| 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 | 36.2 | Very low | 28.8 | Very low | 245 Ų | 245 | 142.3 Ų | 142.3 | 100% | 1.207 | 82% | 0.819 | S | S | * | * | 0 | 141.7 | 0 | -82.2 | 166.2 | 161.5 | 0 | 0 | 107.8 | |||||
| 2 | M | 30.8 | Very low | 28.7 | Very low | 189 Ų | 189 | 144.3 Ų | 144.3 | 93% | 0.931 | 83% | 0.825 | S | S | * | * | trans | 0.7 | 117.4 | 174.3 | -68.4 | 155.7 | 170.3 | 0 | 0 | 117.5 | ||||
| 3 | A | 27 | Very low | 28.4 | Very low | 95 Ų | 95 | 137.8 Ų | 137.8 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | 92.1 | 134.8 | 55.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 4 | S | 27.5 | Very low | 28.2 | Very low | 119 Ų | 119 | 135.9 Ų | 135.9 | 83% | 0.832 | 81% | 0.806 | S | S | * | * | trans | 66 | 147.5 | 174.3 | -122.9 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 5 | S | 28.6 | Very low | 28 | Very low | 97 Ų | 97 | 136.2 Ų | 136.2 | 68% | 0.678 | 80% | 0.802 | S | S | * | * | cis | -165.8 | 127.6 | -24.7 | 32.9 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 6 | D | 28.6 | Very low | 27.9 | Very low | 157 Ų | 157 | 139.4 Ų | 139.4 | 84% | 0.84 | 80% | 0.803 | S | S | * | * | 79.1 | 124.9 | 78.3 | -114.4 | -8.3 | 0 | 0 | 0 | 115.7 | |||||
| 7 | V | 31.1 | Very low | 27.7 | Very low | 113 Ų | 113 | 137 Ų | 137 | 69% | 0.685 | 80% | 0.796 | S | S | * | * | trans | 91.4 | 113.6 | 152.9 | 179.8 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 8 | D | 28 | Very low | 27.8 | Very low | 160 Ų | 160 | 137.7 Ų | 137.7 | 86% | 0.856 | 80% | 0.796 | S | S | * | * | trans | 51.8 | 145.5 | 145.5 | -62.6 | -13.9 | 0 | 0 | 0 | 123.7 | ||||
| 9 | G | 26.5 | Very low | 27.8 | Very low | 63 Ų | 63 | 140.4 Ų | 140.4 | 65% | 0.649 | 80% | 0.801 | S | S | * | * | cis | 159.7 | 170.9 | -5.7 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 10 | R | 26 | Very low | 27.8 | Very low | 258 Ų | 258 | 141 Ų | 141 | 97% | 0.974 | 80% | 0.802 | S | S | * | * | trans | 62.5 | 156.9 | 170.5 | -69.1 | 179.9 | 172.8 | 154.3 | -1.2 | 117.5 | ||||
| 11 | A | 26.7 | Very low | 28.1 | Very low | 69 Ų | 69 | 140 Ų | 140 | 57% | 0.57 | 80% | 0.801 | S | S | * | * | cis | -168.4 | 157 | -25.7 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 12 | D | 27.3 | Very low | 27.9 | Very low | 167 Ų | 167 | 133.4 Ų | 133.4 | 89% | 0.893 | 78% | 0.778 | S | S | * | * | trans | 50.3 | 144.8 | 157.6 | -49.6 | -29.6 | 0 | 0 | 0 | 119.9 | ||||
| 13 | G | 25.5 | Very low | 28.1 | Very low | 60 Ų | 60 | 133.9 Ų | 133.9 | 62% | 0.619 | 78% | 0.779 | S | S | * | * | cis | 153.2 | 149.7 | 2.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 14 | S | 25.1 | Very low | 28.5 | Very low | 110 Ų | 110 | 137 Ų | 137 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | trans | 52.5 | 114.7 | 165.8 | 49.5 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 15 | L | 25.8 | Very low | 28.8 | Very low | 141 Ų | 141 | 138.7 Ų | 138.7 | 74% | 0.738 | 78% | 0.781 | S | S | * | * | 74.3 | 140.3 | 79.3 | -101.5 | 96.1 | 0 | 0 | 0 | 115.8 | |||||
| 16 | F | 25.4 | Very low | 29.3 | Very low | 188 Ų | 188 | 138.2 Ų | 138.2 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | trans | 65.2 | 159.1 | 174.2 | -59.7 | -72.4 | 0 | 0 | 0 | 115.3 | ||||
| 17 | S | 25.1 | Very low | 29.7 | Very low | 98 Ų | 98 | 138.7 Ų | 138.7 | 69% | 0.685 | 79% | 0.785 | S | S | * | * | cis | -166.9 | 171.1 | -29.9 | 52.6 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 18 | D | 29.5 | Very low | 29.9 | Very low | 149 Ų | 149 | 138.8 Ų | 138.8 | 80% | 0.797 | 79% | 0.789 | S | S | * | * | trans | -41 | 134.3 | 173.9 | -53.8 | -67.4 | 0 | 0 | 0 | 115.1 | ||||
| 19 | Q | 27.7 | Very low | 30.2 | Very low | 190 Ų | 190 | 137.6 Ų | 137.6 | 89% | 0.888 | 79% | 0.79 | S | S | * | * | -174.7 | 157 | 114.9 | -96.9 | 164.3 | 26.1 | 0 | 0 | 113.7 | |||||
| 20 | N | 27.8 | Very low | 30.8 | Very low | 152 Ų | 152 | 139.6 Ų | 139.6 | 81% | 0.813 | 79% | 0.794 | S | S | * | * | trans | -45 | 148.8 | -164.7 | -65.8 | -29.8 | 0 | 0 | 0 | 118.5 | ||||
| 21 | P | 34 | Very low | 31.5 | Very low | 120 Ų | 120 | 132.9 Ų | 132.9 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | trans | -76.3 | 141.2 | 176.3 | 30.8 | -32.6 | 0 | 0 | 0 | 113.4 | ||||
| 22 | S | 31.4 | Very low | 32.2 | Very low | 106 Ų | 106 | 135.7 Ų | 135.7 | 74% | 0.741 | 80% | 0.796 | S | S | * | * | trans | -88.4 | 151.8 | 175 | 51.7 | 0 | 0 | 0 | 0 | 113.2 | L24 | S22-L24 VanDerWaalsContact C-N 3.31Å; S22-L24 PolarHBondContact O-N 2.77Å | ||
| 23 | E | 36.3 | Very low | 32.8 | Very low | 200 Ų | 200 | 130.5 Ų | 130.5 | 94% | 0.935 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -56.9 | 49.9 | -170.1 | -59.1 | 171.7 | 100.5 | 0 | 0 | 118.8 | ||
| 24 | L | 33.9 | Very low | 33.3 | Very low | 161 Ų | 161 | 133.9 Ų | 133.9 | 84% | 0.843 | 79% | 0.793 | S | S | * | * | trans | -117 | -3.6 | 178.5 | -139.8 | 81.2 | 0 | 0 | 0 | 116.7 | S22 A26 | S22-L24 VanDerWaalsContact C-N 3.31Å; S22-L24 PolarHBondContact O-N 2.77Å; L24-A26 VanDerWaalsContact C-N 3.3Å; L24-A26 PolarHBondContact O-N 3.38Å | ||
| 25 | D | 34.1 | Very low | 33.9 | Very low | 153 Ų | 153 | 133.8 Ų | 133.8 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -87.5 | 13 | 179.3 | -74.5 | -32.5 | 0 | 0 | 0 | 114.3 | L27 | D25-L27 VanDerWaalsContact C-N 3.25Å; D25-L27 PolarHBondContact O-N 3.09Å; D25-L27 VanDerWaalsContact O-N 3.09Å | ||
| 26 | A | 40.1 | Very low | 34.3 | Very low | 88 Ų | 88 | 138.3 Ų | 138.3 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | trans | -78.3 | 13.4 | -169.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | L24 | L24-A26 VanDerWaalsContact C-N 3.3Å; L24-A26 PolarHBondContact O-N 3.38Å | ||
| 27 | L | 37.1 | Very low | 34.7 | Very low | 167 Ų | 167 | 134.8 Ų | 134.8 | 87% | 0.874 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -139.4 | 66 | 179.8 | -84.2 | 104.2 | 0 | 0 | 0 | 114 | D25 | D25-L27 VanDerWaalsContact C-N 3.25Å; D25-L27 PolarHBondContact O-N 3.09Å; D25-L27 VanDerWaalsContact O-N 3.09Å |
| 28 | C | 34.2 | Very low | 35.2 | Very low | 115 Ų | 115 | 138.9 Ų | 138.9 | 78% | 0.777 | 80% | 0.804 | S | S | * | * | trans | -176.7 | 115.3 | 143.3 | -106.9 | 0 | 0 | 0 | 0 | 110.7 | S30 | C28-S30 PolarHBondContact O-N 3.1Å; C28-S30 VanDerWaalsContact O-N 3.1Å | ||
| 29 | P | 35.7 | Very low | 35.4 | Very low | 135 Ų | 135 | 141.5 Ų | 141.5 | 88% | 0.877 | 80% | 0.803 | S | S | * | * | trans | -74.7 | 103.8 | 176.5 | 29.7 | -32.5 | 0 | 0 | 0 | 110.6 | ||||
| 30 | S | 38.5 | Very low | 35.9 | Very low | 105 Ų | 105 | 139.6 Ų | 139.6 | 73% | 0.734 | 80% | 0.798 | S | S | * | * | trans | -63.9 | 138.8 | 167.6 | 46.1 | 0 | 0 | 0 | 0 | 110.2 | C28 | C28-S30 PolarHBondContact O-N 3.1Å; C28-S30 VanDerWaalsContact O-N 3.1Å | ||
| 31 | P | 40.3 | Very low | 36.6 | Very low | 117 Ų | 117 | 140.3 Ų | 140.3 | 76% | 0.76 | 79% | 0.791 | S | S | * | * | trans | -66.4 | 140.2 | -173.6 | 26.1 | -34.1 | 0 | 0 | 0 | 110.8 | G33 | P31-G33 PolarHBondContact O-N 3.12Š| ||
| 32 | P | 41.5 | Very low | 37.1 | Very low | 128 Ų | 128 | 143.4 Ų | 143.4 | 83% | 0.831 | 80% | 0.795 | S | S | * | * | trans | -64.2 | 111.6 | 176.8 | 26.1 | -32.9 | 0 | 0 | 0 | 109.4 | ||||
| 33 | G | 40.4 | Very low | 38.2 | Very low | 57 Ų | 57 | 142.4 Ų | 142.4 | 59% | 0.588 | 78% | 0.775 | S | S | * | * | trans | -55 | 148.7 | 165.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | P31 S35 | P31-G33 PolarHBondContact O-N 3.12Å; G33-S35 PolarHBondContact O-N 2.91Å | ||
| 34 | P | 34.8 | Very low | 39.1 | Very low | 132 Ų | 132 | 137.9 Ų | 137.9 | 86% | 0.857 | 76% | 0.756 | S | S | * | * | trans | -60.9 | 105.6 | -171.6 | 24.1 | -33.8 | 0 | 0 | 0 | 110.4 | R36 | P34-R36 PolarHBondContact O-N 3.33Å; P34-R36 VanDerWaalsContact O-N 3.09Å | ||
| 35 | S | 37.3 | Very low | 40.1 | Very low | 107 Ų | 107 | 130.5 Ų | 130.5 | 75% | 0.748 | 72% | 0.719 | S | S | * | * | trans | -57.8 | 116.8 | 169.2 | 44.5 | 0 | 0 | 0 | 0 | 107.3 | G33 P37 | G33-S35 PolarHBondContact O-N 2.91Å; S35-P37 VanDerWaalsContact O-CD 3.27Å; S35-P37 WeakPolarHBondContact O-CD 3.3Å | ||
| 36 | R | 34.6 | Very low | 41.4 | Very low | 236 Ų | 236 | 125.1 Ų | 125.1 | 89% | 0.891 | 70% | 0.699 | S | S | * | * | trans | -52.9 | 118.5 | 168.7 | -84.4 | -177 | 170.8 | 177.6 | -1.8 | 106.2 | P34 Q38 | P34-R36 PolarHBondContact O-N 3.33Å; P34-R36 VanDerWaalsContact O-N 3.09Å; R36-Q38 PolarHBondContact O-N 3.36Å | ||
| 37 | P | 33.3 | Very low | 42.2 | Very low | 115 Ų | 115 | 132.9 Ų | 132.9 | 75% | 0.747 | 71% | 0.71 | S | S | * | * | trans | -63.4 | 110.9 | -179.5 | 23.9 | -31.8 | 0 | 0 | 0 | 107 | S35 R39 | S35-P37 VanDerWaalsContact O-CD 3.27Å; S35-P37 WeakPolarHBondContact O-CD 3.3Å; P37-R39 PolarHBondContact O-N 3.2Å | ||
| 38 | Q | 35.9 | Very low | 43.9 | Very low | 184 Ų | 184 | 131.5 Ų | 131.5 | 86% | 0.86 | 71% | 0.709 | S | S | * | * | trans | -67.8 | 81.2 | 167.9 | -170 | 168.2 | 6 | 0 | 0 | 105.9 | R36 N40 | R36-Q38 PolarHBondContact O-N 3.36Å; Q38-N40 PolarHBondContact O-N 2.97Å | ||
| 39 | R | 34.7 | Very low | 45.9 | Very low | 204 Ų | 204 | 126.5 Ų | 126.5 | 77% | 0.77 | 68% | 0.676 | S | S | * | * | trans | -60.4 | 108 | -171.2 | -164.6 | 177.6 | -169.8 | 176 | 3.2 | 106.4 | P37 Y41 | P37-R39 PolarHBondContact O-N 3.2Å; R39-Y41 VanDerWaalsContact C-N 3.34Å; R39-Y41 WeakPolarHBondContact O-CD2 3.41Å; R39-Y41 PolarHBondContact O-N 3.29Å | ||
| 40 | N | 36.9 | Very low | 48.4 | Very low | 149 Ų | 149 | 121.3 Ų | 121.3 | 80% | 0.797 | 64% | 0.643 | S | S | * | * | trans | -56.6 | 102.2 | 174.9 | -82 | -30.4 | 0 | 0 | 0 | 107.4 | Q38 E42 | Q38-N40 PolarHBondContact O-N 2.97Å; N40-E42 PolarHBondContact O-N 3.02Å | ||
| 41 | Y | 42.5 | Very low | 50.9 | Low | 168 Ų | 168 | 118.2 Ų | 118.2 | 66% | 0.659 | 62% | 0.621 | S | S | * | * | trans | -72.5 | 97 | -179.6 | -99.8 | -93.1 | 0 | 0 | 0 | 107.7 | R39 R43 P115 | R39-Y41 VanDerWaalsContact C-N 3.34Å; R39-Y41 WeakPolarHBondContact O-CD2 3.41Å; R39-Y41 PolarHBondContact O-N 3.29Å; Y41-R43 PolarHBondContact O-N 3.47Å; Y41-P115 HydrophobicContact CD1-CG 4.47Å | ||
| 42 | E | 46 | Very low | 53.4 | Low | 184 Ų | 184 | 116.3 Ų | 116.3 | 86% | 0.86 | 60% | 0.601 | S | S | * | * | trans | -62.4 | 108.8 | 170.5 | -69.4 | -168.4 | 123.2 | 0 | 0 | 109.1 | N40 | N40-E42 PolarHBondContact O-N 3.02Š| ||
| 43 | R | 55 | Low | 55.7 | Low | 86 Ų | 86 | 113.7 Ų | 113.7 | 33% | 0.325 | 58% | 0.584 | S | S | . | * | trans | -68 | 148.7 | 175 | -144.2 | 176.9 | -168.8 | 178.2 | 3.5 | 109 | Y41 G45 G46 P115 | Y41-R43 PolarHBondContact O-N 3.47Å; R43-G45 PolarHBondContact O-N 3.48Å; R43-G46 PolarHBondContact O-N 3.25Å; R43-P115 HydrophobicContact CG-CB 4.06Å; R43-P115 WeakPolarHBondContact CG-O 3.19Å; R43-P115 PolarHBondContact NE-O 2.85Å; R43-P115 PolarHBondContact NH2-O 3.01Å | ||
| 44 | I | 54.9 | Low | 58 | Low | 104 Ų | 104 | 115.6 Ų | 115.6 | 53% | 0.533 | 58% | 0.578 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -58.9 | -13.5 | -172 | -64.7 | -179 | 0 | 0 | 0 | 114.2 | S116 | I44-S116 WeakPolarHBondContact CD1-OG 3.2Š|
| 45 | G | 54.8 | Low | 60.6 | Low | 7 Ų | 7 | 109.3 Ų | 109.3 | 7% | 0.072 | 54% | 0.537 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -114.5 | 56.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | R43 N284 Q287 | R43-G45 PolarHBondContact O-N 3.48Å; G45-N284 PolarHBondContact N-O 3.35Å; G45-Q287 WeakPolarHBondContact O-CA 3.45Å |
| 46 | G | 61.5 | Low | 63.2 | Low | 39 Ų | 39 | 105.2 Ų | 105.2 | 40% | 0.402 | 51% | 0.507 | S | S | . | . | S | Bend | trans | -66.9 | -143.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | R43 T48 G49 | R43-G46 PolarHBondContact O-N 3.25Å; G46-T48 PolarHBondContact O-N 3.49Å; G46-G49 PolarHBondContact O-N 2.94Å |
| 47 | R | 57 | Low | 65.8 | Low | 251 Ų | 251 | 98.5 Ų | 98.5 | 95% | 0.947 | 49% | 0.488 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.1 | -16.3 | 176.2 | -68.1 | 177.9 | 96.7 | 141.1 | 0 | 113.6 | ||
| 48 | T | 71.3 | Confident | 68.4 | Low | 138 Ų | 138 | 97 Ų | 97 | 85% | 0.847 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.9 | 0.3 | 178.2 | 48.9 | 0 | 0 | 0 | 0 | 114.7 | G46 | G46-T48 PolarHBondContact O-N 3.49Š|
| 49 | G | 77.9 | Confident | 71 | Confident | 10 Ų | 10 | 88.2 Ų | 88.2 | 10% | 0.103 | 43% | 0.43 | C | S | . | . | S | Bend | trans | -69.6 | 171.7 | 179 | 0 | 0 | 0 | 0 | 0 | 114.2 | G46 K285 Q287 | G46-G49 PolarHBondContact O-N 2.94Å; G49-K285 CarbonylContact C-O 3.57Å; G49-K285 WeakPolarHBondContact CA-O 3.39Å; G49-Q287 VanDerWaalsContact C-CG 3.48Å; G49-Q287 VanDerWaalsContact O-CG 3.25Å; G49-Q287 WeakPolarHBondContact O-CG 3.34Å; G49-Q287 PolarHBondContact O-NE2 2.91Å |
| 50 | T | 86.2 | Confident | 73.7 | Confident | 27 Ų | 27 | 80 Ų | 80 | 17% | 0.166 | 40% | 0.401 | C | S | . | . | B | Isolated β-bridge | trans | -72.5 | 140.5 | 175.1 | 51.8 | 0 | 0 | 0 | 0 | 112.1 | T55 K285 Q287 | T50-T55 WeakPolarHBondContact CB-OG1 3.31Å; T50-T55 PolarHBondContact OG1-OG1 3.2Å; T50-K285 PolarHBondContact N-O 2.95Å; T50-K285 PolarHBondContact OG1-O 3.21Å; T50-Q287 WeakPolarHBondContact O-CG 3.5Å; T50-Q287 PolarHBondContact O-N 3.36Å |
| 51 | S | 92.1 | Very high | 75.8 | Confident | 39 Ų | 39 | 76 Ų | 76 | 27% | 0.273 | 38% | 0.376 | S | S | . | . | P | Polyproline II helix | trans | -73.7 | 167.3 | 174.2 | 81.1 | 0 | 0 | 0 | 0 | 111.9 | C53 Q54 T55 | S51-C53 VanDerWaalsContact C-N 3.34Å; S51-C53 PolarHBondContact O-N 2.93Å; S51-Q54 PolarHBondContact O-N 3.24Å; S51-Q54 WeakPolarHBondContact OG-CG 3.32Å; S51-Q54 PolarHBondContact OG-N 3.49Å; S51-Q54 PolarHBondContact OG-OE1 3.49Å; S51-T55 WeakPolarHBondContact O-CB 3.45Å; S51-T55 PolarHBondContact O-N 3.2Å; S51-T55 PolarHBondContact O-OG1 3.43Å |
| 52 | F | 91.9 | Very high | 77.8 | Confident | 77 Ų | 77 | 69.3 Ų | 69.3 | 34% | 0.338 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -53.5 | -48.8 | 177.4 | -179 | -82.9 | 0 | 0 | 0 | 112.4 | T55 L56 M286 K291 Q294 V295 L298 | F52-T55 PolarHBondContact O-N 3.37Å; F52-L56 WeakPolarHBondContact O-CB 3.49Å; F52-L56 PolarHBondContact O-N 2.91Å; F52-M286 HydrophobicContact CB-CE 4.35Å; F52-M286 HydrophobicContact CD2-CE 4.06Å; F52-K291 HydrophobicContact CD2-CB 4.43Å; F52-Q294 HydrophobicContact CE2-CB 4.04Å; F52-V295 HydrophobicContact CD1-CG2 4.47Å; F52-V295 HydrophobicContact CD2-CG2 3.35Å; F52-V295 HydrophobicContact CE1-CG2 4.45Å; F52-V295 HydrophobicContact CE2-CB 4.38Å; F52-V295 HydrophobicContact CE2-CG2 3.34Å; F52-V295 HydrophobicContact CG-CG2 3.95Å; F52-V295 HydrophobicContact CZ-CG2 3.92Å; F52-L298 HydrophobicContact CE1-CD2 4.16Å; F52-L298 HydrophobicContact CZ-CD2 4.23Å |
| 53 | C | 90 | Very high | 79.8 | Confident | 73 Ų | 73 | 61 Ų | 61 | 49% | 0.493 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -68.5 | -40 | -179.6 | -172.2 | 0 | 0 | 0 | 0 | 112 | S51 T55 L56 I57 | S51-C53 VanDerWaalsContact C-N 3.34Å; S51-C53 PolarHBondContact O-N 2.93Å; C53-T55 PolarHBondContact O-N 3.3Å; C53-L56 WeakPolarHBondContact O-CB 3.23Å; C53-L56 PolarHBondContact O-N 2.71Å; C53-I57 VanDerWaalsContact O-CG1 3.3Å; C53-I57 WeakPolarHBondContact O-CG1 3.41Å; C53-I57 PolarHBondContact O-N 3.01Å |
| 54 | Q | 88.9 | Confident | 81.2 | Confident | 98 Ų | 98 | 59 Ų | 59 | 46% | 0.458 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -62.3 | -44.8 | 174.8 | -72.2 | 168 | -19.7 | 0 | 0 | 111.6 | S51 L56 I57 H58 | S51-Q54 PolarHBondContact O-N 3.24Å; S51-Q54 WeakPolarHBondContact OG-CG 3.32Å; S51-Q54 PolarHBondContact OG-N 3.49Å; S51-Q54 PolarHBondContact OG-OE1 3.49Å; Q54-L56 VanDerWaalsContact C-N 3.33Å; Q54-L56 PolarHBondContact O-N 2.65Å; Q54-I57 PolarHBondContact O-N 3.34Å; Q54-H58 WeakPolarHBondContact O-CB 2.73Å; Q54-H58 PolarHBondContact O-CD2 2.91Å; Q54-H58 PolarHBondContact O-N 3.38Å |
| 55 | T | 90.2 | Very high | 82.5 | Confident | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -63.9 | -39.6 | 178.2 | -47.1 | 0 | 0 | 0 | 0 | 111 | T50 S51 F52 C53 H58 L59 L282 M286 F292 V295 | T50-T55 WeakPolarHBondContact CB-OG1 3.31Å; T50-T55 PolarHBondContact OG1-OG1 3.2Å; S51-T55 WeakPolarHBondContact O-CB 3.45Å; S51-T55 PolarHBondContact O-N 3.2Å; S51-T55 PolarHBondContact O-OG1 3.43Å; F52-T55 PolarHBondContact O-N 3.37Å; C53-T55 PolarHBondContact O-N 3.3Å; T55-H58 PolarHBondContact O-N 3.27Å; T55-L59 WeakPolarHBondContact O-CB 3.37Å; T55-L59 PolarHBondContact O-N 3.44Å; T55-L282 HydrophobicContact CG2-CB 4.13Å; T55-M286 HydrophobicContact CG2-CG 4.43Å; T55-M286 HydrophobicContact CG2-SD 4.27Å; T55-F292 HydrophobicContact CG2-CD2 4.09Å; T55-F292 HydrophobicContact CG2-CE2 4.07Å; T55-V295 HydrophobicContact CG2-CG1 4.18Å |
| 56 | L | 92.3 | Very high | 84 | Confident | 21 Ų | 21 | 54.5 Ų | 54.5 | 11% | 0.11 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.9 | -49.7 | 172.6 | -179 | 64.3 | 0 | 0 | 0 | 111.8 | F52 C53 Q54 H58 L59 L60 V295 L298 G299 | F52-L56 WeakPolarHBondContact O-CB 3.49Å; F52-L56 PolarHBondContact O-N 2.91Å; C53-L56 WeakPolarHBondContact O-CB 3.23Å; C53-L56 PolarHBondContact O-N 2.71Å; Q54-L56 VanDerWaalsContact C-N 3.33Å; Q54-L56 PolarHBondContact O-N 2.65Å; L56-H58 VanDerWaalsContact C-N 3.31Å; L56-H58 PolarHBondContact O-N 2.86Å; L56-L59 PolarHBondContact O-N 2.79Å; L56-L60 HydrophobicContact CD1-CD1 4.48Å; L56-L60 HydrophobicContact CD1-CG 4.37Å; L56-L60 HydrophobicContact CG-CD1 4.22Å; L56-L60 HydrophobicContact CG-CG 4.49Å; L56-L60 WeakPolarHBondContact O-CB 3.49Å; L56-L60 VanDerWaalsContact O-CG 3.31Å; L56-L60 WeakPolarHBondContact O-CG 3.47Å; L56-L60 PolarHBondContact O-N 3.42Å; L56-V295 HydrophobicContact CB-CG1 3.97Å; L56-V295 HydrophobicContact CD1-CG1 4.22Å; L56-L298 HydrophobicContact CD1-CB 4.44Å; L56-L298 HydrophobicContact CD1-CD2 4.43Å; L56-L298 HydrophobicContact CD1-CG 4.21Å; L56-L298 HydrophobicContact CD2-CD2 3.83Å; L56-L298 HydrophobicContact CD2-CG 4.31Å; L56-G299 VanDerWaalsContact CD1-CA 3.4Å |
| 57 | I | 88.9 | Confident | 85.4 | Confident | 95 Ų | 95 | 52.8 Ų | 52.8 | 49% | 0.487 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60.4 | -41.4 | 177.9 | -69.5 | 164.4 | 0 | 0 | 0 | 111 | C53 Q54 K61 | C53-I57 VanDerWaalsContact O-CG1 3.3Å; C53-I57 WeakPolarHBondContact O-CG1 3.41Å; C53-I57 PolarHBondContact O-N 3.01Å; Q54-I57 PolarHBondContact O-N 3.34Å; I57-K61 VanDerWaalsContact O-CB 3.23Å; I57-K61 WeakPolarHBondContact O-CB 3.46Å; I57-K61 PolarHBondContact O-N 2.94Å |
| 58 | H | 87.3 | Confident | 87.2 | Confident | 83 Ų | 83 | 40.9 Ų | 40.9 | 38% | 0.384 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -66.5 | -37.7 | 175.9 | -70.2 | -53.6 | 0 | 0 | 0 | 113 | Q54 T55 L56 G62 L282 | Q54-H58 WeakPolarHBondContact O-CB 2.73Å; Q54-H58 PolarHBondContact O-CD2 2.91Å; Q54-H58 PolarHBondContact O-N 3.38Å; T55-H58 PolarHBondContact O-N 3.27Å; L56-H58 VanDerWaalsContact C-N 3.31Å; L56-H58 PolarHBondContact O-N 2.86Å; H58-G62 PolarHBondContact O-N 3.3Å; H58-L282 HydrophobicContact CB-CD1 4.15Å; H58-L282 HydrophobicContact CB-CD2 3.52Å |
| 59 | L | 91.2 | Very high | 88.3 | Confident | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -66.2 | -47 | 174.9 | 179.8 | 66.9 | 0 | 0 | 0 | 111.3 | T55 L56 G62 N63 V278 L282 V295 L296 | T55-L59 WeakPolarHBondContact O-CB 3.37Å; T55-L59 PolarHBondContact O-N 3.44Å; L56-L59 PolarHBondContact O-N 2.79Å; L59-G62 PolarHBondContact O-N 2.88Å; L59-N63 PolarHBondContact O-N 3.44Å; L59-N63 PolarHBondContact O-ND2 3.28Å; L59-V278 HydrophobicContact CD1-CG2 4.5Å; L59-L282 HydrophobicContact CB-CD1 4.1Å; L59-L282 HydrophobicContact CD1-CD1 4.42Å; L59-V295 HydrophobicContact CD2-CG1 4.26Å; L59-L296 HydrophobicContact CD1-CD1 4.15Å; L59-L296 HydrophobicContact CD2-CD1 3.89Å |
| 60 | L | 90.1 | Very high | 89.1 | Confident | 32 Ų | 32 | 34 Ų | 34 | 17% | 0.168 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -57.5 | -50.5 | 175.5 | -70.2 | 177.4 | 0 | 0 | 0 | 110.7 | L56 G62 N63 I64 G299 I302 V303 | L56-L60 HydrophobicContact CD1-CD1 4.48Å; L56-L60 HydrophobicContact CD1-CG 4.37Å; L56-L60 HydrophobicContact CG-CD1 4.22Å; L56-L60 HydrophobicContact CG-CG 4.49Å; L56-L60 WeakPolarHBondContact O-CB 3.49Å; L56-L60 VanDerWaalsContact O-CG 3.31Å; L56-L60 WeakPolarHBondContact O-CG 3.47Å; L56-L60 PolarHBondContact O-N 3.42Å; L60-G62 VanDerWaalsContact C-N 3.27Å; L60-G62 PolarHBondContact O-N 3.09Å; L60-N63 PolarHBondContact O-N 3.46Å; L60-N63 VanDerWaalsContact O-N 3.12Å; L60-I64 HydrophobicContact CB-CD1 4.21Å; L60-I64 WeakPolarHBondContact O-CB 3.28Å; L60-I64 VanDerWaalsContact O-CG1 3.3Å; L60-I64 WeakPolarHBondContact O-CG1 3.28Å; L60-I64 PolarHBondContact O-N 2.99Å; L60-G299 WeakPolarHBondContact CD2-O 3.29Å; L60-I302 HydrophobicContact CD2-CB 3.97Å; L60-I302 HydrophobicContact CD2-CG2 3.84Å; L60-V303 HydrophobicContact CD2-CG2 3.82Å |
| 61 | K | 82.7 | Confident | 89.6 | Confident | 63 Ų | 63 | 32.7 Ų | 32.7 | 27% | 0.274 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -58.8 | -36.4 | 176.2 | -176.2 | -168.9 | 174.5 | -173.7 | 0 | 112.9 | I57 N63 S225 N229 | I57-K61 VanDerWaalsContact O-CB 3.23Å; I57-K61 WeakPolarHBondContact O-CB 3.46Å; I57-K61 PolarHBondContact O-N 2.94Å; K61-N63 PolarHBondContact O-N 3.38Å; K61-S225 PolarHBondContact NZ-OG 3.11Å; K61-N229 WeakPolarHBondContact CE-ND2 3.46Å; K61-N229 WeakPolarHBondContact CE-OD1 3.3Å |
| 62 | G | 82.8 | Confident | 89.9 | Confident | 28 Ų | 28 | 30.8 Ų | 30.8 | 29% | 0.289 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -68.5 | -17.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | H58 L59 L60 | H58-G62 PolarHBondContact O-N 3.3Å; L59-G62 PolarHBondContact O-N 2.88Å; L60-G62 VanDerWaalsContact C-N 3.27Å; L60-G62 PolarHBondContact O-N 3.09Å |
| 63 | N | 87.9 | Confident | 90.2 | Very high | 10 Ų | 10 | 28 Ų | 28 | 5% | 0.053 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -107.7 | -38.9 | 177.8 | -69.4 | -99.5 | 0 | 0 | 0 | 111.7 | L59 L60 K61 G65 G275 V303 Y307 | L59-N63 PolarHBondContact O-N 3.44Å; L59-N63 PolarHBondContact O-ND2 3.28Å; L60-N63 PolarHBondContact O-N 3.46Å; L60-N63 VanDerWaalsContact O-N 3.12Å; K61-N63 PolarHBondContact O-N 3.38Å; N63-G65 PolarHBondContact O-N 2.87Å; N63-G275 WeakPolarHBondContact OD1-CA 3.43Å; N63-G275 PolarHBondContact OD1-N 2.92Å; N63-V303 HydrophobicContact CB-CG1 4.05Å; N63-V303 HydrophobicContact CB-CG2 3.9Å; N63-Y307 PolarHBondContact O-OH 2.75Å |
| 64 | I | 85.9 | Confident | 90.5 | Very high | 45 Ų | 45 | 24.6 Ų | 24.6 | 23% | 0.231 | 13% | 0.132 | C | C | . | . | trans | -76.5 | 86.5 | -178.1 | -59.3 | 170.5 | 0 | 0 | 0 | 110 | L60 L68 L236 V303 L306 | L60-I64 HydrophobicContact CB-CD1 4.21Å; L60-I64 WeakPolarHBondContact O-CB 3.28Å; L60-I64 VanDerWaalsContact O-CG1 3.3Å; L60-I64 WeakPolarHBondContact O-CG1 3.28Å; L60-I64 PolarHBondContact O-N 2.99Å; I64-L68 HydrophobicContact CG2-CD2 3.94Å; I64-L236 HydrophobicContact CG2-CD2 4.48Å; I64-V303 HydrophobicContact CG1-CG2 4.49Å; I64-L306 HydrophobicContact CD1-CD2 3.77Å; I64-L306 HydrophobicContact CG1-CD2 4.04Å; I64-L306 HydrophobicContact CG2-CD2 4.49Å | ||
| 65 | G | 82.6 | Confident | 90.9 | Very high | 12 Ų | 12 | 20 Ų | 20 | 12% | 0.124 | 11% | 0.11 | C | C | . | . | S | Bend | trans | -133.6 | -153.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | N63 G67 L68 | N63-G65 PolarHBondContact O-N 2.87Å; G65-G67 PolarHBondContact O-N 3.21Å; G65-L68 WeakPolarHBondContact O-CB 3.43Å; G65-L68 PolarHBondContact O-N 2.89Å |
| 66 | T | 85.8 | Confident | 91.3 | Very high | 3 Ų | 3 | 22 Ų | 22 | 2% | 0.018 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -60.7 | -27.4 | 179.7 | 48 | 0 | 0 | 0 | 0 | 114 | L68 L69 G70 V158 Y159 F162 I347 | T66-L68 VanDerWaalsContact C-N 3.27Å; T66-L68 PolarHBondContact O-N 3.03Å; T66-L69 WeakPolarHBondContact O-CB 3.46Å; T66-L69 PolarHBondContact O-N 3.07Å; T66-G70 PolarHBondContact O-N 3.45Å; T66-V158 HydrophobicContact CG2-CG1 4.37Å; T66-V158 WeakPolarHBondContact OG1-CG1 3.48Å; T66-Y159 HydrophobicContact CG2-CD1 3.74Å; T66-Y159 HydrophobicContact CG2-CE1 3.86Å; T66-Y159 WeakPolarHBondContact OG1-CE1 3.45Å; T66-F162 HydrophobicContact CG2-CB 4.15Å; T66-F162 HydrophobicContact CG2-CD1 4.16Å; T66-F162 HydrophobicContact CG2-CD2 4.18Å; T66-F162 HydrophobicContact CG2-CG 3.88Å; T66-I347 HydrophobicContact CG2-CD1 3.77Å; T66-I347 HydrophobicContact CG2-CG1 4.01Å; T66-I347 HydrophobicContact CG2-CG2 4.24Å |
| 67 | G | 89.6 | Confident | 91.5 | Very high | 4 Ų | 4 | 22 Ų | 22 | 4% | 0.041 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -55.8 | -40.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113 | G65 L69 G70 L71 | G65-G67 PolarHBondContact O-N 3.21Å; G67-L69 VanDerWaalsContact C-N 3.29Å; G67-L69 PolarHBondContact O-N 2.74Å; G67-G70 PolarHBondContact O-N 3.17Å; G67-L71 PolarHBondContact O-N 3.5Å |
| 68 | L | 94.8 | Very high | 91.9 | Very high | 0 Ų | 0 | 17.5 Ų | 17.5 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -57.4 | -40.7 | 174.3 | 171.4 | 58.2 | 0 | 0 | 0 | 112.2 | I64 G65 T66 G70 L71 L236 L306 Y307 L310 | I64-L68 HydrophobicContact CG2-CD2 3.94Å; G65-L68 WeakPolarHBondContact O-CB 3.43Å; G65-L68 PolarHBondContact O-N 2.89Å; T66-L68 VanDerWaalsContact C-N 3.27Å; T66-L68 PolarHBondContact O-N 3.03Å; L68-G70 VanDerWaalsContact C-N 3.27Å; L68-G70 PolarHBondContact O-N 3.2Å; L68-L71 HydrophobicContact CD1-CD1 4.02Å; L68-L71 WeakPolarHBondContact O-CB 3.33Å; L68-L71 PolarHBondContact O-N 3.47Å; L68-L236 HydrophobicContact CD2-CD1 4.02Å; L68-L236 HydrophobicContact CD2-CD2 3.77Å; L68-L306 HydrophobicContact CD1-CG 4.28Å; L68-L306 HydrophobicContact CD2-CD2 3.75Å; L68-L306 HydrophobicContact CD2-CG 4.07Å; L68-Y307 HydrophobicContact CB-CE1 4.09Å; L68-Y307 HydrophobicContact CD1-CD1 3.67Å; L68-Y307 HydrophobicContact CD1-CE1 4.05Å; L68-Y307 HydrophobicContact CG-CE1 4.49Å; L68-L310 HydrophobicContact CD1-CB 3.97Å; L68-L310 HydrophobicContact CD1-CD2 3.43Å; L68-L310 VanDerWaalsContact CD1-CD2 3.43Å; L68-L310 HydrophobicContact CD1-CG 4.32Å; L68-L310 HydrophobicContact CD2-CD2 4.24Å; L68-L310 HydrophobicContact CG-CD2 3.56Å |
| 69 | L | 94.8 | Very high | 92.3 | Very high | 0 Ų | 0 | 13.5 Ų | 13.5 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -70.8 | -23 | -176.3 | -56.6 | 179.6 | 0 | 0 | 0 | 112.9 | T66 G67 F162 L236 S325 I326 T327 Y343 | T66-L69 WeakPolarHBondContact O-CB 3.46Å; T66-L69 PolarHBondContact O-N 3.07Å; G67-L69 VanDerWaalsContact C-N 3.29Å; G67-L69 PolarHBondContact O-N 2.74Å; L69-F162 HydrophobicContact CD1-CD2 4.42Å; L69-F162 HydrophobicContact CD1-CE2 3.41Å; L69-F162 VanDerWaalsContact CD1-CE2 3.41Å; L69-F162 HydrophobicContact CD1-CZ 3.48Å; L69-F162 VanDerWaalsContact CD1-CZ 3.48Å; L69-L236 HydrophobicContact CD2-CD1 4.47Å; L69-S325 CarbonylContact O-C 3.57Å; L69-S325 VanDerWaalsContact O-CA 3.3Å; L69-S325 WeakPolarHBondContact O-CA 3.39Å; L69-I326 HydrophobicContact CB-CG2 4.18Å; L69-I326 HydrophobicContact CD2-CG2 3.81Å; L69-I326 PolarHBondContact O-N 2.85Å; L69-T327 HydrophobicContact CD1-CG2 4.02Å; L69-T327 HydrophobicContact CD2-CG2 4.44Å; L69-Y343 HydrophobicContact CD1-CD1 4.03Å; L69-Y343 HydrophobicContact CD1-CE1 3.64Å; L69-Y343 HydrophobicContact CD1-CE2 4.36Å; L69-Y343 HydrophobicContact CD2-CE2 4.14Å; L69-Y343 HydrophobicContact CG-CE1 4.44Å |
| 70 | G | 95.6 | Very high | 92.5 | Very high | 3 Ų | 3 | 14.8 Ų | 14.8 | 3% | 0.031 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -86.5 | -11.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | T66 G67 L68 P72 L73 A74 | T66-G70 PolarHBondContact O-N 3.45Å; G67-G70 PolarHBondContact O-N 3.17Å; L68-G70 VanDerWaalsContact C-N 3.27Å; L68-G70 PolarHBondContact O-N 3.2Å; G70-P72 VanDerWaalsContact C-CD 3.48Å; G70-L73 PolarHBondContact O-N 2.94Å; G70-A74 PolarHBondContact O-N 3.35Å; G70-A74 VanDerWaalsContact O-N 3.12Å |
| 71 | L | 97.4 | Very high | 92.8 | Very high | 0 Ų | 0 | 16.8 Ų | 16.8 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -59.9 | -33.1 | -178.6 | -70.1 | 179.5 | 0 | 0 | 0 | 115.3 | G67 L68 L73 A74 V75 L87 T268 A272 Y307 | G67-L71 PolarHBondContact O-N 3.5Å; L68-L71 HydrophobicContact CD1-CD1 4.02Å; L68-L71 WeakPolarHBondContact O-CB 3.33Å; L68-L71 PolarHBondContact O-N 3.47Å; L71-L73 VanDerWaalsContact C-N 3.34Å; L71-L73 PolarHBondContact O-N 3.47Å; L71-A74 HydrophobicContact CD2-CB 4.46Å; L71-A74 WeakPolarHBondContact O-CB 3.44Å; L71-A74 PolarHBondContact O-N 3.5Å; L71-A74 VanDerWaalsContact O-N 3.16Å; L71-V75 WeakPolarHBondContact O-CG2 3.48Å; L71-V75 PolarHBondContact O-N 3.43Å; L71-L87 HydrophobicContact CD2-CD2 3.94Å; L71-T268 HydrophobicContact CD2-CG2 4.42Å; L71-A272 HydrophobicContact CD1-CB 4.3Å; L71-A272 HydrophobicContact CD2-CB 3.84Å; L71-A272 HydrophobicContact CG-CB 4.23Å; L71-Y307 VanDerWaalsContact CD1-CB 3.4Å; L71-Y307 HydrophobicContact CD1-CD1 3.84Å; L71-Y307 HydrophobicContact CD1-CD2 3.73Å; L71-Y307 HydrophobicContact CD1-CE1 4.5Å; L71-Y307 HydrophobicContact CD1-CE2 4.44Å; L71-Y307 HydrophobicContact CD1-CG 3.37Å |
| 72 | P | 97.6 | Very high | 93.5 | Very high | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -59.7 | -40.4 | 173.9 | -30.1 | 39.9 | 0 | 0 | 0 | 113.7 | G70 V75 K76 I322 I326 | G70-P72 VanDerWaalsContact C-CD 3.48Å; P72-V75 PolarHBondContact O-N 3.4Å; P72-K76 PolarHBondContact O-N 3.31Å; P72-I322 HydrophobicContact CB-CD1 3.72Å; P72-I322 HydrophobicContact CB-CG1 3.87Å; P72-I326 HydrophobicContact CG-CB 4.18Å; P72-I326 HydrophobicContact CG-CD1 4.03Å; P72-I326 HydrophobicContact CG-CG1 4.5Å |
| 73 | L | 97.1 | Very high | 94.2 | Very high | 19 Ų | 19 | 15.1 Ų | 15.1 | 10% | 0.099 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -70 | -35.3 | 173.2 | 175 | 61.4 | 0 | 0 | 0 | 111.6 | G70 L71 K76 N77 I322 D401 | G70-L73 PolarHBondContact O-N 2.94Å; L71-L73 VanDerWaalsContact C-N 3.34Å; L71-L73 PolarHBondContact O-N 3.47Å; L73-K76 HydrophobicContact CD1-CB 4.48Å; L73-K76 HydrophobicContact CD1-CD 4.07Å; L73-K76 WeakPolarHBondContact O-CB 3.35Å; L73-K76 PolarHBondContact O-N 3.33Å; L73-N77 PolarHBondContact O-N 3.03Å; L73-I322 HydrophobicContact CB-CG1 4.4Å; L73-I322 HydrophobicContact CB-CG2 4.27Å; L73-I322 HydrophobicContact CD1-CG2 4.02Å; L73-D401 HydrophobicContact CD2-CB 3.38Å |
| 74 | A | 97.4 | Very high | 94.7 | Very high | 1 Ų | 1 | 15.7 Ų | 15.7 | 1% | 0.008 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -60.1 | -47 | 171.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | G70 L71 K76 N77 A78 F265 T268 | G70-A74 PolarHBondContact O-N 3.35Å; G70-A74 VanDerWaalsContact O-N 3.12Å; L71-A74 HydrophobicContact CD2-CB 4.46Å; L71-A74 WeakPolarHBondContact O-CB 3.44Å; L71-A74 PolarHBondContact O-N 3.5Å; L71-A74 VanDerWaalsContact O-N 3.16Å; A74-K76 VanDerWaalsContact C-N 3.31Å; A74-K76 PolarHBondContact O-N 3.32Å; A74-N77 WeakPolarHBondContact O-CB 3.48Å; A74-N77 PolarHBondContact O-N 3.29Å; A74-N77 VanDerWaalsContact O-N 3.07Å; A74-A78 PolarHBondContact O-N 3.12Å; A74-F265 HydrophobicContact CB-CD2 3.73Å; A74-F265 HydrophobicContact CB-CE2 4.42Å; A74-F265 VanDerWaalsContact O-CD2 3.25Å; A74-F265 WeakPolarHBondContact O-CD2 3.34Å; A74-T268 HydrophobicContact CB-CG2 3.75Å |
| 75 | V | 97.9 | Very high | 95.3 | Very high | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -63.6 | -35.6 | 177 | 173.1 | 0 | 0 | 0 | 0 | 111.5 | L71 P72 A78 G79 P84 L87 Y315 | L71-V75 WeakPolarHBondContact O-CG2 3.48Å; L71-V75 PolarHBondContact O-N 3.43Å; P72-V75 PolarHBondContact O-N 3.4Å; V75-A78 PolarHBondContact O-N 2.81Å; V75-G79 CarbonylContact O-C 3.41Å; V75-G79 WeakPolarHBondContact O-CA 3.36Å; V75-G79 PolarHBondContact O-N 3.16Å; V75-P84 HydrophobicContact CG1-CG 4.49Å; V75-L87 HydrophobicContact CG2-CD1 3.77Å; V75-Y315 HydrophobicContact CG1-CD1 3.94Å; V75-Y315 HydrophobicContact CG1-CG 4.36Å |
| 76 | K | 96.9 | Very high | 96 | Very high | 44 Ų | 44 | 18 Ų | 18 | 19% | 0.191 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -55.7 | -50.3 | 167.5 | 170.6 | 176.4 | 167 | 171.5 | 0 | 111.9 | P72 L73 A74 A78 G79 Y315 E320 I322 | P72-K76 PolarHBondContact O-N 3.31Å; L73-K76 HydrophobicContact CD1-CB 4.48Å; L73-K76 HydrophobicContact CD1-CD 4.07Å; L73-K76 WeakPolarHBondContact O-CB 3.35Å; L73-K76 PolarHBondContact O-N 3.33Å; A74-K76 VanDerWaalsContact C-N 3.31Å; A74-K76 PolarHBondContact O-N 3.32Å; K76-A78 VanDerWaalsContact C-N 3.3Å; K76-A78 PolarHBondContact O-N 2.86Å; K76-G79 PolarHBondContact O-N 3.04Å; K76-Y315 HydrophobicContact CB-CD2 3.59Å; K76-Y315 HydrophobicContact CB-CE2 3.47Å; K76-Y315 VanDerWaalsContact CB-CE2 3.47Å; K76-Y315 HydrophobicContact CB-CG 4.24Å; K76-Y315 HydrophobicContact CD-CE2 4.19Å; K76-Y315 HydrophobicContact CG-CD2 4.23Å; K76-Y315 HydrophobicContact CG-CE2 3.63Å; K76-E320 WeakPolarHBondContact CE-OE2 3.48Å; K76-E320 PolarHBondContact NZ-O 3.47Å; K76-E320 IonicContact NZ-OE2 2.58Å; K76-E320 PolarHBondContact NZ-OE2 3.03Å; K76-I322 HydrophobicContact CB-CG2 3.99Å; K76-I322 HydrophobicContact CD-CG2 3.5Å; K76-I322 HydrophobicContact CG-CG2 4.35Å |
| 77 | N | 96.4 | Very high | 96.6 | Very high | 19 Ų | 19 | 17.9 Ų | 17.9 | 10% | 0.102 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -63.1 | -33.7 | -178 | -69.3 | -14.8 | 0 | 0 | 0 | 112.9 | L73 A74 D261 F265 | L73-N77 PolarHBondContact O-N 3.03Å; A74-N77 WeakPolarHBondContact O-CB 3.48Å; A74-N77 PolarHBondContact O-N 3.29Å; A74-N77 VanDerWaalsContact O-N 3.07Å; N77-D261 HydrophobicContact CB-CB 3.89Å; N77-F265 HydrophobicContact CB-CB 4.23Å |
| 78 | A | 97.3 | Very high | 97.1 | Very high | 1 Ų | 1 | 21.7 Ų | 21.7 | 1% | 0.008 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -88.7 | -23 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | A74 V75 K76 L82 G257 Y262 F265 | A74-A78 PolarHBondContact O-N 3.12Å; V75-A78 PolarHBondContact O-N 2.81Å; K76-A78 VanDerWaalsContact C-N 3.3Å; K76-A78 PolarHBondContact O-N 2.86Å; A78-L82 WeakPolarHBondContact O-CB 3.37Å; A78-G257 VanDerWaalsContact C-N 3.35Å; A78-G257 PolarHBondContact O-N 2.75Å; A78-Y262 HydrophobicContact CB-CD2 4.08Å; A78-Y262 HydrophobicContact CB-CE2 4.21Å; A78-F265 HydrophobicContact CB-CB 4.01Å; A78-F265 HydrophobicContact CB-CD1 4.11Å; A78-F265 HydrophobicContact CB-CD2 3.69Å; A78-F265 HydrophobicContact CB-CE2 4.2Å; A78-F265 HydrophobicContact CB-CG 3.64Å |
| 79 | G | 96.6 | Very high | 97.2 | Very high | 0 Ų | 0 | 25.1 Ų | 25.1 | 0% | 0 | 14% | 0.138 | C | C | . | . | trans | 93.6 | 158.6 | -172.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | V75 K76 V81 G83 P254 K255 | V75-G79 CarbonylContact O-C 3.41Å; V75-G79 WeakPolarHBondContact O-CA 3.36Å; V75-G79 PolarHBondContact O-N 3.16Å; K76-G79 PolarHBondContact O-N 3.04Å; G79-V81 VanDerWaalsContact C-N 3.3Å; G79-V81 PolarHBondContact O-N 3.18Å; G79-G83 WeakPolarHBondContact O-CA 3.19Å; G79-G83 PolarHBondContact O-N 3.32Å; G79-P254 CarbonylContact C-O 3.53Å; G79-P254 WeakPolarHBondContact CA-O 3.45Å; G79-K255 CarbonylContact C-O 3.38Å | ||
| 80 | L | 95.9 | Very high | 97.3 | Very high | 26 Ų | 26 | 25.6 Ų | 25.6 | 14% | 0.136 | 14% | 0.14 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -27.7 | -167.7 | -171.3 | 66.5 | 0 | 0 | 0 | 115 | P84 I251 L253 P254 K255 T312 Y315 M316 | L80-P84 VanDerWaalsContact O-CD 3.24Å; L80-P84 WeakPolarHBondContact O-CD 3.09Å; L80-P84 VanDerWaalsContact O-CG 3.3Å; L80-P84 WeakPolarHBondContact O-CG 3.46Å; L80-I251 HydrophobicContact CD2-CG2 3.81Å; L80-L253 HydrophobicContact CD2-CB 4.3Å; L80-P254 PolarHBondContact N-O 2.97Å; L80-K255 PolarHBondContact N-O 3.49Å; L80-T312 HydrophobicContact CD1-CG2 4.15Å; L80-Y315 HydrophobicContact CB-CD1 4.28Å; L80-Y315 HydrophobicContact CB-CE1 4.14Å; L80-Y315 HydrophobicContact CD1-CD1 3.84Å; L80-Y315 HydrophobicContact CD1-CE1 4.44Å; L80-M316 HydrophobicContact CD1-CE 3.86Å; L80-M316 HydrophobicContact CD1-CG 3.73Å; L80-M316 HydrophobicContact CD2-CE 4.17Å; L80-M316 HydrophobicContact CG-CE 4.3Å |
| 81 | V | 96.6 | Very high | 97.4 | Very high | 74 Ų | 74 | 25.5 Ų | 25.5 | 45% | 0.448 | 14% | 0.139 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -102.1 | -44.6 | 179.1 | 179.7 | 0 | 0 | 0 | 0 | 111 | G79 I85 K255 | G79-V81 VanDerWaalsContact C-N 3.3Å; G79-V81 PolarHBondContact O-N 3.18Å; V81-I85 HydrophobicContact CG1-CD1 3.91Å; V81-I85 WeakPolarHBondContact O-CD1 3.37Å; V81-I85 WeakPolarHBondContact O-CG1 3.45Å; V81-I85 PolarHBondContact O-N 2.93Å; V81-K255 HydrophobicContact CB-CB 4.39Å; V81-K255 WeakPolarHBondContact CB-O 3.42Å; V81-K255 HydrophobicContact CG2-CB 3.87Å; V81-K255 HydrophobicContact CG2-CG 4.1Å; V81-K255 PolarHBondContact N-O 3.42Å |
| 82 | L | 97.4 | Very high | 97.4 | Very high | 56 Ų | 56 | 30.4 Ų | 30.4 | 29% | 0.293 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -68.5 | -40.6 | -179 | 177 | 62.7 | 0 | 0 | 0 | 111.9 | A78 I85 S86 K255 V256 Y262 | A78-L82 WeakPolarHBondContact O-CB 3.37Å; L82-I85 PolarHBondContact O-N 3.42Å; L82-S86 WeakPolarHBondContact O-CB 3.45Å; L82-S86 PolarHBondContact O-N 2.97Å; L82-S86 PolarHBondContact O-OG 3.45Å; L82-K255 PolarHBondContact N-O 2.94Å; L82-V256 HydrophobicContact CB-CG2 4.46Å; L82-V256 HydrophobicContact CD2-CG1 3.98Å; L82-Y262 HydrophobicContact CD2-CD2 4.02Å; L82-Y262 HydrophobicContact CD2-CE2 3.88Å; L82-Y262 HydrophobicContact CG-CE2 4.07Å |
| 83 | G | 97.8 | Very high | 97.3 | Very high | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -55.2 | -54.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | G79 I85 S86 L87 | G79-G83 WeakPolarHBondContact O-CA 3.19Å; G79-G83 PolarHBondContact O-N 3.32Å; G83-I85 PolarHBondContact O-N 3.47Å; G83-S86 PolarHBondContact O-N 3.46Å; G83-L87 WeakPolarHBondContact O-CG 3.38Å; G83-L87 PolarHBondContact O-N 2.98Å |
| 84 | P | 98.1 | Very high | 97.3 | Very high | 22 Ų | 22 | 31.3 Ų | 31.3 | 14% | 0.143 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -60.6 | -40.3 | 177.6 | -30.2 | 40.4 | 0 | 0 | 0 | 114.1 | V75 L80 L87 L88 I308 T312 | V75-P84 HydrophobicContact CG1-CG 4.49Å; L80-P84 VanDerWaalsContact O-CD 3.24Å; L80-P84 WeakPolarHBondContact O-CD 3.09Å; L80-P84 VanDerWaalsContact O-CG 3.3Å; L80-P84 WeakPolarHBondContact O-CG 3.46Å; P84-L87 PolarHBondContact O-N 3.29Å; P84-L88 PolarHBondContact O-N 2.9Å; P84-I308 HydrophobicContact CB-CG2 4.13Å; P84-T312 HydrophobicContact CG-CG2 4.25Å; P84-T312 VanDerWaalsContact CG-OG1 3.27Å; P84-T312 WeakPolarHBondContact CG-OG1 3.48Å |
| 85 | I | 98.4 | Very high | 97.3 | Very high | 97 Ų | 97 | 32 Ų | 32 | 50% | 0.497 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -64.1 | -46.4 | 176.1 | -67.3 | 171.7 | 0 | 0 | 0 | 110.1 | V81 L82 G83 L88 V89 | V81-I85 HydrophobicContact CG1-CD1 3.91Å; V81-I85 WeakPolarHBondContact O-CD1 3.37Å; V81-I85 WeakPolarHBondContact O-CG1 3.45Å; V81-I85 PolarHBondContact O-N 2.93Å; L82-I85 PolarHBondContact O-N 3.42Å; G83-I85 PolarHBondContact O-N 3.47Å; I85-L88 WeakPolarHBondContact O-CB 3.36Å; I85-L88 PolarHBondContact O-N 3.26Å; I85-V89 WeakPolarHBondContact O-CG2 3.41Å; I85-V89 PolarHBondContact O-N 3.07Å |
| 86 | S | 97.7 | Very high | 97.2 | Very high | 10 Ų | 10 | 35.2 Ų | 35.2 | 7% | 0.07 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -65 | -39.7 | 177.4 | -67.7 | 0 | 0 | 0 | 0 | 111.9 | L82 G83 L88 V89 M90 Y262 F265 | L82-S86 WeakPolarHBondContact O-CB 3.45Å; L82-S86 PolarHBondContact O-N 2.97Å; L82-S86 PolarHBondContact O-OG 3.45Å; G83-S86 PolarHBondContact O-N 3.46Å; S86-L88 VanDerWaalsContact C-N 3.31Å; S86-L88 PolarHBondContact O-N 3.39Å; S86-V89 PolarHBondContact O-N 2.74Å; S86-M90 WeakPolarHBondContact O-CB 3.44Å; S86-M90 WeakPolarHBondContact O-CG 3.29Å; S86-M90 PolarHBondContact O-N 3.26Å; S86-Y262 WeakPolarHBondContact CB-OH 3.2Å; S86-Y262 PolarHBondContact OG-OH 2.95Å; S86-F265 VanDerWaalsContact CB-CE1 3.4Å; S86-F265 VanDerWaalsContact CB-CZ 3.45Å |
| 87 | L | 98.3 | Very high | 97.2 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -60.3 | -39.7 | 173.8 | -74.1 | 176.6 | 0 | 0 | 0 | 112.1 | L71 V75 G83 P84 G91 F265 A269 F273 I308 | L71-L87 HydrophobicContact CD2-CD2 3.94Å; V75-L87 HydrophobicContact CG2-CD1 3.77Å; G83-L87 WeakPolarHBondContact O-CG 3.38Å; G83-L87 PolarHBondContact O-N 2.98Å; P84-L87 PolarHBondContact O-N 3.29Å; L87-G91 PolarHBondContact O-N 2.92Å; L87-F265 HydrophobicContact CD2-CE2 3.75Å; L87-F265 HydrophobicContact CD2-CZ 3.89Å; L87-F265 HydrophobicContact CG-CE2 3.79Å; L87-F265 HydrophobicContact CG-CZ 3.94Å; L87-A269 HydrophobicContact CD2-CB 3.79Å; L87-F273 HydrophobicContact CD2-CE2 4.25Å; L87-F273 WeakPolarHBondContact O-CE2 3.5Å; L87-F273 WeakPolarHBondContact O-CZ 3.48Å; L87-I308 HydrophobicContact CB-CG1 3.77Å; L87-I308 HydrophobicContact CD1-CG1 4.49Å |
| 88 | L | 98.4 | Very high | 97.2 | Very high | 84 Ų | 84 | 32.4 Ų | 32.4 | 44% | 0.44 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -63.5 | -47.2 | 174.6 | -178.6 | 60.9 | 0 | 0 | 0 | 111.8 | P84 I85 S86 G91 I92 T304 I308 | P84-L88 PolarHBondContact O-N 2.9Å; I85-L88 WeakPolarHBondContact O-CB 3.36Å; I85-L88 PolarHBondContact O-N 3.26Å; S86-L88 VanDerWaalsContact C-N 3.31Å; S86-L88 PolarHBondContact O-N 3.39Å; L88-G91 PolarHBondContact O-N 2.9Å; L88-I92 HydrophobicContact CD1-CD1 4.23Å; L88-I92 HydrophobicContact CG-CD1 4.09Å; L88-I92 VanDerWaalsContact O-CG1 3.3Å; L88-I92 WeakPolarHBondContact O-CG1 3.39Å; L88-I92 PolarHBondContact O-N 3.33Å; L88-T304 HydrophobicContact CD1-CG2 4.12Å; L88-I308 HydrophobicContact CB-CD1 3.79Å; L88-I308 HydrophobicContact CD1-CD1 4.12Å |
| 89 | V | 97.8 | Very high | 97.1 | Very high | 71 Ų | 71 | 32.9 Ų | 32.9 | 43% | 0.43 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -61.3 | -46.3 | 177.6 | 171.1 | 0 | 0 | 0 | 0 | 111 | I85 S86 G91 I92 I93 | I85-V89 WeakPolarHBondContact O-CG2 3.41Å; I85-V89 PolarHBondContact O-N 3.07Å; S86-V89 PolarHBondContact O-N 2.74Å; V89-G91 PolarHBondContact O-N 3Å; V89-I92 PolarHBondContact O-N 2.81Å; V89-I93 HydrophobicContact CG1-CD1 3.79Å; V89-I93 VanDerWaalsContact O-CG1 3.3Å; V89-I93 WeakPolarHBondContact O-CG1 3.33Å; V89-I93 PolarHBondContact O-N 3.32Å |
| 90 | M | 96.8 | Very high | 97.1 | Very high | 10 Ų | 10 | 32.9 Ų | 32.9 | 5% | 0.049 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -65 | -38.6 | 178.9 | -65.2 | -57.2 | -75.4 | 0 | 0 | 111.8 | S86 I93 A94 F266 I270 F273 L417 | S86-M90 WeakPolarHBondContact O-CB 3.44Å; S86-M90 WeakPolarHBondContact O-CG 3.29Å; S86-M90 PolarHBondContact O-N 3.26Å; M90-I93 PolarHBondContact O-N 3.11Å; M90-A94 VanDerWaalsContact O-CB 3.3Å; M90-A94 WeakPolarHBondContact O-CB 3.27Å; M90-A94 PolarHBondContact O-N 3.2Å; M90-F266 HydrophobicContact CE-CD2 3.64Å; M90-F266 HydrophobicContact CE-CE2 3.32Å; M90-F266 HydrophobicContact CE-CZ 4.04Å; M90-F266 HydrophobicContact SD-CD2 4.37Å; M90-F266 HydrophobicContact SD-CE2 4.22Å; M90-I270 HydrophobicContact CE-CD1 3.39Å; M90-I270 HydrophobicContact CE-CG1 3.37Å; M90-F273 HydrophobicContact CB-CD2 4.27Å; M90-F273 HydrophobicContact CB-CE2 4.26Å; M90-L417 HydrophobicContact CE-CD1 4.33Å |
| 91 | G | 96.9 | Very high | 97.1 | Very high | 1 Ų | 1 | 31.7 Ų | 31.7 | 1% | 0.01 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -61.9 | -44.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | L87 L88 V89 I93 A94 V95 F273 | L87-G91 PolarHBondContact O-N 2.92Å; L88-G91 PolarHBondContact O-N 2.9Å; V89-G91 PolarHBondContact O-N 3Å; G91-I93 PolarHBondContact O-N 3.14Å; G91-A94 PolarHBondContact O-N 3.11Å; G91-V95 WeakPolarHBondContact O-CB 3.16Å; G91-V95 VanDerWaalsContact O-CG2 3.29Å; G91-V95 WeakPolarHBondContact O-CG2 3.47Å; G91-V95 PolarHBondContact O-N 3.45Å; G91-F273 VanDerWaalsContact CA-CZ 3.5Å |
| 92 | I | 97.5 | Very high | 97 | Very high | 104 Ų | 104 | 28.2 Ų | 28.2 | 53% | 0.533 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -60.7 | -45.3 | 175.3 | -69 | 164.2 | 0 | 0 | 0 | 111 | L88 V89 H96 | L88-I92 HydrophobicContact CD1-CD1 4.23Å; L88-I92 HydrophobicContact CG-CD1 4.09Å; L88-I92 VanDerWaalsContact O-CG1 3.3Å; L88-I92 WeakPolarHBondContact O-CG1 3.39Å; L88-I92 PolarHBondContact O-N 3.33Å; V89-I92 PolarHBondContact O-N 2.81Å; I92-H96 WeakPolarHBondContact O-CB 3.27Å; I92-H96 PolarHBondContact O-N 2.65Å |
| 93 | I | 96.9 | Very high | 96.8 | Very high | 35 Ų | 35 | 30.3 Ų | 30.3 | 18% | 0.179 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -65.9 | -43.5 | 178.9 | -63.7 | 166.6 | 0 | 0 | 0 | 110.9 | V89 M90 G91 H96 C97 L417 I444 | V89-I93 HydrophobicContact CG1-CD1 3.79Å; V89-I93 VanDerWaalsContact O-CG1 3.3Å; V89-I93 WeakPolarHBondContact O-CG1 3.33Å; V89-I93 PolarHBondContact O-N 3.32Å; M90-I93 PolarHBondContact O-N 3.11Å; G91-I93 PolarHBondContact O-N 3.14Å; I93-H96 WeakPolarHBondContact O-CB 3.38Å; I93-H96 PolarHBondContact O-N 3.26Å; I93-C97 PolarHBondContact O-N 3.1Å; I93-L417 HydrophobicContact CG2-CD2 3.43Å; I93-L417 VanDerWaalsContact CG2-CD2 3.43Å; I93-I444 HydrophobicContact CG2-CG1 4.41Å; I93-I444 HydrophobicContact CG2-CG2 3.78Å |
| 94 | A | 96.1 | Very high | 96.6 | Very high | 2 Ų | 2 | 30.3 Ų | 30.3 | 2% | 0.017 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -60.7 | -47.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | M90 G91 H96 C97 M98 F273 | M90-A94 VanDerWaalsContact O-CB 3.3Å; M90-A94 WeakPolarHBondContact O-CB 3.27Å; M90-A94 PolarHBondContact O-N 3.2Å; G91-A94 PolarHBondContact O-N 3.11Å; A94-H96 VanDerWaalsContact C-N 3.33Å; A94-H96 PolarHBondContact O-N 3.36Å; A94-C97 PolarHBondContact O-N 3.11Å; A94-M98 VanDerWaalsContact O-CG 3.32Å; A94-M98 WeakPolarHBondContact O-CG 2.96Å; A94-M98 PolarHBondContact O-N 3.21Å; A94-F273 HydrophobicContact CB-CB 3.94Å; A94-F273 HydrophobicContact CB-CG 4.36Å |
| 95 | V | 96.8 | Very high | 96.4 | Very high | 17 Ų | 17 | 29.4 Ų | 29.4 | 10% | 0.103 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -59.1 | -44.2 | 174.6 | 171 | 0 | 0 | 0 | 0 | 111.6 | G91 M98 M99 Y297 M300 | G91-V95 WeakPolarHBondContact O-CB 3.16Å; G91-V95 VanDerWaalsContact O-CG2 3.29Å; G91-V95 WeakPolarHBondContact O-CG2 3.47Å; G91-V95 PolarHBondContact O-N 3.45Å; V95-M98 PolarHBondContact O-N 3.01Å; V95-M99 WeakPolarHBondContact O-CB 3.27Å; V95-M99 WeakPolarHBondContact O-CG 3.39Å; V95-M99 PolarHBondContact O-N 3.44Å; V95-Y297 HydrophobicContact CG1-CD1 3.6Å; V95-Y297 HydrophobicContact CG1-CE1 3.54Å; V95-M300 HydrophobicContact CG2-CB 3.29Å; V95-M300 HydrophobicContact CG2-CG 3.88Å |
| 96 | H | 96.8 | Very high | 96.1 | Very high | 66 Ų | 66 | 27.9 Ų | 27.9 | 31% | 0.306 | 14% | 0.142 | S | C | . | . | H | α-helix | trans | -59.8 | -47.1 | 176.8 | 178.7 | 77.2 | 0 | 0 | 0 | 111.4 | I92 I93 A94 M99 L100 K440 | I92-H96 WeakPolarHBondContact O-CB 3.27Å; I92-H96 PolarHBondContact O-N 2.65Å; I93-H96 WeakPolarHBondContact O-CB 3.38Å; I93-H96 PolarHBondContact O-N 3.26Å; A94-H96 VanDerWaalsContact C-N 3.33Å; A94-H96 PolarHBondContact O-N 3.36Å; H96-M99 CarbonylContact O-C 3.45Å; H96-M99 WeakPolarHBondContact O-CA 3.34Å; H96-M99 WeakPolarHBondContact O-CB 3.27Å; H96-M99 PolarHBondContact O-N 2.88Å; H96-L100 WeakPolarHBondContact NE2-CD1 3.37Å; H96-L100 WeakPolarHBondContact NE2-CD2 3.45Å; H96-L100 WeakPolarHBondContact NE2-CG 3.35Å; H96-L100 WeakPolarHBondContact O-CG 3.25Å; H96-L100 PolarHBondContact O-N 2.92Å; H96-K440 PolarHBondContact CE1-NZ 3.2Å; H96-K440 VanDerWaalsContact NE2-CD 3.31Å; H96-K440 WeakPolarHBondContact NE2-CD 3.32Å; H96-K440 WeakPolarHBondContact NE2-CE 3.37Å; H96-K440 PolarHBondContact NE2-NZ 2.98Å |
| 97 | C | 97.3 | Very high | 95.9 | Very high | 1 Ų | 1 | 29 Ų | 29 | 1% | 0.007 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -65.3 | -39.9 | 177.7 | -80.5 | 0 | 0 | 0 | 0 | 113.8 | I93 A94 M99 L100 L101 A416 P420 | I93-C97 PolarHBondContact O-N 3.1Å; A94-C97 PolarHBondContact O-N 3.11Å; C97-M99 VanDerWaalsContact C-N 3.28Å; C97-M99 PolarHBondContact O-N 2.73Å; C97-L100 WeakPolarHBondContact O-CB 3.43Å; C97-L100 PolarHBondContact O-N 3.24Å; C97-L100 VanDerWaalsContact O-N 3.16Å; C97-L101 PolarHBondContact O-N 3.37Å; C97-A416 WeakPolarHBondContact CB-O 3.09Å; C97-A416 PolarHBondContact SG-O 2.92Å; C97-P420 HydrophobicContact CB-CB 3.9Å; C97-P420 HydrophobicContact CB-CG 4Å; C97-P420 WeakPolarHBondContact O-CB 3.45Å |
| 98 | M | 96.4 | Very high | 95.6 | Very high | 4 Ų | 4 | 29.1 Ų | 29.1 | 2% | 0.02 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -60.5 | -40.1 | 171.7 | -67.3 | -179.9 | -167.7 | 0 | 0 | 111.1 | A94 V95 L101 V102 F273 I276 V279 L296 M300 | A94-M98 VanDerWaalsContact O-CG 3.32Å; A94-M98 WeakPolarHBondContact O-CG 2.96Å; A94-M98 PolarHBondContact O-N 3.21Å; V95-M98 PolarHBondContact O-N 3.01Å; M98-L101 PolarHBondContact O-N 3.02Å; M98-V102 WeakPolarHBondContact O-CG2 3.46Å; M98-V102 PolarHBondContact O-N 2.81Å; M98-V102 VanDerWaalsContact O-N 3.08Å; M98-F273 VanDerWaalsContact CE-O 3.31Å; M98-F273 WeakPolarHBondContact CE-O 3.08Å; M98-I276 HydrophobicContact CG-CB 4.3Å; M98-I276 HydrophobicContact CG-CG1 4.17Å; M98-V279 HydrophobicContact CB-CG2 4.2Å; M98-V279 HydrophobicContact CG-CG2 3.93Å; M98-V279 HydrophobicContact SD-CG2 3.76Å; M98-L296 HydrophobicContact CB-CD1 4.39Å; M98-L296 HydrophobicContact CB-CD2 3.87Å; M98-L296 HydrophobicContact SD-CD1 3.95Å; M98-M300 HydrophobicContact CE-CE 3.7Å; M98-M300 HydrophobicContact CE-SD 4.23Å; M98-M300 HydrophobicContact SD-CE 4.15Å; M98-M300 HydrophobicContact SD-CG 4.22Å; M98-M300 HydrophobicContact SD-SD 4.11Å |
| 99 | M | 95.6 | Very high | 95.2 | Very high | 11 Ų | 11 | 25.7 Ų | 25.7 | 5% | 0.054 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -66.5 | -34.8 | 173.4 | -80.3 | -60.1 | -53.9 | 0 | 0 | 113.3 | V95 H96 C97 K103 T293 L296 Y297 | V95-M99 WeakPolarHBondContact O-CB 3.27Å; V95-M99 WeakPolarHBondContact O-CG 3.39Å; V95-M99 PolarHBondContact O-N 3.44Å; H96-M99 CarbonylContact O-C 3.45Å; H96-M99 WeakPolarHBondContact O-CA 3.34Å; H96-M99 WeakPolarHBondContact O-CB 3.27Å; H96-M99 PolarHBondContact O-N 2.88Å; C97-M99 VanDerWaalsContact C-N 3.28Å; C97-M99 PolarHBondContact O-N 2.73Å; M99-K103 WeakPolarHBondContact O-CB 3.42Å; M99-K103 VanDerWaalsContact O-CG 3.28Å; M99-K103 WeakPolarHBondContact O-CG 3.5Å; M99-K103 PolarHBondContact O-N 3.34Å; M99-T293 HydrophobicContact CE-CG2 3.61Å; M99-T293 HydrophobicContact SD-CG2 3.74Å; M99-L296 HydrophobicContact CG-CD2 3.91Å; M99-L296 HydrophobicContact SD-CD2 3.71Å; M99-Y297 HydrophobicContact CG-CE1 4.39Å; M99-Y297 HydrophobicContact SD-CE2 4.42Å |
| 100 | L | 95.5 | Very high | 94.8 | Very high | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -61.9 | -46.4 | 172.1 | -63.4 | -165.5 | 0 | 0 | 0 | 110.7 | H96 C97 V102 K103 C104 P420 P421 E424 | H96-L100 WeakPolarHBondContact NE2-CD1 3.37Å; H96-L100 WeakPolarHBondContact NE2-CD2 3.45Å; H96-L100 WeakPolarHBondContact NE2-CG 3.35Å; H96-L100 WeakPolarHBondContact O-CG 3.25Å; H96-L100 PolarHBondContact O-N 2.92Å; C97-L100 WeakPolarHBondContact O-CB 3.43Å; C97-L100 PolarHBondContact O-N 3.24Å; C97-L100 VanDerWaalsContact O-N 3.16Å; L100-V102 PolarHBondContact O-N 3.48Å; L100-K103 PolarHBondContact O-N 3.27Å; L100-C104 WeakPolarHBondContact O-CB 3.25Å; L100-C104 PolarHBondContact O-N 3.43Å; L100-C104 PolarHBondContact O-SG 2.78Å; L100-P420 HydrophobicContact CB-CB 4.34Å; L100-P421 HydrophobicContact CD1-CB 4.41Å; L100-P421 HydrophobicContact CD1-CG 4.33Å; L100-E424 HydrophobicContact CD1-CB 4.21Å; L100-E424 VanDerWaalsContact CD2-CD 3.49Å; L100-E424 VanDerWaalsContact CD2-OE1 3.28Å; L100-E424 WeakPolarHBondContact CD2-OE1 3.21Å |
| 101 | L | 95.9 | Very high | 94.4 | Very high | 0 Ų | 0 | 29.6 Ų | 29.6 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -59.8 | -46.1 | 178.7 | 178.1 | 57.7 | 0 | 0 | 0 | 112.1 | C97 M98 C104 S105 Y119 V122 I276 L280 L423 | C97-L101 PolarHBondContact O-N 3.37Å; M98-L101 PolarHBondContact O-N 3.02Å; L101-C104 PolarHBondContact O-N 2.89Å; L101-S105 VanDerWaalsContact O-CB 3.3Å; L101-S105 WeakPolarHBondContact O-CB 3.43Å; L101-S105 PolarHBondContact O-N 3.36Å; L101-Y119 HydrophobicContact CD1-CD2 3.36Å; L101-Y119 HydrophobicContact CD1-CE2 3.46Å; L101-Y119 VanDerWaalsContact CD1-CE2 3.46Å; L101-Y119 HydrophobicContact CD1-CG 4.15Å; L101-Y119 HydrophobicContact CD2-CD1 3.98Å; L101-Y119 HydrophobicContact CD2-CD2 3.91Å; L101-Y119 HydrophobicContact CD2-CE1 4.04Å; L101-Y119 HydrophobicContact CD2-CE2 4Å; L101-Y119 HydrophobicContact CD2-CG 3.92Å; L101-Y119 HydrophobicContact CG-CD2 4.3Å; L101-Y119 HydrophobicContact CG-CE2 4.34Å; L101-V122 HydrophobicContact CD1-CG1 4.45Å; L101-I276 HydrophobicContact CB-CD1 4.33Å; L101-I276 HydrophobicContact CD2-CD1 3.76Å; L101-I276 HydrophobicContact CD2-CG1 3.52Å; L101-L280 HydrophobicContact CD1-CD1 3.86Å; L101-L280 HydrophobicContact CD2-CD1 4Å; L101-L280 HydrophobicContact CD2-CG 4.03Å; L101-L280 HydrophobicContact CG-CD1 3.86Å; L101-L280 HydrophobicContact CG-CD2 4.27Å; L101-L280 HydrophobicContact CG-CG 4.01Å; L101-L423 HydrophobicContact CD1-CD2 3.62Å |
| 102 | V | 94.4 | Very high | 93.9 | Very high | 2 Ų | 2 | 33.4 Ų | 33.4 | 1% | 0.012 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -59.5 | -48 | 175.8 | 170.1 | 0 | 0 | 0 | 0 | 111.6 | M98 L100 C104 S105 H106 V279 L280 E283 F292 | M98-V102 WeakPolarHBondContact O-CG2 3.46Å; M98-V102 PolarHBondContact O-N 2.81Å; M98-V102 VanDerWaalsContact O-N 3.08Å; L100-V102 PolarHBondContact O-N 3.48Å; V102-C104 PolarHBondContact O-N 3.4Å; V102-S105 WeakPolarHBondContact O-CB 3.37Å; V102-S105 PolarHBondContact O-N 3.1Å; V102-H106 PolarHBondContact O-CD2 3.28Å; V102-H106 PolarHBondContact O-N 3.49Å; V102-V279 HydrophobicContact CG2-CG1 3.54Å; V102-L280 HydrophobicContact CG2-CD2 4.41Å; V102-E283 WeakPolarHBondContact CG1-OE1 3.18Å; V102-F292 HydrophobicContact CG2-CD1 4.12Å; V102-F292 HydrophobicContact CG2-CE1 3.85Å |
| 103 | K | 93.6 | Very high | 93.3 | Very high | 100 Ų | 100 | 35.1 Ų | 35.1 | 44% | 0.435 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -59.9 | -45.5 | 178 | -74.1 | 172.4 | 177.9 | -177.3 | 0 | 112.5 | M99 L100 S105 H106 H107 | M99-K103 WeakPolarHBondContact O-CB 3.42Å; M99-K103 VanDerWaalsContact O-CG 3.28Å; M99-K103 WeakPolarHBondContact O-CG 3.5Å; M99-K103 PolarHBondContact O-N 3.34Å; L100-K103 PolarHBondContact O-N 3.27Å; K103-S105 VanDerWaalsContact C-N 3.34Å; K103-H106 PolarHBondContact O-N 2.94Å; K103-H107 WeakPolarHBondContact O-CB 3.44Å; K103-H107 PolarHBondContact O-N 3.47Å |
| 104 | C | 94.4 | Very high | 92.6 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -64.5 | -40.9 | 178 | -63.2 | 0 | 0 | 0 | 0 | 111.4 | L100 L101 V102 H107 L108 V122 L423 E424 A427 | L100-C104 WeakPolarHBondContact O-CB 3.25Å; L100-C104 PolarHBondContact O-N 3.43Å; L100-C104 PolarHBondContact O-SG 2.78Å; L101-C104 PolarHBondContact O-N 2.89Å; V102-C104 PolarHBondContact O-N 3.4Å; C104-H107 PolarHBondContact O-N 3.1Å; C104-L108 WeakPolarHBondContact O-CB 3.49Å; C104-L108 WeakPolarHBondContact O-CG 3.13Å; C104-L108 PolarHBondContact O-N 3.14Å; C104-V122 HydrophobicContact CB-CG1 4.07Å; C104-L423 HydrophobicContact CB-CD2 4.1Å; C104-L423 HydrophobicContact CB-CG 3.89Å; C104-E424 VanDerWaalsContact SG-CA 3.56Å; C104-A427 HydrophobicContact CB-CB 4.15Å |
| 105 | S | 93.8 | Very high | 91.7 | Very high | 2 Ų | 2 | 40.6 Ų | 40.6 | 1% | 0.014 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -58.3 | -47.5 | 173.6 | -177.2 | 0 | 0 | 0 | 0 | 111.5 | L101 V102 K103 S109 | L101-S105 VanDerWaalsContact O-CB 3.3Å; L101-S105 WeakPolarHBondContact O-CB 3.43Å; L101-S105 PolarHBondContact O-N 3.36Å; V102-S105 WeakPolarHBondContact O-CB 3.37Å; V102-S105 PolarHBondContact O-N 3.1Å; K103-S105 VanDerWaalsContact C-N 3.34Å; S105-S109 WeakPolarHBondContact O-CA 3.37Å; S105-S109 WeakPolarHBondContact O-CB 3.45Å; S105-S109 PolarHBondContact O-N 3.48Å |
| 106 | H | 92 | Very high | 90.9 | Very high | 66 Ų | 66 | 41 Ų | 41 | 31% | 0.306 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -64.8 | -45.5 | 179.2 | -73.4 | -161.6 | 0 | 0 | 0 | 112.2 | V102 K103 S109 A110 E283 | V102-H106 PolarHBondContact O-CD2 3.28Å; V102-H106 PolarHBondContact O-N 3.49Å; K103-H106 PolarHBondContact O-N 2.94Å; H106-S109 PolarHBondContact O-N 3.08Å; H106-A110 WeakPolarHBondContact O-CB 3.3Å; H106-A110 PolarHBondContact O-N 2.84Å; H106-E283 IonicContact CD2-OE1 2.74Å; H106-E283 IonicContact CD2-OE2 3.07Å; H106-E283 IonicContact CE1-OE1 3.99Å; H106-E283 PolarHBondContact CE1-OE1 2.85Å; H106-E283 VanDerWaalsContact CE1-OE1 3.26Å; H106-E283 IonicContact NE2-OE1 2.71Å; H106-E283 PolarHBondContact NE2-OE1 3.34Å; H106-E283 IonicContact NE2-OE2 3.25Å; H106-E283 PolarHBondContact NE2-OE2 3.37Å; H106-E283 VanDerWaalsContact NE2-OE2 3.07Å |
| 107 | H | 91.8 | Very high | 90.5 | Very high | 34 Ų | 34 | 38 Ų | 38 | 16% | 0.157 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.4 | -50.9 | 178.5 | 174.6 | 77.9 | 0 | 0 | 0 | 111.5 | K103 C104 A110 K111 F428 E431 | K103-H107 WeakPolarHBondContact O-CB 3.44Å; K103-H107 PolarHBondContact O-N 3.47Å; C104-H107 PolarHBondContact O-N 3.1Å; H107-A110 PolarHBondContact O-N 3.27Å; H107-K111 WeakPolarHBondContact O-CB 3.3Å; H107-K111 PolarHBondContact O-N 3.48Å; H107-F428 HydrophobicContact CB-CE1 4.12Å; H107-F428 HydrophobicContact CB-CZ 3.77Å; H107-F428 AromaticContact CG-CE1 3.69Å; H107-F428 AromaticContact CG-CZ 3.83Å; H107-F428 AromaticContact ND1-CE1 3.59Å; H107-E431 IonicContact CE1-OE1 3.75Å; H107-E431 PolarHBondContact CE1-OE1 3.27Å; H107-E431 VanDerWaalsContact CE1-OE1 3.25Å; H107-E431 IonicContact CE1-OE2 2.88Å; H107-E431 PolarHBondContact CE1-OE2 2.96Å; H107-E431 IonicContact ND1-OE2 2.71Å |
| 108 | L | 92.3 | Very high | 90.2 | Very high | 1 Ų | 1 | 41.6 Ų | 41.6 | 1% | 0.005 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -71.7 | -34.1 | -179.6 | -64.7 | 170.4 | 0 | 0 | 0 | 112.3 | C104 K111 M112 M117 V122 A427 | C104-L108 WeakPolarHBondContact O-CB 3.49Å; C104-L108 WeakPolarHBondContact O-CG 3.13Å; C104-L108 PolarHBondContact O-N 3.14Å; L108-K111 PolarHBondContact O-N 3Å; L108-M112 VanDerWaalsContact O-CB 3.29Å; L108-M112 WeakPolarHBondContact O-CB 3.46Å; L108-M112 VanDerWaalsContact O-CG 3.27Å; L108-M112 WeakPolarHBondContact O-CG 3.5Å; L108-M112 PolarHBondContact O-N 2.74Å; L108-M117 HydrophobicContact CB-CE 4.2Å; L108-M117 HydrophobicContact CB-SD 3.97Å; L108-M117 WeakPolarHBondContact O-CE 3.3Å; L108-V122 HydrophobicContact CD1-CG1 3.81Å; L108-V122 WeakPolarHBondContact CD1-O 3.46Å; L108-A427 HydrophobicContact CD1-CB 4.15Å; L108-A427 HydrophobicContact CG-CB 4.38Å |
| 109 | S | 90.3 | Very high | 90.1 | Very high | 12 Ų | 12 | 42 Ų | 42 | 8% | 0.084 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -58.5 | -45.2 | 172.4 | 168 | 0 | 0 | 0 | 0 | 111.8 | S105 H106 N113 R114 | S105-S109 WeakPolarHBondContact O-CA 3.37Å; S105-S109 WeakPolarHBondContact O-CB 3.45Å; S105-S109 PolarHBondContact O-N 3.48Å; H106-S109 PolarHBondContact O-N 3.08Å; S109-N113 PolarHBondContact O-N 3.44Å; S109-N113 VanDerWaalsContact O-N 3.14Å; S109-R114 PolarHBondContact O-N 3Å; S109-R114 VanDerWaalsContact O-N 3.11Å; S109-R114 PolarHBondContact OG-O 3.4Å |
| 110 | A | 88.8 | Confident | 90 | Very high | 71 Ų | 71 | 41.5 Ų | 41.5 | 59% | 0.587 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -66.4 | -48.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | H106 H107 M112 N113 | H106-A110 WeakPolarHBondContact O-CB 3.3Å; H106-A110 PolarHBondContact O-N 2.84Å; H107-A110 PolarHBondContact O-N 3.27Å; A110-M112 VanDerWaalsContact C-N 3.3Å; A110-M112 PolarHBondContact O-N 3.36Å; A110-N113 PolarHBondContact O-N 3.25Å |
| 111 | K | 88.4 | Confident | 89.8 | Confident | 92 Ų | 92 | 43.7 Ų | 43.7 | 40% | 0.4 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -59.6 | -37.9 | -179.7 | -167.9 | 176.1 | -171 | 175.2 | 0 | 113.1 | H107 L108 N129 | H107-K111 WeakPolarHBondContact O-CB 3.3Å; H107-K111 PolarHBondContact O-N 3.48Å; L108-K111 PolarHBondContact O-N 3Å; K111-N129 PolarHBondContact NZ-OD1 2.98Å |
| 112 | M | 87 | Confident | 89.8 | Confident | 82 Ų | 82 | 43.7 Ų | 43.7 | 40% | 0.404 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -98.4 | 4.2 | -175.6 | -57.1 | -59.6 | -70.3 | 0 | 0 | 114.1 | L108 A110 R114 M117 Y125 | L108-M112 VanDerWaalsContact O-CB 3.29Å; L108-M112 WeakPolarHBondContact O-CB 3.46Å; L108-M112 VanDerWaalsContact O-CG 3.27Å; L108-M112 WeakPolarHBondContact O-CG 3.5Å; L108-M112 PolarHBondContact O-N 2.74Å; A110-M112 VanDerWaalsContact C-N 3.3Å; A110-M112 PolarHBondContact O-N 3.36Å; M112-R114 VanDerWaalsContact C-N 3.28Å; M112-R114 PolarHBondContact O-N 3.25Å; M112-M117 HydrophobicContact CB-CE 3.88Å; M112-M117 HydrophobicContact CG-CE 4.08Å; M112-Y125 HydrophobicContact CE-CD1 3.82Å; M112-Y125 HydrophobicContact CE-CE1 3.77Å; M112-Y125 HydrophobicContact CG-CD1 4.35Å; M112-Y125 HydrophobicContact CG-CG 4.38Å |
| 113 | N | 85.4 | Confident | 89.9 | Confident | 139 Ų | 139 | 44 Ų | 44 | 74% | 0.743 | 23% | 0.228 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 49.3 | 42.5 | -176.1 | -72.4 | -73.8 | 0 | 0 | 0 | 114 | S109 A110 | S109-N113 PolarHBondContact O-N 3.44Å; S109-N113 VanDerWaalsContact O-N 3.14Å; A110-N113 PolarHBondContact O-N 3.25Å |
| 114 | R | 82.4 | Confident | 90 | Very high | 113 Ų | 113 | 41 Ų | 41 | 43% | 0.426 | 22% | 0.216 | S | C | . | . | trans | -110.1 | 135.1 | 175.2 | -77 | -163.7 | 169.8 | -155 | -3.1 | 111.4 | S109 M112 S116 M117 E121 | S109-R114 PolarHBondContact O-N 3Å; S109-R114 VanDerWaalsContact O-N 3.11Å; S109-R114 PolarHBondContact OG-O 3.4Å; M112-R114 VanDerWaalsContact C-N 3.28Å; M112-R114 PolarHBondContact O-N 3.25Å; R114-S116 VanDerWaalsContact C-N 3.29Å; R114-S116 PolarHBondContact O-N 3.06Å; R114-M117 HydrophobicContact CB-CE 4.26Å; R114-E121 IonicContact NH1-OE1 3.34Å; R114-E121 PolarHBondContact NH1-OE1 3.48Å | ||
| 115 | P | 76.3 | Confident | 89.9 | Confident | 39 Ų | 39 | 42.4 Ų | 42.4 | 25% | 0.253 | 22% | 0.221 | S | C | . | . | S | Bend | trans | -69 | -25.6 | -174.1 | 27.3 | -35.3 | 0 | 0 | 0 | 113.8 | Y41 R43 | Y41-P115 HydrophobicContact CD1-CG 4.47Å; R43-P115 HydrophobicContact CG-CB 4.06Å; R43-P115 WeakPolarHBondContact CG-O 3.19Å; R43-P115 PolarHBondContact NE-O 2.85Å; R43-P115 PolarHBondContact NH2-O 3.01Å |
| 116 | S | 81.4 | Confident | 89.9 | Confident | 27 Ų | 27 | 42.3 Ų | 42.3 | 19% | 0.189 | 22% | 0.22 | C | C | . | . | trans | -154 | 152.6 | -176.4 | 52.5 | 0 | 0 | 0 | 0 | 109.7 | I44 R114 N284 | I44-S116 WeakPolarHBondContact CD1-OG 3.2Å; R114-S116 VanDerWaalsContact C-N 3.29Å; R114-S116 PolarHBondContact O-N 3.06Å; S116-N284 WeakPolarHBondContact CA-OD1 3.39Å; S116-N284 VanDerWaalsContact CB-CG 3.47Å; S116-N284 WeakPolarHBondContact CB-OD1 3.26Å | ||
| 117 | M | 88.1 | Confident | 90 | Very high | 2 Ų | 2 | 40.3 Ų | 40.3 | 1% | 0.01 | 21% | 0.211 | C | C | . | . | trans | -134.4 | 146.6 | 172 | -68 | -178.6 | 167.6 | 0 | 0 | 110.8 | L108 M112 R114 E121 V122 Y125 N284 | L108-M117 HydrophobicContact CB-CE 4.2Å; L108-M117 HydrophobicContact CB-SD 3.97Å; L108-M117 WeakPolarHBondContact O-CE 3.3Å; M112-M117 HydrophobicContact CB-CE 3.88Å; M112-M117 HydrophobicContact CG-CE 4.08Å; R114-M117 HydrophobicContact CB-CE 4.26Å; M117-E121 HydrophobicContact CB-CB 4.38Å; M117-V122 HydrophobicContact CB-CG2 3.52Å; M117-V122 HydrophobicContact CG-CG2 4.44Å; M117-V122 HydrophobicContact SD-CG2 4.14Å; M117-Y125 HydrophobicContact CE-CD2 3.47Å; M117-Y125 VanDerWaalsContact CE-CD2 3.47Å; M117-Y125 HydrophobicContact CE-CE2 3.79Å; M117-Y125 HydrophobicContact CE-CG 4.26Å; M117-Y125 HydrophobicContact SD-CD2 3.94Å; M117-Y125 HydrophobicContact SD-CE2 4.5Å; M117-N284 PolarHBondContact O-ND2 3.42Å | ||
| 118 | T | 91 | Very high | 90.1 | Very high | 76 Ų | 76 | 41.4 Ų | 41.4 | 47% | 0.466 | 22% | 0.217 | S | C | . | . | trans | -85.5 | 159.4 | 166.7 | 60.1 | 0 | 0 | 0 | 0 | 110.8 | G120 E121 V122 | T118-G120 VanDerWaalsContact C-N 3.31Å; T118-G120 PolarHBondContact O-N 2.96Å; T118-E121 WeakPolarHBondContact CB-OE2 3.38Å; T118-E121 PolarHBondContact N-OE2 2.9Å; T118-E121 WeakPolarHBondContact O-CB 3.45Å; T118-E121 PolarHBondContact O-N 3.38Å; T118-E121 VanDerWaalsContact OG1-CG 3.3Å; T118-E121 WeakPolarHBondContact OG1-CG 3.49Å; T118-E121 PolarHBondContact OG1-N 3.28Å; T118-E121 PolarHBondContact OG1-OE2 2.85Å; T118-V122 WeakPolarHBondContact O-CG2 3.49Å; T118-V122 PolarHBondContact O-N 2.83Å | ||
| 119 | Y | 92.9 | Very high | 89.9 | Confident | 14 Ų | 14 | 42.8 Ų | 42.8 | 6% | 0.055 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -57.9 | -42.1 | -177.3 | -167.3 | -177.3 | 0 | 0 | 0 | 112.4 | L101 E121 V122 M123 V144 I276 L415 F419 P420 L423 | L101-Y119 HydrophobicContact CD1-CD2 3.36Å; L101-Y119 HydrophobicContact CD1-CE2 3.46Å; L101-Y119 VanDerWaalsContact CD1-CE2 3.46Å; L101-Y119 HydrophobicContact CD1-CG 4.15Å; L101-Y119 HydrophobicContact CD2-CD1 3.98Å; L101-Y119 HydrophobicContact CD2-CD2 3.91Å; L101-Y119 HydrophobicContact CD2-CE1 4.04Å; L101-Y119 HydrophobicContact CD2-CE2 4Å; L101-Y119 HydrophobicContact CD2-CG 3.92Å; L101-Y119 HydrophobicContact CG-CD2 4.3Å; L101-Y119 HydrophobicContact CG-CE2 4.34Å; Y119-E121 PolarHBondContact O-N 2.97Å; Y119-V122 PolarHBondContact O-N 3.49Å; Y119-M123 PolarHBondContact O-N 3.26Å; Y119-V144 HydrophobicContact CD1-CG1 3.77Å; Y119-V144 HydrophobicContact CD2-CG1 3.93Å; Y119-V144 HydrophobicContact CE1-CG1 4.18Å; Y119-V144 HydrophobicContact CE2-CG1 4.31Å; Y119-V144 HydrophobicContact CG-CG1 3.62Å; Y119-I276 HydrophobicContact CE1-CD1 4.14Å; Y119-I276 HydrophobicContact CE1-CG1 4.32Å; Y119-I276 HydrophobicContact CE1-CG2 4.28Å; Y119-L415 HydrophobicContact CE1-CD2 4.07Å; Y119-L415 PolarHBondContact OH-O 3.34Å; Y119-L415 VanDerWaalsContact OH-O 3.07Å; Y119-F419 VanDerWaalsContact OH-CB 3.25Å; Y119-F419 WeakPolarHBondContact OH-CB 3.04Å; Y119-P420 WeakPolarHBondContact OH-CD 3.42Å; Y119-P420 WeakPolarHBondContact OH-CG 3.44Å; Y119-L423 HydrophobicContact CE2-CD2 4.15Å |
| 120 | G | 93.3 | Very high | 89.9 | Confident | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -59.8 | -41.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | T118 M123 Q124 S141 | T118-G120 VanDerWaalsContact C-N 3.31Å; T118-G120 PolarHBondContact O-N 2.96Å; G120-M123 PolarHBondContact O-N 3.38Å; G120-Q124 PolarHBondContact O-N 3.18Å; G120-S141 VanDerWaalsContact O-CA 3.29Å; G120-S141 WeakPolarHBondContact O-CA 3.45Å; G120-S141 WeakPolarHBondContact O-CB 3.29Å |
| 121 | E | 93.3 | Very high | 89.9 | Confident | 45 Ų | 45 | 44.8 Ų | 44.8 | 21% | 0.21 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -64.7 | -44.7 | 174.6 | -74.3 | 171.3 | 117.5 | 0 | 0 | 112.4 | R114 M117 T118 Y119 M123 Q124 Y125 | R114-E121 IonicContact NH1-OE1 3.34Å; R114-E121 PolarHBondContact NH1-OE1 3.48Å; M117-E121 HydrophobicContact CB-CB 4.38Å; T118-E121 WeakPolarHBondContact CB-OE2 3.38Å; T118-E121 PolarHBondContact N-OE2 2.9Å; T118-E121 WeakPolarHBondContact O-CB 3.45Å; T118-E121 PolarHBondContact O-N 3.38Å; T118-E121 VanDerWaalsContact OG1-CG 3.3Å; T118-E121 WeakPolarHBondContact OG1-CG 3.49Å; T118-E121 PolarHBondContact OG1-N 3.28Å; T118-E121 PolarHBondContact OG1-OE2 2.85Å; Y119-E121 PolarHBondContact O-N 2.97Å; E121-M123 VanDerWaalsContact C-N 3.26Å; E121-M123 PolarHBondContact O-N 3.25Å; E121-Q124 PolarHBondContact O-N 3.05Å; E121-Q124 VanDerWaalsContact O-N 3.17Å; E121-Y125 HydrophobicContact CB-CD2 4.21Å; E121-Y125 HydrophobicContact CB-CE2 4.03Å; E121-Y125 HydrophobicContact CG-CE2 4.46Å; E121-Y125 WeakPolarHBondContact O-CD2 3.01Å; E121-Y125 PolarHBondContact O-N 3.44Å |
| 122 | V | 94.9 | Very high | 89.9 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -59.3 | -41.5 | 178.4 | -171.9 | 0 | 0 | 0 | 0 | 109.9 | L101 C104 L108 M117 T118 Y119 G126 L280 L423 | L101-V122 HydrophobicContact CD1-CG1 4.45Å; C104-V122 HydrophobicContact CB-CG1 4.07Å; L108-V122 HydrophobicContact CD1-CG1 3.81Å; L108-V122 WeakPolarHBondContact CD1-O 3.46Å; M117-V122 HydrophobicContact CB-CG2 3.52Å; M117-V122 HydrophobicContact CG-CG2 4.44Å; M117-V122 HydrophobicContact SD-CG2 4.14Å; T118-V122 WeakPolarHBondContact O-CG2 3.49Å; T118-V122 PolarHBondContact O-N 2.83Å; Y119-V122 PolarHBondContact O-N 3.49Å; V122-G126 PolarHBondContact O-N 2.89Å; V122-L280 HydrophobicContact CG2-CD1 3.95Å; V122-L423 HydrophobicContact CB-CD2 4.34Å; V122-L423 HydrophobicContact CG1-CD1 4.21Å; V122-L423 HydrophobicContact CG1-CD2 3.71Å; V122-L423 HydrophobicContact CG1-CG 4.34Å; V122-L423 WeakPolarHBondContact O-CD1 3.17Å |
| 123 | M | 96.2 | Very high | 90 | Very high | 9 Ų | 9 | 47 Ų | 47 | 4% | 0.044 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -63.1 | -46.9 | 174.3 | -177.1 | 61.5 | 77.1 | 0 | 0 | 112.5 | Y119 G120 E121 Y125 G126 M127 V144 F419 L423 L426 | Y119-M123 PolarHBondContact O-N 3.26Å; G120-M123 PolarHBondContact O-N 3.38Å; E121-M123 VanDerWaalsContact C-N 3.26Å; E121-M123 PolarHBondContact O-N 3.25Å; M123-Y125 PolarHBondContact O-N 3.35Å; M123-G126 PolarHBondContact O-N 2.93Å; M123-M127 WeakPolarHBondContact O-CG 3.45Å; M123-M127 PolarHBondContact O-N 3.48Å; M123-V144 HydrophobicContact CB-CG2 3.79Å; M123-V144 HydrophobicContact CE-CG2 4.03Å; M123-V144 HydrophobicContact CG-CG2 3.79Å; M123-F419 HydrophobicContact CE-CB 3.71Å; M123-F419 HydrophobicContact CE-CD1 4.16Å; M123-F419 HydrophobicContact CE-CG 4.04Å; M123-L423 HydrophobicContact CE-CB 4.21Å; M123-L423 HydrophobicContact SD-CD1 4.3Å; M123-L426 HydrophobicContact SD-CD1 4.08Å |
| 124 | Q | 95.3 | Very high | 90.2 | Very high | 38 Ų | 38 | 48.4 Ų | 48.4 | 18% | 0.178 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -57.3 | -50.5 | 176.5 | 171.8 | 178.8 | -21.4 | 0 | 0 | 111.7 | G120 E121 G126 M127 E128 S137 | G120-Q124 PolarHBondContact O-N 3.18Å; E121-Q124 PolarHBondContact O-N 3.05Å; E121-Q124 VanDerWaalsContact O-N 3.17Å; Q124-G126 VanDerWaalsContact C-N 3.32Å; Q124-G126 PolarHBondContact O-N 3.43Å; Q124-M127 WeakPolarHBondContact O-CB 3.1Å; Q124-M127 PolarHBondContact O-N 2.89Å; Q124-M127 VanDerWaalsContact O-N 3.14Å; Q124-E128 WeakPolarHBondContact CG-OE1 3.29Å; Q124-E128 PolarHBondContact NE2-OE1 2.69Å; Q124-E128 WeakPolarHBondContact O-CG 3.48Å; Q124-E128 PolarHBondContact O-N 2.99Å; Q124-E128 VanDerWaalsContact O-N 3.1Å; Q124-S137 WeakPolarHBondContact O-CB 3.32Å |
| 125 | Y | 93.4 | Very high | 90.6 | Very high | 28 Ų | 28 | 53.9 Ų | 53.9 | 11% | 0.11 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -68.2 | -31.3 | -178.3 | -66.6 | -54.6 | 0 | 0 | 0 | 112.5 | M112 M117 E121 M123 E128 | M112-Y125 HydrophobicContact CE-CD1 3.82Å; M112-Y125 HydrophobicContact CE-CE1 3.77Å; M112-Y125 HydrophobicContact CG-CD1 4.35Å; M112-Y125 HydrophobicContact CG-CG 4.38Å; M117-Y125 HydrophobicContact CE-CD2 3.47Å; M117-Y125 VanDerWaalsContact CE-CD2 3.47Å; M117-Y125 HydrophobicContact CE-CE2 3.79Å; M117-Y125 HydrophobicContact CE-CG 4.26Å; M117-Y125 HydrophobicContact SD-CD2 3.94Å; M117-Y125 HydrophobicContact SD-CE2 4.5Å; E121-Y125 HydrophobicContact CB-CD2 4.21Å; E121-Y125 HydrophobicContact CB-CE2 4.03Å; E121-Y125 HydrophobicContact CG-CE2 4.46Å; E121-Y125 WeakPolarHBondContact O-CD2 3.01Å; E121-Y125 PolarHBondContact O-N 3.44Å; M123-Y125 PolarHBondContact O-N 3.35Å; Y125-E128 WeakPolarHBondContact CD1-OE2 3.47Å; Y125-E128 PolarHBondContact O-N 2.96Å |
| 126 | G | 93.4 | Very high | 91.3 | Very high | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -59.9 | -45.9 | 168.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | V122 M123 Q124 E128 N129 | V122-G126 PolarHBondContact O-N 2.89Å; M123-G126 PolarHBondContact O-N 2.93Å; Q124-G126 VanDerWaalsContact C-N 3.32Å; Q124-G126 PolarHBondContact O-N 3.43Å; G126-E128 VanDerWaalsContact C-N 3.26Å; G126-E128 PolarHBondContact O-N 3.33Å; G126-N129 PolarHBondContact O-N 2.95Å |
| 127 | M | 94.4 | Very high | 91.8 | Very high | 24 Ų | 24 | 55.3 Ų | 55.3 | 12% | 0.118 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.6 | -28.1 | 176 | -66.7 | -175.9 | 74.6 | 0 | 0 | 113.5 | M123 Q124 N129 V130 L133 R134 G140 L426 | M123-M127 WeakPolarHBondContact O-CG 3.45Å; M123-M127 PolarHBondContact O-N 3.48Å; Q124-M127 WeakPolarHBondContact O-CB 3.1Å; Q124-M127 PolarHBondContact O-N 2.89Å; Q124-M127 VanDerWaalsContact O-N 3.14Å; M127-N129 VanDerWaalsContact C-N 3.28Å; M127-N129 PolarHBondContact O-N 3.43Å; M127-V130 PolarHBondContact O-N 2.95Å; M127-L133 HydrophobicContact CB-CB 4.21Å; M127-L133 HydrophobicContact CB-CD2 4.2Å; M127-L133 HydrophobicContact CE-CB 4.2Å; M127-L133 HydrophobicContact CE-CD2 3.82Å; M127-L133 HydrophobicContact CE-CG 3.62Å; M127-L133 HydrophobicContact CG-CD2 3.95Å; M127-L133 WeakPolarHBondContact O-CB 3.29Å; M127-R134 PolarHBondContact O-N 3.01Å; M127-G140 WeakPolarHBondContact SD-CA 3.36Å; M127-G140 PolarHBondContact SD-N 3.17Å; M127-L426 HydrophobicContact CG-CD1 3.92Å |
| 128 | E | 92.7 | Very high | 92 | Very high | 58 Ų | 58 | 63.8 Ų | 63.8 | 27% | 0.271 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -70.7 | -20.8 | 179.7 | -71.5 | 173.9 | -167.6 | 0 | 0 | 113.6 | Q124 Y125 G126 V130 R134 S137 | Q124-E128 WeakPolarHBondContact CG-OE1 3.29Å; Q124-E128 PolarHBondContact NE2-OE1 2.69Å; Q124-E128 WeakPolarHBondContact O-CG 3.48Å; Q124-E128 PolarHBondContact O-N 2.99Å; Q124-E128 VanDerWaalsContact O-N 3.1Å; Y125-E128 WeakPolarHBondContact CD1-OE2 3.47Å; Y125-E128 PolarHBondContact O-N 2.96Å; G126-E128 VanDerWaalsContact C-N 3.26Å; G126-E128 PolarHBondContact O-N 3.33Å; E128-V130 VanDerWaalsContact C-N 3.27Å; E128-V130 PolarHBondContact O-N 3.42Å; E128-R134 HydrophobicContact CB-CG 4.42Å; E128-R134 HydrophobicContact CG-CG 4.4Å; E128-S137 WeakPolarHBondContact CG-OG 3.3Å; E128-S137 WeakPolarHBondContact OE1-CB 3.4Å; E128-S137 PolarHBondContact OE1-OG 3.42Å |
| 129 | N | 89.8 | Confident | 92.2 | Very high | 29 Ų | 29 | 67.5 Ų | 67.5 | 16% | 0.155 | 29% | 0.29 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.4 | -19.4 | 173.5 | -72.9 | -25.8 | 0 | 0 | 0 | 113.7 | K111 G126 M127 A427 T430 | K111-N129 PolarHBondContact NZ-OD1 2.98Å; G126-N129 PolarHBondContact O-N 2.95Å; M127-N129 VanDerWaalsContact C-N 3.28Å; M127-N129 PolarHBondContact O-N 3.43Å; N129-A427 PolarHBondContact ND2-O 3.01Å; N129-T430 HydrophobicContact CB-CG2 4.47Å |
| 130 | V | 89.6 | Confident | 92.2 | Very high | 19 Ų | 19 | 67.2 Ų | 67.2 | 12% | 0.115 | 29% | 0.291 | C | S | . | . | S | Bend | trans | -103.8 | 119.6 | -178.4 | 175.9 | 0 | 0 | 0 | 0 | 109.5 | M127 E128 W132 L133 R134 L426 H429 | M127-V130 PolarHBondContact O-N 2.95Å; E128-V130 VanDerWaalsContact C-N 3.27Å; E128-V130 PolarHBondContact O-N 3.42Å; V130-W132 PolarHBondContact O-N 3.08Å; V130-L133 HydrophobicContact CB-CB 3.98Å; V130-L133 HydrophobicContact CB-CD2 4.48Å; V130-L133 HydrophobicContact CG1-CB 4.12Å; V130-L133 HydrophobicContact CG1-CD1 4.41Å; V130-L133 PolarHBondContact O-N 2.9Å; V130-R134 PolarHBondContact O-N 3.43Å; V130-L426 HydrophobicContact CG2-CD2 3.77Å; V130-H429 HydrophobicContact CG2-CB 3.99Å |
| 131 | S | 87.9 | Confident | 92.2 | Very high | 106 Ų | 106 | 68.1 Ų | 68.1 | 74% | 0.741 | 30% | 0.297 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.3 | -42.9 | -168.6 | 57.4 | 0 | 0 | 0 | 0 | 114.7 | ||
| 132 | W | 89.3 | Confident | 92.3 | Very high | 197 Ų | 197 | 73.5 Ų | 73.5 | 75% | 0.746 | 32% | 0.316 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.9 | -38.7 | 176.6 | 155.9 | 59.6 | 0 | 0 | 0 | 113 | V130 | V130-W132 PolarHBondContact O-N 3.08Š|
| 133 | L | 89.9 | Confident | 92.3 | Very high | 23 Ų | 23 | 75.8 Ų | 75.8 | 12% | 0.12 | 33% | 0.33 | C | S | . | . | G | 310 helix | trans | -74.2 | -26.5 | 179.2 | -103.6 | 61.2 | 0 | 0 | 0 | 113.1 | M127 V130 R135 H136 S137 L426 | M127-L133 HydrophobicContact CB-CB 4.21Å; M127-L133 HydrophobicContact CB-CD2 4.2Å; M127-L133 HydrophobicContact CE-CB 4.2Å; M127-L133 HydrophobicContact CE-CD2 3.82Å; M127-L133 HydrophobicContact CE-CG 3.62Å; M127-L133 HydrophobicContact CG-CD2 3.95Å; M127-L133 WeakPolarHBondContact O-CB 3.29Å; V130-L133 HydrophobicContact CB-CB 3.98Å; V130-L133 HydrophobicContact CB-CD2 4.48Å; V130-L133 HydrophobicContact CG1-CB 4.12Å; V130-L133 HydrophobicContact CG1-CD1 4.41Å; V130-L133 PolarHBondContact O-N 2.9Å; L133-R135 PolarHBondContact O-N 2.95Å; L133-R135 VanDerWaalsContact O-N 3.1Å; L133-H136 CarbonylContact O-C 3.55Å; L133-H136 WeakPolarHBondContact O-CA 3.48Å; L133-H136 PolarHBondContact O-N 3.23Å; L133-S137 PolarHBondContact O-N 3.35Å; L133-S137 VanDerWaalsContact O-N 3.08Å; L133-L426 HydrophobicContact CD2-CD1 4.29Å; L133-L426 HydrophobicContact CD2-CD2 3.54Å |
| 134 | R | 88.9 | Confident | 92.2 | Very high | 169 Ų | 169 | 75.4 Ų | 75.4 | 64% | 0.638 | 33% | 0.328 | S | S | * | . | G | 310 helix | trans | -51.9 | -36.5 | -176.1 | -170.6 | 177.9 | 68.6 | 176.8 | 2.1 | 113.8 | M127 E128 V130 H136 | M127-R134 PolarHBondContact O-N 3.01Å; E128-R134 HydrophobicContact CB-CG 4.42Å; E128-R134 HydrophobicContact CG-CG 4.4Å; V130-R134 PolarHBondContact O-N 3.43Å; R134-H136 PolarHBondContact O-N 3.07Å |
| 135 | R | 90.5 | Very high | 92.2 | Very high | 229 Ų | 229 | 75 Ų | 75 | 86% | 0.864 | 33% | 0.327 | S | S | * | . | G | 310 helix | trans | -67.9 | -23.4 | 176.4 | -171.5 | 173.1 | -177.6 | 175 | 0.9 | 113.1 | L133 | L133-R135 PolarHBondContact O-N 2.95Å; L133-R135 VanDerWaalsContact O-N 3.1Å |
| 136 | H | 91.8 | Very high | 92.3 | Very high | 89 Ų | 89 | 78.2 Ų | 78.2 | 41% | 0.412 | 35% | 0.346 | S | S | . | . | G | 310 helix | trans | -111.7 | 8.8 | -175.6 | -59.6 | 100.3 | 0 | 0 | 0 | 113.2 | L133 R134 R138 W139 | L133-H136 CarbonylContact O-C 3.55Å; L133-H136 WeakPolarHBondContact O-CA 3.48Å; L133-H136 PolarHBondContact O-N 3.23Å; R134-H136 PolarHBondContact O-N 3.07Å; H136-R138 PolarHBondContact O-N 2.97Å; H136-R138 VanDerWaalsContact O-N 3.08Å; H136-W139 VanDerWaalsContact O-CB 3.29Å; H136-W139 WeakPolarHBondContact O-CB 3.38Å; H136-W139 PolarHBondContact O-N 2.95Å |
| 137 | S | 91.9 | Very high | 92.4 | Very high | 7 Ų | 7 | 79.8 Ų | 79.8 | 5% | 0.049 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -53.4 | -37.1 | -172.8 | 68 | 0 | 0 | 0 | 0 | 114.5 | Q124 E128 L133 W139 G140 | Q124-S137 WeakPolarHBondContact O-CB 3.32Å; E128-S137 WeakPolarHBondContact CG-OG 3.3Å; E128-S137 WeakPolarHBondContact OE1-CB 3.4Å; E128-S137 PolarHBondContact OE1-OG 3.42Å; L133-S137 PolarHBondContact O-N 3.35Å; L133-S137 VanDerWaalsContact O-N 3.08Å; S137-W139 PolarHBondContact O-N 3.42Å; S137-G140 PolarHBondContact O-N 3.42Å |
| 138 | R | 92.3 | Very high | 92.4 | Very high | 179 Ų | 179 | 79.3 Ų | 79.3 | 68% | 0.675 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -59.3 | -26.3 | 175.7 | -63.1 | -177.7 | -176.6 | 176 | 0.3 | 113.5 | H136 R142 | H136-R138 PolarHBondContact O-N 2.97Å; H136-R138 VanDerWaalsContact O-N 3.08Å; R138-R142 WeakPolarHBondContact O-CG 3.35Å; R138-R142 PolarHBondContact O-N 2.83Å |
| 139 | W | 93.5 | Very high | 92.5 | Very high | 155 Ų | 155 | 77.7 Ų | 77.7 | 59% | 0.587 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -66.9 | -36.3 | 173.3 | -78.9 | 92.2 | 0 | 0 | 0 | 111.7 | H136 S137 S141 R142 T143 | H136-W139 VanDerWaalsContact O-CB 3.29Å; H136-W139 WeakPolarHBondContact O-CB 3.38Å; H136-W139 PolarHBondContact O-N 2.95Å; S137-W139 PolarHBondContact O-N 3.42Å; W139-S141 PolarHBondContact O-N 3.06Å; W139-R142 PolarHBondContact O-N 2.82Å; W139-T143 WeakPolarHBondContact O-CB 3.43Å; W139-T143 PolarHBondContact O-N 3.05Å; W139-T143 PolarHBondContact O-OG1 3.01Å |
| 140 | G | 93.4 | Very high | 92.7 | Very high | 7 Ų | 7 | 79.6 Ų | 79.6 | 7% | 0.072 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -58.9 | -47.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113 | M127 S137 T143 V144 | M127-G140 WeakPolarHBondContact SD-CA 3.36Å; M127-G140 PolarHBondContact SD-N 3.17Å; S137-G140 PolarHBondContact O-N 3.42Å; G140-T143 PolarHBondContact O-N 2.85Å; G140-V144 WeakPolarHBondContact O-CG2 3.39Å; G140-V144 PolarHBondContact O-N 2.89Å |
| 141 | S | 94.1 | Very high | 93 | Very high | 20 Ų | 20 | 78.7 Ų | 78.7 | 14% | 0.14 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -60.5 | -46.4 | 174.6 | 179.4 | 0 | 0 | 0 | 0 | 111.8 | G120 W139 T143 V144 N145 | G120-S141 VanDerWaalsContact O-CA 3.29Å; G120-S141 WeakPolarHBondContact O-CA 3.45Å; G120-S141 WeakPolarHBondContact O-CB 3.29Å; W139-S141 PolarHBondContact O-N 3.06Å; S141-T143 PolarHBondContact O-N 2.79Å; S141-V144 PolarHBondContact O-N 2.89Å; S141-N145 VanDerWaalsContact O-CB 3.26Å; S141-N145 WeakPolarHBondContact O-CB 3.48Å; S141-N145 PolarHBondContact O-N 3.22Å; S141-N145 PolarHBondContact O-ND2 3.49Å; S141-N145 PolarHBondContact OG-ND2 3Å |
| 142 | R | 94 | Very high | 93.3 | Very high | 157 Ų | 157 | 74.1 Ų | 74.1 | 59% | 0.592 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -60.1 | -43.5 | 176.8 | -72.8 | 173.7 | 176.9 | 179.6 | -4 | 112.5 | R138 W139 N145 L146 | R138-R142 WeakPolarHBondContact O-CG 3.35Å; R138-R142 PolarHBondContact O-N 2.83Å; W139-R142 PolarHBondContact O-N 2.82Å; R142-N145 PolarHBondContact O-N 3Å; R142-L146 VanDerWaalsContact O-CB 3.27Å; R142-L146 WeakPolarHBondContact O-CB 3.33Å; R142-L146 PolarHBondContact O-N 3.09Å |
| 143 | T | 95.4 | Very high | 93.5 | Very high | 49 Ų | 49 | 66 Ų | 66 | 30% | 0.301 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -64.6 | -50.2 | 178.7 | -62 | 0 | 0 | 0 | 0 | 111.1 | W139 G140 S141 N145 L146 F147 F419 | W139-T143 WeakPolarHBondContact O-CB 3.43Å; W139-T143 PolarHBondContact O-N 3.05Å; W139-T143 PolarHBondContact O-OG1 3.01Å; G140-T143 PolarHBondContact O-N 2.85Å; S141-T143 PolarHBondContact O-N 2.79Å; T143-N145 VanDerWaalsContact C-N 3.33Å; T143-N145 PolarHBondContact O-N 2.95Å; T143-L146 PolarHBondContact O-N 3.42Å; T143-F147 HydrophobicContact CG2-CD2 3.91Å; T143-F147 HydrophobicContact CG2-CE2 4.04Å; T143-F147 WeakPolarHBondContact O-CD2 3.31Å; T143-F147 PolarHBondContact O-N 3.21Å; T143-F419 HydrophobicContact CG2-CE1 4.21Å; T143-F419 HydrophobicContact CG2-CZ 3.69Å |
| 144 | V | 95.4 | Very high | 93.8 | Very high | 1 Ų | 1 | 65.2 Ų | 65.2 | 1% | 0.006 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.4 | -43.2 | 177.6 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | Y119 M123 G140 S141 F147 L148 L415 F419 | Y119-V144 HydrophobicContact CD1-CG1 3.77Å; Y119-V144 HydrophobicContact CD2-CG1 3.93Å; Y119-V144 HydrophobicContact CE1-CG1 4.18Å; Y119-V144 HydrophobicContact CE2-CG1 4.31Å; Y119-V144 HydrophobicContact CG-CG1 3.62Å; M123-V144 HydrophobicContact CB-CG2 3.79Å; M123-V144 HydrophobicContact CE-CG2 4.03Å; M123-V144 HydrophobicContact CG-CG2 3.79Å; G140-V144 WeakPolarHBondContact O-CG2 3.39Å; G140-V144 PolarHBondContact O-N 2.89Å; S141-V144 PolarHBondContact O-N 2.89Å; V144-F147 PolarHBondContact O-N 3.35Å; V144-L148 HydrophobicContact CG1-CD1 4.06Å; V144-L148 WeakPolarHBondContact O-CB 3.35Å; V144-L148 WeakPolarHBondContact O-CG 3.41Å; V144-L148 PolarHBondContact O-N 3.49Å; V144-L415 HydrophobicContact CG1-CD2 4.48Å; V144-F419 HydrophobicContact CG2-CD2 3.87Å; V144-F419 HydrophobicContact CG2-CE2 4.14Å; V144-F419 HydrophobicContact CG2-CG 4.3Å |
| 145 | N | 94.3 | Very high | 94.1 | Very high | 30 Ų | 30 | 57.9 Ų | 57.9 | 16% | 0.16 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -66.5 | -36.3 | 178 | -69.9 | -15.9 | 0 | 0 | 0 | 112.8 | S141 R142 T143 L148 I149 I361 | S141-N145 VanDerWaalsContact O-CB 3.26Å; S141-N145 WeakPolarHBondContact O-CB 3.48Å; S141-N145 PolarHBondContact O-N 3.22Å; S141-N145 PolarHBondContact O-ND2 3.49Å; S141-N145 PolarHBondContact OG-ND2 3Å; R142-N145 PolarHBondContact O-N 3Å; T143-N145 VanDerWaalsContact C-N 3.33Å; T143-N145 PolarHBondContact O-N 2.95Å; N145-L148 PolarHBondContact O-N 2.87Å; N145-I149 VanDerWaalsContact O-CG1 3.32Å; N145-I149 WeakPolarHBondContact O-CG1 3.17Å; N145-I149 PolarHBondContact O-N 2.98Å; N145-I361 HydrophobicContact CB-CG2 3.93Å |
| 146 | L | 95.5 | Very high | 94.3 | Very high | 94 Ų | 94 | 47 Ų | 47 | 49% | 0.492 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -63.6 | -48.2 | 173.4 | 176 | 63.6 | 0 | 0 | 0 | 111.2 | R142 T143 L148 I149 I150 | R142-L146 VanDerWaalsContact O-CB 3.27Å; R142-L146 WeakPolarHBondContact O-CB 3.33Å; R142-L146 PolarHBondContact O-N 3.09Å; T143-L146 PolarHBondContact O-N 3.42Å; L146-L148 VanDerWaalsContact C-N 3.33Å; L146-L148 PolarHBondContact O-N 2.97Å; L146-I149 PolarHBondContact O-N 2.95Å; L146-I150 HydrophobicContact CD1-CD1 4.02Å; L146-I150 HydrophobicContact CD1-CG1 4.32Å; L146-I150 HydrophobicContact CG-CD1 3.9Å; L146-I150 VanDerWaalsContact O-CG1 3.31Å; L146-I150 WeakPolarHBondContact O-CG1 3.47Å; L146-I150 PolarHBondContact O-N 2.88Å |
| 147 | F | 96 | Very high | 94.5 | Very high | 34 Ų | 34 | 43 Ų | 43 | 15% | 0.149 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -63.6 | -38.2 | 177.1 | -89.1 | -88.7 | 0 | 0 | 0 | 112.1 | T143 V144 I150 T151 F414 L415 F419 | T143-F147 HydrophobicContact CG2-CD2 3.91Å; T143-F147 HydrophobicContact CG2-CE2 4.04Å; T143-F147 WeakPolarHBondContact O-CD2 3.31Å; T143-F147 PolarHBondContact O-N 3.21Å; V144-F147 PolarHBondContact O-N 3.35Å; F147-I150 PolarHBondContact O-N 3.4Å; F147-T151 PolarHBondContact O-N 2.91Å; F147-T151 PolarHBondContact O-OG1 3.31Å; F147-F414 HydrophobicContact CD1-CB 3.55Å; F147-F414 HydrophobicContact CD1-CD2 4.37Å; F147-F414 HydrophobicContact CD1-CG 4Å; F147-F414 HydrophobicContact CE1-CB 3.51Å; F147-F414 HydrophobicContact CE1-CD1 4.05Å; F147-F414 AromaticContact CE1-CD2 3.48Å; F147-F414 HydrophobicContact CE1-CD2 3.48Å; F147-F414 VanDerWaalsContact CE1-CD2 3.48Å; F147-F414 HydrophobicContact CE1-CE2 4.15Å; F147-F414 AromaticContact CE1-CG 3.4Å; F147-F414 HydrophobicContact CE1-CG 3.4Å; F147-F414 HydrophobicContact CE2-CD1 4.31Å; F147-F414 HydrophobicContact CE2-CG 4.44Å; F147-F414 HydrophobicContact CG-CB 4.2Å; F147-F414 HydrophobicContact CZ-CB 4.12Å; F147-F414 AromaticContact CZ-CD1 3.8Å; F147-F414 HydrophobicContact CZ-CD1 3.8Å; F147-F414 AromaticContact CZ-CD2 3.86Å; F147-F414 HydrophobicContact CZ-CD2 3.86Å; F147-F414 HydrophobicContact CZ-CE1 4.12Å; F147-F414 HydrophobicContact CZ-CE2 4.16Å; F147-F414 AromaticContact CZ-CG 3.65Å; F147-F414 HydrophobicContact CZ-CG 3.65Å; F147-F414 HydrophobicContact CZ-CZ 4.28Å; F147-L415 HydrophobicContact CB-CD2 3.87Å; F147-L415 HydrophobicContact CB-CG 4.11Å; F147-F419 HydrophobicContact CB-CE2 3.97Å; F147-F419 AromaticContact CD2-CE2 3.93Å; F147-F419 HydrophobicContact CD2-CE2 3.93Å; F147-F419 AromaticContact CD2-CZ 3.72Å; F147-F419 HydrophobicContact CD2-CZ 3.72Å; F147-F419 HydrophobicContact CE2-CZ 4.02Å; F147-F419 AromaticContact CG-CE2 3.91Å; F147-F419 HydrophobicContact CG-CE2 3.91Å; F147-F419 HydrophobicContact CG-CZ 4.13Å |
| 148 | L | 94.4 | Very high | 94.7 | Very high | 13 Ų | 13 | 42.7 Ų | 42.7 | 7% | 0.068 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -57.9 | -52.3 | 169.3 | -76.1 | 167.5 | 0 | 0 | 0 | 110.7 | V144 N145 L146 I150 T151 Q152 I361 L415 | V144-L148 HydrophobicContact CG1-CD1 4.06Å; V144-L148 WeakPolarHBondContact O-CB 3.35Å; V144-L148 WeakPolarHBondContact O-CG 3.41Å; V144-L148 PolarHBondContact O-N 3.49Å; N145-L148 PolarHBondContact O-N 2.87Å; L146-L148 VanDerWaalsContact C-N 3.33Å; L146-L148 PolarHBondContact O-N 2.97Å; L148-I150 VanDerWaalsContact C-N 3.33Å; L148-I150 PolarHBondContact O-N 3.4Å; L148-T151 PolarHBondContact O-N 3.5Å; L148-Q152 WeakPolarHBondContact O-CG 3.44Å; L148-Q152 PolarHBondContact O-N 2.87Å; L148-I361 HydrophobicContact CB-CD1 4.21Å; L148-I361 HydrophobicContact CD1-CD1 4.48Å; L148-L415 HydrophobicContact CD2-CD1 3.97Å; L148-L415 HydrophobicContact CD2-CD2 4.12Å; L148-L415 HydrophobicContact CG-CD1 4.38Å; L148-L415 HydrophobicContact CG-CD2 3.95Å |
| 149 | I | 94.3 | Very high | 94.9 | Very high | 24 Ų | 24 | 34.6 Ų | 34.6 | 12% | 0.123 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -56.5 | -46 | 178.6 | -71.3 | 162.8 | 0 | 0 | 0 | 111.5 | N145 L146 Q152 I153 P358 I361 L362 | N145-I149 VanDerWaalsContact O-CG1 3.32Å; N145-I149 WeakPolarHBondContact O-CG1 3.17Å; N145-I149 PolarHBondContact O-N 2.98Å; L146-I149 PolarHBondContact O-N 2.95Å; I149-Q152 PolarHBondContact O-N 3.38Å; I149-I153 HydrophobicContact CG2-CD1 3.64Å; I149-I153 HydrophobicContact CG2-CG1 4.32Å; I149-I153 WeakPolarHBondContact O-CB 3.25Å; I149-I153 WeakPolarHBondContact O-CG1 3.34Å; I149-I153 PolarHBondContact O-N 3.2Å; I149-P358 HydrophobicContact CB-CB 4.34Å; I149-P358 HydrophobicContact CG1-CB 4.03Å; I149-P358 HydrophobicContact CG2-CB 4.13Å; I149-I361 HydrophobicContact CD1-CB 4.21Å; I149-I361 HydrophobicContact CD1-CG2 3.68Å; I149-I361 HydrophobicContact CG1-CB 4.25Å; I149-I361 HydrophobicContact CG1-CD1 4.45Å; I149-I361 HydrophobicContact CG1-CG2 4.1Å; I149-L362 HydrophobicContact CD1-CB 4.32Å |
| 150 | I | 95.3 | Very high | 95.1 | Very high | 69 Ų | 69 | 27.2 Ų | 27.2 | 35% | 0.354 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -60.8 | -47.6 | 179.4 | -67.1 | 166.3 | 0 | 0 | 0 | 111 | L146 F147 L148 Q152 I153 G154 | L146-I150 HydrophobicContact CD1-CD1 4.02Å; L146-I150 HydrophobicContact CD1-CG1 4.32Å; L146-I150 HydrophobicContact CG-CD1 3.9Å; L146-I150 VanDerWaalsContact O-CG1 3.31Å; L146-I150 WeakPolarHBondContact O-CG1 3.47Å; L146-I150 PolarHBondContact O-N 2.88Å; F147-I150 PolarHBondContact O-N 3.4Å; L148-I150 VanDerWaalsContact C-N 3.33Å; L148-I150 PolarHBondContact O-N 3.4Å; I150-Q152 VanDerWaalsContact C-N 3.33Å; I150-Q152 PolarHBondContact O-N 3.47Å; I150-I153 PolarHBondContact O-N 2.84Å; I150-G154 PolarHBondContact O-N 3.32Å |
| 151 | T | 94.4 | Very high | 95.2 | Very high | 1 Ų | 1 | 26.9 Ų | 26.9 | 1% | 0.006 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -59.3 | -44.3 | 177.4 | -60.9 | 0 | 0 | 0 | 0 | 111.6 | F147 L148 G154 F155 E274 S411 L415 | F147-T151 PolarHBondContact O-N 2.91Å; F147-T151 PolarHBondContact O-OG1 3.31Å; L148-T151 PolarHBondContact O-N 3.5Å; T151-G154 WeakPolarHBondContact O-CA 3.42Å; T151-G154 PolarHBondContact O-N 2.88Å; T151-F155 HydrophobicContact CG2-CD1 4.1Å; T151-F155 HydrophobicContact CG2-CE1 3.48Å; T151-F155 VanDerWaalsContact CG2-CE1 3.48Å; T151-F155 HydrophobicContact CG2-CE2 4.17Å; T151-F155 HydrophobicContact CG2-CZ 3.52Å; T151-F155 WeakPolarHBondContact O-CD1 3.3Å; T151-F155 WeakPolarHBondContact O-CG 3.47Å; T151-F155 PolarHBondContact O-N 3.13Å; T151-E274 HydrophobicContact CG2-CG 3.89Å; T151-S411 VanDerWaalsContact CA-OG 3.29Å; T151-S411 WeakPolarHBondContact CA-OG 3.4Å; T151-S411 WeakPolarHBondContact OG1-CB 3.41Å; T151-S411 PolarHBondContact OG1-OG 3.05Å; T151-L415 HydrophobicContact CG2-CD1 4.33Å; T151-L415 VanDerWaalsContact OG1-CD1 3.22Å; T151-L415 WeakPolarHBondContact OG1-CD1 3.48Å |
| 152 | Q | 94.1 | Very high | 95.3 | Very high | 9 Ų | 9 | 26 Ų | 26 | 4% | 0.042 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -68.9 | -41.6 | -177.8 | -61.1 | -68.2 | 2.5 | 0 | 0 | 112.4 | L148 I149 I150 G154 F155 C156 Q354 V357 P358 | L148-Q152 WeakPolarHBondContact O-CG 3.44Å; L148-Q152 PolarHBondContact O-N 2.87Å; I149-Q152 PolarHBondContact O-N 3.38Å; I150-Q152 VanDerWaalsContact C-N 3.33Å; I150-Q152 PolarHBondContact O-N 3.47Å; Q152-G154 VanDerWaalsContact C-N 3.31Å; Q152-F155 PolarHBondContact O-N 3.21Å; Q152-C156 PolarHBondContact O-N 3.37Å; Q152-Q354 VanDerWaalsContact OE1-CD 3.28Å; Q152-V357 HydrophobicContact CG-CB 4.03Å; Q152-V357 HydrophobicContact CG-CG1 3.99Å; Q152-P358 HydrophobicContact CB-CB 4.28Å; Q152-P358 HydrophobicContact CB-CG 3.74Å |
| 153 | I | 94.6 | Very high | 95.4 | Very high | 28 Ų | 28 | 18.6 Ų | 18.6 | 14% | 0.144 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -59.4 | -44.2 | 170.2 | -74.8 | 176.5 | 0 | 0 | 0 | 109.8 | I149 I150 F155 C156 C157 L386 T390 L393 | I149-I153 HydrophobicContact CG2-CD1 3.64Å; I149-I153 HydrophobicContact CG2-CG1 4.32Å; I149-I153 WeakPolarHBondContact O-CB 3.25Å; I149-I153 WeakPolarHBondContact O-CG1 3.34Å; I149-I153 PolarHBondContact O-N 3.2Å; I150-I153 PolarHBondContact O-N 2.84Å; I153-F155 PolarHBondContact O-N 2.86Å; I153-C156 WeakPolarHBondContact O-CB 3.37Å; I153-C156 PolarHBondContact O-N 3.35Å; I153-C157 PolarHBondContact O-N 3.16Å; I153-C157 PolarHBondContact O-SG 2.79Å; I153-L386 HydrophobicContact CD1-CD2 4.24Å; I153-T390 HydrophobicContact CB-CG2 4.18Å; I153-T390 HydrophobicContact CG1-CG2 4.27Å; I153-T390 HydrophobicContact CG2-CG2 3.74Å; I153-L393 HydrophobicContact CG2-CD1 3.9Å |
| 154 | G | 95.6 | Very high | 95.4 | Very high | 6 Ų | 6 | 16.3 Ų | 16.3 | 6% | 0.062 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -57.6 | -44.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | I150 T151 Q152 C156 C157 V158 | I150-G154 PolarHBondContact O-N 3.32Å; T151-G154 WeakPolarHBondContact O-CA 3.42Å; T151-G154 PolarHBondContact O-N 2.88Å; Q152-G154 VanDerWaalsContact C-N 3.31Å; G154-C156 PolarHBondContact O-N 3.26Å; G154-C157 WeakPolarHBondContact O-CB 3.3Å; G154-C157 PolarHBondContact O-N 3.08Å; G154-C157 VanDerWaalsContact O-N 3.13Å; G154-V158 WeakPolarHBondContact O-CG2 3.39Å; G154-V158 PolarHBondContact O-N 3.25Å |
| 155 | F | 94.9 | Very high | 95.3 | Very high | 15 Ų | 15 | 17.5 Ų | 17.5 | 7% | 0.066 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -63.8 | -42 | 176.2 | -67.8 | 6.1 | 0 | 0 | 0 | 111.5 | T151 Q152 I153 C157 V158 Y159 F271 E274 Q354 V407 | T151-F155 HydrophobicContact CG2-CD1 4.1Å; T151-F155 HydrophobicContact CG2-CE1 3.48Å; T151-F155 VanDerWaalsContact CG2-CE1 3.48Å; T151-F155 HydrophobicContact CG2-CE2 4.17Å; T151-F155 HydrophobicContact CG2-CZ 3.52Å; T151-F155 WeakPolarHBondContact O-CD1 3.3Å; T151-F155 WeakPolarHBondContact O-CG 3.47Å; T151-F155 PolarHBondContact O-N 3.13Å; Q152-F155 PolarHBondContact O-N 3.21Å; I153-F155 PolarHBondContact O-N 2.86Å; F155-C157 VanDerWaalsContact C-N 3.29Å; F155-C157 PolarHBondContact O-N 3.46Å; F155-V158 PolarHBondContact O-N 2.85Å; F155-Y159 WeakPolarHBondContact O-CD1 3.4Å; F155-Y159 PolarHBondContact O-N 2.99Å; F155-F271 HydrophobicContact CD1-CD2 4.09Å; F155-F271 HydrophobicContact CD1-CE1 4.48Å; F155-F271 AromaticContact CD1-CE2 3.3Å; F155-F271 HydrophobicContact CD1-CE2 3.3Å; F155-F271 AromaticContact CD1-CZ 3.53Å; F155-F271 HydrophobicContact CD1-CZ 3.53Å; F155-F271 AromaticContact CE1-CD2 3.71Å; F155-F271 HydrophobicContact CE1-CD2 3.71Å; F155-F271 HydrophobicContact CE1-CE1 4.39Å; F155-F271 AromaticContact CE1-CE2 3.41Å; F155-F271 HydrophobicContact CE1-CE2 3.41Å; F155-F271 VanDerWaalsContact CE1-CE2 3.41Å; F155-F271 HydrophobicContact CE1-CG 4.33Å; F155-F271 AromaticContact CE1-CZ 3.77Å; F155-F271 HydrophobicContact CE1-CZ 3.77Å; F155-F271 HydrophobicContact CG-CE2 4.4Å; F155-F271 HydrophobicContact CG-CZ 4.26Å; F155-E274 HydrophobicContact CZ-CB 3.99Å; F155-E274 HydrophobicContact CZ-CG 3.68Å; F155-Q354 HydrophobicContact CB-CG 3.91Å; F155-Q354 HydrophobicContact CD2-CG 3.84Å; F155-Q354 HydrophobicContact CG-CG 4.4Å; F155-V407 HydrophobicContact CD1-CG1 4.02Å; F155-V407 HydrophobicContact CE1-CG1 4.05Å |
| 156 | C | 95.7 | Very high | 95.3 | Very high | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -60 | -36.6 | 172 | -75.8 | 0 | 0 | 0 | 0 | 112.6 | Q152 I153 G154 Y159 F160 F351 T390 | Q152-C156 PolarHBondContact O-N 3.37Å; I153-C156 WeakPolarHBondContact O-CB 3.37Å; I153-C156 PolarHBondContact O-N 3.35Å; G154-C156 PolarHBondContact O-N 3.26Å; C156-Y159 PolarHBondContact O-N 3.08Å; C156-F160 WeakPolarHBondContact O-CD2 3.45Å; C156-F160 PolarHBondContact O-N 3.43Å; C156-F160 VanDerWaalsContact O-N 3.16Å; C156-F351 HydrophobicContact CB-CD2 4.04Å; C156-F351 HydrophobicContact CB-CE2 3.49Å; C156-F351 VanDerWaalsContact CB-CE2 3.49Å; C156-F351 HydrophobicContact CB-CZ 3.98Å; C156-T390 HydrophobicContact CB-CG2 3.69Å |
| 157 | C | 96.1 | Very high | 95.3 | Very high | 5 Ų | 5 | 13.1 Ų | 13.1 | 3% | 0.034 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -64.9 | -46.7 | 174 | -58.1 | 0 | 0 | 0 | 0 | 111.4 | I153 G154 F155 Y159 F160 V161 T390 A394 V403 | I153-C157 PolarHBondContact O-N 3.16Å; I153-C157 PolarHBondContact O-SG 2.79Å; G154-C157 WeakPolarHBondContact O-CB 3.3Å; G154-C157 PolarHBondContact O-N 3.08Å; G154-C157 VanDerWaalsContact O-N 3.13Å; F155-C157 VanDerWaalsContact C-N 3.29Å; F155-C157 PolarHBondContact O-N 3.46Å; C157-Y159 PolarHBondContact O-N 3Å; C157-F160 WeakPolarHBondContact O-CB 3.32Å; C157-F160 PolarHBondContact O-N 3.2Å; C157-F160 VanDerWaalsContact O-N 3.11Å; C157-V161 PolarHBondContact O-N 2.83Å; C157-V161 VanDerWaalsContact O-N 3.15Å; C157-T390 PolarHBondContact SG-O 2.81Å; C157-A394 HydrophobicContact CB-CB 4.39Å; C157-V403 HydrophobicContact CB-CG1 4.26Å |
| 158 | V | 96.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 13.9 Ų | 13.9 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -56.7 | -37.7 | 174.9 | 172 | 0 | 0 | 0 | 0 | 111.3 | T66 G154 F155 V161 F162 F271 L400 V403 I404 | T66-V158 HydrophobicContact CG2-CG1 4.37Å; T66-V158 WeakPolarHBondContact OG1-CG1 3.48Å; G154-V158 WeakPolarHBondContact O-CG2 3.39Å; G154-V158 PolarHBondContact O-N 3.25Å; F155-V158 PolarHBondContact O-N 2.85Å; V158-V161 PolarHBondContact O-N 2.77Å; V158-F162 VanDerWaalsContact O-CB 3.24Å; V158-F162 WeakPolarHBondContact O-CB 3.34Å; V158-F162 PolarHBondContact O-N 3.07Å; V158-F271 HydrophobicContact CB-CZ 4.21Å; V158-F271 HydrophobicContact CG1-CZ 4.16Å; V158-F271 HydrophobicContact CG2-CE2 3.86Å; V158-F271 HydrophobicContact CG2-CZ 3.82Å; V158-L400 HydrophobicContact CG1-CD1 3.82Å; V158-V403 HydrophobicContact CG2-CB 4.21Å; V158-V403 HydrophobicContact CG2-CG1 3.59Å; V158-I404 HydrophobicContact CB-CG1 4.33Å; V158-I404 HydrophobicContact CG1-CD1 3.91Å; V158-I404 HydrophobicContact CG1-CG1 3.6Å; V158-I404 HydrophobicContact CG2-CG1 3.67Å |
| 159 | Y | 96.4 | Very high | 94.8 | Very high | 10 Ų | 10 | 15.6 Ų | 15.6 | 4% | 0.039 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -67.8 | -38.9 | 177.1 | -61.7 | -16 | 0 | 0 | 0 | 112.9 | T66 F155 C156 C157 L163 I347 T350 F351 Q354 | T66-Y159 HydrophobicContact CG2-CD1 3.74Å; T66-Y159 HydrophobicContact CG2-CE1 3.86Å; T66-Y159 WeakPolarHBondContact OG1-CE1 3.45Å; F155-Y159 WeakPolarHBondContact O-CD1 3.4Å; F155-Y159 PolarHBondContact O-N 2.99Å; C156-Y159 PolarHBondContact O-N 3.08Å; C157-Y159 PolarHBondContact O-N 3Å; Y159-L163 WeakPolarHBondContact O-CB 3.38Å; Y159-L163 WeakPolarHBondContact O-CD1 3.29Å; Y159-L163 PolarHBondContact O-N 3.44Å; Y159-I347 HydrophobicContact CD1-CG2 3.47Å; Y159-I347 VanDerWaalsContact CD1-CG2 3.47Å; Y159-I347 HydrophobicContact CD2-CG2 4.22Å; Y159-I347 HydrophobicContact CE1-CD1 4.47Å; Y159-I347 HydrophobicContact CE1-CG2 4.13Å; Y159-I347 HydrophobicContact CG-CG2 3.53Å; Y159-T350 HydrophobicContact CE2-CG2 4.23Å; Y159-F351 HydrophobicContact CD2-CB 3.94Å; Y159-F351 AromaticContact CD2-CD2 4Å; Y159-F351 HydrophobicContact CD2-CD2 4Å; Y159-F351 HydrophobicContact CD2-CG 4.38Å; Y159-Q354 HydrophobicContact CE2-CB 3.91Å; Y159-Q354 HydrophobicContact CE2-CG 4.16Å |
| 160 | F | 96.8 | Very high | 94.7 | Very high | 0 Ų | 0 | 15.6 Ų | 15.6 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -58 | -51.4 | 172.2 | -93.2 | -79.1 | 0 | 0 | 0 | 111.4 | C156 C157 L163 S164 M202 F205 L206 F209 F351 V387 C391 A394 | C156-F160 WeakPolarHBondContact O-CD2 3.45Å; C156-F160 PolarHBondContact O-N 3.43Å; C156-F160 VanDerWaalsContact O-N 3.16Å; C157-F160 WeakPolarHBondContact O-CB 3.32Å; C157-F160 PolarHBondContact O-N 3.2Å; C157-F160 VanDerWaalsContact O-N 3.11Å; F160-L163 PolarHBondContact O-N 2.64Å; F160-S164 PolarHBondContact O-N 3.42Å; F160-S164 PolarHBondContact O-OG 3.26Å; F160-M202 HydrophobicContact CD1-CB 4.3Å; F160-F205 HydrophobicContact CE1-CB 4.37Å; F160-L206 HydrophobicContact CE1-CB 4.33Å; F160-L206 HydrophobicContact CZ-CD1 4.15Å; F160-F209 HydrophobicContact CD1-CD2 4.01Å; F160-F209 AromaticContact CD1-CE2 3.91Å; F160-F209 HydrophobicContact CD1-CE2 3.91Å; F160-F209 HydrophobicContact CD2-CD2 4.46Å; F160-F209 HydrophobicContact CD2-CE2 4.4Å; F160-F209 AromaticContact CE1-CD2 3.44Å; F160-F209 HydrophobicContact CE1-CD2 3.44Å; F160-F209 VanDerWaalsContact CE1-CD2 3.44Å; F160-F209 AromaticContact CE1-CE2 3.84Å; F160-F209 HydrophobicContact CE1-CE2 3.84Å; F160-F209 AromaticContact CE2-CD2 3.94Å; F160-F209 HydrophobicContact CE2-CD2 3.94Å; F160-F209 HydrophobicContact CE2-CE2 4.32Å; F160-F209 HydrophobicContact CG-CD2 4.49Å; F160-F209 HydrophobicContact CG-CE2 4.2Å; F160-F209 HydrophobicContact CZ-CB 4.2Å; F160-F209 AromaticContact CZ-CD2 3.39Å; F160-F209 HydrophobicContact CZ-CD2 3.39Å; F160-F209 HydrophobicContact CZ-CE2 4.05Å; F160-F209 HydrophobicContact CZ-CG 4.13Å; F160-F351 AromaticContact CD2-CE2 3.9Å; F160-F351 HydrophobicContact CD2-CE2 3.9Å; F160-F351 AromaticContact CE2-CE2 3.68Å; F160-F351 HydrophobicContact CE2-CE2 3.68Å; F160-F351 AromaticContact CE2-CZ 3.92Å; F160-F351 HydrophobicContact CE2-CZ 3.92Å; F160-V387 HydrophobicContact CE2-CG1 4.31Å; F160-V387 HydrophobicContact CZ-CG1 4.09Å; F160-C391 HydrophobicContact CD1-CB 4.41Å; F160-C391 HydrophobicContact CD2-CB 4.45Å; F160-C391 HydrophobicContact CE1-CB 3.9Å; F160-C391 HydrophobicContact CE2-CB 3.96Å; F160-C391 HydrophobicContact CZ-CB 3.66Å; F160-A394 HydrophobicContact CB-CB 3.68Å; F160-A394 HydrophobicContact CG-CB 4.43Å |
| 161 | V | 95.9 | Very high | 94.4 | Very high | 0 Ų | 0 | 15.1 Ų | 15.1 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -63.3 | -45.6 | -179.7 | -174.8 | 0 | 0 | 0 | 0 | 111.1 | C157 V158 L163 S164 D165 M202 A394 L400 | C157-V161 PolarHBondContact O-N 2.83Å; C157-V161 VanDerWaalsContact O-N 3.15Å; V158-V161 PolarHBondContact O-N 2.77Å; V161-L163 PolarHBondContact O-N 2.88Å; V161-S164 WeakPolarHBondContact CA-OG 3.33Å; V161-S164 PolarHBondContact O-N 3.01Å; V161-S164 PolarHBondContact O-OG 3.22Å; V161-D165 WeakPolarHBondContact CG1-OD2 3.46Å; V161-D165 VanDerWaalsContact O-CG 3.32Å; V161-D165 PolarHBondContact O-N 3.17Å; V161-M202 HydrophobicContact CB-CE 4.39Å; V161-M202 HydrophobicContact CG1-CE 4.34Å; V161-M202 HydrophobicContact CG2-CE 3.96Å; V161-M202 HydrophobicContact CG2-SD 4.49Å; V161-A394 HydrophobicContact CG2-CB 3.86Å; V161-L400 HydrophobicContact CB-CD1 4.12Å; V161-L400 HydrophobicContact CG1-CB 3.88Å; V161-L400 HydrophobicContact CG1-CD1 4.14Å |
| 162 | F | 96.3 | Very high | 94 | Very high | 1 Ų | 1 | 17.2 Ų | 17.2 | 0% | 0.004 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -60.4 | -45.1 | 178.9 | -179.5 | -94.7 | 0 | 0 | 0 | 112.4 | T66 L69 V158 N166 T327 Y343 I347 L400 | T66-F162 HydrophobicContact CG2-CB 4.15Å; T66-F162 HydrophobicContact CG2-CD1 4.16Å; T66-F162 HydrophobicContact CG2-CD2 4.18Å; T66-F162 HydrophobicContact CG2-CG 3.88Å; L69-F162 HydrophobicContact CD1-CD2 4.42Å; L69-F162 HydrophobicContact CD1-CE2 3.41Å; L69-F162 VanDerWaalsContact CD1-CE2 3.41Å; L69-F162 HydrophobicContact CD1-CZ 3.48Å; L69-F162 VanDerWaalsContact CD1-CZ 3.48Å; V158-F162 VanDerWaalsContact O-CB 3.24Å; V158-F162 WeakPolarHBondContact O-CB 3.34Å; V158-F162 PolarHBondContact O-N 3.07Å; F162-N166 WeakPolarHBondContact CD2-ND2 3.34Å; F162-N166 WeakPolarHBondContact CE2-ND2 3.45Å; F162-N166 WeakPolarHBondContact CZ-ND2 3.25Å; F162-N166 WeakPolarHBondContact O-CB 3.43Å; F162-N166 PolarHBondContact O-N 3.3Å; F162-N166 PolarHBondContact O-ND2 2.74Å; F162-T327 HydrophobicContact CE2-CG2 4.43Å; F162-T327 WeakPolarHBondContact CE2-OG1 3.14Å; F162-T327 HydrophobicContact CZ-CG2 4.21Å; F162-Y343 HydrophobicContact CE1-CD1 4.12Å; F162-Y343 HydrophobicContact CZ-CD1 4.08Å; F162-I347 HydrophobicContact CD1-CB 4.33Å; F162-I347 HydrophobicContact CD1-CG1 4.07Å; F162-I347 HydrophobicContact CD1-CG2 4.31Å; F162-I347 HydrophobicContact CE1-CG1 3.96Å; F162-L400 HydrophobicContact CB-CD1 4.02Å; F162-L400 HydrophobicContact CD2-CD2 3.97Å |
| 163 | L | 96.1 | Very high | 93.5 | Very high | 2 Ų | 2 | 16.8 Ų | 16.8 | 1% | 0.01 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -64.8 | -42.6 | 176.7 | -96.1 | 76.5 | 0 | 0 | 0 | 111.6 | Y159 F160 V161 L167 F205 F209 C344 I347 F348 | Y159-L163 WeakPolarHBondContact O-CB 3.38Å; Y159-L163 WeakPolarHBondContact O-CD1 3.29Å; Y159-L163 PolarHBondContact O-N 3.44Å; F160-L163 PolarHBondContact O-N 2.64Å; V161-L163 PolarHBondContact O-N 2.88Å; L163-L167 VanDerWaalsContact O-CB 3.25Å; L163-L167 WeakPolarHBondContact O-CB 3.38Å; L163-L167 PolarHBondContact O-N 2.98Å; L163-F205 HydrophobicContact CB-CD2 3.91Å; L163-F205 HydrophobicContact CB-CE2 3.7Å; L163-F205 HydrophobicContact CB-CG 4.48Å; L163-F205 HydrophobicContact CB-CZ 4.09Å; L163-F205 HydrophobicContact CD2-CD1 3.81Å; L163-F205 HydrophobicContact CD2-CD2 4.32Å; L163-F205 HydrophobicContact CD2-CE1 3.73Å; L163-F205 HydrophobicContact CD2-CE2 4.24Å; L163-F205 HydrophobicContact CD2-CG 4.11Å; L163-F205 HydrophobicContact CD2-CZ 3.93Å; L163-F205 HydrophobicContact CG-CE2 4.43Å; L163-F205 HydrophobicContact CG-CZ 4.33Å; L163-F209 HydrophobicContact CD2-CE2 4.13Å; L163-F209 HydrophobicContact CD2-CZ 3.65Å; L163-C344 HydrophobicContact CG-CB 4.28Å; L163-I347 HydrophobicContact CD1-CB 3.84Å; L163-I347 HydrophobicContact CD1-CG2 3.48Å; L163-I347 VanDerWaalsContact CD1-CG2 3.48Å; L163-F348 HydrophobicContact CD2-CB 4.09Å; L163-F348 HydrophobicContact CD2-CD2 3.99Å |
| 164 | S | 95.2 | Very high | 92.8 | Very high | 0 Ų | 0 | 17.7 Ų | 17.7 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -63.9 | -46.4 | -179.7 | 56.9 | 0 | 0 | 0 | 0 | 112.2 | F160 V161 L167 K168 S198 M202 | F160-S164 PolarHBondContact O-N 3.42Å; F160-S164 PolarHBondContact O-OG 3.26Å; V161-S164 WeakPolarHBondContact CA-OG 3.33Å; V161-S164 PolarHBondContact O-N 3.01Å; V161-S164 PolarHBondContact O-OG 3.22Å; S164-L167 PolarHBondContact O-N 3.4Å; S164-K168 WeakPolarHBondContact O-CB 3.16Å; S164-K168 PolarHBondContact O-N 2.86Å; S164-S198 WeakPolarHBondContact CB-O 3.45Å; S164-M202 WeakPolarHBondContact OG-CE 3.36Å; S164-M202 WeakPolarHBondContact OG-CG 3.4Å |
| 165 | D | 93.7 | Very high | 91.6 | Very high | 27 Ų | 27 | 24 Ų | 24 | 14% | 0.144 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -69.5 | -42.4 | -175.5 | -66.2 | -15.6 | 0 | 0 | 0 | 111.8 | V161 K168 Q169 L328 | V161-D165 WeakPolarHBondContact CG1-OD2 3.46Å; V161-D165 VanDerWaalsContact O-CG 3.32Å; V161-D165 PolarHBondContact O-N 3.17Å; D165-K168 PolarHBondContact O-N 3.06Å; D165-Q169 WeakPolarHBondContact O-CG 3.39Å; D165-Q169 PolarHBondContact O-N 3.29Å; D165-L328 HydrophobicContact CB-CD1 4.3Å; D165-L328 HydrophobicContact CB-CD2 3.82Å |
| 166 | N | 94.6 | Very high | 90.4 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -69.2 | -38.2 | 177.8 | -76.5 | -89.9 | 0 | 0 | 0 | 111.7 | F162 V170 T327 C344 | F162-N166 WeakPolarHBondContact CD2-ND2 3.34Å; F162-N166 WeakPolarHBondContact CE2-ND2 3.45Å; F162-N166 WeakPolarHBondContact CZ-ND2 3.25Å; F162-N166 WeakPolarHBondContact O-CB 3.43Å; F162-N166 PolarHBondContact O-N 3.3Å; F162-N166 PolarHBondContact O-ND2 2.74Å; N166-V170 VanDerWaalsContact O-CG2 3.23Å; N166-V170 WeakPolarHBondContact O-CG2 3.5Å; N166-V170 PolarHBondContact O-N 3.05Å; N166-V170 VanDerWaalsContact O-N 3.15Å; N166-T327 PolarHBondContact ND2-OG1 3.44Å; N166-T327 VanDerWaalsContact OD1-CB 3.23Å; N166-T327 WeakPolarHBondContact OD1-CB 3.48Å; N166-T327 PolarHBondContact OD1-OG1 2.91Å; N166-C344 WeakPolarHBondContact CB-SG 3.37Å |
| 167 | L | 93.8 | Very high | 89.4 | Confident | 32 Ų | 32 | 25 Ų | 25 | 17% | 0.168 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -68.4 | -41.6 | 174.4 | -178.9 | 60 | 0 | 0 | 0 | 111.5 | L163 S164 Q169 V170 V171 Y201 F204 F205 L341 | L163-L167 VanDerWaalsContact O-CB 3.25Å; L163-L167 WeakPolarHBondContact O-CB 3.38Å; L163-L167 PolarHBondContact O-N 2.98Å; S164-L167 PolarHBondContact O-N 3.4Å; L167-Q169 PolarHBondContact O-N 3.47Å; L167-V170 PolarHBondContact O-N 3.17Å; L167-V171 HydrophobicContact CD1-CG2 4.4Å; L167-V171 WeakPolarHBondContact O-CG2 3.47Å; L167-V171 PolarHBondContact O-N 3.21Å; L167-Y201 HydrophobicContact CB-CD1 4.39Å; L167-Y201 HydrophobicContact CD2-CD1 3.93Å; L167-Y201 HydrophobicContact CD2-CE1 4.45Å; L167-Y201 HydrophobicContact CG-CD1 3.97Å; L167-Y201 HydrophobicContact CG-CE1 4.18Å; L167-F204 HydrophobicContact CD2-CD1 4.27Å; L167-F204 HydrophobicContact CD2-CE1 4.18Å; L167-F205 HydrophobicContact CB-CE2 4.08Å; L167-F205 HydrophobicContact CB-CZ 4.21Å; L167-F205 HydrophobicContact CD2-CE1 4.47Å; L167-F205 HydrophobicContact CD2-CE2 3.6Å; L167-F205 HydrophobicContact CD2-CZ 3.47Å; L167-F205 VanDerWaalsContact CD2-CZ 3.47Å; L167-F205 HydrophobicContact CG-CE2 4.48Å; L167-F205 HydrophobicContact CG-CZ 4.42Å; L167-L341 HydrophobicContact CD1-CD2 4.19Å |
| 168 | K | 92 | Very high | 88.3 | Confident | 50 Ų | 50 | 26.7 Ų | 26.7 | 22% | 0.217 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -55.4 | -51.9 | 175.1 | -179.4 | -176.9 | 175.3 | -168.5 | 0 | 110.9 | S164 D165 V170 V171 E172 S195 F196 Y201 | S164-K168 WeakPolarHBondContact O-CB 3.16Å; S164-K168 PolarHBondContact O-N 2.86Å; D165-K168 PolarHBondContact O-N 3.06Å; K168-V170 VanDerWaalsContact C-N 3.32Å; K168-V170 PolarHBondContact O-N 2.85Å; K168-V171 PolarHBondContact O-N 2.97Å; K168-V171 VanDerWaalsContact O-N 3.08Å; K168-E172 WeakPolarHBondContact CE-OE1 3.37Å; K168-E172 HydrophobicContact CG-CG 4.39Å; K168-E172 IonicContact NZ-OE1 3.8Å; K168-E172 WeakPolarHBondContact O-CG 3.39Å; K168-E172 PolarHBondContact O-N 2.97Å; K168-S195 WeakPolarHBondContact CE-OG 3.3Å; K168-F196 WeakPolarHBondContact CE-O 3.27Å; K168-Y201 HydrophobicContact CB-CD2 4.03Å; K168-Y201 HydrophobicContact CB-CE1 4.47Å; K168-Y201 HydrophobicContact CB-CE2 3.88Å; K168-Y201 HydrophobicContact CB-CG 4.4Å; K168-Y201 HydrophobicContact CD-CE2 4.39Å; K168-Y201 HydrophobicContact CG-CD2 4.29Å; K168-Y201 HydrophobicContact CG-CE2 3.81Å |
| 169 | Q | 89.7 | Confident | 87.1 | Confident | 49 Ų | 49 | 35.7 Ų | 35.7 | 23% | 0.229 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.2 | -37.4 | 177.4 | -76.7 | -164.4 | -8.8 | 0 | 0 | 113.7 | D165 L167 V171 A173 L328 | D165-Q169 WeakPolarHBondContact O-CG 3.39Å; D165-Q169 PolarHBondContact O-N 3.29Å; L167-Q169 PolarHBondContact O-N 3.47Å; Q169-V171 VanDerWaalsContact C-N 3.31Å; Q169-A173 WeakPolarHBondContact O-CB 3.24Å; Q169-A173 PolarHBondContact O-N 2.88Å; Q169-L328 HydrophobicContact CG-CD2 4.26Å; Q169-L328 PolarHBondContact NE2-O 3.1Å; Q169-L328 PolarHBondContact OE1-O 3.25Å |
| 170 | V | 91 | Very high | 85.6 | Confident | 23 Ų | 23 | 38.8 Ų | 38.8 | 14% | 0.139 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -64.1 | -38.3 | 176 | 170.4 | 0 | 0 | 0 | 0 | 110.9 | N166 L167 K168 A174 K340 L341 | N166-V170 VanDerWaalsContact O-CG2 3.23Å; N166-V170 WeakPolarHBondContact O-CG2 3.5Å; N166-V170 PolarHBondContact O-N 3.05Å; N166-V170 VanDerWaalsContact O-N 3.15Å; L167-V170 PolarHBondContact O-N 3.17Å; K168-V170 VanDerWaalsContact C-N 3.32Å; K168-V170 PolarHBondContact O-N 2.85Å; V170-A174 PolarHBondContact O-N 3.37Å; V170-K340 HydrophobicContact CG2-CB 4.04Å; V170-K340 HydrophobicContact CG2-CD 4.21Å; V170-L341 HydrophobicContact CB-CD2 4.44Å; V170-L341 HydrophobicContact CG1-CD1 4.18Å; V170-L341 HydrophobicContact CG1-CD2 4.15Å; V170-L341 HydrophobicContact CG1-CG 4.24Å; V170-L341 HydrophobicContact CG2-CD2 4.11Å; V170-L341 HydrophobicContact CG2-CG 4.12Å |
| 171 | V | 89.3 | Confident | 84.2 | Confident | 59 Ų | 59 | 41.3 Ų | 41.3 | 36% | 0.358 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -71.9 | -45.6 | 177.2 | 173.4 | 0 | 0 | 0 | 0 | 111.7 | L167 K168 Q169 A173 A174 Y201 | L167-V171 HydrophobicContact CD1-CG2 4.4Å; L167-V171 WeakPolarHBondContact O-CG2 3.47Å; L167-V171 PolarHBondContact O-N 3.21Å; K168-V171 PolarHBondContact O-N 2.97Å; K168-V171 VanDerWaalsContact O-N 3.08Å; Q169-V171 VanDerWaalsContact C-N 3.31Å; V171-A173 VanDerWaalsContact C-N 3.29Å; V171-A173 PolarHBondContact O-N 2.94Å; V171-A174 VanDerWaalsContact O-CB 3.27Å; V171-A174 WeakPolarHBondContact O-CB 3.43Å; V171-A174 PolarHBondContact O-N 3.33Å; V171-Y201 HydrophobicContact CG2-CE1 4.21Å |
| 172 | E | 85.7 | Confident | 82.4 | Confident | 45 Ų | 45 | 48.7 Ų | 48.7 | 21% | 0.21 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -57.9 | -42.6 | 176.6 | -74.2 | 175.9 | 148.5 | 0 | 0 | 112.1 | K168 A174 L192 V193 S195 | K168-E172 WeakPolarHBondContact CE-OE1 3.37Å; K168-E172 HydrophobicContact CG-CG 4.39Å; K168-E172 IonicContact NZ-OE1 3.8Å; K168-E172 WeakPolarHBondContact O-CG 3.39Å; K168-E172 PolarHBondContact O-N 2.97Å; E172-A174 VanDerWaalsContact C-N 3.32Å; E172-A174 PolarHBondContact O-N 3.38Å; E172-L192 HydrophobicContact CB-CD2 4Å; E172-V193 PolarHBondContact O-N 3.33Å; E172-V193 VanDerWaalsContact O-N 3.12Å; E172-S195 VanDerWaalsContact CD-OG 3.27Å; E172-S195 VanDerWaalsContact CG-CB 3.41Å; E172-S195 VanDerWaalsContact CG-OG 3.3Å; E172-S195 WeakPolarHBondContact CG-OG 3.48Å; E172-S195 PolarHBondContact OE1-OG 3.42Å |
| 173 | A | 83.2 | Confident | 80.5 | Confident | 1 Ų | 1 | 52.8 Ų | 52.8 | 1% | 0.008 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.6 | -10.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q169 V171 N175 A176 T177 N332 | Q169-A173 WeakPolarHBondContact O-CB 3.24Å; Q169-A173 PolarHBondContact O-N 2.88Å; V171-A173 VanDerWaalsContact C-N 3.29Å; V171-A173 PolarHBondContact O-N 2.94Å; A173-N175 VanDerWaalsContact C-N 3.35Å; A173-N175 PolarHBondContact O-N 2.91Å; A173-A176 CarbonylContact O-C 3.37Å; A173-A176 WeakPolarHBondContact O-CA 3.28Å; A173-A176 PolarHBondContact O-N 3.34Å; A173-T177 HydrophobicContact CB-CG2 4.49Å; A173-T177 WeakPolarHBondContact O-CG2 3.27Å; A173-T177 PolarHBondContact O-N 3.37Å; A173-N332 HydrophobicContact CB-CB 4.09Å; A173-N332 WeakPolarHBondContact CB-OD1 3.49Å |
| 174 | A | 79.9 | Confident | 78.1 | Confident | 47 Ų | 47 | 58.7 Ų | 58.7 | 39% | 0.388 | 32% | 0.32 | S | S | . | . | G | 310 helix | trans | -51.5 | -49.1 | -168.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | V170 V171 E172 A176 T177 | V170-A174 PolarHBondContact O-N 3.37Å; V171-A174 VanDerWaalsContact O-CB 3.27Å; V171-A174 WeakPolarHBondContact O-CB 3.43Å; V171-A174 PolarHBondContact O-N 3.33Å; E172-A174 VanDerWaalsContact C-N 3.32Å; E172-A174 PolarHBondContact O-N 3.38Å; A174-A176 VanDerWaalsContact C-N 3.32Å; A174-A176 PolarHBondContact O-N 3.01Å; A174-T177 PolarHBondContact O-N 3Å; A174-T177 PolarHBondContact O-OG1 3.05Å |
| 175 | N | 70.5 | Confident | 75.9 | Confident | 137 Ų | 137 | 66.8 Ų | 66.8 | 73% | 0.733 | 36% | 0.358 | S | S | * | . | G | 310 helix | trans | -75.1 | -18.3 | 178.9 | -69.8 | -0.2 | 0 | 0 | 0 | 113.9 | A173 V193 | A173-N175 VanDerWaalsContact C-N 3.35Å; A173-N175 PolarHBondContact O-N 2.91Å; N175-V193 HydrophobicContact CB-CG2 3.9Å; N175-V193 WeakPolarHBondContact ND2-CG2 3.31Å |
| 176 | A | 70.5 | Confident | 73.4 | Confident | 10 Ų | 10 | 70.9 Ų | 70.9 | 8% | 0.083 | 38% | 0.384 | C | S | . | . | G | 310 helix | trans | -95.2 | -0.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | A173 A174 T178 | A173-A176 CarbonylContact O-C 3.37Å; A173-A176 WeakPolarHBondContact O-CA 3.28Å; A173-A176 PolarHBondContact O-N 3.34Å; A174-A176 VanDerWaalsContact C-N 3.32Å; A174-A176 PolarHBondContact O-N 3.01Å; A176-T178 PolarHBondContact O-N 3.03Å |
| 177 | T | 75.2 | Confident | 70.9 | Confident | 26 Ų | 26 | 77.9 Ų | 77.9 | 16% | 0.16 | 42% | 0.421 | C | S | . | . | trans | -68.9 | 121.5 | -176.6 | 53.1 | 0 | 0 | 0 | 0 | 112.6 | A173 A174 N332 W334 Q337 | A173-T177 HydrophobicContact CB-CG2 4.49Å; A173-T177 WeakPolarHBondContact O-CG2 3.27Å; A173-T177 PolarHBondContact O-N 3.37Å; A174-T177 PolarHBondContact O-N 3Å; A174-T177 PolarHBondContact O-OG1 3.05Å; T177-N332 WeakPolarHBondContact CA-O 3.3Å; T177-W334 WeakPolarHBondContact OG1-CZ2 3.4Å; T177-W334 PolarHBondContact OG1-NE1 2.92Å; T177-Q337 HydrophobicContact CG2-CG 3.85Å | ||
| 178 | T | 72.8 | Confident | 68.5 | Low | 42 Ų | 42 | 81.5 Ų | 81.5 | 26% | 0.258 | 44% | 0.438 | S | S | . | . | B | Isolated β-bridge | trans | -107.8 | 154.6 | 176.8 | 56.9 | 0 | 0 | 0 | 0 | 112 | A176 S180 N332 C333 W334 | A176-T178 PolarHBondContact O-N 3.03Å; T178-S180 PolarHBondContact OG1-O 2.87Å; T178-N332 PolarHBondContact N-O 3.46Å; T178-C333 WeakPolarHBondContact O-CA 3.41Å; T178-C333 WeakPolarHBondContact O-CB 3.45Å; T178-W334 PolarHBondContact O-N 3.19Å |
| 179 | F | 70.9 | Confident | 66.1 | Low | 188 Ų | 188 | 85.7 Ų | 85.7 | 83% | 0.825 | 47% | 0.467 | S | S | * | . | S | Bend | trans | -75 | -26.2 | 173.7 | -74.8 | -80.6 | 0 | 0 | 0 | 112.7 | W334 | F179-W334 AromaticContact CD1-CD1 4Š|
| 180 | S | 65.6 | Low | 64 | Low | 75 Ų | 75 | 87 Ų | 87 | 52% | 0.524 | 48% | 0.476 | S | S | . | . | trans | -96 | 109.4 | -180 | 53 | 0 | 0 | 0 | 0 | 111.5 | T178 Q182 | T178-S180 PolarHBondContact OG1-O 2.87Å; S180-Q182 PolarHBondContact O-N 3.4Å | ||
| 181 | C | 66.6 | Low | 62.2 | Low | 54 Ų | 54 | 91.4 Ų | 91.4 | 37% | 0.365 | 50% | 0.503 | S | S | . | . | trans | -73 | 26.4 | 173.9 | -51.1 | 0 | 0 | 0 | 0 | 113.9 | C333 Y336 | C181-C333 HydrophobicContact CB-CB 3.85Å; C181-C333 WeakPolarHBondContact CB-SG 3.2Å; C181-C333 WeakPolarHBondContact SG-CB 3.29Å; C181-C333 CovalentContact SG-SG 2.03Å; C181-C333 PolarHBondContact SG-SG 3.18Å; C181-Y336 HydrophobicContact CB-CE2 4.42Å | ||
| 182 | Q | 57.5 | Low | 60.8 | Low | 154 Ų | 154 | 93.2 Ų | 93.2 | 72% | 0.72 | 51% | 0.51 | S | S | * | . | trans | -103.7 | 117 | -168.6 | -162.5 | 151.6 | -17.2 | 0 | 0 | 110.2 | S180 N184 | S180-Q182 PolarHBondContact O-N 3.4Å; Q182-N184 VanDerWaalsContact C-N 3.31Å; Q182-N184 PolarHBondContact O-N 2.91Å | ||
| 183 | V | 56.2 | Low | 59.7 | Low | 88 Ų | 88 | 93.2 Ų | 93.2 | 53% | 0.533 | 51% | 0.513 | S | S | . | . | trans | -75.9 | 77.4 | -169.6 | -172.1 | 0 | 0 | 0 | 0 | 111.4 | H185 | V183-H185 PolarHBondContact O-N 3.42Š| ||
| 184 | N | 46.8 | Very low | 58.7 | Low | 125 Ų | 125 | 99.1 Ų | 99.1 | 67% | 0.668 | 55% | 0.551 | S | S | * | * | trans | -87.8 | 94.1 | 164.1 | -82.2 | -8.4 | 0 | 0 | 0 | 109 | Q182 T186 | Q182-N184 VanDerWaalsContact C-N 3.31Å; Q182-N184 PolarHBondContact O-N 2.91Å; N184-T186 PolarHBondContact O-N 3.29Å | ||
| 185 | H | 47.8 | Very low | 58 | Low | 171 Ų | 171 | 98.5 Ų | 98.5 | 79% | 0.792 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | 9.1 | -171.6 | -114.9 | -64.4 | 0 | 0 | 0 | 116.7 | V183 | V183-H185 PolarHBondContact O-N 3.42Š|
| 186 | T | 41.1 | Very low | 58.2 | Low | 112 Ų | 112 | 98.6 Ų | 98.6 | 69% | 0.687 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -114.7 | -18.3 | -160.9 | 46.7 | 0 | 0 | 0 | 0 | 116.6 | N184 | N184-T186 PolarHBondContact O-N 3.29Š|
| 187 | N | 42.1 | Very low | 58.8 | Low | 147 Ų | 147 | 101.5 Ų | 101.5 | 79% | 0.786 | 55% | 0.552 | S | S | * | * | trans | -149.3 | 63.7 | -174.4 | -75.6 | -53.7 | 0 | 0 | 0 | 113.8 | ||||
| 188 | Q | 44.4 | Very low | 59.2 | Low | 108 Ų | 108 | 100.6 Ų | 100.6 | 51% | 0.505 | 55% | 0.547 | S | S | . | . | trans | -129.7 | 115.4 | 159.9 | -77.1 | -165.8 | -121.1 | 0 | 0 | 111 | D190 | Q188-D190 WeakPolarHBondContact CB-OD1 3.3Å; Q188-D190 PolarHBondContact NE2-OD1 2.9Å; Q188-D190 PolarHBondContact O-N 3.22Å | ||
| 189 | T | 41.8 | Very low | 60.1 | Low | 138 Ų | 138 | 102.5 Ų | 102.5 | 85% | 0.847 | 55% | 0.549 | S | S | * | . | trans | -74.7 | 78.2 | 159.1 | 49.4 | 0 | 0 | 0 | 0 | 108 | V191 | T189-V191 PolarHBondContact O-N 3.29Š| ||
| 190 | D | 46.3 | Very low | 61 | Low | 78 Ų | 78 | 97.9 Ų | 97.9 | 42% | 0.417 | 53% | 0.532 | S | S | . | . | trans | -70.4 | 77.4 | 176.1 | -76.4 | -20.8 | 0 | 0 | 0 | 110 | Q188 L192 | Q188-D190 WeakPolarHBondContact CB-OD1 3.3Å; Q188-D190 PolarHBondContact NE2-OD1 2.9Å; Q188-D190 PolarHBondContact O-N 3.22Å; D190-L192 PolarHBondContact O-N 3.41Å | ||
| 191 | V | 51.8 | Low | 62.3 | Low | 114 Ų | 114 | 95.5 Ų | 95.5 | 69% | 0.691 | 51% | 0.512 | S | S | * | . | trans | -74.8 | 81.7 | 167.7 | -173.3 | 0 | 0 | 0 | 0 | 107.5 | T189 V193 | T189-V191 PolarHBondContact O-N 3.29Å; V191-V193 PolarHBondContact O-N 3.46Å | ||
| 192 | L | 60.7 | Low | 63.6 | Low | 98 Ų | 98 | 92.9 Ų | 92.9 | 51% | 0.513 | 49% | 0.494 | S | S | . | . | trans | -50.8 | 129.8 | 168.1 | -74.6 | 150.2 | 0 | 0 | 0 | 108.7 | E172 D190 | E172-L192 HydrophobicContact CB-CD2 4Å; D190-L192 PolarHBondContact O-N 3.41Å | ||
| 193 | V | 62.4 | Low | 65.4 | Low | 45 Ų | 45 | 90 Ų | 90 | 27% | 0.273 | 48% | 0.484 | S | S | . | . | trans | -67.6 | 127.5 | 177.8 | -174.8 | 0 | 0 | 0 | 0 | 107.8 | E172 N175 V191 S195 | E172-V193 PolarHBondContact O-N 3.33Å; E172-V193 VanDerWaalsContact O-N 3.12Å; N175-V193 HydrophobicContact CB-CG2 3.9Å; N175-V193 WeakPolarHBondContact ND2-CG2 3.31Å; V191-V193 PolarHBondContact O-N 3.46Å; V193-S195 PolarHBondContact O-N 3.5Å | ||
| 194 | P | 62.4 | Low | 67.2 | Low | 124 Ų | 124 | 91 Ų | 91 | 81% | 0.805 | 48% | 0.481 | S | S | * | . | trans | -59.5 | 114.2 | 176.2 | 24.4 | -33.5 | 0 | 0 | 0 | 109.3 | ||||
| 195 | S | 65 | Low | 69.6 | Low | 34 Ų | 34 | 86.3 Ų | 86.3 | 24% | 0.238 | 46% | 0.455 | C | S | . | . | trans | -104.1 | 164.4 | -176.6 | 80.5 | 0 | 0 | 0 | 0 | 111.7 | K168 E172 V193 | K168-S195 WeakPolarHBondContact CE-OG 3.3Å; E172-S195 VanDerWaalsContact CD-OG 3.27Å; E172-S195 VanDerWaalsContact CG-CB 3.41Å; E172-S195 VanDerWaalsContact CG-OG 3.3Å; E172-S195 WeakPolarHBondContact CG-OG 3.48Å; E172-S195 PolarHBondContact OE1-OG 3.42Å; V193-S195 PolarHBondContact O-N 3.5Å | ||
| 196 | F | 74.4 | Confident | 71.9 | Confident | 140 Ų | 140 | 79.6 Ų | 79.6 | 61% | 0.614 | 42% | 0.424 | S | S | * | . | trans | -77.3 | 162.8 | 176.7 | -66.5 | -76.5 | 0 | 0 | 0 | 111.7 | K168 I200 Y201 | K168-F196 WeakPolarHBondContact CE-O 3.27Å; F196-I200 HydrophobicContact CB-CB 4.21Å; F196-I200 HydrophobicContact CB-CD1 3.85Å; F196-I200 HydrophobicContact CB-CG2 4.3Å; F196-I200 HydrophobicContact CD1-CD1 4.01Å; F196-I200 HydrophobicContact CG-CD1 4.24Å; F196-Y201 HydrophobicContact CB-CE2 4.21Å | ||
| 197 | D | 83.8 | Confident | 74.5 | Confident | 70 Ų | 70 | 77.8 Ų | 77.8 | 37% | 0.374 | 42% | 0.415 | S | S | . | . | trans | -58.4 | 143.1 | 172.8 | -174.1 | 15.2 | 0 | 0 | 0 | 111 | R199 I200 | D197-R199 PolarHBondContact O-N 2.86Å; D197-R199 WeakPolarHBondContact OD2-CD 3.3Å; D197-R199 VanDerWaalsContact OD2-CG 3.26Å; D197-R199 WeakPolarHBondContact OD2-CG 3.45Å; D197-R199 IonicContact OD2-NE 3.97Å; D197-R199 PolarHBondContact OD2-NE 3.28Å; D197-R199 VanDerWaalsContact OD2-NE 3.1Å; D197-I200 WeakPolarHBondContact O-CB 3.31Å; D197-I200 PolarHBondContact O-N 3.32Å | ||
| 198 | S | 83.2 | Confident | 77.1 | Confident | 7 Ų | 7 | 75.3 Ų | 75.3 | 5% | 0.049 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -37.6 | -42.8 | 171.5 | 57.7 | 0 | 0 | 0 | 0 | 113.4 | S164 I200 Y201 M202 | S164-S198 WeakPolarHBondContact CB-O 3.45Å; S198-I200 VanDerWaalsContact C-N 3.27Å; S198-I200 PolarHBondContact O-N 2.83Å; S198-Y201 WeakPolarHBondContact O-CA 3.16Å; S198-Y201 WeakPolarHBondContact O-CB 3.46Å; S198-Y201 PolarHBondContact O-N 2.73Å; S198-M202 PolarHBondContact O-N 2.9Å |
| 199 | R | 90.8 | Very high | 79.5 | Confident | 83 Ų | 83 | 70.2 Ų | 70.2 | 31% | 0.313 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -55.4 | -35.6 | 178.5 | -58 | 175.9 | -164 | -124.1 | 1.2 | 113.5 | D197 M202 L203 I395 P398 | D197-R199 PolarHBondContact O-N 2.86Å; D197-R199 WeakPolarHBondContact OD2-CD 3.3Å; D197-R199 VanDerWaalsContact OD2-CG 3.26Å; D197-R199 WeakPolarHBondContact OD2-CG 3.45Å; D197-R199 IonicContact OD2-NE 3.97Å; D197-R199 PolarHBondContact OD2-NE 3.28Å; D197-R199 VanDerWaalsContact OD2-NE 3.1Å; R199-M202 WeakPolarHBondContact O-CB 3.32Å; R199-M202 PolarHBondContact O-N 3Å; R199-L203 PolarHBondContact O-N 2.89Å; R199-L203 VanDerWaalsContact O-N 3.09Å; R199-I395 HydrophobicContact CB-CG2 4.43Å; R199-I395 HydrophobicContact CG-CG2 4.2Å; R199-I395 PolarHBondContact NH1-O 3.37Å; R199-P398 HydrophobicContact CG-CB 4.48Å |
| 200 | I | 91.4 | Very high | 82 | Confident | 90 Ų | 90 | 65 Ų | 65 | 46% | 0.462 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -71.2 | -37.6 | 178.3 | -69.2 | 165.4 | 0 | 0 | 0 | 110.3 | F196 D197 S198 M202 L203 F204 | F196-I200 HydrophobicContact CB-CB 4.21Å; F196-I200 HydrophobicContact CB-CD1 3.85Å; F196-I200 HydrophobicContact CB-CG2 4.3Å; F196-I200 HydrophobicContact CD1-CD1 4.01Å; F196-I200 HydrophobicContact CG-CD1 4.24Å; D197-I200 WeakPolarHBondContact O-CB 3.31Å; D197-I200 PolarHBondContact O-N 3.32Å; S198-I200 VanDerWaalsContact C-N 3.27Å; S198-I200 PolarHBondContact O-N 2.83Å; I200-M202 VanDerWaalsContact C-N 3.35Å; I200-L203 PolarHBondContact O-N 3.44Å; I200-F204 PolarHBondContact O-N 2.84Å |
| 201 | Y | 92.8 | Very high | 84.3 | Confident | 25 Ų | 25 | 67 Ų | 67 | 10% | 0.098 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -66.7 | -34.2 | 172.6 | -67.3 | -93.4 | 0 | 0 | 0 | 112 | L167 K168 V171 F196 S198 F204 F205 | L167-Y201 HydrophobicContact CB-CD1 4.39Å; L167-Y201 HydrophobicContact CD2-CD1 3.93Å; L167-Y201 HydrophobicContact CD2-CE1 4.45Å; L167-Y201 HydrophobicContact CG-CD1 3.97Å; L167-Y201 HydrophobicContact CG-CE1 4.18Å; K168-Y201 HydrophobicContact CB-CD2 4.03Å; K168-Y201 HydrophobicContact CB-CE1 4.47Å; K168-Y201 HydrophobicContact CB-CE2 3.88Å; K168-Y201 HydrophobicContact CB-CG 4.4Å; K168-Y201 HydrophobicContact CD-CE2 4.39Å; K168-Y201 HydrophobicContact CG-CD2 4.29Å; K168-Y201 HydrophobicContact CG-CE2 3.81Å; V171-Y201 HydrophobicContact CG2-CE1 4.21Å; F196-Y201 HydrophobicContact CB-CE2 4.21Å; S198-Y201 WeakPolarHBondContact O-CA 3.16Å; S198-Y201 WeakPolarHBondContact O-CB 3.46Å; S198-Y201 PolarHBondContact O-N 2.73Å; Y201-F204 WeakPolarHBondContact O-CB 3.35Å; Y201-F204 PolarHBondContact O-N 3.01Å; Y201-F205 WeakPolarHBondContact O-CD2 3.46Å; Y201-F205 PolarHBondContact O-N 3.44Å; Y201-F205 VanDerWaalsContact O-N 3.11Å |
| 202 | M | 93.6 | Very high | 86.2 | Confident | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -63.2 | -45.1 | 172.2 | -58.9 | 177.1 | -159.8 | 0 | 0 | 111.8 | F160 V161 S164 S198 R199 I200 F204 F205 L206 A394 I395 P398 | F160-M202 HydrophobicContact CD1-CB 4.3Å; V161-M202 HydrophobicContact CB-CE 4.39Å; V161-M202 HydrophobicContact CG1-CE 4.34Å; V161-M202 HydrophobicContact CG2-CE 3.96Å; V161-M202 HydrophobicContact CG2-SD 4.49Å; S164-M202 WeakPolarHBondContact OG-CE 3.36Å; S164-M202 WeakPolarHBondContact OG-CG 3.4Å; S198-M202 PolarHBondContact O-N 2.9Å; R199-M202 WeakPolarHBondContact O-CB 3.32Å; R199-M202 PolarHBondContact O-N 3Å; I200-M202 VanDerWaalsContact C-N 3.35Å; M202-F204 VanDerWaalsContact C-N 3.31Å; M202-F204 PolarHBondContact O-N 3.47Å; M202-F205 PolarHBondContact O-N 3.05Å; M202-L206 PolarHBondContact O-N 3.33Å; M202-L206 VanDerWaalsContact O-N 3.12Å; M202-A394 HydrophobicContact SD-CB 3.88Å; M202-I395 HydrophobicContact CB-CG1 4.22Å; M202-I395 HydrophobicContact SD-CG1 3.84Å; M202-P398 HydrophobicContact CE-CB 3.66Å |
| 203 | L | 94.8 | Very high | 87.6 | Confident | 94 Ų | 94 | 58.1 Ų | 58.1 | 49% | 0.492 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -63.8 | -34.5 | 174.7 | -71.8 | 174.3 | 0 | 0 | 0 | 112.5 | R199 I200 L206 P207 I395 | R199-L203 PolarHBondContact O-N 2.89Å; R199-L203 VanDerWaalsContact O-N 3.09Å; I200-L203 PolarHBondContact O-N 3.44Å; L203-L206 HydrophobicContact CD2-CD2 4.31Å; L203-L206 WeakPolarHBondContact O-CB 3.4Å; L203-L206 PolarHBondContact O-N 2.81Å; L203-P207 WeakPolarHBondContact O-CD 3.31Å; L203-I395 HydrophobicContact CD2-CD1 3.75Å; L203-I395 HydrophobicContact CG-CD1 3.92Å |
| 204 | F | 94.6 | Very high | 89 | Confident | 108 Ų | 108 | 59.4 Ų | 59.4 | 47% | 0.474 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.1 | -40.4 | 172.4 | 171 | -96.9 | 0 | 0 | 0 | 112.2 | L167 I200 Y201 M202 P207 F208 | L167-F204 HydrophobicContact CD2-CD1 4.27Å; L167-F204 HydrophobicContact CD2-CE1 4.18Å; I200-F204 PolarHBondContact O-N 2.84Å; Y201-F204 WeakPolarHBondContact O-CB 3.35Å; Y201-F204 PolarHBondContact O-N 3.01Å; M202-F204 VanDerWaalsContact C-N 3.31Å; M202-F204 PolarHBondContact O-N 3.47Å; F204-P207 WeakPolarHBondContact O-CD 3.36Å; F204-F208 HydrophobicContact CD1-CE2 4.44Å; F204-F208 HydrophobicContact CD2-CE2 4.42Å; F204-F208 HydrophobicContact CE1-CE2 4.01Å; F204-F208 AromaticContact CE2-CE2 3.98Å; F204-F208 HydrophobicContact CE2-CE2 3.98Å; F204-F208 HydrophobicContact CE2-CZ 4.44Å; F204-F208 AromaticContact CZ-CE2 3.75Å; F204-F208 HydrophobicContact CZ-CE2 3.75Å; F204-F208 HydrophobicContact CZ-CZ 4.2Å; F204-F208 WeakPolarHBondContact O-CD2 3.3Å; F204-F208 VanDerWaalsContact O-CE2 3.32Å; F204-F208 WeakPolarHBondContact O-CE2 3.31Å |
| 205 | F | 95.6 | Very high | 89.9 | Confident | 27 Ų | 27 | 55.7 Ų | 55.7 | 12% | 0.118 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -74.8 | -23.3 | 177.8 | -78.7 | -63.6 | 0 | 0 | 0 | 114.6 | F160 L163 L167 Y201 M202 F208 F209 | F160-F205 HydrophobicContact CE1-CB 4.37Å; L163-F205 HydrophobicContact CB-CD2 3.91Å; L163-F205 HydrophobicContact CB-CE2 3.7Å; L163-F205 HydrophobicContact CB-CG 4.48Å; L163-F205 HydrophobicContact CB-CZ 4.09Å; L163-F205 HydrophobicContact CD2-CD1 3.81Å; L163-F205 HydrophobicContact CD2-CD2 4.32Å; L163-F205 HydrophobicContact CD2-CE1 3.73Å; L163-F205 HydrophobicContact CD2-CE2 4.24Å; L163-F205 HydrophobicContact CD2-CG 4.11Å; L163-F205 HydrophobicContact CD2-CZ 3.93Å; L163-F205 HydrophobicContact CG-CE2 4.43Å; L163-F205 HydrophobicContact CG-CZ 4.33Å; L167-F205 HydrophobicContact CB-CE2 4.08Å; L167-F205 HydrophobicContact CB-CZ 4.21Å; L167-F205 HydrophobicContact CD2-CE1 4.47Å; L167-F205 HydrophobicContact CD2-CE2 3.6Å; L167-F205 HydrophobicContact CD2-CZ 3.47Å; L167-F205 VanDerWaalsContact CD2-CZ 3.47Å; L167-F205 HydrophobicContact CG-CE2 4.48Å; L167-F205 HydrophobicContact CG-CZ 4.42Å; Y201-F205 WeakPolarHBondContact O-CD2 3.46Å; Y201-F205 PolarHBondContact O-N 3.44Å; Y201-F205 VanDerWaalsContact O-N 3.11Å; M202-F205 PolarHBondContact O-N 3.05Å; F205-F208 PolarHBondContact O-N 2.88Å; F205-F208 VanDerWaalsContact O-N 3.14Å; F205-F209 HydrophobicContact CB-CD2 3.98Å; F205-F209 HydrophobicContact CB-CE2 3.86Å; F205-F209 WeakPolarHBondContact O-CD2 3.39Å; F205-F209 PolarHBondContact O-N 3.41Å |
| 206 | L | 96.5 | Very high | 90 | Very high | 29 Ų | 29 | 57.7 Ų | 57.7 | 15% | 0.152 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -49.3 | -54.6 | -178.3 | 178.2 | 58 | 0 | 0 | 0 | 114.9 | F160 M202 L203 F208 F209 I210 V387 I388 C391 | F160-L206 HydrophobicContact CE1-CB 4.33Å; F160-L206 HydrophobicContact CZ-CD1 4.15Å; M202-L206 PolarHBondContact O-N 3.33Å; M202-L206 VanDerWaalsContact O-N 3.12Å; L203-L206 HydrophobicContact CD2-CD2 4.31Å; L203-L206 WeakPolarHBondContact O-CB 3.4Å; L203-L206 PolarHBondContact O-N 2.81Å; L206-F208 VanDerWaalsContact C-N 3.28Å; L206-F208 PolarHBondContact O-N 3.22Å; L206-F209 PolarHBondContact O-N 2.66Å; L206-I210 HydrophobicContact CD1-CD1 3.79Å; L206-I210 HydrophobicContact CD1-CG1 4.14Å; L206-I210 HydrophobicContact CG-CD1 3.94Å; L206-I210 WeakPolarHBondContact O-CG1 3.36Å; L206-I210 PolarHBondContact O-N 3.19Å; L206-V387 HydrophobicContact CD1-CG1 3.86Å; L206-I388 HydrophobicContact CD1-CG1 4.33Å; L206-C391 HydrophobicContact CD1-CB 3.89Å |
| 207 | P | 96.4 | Very high | 89.9 | Confident | 75 Ų | 75 | 56.3 Ų | 56.3 | 49% | 0.487 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -61.6 | -34.3 | 179.5 | 23.7 | -35 | 0 | 0 | 0 | 113.2 | L203 F204 I210 L211 | L203-P207 WeakPolarHBondContact O-CD 3.31Å; F204-P207 WeakPolarHBondContact O-CD 3.36Å; P207-I210 PolarHBondContact O-N 2.83Å; P207-L211 WeakPolarHBondContact O-CB 3.29Å; P207-L211 PolarHBondContact O-N 3.39Å |
| 208 | F | 95.6 | Very high | 89.4 | Confident | 95 Ų | 95 | 55.7 Ų | 55.7 | 42% | 0.417 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -69.5 | -38.9 | 177.8 | -59.4 | -78.2 | 0 | 0 | 0 | 111.9 | F204 F205 L206 L211 L212 F348 | F204-F208 HydrophobicContact CD1-CE2 4.44Å; F204-F208 HydrophobicContact CD2-CE2 4.42Å; F204-F208 HydrophobicContact CE1-CE2 4.01Å; F204-F208 AromaticContact CE2-CE2 3.98Å; F204-F208 HydrophobicContact CE2-CE2 3.98Å; F204-F208 HydrophobicContact CE2-CZ 4.44Å; F204-F208 AromaticContact CZ-CE2 3.75Å; F204-F208 HydrophobicContact CZ-CE2 3.75Å; F204-F208 HydrophobicContact CZ-CZ 4.2Å; F204-F208 WeakPolarHBondContact O-CD2 3.3Å; F204-F208 VanDerWaalsContact O-CE2 3.32Å; F204-F208 WeakPolarHBondContact O-CE2 3.31Å; F205-F208 PolarHBondContact O-N 2.88Å; F205-F208 VanDerWaalsContact O-N 3.14Å; L206-F208 VanDerWaalsContact C-N 3.28Å; L206-F208 PolarHBondContact O-N 3.22Å; F208-L211 PolarHBondContact O-N 2.88Å; F208-L212 VanDerWaalsContact O-CB 3.32Å; F208-L212 WeakPolarHBondContact O-CB 3.18Å; F208-L212 PolarHBondContact O-N 3.02Å; F208-F348 HydrophobicContact CB-CE2 3.84Å; F208-F348 HydrophobicContact CB-CZ 3.87Å |
| 209 | F | 95.6 | Very high | 89.2 | Confident | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -68.7 | -38.1 | 174.3 | -77.3 | -56.4 | 0 | 0 | 0 | 113 | F160 L163 F205 L206 L212 V213 F348 F351 V387 | F160-F209 HydrophobicContact CD1-CD2 4.01Å; F160-F209 AromaticContact CD1-CE2 3.91Å; F160-F209 HydrophobicContact CD1-CE2 3.91Å; F160-F209 HydrophobicContact CD2-CD2 4.46Å; F160-F209 HydrophobicContact CD2-CE2 4.4Å; F160-F209 AromaticContact CE1-CD2 3.44Å; F160-F209 HydrophobicContact CE1-CD2 3.44Å; F160-F209 VanDerWaalsContact CE1-CD2 3.44Å; F160-F209 AromaticContact CE1-CE2 3.84Å; F160-F209 HydrophobicContact CE1-CE2 3.84Å; F160-F209 AromaticContact CE2-CD2 3.94Å; F160-F209 HydrophobicContact CE2-CD2 3.94Å; F160-F209 HydrophobicContact CE2-CE2 4.32Å; F160-F209 HydrophobicContact CG-CD2 4.49Å; F160-F209 HydrophobicContact CG-CE2 4.2Å; F160-F209 HydrophobicContact CZ-CB 4.2Å; F160-F209 AromaticContact CZ-CD2 3.39Å; F160-F209 HydrophobicContact CZ-CD2 3.39Å; F160-F209 HydrophobicContact CZ-CE2 4.05Å; F160-F209 HydrophobicContact CZ-CG 4.13Å; L163-F209 HydrophobicContact CD2-CE2 4.13Å; L163-F209 HydrophobicContact CD2-CZ 3.65Å; F205-F209 HydrophobicContact CB-CD2 3.98Å; F205-F209 HydrophobicContact CB-CE2 3.86Å; F205-F209 WeakPolarHBondContact O-CD2 3.39Å; F205-F209 PolarHBondContact O-N 3.41Å; L206-F209 PolarHBondContact O-N 2.66Å; F209-L212 HydrophobicContact CD1-CD2 4.32Å; F209-L212 PolarHBondContact O-N 2.98Å; F209-V213 WeakPolarHBondContact O-CB 3.49Å; F209-V213 WeakPolarHBondContact O-CG2 3.3Å; F209-V213 PolarHBondContact O-N 3.07Å; F209-F348 AromaticContact CD1-CD2 3.78Å; F209-F348 HydrophobicContact CD1-CD2 3.78Å; F209-F348 AromaticContact CD1-CE2 3.6Å; F209-F348 HydrophobicContact CD1-CE2 3.6Å; F209-F348 AromaticContact CE1-CD2 3.31Å; F209-F348 HydrophobicContact CE1-CD2 3.31Å; F209-F348 AromaticContact CE1-CE2 3.67Å; F209-F348 HydrophobicContact CE1-CE2 3.67Å; F209-F348 HydrophobicContact CE1-CG 4.21Å; F209-F348 HydrophobicContact CE2-CD2 4.48Å; F209-F348 HydrophobicContact CG-CE2 4.12Å; F209-F348 AromaticContact CZ-CD2 3.75Å; F209-F348 HydrophobicContact CZ-CD2 3.75Å; F209-F348 HydrophobicContact CZ-CE2 4.27Å; F209-F351 HydrophobicContact CB-CD1 4.5Å; F209-F351 HydrophobicContact CB-CE1 4.09Å; F209-F351 HydrophobicContact CB-CZ 4.25Å; F209-F351 HydrophobicContact CD1-CB 3.87Å; F209-F351 AromaticContact CD1-CD1 3.46Å; F209-F351 HydrophobicContact CD1-CD1 3.46Å; F209-F351 VanDerWaalsContact CD1-CD1 3.46Å; F209-F351 AromaticContact CD1-CD2 3.76Å; F209-F351 HydrophobicContact CD1-CD2 3.76Å; F209-F351 AromaticContact CD1-CE1 3.87Å; F209-F351 HydrophobicContact CD1-CE1 3.87Å; F209-F351 HydrophobicContact CD1-CE2 4.12Å; F209-F351 AromaticContact CD1-CG 3.43Å; F209-F351 HydrophobicContact CD1-CG 3.43Å; F209-F351 VanDerWaalsContact CD1-CG 3.43Å; F209-F351 HydrophobicContact CD1-CZ 4.18Å; F209-F351 HydrophobicContact CD2-CE2 4.49Å; F209-F351 HydrophobicContact CE1-CB 3.38Å; F209-F351 AromaticContact CE1-CD1 3.9Å; F209-F351 HydrophobicContact CE1-CD1 3.9Å; F209-F351 AromaticContact CE1-CD2 3.51Å; F209-F351 HydrophobicContact CE1-CD2 3.51Å; F209-F351 HydrophobicContact CE1-CE2 4.22Å; F209-F351 AromaticContact CE1-CG 3.33Å; F209-F351 HydrophobicContact CE1-CG 3.33Å; F209-F351 HydrophobicContact CE2-CD2 4.4Å; F209-F351 HydrophobicContact CG-CD1 4.21Å; F209-F351 HydrophobicContact CG-CD2 4.32Å; F209-F351 HydrophobicContact CG-CE1 4.15Å; F209-F351 HydrophobicContact CG-CE2 4.25Å; F209-F351 HydrophobicContact CG-CG 4.32Å; F209-F351 HydrophobicContact CG-CZ 4.18Å; F209-F351 HydrophobicContact CZ-CB 4.28Å; F209-F351 AromaticContact CZ-CD2 3.84Å; F209-F351 HydrophobicContact CZ-CD2 3.84Å; F209-F351 HydrophobicContact CZ-CE2 4.4Å; F209-F351 HydrophobicContact CZ-CG 4.13Å; F209-V387 HydrophobicContact CB-CG1 3.89Å |
| 210 | I | 95.3 | Very high | 88.8 | Confident | 29 Ų | 29 | 66.2 Ų | 66.2 | 15% | 0.149 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -59.3 | -50.1 | 173.3 | -68.1 | 165.2 | 0 | 0 | 0 | 109.9 | L206 P207 L212 V213 F214 T384 V387 I388 | L206-I210 HydrophobicContact CD1-CD1 3.79Å; L206-I210 HydrophobicContact CD1-CG1 4.14Å; L206-I210 HydrophobicContact CG-CD1 3.94Å; L206-I210 WeakPolarHBondContact O-CG1 3.36Å; L206-I210 PolarHBondContact O-N 3.19Å; P207-I210 PolarHBondContact O-N 2.83Å; I210-L212 VanDerWaalsContact C-N 3.32Å; I210-L212 PolarHBondContact O-N 3.32Å; I210-V213 PolarHBondContact O-N 3.42Å; I210-F214 HydrophobicContact CG2-CE1 3.82Å; I210-F214 HydrophobicContact CG2-CE2 3.81Å; I210-F214 HydrophobicContact CG2-CZ 3.41Å; I210-F214 VanDerWaalsContact CG2-CZ 3.41Å; I210-F214 WeakPolarHBondContact O-CD1 3.37Å; I210-F214 WeakPolarHBondContact O-CG 3.5Å; I210-F214 PolarHBondContact O-N 2.78Å; I210-F214 VanDerWaalsContact O-N 3.16Å; I210-T384 HydrophobicContact CD1-CG2 4.1Å; I210-T384 HydrophobicContact CG1-CG2 4.36Å; I210-T384 HydrophobicContact CG2-CG2 4.17Å; I210-V387 HydrophobicContact CG1-CB 4.14Å; I210-V387 HydrophobicContact CG1-CG1 3.87Å; I210-I388 HydrophobicContact CD1-CG1 4.48Å |
| 211 | L | 93.5 | Very high | 88.5 | Confident | 120 Ų | 120 | 62.2 Ų | 62.2 | 63% | 0.628 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -59.9 | -40.6 | 177.2 | -178.3 | 64 | 0 | 0 | 0 | 112.5 | P207 F208 F214 | P207-L211 WeakPolarHBondContact O-CB 3.29Å; P207-L211 PolarHBondContact O-N 3.39Å; F208-L211 PolarHBondContact O-N 2.88Å; L211-F214 PolarHBondContact O-N 2.82Å |
| 212 | L | 91.9 | Very high | 88.1 | Confident | 20 Ų | 20 | 63.7 Ų | 63.7 | 11% | 0.105 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -63 | -46.1 | 178.4 | -171.5 | 72.9 | 0 | 0 | 0 | 111.5 | F208 F209 I210 F214 T215 L221 F348 I349 A352 | F208-L212 VanDerWaalsContact O-CB 3.32Å; F208-L212 WeakPolarHBondContact O-CB 3.18Å; F208-L212 PolarHBondContact O-N 3.02Å; F209-L212 HydrophobicContact CD1-CD2 4.32Å; F209-L212 PolarHBondContact O-N 2.98Å; I210-L212 VanDerWaalsContact C-N 3.32Å; I210-L212 PolarHBondContact O-N 3.32Å; L212-F214 VanDerWaalsContact C-N 3.27Å; L212-F214 PolarHBondContact O-N 3.4Å; L212-T215 VanDerWaalsContact O-CB 3.31Å; L212-T215 WeakPolarHBondContact O-CB 3.45Å; L212-T215 PolarHBondContact O-N 3.03Å; L212-T215 VanDerWaalsContact O-N 3.12Å; L212-T215 PolarHBondContact O-OG1 3.35Å; L212-L221 HydrophobicContact CD1-CD1 3.92Å; L212-F348 HydrophobicContact CB-CZ 4.15Å; L212-F348 HydrophobicContact CD1-CE1 3.93Å; L212-F348 HydrophobicContact CD1-CZ 4.37Å; L212-F348 HydrophobicContact CD2-CD1 4.24Å; L212-F348 HydrophobicContact CD2-CE1 3.92Å; L212-F348 HydrophobicContact CD2-CE2 4.37Å; L212-F348 HydrophobicContact CD2-CZ 3.97Å; L212-F348 WeakPolarHBondContact CD2-O 3.3Å; L212-F348 HydrophobicContact CG-CE1 4.35Å; L212-F348 HydrophobicContact CG-CZ 4.39Å; L212-I349 HydrophobicContact CD1-CD1 4.43Å; L212-A352 HydrophobicContact CD2-CB 3.68Å; L212-A352 HydrophobicContact CG-CB 3.8Å |
| 213 | V | 90.9 | Very high | 87.9 | Confident | 5 Ų | 5 | 67.5 Ų | 67.5 | 3% | 0.03 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -68 | -23.9 | -178.8 | 164.9 | 0 | 0 | 0 | 0 | 113.2 | F209 I210 T215 F351 F355 R383 V387 | F209-V213 WeakPolarHBondContact O-CB 3.49Å; F209-V213 WeakPolarHBondContact O-CG2 3.3Å; F209-V213 PolarHBondContact O-N 3.07Å; I210-V213 PolarHBondContact O-N 3.42Å; V213-T215 PolarHBondContact O-N 3.37Å; V213-F351 HydrophobicContact CG2-CD1 4.16Å; V213-F351 HydrophobicContact CG2-CE1 3.76Å; V213-F355 HydrophobicContact CB-CD1 4.28Å; V213-F355 HydrophobicContact CB-CE1 4.31Å; V213-F355 HydrophobicContact CG1-CD1 3.53Å; V213-F355 HydrophobicContact CG1-CE1 3.19Å; V213-F355 HydrophobicContact CG1-CG 4.38Å; V213-F355 HydrophobicContact CG1-CZ 3.75Å; V213-F355 HydrophobicContact CG2-CB 4.28Å; V213-F355 HydrophobicContact CG2-CD1 3.68Å; V213-F355 HydrophobicContact CG2-CD2 4.23Å; V213-F355 HydrophobicContact CG2-CE1 4.1Å; V213-F355 HydrophobicContact CG2-CG 3.78Å; V213-R383 HydrophobicContact CG1-CB 3.72Å; V213-R383 HydrophobicContact CG1-CG 3.85Å; V213-V387 HydrophobicContact CB-CG2 4.23Å; V213-V387 HydrophobicContact CG1-CG2 4.29Å; V213-V387 HydrophobicContact CG2-CG2 3.86Å |
| 214 | F | 90.7 | Very high | 87.6 | Confident | 73 Ų | 73 | 67.2 Ų | 67.2 | 32% | 0.32 | 35% | 0.348 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | -9.8 | 171.8 | -68.5 | -10.5 | 0 | 0 | 0 | 113.9 | I210 L211 L212 P216 L380 T384 | I210-F214 HydrophobicContact CG2-CE1 3.82Å; I210-F214 HydrophobicContact CG2-CE2 3.81Å; I210-F214 HydrophobicContact CG2-CZ 3.41Å; I210-F214 VanDerWaalsContact CG2-CZ 3.41Å; I210-F214 WeakPolarHBondContact O-CD1 3.37Å; I210-F214 WeakPolarHBondContact O-CG 3.5Å; I210-F214 PolarHBondContact O-N 2.78Å; I210-F214 VanDerWaalsContact O-N 3.16Å; L211-F214 PolarHBondContact O-N 2.82Å; L212-F214 VanDerWaalsContact C-N 3.27Å; L212-F214 PolarHBondContact O-N 3.4Å; F214-P216 WeakPolarHBondContact O-CD 3.14Å; F214-P216 WeakPolarHBondContact O-CG 3.41Å; F214-L380 HydrophobicContact CB-CD2 4.16Å; F214-L380 HydrophobicContact CD1-CD2 3.49Å; F214-L380 VanDerWaalsContact CD1-CD2 3.49Å; F214-L380 HydrophobicContact CD2-CD2 4.35Å; F214-L380 HydrophobicContact CE1-CB 4.36Å; F214-L380 HydrophobicContact CE1-CD2 3.87Å; F214-L380 HydrophobicContact CG-CD2 3.76Å; F214-L380 HydrophobicContact CZ-CD2 4.44Å; F214-T384 VanDerWaalsContact CE1-OG1 3.23Å; F214-T384 WeakPolarHBondContact CE1-OG1 3.38Å; F214-T384 VanDerWaalsContact CZ-OG1 3.29Å; F214-T384 WeakPolarHBondContact CZ-OG1 3.45Å |
| 215 | T | 82.4 | Confident | 87.3 | Confident | 45 Ų | 45 | 62.2 Ų | 62.2 | 28% | 0.276 | 33% | 0.326 | S | S | . | . | trans | -78.7 | 101 | 172.7 | -55.8 | 0 | 0 | 0 | 0 | 109.9 | L212 V213 N217 F220 | L212-T215 VanDerWaalsContact O-CB 3.31Å; L212-T215 WeakPolarHBondContact O-CB 3.45Å; L212-T215 PolarHBondContact O-N 3.03Å; L212-T215 VanDerWaalsContact O-N 3.12Å; L212-T215 PolarHBondContact O-OG1 3.35Å; V213-T215 PolarHBondContact O-N 3.37Å; T215-N217 VanDerWaalsContact C-N 3.34Å; T215-F220 HydrophobicContact CG2-CB 4.21Å; T215-F220 HydrophobicContact CG2-CD1 3.99Å; T215-F220 HydrophobicContact CG2-CG 4.49Å | ||
| 216 | P | 65.8 | Low | 87 | Confident | 77 Ų | 77 | 66.6 Ų | 66.6 | 50% | 0.5 | 35% | 0.35 | S | S | . | . | trans | -80.4 | -25.4 | -173.8 | -6.5 | 27.4 | 0 | 0 | 0 | 110.9 | F214 L218 | F214-P216 WeakPolarHBondContact O-CD 3.14Å; F214-P216 WeakPolarHBondContact O-CG 3.41Å; P216-L218 PolarHBondContact O-N 3.47Å | ||
| 217 | N | 72.9 | Confident | 86.8 | Confident | 111 Ų | 111 | 69.5 Ų | 69.5 | 59% | 0.594 | 37% | 0.365 | S | S | * | . | trans | -88.4 | 92.5 | -176.6 | -74.3 | -58.6 | 0 | 0 | 0 | 110.7 | T215 K219 F220 | T215-N217 VanDerWaalsContact C-N 3.34Å; N217-K219 PolarHBondContact O-N 3.5Å; N217-F220 WeakPolarHBondContact O-CB 3.41Å; N217-F220 PolarHBondContact O-N 2.88Å | ||
| 218 | L | 73.6 | Confident | 86.5 | Confident | 57 Ų | 57 | 65.9 Ų | 65.9 | 30% | 0.298 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -51.6 | -22.4 | 172 | -64.3 | -175.4 | 0 | 0 | 0 | 114 | P216 F220 L221 A222 L353 Y356 | P216-L218 PolarHBondContact O-N 3.47Å; L218-F220 VanDerWaalsContact C-N 3.29Å; L218-F220 PolarHBondContact O-N 3.3Å; L218-L221 CarbonylContact O-C 3.6Å; L218-L221 PolarHBondContact O-N 3.4Å; L218-L221 VanDerWaalsContact O-N 3.13Å; L218-A222 PolarHBondContact O-N 3.39Å; L218-L353 HydrophobicContact CD2-CD2 4.09Å; L218-Y356 HydrophobicContact CD1-CD1 3.67Å; L218-Y356 HydrophobicContact CD1-CD2 3.95Å; L218-Y356 HydrophobicContact CD1-CE1 3.68Å; L218-Y356 HydrophobicContact CD1-CE2 4Å; L218-Y356 HydrophobicContact CD1-CG 3.8Å; L218-Y356 HydrophobicContact CD2-CD2 4.05Å; L218-Y356 HydrophobicContact CD2-CG 4.19Å; L218-Y356 HydrophobicContact CG-CD2 4.05Å; L218-Y356 HydrophobicContact CG-CE2 4.15Å; L218-Y356 HydrophobicContact CG-CG 4.31Å |
| 219 | K | 78.9 | Confident | 86.2 | Confident | 182 Ų | 182 | 63.2 Ų | 63.2 | 79% | 0.791 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -57.7 | -37.8 | 172 | -65.8 | -176.2 | -178.8 | 177.5 | 0 | 113 | N217 L221 A222 | N217-K219 PolarHBondContact O-N 3.5Å; K219-L221 VanDerWaalsContact C-N 3.32Å; K219-A222 WeakPolarHBondContact O-CB 3.48Å; K219-A222 PolarHBondContact O-N 2.79Å |
| 220 | F | 82.8 | Confident | 86 | Confident | 128 Ų | 128 | 67.5 Ų | 67.5 | 56% | 0.561 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -69.1 | -34.2 | 175.8 | -177.4 | -98.8 | 0 | 0 | 0 | 111.5 | T215 N217 L218 P223 F224 | T215-F220 HydrophobicContact CG2-CB 4.21Å; T215-F220 HydrophobicContact CG2-CD1 3.99Å; T215-F220 HydrophobicContact CG2-CG 4.49Å; N217-F220 WeakPolarHBondContact O-CB 3.41Å; N217-F220 PolarHBondContact O-N 2.88Å; L218-F220 VanDerWaalsContact C-N 3.29Å; L218-F220 PolarHBondContact O-N 3.3Å; F220-P223 WeakPolarHBondContact O-CD 3.19Å; F220-F224 HydrophobicContact CD1-CE2 4.4Å; F220-F224 AromaticContact CE1-CE2 3.87Å; F220-F224 HydrophobicContact CE1-CE2 3.87Å; F220-F224 HydrophobicContact CZ-CE2 4.04Å; F220-F224 WeakPolarHBondContact O-CD2 3.39Å |
| 221 | L | 83.9 | Confident | 85.8 | Confident | 7 Ų | 7 | 67.2 Ų | 67.2 | 4% | 0.037 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -79.9 | -15.1 | 179.3 | -144.7 | 76.7 | 0 | 0 | 0 | 113.7 | L212 L218 K219 F224 S225 I349 A352 L353 | L212-L221 HydrophobicContact CD1-CD1 3.92Å; L218-L221 CarbonylContact O-C 3.6Å; L218-L221 PolarHBondContact O-N 3.4Å; L218-L221 VanDerWaalsContact O-N 3.13Å; K219-L221 VanDerWaalsContact C-N 3.32Å; L221-F224 PolarHBondContact O-N 2.94Å; L221-S225 VanDerWaalsContact O-CB 3.28Å; L221-S225 WeakPolarHBondContact O-CB 3.31Å; L221-S225 PolarHBondContact O-N 3.45Å; L221-I349 HydrophobicContact CD2-CG2 4.16Å; L221-I349 HydrophobicContact CG-CG2 4.14Å; L221-A352 HydrophobicContact CD2-CB 3.62Å; L221-L353 HydrophobicContact CD2-CD2 4.29Å |
| 222 | A | 85.1 | Confident | 85.8 | Confident | 55 Ų | 55 | 62.2 Ų | 62.2 | 46% | 0.455 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -55.9 | -50.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | L218 K219 S225 L226 | L218-A222 PolarHBondContact O-N 3.39Å; K219-A222 WeakPolarHBondContact O-CB 3.48Å; K219-A222 PolarHBondContact O-N 2.79Å; A222-S225 PolarHBondContact O-N 3.28Å; A222-L226 PolarHBondContact O-N 3.24Å |
| 223 | P | 88.4 | Confident | 85.7 | Confident | 81 Ų | 81 | 65 Ų | 65 | 53% | 0.526 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -64.4 | -43.6 | 177.6 | 24.1 | -34.7 | 0 | 0 | 0 | 112.7 | F220 S225 L226 L227 | F220-P223 WeakPolarHBondContact O-CD 3.19Å; P223-S225 VanDerWaalsContact C-N 3.28Å; P223-S225 PolarHBondContact O-N 3.31Å; P223-L226 PolarHBondContact O-N 3.45Å; P223-L227 PolarHBondContact O-N 3.02Å |
| 224 | F | 89.6 | Confident | 85.9 | Confident | 87 Ų | 87 | 69.4 Ų | 69.4 | 38% | 0.382 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -60.1 | -40.6 | 174.8 | -64.9 | -75.4 | 0 | 0 | 0 | 111.6 | F220 L221 L227 A228 I349 | F220-F224 HydrophobicContact CD1-CE2 4.4Å; F220-F224 AromaticContact CE1-CE2 3.87Å; F220-F224 HydrophobicContact CE1-CE2 3.87Å; F220-F224 HydrophobicContact CZ-CE2 4.04Å; F220-F224 WeakPolarHBondContact O-CD2 3.39Å; L221-F224 PolarHBondContact O-N 2.94Å; F224-L227 PolarHBondContact O-N 2.98Å; F224-A228 VanDerWaalsContact O-CB 3.27Å; F224-A228 WeakPolarHBondContact O-CB 3.47Å; F224-A228 PolarHBondContact O-N 3.23Å; F224-I349 HydrophobicContact CB-CD1 4.12Å; F224-I349 HydrophobicContact CB-CG1 4.45Å; F224-I349 HydrophobicContact CB-CG2 4.3Å |
| 225 | S | 87.6 | Confident | 86 | Confident | 4 Ų | 4 | 66 Ų | 66 | 3% | 0.028 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -69.4 | -34.9 | 177.6 | -169.2 | 0 | 0 | 0 | 0 | 112.4 | K61 L221 A222 P223 A228 N229 L353 | K61-S225 PolarHBondContact NZ-OG 3.11Å; L221-S225 VanDerWaalsContact O-CB 3.28Å; L221-S225 WeakPolarHBondContact O-CB 3.31Å; L221-S225 PolarHBondContact O-N 3.45Å; A222-S225 PolarHBondContact O-N 3.28Å; P223-S225 VanDerWaalsContact C-N 3.28Å; P223-S225 PolarHBondContact O-N 3.31Å; S225-A228 PolarHBondContact O-N 3.4Å; S225-N229 PolarHBondContact O-N 2.96Å; S225-N229 PolarHBondContact O-ND2 2.86Å; S225-N229 PolarHBondContact O-OD1 3.49Å; S225-L353 WeakPolarHBondContact OG-CD1 3.44Å |
| 226 | L | 88.8 | Confident | 86.6 | Confident | 118 Ų | 118 | 64.7 Ų | 64.7 | 62% | 0.618 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -63 | -47.8 | 172.9 | -176.8 | 146.4 | 0 | 0 | 0 | 110.9 | A222 P223 N229 V230 | A222-L226 PolarHBondContact O-N 3.24Å; P223-L226 PolarHBondContact O-N 3.45Å; L226-N229 PolarHBondContact O-N 3.45Å; L226-V230 PolarHBondContact O-N 3.23Å; L226-V230 VanDerWaalsContact O-N 3.16Å |
| 227 | L | 91.9 | Very high | 87.9 | Confident | 90 Ų | 90 | 65.2 Ų | 65.2 | 47% | 0.471 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -58.7 | -47.9 | 175.2 | 179.7 | 61.6 | 0 | 0 | 0 | 111.4 | P223 F224 N229 V230 V231 F345 | P223-L227 PolarHBondContact O-N 3.02Å; F224-L227 PolarHBondContact O-N 2.98Å; L227-N229 VanDerWaalsContact C-N 3.32Å; L227-N229 PolarHBondContact O-N 2.82Å; L227-V230 PolarHBondContact O-N 3.2Å; L227-V231 HydrophobicContact CD1-CG2 4.05Å; L227-V231 HydrophobicContact CG-CG2 4.33Å; L227-V231 WeakPolarHBondContact O-CB 3.24Å; L227-V231 VanDerWaalsContact O-CG2 3.27Å; L227-V231 WeakPolarHBondContact O-CG2 3.17Å; L227-V231 PolarHBondContact O-N 3.17Å; L227-F345 HydrophobicContact CD2-CE1 4.45Å |
| 228 | A | 90.6 | Very high | 89 | Confident | 0 Ų | 0 | 62.4 Ų | 62.4 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -53 | -44.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | F224 S225 V231 M232 F345 I349 | F224-A228 VanDerWaalsContact O-CB 3.27Å; F224-A228 WeakPolarHBondContact O-CB 3.47Å; F224-A228 PolarHBondContact O-N 3.23Å; S225-A228 PolarHBondContact O-N 3.4Å; A228-V231 PolarHBondContact O-N 3.37Å; A228-M232 WeakPolarHBondContact O-CB 3.41Å; A228-M232 WeakPolarHBondContact O-CG 3.48Å; A228-M232 PolarHBondContact O-N 2.83Å; A228-F345 HydrophobicContact CB-CE1 4.39Å; A228-I349 HydrophobicContact CB-CB 4.14Å; A228-I349 HydrophobicContact CB-CG1 4.42Å; A228-I349 HydrophobicContact CB-CG2 4.37Å |
| 229 | N | 89.3 | Confident | 90 | Very high | 39 Ų | 39 | 59.7 Ų | 59.7 | 21% | 0.209 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66.8 | -41.6 | 179.7 | -55.6 | -37.8 | 0 | 0 | 0 | 111.8 | K61 S225 L226 L227 V231 T233 | K61-N229 WeakPolarHBondContact CE-ND2 3.46Å; K61-N229 WeakPolarHBondContact CE-OD1 3.3Å; S225-N229 PolarHBondContact O-N 2.96Å; S225-N229 PolarHBondContact O-ND2 2.86Å; S225-N229 PolarHBondContact O-OD1 3.49Å; L226-N229 PolarHBondContact O-N 3.45Å; L227-N229 VanDerWaalsContact C-N 3.32Å; L227-N229 PolarHBondContact O-N 2.82Å; N229-V231 VanDerWaalsContact C-N 3.33Å; N229-T233 VanDerWaalsContact O-CB 3.32Å; N229-T233 WeakPolarHBondContact O-CB 3.28Å; N229-T233 PolarHBondContact O-N 2.98Å; N229-T233 PolarHBondContact O-OG1 3.06Å |
| 230 | V | 91.9 | Very high | 90.7 | Very high | 89 Ų | 89 | 53.8 Ų | 53.8 | 54% | 0.539 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.1 | -46.1 | 176.5 | 172.7 | 0 | 0 | 0 | 0 | 110.3 | L226 L227 T233 L234 | L226-V230 PolarHBondContact O-N 3.23Å; L226-V230 VanDerWaalsContact O-N 3.16Å; L227-V230 PolarHBondContact O-N 3.2Å; V230-T233 PolarHBondContact O-N 3.38Å; V230-L234 PolarHBondContact O-N 3.28Å |
| 231 | V | 92.2 | Very high | 91.2 | Very high | 23 Ų | 23 | 51.4 Ų | 51.4 | 14% | 0.139 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -66 | -44.1 | -179.7 | 169.2 | 0 | 0 | 0 | 0 | 112.1 | L227 A228 N229 T233 L234 S235 L342 | L227-V231 HydrophobicContact CD1-CG2 4.05Å; L227-V231 HydrophobicContact CG-CG2 4.33Å; L227-V231 WeakPolarHBondContact O-CB 3.24Å; L227-V231 VanDerWaalsContact O-CG2 3.27Å; L227-V231 WeakPolarHBondContact O-CG2 3.17Å; L227-V231 PolarHBondContact O-N 3.17Å; A228-V231 PolarHBondContact O-N 3.37Å; N229-V231 VanDerWaalsContact C-N 3.33Å; V231-T233 VanDerWaalsContact C-N 3.35Å; V231-L234 PolarHBondContact O-N 3.48Å; V231-S235 VanDerWaalsContact O-CB 3.28Å; V231-S235 WeakPolarHBondContact O-CB 3.5Å; V231-S235 PolarHBondContact O-N 2.88Å; V231-S235 PolarHBondContact O-OG 2.93Å; V231-L342 HydrophobicContact CG1-CB 3.46Å; V231-L342 VanDerWaalsContact CG1-CB 3.46Å; V231-L342 HydrophobicContact CG1-CD1 4.39Å; V231-L342 HydrophobicContact CG1-CD2 3.63Å; V231-L342 HydrophobicContact CG1-CG 3.99Å; V231-L342 WeakPolarHBondContact CG1-O 3.46Å |
| 232 | M | 91.6 | Very high | 91.7 | Very high | 15 Ų | 15 | 52.4 Ų | 52.4 | 7% | 0.074 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -64 | -38.7 | 173.3 | -73.3 | -173.8 | -63.5 | 0 | 0 | 111.9 | A228 S235 L236 Y343 G346 I347 | A228-M232 WeakPolarHBondContact O-CB 3.41Å; A228-M232 WeakPolarHBondContact O-CG 3.48Å; A228-M232 PolarHBondContact O-N 2.83Å; M232-S235 PolarHBondContact O-N 3.31Å; M232-L236 WeakPolarHBondContact O-CB 3.4Å; M232-L236 PolarHBondContact O-N 3.28Å; M232-Y343 HydrophobicContact CB-CE2 4.37Å; M232-Y343 HydrophobicContact CG-CD1 4.13Å; M232-Y343 HydrophobicContact CG-CE1 4.11Å; M232-Y343 HydrophobicContact CG-CG 4.38Å; M232-Y343 HydrophobicContact SD-CD1 4.3Å; M232-Y343 HydrophobicContact SD-CE1 3.97Å; M232-G346 VanDerWaalsContact SD-C 3.54Å; M232-I347 HydrophobicContact SD-CD1 3.99Å; M232-I347 HydrophobicContact SD-CG1 4.41Å |
| 233 | T | 91.6 | Very high | 92.1 | Very high | 80 Ų | 80 | 49.8 Ų | 49.8 | 49% | 0.491 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -64.4 | -46.4 | 177.7 | -56.6 | 0 | 0 | 0 | 0 | 111.1 | N229 V230 V231 S235 L236 I237 | N229-T233 VanDerWaalsContact O-CB 3.32Å; N229-T233 WeakPolarHBondContact O-CB 3.28Å; N229-T233 PolarHBondContact O-N 2.98Å; N229-T233 PolarHBondContact O-OG1 3.06Å; V230-T233 PolarHBondContact O-N 3.38Å; V231-T233 VanDerWaalsContact C-N 3.35Å; T233-S235 VanDerWaalsContact C-N 3.34Å; T233-S235 PolarHBondContact O-N 3.01Å; T233-L236 PolarHBondContact O-N 3.45Å; T233-I237 HydrophobicContact CG2-CD1 4.12Å; T233-I237 VanDerWaalsContact O-CG1 3.3Å; T233-I237 WeakPolarHBondContact O-CG1 3.25Å; T233-I237 PolarHBondContact O-N 3.46Å |
| 234 | L | 93.6 | Very high | 92.4 | Very high | 96 Ų | 96 | 50 Ų | 50 | 50% | 0.503 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -61.1 | -43.6 | 174.8 | 178.6 | 61.1 | 0 | 0 | 0 | 111.7 | V230 V231 L236 I237 L238 | V230-L234 PolarHBondContact O-N 3.28Å; V231-L234 PolarHBondContact O-N 3.48Å; L234-L236 PolarHBondContact O-N 2.9Å; L234-I237 PolarHBondContact O-N 3.38Å; L234-L238 HydrophobicContact CG-CD1 4.44Å; L234-L238 WeakPolarHBondContact O-CG 3.23Å; L234-L238 PolarHBondContact O-N 3.48Å |
| 235 | S | 94.1 | Very high | 92.5 | Very high | 1 Ų | 1 | 53.1 Ų | 53.1 | 1% | 0.007 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.8 | -43.5 | 177.1 | -61.1 | 0 | 0 | 0 | 0 | 111.7 | V231 M232 T233 L238 I239 | V231-S235 VanDerWaalsContact O-CB 3.28Å; V231-S235 WeakPolarHBondContact O-CB 3.5Å; V231-S235 PolarHBondContact O-N 2.88Å; V231-S235 PolarHBondContact O-OG 2.93Å; M232-S235 PolarHBondContact O-N 3.31Å; T233-S235 VanDerWaalsContact C-N 3.34Å; T233-S235 PolarHBondContact O-N 3.01Å; S235-L238 PolarHBondContact O-N 3.47Å; S235-I239 VanDerWaalsContact O-CG1 3.27Å; S235-I239 WeakPolarHBondContact O-CG1 3.42Å; S235-I239 PolarHBondContact O-N 3.19Å |
| 236 | L | 93.7 | Very high | 92.6 | Very high | 18 Ų | 18 | 55.6 Ų | 55.6 | 9% | 0.094 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -63.8 | -40.3 | 175.4 | -176.7 | 63.3 | 0 | 0 | 0 | 112.3 | I64 L68 L69 M232 T233 L234 I239 Y240 L306 L310 Y343 | I64-L236 HydrophobicContact CG2-CD2 4.48Å; L68-L236 HydrophobicContact CD2-CD1 4.02Å; L68-L236 HydrophobicContact CD2-CD2 3.77Å; L69-L236 HydrophobicContact CD2-CD1 4.47Å; M232-L236 WeakPolarHBondContact O-CB 3.4Å; M232-L236 PolarHBondContact O-N 3.28Å; T233-L236 PolarHBondContact O-N 3.45Å; L234-L236 PolarHBondContact O-N 2.9Å; L236-I239 PolarHBondContact O-N 3.27Å; L236-Y240 WeakPolarHBondContact O-CB 3.38Å; L236-Y240 PolarHBondContact O-N 2.84Å; L236-L306 HydrophobicContact CD2-CD1 4.38Å; L236-L306 HydrophobicContact CD2-CD2 4.2Å; L236-L310 HydrophobicContact CD1-CD1 4.38Å; L236-L310 HydrophobicContact CD1-CD2 3.96Å; L236-Y343 HydrophobicContact CB-CE2 4.37Å |
| 237 | I | 94.7 | Very high | 92.7 | Very high | 88 Ų | 88 | 52.3 Ų | 52.3 | 45% | 0.451 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -61.6 | -43.8 | 175 | -70 | 163.7 | 0 | 0 | 0 | 110.8 | T233 L234 Y240 I241 | T233-I237 HydrophobicContact CG2-CD1 4.12Å; T233-I237 VanDerWaalsContact O-CG1 3.3Å; T233-I237 WeakPolarHBondContact O-CG1 3.25Å; T233-I237 PolarHBondContact O-N 3.46Å; L234-I237 PolarHBondContact O-N 3.38Å; I237-Y240 WeakPolarHBondContact O-CB 3.38Å; I237-Y240 PolarHBondContact O-N 2.66Å; I237-I241 HydrophobicContact CG2-CD1 3.8Å; I237-I241 HydrophobicContact CG2-CG1 4.45Å; I237-I241 WeakPolarHBondContact O-CG1 3.46Å; I237-I241 PolarHBondContact O-N 3.45Å |
| 238 | L | 94.7 | Very high | 92.4 | Very high | 53 Ų | 53 | 55.6 Ų | 55.6 | 28% | 0.277 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -64.9 | -39.9 | 177.6 | -69.4 | 172.3 | 0 | 0 | 0 | 112.3 | L234 S235 Y240 I241 Y242 V339 | L234-L238 HydrophobicContact CG-CD1 4.44Å; L234-L238 WeakPolarHBondContact O-CG 3.23Å; L234-L238 PolarHBondContact O-N 3.48Å; S235-L238 PolarHBondContact O-N 3.47Å; L238-Y240 VanDerWaalsContact C-N 3.32Å; L238-Y240 PolarHBondContact O-N 2.87Å; L238-I241 PolarHBondContact O-N 3.38Å; L238-Y242 WeakPolarHBondContact O-CB 3.47Å; L238-Y242 PolarHBondContact O-N 3.23Å; L238-V339 HydrophobicContact CB-CG2 4.04Å; L238-V339 HydrophobicContact CD1-CG2 3.62Å; L238-V339 HydrophobicContact CG-CG2 4.49Å |
| 239 | I | 94.4 | Very high | 92.1 | Very high | 0 Ų | 0 | 62.6 Ų | 62.6 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -60.2 | -43.2 | 172.2 | -67.2 | 163.6 | 0 | 0 | 0 | 110.7 | S235 L236 Y242 S243 L310 I326 T327 L330 V339 Y343 | S235-I239 VanDerWaalsContact O-CG1 3.27Å; S235-I239 WeakPolarHBondContact O-CG1 3.42Å; S235-I239 PolarHBondContact O-N 3.19Å; L236-I239 PolarHBondContact O-N 3.27Å; I239-Y242 PolarHBondContact O-N 3Å; I239-S243 WeakPolarHBondContact O-CB 3.48Å; I239-S243 PolarHBondContact O-N 2.97Å; I239-S243 PolarHBondContact O-OG 2.91Å; I239-L310 HydrophobicContact CG2-CD1 4.42Å; I239-I326 HydrophobicContact CG2-CD1 3.7Å; I239-I326 HydrophobicContact CG2-CG1 4.03Å; I239-I326 HydrophobicContact CG2-CG2 4Å; I239-T327 HydrophobicContact CD1-CG2 3.78Å; I239-L330 HydrophobicContact CD1-CD1 4.4Å; I239-L330 HydrophobicContact CG1-CD1 3.94Å; I239-L330 HydrophobicContact CG1-CD2 4.2Å; I239-V339 HydrophobicContact CD1-CG1 4.05Å; I239-V339 HydrophobicContact CG1-CG1 3.94Å; I239-Y343 HydrophobicContact CD1-CD2 4.4Å |
| 240 | Y | 94.4 | Very high | 91.9 | Very high | 58 Ų | 58 | 66.3 Ų | 66.3 | 23% | 0.227 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -65.7 | -44.8 | -179.3 | -157.6 | -90.8 | 0 | 0 | 0 | 112 | L236 I237 L238 S243 L244 S309 L310 I313 | L236-Y240 WeakPolarHBondContact O-CB 3.38Å; L236-Y240 PolarHBondContact O-N 2.84Å; I237-Y240 WeakPolarHBondContact O-CB 3.38Å; I237-Y240 PolarHBondContact O-N 2.66Å; L238-Y240 VanDerWaalsContact C-N 3.32Å; L238-Y240 PolarHBondContact O-N 2.87Å; Y240-S243 PolarHBondContact O-N 3.32Å; Y240-L244 HydrophobicContact CD1-CD1 3.71Å; Y240-L244 HydrophobicContact CD1-CG 4.28Å; Y240-L244 HydrophobicContact CE1-CD1 3.67Å; Y240-L244 HydrophobicContact CE1-CG 4.29Å; Y240-L244 WeakPolarHBondContact O-CG 3.29Å; Y240-L244 PolarHBondContact O-N 2.84Å; Y240-S309 VanDerWaalsContact OH-CB 3.32Å; Y240-S309 WeakPolarHBondContact OH-CB 3.47Å; Y240-S309 PolarHBondContact OH-OG 3.44Å; Y240-L310 HydrophobicContact CD2-CD1 3.8Å; Y240-L310 HydrophobicContact CE2-CD1 4.47Å; Y240-I313 HydrophobicContact CE1-CD1 4.09Å; Y240-I313 HydrophobicContact CE2-CD1 3.89Å; Y240-I313 VanDerWaalsContact CZ-CD1 3.5Å; Y240-I313 VanDerWaalsContact OH-CD1 3.31Å; Y240-I313 WeakPolarHBondContact OH-CD1 3.46Å |
| 241 | I | 94.1 | Very high | 91.8 | Very high | 78 Ų | 78 | 65.3 Ų | 65.3 | 40% | 0.4 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.2 | -49.3 | 175 | -68.4 | 166.7 | 0 | 0 | 0 | 110.4 | I237 L238 S243 L244 M245 | I237-I241 HydrophobicContact CG2-CD1 3.8Å; I237-I241 HydrophobicContact CG2-CG1 4.45Å; I237-I241 WeakPolarHBondContact O-CG1 3.46Å; I237-I241 PolarHBondContact O-N 3.45Å; L238-I241 PolarHBondContact O-N 3.38Å; I241-S243 VanDerWaalsContact C-N 3.32Å; I241-S243 PolarHBondContact O-N 2.85Å; I241-L244 PolarHBondContact O-N 3.33Å; I241-M245 HydrophobicContact CG2-CG 4.47Å; I241-M245 HydrophobicContact CG2-SD 3.78Å; I241-M245 WeakPolarHBondContact O-CG 3.37Å; I241-M245 PolarHBondContact O-N 3.12Å |
| 242 | Y | 93.3 | Very high | 91.6 | Very high | 28 Ų | 28 | 71.6 Ų | 71.6 | 11% | 0.11 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -56.5 | -47 | 177.2 | 179.3 | -98.5 | 0 | 0 | 0 | 111.9 | L238 I239 L244 M245 N246 F318 L330 P331 Y336 | L238-Y242 WeakPolarHBondContact O-CB 3.47Å; L238-Y242 PolarHBondContact O-N 3.23Å; I239-Y242 PolarHBondContact O-N 3Å; Y242-L244 VanDerWaalsContact C-N 3.35Å; Y242-L244 PolarHBondContact O-N 3.35Å; Y242-M245 PolarHBondContact O-N 3.18Å; Y242-N246 VanDerWaalsContact CD2-ND2 3.34Å; Y242-N246 WeakPolarHBondContact CD2-ND2 3.43Å; Y242-N246 WeakPolarHBondContact CE2-ND2 3.27Å; Y242-N246 PolarHBondContact O-N 3.32Å; Y242-N246 PolarHBondContact O-ND2 2.91Å; Y242-F318 HydrophobicContact CD1-CZ 4.05Å; Y242-F318 AromaticContact CE1-CE1 3.93Å; Y242-F318 HydrophobicContact CE1-CE1 3.93Å; Y242-F318 AromaticContact CE1-CZ 3.67Å; Y242-F318 HydrophobicContact CE1-CZ 3.67Å; Y242-L330 HydrophobicContact CD1-CD2 3.99Å; Y242-L330 HydrophobicContact CG-CD2 4.49Å; Y242-P331 HydrophobicContact CE2-CG 3.65Å; Y242-P331 VanDerWaalsContact CZ-CD 3.49Å; Y242-Y336 HydrophobicContact CD2-CE1 4.26Å; Y242-Y336 AromaticContact CD2-CE2 3.77Å; Y242-Y336 HydrophobicContact CD2-CE2 3.77Å; Y242-Y336 AromaticContact CD2-CZ 3.53Å; Y242-Y336 WeakPolarHBondContact CD2-OH 3.43Å; Y242-Y336 HydrophobicContact CE2-CE2 4.19Å; Y242-Y336 HydrophobicContact CG-CE1 4.19Å; Y242-Y336 HydrophobicContact CG-CE2 4.46Å; Y242-Y336 AromaticContact CG-CZ 3.91Å |
| 243 | S | 94 | Very high | 91.7 | Very high | 0 Ų | 0 | 72.4 Ų | 72.4 | 0% | 0 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -67.4 | -35.1 | -176.2 | -52.2 | 0 | 0 | 0 | 0 | 112.2 | I239 Y240 I241 I247 | I239-S243 WeakPolarHBondContact O-CB 3.48Å; I239-S243 PolarHBondContact O-N 2.97Å; I239-S243 PolarHBondContact O-OG 2.91Å; Y240-S243 PolarHBondContact O-N 3.32Å; I241-S243 VanDerWaalsContact C-N 3.32Å; I241-S243 PolarHBondContact O-N 2.85Å; S243-I247 VanDerWaalsContact O-CG1 3.23Å; S243-I247 WeakPolarHBondContact O-CG1 3.37Å |
| 244 | L | 93.9 | Very high | 91.7 | Very high | 86 Ų | 86 | 71.7 Ų | 71.7 | 45% | 0.45 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -68.3 | -39.4 | 173.2 | -77.7 | 174.6 | 0 | 0 | 0 | 112.9 | Y240 I241 Y242 N246 I247 I313 | Y240-L244 HydrophobicContact CD1-CD1 3.71Å; Y240-L244 HydrophobicContact CD1-CG 4.28Å; Y240-L244 HydrophobicContact CE1-CD1 3.67Å; Y240-L244 HydrophobicContact CE1-CG 4.29Å; Y240-L244 WeakPolarHBondContact O-CG 3.29Å; Y240-L244 PolarHBondContact O-N 2.84Å; I241-L244 PolarHBondContact O-N 3.33Å; Y242-L244 VanDerWaalsContact C-N 3.35Å; Y242-L244 PolarHBondContact O-N 3.35Å; L244-N246 VanDerWaalsContact C-N 3.32Å; L244-N246 PolarHBondContact O-N 2.94Å; L244-I247 HydrophobicContact CD2-CD1 4.47Å; L244-I313 HydrophobicContact CD2-CD1 3.8Å; L244-I313 HydrophobicContact CD2-CG1 4.18Å; L244-I313 HydrophobicContact CD2-CG2 4.03Å; L244-I313 HydrophobicContact CG-CD1 4.42Å; L244-I313 HydrophobicContact CG-CG2 4.22Å |
| 245 | M | 91.7 | Very high | 91.7 | Very high | 152 Ų | 152 | 74.4 Ų | 74.4 | 75% | 0.749 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -74.7 | -19.7 | -176.8 | -70.4 | -179.8 | 70.7 | 0 | 0 | 113.9 | I241 Y242 | I241-M245 HydrophobicContact CG2-CG 4.47Å; I241-M245 HydrophobicContact CG2-SD 3.78Å; I241-M245 WeakPolarHBondContact O-CG 3.37Å; I241-M245 PolarHBondContact O-N 3.12Å; Y242-M245 PolarHBondContact O-N 3.18Å |
| 246 | N | 90 | Very high | 91.8 | Very high | 56 Ų | 56 | 79 Ų | 79 | 30% | 0.299 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -112.1 | 15.7 | -173.6 | -67.6 | -86.1 | 0 | 0 | 0 | 113.9 | Y242 L244 K248 | Y242-N246 VanDerWaalsContact CD2-ND2 3.34Å; Y242-N246 WeakPolarHBondContact CD2-ND2 3.43Å; Y242-N246 WeakPolarHBondContact CE2-ND2 3.27Å; Y242-N246 PolarHBondContact O-N 3.32Å; Y242-N246 PolarHBondContact O-ND2 2.91Å; L244-N246 VanDerWaalsContact C-N 3.32Å; L244-N246 PolarHBondContact O-N 2.94Å; N246-K248 PolarHBondContact O-N 2.7Å |
| 247 | I | 91.2 | Very high | 91.7 | Very high | 48 Ų | 48 | 79.1 Ų | 79.1 | 25% | 0.246 | 41% | 0.413 | C | S | . | . | trans | -64 | 118.5 | 171.8 | -56.9 | -178.4 | 0 | 0 | 0 | 109.2 | S243 L244 I251 I313 M316 | S243-I247 VanDerWaalsContact O-CG1 3.23Å; S243-I247 WeakPolarHBondContact O-CG1 3.37Å; L244-I247 HydrophobicContact CD2-CD1 4.47Å; I247-I251 HydrophobicContact CG2-CD1 4.22Å; I247-I251 HydrophobicContact CG2-CG1 4.27Å; I247-I313 HydrophobicContact CD1-CG2 4.46Å; I247-M316 HydrophobicContact CD1-CB 4.36Å; I247-M316 HydrophobicContact CG1-CB 4.45Å; I247-M316 HydrophobicContact CG2-CB 4.19Å | ||
| 248 | K | 85.1 | Confident | 91.5 | Very high | 159 Ų | 159 | 82.2 Ų | 82.2 | 69% | 0.691 | 42% | 0.419 | S | S | * | . | trans | -79.8 | 133.4 | 176.6 | -63.5 | -179 | -174.1 | 179.1 | 0 | 109.9 | N246 | N246-K248 PolarHBondContact O-N 2.7Š| ||
| 249 | L | 85.3 | Confident | 91.4 | Very high | 147 Ų | 147 | 84 Ų | 84 | 77% | 0.77 | 44% | 0.442 | S | S | * | . | S | Bend | trans | -111.5 | 139.5 | 174.8 | -73.8 | 165.2 | 0 | 0 | 0 | 109.5 | I251 | L249-I251 HydrophobicContact CD2-CG1 4.19Š|
| 250 | P | 85.2 | Confident | 91.3 | Very high | 117 Ų | 117 | 89.9 Ų | 89.9 | 76% | 0.76 | 47% | 0.467 | S | S | * | . | S | Bend | cis | -71.5 | 154 | -3.2 | 31.8 | -36.2 | 0 | 0 | 0 | 112.9 | D252 | P250-D252 PolarHBondContact O-N 2.9Å; P250-D252 VanDerWaalsContact O-N 3.17Å |
| 251 | I | 88.4 | Confident | 91.3 | Very high | 68 Ų | 68 | 87.9 Ų | 87.9 | 35% | 0.349 | 46% | 0.46 | S | S | . | . | trans | -80.9 | 95.4 | 175.2 | -58.5 | 169.1 | 0 | 0 | 0 | 108.6 | L80 I247 L249 L253 M316 | L80-I251 HydrophobicContact CD2-CG2 3.81Å; I247-I251 HydrophobicContact CG2-CD1 4.22Å; I247-I251 HydrophobicContact CG2-CG1 4.27Å; L249-I251 HydrophobicContact CD2-CG1 4.19Å; I251-L253 HydrophobicContact CG2-CB 4.31Å; I251-L253 HydrophobicContact CG2-CD1 4.05Å; I251-L253 HydrophobicContact CG2-CG 4.17Å; I251-M316 HydrophobicContact CD1-CE 4.15Å; I251-M316 HydrophobicContact CD1-CG 4.36Å; I251-M316 HydrophobicContact CD1-SD 4.04Å | ||
| 252 | D | 88.8 | Confident | 91.4 | Very high | 155 Ų | 155 | 87.6 Ų | 87.6 | 83% | 0.829 | 46% | 0.455 | S | S | * | . | trans | -101.9 | 82.9 | 172.2 | -168.5 | 21.5 | 0 | 0 | 0 | 110 | P250 | P250-D252 PolarHBondContact O-N 2.9Å; P250-D252 VanDerWaalsContact O-N 3.17Å | ||
| 253 | L | 92.5 | Very high | 91.5 | Very high | 32 Ų | 32 | 87 Ų | 87 | 17% | 0.168 | 45% | 0.454 | C | S | . | . | trans | -132.6 | 144.4 | 179.7 | -68 | 175.4 | 0 | 0 | 0 | 110.9 | L80 I251 K255 Y315 | L80-L253 HydrophobicContact CD2-CB 4.3Å; I251-L253 HydrophobicContact CG2-CB 4.31Å; I251-L253 HydrophobicContact CG2-CD1 4.05Å; I251-L253 HydrophobicContact CG2-CG 4.17Å; L253-K255 PolarHBondContact O-N 3.05Å; L253-K255 VanDerWaalsContact O-N 3.13Å; L253-Y315 HydrophobicContact CB-CE1 4.22Å; L253-Y315 HydrophobicContact CD1-CD1 4.2Å; L253-Y315 HydrophobicContact CD1-CD2 4.46Å; L253-Y315 HydrophobicContact CD1-CE1 4.16Å; L253-Y315 HydrophobicContact CD1-CE2 4.41Å; L253-Y315 HydrophobicContact CD1-CG 4.37Å; L253-Y315 WeakPolarHBondContact CD1-O 3.32Å; L253-Y315 HydrophobicContact CD2-CE2 4.21Å | ||
| 254 | P | 92.9 | Very high | 91.6 | Very high | 66 Ų | 66 | 87.6 Ų | 87.6 | 43% | 0.429 | 46% | 0.457 | S | S | . | . | trans | -51.1 | 116.5 | 174.7 | -28.9 | 34.3 | 0 | 0 | 0 | 113.4 | G79 L80 V256 Y315 | G79-P254 CarbonylContact C-O 3.53Å; G79-P254 WeakPolarHBondContact CA-O 3.45Å; L80-P254 PolarHBondContact N-O 2.97Å; P254-V256 VanDerWaalsContact C-N 3.25Å; P254-V256 PolarHBondContact O-N 3.49Å; P254-Y315 WeakPolarHBondContact CD-OH 3.37Å | ||
| 255 | K | 93.4 | Very high | 91.8 | Very high | 152 Ų | 152 | 83.5 Ų | 83.5 | 66% | 0.661 | 44% | 0.436 | S | S | * | . | S | Bend | trans | -64.3 | -32.6 | 175.1 | -64.4 | 179.8 | -176.5 | 175.7 | 0 | 112.2 | G79 L80 V81 L82 L253 | G79-K255 CarbonylContact C-O 3.38Å; L80-K255 PolarHBondContact N-O 3.49Å; V81-K255 HydrophobicContact CB-CB 4.39Å; V81-K255 WeakPolarHBondContact CB-O 3.42Å; V81-K255 HydrophobicContact CG2-CB 3.87Å; V81-K255 HydrophobicContact CG2-CG 4.1Å; V81-K255 PolarHBondContact N-O 3.42Å; L82-K255 PolarHBondContact N-O 2.94Å; L253-K255 PolarHBondContact O-N 3.05Å; L253-K255 VanDerWaalsContact O-N 3.13Å |
| 256 | V | 95.5 | Very high | 92.1 | Very high | 97 Ų | 97 | 76.8 Ų | 76.8 | 59% | 0.588 | 40% | 0.403 | S | S | * | . | S | Bend | trans | -130.5 | 129.4 | 175.2 | -179 | 0 | 0 | 0 | 0 | 107.3 | L82 P254 | L82-V256 HydrophobicContact CB-CG2 4.46Å; L82-V256 HydrophobicContact CD2-CG1 3.98Å; P254-V256 VanDerWaalsContact C-N 3.25Å; P254-V256 PolarHBondContact O-N 3.49Å |
| 257 | G | 91.3 | Very high | 92.4 | Very high | 21 Ų | 21 | 74.1 Ų | 74.1 | 22% | 0.216 | 39% | 0.388 | C | S | . | . | trans | -79.6 | -177.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | A78 | A78-G257 VanDerWaalsContact C-N 3.35Å; A78-G257 PolarHBondContact O-N 2.75Å | ||
| 258 | R | 91.8 | Very high | 92.7 | Very high | 154 Ų | 154 | 72.3 Ų | 72.3 | 58% | 0.581 | 38% | 0.379 | S | S | * | . | trans | -78.5 | 131 | -179.3 | -53.3 | 177.6 | -60.5 | -159.2 | -1 | 109.2 | K260 D261 | R258-K260 HydrophobicContact CB-CG 4.06Å; R258-K260 PolarHBondContact O-N 2.95Å; R258-D261 WeakPolarHBondContact CB-OD2 3.42Å; R258-D261 IonicContact CZ-OD1 3.67Å; R258-D261 IonicContact CZ-OD2 3.26Å; R258-D261 IonicContact NE-OD1 2.97Å; R258-D261 IonicContact NE-OD2 3.97Å; R258-D261 PolarHBondContact NE-OD2 3.24Å; R258-D261 IonicContact NH2-OD1 2.84Å; R258-D261 PolarHBondContact NH2-OD1 3.24Å; R258-D261 IonicContact NH2-OD2 3.85Å; R258-D261 PolarHBondContact NH2-OD2 3.13Å; R258-D261 PolarHBondContact O-N 3.39Å | ||
| 259 | A | 91.8 | Very high | 93.3 | Very high | 91 Ų | 91 | 64.7 Ų | 64.7 | 75% | 0.752 | 35% | 0.346 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.2 | -29.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114 | D261 Y262 | A259-D261 VanDerWaalsContact C-N 3.32Å; A259-D261 PolarHBondContact O-N 2.96Å; A259-Y262 PolarHBondContact O-N 3.2Å |
| 260 | K | 92.9 | Very high | 93.9 | Very high | 122 Ų | 122 | 57.8 Ų | 57.8 | 53% | 0.53 | 31% | 0.31 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.9 | -25.1 | 175.9 | 64.2 | 156.6 | -163.5 | 162.1 | 0 | 114.8 | R258 P263 | R258-K260 HydrophobicContact CB-CG 4.06Å; R258-K260 PolarHBondContact O-N 2.95Å; K260-P263 WeakPolarHBondContact O-CD 3.45Å |
| 261 | D | 93.7 | Very high | 94.4 | Very high | 16 Ų | 16 | 52.7 Ų | 52.7 | 9% | 0.086 | 28% | 0.276 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.3 | -15.1 | -178.2 | -49.9 | -36 | 0 | 0 | 0 | 111.4 | N77 R258 A259 P263 L264 F265 | N77-D261 HydrophobicContact CB-CB 3.89Å; R258-D261 WeakPolarHBondContact CB-OD2 3.42Å; R258-D261 IonicContact CZ-OD1 3.67Å; R258-D261 IonicContact CZ-OD2 3.26Å; R258-D261 IonicContact NE-OD1 2.97Å; R258-D261 IonicContact NE-OD2 3.97Å; R258-D261 PolarHBondContact NE-OD2 3.24Å; R258-D261 IonicContact NH2-OD1 2.84Å; R258-D261 PolarHBondContact NH2-OD1 3.24Å; R258-D261 IonicContact NH2-OD2 3.85Å; R258-D261 PolarHBondContact NH2-OD2 3.13Å; R258-D261 PolarHBondContact O-N 3.39Å; A259-D261 VanDerWaalsContact C-N 3.32Å; A259-D261 PolarHBondContact O-N 2.96Å; D261-P263 VanDerWaalsContact C-CD 3.45Å; D261-P263 VanDerWaalsContact C-N 3.33Å; D261-L264 WeakPolarHBondContact O-CA 3.22Å; D261-L264 WeakPolarHBondContact O-CB 3.42Å; D261-L264 PolarHBondContact O-N 2.85Å; D261-F265 PolarHBondContact O-N 3.31Å |
| 262 | Y | 96.4 | Very high | 94.7 | Very high | 73 Ų | 73 | 49.6 Ų | 49.6 | 29% | 0.286 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -57.4 | -34.4 | 179.1 | -168 | -90.3 | 0 | 0 | 0 | 114.2 | A78 L82 S86 A259 L264 F265 F266 | A78-Y262 HydrophobicContact CB-CD2 4.08Å; A78-Y262 HydrophobicContact CB-CE2 4.21Å; L82-Y262 HydrophobicContact CD2-CD2 4.02Å; L82-Y262 HydrophobicContact CD2-CE2 3.88Å; L82-Y262 HydrophobicContact CG-CE2 4.07Å; S86-Y262 WeakPolarHBondContact CB-OH 3.2Å; S86-Y262 PolarHBondContact OG-OH 2.95Å; A259-Y262 PolarHBondContact O-N 3.2Å; Y262-L264 VanDerWaalsContact C-N 3.28Å; Y262-L264 PolarHBondContact O-N 3.35Å; Y262-F265 HydrophobicContact CD2-CD1 4.15Å; Y262-F265 HydrophobicContact CE1-CD1 4.4Å; Y262-F265 AromaticContact CE2-CD1 3.77Å; Y262-F265 HydrophobicContact CE2-CD1 3.77Å; Y262-F265 HydrophobicContact CE2-CE1 4.1Å; Y262-F265 AromaticContact CZ-CD1 3.92Å; Y262-F265 WeakPolarHBondContact O-CB 3.41Å; Y262-F265 PolarHBondContact O-N 2.98Å; Y262-F266 PolarHBondContact O-N 3.29Å |
| 263 | P | 96.7 | Very high | 95 | Very high | 16 Ų | 16 | 42.3 Ų | 42.3 | 10% | 0.104 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -63.3 | -29.9 | 171.9 | -25 | 37.2 | 0 | 0 | 0 | 113.9 | K260 D261 F266 G267 L454 I458 | K260-P263 WeakPolarHBondContact O-CD 3.45Å; D261-P263 VanDerWaalsContact C-CD 3.45Å; D261-P263 VanDerWaalsContact C-N 3.33Å; P263-F266 PolarHBondContact O-N 3.26Å; P263-G267 PolarHBondContact O-N 3.09Å; P263-L454 HydrophobicContact CB-CB 4.07Å; P263-L454 HydrophobicContact CG-CB 4.01Å; P263-I458 HydrophobicContact CB-CB 4.33Å; P263-I458 HydrophobicContact CB-CG1 4.1Å; P263-I458 HydrophobicContact CG-CG1 4.03Å |
| 264 | L | 96.1 | Very high | 94.8 | Very high | 11 Ų | 11 | 41.4 Ų | 41.4 | 6% | 0.058 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -71.5 | -39.6 | 172.8 | -60.7 | 174.5 | 0 | 0 | 0 | 111.3 | D261 Y262 F266 G267 T268 L402 S405 I458 A459 | D261-L264 WeakPolarHBondContact O-CA 3.22Å; D261-L264 WeakPolarHBondContact O-CB 3.42Å; D261-L264 PolarHBondContact O-N 2.85Å; Y262-L264 VanDerWaalsContact C-N 3.28Å; Y262-L264 PolarHBondContact O-N 3.35Å; L264-F266 VanDerWaalsContact C-N 3.33Å; L264-G267 PolarHBondContact O-N 3.16Å; L264-T268 PolarHBondContact O-N 3.4Å; L264-T268 VanDerWaalsContact O-N 3.09Å; L264-T268 PolarHBondContact O-OG1 3.48Å; L264-L402 HydrophobicContact CD2-CD2 4.39Å; L264-S405 WeakPolarHBondContact CA-OG 3.42Å; L264-S405 WeakPolarHBondContact CD2-OG 3.35Å; L264-I458 HydrophobicContact CD1-CG2 4.12Å; L264-I458 HydrophobicContact CD2-CG2 3.96Å; L264-I458 HydrophobicContact CG-CG2 3.78Å; L264-A459 HydrophobicContact CD2-CB 4.13Å |
| 265 | F | 97.7 | Very high | 94.5 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -57.4 | -47.6 | 169 | 161.2 | -92.5 | 0 | 0 | 0 | 111.1 | A74 N77 A78 S86 L87 D261 Y262 G267 T268 A269 | A74-F265 HydrophobicContact CB-CD2 3.73Å; A74-F265 HydrophobicContact CB-CE2 4.42Å; A74-F265 VanDerWaalsContact O-CD2 3.25Å; A74-F265 WeakPolarHBondContact O-CD2 3.34Å; N77-F265 HydrophobicContact CB-CB 4.23Å; A78-F265 HydrophobicContact CB-CB 4.01Å; A78-F265 HydrophobicContact CB-CD1 4.11Å; A78-F265 HydrophobicContact CB-CD2 3.69Å; A78-F265 HydrophobicContact CB-CE2 4.2Å; A78-F265 HydrophobicContact CB-CG 3.64Å; S86-F265 VanDerWaalsContact CB-CE1 3.4Å; S86-F265 VanDerWaalsContact CB-CZ 3.45Å; L87-F265 HydrophobicContact CD2-CE2 3.75Å; L87-F265 HydrophobicContact CD2-CZ 3.89Å; L87-F265 HydrophobicContact CG-CE2 3.79Å; L87-F265 HydrophobicContact CG-CZ 3.94Å; D261-F265 PolarHBondContact O-N 3.31Å; Y262-F265 HydrophobicContact CD2-CD1 4.15Å; Y262-F265 HydrophobicContact CE1-CD1 4.4Å; Y262-F265 AromaticContact CE2-CD1 3.77Å; Y262-F265 HydrophobicContact CE2-CD1 3.77Å; Y262-F265 HydrophobicContact CE2-CE1 4.1Å; Y262-F265 AromaticContact CZ-CD1 3.92Å; Y262-F265 WeakPolarHBondContact O-CB 3.41Å; Y262-F265 PolarHBondContact O-N 2.98Å; F265-G267 PolarHBondContact O-N 2.95Å; F265-T268 PolarHBondContact O-N 3.49Å; F265-A269 HydrophobicContact CE1-CB 4.27Å; F265-A269 HydrophobicContact CE2-CB 4.27Å; F265-A269 HydrophobicContact CZ-CB 4.03Å; F265-A269 VanDerWaalsContact O-CB 3.23Å; F265-A269 WeakPolarHBondContact O-CB 3.47Å; F265-A269 PolarHBondContact O-N 3.04Å |
| 266 | F | 97.6 | Very high | 94.3 | Very high | 12 Ų | 12 | 31.3 Ų | 31.3 | 5% | 0.053 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -59.5 | -47.1 | -179 | 175 | -82.6 | 0 | 0 | 0 | 111.6 | M90 Y262 P263 L264 A269 I270 S413 L417 V447 | M90-F266 HydrophobicContact CE-CD2 3.64Å; M90-F266 HydrophobicContact CE-CE2 3.32Å; M90-F266 HydrophobicContact CE-CZ 4.04Å; M90-F266 HydrophobicContact SD-CD2 4.37Å; M90-F266 HydrophobicContact SD-CE2 4.22Å; Y262-F266 PolarHBondContact O-N 3.29Å; P263-F266 PolarHBondContact O-N 3.26Å; L264-F266 VanDerWaalsContact C-N 3.33Å; F266-A269 PolarHBondContact O-N 3.48Å; F266-I270 HydrophobicContact CE1-CG1 3.99Å; F266-I270 HydrophobicContact CE2-CG1 4.28Å; F266-I270 HydrophobicContact CZ-CG1 3.87Å; F266-I270 WeakPolarHBondContact O-CB 3.26Å; F266-I270 PolarHBondContact O-N 2.87Å; F266-S413 WeakPolarHBondContact CE1-OG 3.35Å; F266-L417 HydrophobicContact CE2-CD1 4.2Å; F266-L417 HydrophobicContact CZ-CD1 3.74Å; F266-V447 HydrophobicContact CE2-CG1 4.25Å |
| 267 | G | 97.1 | Very high | 93.8 | Very high | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -56.5 | -54.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | P263 L264 F265 A269 I270 F271 S405 G408 | P263-G267 PolarHBondContact O-N 3.09Å; L264-G267 PolarHBondContact O-N 3.16Å; F265-G267 PolarHBondContact O-N 2.95Å; G267-A269 PolarHBondContact O-N 2.95Å; G267-I270 PolarHBondContact O-N 2.97Å; G267-F271 WeakPolarHBondContact O-CB 3.22Å; G267-F271 PolarHBondContact O-N 3.36Å; G267-S405 WeakPolarHBondContact CA-O 3.38Å; G267-G408 WeakPolarHBondContact O-CA 3.3Å |
| 268 | T | 97.2 | Very high | 93.6 | Very high | 9 Ų | 9 | 28.8 Ų | 28.8 | 6% | 0.055 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -63.7 | -36.9 | 179.9 | -61.8 | 0 | 0 | 0 | 0 | 113.3 | L71 A74 L264 F265 A272 I404 | L71-T268 HydrophobicContact CD2-CG2 4.42Å; A74-T268 HydrophobicContact CB-CG2 3.75Å; L264-T268 PolarHBondContact O-N 3.4Å; L264-T268 VanDerWaalsContact O-N 3.09Å; L264-T268 PolarHBondContact O-OG1 3.48Å; F265-T268 PolarHBondContact O-N 3.49Å; T268-A272 WeakPolarHBondContact O-CB 3.49Å; T268-A272 PolarHBondContact O-N 2.9Å; T268-I404 HydrophobicContact CG2-CG2 3.74Å |
| 269 | A | 97.4 | Very high | 93.6 | Very high | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -66.2 | -44.3 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | L87 F265 F266 G267 A272 F273 | L87-A269 HydrophobicContact CD2-CB 3.79Å; F265-A269 HydrophobicContact CE1-CB 4.27Å; F265-A269 HydrophobicContact CE2-CB 4.27Å; F265-A269 HydrophobicContact CZ-CB 4.03Å; F265-A269 VanDerWaalsContact O-CB 3.23Å; F265-A269 WeakPolarHBondContact O-CB 3.47Å; F265-A269 PolarHBondContact O-N 3.04Å; F266-A269 PolarHBondContact O-N 3.48Å; G267-A269 PolarHBondContact O-N 2.95Å; A269-A272 PolarHBondContact O-N 3.18Å; A269-F273 VanDerWaalsContact O-CD2 3.28Å; A269-F273 WeakPolarHBondContact O-CD2 3.32Å; A269-F273 PolarHBondContact O-N 2.85Å |
| 270 | I | 96.6 | Very high | 93.6 | Very high | 1 Ų | 1 | 17.2 Ų | 17.2 | 1% | 0.005 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -67.3 | -40.7 | 176.1 | -80.1 | -66.4 | 0 | 0 | 0 | 111.7 | M90 F266 G267 A272 F273 E274 G408 A416 L417 | M90-I270 HydrophobicContact CE-CD1 3.39Å; M90-I270 HydrophobicContact CE-CG1 3.37Å; F266-I270 HydrophobicContact CE1-CG1 3.99Å; F266-I270 HydrophobicContact CE2-CG1 4.28Å; F266-I270 HydrophobicContact CZ-CG1 3.87Å; F266-I270 WeakPolarHBondContact O-CB 3.26Å; F266-I270 PolarHBondContact O-N 2.87Å; G267-I270 PolarHBondContact O-N 2.97Å; I270-A272 VanDerWaalsContact C-N 3.28Å; I270-A272 PolarHBondContact O-N 3.47Å; I270-F273 PolarHBondContact O-N 2.72Å; I270-E274 WeakPolarHBondContact O-CB 3.44Å; I270-E274 PolarHBondContact O-N 3.38Å; I270-G408 VanDerWaalsContact CG2-O 3.29Å; I270-G408 WeakPolarHBondContact CG2-O 3.45Å; I270-A416 HydrophobicContact CD1-CB 4.42Å; I270-L417 HydrophobicContact CD1-CD1 3.74Å; I270-L417 HydrophobicContact CD1-CD2 4.12Å; I270-L417 HydrophobicContact CD1-CG 3.85Å; I270-L417 HydrophobicContact CG1-CD1 4.26Å |
| 271 | F | 95.6 | Very high | 93.4 | Very high | 10 Ų | 10 | 14.4 Ų | 14.4 | 4% | 0.044 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -55.3 | -45.2 | 171.7 | -178.3 | -78.9 | 0 | 0 | 0 | 111.3 | F155 V158 G267 E274 I404 V407 | F155-F271 HydrophobicContact CD1-CD2 4.09Å; F155-F271 HydrophobicContact CD1-CE1 4.48Å; F155-F271 AromaticContact CD1-CE2 3.3Å; F155-F271 HydrophobicContact CD1-CE2 3.3Å; F155-F271 AromaticContact CD1-CZ 3.53Å; F155-F271 HydrophobicContact CD1-CZ 3.53Å; F155-F271 AromaticContact CE1-CD2 3.71Å; F155-F271 HydrophobicContact CE1-CD2 3.71Å; F155-F271 HydrophobicContact CE1-CE1 4.39Å; F155-F271 AromaticContact CE1-CE2 3.41Å; F155-F271 HydrophobicContact CE1-CE2 3.41Å; F155-F271 VanDerWaalsContact CE1-CE2 3.41Å; F155-F271 HydrophobicContact CE1-CG 4.33Å; F155-F271 AromaticContact CE1-CZ 3.77Å; F155-F271 HydrophobicContact CE1-CZ 3.77Å; F155-F271 HydrophobicContact CG-CE2 4.4Å; F155-F271 HydrophobicContact CG-CZ 4.26Å; V158-F271 HydrophobicContact CB-CZ 4.21Å; V158-F271 HydrophobicContact CG1-CZ 4.16Å; V158-F271 HydrophobicContact CG2-CE2 3.86Å; V158-F271 HydrophobicContact CG2-CZ 3.82Å; G267-F271 WeakPolarHBondContact O-CB 3.22Å; G267-F271 PolarHBondContact O-N 3.36Å; F271-E274 WeakPolarHBondContact O-CB 3.23Å; F271-E274 PolarHBondContact O-N 3.31Å; F271-I404 HydrophobicContact CB-CG2 4.05Å; F271-I404 HydrophobicContact CD1-CG2 3.79Å; F271-I404 HydrophobicContact CD2-CG2 4.23Å; F271-I404 WeakPolarHBondContact CD2-O 3.43Å; F271-I404 HydrophobicContact CE1-CG1 4.32Å; F271-I404 HydrophobicContact CE1-CG2 4.3Å; F271-I404 HydrophobicContact CG-CG2 3.78Å; F271-I404 HydrophobicContact CZ-CG1 4.27Å; F271-V407 HydrophobicContact CD2-CB 3.89Å; F271-V407 HydrophobicContact CD2-CG1 3.86Å; F271-V407 HydrophobicContact CE2-CB 3.98Å; F271-V407 HydrophobicContact CE2-CG1 3.85Å |
| 272 | A | 96.1 | Very high | 93.2 | Very high | 4 Ų | 4 | 14.8 Ų | 14.8 | 3% | 0.033 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -67.2 | -39.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | L71 T268 A269 I270 E274 Y307 | L71-A272 HydrophobicContact CD1-CB 4.3Å; L71-A272 HydrophobicContact CD2-CB 3.84Å; L71-A272 HydrophobicContact CG-CB 4.23Å; T268-A272 WeakPolarHBondContact O-CB 3.49Å; T268-A272 PolarHBondContact O-N 2.9Å; A269-A272 PolarHBondContact O-N 3.18Å; I270-A272 VanDerWaalsContact C-N 3.28Å; I270-A272 PolarHBondContact O-N 3.47Å; A272-E274 VanDerWaalsContact C-N 3.28Å; A272-E274 PolarHBondContact O-N 2.83Å; A272-Y307 VanDerWaalsContact C-CE2 3.46Å; A272-Y307 HydrophobicContact CB-CD2 4.1Å; A272-Y307 HydrophobicContact CB-CE2 3.56Å; A272-Y307 VanDerWaalsContact O-CE2 3.23Å; A272-Y307 WeakPolarHBondContact O-CE2 3.35Å; A272-Y307 PolarHBondContact O-OH 2.75Å |
| 273 | F | 94.8 | Very high | 93 | Very high | 1 Ų | 1 | 11.4 Ų | 11.4 | 0% | 0.004 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -82.3 | 3.9 | 178.3 | -76.3 | -64.9 | 0 | 0 | 0 | 114.5 | L87 M90 G91 A94 M98 A269 I270 G275 M300 V303 T304 Y307 | L87-F273 HydrophobicContact CD2-CE2 4.25Å; L87-F273 WeakPolarHBondContact O-CE2 3.5Å; L87-F273 WeakPolarHBondContact O-CZ 3.48Å; M90-F273 HydrophobicContact CB-CD2 4.27Å; M90-F273 HydrophobicContact CB-CE2 4.26Å; G91-F273 VanDerWaalsContact CA-CZ 3.5Å; A94-F273 HydrophobicContact CB-CB 3.94Å; A94-F273 HydrophobicContact CB-CG 4.36Å; M98-F273 VanDerWaalsContact CE-O 3.31Å; M98-F273 WeakPolarHBondContact CE-O 3.08Å; A269-F273 VanDerWaalsContact O-CD2 3.28Å; A269-F273 WeakPolarHBondContact O-CD2 3.32Å; A269-F273 PolarHBondContact O-N 2.85Å; I270-F273 PolarHBondContact O-N 2.72Å; F273-G275 VanDerWaalsContact C-N 3.27Å; F273-G275 PolarHBondContact O-N 3.38Å; F273-M300 HydrophobicContact CD1-CE 4.07Å; F273-V303 HydrophobicContact CD1-CG1 4.42Å; F273-V303 HydrophobicContact CE1-CG1 4.31Å; F273-T304 HydrophobicContact CE1-CG2 4.48Å; F273-T304 WeakPolarHBondContact CE1-OG1 3.41Å; F273-T304 HydrophobicContact CZ-CG2 4.19Å; F273-Y307 AromaticContact CD1-CD2 3.91Å; F273-Y307 HydrophobicContact CD1-CD2 3.91Å; F273-Y307 AromaticContact CD1-CE2 3.79Å; F273-Y307 HydrophobicContact CD1-CE2 3.79Å; F273-Y307 HydrophobicContact CD2-CD2 4.29Å; F273-Y307 HydrophobicContact CD2-CE2 4.5Å; F273-Y307 AromaticContact CE1-CD2 3.54Å; F273-Y307 HydrophobicContact CE1-CD2 3.54Å; F273-Y307 AromaticContact CE1-CE2 3.89Å; F273-Y307 HydrophobicContact CE1-CE2 3.89Å; F273-Y307 HydrophobicContact CE1-CG 4.47Å; F273-Y307 AromaticContact CE2-CD2 3.96Å; F273-Y307 HydrophobicContact CE2-CD2 3.96Å; F273-Y307 HydrophobicContact CG-CD2 4.27Å; F273-Y307 HydrophobicContact CG-CE2 4.11Å; F273-Y307 AromaticContact CZ-CD2 3.57Å; F273-Y307 HydrophobicContact CZ-CD2 3.57Å; F273-Y307 HydrophobicContact CZ-CE2 4.3Å; F273-Y307 HydrophobicContact CZ-CG 4.41Å |
| 274 | E | 88.5 | Confident | 92.6 | Very high | 13 Ų | 13 | 11.7 Ų | 11.7 | 6% | 0.061 | 7% | 0.073 | C | C | . | . | trans | -75.9 | 72.5 | -179.1 | -178.5 | 57.8 | -167 | 0 | 0 | 112.3 | T151 F155 I270 F271 A272 I276 S412 L415 | T151-E274 HydrophobicContact CG2-CG 3.89Å; F155-E274 HydrophobicContact CZ-CB 3.99Å; F155-E274 HydrophobicContact CZ-CG 3.68Å; I270-E274 WeakPolarHBondContact O-CB 3.44Å; I270-E274 PolarHBondContact O-N 3.38Å; F271-E274 WeakPolarHBondContact O-CB 3.23Å; F271-E274 PolarHBondContact O-N 3.31Å; A272-E274 VanDerWaalsContact C-N 3.28Å; A272-E274 PolarHBondContact O-N 2.83Å; E274-I276 WeakPolarHBondContact OE1-CG2 3.35Å; E274-S412 WeakPolarHBondContact CG-OG 3.43Å; E274-L415 WeakPolarHBondContact OE1-CB 3.35Å; E274-L415 WeakPolarHBondContact OE1-CD1 3.16Å | ||
| 275 | G | 86 | Confident | 92.2 | Very high | 2 Ų | 2 | 17 Ų | 17 | 2% | 0.021 | 10% | 0.095 | C | C | . | . | trans | -96.8 | -4.7 | 170.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | N63 F273 G277 V278 | N63-G275 WeakPolarHBondContact OD1-CA 3.43Å; N63-G275 PolarHBondContact OD1-N 2.92Å; F273-G275 VanDerWaalsContact C-N 3.27Å; F273-G275 PolarHBondContact O-N 3.38Å; G275-G277 VanDerWaalsContact C-N 3.28Å; G275-G277 PolarHBondContact O-N 3.16Å; G275-G277 VanDerWaalsContact O-N 3.17Å; G275-V278 WeakPolarHBondContact O-CG2 3.31Å; G275-V278 PolarHBondContact O-N 3.12Å | ||
| 276 | I | 89.2 | Confident | 91.7 | Very high | 4 Ų | 4 | 17.2 Ų | 17.2 | 2% | 0.021 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -64.1 | -31.1 | -162.5 | -162.1 | 169 | 0 | 0 | 0 | 113.5 | M98 L101 Y119 E274 V278 V279 L415 P420 | M98-I276 HydrophobicContact CG-CB 4.3Å; M98-I276 HydrophobicContact CG-CG1 4.17Å; L101-I276 HydrophobicContact CB-CD1 4.33Å; L101-I276 HydrophobicContact CD2-CD1 3.76Å; L101-I276 HydrophobicContact CD2-CG1 3.52Å; Y119-I276 HydrophobicContact CE1-CD1 4.14Å; Y119-I276 HydrophobicContact CE1-CG1 4.32Å; Y119-I276 HydrophobicContact CE1-CG2 4.28Å; E274-I276 WeakPolarHBondContact OE1-CG2 3.35Å; I276-V278 VanDerWaalsContact C-N 3.25Å; I276-V278 PolarHBondContact O-N 3.44Å; I276-V279 WeakPolarHBondContact O-CB 3.28Å; I276-V279 PolarHBondContact O-N 3.2Å; I276-L415 WeakPolarHBondContact CD1-O 3.43Å; I276-L415 HydrophobicContact CG2-CB 3.91Å; I276-P420 HydrophobicContact CD1-CG 3.57Å |
| 277 | G | 85.4 | Confident | 91.2 | Very high | 24 Ų | 24 | 21 Ų | 21 | 25% | 0.247 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -61.2 | -26.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | G275 P281 | G275-G277 VanDerWaalsContact C-N 3.28Å; G275-G277 PolarHBondContact O-N 3.16Å; G275-G277 VanDerWaalsContact O-N 3.17Å; G277-P281 WeakPolarHBondContact O-CD 3.47Å; G277-P281 WeakPolarHBondContact O-CG 3.5Å |
| 278 | V | 87.7 | Confident | 90.6 | Very high | 41 Ų | 41 | 28.5 Ų | 28.5 | 25% | 0.248 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -93.8 | -13.7 | 177.6 | -59.2 | 0 | 0 | 0 | 0 | 113.8 | L59 G275 I276 P281 L282 | L59-V278 HydrophobicContact CD1-CG2 4.5Å; G275-V278 WeakPolarHBondContact O-CG2 3.31Å; G275-V278 PolarHBondContact O-N 3.12Å; I276-V278 VanDerWaalsContact C-N 3.25Å; I276-V278 PolarHBondContact O-N 3.44Å; V278-P281 WeakPolarHBondContact O-CD 3.45Å; V278-L282 HydrophobicContact CB-CD1 4.1Å; V278-L282 HydrophobicContact CB-CG 4.41Å; V278-L282 HydrophobicContact CG2-CD1 4.02Å; V278-L282 VanDerWaalsContact O-CB 3.3Å; V278-L282 WeakPolarHBondContact O-CB 3.3Å; V278-L282 WeakPolarHBondContact O-CG 3.42Å; V278-L282 PolarHBondContact O-N 3.23Å |
| 279 | V | 92 | Very high | 90.1 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -57.9 | -60.1 | -174.6 | 173 | 0 | 0 | 0 | 0 | 112 | M98 V102 I276 L282 E283 F292 L296 | M98-V279 HydrophobicContact CB-CG2 4.2Å; M98-V279 HydrophobicContact CG-CG2 3.93Å; M98-V279 HydrophobicContact SD-CG2 3.76Å; V102-V279 HydrophobicContact CG2-CG1 3.54Å; I276-V279 WeakPolarHBondContact O-CB 3.28Å; I276-V279 PolarHBondContact O-N 3.2Å; V279-L282 PolarHBondContact O-N 3.42Å; V279-E283 PolarHBondContact O-N 3.42Å; V279-F292 HydrophobicContact CB-CZ 4.49Å; V279-F292 HydrophobicContact CG1-CE1 3.69Å; V279-F292 HydrophobicContact CG1-CZ 3.88Å; V279-F292 WeakPolarHBondContact O-CZ 3.32Å; V279-L296 HydrophobicContact CG2-CD1 4.27Å |
| 280 | L | 91.7 | Very high | 89.5 | Confident | 3 Ų | 3 | 35.6 Ų | 35.6 | 2% | 0.016 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -66.2 | -43.6 | -179.1 | -65 | -179.6 | 0 | 0 | 0 | 113.1 | L101 V102 V122 L282 E283 N284 | L101-L280 HydrophobicContact CD1-CD1 3.86Å; L101-L280 HydrophobicContact CD2-CD1 4Å; L101-L280 HydrophobicContact CD2-CG 4.03Å; L101-L280 HydrophobicContact CG-CD1 3.86Å; L101-L280 HydrophobicContact CG-CD2 4.27Å; L101-L280 HydrophobicContact CG-CG 4.01Å; V102-L280 HydrophobicContact CG2-CD2 4.41Å; V122-L280 HydrophobicContact CG2-CD1 3.95Å; L280-L282 VanDerWaalsContact C-N 3.29Å; L280-L282 PolarHBondContact O-N 3.31Å; L280-E283 PolarHBondContact O-N 2.99Å; L280-N284 VanDerWaalsContact O-CB 3.29Å; L280-N284 WeakPolarHBondContact O-CB 3.47Å; L280-N284 PolarHBondContact O-N 3.01Å; L280-N284 PolarHBondContact O-ND2 2.9Å |
| 281 | P | 88.9 | Confident | 89.2 | Confident | 63 Ų | 63 | 40.1 Ų | 40.1 | 41% | 0.409 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -58.5 | -35.1 | 174.5 | -28.5 | 36.6 | 0 | 0 | 0 | 114.6 | G277 V278 K285 | G277-P281 WeakPolarHBondContact O-CD 3.47Å; G277-P281 WeakPolarHBondContact O-CG 3.5Å; V278-P281 WeakPolarHBondContact O-CD 3.45Å; P281-K285 WeakPolarHBondContact O-CG 3.23Å |
| 282 | L | 89.1 | Confident | 89.1 | Confident | 23 Ų | 23 | 39.7 Ų | 39.7 | 12% | 0.12 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -73.4 | -44 | 176.4 | -72.1 | 175.9 | 0 | 0 | 0 | 111.9 | T55 H58 L59 V278 V279 L280 K285 M286 F292 | T55-L282 HydrophobicContact CG2-CB 4.13Å; H58-L282 HydrophobicContact CB-CD1 4.15Å; H58-L282 HydrophobicContact CB-CD2 3.52Å; L59-L282 HydrophobicContact CB-CD1 4.1Å; L59-L282 HydrophobicContact CD1-CD1 4.42Å; V278-L282 HydrophobicContact CB-CD1 4.1Å; V278-L282 HydrophobicContact CB-CG 4.41Å; V278-L282 HydrophobicContact CG2-CD1 4.02Å; V278-L282 VanDerWaalsContact O-CB 3.3Å; V278-L282 WeakPolarHBondContact O-CB 3.3Å; V278-L282 WeakPolarHBondContact O-CG 3.42Å; V278-L282 PolarHBondContact O-N 3.23Å; V279-L282 PolarHBondContact O-N 3.42Å; L280-L282 VanDerWaalsContact C-N 3.29Å; L280-L282 PolarHBondContact O-N 3.31Å; L282-K285 PolarHBondContact O-N 2.92Å; L282-M286 PolarHBondContact O-N 3.21Å; L282-F292 HydrophobicContact CB-CE2 4.02Å |
| 283 | E | 90.9 | Very high | 88.9 | Confident | 3 Ų | 3 | 41.5 Ų | 41.5 | 1% | 0.014 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -59.9 | -48.3 | 175.2 | -178.1 | 172.9 | -129.1 | 0 | 0 | 112.1 | V102 H106 V279 L280 K285 M286 P289 F292 | V102-E283 WeakPolarHBondContact CG1-OE1 3.18Å; H106-E283 IonicContact CD2-OE1 2.74Å; H106-E283 IonicContact CD2-OE2 3.07Å; H106-E283 IonicContact CE1-OE1 3.99Å; H106-E283 PolarHBondContact CE1-OE1 2.85Å; H106-E283 VanDerWaalsContact CE1-OE1 3.26Å; H106-E283 IonicContact NE2-OE1 2.71Å; H106-E283 PolarHBondContact NE2-OE1 3.34Å; H106-E283 IonicContact NE2-OE2 3.25Å; H106-E283 PolarHBondContact NE2-OE2 3.37Å; H106-E283 VanDerWaalsContact NE2-OE2 3.07Å; V279-E283 PolarHBondContact O-N 3.42Å; L280-E283 PolarHBondContact O-N 2.99Å; E283-K285 PolarHBondContact O-N 3.27Å; E283-K285 VanDerWaalsContact O-N 3.09Å; E283-M286 WeakPolarHBondContact O-CB 3.36Å; E283-M286 PolarHBondContact O-N 2.97Å; E283-P289 HydrophobicContact CG-CB 3.9Å; E283-F292 HydrophobicContact CB-CB 4.36Å; E283-F292 HydrophobicContact CB-CD1 3.85Å; E283-F292 HydrophobicContact CB-CD2 3.74Å; E283-F292 HydrophobicContact CB-CE1 4.09Å; E283-F292 HydrophobicContact CB-CE2 3.96Å; E283-F292 HydrophobicContact CB-CG 3.69Å; E283-F292 HydrophobicContact CB-CZ 4.13Å; E283-F292 HydrophobicContact CG-CB 3.91Å; E283-F292 HydrophobicContact CG-CD1 4Å; E283-F292 HydrophobicContact CG-CD2 4.23Å; E283-F292 HydrophobicContact CG-CG 3.76Å |
| 284 | N | 88.6 | Confident | 88.9 | Confident | 22 Ų | 22 | 46.8 Ų | 46.8 | 12% | 0.118 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.9 | -22.2 | -179.3 | -74.7 | -38.6 | 0 | 0 | 0 | 113.3 | G45 S116 M117 L280 | G45-N284 PolarHBondContact N-O 3.35Å; S116-N284 WeakPolarHBondContact CA-OD1 3.39Å; S116-N284 VanDerWaalsContact CB-CG 3.47Å; S116-N284 WeakPolarHBondContact CB-OD1 3.26Å; M117-N284 PolarHBondContact O-ND2 3.42Å; L280-N284 VanDerWaalsContact O-CB 3.29Å; L280-N284 WeakPolarHBondContact O-CB 3.47Å; L280-N284 PolarHBondContact O-N 3.01Å; L280-N284 PolarHBondContact O-ND2 2.9Å |
| 285 | K | 87.2 | Confident | 89.2 | Confident | 121 Ų | 121 | 46.2 Ų | 46.2 | 53% | 0.526 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -101.4 | -3 | 179.3 | -69.6 | 178.6 | -179.6 | 178.5 | 0 | 113.8 | G49 T50 P281 L282 E283 | G49-K285 CarbonylContact C-O 3.57Å; G49-K285 WeakPolarHBondContact CA-O 3.39Å; T50-K285 PolarHBondContact N-O 2.95Å; T50-K285 PolarHBondContact OG1-O 3.21Å; P281-K285 WeakPolarHBondContact O-CG 3.23Å; L282-K285 PolarHBondContact O-N 2.92Å; E283-K285 PolarHBondContact O-N 3.27Å; E283-K285 VanDerWaalsContact O-N 3.09Å |
| 286 | M | 87.7 | Confident | 89.7 | Confident | 6 Ų | 6 | 46.1 Ų | 46.1 | 3% | 0.03 | 23% | 0.226 | C | C | . | . | B | Isolated β-bridge | trans | -80.1 | 139.9 | -176.9 | -169.9 | -178.7 | 176.2 | 0 | 0 | 112.1 | F52 T55 L282 E283 R288 K291 F292 V295 | F52-M286 HydrophobicContact CB-CE 4.35Å; F52-M286 HydrophobicContact CD2-CE 4.06Å; T55-M286 HydrophobicContact CG2-CG 4.43Å; T55-M286 HydrophobicContact CG2-SD 4.27Å; L282-M286 PolarHBondContact O-N 3.21Å; E283-M286 WeakPolarHBondContact O-CB 3.36Å; E283-M286 PolarHBondContact O-N 2.97Å; M286-R288 WeakPolarHBondContact CE-O 3.43Å; M286-R288 PolarHBondContact O-N 3.03Å; M286-K291 HydrophobicContact CE-CB 3.96Å; M286-F292 HydrophobicContact SD-CB 3.85Å; M286-F292 HydrophobicContact SD-CD2 4.06Å; M286-F292 HydrophobicContact SD-CG 4.48Å; M286-V295 HydrophobicContact CE-CG2 3.72Å; M286-V295 HydrophobicContact SD-CG2 4.31Å |
| 287 | Q | 86.8 | Confident | 90 | Very high | 92 Ų | 92 | 52.2 Ų | 52.2 | 43% | 0.43 | 25% | 0.249 | S | C | . | . | S | Bend | trans | -60.1 | -28.7 | 178.3 | -66.9 | 177.9 | 4.8 | 0 | 0 | 114.5 | G45 G49 T50 | G45-Q287 WeakPolarHBondContact O-CA 3.45Å; G49-Q287 VanDerWaalsContact C-CG 3.48Å; G49-Q287 VanDerWaalsContact O-CG 3.25Å; G49-Q287 WeakPolarHBondContact O-CG 3.34Å; G49-Q287 PolarHBondContact O-NE2 2.91Å; T50-Q287 WeakPolarHBondContact O-CG 3.5Å; T50-Q287 PolarHBondContact O-N 3.36Å |
| 288 | R | 86.2 | Confident | 90.6 | Very high | 157 Ų | 157 | 54.9 Ų | 54.9 | 59% | 0.592 | 26% | 0.258 | S | S | * | . | trans | -140.2 | 74.8 | -176.3 | -67.3 | -176.4 | 179.5 | 140.3 | -6.2 | 109.3 | M286 Q290 K291 | M286-R288 WeakPolarHBondContact CE-O 3.43Å; M286-R288 PolarHBondContact O-N 3.03Å; R288-Q290 PolarHBondContact O-N 3.24Å; R288-Q290 VanDerWaalsContact O-N 3.1Å; R288-K291 PolarHBondContact O-N 3.41Å | ||
| 289 | P | 85.1 | Confident | 90.9 | Very high | 13 Ų | 13 | 53 Ų | 53 | 8% | 0.084 | 25% | 0.246 | C | C | . | . | G | 310 helix | trans | -61.4 | -21.3 | -174 | 24.9 | -34 | 0 | 0 | 0 | 113 | E283 K291 F292 | E283-P289 HydrophobicContact CG-CB 3.9Å; P289-K291 PolarHBondContact O-N 3.36Å; P289-K291 VanDerWaalsContact O-N 3.11Å; P289-F292 WeakPolarHBondContact O-CB 3.17Å; P289-F292 PolarHBondContact O-N 3Å |
| 290 | Q | 85.6 | Confident | 91.1 | Very high | 145 Ų | 145 | 53 Ų | 53 | 68% | 0.678 | 25% | 0.246 | S | C | * | . | G | 310 helix | trans | -59.8 | -22.9 | 172 | -55.6 | 81.3 | 1 | 0 | 0 | 112.9 | R288 | R288-Q290 PolarHBondContact O-N 3.24Å; R288-Q290 VanDerWaalsContact O-N 3.1Å |
| 291 | K | 90.1 | Very high | 91.4 | Very high | 96 Ų | 96 | 54.7 Ų | 54.7 | 42% | 0.417 | 26% | 0.264 | S | S | . | . | G | 310 helix | trans | -93 | -1 | 173.8 | -61.4 | -162.3 | 175.4 | -160.2 | 0 | 113.3 | F52 M286 R288 P289 T293 Q294 V295 | F52-K291 HydrophobicContact CD2-CB 4.43Å; M286-K291 HydrophobicContact CE-CB 3.96Å; R288-K291 PolarHBondContact O-N 3.41Å; P289-K291 PolarHBondContact O-N 3.36Å; P289-K291 VanDerWaalsContact O-N 3.11Å; K291-T293 VanDerWaalsContact C-N 3.3Å; K291-T293 PolarHBondContact O-N 3.3Å; K291-Q294 WeakPolarHBondContact O-CB 3.43Å; K291-Q294 PolarHBondContact O-N 3.24Å; K291-V295 PolarHBondContact O-N 3.36Å |
| 292 | F | 92.6 | Very high | 91.8 | Very high | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.9 | -38.9 | -178.6 | -178.1 | -97.1 | 0 | 0 | 0 | 112 | T55 V102 V279 L282 E283 M286 P289 Q294 V295 L296 | T55-F292 HydrophobicContact CG2-CD2 4.09Å; T55-F292 HydrophobicContact CG2-CE2 4.07Å; V102-F292 HydrophobicContact CG2-CD1 4.12Å; V102-F292 HydrophobicContact CG2-CE1 3.85Å; V279-F292 HydrophobicContact CB-CZ 4.49Å; V279-F292 HydrophobicContact CG1-CE1 3.69Å; V279-F292 HydrophobicContact CG1-CZ 3.88Å; V279-F292 WeakPolarHBondContact O-CZ 3.32Å; L282-F292 HydrophobicContact CB-CE2 4.02Å; E283-F292 HydrophobicContact CB-CB 4.36Å; E283-F292 HydrophobicContact CB-CD1 3.85Å; E283-F292 HydrophobicContact CB-CD2 3.74Å; E283-F292 HydrophobicContact CB-CE1 4.09Å; E283-F292 HydrophobicContact CB-CE2 3.96Å; E283-F292 HydrophobicContact CB-CG 3.69Å; E283-F292 HydrophobicContact CB-CZ 4.13Å; E283-F292 HydrophobicContact CG-CB 3.91Å; E283-F292 HydrophobicContact CG-CD1 4Å; E283-F292 HydrophobicContact CG-CD2 4.23Å; E283-F292 HydrophobicContact CG-CG 3.76Å; M286-F292 HydrophobicContact SD-CB 3.85Å; M286-F292 HydrophobicContact SD-CD2 4.06Å; M286-F292 HydrophobicContact SD-CG 4.48Å; P289-F292 WeakPolarHBondContact O-CB 3.17Å; P289-F292 PolarHBondContact O-N 3Å; F292-Q294 PolarHBondContact O-N 3.17Å; F292-V295 CarbonylContact O-C 3.58Å; F292-V295 WeakPolarHBondContact O-CA 3.25Å; F292-V295 WeakPolarHBondContact O-CB 3.38Å; F292-V295 PolarHBondContact O-N 3.38Å; F292-L296 HydrophobicContact CE1-CB 4.31Å; F292-L296 HydrophobicContact CE1-CD1 4.44Å; F292-L296 HydrophobicContact CE1-CD2 4.36Å; F292-L296 HydrophobicContact CZ-CD1 4.46Å; F292-L296 PolarHBondContact O-N 3.41Å |
| 293 | T | 92.7 | Very high | 92.1 | Very high | 43 Ų | 43 | 54 Ų | 54 | 26% | 0.264 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -51.5 | -39.8 | 170.6 | -59.1 | 0 | 0 | 0 | 0 | 113.2 | M99 K291 L296 Y297 | M99-T293 HydrophobicContact CE-CG2 3.61Å; M99-T293 HydrophobicContact SD-CG2 3.74Å; K291-T293 VanDerWaalsContact C-N 3.3Å; K291-T293 PolarHBondContact O-N 3.3Å; T293-L296 PolarHBondContact O-N 3.31Å; T293-Y297 HydrophobicContact CG2-CD2 3.75Å; T293-Y297 HydrophobicContact CG2-CE2 3.45Å; T293-Y297 VanDerWaalsContact CG2-CE2 3.45Å; T293-Y297 WeakPolarHBondContact O-CD2 3.33Å; T293-Y297 PolarHBondContact O-N 3.47Å |
| 294 | Q | 94.7 | Very high | 92.4 | Very high | 112 Ų | 112 | 54.5 Ų | 54.5 | 52% | 0.523 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -71.3 | -38.4 | 177.3 | -63 | 177.8 | -27.9 | 0 | 0 | 111.5 | F52 K291 F292 L296 L298 | F52-Q294 HydrophobicContact CE2-CB 4.04Å; K291-Q294 WeakPolarHBondContact O-CB 3.43Å; K291-Q294 PolarHBondContact O-N 3.24Å; F292-Q294 PolarHBondContact O-N 3.17Å; Q294-L296 VanDerWaalsContact C-N 3.33Å; Q294-L298 VanDerWaalsContact O-CB 3.27Å; Q294-L298 WeakPolarHBondContact O-CB 3.23Å; Q294-L298 PolarHBondContact O-N 3.43Å; Q294-L298 VanDerWaalsContact O-N 3.11Å |
| 295 | V | 95.6 | Very high | 92.8 | Very high | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.8 | -43.2 | 172.6 | 179.4 | 0 | 0 | 0 | 0 | 110.6 | F52 T55 L56 L59 M286 K291 F292 G299 | F52-V295 HydrophobicContact CD1-CG2 4.47Å; F52-V295 HydrophobicContact CD2-CG2 3.35Å; F52-V295 HydrophobicContact CE1-CG2 4.45Å; F52-V295 HydrophobicContact CE2-CB 4.38Å; F52-V295 HydrophobicContact CE2-CG2 3.34Å; F52-V295 HydrophobicContact CG-CG2 3.95Å; F52-V295 HydrophobicContact CZ-CG2 3.92Å; T55-V295 HydrophobicContact CG2-CG1 4.18Å; L56-V295 HydrophobicContact CB-CG1 3.97Å; L56-V295 HydrophobicContact CD1-CG1 4.22Å; L59-V295 HydrophobicContact CD2-CG1 4.26Å; M286-V295 HydrophobicContact CE-CG2 3.72Å; M286-V295 HydrophobicContact SD-CG2 4.31Å; K291-V295 PolarHBondContact O-N 3.36Å; F292-V295 CarbonylContact O-C 3.58Å; F292-V295 WeakPolarHBondContact O-CA 3.25Å; F292-V295 WeakPolarHBondContact O-CB 3.38Å; F292-V295 PolarHBondContact O-N 3.38Å; V295-G299 PolarHBondContact O-N 3.2Å |
| 296 | L | 95.2 | Very high | 93.3 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -65.5 | -50.5 | -177.8 | -169.3 | 66.4 | 0 | 0 | 0 | 111.8 | L59 M98 M99 V279 F292 T293 Q294 L298 M300 | L59-L296 HydrophobicContact CD1-CD1 4.15Å; L59-L296 HydrophobicContact CD2-CD1 3.89Å; M98-L296 HydrophobicContact CB-CD1 4.39Å; M98-L296 HydrophobicContact CB-CD2 3.87Å; M98-L296 HydrophobicContact SD-CD1 3.95Å; M99-L296 HydrophobicContact CG-CD2 3.91Å; M99-L296 HydrophobicContact SD-CD2 3.71Å; V279-L296 HydrophobicContact CG2-CD1 4.27Å; F292-L296 HydrophobicContact CE1-CB 4.31Å; F292-L296 HydrophobicContact CE1-CD1 4.44Å; F292-L296 HydrophobicContact CE1-CD2 4.36Å; F292-L296 HydrophobicContact CZ-CD1 4.46Å; F292-L296 PolarHBondContact O-N 3.41Å; T293-L296 PolarHBondContact O-N 3.31Å; Q294-L296 VanDerWaalsContact C-N 3.33Å; L296-L298 PolarHBondContact O-N 3.41Å; L296-M300 HydrophobicContact CD1-CG 3.97Å; L296-M300 HydrophobicContact CG-CG 4.4Å; L296-M300 VanDerWaalsContact O-CB 3.29Å; L296-M300 WeakPolarHBondContact O-CB 3.12Å; L296-M300 WeakPolarHBondContact O-CG 3.31Å; L296-M300 PolarHBondContact O-N 3.25Å |
| 297 | Y | 96.2 | Very high | 93.7 | Very high | 133 Ų | 133 | 55.8 Ų | 55.8 | 52% | 0.522 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -61.9 | -43.2 | 176.8 | -75.4 | -56.7 | 0 | 0 | 0 | 112.4 | V95 M99 T293 G301 | V95-Y297 HydrophobicContact CG1-CD1 3.6Å; V95-Y297 HydrophobicContact CG1-CE1 3.54Å; M99-Y297 HydrophobicContact CG-CE1 4.39Å; M99-Y297 HydrophobicContact SD-CE2 4.42Å; T293-Y297 HydrophobicContact CG2-CD2 3.75Å; T293-Y297 HydrophobicContact CG2-CE2 3.45Å; T293-Y297 VanDerWaalsContact CG2-CE2 3.45Å; T293-Y297 WeakPolarHBondContact O-CD2 3.33Å; T293-Y297 PolarHBondContact O-N 3.47Å; Y297-G301 PolarHBondContact O-N 3.45Å |
| 298 | L | 96.9 | Very high | 94.3 | Very high | 80 Ų | 80 | 53.3 Ų | 53.3 | 42% | 0.419 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -65.9 | -49.1 | 178.5 | 178.8 | 59.3 | 0 | 0 | 0 | 111.6 | F52 L56 Q294 L296 G301 I302 | F52-L298 HydrophobicContact CE1-CD2 4.16Å; F52-L298 HydrophobicContact CZ-CD2 4.23Å; L56-L298 HydrophobicContact CD1-CB 4.44Å; L56-L298 HydrophobicContact CD1-CD2 4.43Å; L56-L298 HydrophobicContact CD1-CG 4.21Å; L56-L298 HydrophobicContact CD2-CD2 3.83Å; L56-L298 HydrophobicContact CD2-CG 4.31Å; Q294-L298 VanDerWaalsContact O-CB 3.27Å; Q294-L298 WeakPolarHBondContact O-CB 3.23Å; Q294-L298 PolarHBondContact O-N 3.43Å; Q294-L298 VanDerWaalsContact O-N 3.11Å; L296-L298 PolarHBondContact O-N 3.41Å; L298-G301 PolarHBondContact O-N 3.33Å; L298-I302 HydrophobicContact CD1-CD1 4.08Å; L298-I302 HydrophobicContact CG-CD1 4.17Å; L298-I302 WeakPolarHBondContact O-CD1 3.5Å; L298-I302 VanDerWaalsContact O-CG1 3.31Å; L298-I302 WeakPolarHBondContact O-CG1 3.35Å; L298-I302 PolarHBondContact O-N 3.39Å |
| 299 | G | 95.8 | Very high | 94.8 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.1 | -49.7 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L56 L60 V295 G301 I302 V303 | L56-G299 VanDerWaalsContact CD1-CA 3.4Å; L60-G299 WeakPolarHBondContact CD2-O 3.29Å; V295-G299 PolarHBondContact O-N 3.2Å; G299-G301 VanDerWaalsContact C-N 3.3Å; G299-G301 PolarHBondContact O-N 3.01Å; G299-I302 PolarHBondContact O-N 3.38Å; G299-V303 VanDerWaalsContact O-CG2 3.31Å; G299-V303 WeakPolarHBondContact O-CG2 3.17Å; G299-V303 PolarHBondContact O-N 3.47Å |
| 300 | M | 96 | Very high | 95.4 | Very high | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -71.2 | -25.9 | 179.3 | -62.4 | -56.6 | -63.5 | 0 | 0 | 113 | V95 M98 F273 L296 V303 T304 | V95-M300 HydrophobicContact CG2-CB 3.29Å; V95-M300 HydrophobicContact CG2-CG 3.88Å; M98-M300 HydrophobicContact CE-CE 3.7Å; M98-M300 HydrophobicContact CE-SD 4.23Å; M98-M300 HydrophobicContact SD-CE 4.15Å; M98-M300 HydrophobicContact SD-CG 4.22Å; M98-M300 HydrophobicContact SD-SD 4.11Å; F273-M300 HydrophobicContact CD1-CE 4.07Å; L296-M300 HydrophobicContact CD1-CG 3.97Å; L296-M300 HydrophobicContact CG-CG 4.4Å; L296-M300 VanDerWaalsContact O-CB 3.29Å; L296-M300 WeakPolarHBondContact O-CB 3.12Å; L296-M300 WeakPolarHBondContact O-CG 3.31Å; L296-M300 PolarHBondContact O-N 3.25Å; M300-V303 HydrophobicContact CE-CG1 4.33Å; M300-T304 VanDerWaalsContact O-CB 3.29Å; M300-T304 WeakPolarHBondContact O-CB 3.49Å; M300-T304 PolarHBondContact O-N 3.05Å; M300-T304 PolarHBondContact O-OG1 3.21Å |
| 301 | G | 97.3 | Very high | 95.9 | Very high | 39 Ų | 39 | 39 Ų | 39 | 40% | 0.402 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -63.2 | -46 | 168.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y297 L298 G299 T304 F305 | Y297-G301 PolarHBondContact O-N 3.45Å; L298-G301 PolarHBondContact O-N 3.33Å; G299-G301 VanDerWaalsContact C-N 3.3Å; G299-G301 PolarHBondContact O-N 3.01Å; G301-T304 PolarHBondContact O-N 2.69Å; G301-F305 WeakPolarHBondContact O-CB 3.26Å; G301-F305 PolarHBondContact O-N 2.93Å |
| 302 | I | 96.8 | Very high | 96.3 | Very high | 71 Ų | 71 | 35.5 Ų | 35.5 | 36% | 0.364 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -61.9 | -45.1 | 174.3 | -67.2 | 162.1 | 0 | 0 | 0 | 110.9 | L60 L298 G299 F305 L306 | L60-I302 HydrophobicContact CD2-CB 3.97Å; L60-I302 HydrophobicContact CD2-CG2 3.84Å; L298-I302 HydrophobicContact CD1-CD1 4.08Å; L298-I302 HydrophobicContact CG-CD1 4.17Å; L298-I302 WeakPolarHBondContact O-CD1 3.5Å; L298-I302 VanDerWaalsContact O-CG1 3.31Å; L298-I302 WeakPolarHBondContact O-CG1 3.35Å; L298-I302 PolarHBondContact O-N 3.39Å; G299-I302 PolarHBondContact O-N 3.38Å; I302-F305 PolarHBondContact O-N 3.48Å; I302-L306 WeakPolarHBondContact O-CB 3.43Å; I302-L306 PolarHBondContact O-N 3.36Å |
| 303 | V | 96.4 | Very high | 96.5 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -58.8 | -51 | 176 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | L60 N63 I64 F273 G299 M300 F305 L306 Y307 | L60-V303 HydrophobicContact CD2-CG2 3.82Å; N63-V303 HydrophobicContact CB-CG1 4.05Å; N63-V303 HydrophobicContact CB-CG2 3.9Å; I64-V303 HydrophobicContact CG1-CG2 4.49Å; F273-V303 HydrophobicContact CD1-CG1 4.42Å; F273-V303 HydrophobicContact CE1-CG1 4.31Å; G299-V303 VanDerWaalsContact O-CG2 3.31Å; G299-V303 WeakPolarHBondContact O-CG2 3.17Å; G299-V303 PolarHBondContact O-N 3.47Å; M300-V303 HydrophobicContact CE-CG1 4.33Å; V303-F305 VanDerWaalsContact C-N 3.34Å; V303-F305 PolarHBondContact O-N 2.94Å; V303-L306 PolarHBondContact O-N 3.36Å; V303-Y307 HydrophobicContact CG1-CD1 3.96Å; V303-Y307 HydrophobicContact CG1-CD2 3.99Å; V303-Y307 HydrophobicContact CG1-CE1 3.55Å; V303-Y307 HydrophobicContact CG1-CE2 3.51Å; V303-Y307 HydrophobicContact CG1-CG 4.2Å; V303-Y307 WeakPolarHBondContact O-CB 3.12Å; V303-Y307 WeakPolarHBondContact O-CD1 3.32Å; V303-Y307 PolarHBondContact O-N 2.92Å |
| 304 | T | 97.6 | Very high | 96.6 | Very high | 14 Ų | 14 | 34.4 Ų | 34.4 | 9% | 0.086 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -59.9 | -43 | 180 | -55.9 | 0 | 0 | 0 | 0 | 111.6 | L88 F273 M300 G301 Y307 I308 | L88-T304 HydrophobicContact CD1-CG2 4.12Å; F273-T304 HydrophobicContact CE1-CG2 4.48Å; F273-T304 WeakPolarHBondContact CE1-OG1 3.41Å; F273-T304 HydrophobicContact CZ-CG2 4.19Å; M300-T304 VanDerWaalsContact O-CB 3.29Å; M300-T304 WeakPolarHBondContact O-CB 3.49Å; M300-T304 PolarHBondContact O-N 3.05Å; M300-T304 PolarHBondContact O-OG1 3.21Å; G301-T304 PolarHBondContact O-N 2.69Å; T304-Y307 PolarHBondContact O-N 3.49Å; T304-I308 HydrophobicContact CG2-CD1 3.8Å; T304-I308 WeakPolarHBondContact O-CB 3.23Å; T304-I308 VanDerWaalsContact O-CG1 3.3Å; T304-I308 WeakPolarHBondContact O-CG1 3.3Å; T304-I308 PolarHBondContact O-N 3.49Å |
| 305 | F | 97.4 | Very high | 96.7 | Very high | 145 Ų | 145 | 29.1 Ų | 29.1 | 64% | 0.636 | 15% | 0.15 | S | C | * | . | H | α-helix | trans | -60.8 | -49.4 | 175.2 | 172.8 | -99.2 | 0 | 0 | 0 | 111.9 | G301 I302 V303 Y307 I308 S309 | G301-F305 WeakPolarHBondContact O-CB 3.26Å; G301-F305 PolarHBondContact O-N 2.93Å; I302-F305 PolarHBondContact O-N 3.48Å; V303-F305 VanDerWaalsContact C-N 3.34Å; V303-F305 PolarHBondContact O-N 2.94Å; F305-Y307 VanDerWaalsContact C-N 3.27Å; F305-Y307 PolarHBondContact O-N 3.26Å; F305-I308 PolarHBondContact O-N 3.31Å; F305-S309 WeakPolarHBondContact O-CB 3.34Å; F305-S309 PolarHBondContact O-N 2.69Å; F305-S309 PolarHBondContact O-OG 2.98Å |
| 306 | L | 96.4 | Very high | 96.7 | Very high | 32 Ų | 32 | 31.5 Ų | 31.5 | 17% | 0.168 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.5 | -36.2 | 179.1 | -177.8 | 64.8 | 0 | 0 | 0 | 112.3 | I64 L68 L236 I302 V303 S309 L310 | I64-L306 HydrophobicContact CD1-CD2 3.77Å; I64-L306 HydrophobicContact CG1-CD2 4.04Å; I64-L306 HydrophobicContact CG2-CD2 4.49Å; L68-L306 HydrophobicContact CD1-CG 4.28Å; L68-L306 HydrophobicContact CD2-CD2 3.75Å; L68-L306 HydrophobicContact CD2-CG 4.07Å; L236-L306 HydrophobicContact CD2-CD1 4.38Å; L236-L306 HydrophobicContact CD2-CD2 4.2Å; I302-L306 WeakPolarHBondContact O-CB 3.43Å; I302-L306 PolarHBondContact O-N 3.36Å; V303-L306 PolarHBondContact O-N 3.36Å; L306-S309 PolarHBondContact O-OG 3.37Å; L306-L310 VanDerWaalsContact O-CB 3.28Å; L306-L310 WeakPolarHBondContact O-CB 3.34Å; L306-L310 PolarHBondContact O-N 3.34Å |
| 307 | Y | 97.4 | Very high | 96.7 | Very high | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -69.9 | -47.9 | -179.7 | -78 | 17.9 | 0 | 0 | 0 | 111.4 | N63 L68 L71 A272 F273 V303 T304 F305 G311 | N63-Y307 PolarHBondContact O-OH 2.75Å; L68-Y307 HydrophobicContact CB-CE1 4.09Å; L68-Y307 HydrophobicContact CD1-CD1 3.67Å; L68-Y307 HydrophobicContact CD1-CE1 4.05Å; L68-Y307 HydrophobicContact CG-CE1 4.49Å; L71-Y307 VanDerWaalsContact CD1-CB 3.4Å; L71-Y307 HydrophobicContact CD1-CD1 3.84Å; L71-Y307 HydrophobicContact CD1-CD2 3.73Å; L71-Y307 HydrophobicContact CD1-CE1 4.5Å; L71-Y307 HydrophobicContact CD1-CE2 4.44Å; L71-Y307 HydrophobicContact CD1-CG 3.37Å; A272-Y307 VanDerWaalsContact C-CE2 3.46Å; A272-Y307 HydrophobicContact CB-CD2 4.1Å; A272-Y307 HydrophobicContact CB-CE2 3.56Å; A272-Y307 VanDerWaalsContact O-CE2 3.23Å; A272-Y307 WeakPolarHBondContact O-CE2 3.35Å; A272-Y307 PolarHBondContact O-OH 2.75Å; F273-Y307 AromaticContact CD1-CD2 3.91Å; F273-Y307 HydrophobicContact CD1-CD2 3.91Å; F273-Y307 AromaticContact CD1-CE2 3.79Å; F273-Y307 HydrophobicContact CD1-CE2 3.79Å; F273-Y307 HydrophobicContact CD2-CD2 4.29Å; F273-Y307 HydrophobicContact CD2-CE2 4.5Å; F273-Y307 AromaticContact CE1-CD2 3.54Å; F273-Y307 HydrophobicContact CE1-CD2 3.54Å; F273-Y307 AromaticContact CE1-CE2 3.89Å; F273-Y307 HydrophobicContact CE1-CE2 3.89Å; F273-Y307 HydrophobicContact CE1-CG 4.47Å; F273-Y307 AromaticContact CE2-CD2 3.96Å; F273-Y307 HydrophobicContact CE2-CD2 3.96Å; F273-Y307 HydrophobicContact CG-CD2 4.27Å; F273-Y307 HydrophobicContact CG-CE2 4.11Å; F273-Y307 AromaticContact CZ-CD2 3.57Å; F273-Y307 HydrophobicContact CZ-CD2 3.57Å; F273-Y307 HydrophobicContact CZ-CE2 4.3Å; F273-Y307 HydrophobicContact CZ-CG 4.41Å; V303-Y307 HydrophobicContact CG1-CD1 3.96Å; V303-Y307 HydrophobicContact CG1-CD2 3.99Å; V303-Y307 HydrophobicContact CG1-CE1 3.55Å; V303-Y307 HydrophobicContact CG1-CE2 3.51Å; V303-Y307 HydrophobicContact CG1-CG 4.2Å; V303-Y307 WeakPolarHBondContact O-CB 3.12Å; V303-Y307 WeakPolarHBondContact O-CD1 3.32Å; V303-Y307 PolarHBondContact O-N 2.92Å; T304-Y307 PolarHBondContact O-N 3.49Å; F305-Y307 VanDerWaalsContact C-N 3.27Å; F305-Y307 PolarHBondContact O-N 3.26Å; Y307-G311 PolarHBondContact O-N 3.43Å |
| 308 | I | 98.3 | Very high | 96.5 | Very high | 39 Ų | 39 | 27.1 Ų | 27.1 | 20% | 0.2 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -63 | -47.2 | 175.5 | -69.3 | 166.7 | 0 | 0 | 0 | 110.1 | P84 L87 L88 T304 F305 T312 | P84-I308 HydrophobicContact CB-CG2 4.13Å; L87-I308 HydrophobicContact CB-CG1 3.77Å; L87-I308 HydrophobicContact CD1-CG1 4.49Å; L88-I308 HydrophobicContact CB-CD1 3.79Å; L88-I308 HydrophobicContact CD1-CD1 4.12Å; T304-I308 HydrophobicContact CG2-CD1 3.8Å; T304-I308 WeakPolarHBondContact O-CB 3.23Å; T304-I308 VanDerWaalsContact O-CG1 3.3Å; T304-I308 WeakPolarHBondContact O-CG1 3.3Å; T304-I308 PolarHBondContact O-N 3.49Å; F305-I308 PolarHBondContact O-N 3.31Å; I308-T312 VanDerWaalsContact O-CB 3.31Å; I308-T312 WeakPolarHBondContact O-CB 3.35Å; I308-T312 PolarHBondContact O-N 2.91Å; I308-T312 PolarHBondContact O-OG1 3.41Å |
| 309 | S | 97.4 | Very high | 96.3 | Very high | 15 Ų | 15 | 23.8 Ų | 23.8 | 11% | 0.105 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -67.8 | -51.8 | -175.3 | 71.5 | 0 | 0 | 0 | 0 | 112 | Y240 F305 L306 G311 T312 I313 | Y240-S309 VanDerWaalsContact OH-CB 3.32Å; Y240-S309 WeakPolarHBondContact OH-CB 3.47Å; Y240-S309 PolarHBondContact OH-OG 3.44Å; F305-S309 WeakPolarHBondContact O-CB 3.34Å; F305-S309 PolarHBondContact O-N 2.69Å; F305-S309 PolarHBondContact O-OG 2.98Å; L306-S309 PolarHBondContact O-OG 3.37Å; S309-G311 PolarHBondContact O-N 2.76Å; S309-T312 PolarHBondContact O-N 2.95Å; S309-I313 VanDerWaalsContact O-CB 3.3Å; S309-I313 WeakPolarHBondContact O-CB 3.49Å; S309-I313 WeakPolarHBondContact O-CD1 3.36Å; S309-I313 WeakPolarHBondContact O-CG1 3.34Å; S309-I313 PolarHBondContact O-N 3.26Å |
| 310 | L | 96.7 | Very high | 96 | Very high | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -64.1 | -42.3 | 178.6 | -170.1 | 77.3 | 0 | 0 | 0 | 111.6 | L68 L236 I239 Y240 L306 T312 G314 I326 | L68-L310 HydrophobicContact CD1-CB 3.97Å; L68-L310 HydrophobicContact CD1-CD2 3.43Å; L68-L310 VanDerWaalsContact CD1-CD2 3.43Å; L68-L310 HydrophobicContact CD1-CG 4.32Å; L68-L310 HydrophobicContact CD2-CD2 4.24Å; L68-L310 HydrophobicContact CG-CD2 3.56Å; L236-L310 HydrophobicContact CD1-CD1 4.38Å; L236-L310 HydrophobicContact CD1-CD2 3.96Å; I239-L310 HydrophobicContact CG2-CD1 4.42Å; Y240-L310 HydrophobicContact CD2-CD1 3.8Å; Y240-L310 HydrophobicContact CE2-CD1 4.47Å; L306-L310 VanDerWaalsContact O-CB 3.28Å; L306-L310 WeakPolarHBondContact O-CB 3.34Å; L306-L310 PolarHBondContact O-N 3.34Å; L310-T312 PolarHBondContact O-N 3.14Å; L310-G314 WeakPolarHBondContact O-CA 3.35Å; L310-G314 PolarHBondContact O-N 3.01Å; L310-I326 HydrophobicContact CD1-CD1 4.22Å |
| 311 | G | 97.4 | Very high | 95.7 | Very high | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -58.5 | -46.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y307 S309 Y315 | Y307-G311 PolarHBondContact O-N 3.43Å; S309-G311 PolarHBondContact O-N 2.76Å; G311-Y315 PolarHBondContact O-N 3.46Å |
| 312 | T | 97.2 | Very high | 95.6 | Very high | 22 Ų | 22 | 34.8 Ų | 34.8 | 14% | 0.135 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -68.1 | -51.1 | 179.2 | -48.1 | 0 | 0 | 0 | 0 | 111.7 | L80 P84 I308 S309 L310 G314 Y315 M316 | L80-T312 HydrophobicContact CD1-CG2 4.15Å; P84-T312 HydrophobicContact CG-CG2 4.25Å; P84-T312 VanDerWaalsContact CG-OG1 3.27Å; P84-T312 WeakPolarHBondContact CG-OG1 3.48Å; I308-T312 VanDerWaalsContact O-CB 3.31Å; I308-T312 WeakPolarHBondContact O-CB 3.35Å; I308-T312 PolarHBondContact O-N 2.91Å; I308-T312 PolarHBondContact O-OG1 3.41Å; S309-T312 PolarHBondContact O-N 2.95Å; L310-T312 PolarHBondContact O-N 3.14Å; T312-G314 PolarHBondContact O-N 2.83Å; T312-Y315 PolarHBondContact O-N 2.88Å; T312-M316 HydrophobicContact CG2-CE 3.8Å; T312-M316 HydrophobicContact CG2-SD 4.17Å; T312-M316 WeakPolarHBondContact O-CG 3.19Å; T312-M316 PolarHBondContact O-N 2.74Å |
| 313 | I | 96.6 | Very high | 95.4 | Very high | 20 Ų | 20 | 32.6 Ų | 32.6 | 10% | 0.103 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -65 | -40.5 | -176.6 | -67.4 | 162.7 | 0 | 0 | 0 | 110.6 | Y240 L244 I247 S309 M316 C317 | Y240-I313 HydrophobicContact CE1-CD1 4.09Å; Y240-I313 HydrophobicContact CE2-CD1 3.89Å; Y240-I313 VanDerWaalsContact CZ-CD1 3.5Å; Y240-I313 VanDerWaalsContact OH-CD1 3.31Å; Y240-I313 WeakPolarHBondContact OH-CD1 3.46Å; L244-I313 HydrophobicContact CD2-CD1 3.8Å; L244-I313 HydrophobicContact CD2-CG1 4.18Å; L244-I313 HydrophobicContact CD2-CG2 4.03Å; L244-I313 HydrophobicContact CG-CD1 4.42Å; L244-I313 HydrophobicContact CG-CG2 4.22Å; I247-I313 HydrophobicContact CD1-CG2 4.46Å; S309-I313 VanDerWaalsContact O-CB 3.3Å; S309-I313 WeakPolarHBondContact O-CB 3.49Å; S309-I313 WeakPolarHBondContact O-CD1 3.36Å; S309-I313 WeakPolarHBondContact O-CG1 3.34Å; S309-I313 PolarHBondContact O-N 3.26Å; I313-M316 PolarHBondContact O-N 3.09Å; I313-C317 WeakPolarHBondContact O-CB 3.47Å; I313-C317 PolarHBondContact O-N 3.24Å |
| 314 | G | 96.1 | Very high | 95.1 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61.7 | -43.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L310 T312 C317 F318 | L310-G314 WeakPolarHBondContact O-CA 3.35Å; L310-G314 PolarHBondContact O-N 3.01Å; T312-G314 PolarHBondContact O-N 2.83Å; G314-C317 PolarHBondContact O-N 3.11Å; G314-F318 WeakPolarHBondContact O-CD2 3.41Å; G314-F318 PolarHBondContact O-N 3.12Å |
| 315 | Y | 96.4 | Very high | 95 | Very high | 1 Ų | 1 | 32.5 Ų | 32.5 | 0% | 0.004 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -67.3 | -39.8 | 175.1 | -175 | -139.3 | 0 | 0 | 0 | 112.1 | V75 K76 L80 L253 P254 G311 T312 C317 G319 E320 | V75-Y315 HydrophobicContact CG1-CD1 3.94Å; V75-Y315 HydrophobicContact CG1-CG 4.36Å; K76-Y315 HydrophobicContact CB-CD2 3.59Å; K76-Y315 HydrophobicContact CB-CE2 3.47Å; K76-Y315 VanDerWaalsContact CB-CE2 3.47Å; K76-Y315 HydrophobicContact CB-CG 4.24Å; K76-Y315 HydrophobicContact CD-CE2 4.19Å; K76-Y315 HydrophobicContact CG-CD2 4.23Å; K76-Y315 HydrophobicContact CG-CE2 3.63Å; L80-Y315 HydrophobicContact CB-CD1 4.28Å; L80-Y315 HydrophobicContact CB-CE1 4.14Å; L80-Y315 HydrophobicContact CD1-CD1 3.84Å; L80-Y315 HydrophobicContact CD1-CE1 4.44Å; L253-Y315 HydrophobicContact CB-CE1 4.22Å; L253-Y315 HydrophobicContact CD1-CD1 4.2Å; L253-Y315 HydrophobicContact CD1-CD2 4.46Å; L253-Y315 HydrophobicContact CD1-CE1 4.16Å; L253-Y315 HydrophobicContact CD1-CE2 4.41Å; L253-Y315 HydrophobicContact CD1-CG 4.37Å; L253-Y315 WeakPolarHBondContact CD1-O 3.32Å; L253-Y315 HydrophobicContact CD2-CE2 4.21Å; P254-Y315 WeakPolarHBondContact CD-OH 3.37Å; G311-Y315 PolarHBondContact O-N 3.46Å; T312-Y315 PolarHBondContact O-N 2.88Å; Y315-C317 VanDerWaalsContact C-N 3.3Å; Y315-C317 PolarHBondContact O-N 2.76Å; Y315-G319 VanDerWaalsContact O-CA 3.26Å; Y315-G319 WeakPolarHBondContact O-CA 3.32Å; Y315-G319 PolarHBondContact O-N 3Å; Y315-E320 PolarHBondContact OH-OE1 2.81Å |
| 316 | M | 95.9 | Very high | 94.9 | Very high | 50 Ų | 50 | 25.6 Ų | 25.6 | 25% | 0.246 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -62.1 | -33.7 | 174.2 | -71.9 | 179.2 | 170.2 | 0 | 0 | 113.4 | L80 I247 I251 T312 I313 | L80-M316 HydrophobicContact CD1-CE 3.86Å; L80-M316 HydrophobicContact CD1-CG 3.73Å; L80-M316 HydrophobicContact CD2-CE 4.17Å; L80-M316 HydrophobicContact CG-CE 4.3Å; I247-M316 HydrophobicContact CD1-CB 4.36Å; I247-M316 HydrophobicContact CG1-CB 4.45Å; I247-M316 HydrophobicContact CG2-CB 4.19Å; I251-M316 HydrophobicContact CD1-CE 4.15Å; I251-M316 HydrophobicContact CD1-CG 4.36Å; I251-M316 HydrophobicContact CD1-SD 4.04Å; T312-M316 HydrophobicContact CG2-CE 3.8Å; T312-M316 HydrophobicContact CG2-SD 4.17Å; T312-M316 WeakPolarHBondContact O-CG 3.19Å; T312-M316 PolarHBondContact O-N 2.74Å; I313-M316 PolarHBondContact O-N 3.09Å |
| 317 | C | 94.2 | Very high | 94.8 | Very high | 13 Ų | 13 | 24.1 Ų | 24.1 | 9% | 0.088 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -78.1 | -45.7 | 180 | -177.8 | 0 | 0 | 0 | 0 | 112.8 | I313 G314 Y315 | I313-C317 WeakPolarHBondContact O-CB 3.47Å; I313-C317 PolarHBondContact O-N 3.24Å; G314-C317 PolarHBondContact O-N 3.11Å; Y315-C317 VanDerWaalsContact C-N 3.3Å; Y315-C317 PolarHBondContact O-N 2.76Å |
| 318 | F | 93.1 | Very high | 94.6 | Very high | 28 Ų | 28 | 25.5 Ų | 25.5 | 12% | 0.123 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -105.2 | -16.4 | -169.9 | -61.7 | -68.9 | 0 | 0 | 0 | 114.6 | Y242 G314 E320 H321 I322 I326 N329 | Y242-F318 HydrophobicContact CD1-CZ 4.05Å; Y242-F318 AromaticContact CE1-CE1 3.93Å; Y242-F318 HydrophobicContact CE1-CE1 3.93Å; Y242-F318 AromaticContact CE1-CZ 3.67Å; Y242-F318 HydrophobicContact CE1-CZ 3.67Å; G314-F318 WeakPolarHBondContact O-CD2 3.41Å; G314-F318 PolarHBondContact O-N 3.12Å; F318-E320 PolarHBondContact O-N 3.1Å; F318-H321 PolarHBondContact O-N 3.33Å; F318-H321 VanDerWaalsContact O-N 3.12Å; F318-I322 HydrophobicContact CB-CB 4.07Å; F318-I322 HydrophobicContact CB-CD1 3.81Å; F318-I322 HydrophobicContact CD2-CD1 3.62Å; F318-I322 HydrophobicContact CG-CD1 4Å; F318-I326 HydrophobicContact CD2-CG1 4.2Å; F318-I326 HydrophobicContact CE2-CD1 4.04Å; F318-I326 HydrophobicContact CE2-CG1 3.66Å; F318-N329 HydrophobicContact CD1-CB 3.61Å; F318-N329 HydrophobicContact CD2-CB 4.18Å; F318-N329 HydrophobicContact CE1-CB 3.52Å; F318-N329 VanDerWaalsContact CE1-O 3.28Å; F318-N329 WeakPolarHBondContact CE1-O 3.3Å; F318-N329 HydrophobicContact CE2-CB 4.12Å; F318-N329 HydrophobicContact CG-CB 3.93Å; F318-N329 HydrophobicContact CZ-CB 3.77Å |
| 319 | G | 92.5 | Very high | 94.3 | Very high | 10 Ų | 10 | 25.3 Ų | 25.3 | 10% | 0.103 | 14% | 0.138 | C | C | . | . | G | 310 helix | trans | 53 | -131 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y315 H321 I322 | Y315-G319 VanDerWaalsContact O-CA 3.26Å; Y315-G319 WeakPolarHBondContact O-CA 3.32Å; Y315-G319 PolarHBondContact O-N 3Å; G319-H321 PolarHBondContact O-N 2.99Å; G319-I322 WeakPolarHBondContact O-CG2 3.3Å; G319-I322 PolarHBondContact O-N 3.13Å |
| 320 | E | 89.6 | Confident | 94 | Very high | 100 Ų | 100 | 24.8 Ų | 24.8 | 47% | 0.467 | 13% | 0.134 | S | C | . | . | G | 310 helix | trans | -66.7 | -19.1 | -179.4 | -72.8 | -55.7 | 121.1 | 0 | 0 | 114.5 | K76 Y315 F318 | K76-E320 WeakPolarHBondContact CE-OE2 3.48Å; K76-E320 PolarHBondContact NZ-O 3.47Å; K76-E320 IonicContact NZ-OE2 2.58Å; K76-E320 PolarHBondContact NZ-OE2 3.03Å; Y315-E320 PolarHBondContact OH-OE1 2.81Å; F318-E320 PolarHBondContact O-N 3.1Å |
| 321 | H | 90.1 | Very high | 93.6 | Very high | 162 Ų | 162 | 26.4 Ų | 26.4 | 75% | 0.75 | 14% | 0.144 | S | C | * | . | G | 310 helix | trans | -88 | 2 | -176.9 | -57.9 | -69.6 | 0 | 0 | 0 | 114.2 | F318 G319 G323 N329 | F318-H321 PolarHBondContact O-N 3.33Å; F318-H321 VanDerWaalsContact O-N 3.12Å; G319-H321 PolarHBondContact O-N 2.99Å; H321-G323 PolarHBondContact O-N 3.5Å; H321-N329 PolarHBondContact O-ND2 2.9Å |
| 322 | I | 93.5 | Very high | 93 | Very high | 9 Ų | 9 | 29 Ų | 29 | 5% | 0.046 | 16% | 0.158 | C | C | . | . | trans | -59.2 | 126.7 | 176.3 | -167.6 | 77.9 | 0 | 0 | 0 | 111 | P72 L73 K76 F318 G319 I326 N329 | P72-I322 HydrophobicContact CB-CD1 3.72Å; P72-I322 HydrophobicContact CB-CG1 3.87Å; L73-I322 HydrophobicContact CB-CG1 4.4Å; L73-I322 HydrophobicContact CB-CG2 4.27Å; L73-I322 HydrophobicContact CD1-CG2 4.02Å; K76-I322 HydrophobicContact CB-CG2 3.99Å; K76-I322 HydrophobicContact CD-CG2 3.5Å; K76-I322 HydrophobicContact CG-CG2 4.35Å; F318-I322 HydrophobicContact CB-CB 4.07Å; F318-I322 HydrophobicContact CB-CD1 3.81Å; F318-I322 HydrophobicContact CD2-CD1 3.62Å; F318-I322 HydrophobicContact CG-CD1 4Å; G319-I322 WeakPolarHBondContact O-CG2 3.3Å; G319-I322 PolarHBondContact O-N 3.13Å; I322-I326 HydrophobicContact CD1-CG1 4.39Å; I322-N329 WeakPolarHBondContact CD1-OD1 3.37Å | ||
| 323 | G | 92.6 | Very high | 92.5 | Very high | 24 Ų | 24 | 28.1 Ų | 28.1 | 25% | 0.247 | 15% | 0.152 | C | C | . | . | trans | -89.1 | -174 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | H321 S325 N329 | H321-G323 PolarHBondContact O-N 3.5Å; G323-S325 PolarHBondContact O-N 3.44Å; G323-N329 PolarHBondContact N-OD1 3Å | ||
| 324 | G | 90.7 | Very high | 92.1 | Very high | 12 Ų | 12 | 33.7 Ų | 33.7 | 12% | 0.124 | 17% | 0.172 | C | C | . | . | S | Bend | trans | -59.7 | -18.6 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 325 | S | 94.9 | Very high | 91.8 | Very high | 1 Ų | 1 | 37.1 Ų | 37.1 | 1% | 0.007 | 19% | 0.194 | C | C | . | . | S | Bend | trans | -149.2 | 150.2 | 163.3 | 60.6 | 0 | 0 | 0 | 0 | 111.4 | L69 G323 T327 L328 L400 | L69-S325 CarbonylContact O-C 3.57Å; L69-S325 VanDerWaalsContact O-CA 3.3Å; L69-S325 WeakPolarHBondContact O-CA 3.39Å; G323-S325 PolarHBondContact O-N 3.44Å; S325-T327 PolarHBondContact O-N 3.21Å; S325-T327 VanDerWaalsContact O-N 3.1Å; S325-T327 PolarHBondContact OG-OG1 2.99Å; S325-L328 WeakPolarHBondContact O-CB 3.15Å; S325-L328 PolarHBondContact O-N 3.32Å; S325-L400 WeakPolarHBondContact OG-CD2 3.44Å |
| 326 | I | 95.4 | Very high | 91.5 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 20% | 0.199 | C | C | . | . | G | 310 helix | trans | -58 | -25.6 | -177.2 | -166.3 | 169.5 | 0 | 0 | 0 | 114 | L69 P72 I239 L310 F318 I322 L328 N329 | L69-I326 HydrophobicContact CB-CG2 4.18Å; L69-I326 HydrophobicContact CD2-CG2 3.81Å; L69-I326 PolarHBondContact O-N 2.85Å; P72-I326 HydrophobicContact CG-CB 4.18Å; P72-I326 HydrophobicContact CG-CD1 4.03Å; P72-I326 HydrophobicContact CG-CG1 4.5Å; I239-I326 HydrophobicContact CG2-CD1 3.7Å; I239-I326 HydrophobicContact CG2-CG1 4.03Å; I239-I326 HydrophobicContact CG2-CG2 4Å; L310-I326 HydrophobicContact CD1-CD1 4.22Å; F318-I326 HydrophobicContact CD2-CG1 4.2Å; F318-I326 HydrophobicContact CE2-CD1 4.04Å; F318-I326 HydrophobicContact CE2-CG1 3.66Å; I322-I326 HydrophobicContact CD1-CG1 4.39Å; I326-L328 VanDerWaalsContact C-N 3.26Å; I326-L328 PolarHBondContact O-N 3.1Å; I326-N329 PolarHBondContact O-N 2.93Å |
| 327 | T | 94.6 | Very high | 91.3 | Very high | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 19% | 0.188 | C | C | . | . | G | 310 helix | trans | -66.5 | -30.1 | 177.1 | 57.8 | 0 | 0 | 0 | 0 | 112.1 | L69 F162 N166 I239 S325 N329 L330 K340 | L69-T327 HydrophobicContact CD1-CG2 4.02Å; L69-T327 HydrophobicContact CD2-CG2 4.44Å; F162-T327 HydrophobicContact CE2-CG2 4.43Å; F162-T327 WeakPolarHBondContact CE2-OG1 3.14Å; F162-T327 HydrophobicContact CZ-CG2 4.21Å; N166-T327 PolarHBondContact ND2-OG1 3.44Å; N166-T327 VanDerWaalsContact OD1-CB 3.23Å; N166-T327 WeakPolarHBondContact OD1-CB 3.48Å; N166-T327 PolarHBondContact OD1-OG1 2.91Å; I239-T327 HydrophobicContact CD1-CG2 3.78Å; S325-T327 PolarHBondContact O-N 3.21Å; S325-T327 VanDerWaalsContact O-N 3.1Å; S325-T327 PolarHBondContact OG-OG1 2.99Å; T327-N329 PolarHBondContact O-N 3.4Å; T327-L330 PolarHBondContact O-N 2.99Å; T327-K340 WeakPolarHBondContact O-CE 2.95Å |
| 328 | L | 92.6 | Very high | 91.3 | Very high | 30 Ų | 30 | 37.8 Ų | 37.8 | 16% | 0.157 | 20% | 0.201 | C | C | . | . | G | 310 helix | trans | -70.4 | -11.5 | 178.7 | -59.8 | 176 | 0 | 0 | 0 | 113.3 | D165 Q169 S325 I326 L400 | D165-L328 HydrophobicContact CB-CD1 4.3Å; D165-L328 HydrophobicContact CB-CD2 3.82Å; Q169-L328 HydrophobicContact CG-CD2 4.26Å; Q169-L328 PolarHBondContact NE2-O 3.1Å; Q169-L328 PolarHBondContact OE1-O 3.25Å; S325-L328 WeakPolarHBondContact O-CB 3.15Å; S325-L328 PolarHBondContact O-N 3.32Å; I326-L328 VanDerWaalsContact C-N 3.26Å; I326-L328 PolarHBondContact O-N 3.1Å; L328-L400 HydrophobicContact CD1-CD2 4.5Å |
| 329 | N | 93.2 | Very high | 91.3 | Very high | 35 Ų | 35 | 36.6 Ų | 36.6 | 19% | 0.187 | 20% | 0.196 | C | C | . | . | G | 310 helix | trans | -101.8 | -2.2 | 177.6 | -68 | 102.2 | 0 | 0 | 0 | 114.1 | F318 H321 I322 G323 I326 T327 | F318-N329 HydrophobicContact CD1-CB 3.61Å; F318-N329 HydrophobicContact CD2-CB 4.18Å; F318-N329 HydrophobicContact CE1-CB 3.52Å; F318-N329 VanDerWaalsContact CE1-O 3.28Å; F318-N329 WeakPolarHBondContact CE1-O 3.3Å; F318-N329 HydrophobicContact CE2-CB 4.12Å; F318-N329 HydrophobicContact CG-CB 3.93Å; F318-N329 HydrophobicContact CZ-CB 3.77Å; H321-N329 PolarHBondContact O-ND2 2.9Å; I322-N329 WeakPolarHBondContact CD1-OD1 3.37Å; G323-N329 PolarHBondContact N-OD1 3Å; I326-N329 PolarHBondContact O-N 2.93Å; T327-N329 PolarHBondContact O-N 3.4Å |
| 330 | L | 90.8 | Very high | 91.4 | Very high | 4 Ų | 4 | 36.1 Ų | 36.1 | 2% | 0.021 | 19% | 0.191 | C | C | . | . | S | Bend | trans | -71.4 | 141.5 | 178.9 | -60.8 | 171.2 | 0 | 0 | 0 | 111.3 | I239 Y242 T327 Y336 V339 K340 | I239-L330 HydrophobicContact CD1-CD1 4.4Å; I239-L330 HydrophobicContact CG1-CD1 3.94Å; I239-L330 HydrophobicContact CG1-CD2 4.2Å; Y242-L330 HydrophobicContact CD1-CD2 3.99Å; Y242-L330 HydrophobicContact CG-CD2 4.49Å; T327-L330 PolarHBondContact O-N 2.99Å; L330-Y336 HydrophobicContact CB-CG 4.27Å; L330-Y336 HydrophobicContact CD1-CD1 4.28Å; L330-Y336 HydrophobicContact CD2-CD1 4.11Å; L330-V339 HydrophobicContact CD1-CG1 3.89Å; L330-K340 HydrophobicContact CD1-CG 4.41Å; L330-K340 PolarHBondContact O-NZ 3.06Å |
| 331 | P | 88.5 | Confident | 91.7 | Very high | 34 Ų | 34 | 35.1 Ų | 35.1 | 22% | 0.221 | 19% | 0.188 | C | C | . | . | trans | -72.8 | 158.9 | -173 | 31.2 | -36.1 | 0 | 0 | 0 | 112.4 | Y242 C333 Y336 | Y242-P331 HydrophobicContact CE2-CG 3.65Å; Y242-P331 VanDerWaalsContact CZ-CD 3.49Å; P331-C333 PolarHBondContact O-N 2.9Å; P331-Y336 HydrophobicContact CG-CD2 3.63Å; P331-Y336 HydrophobicContact CG-CE2 3.99Å; P331-Y336 HydrophobicContact CG-CG 4.47Å | ||
| 332 | N | 84.1 | Confident | 91.9 | Very high | 55 Ų | 55 | 30.9 Ų | 30.9 | 29% | 0.294 | 17% | 0.171 | S | C | . | . | S | Bend | trans | -79.8 | 41.9 | -169 | -66.7 | -32.6 | 0 | 0 | 0 | 115 | A173 T177 T178 Q337 | A173-N332 HydrophobicContact CB-CB 4.09Å; A173-N332 WeakPolarHBondContact CB-OD1 3.49Å; T177-N332 WeakPolarHBondContact CA-O 3.3Å; T178-N332 PolarHBondContact N-O 3.46Å; N332-Q337 PolarHBondContact OD1-NE2 3.17Å; N332-Q337 VanDerWaalsContact OD1-NE2 3.11Å |
| 333 | C | 86.8 | Confident | 91.9 | Very high | 2 Ų | 2 | 30.5 Ų | 30.5 | 1% | 0.014 | 17% | 0.169 | C | C | . | . | B | Isolated β-bridge | trans | -102 | 154.5 | 171.2 | 72.2 | 0 | 0 | 0 | 0 | 112 | T178 C181 P331 T335 Y336 Q337 | T178-C333 WeakPolarHBondContact O-CA 3.41Å; T178-C333 WeakPolarHBondContact O-CB 3.45Å; C181-C333 HydrophobicContact CB-CB 3.85Å; C181-C333 WeakPolarHBondContact CB-SG 3.2Å; C181-C333 WeakPolarHBondContact SG-CB 3.29Å; C181-C333 CovalentContact SG-SG 2.03Å; C181-C333 PolarHBondContact SG-SG 3.18Å; P331-C333 PolarHBondContact O-N 2.9Å; C333-T335 PolarHBondContact O-N 3.49Å; C333-T335 VanDerWaalsContact O-N 3.08Å; C333-Y336 PolarHBondContact O-N 3.46Å; C333-Y336 WeakPolarHBondContact SG-CD2 3.48Å; C333-Q337 PolarHBondContact O-N 3.45Å |
| 334 | W | 87.6 | Confident | 92 | Very high | 138 Ų | 138 | 29.9 Ų | 29.9 | 52% | 0.523 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -49.7 | -38.9 | -174.7 | -80 | 100.9 | 0 | 0 | 0 | 114.6 | T177 T178 F179 Y336 Q337 A338 | T177-W334 WeakPolarHBondContact OG1-CZ2 3.4Å; T177-W334 PolarHBondContact OG1-NE1 2.92Å; T178-W334 PolarHBondContact O-N 3.19Å; F179-W334 AromaticContact CD1-CD1 4Å; W334-Y336 PolarHBondContact O-N 2.93Å; W334-Q337 PolarHBondContact O-N 3.42Å; W334-A338 WeakPolarHBondContact O-CB 3.2Å; W334-A338 PolarHBondContact O-N 3.36Å |
| 335 | T | 90.4 | Very high | 92.1 | Very high | 72 Ų | 72 | 32.8 Ų | 32.8 | 44% | 0.442 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -58.1 | -47.2 | 177 | -52 | 0 | 0 | 0 | 0 | 112.3 | C333 A338 V339 | C333-T335 PolarHBondContact O-N 3.49Å; C333-T335 VanDerWaalsContact O-N 3.08Å; T335-A338 PolarHBondContact O-N 3.32Å; T335-V339 WeakPolarHBondContact O-CG2 3.28Å; T335-V339 PolarHBondContact O-N 3.03Å |
| 336 | Y | 91.3 | Very high | 92 | Very high | 29 Ų | 29 | 32.8 Ų | 32.8 | 11% | 0.114 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -83.3 | -25.5 | -177.8 | -62.4 | -66.4 | 0 | 0 | 0 | 113.3 | C181 Y242 L330 P331 C333 W334 A338 V339 K340 | C181-Y336 HydrophobicContact CB-CE2 4.42Å; Y242-Y336 HydrophobicContact CD2-CE1 4.26Å; Y242-Y336 AromaticContact CD2-CE2 3.77Å; Y242-Y336 HydrophobicContact CD2-CE2 3.77Å; Y242-Y336 AromaticContact CD2-CZ 3.53Å; Y242-Y336 WeakPolarHBondContact CD2-OH 3.43Å; Y242-Y336 HydrophobicContact CE2-CE2 4.19Å; Y242-Y336 HydrophobicContact CG-CE1 4.19Å; Y242-Y336 HydrophobicContact CG-CE2 4.46Å; Y242-Y336 AromaticContact CG-CZ 3.91Å; L330-Y336 HydrophobicContact CB-CG 4.27Å; L330-Y336 HydrophobicContact CD1-CD1 4.28Å; L330-Y336 HydrophobicContact CD2-CD1 4.11Å; P331-Y336 HydrophobicContact CG-CD2 3.63Å; P331-Y336 HydrophobicContact CG-CE2 3.99Å; P331-Y336 HydrophobicContact CG-CG 4.47Å; C333-Y336 PolarHBondContact O-N 3.46Å; C333-Y336 WeakPolarHBondContact SG-CD2 3.48Å; W334-Y336 PolarHBondContact O-N 2.93Å; Y336-A338 VanDerWaalsContact C-N 3.32Å; Y336-V339 HydrophobicContact CD1-CG2 4.33Å; Y336-V339 WeakPolarHBondContact O-CB 3.39Å; Y336-V339 PolarHBondContact O-N 3.01Å; Y336-K340 WeakPolarHBondContact O-CG 3.3Å; Y336-K340 PolarHBondContact O-N 3.29Å |
| 337 | Q | 91.9 | Very high | 92 | Very high | 5 Ų | 5 | 32.8 Ų | 32.8 | 2% | 0.023 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -64.7 | -39.7 | 167.2 | -57.1 | -59.3 | 6.3 | 0 | 0 | 111.1 | T177 N332 C333 W334 K340 L341 | T177-Q337 HydrophobicContact CG2-CG 3.85Å; N332-Q337 PolarHBondContact OD1-NE2 3.17Å; N332-Q337 VanDerWaalsContact OD1-NE2 3.11Å; C333-Q337 PolarHBondContact O-N 3.45Å; W334-Q337 PolarHBondContact O-N 3.42Å; Q337-K340 PolarHBondContact O-N 2.83Å; Q337-L341 WeakPolarHBondContact O-CG 3.37Å; Q337-L341 PolarHBondContact O-N 3Å |
| 338 | A | 92.9 | Very high | 92 | Very high | 43 Ų | 43 | 34.6 Ų | 34.6 | 36% | 0.355 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -60.4 | -44.8 | 170.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | W334 T335 Y336 K340 L341 L342 | W334-A338 WeakPolarHBondContact O-CB 3.2Å; W334-A338 PolarHBondContact O-N 3.36Å; T335-A338 PolarHBondContact O-N 3.32Å; Y336-A338 VanDerWaalsContact C-N 3.32Å; A338-K340 PolarHBondContact O-N 3.22Å; A338-L341 PolarHBondContact O-N 3.16Å; A338-L342 WeakPolarHBondContact O-CB 3.39Å; A338-L342 WeakPolarHBondContact O-CG 3.36Å; A338-L342 PolarHBondContact O-N 3.4Å |
| 339 | V | 94.1 | Very high | 91.9 | Very high | 3 Ų | 3 | 33.6 Ų | 33.6 | 2% | 0.018 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -55.3 | -46.5 | 173.1 | 166.4 | 0 | 0 | 0 | 0 | 112.1 | L238 I239 L330 T335 Y336 L342 Y343 | L238-V339 HydrophobicContact CB-CG2 4.04Å; L238-V339 HydrophobicContact CD1-CG2 3.62Å; L238-V339 HydrophobicContact CG-CG2 4.49Å; I239-V339 HydrophobicContact CD1-CG1 4.05Å; I239-V339 HydrophobicContact CG1-CG1 3.94Å; L330-V339 HydrophobicContact CD1-CG1 3.89Å; T335-V339 WeakPolarHBondContact O-CG2 3.28Å; T335-V339 PolarHBondContact O-N 3.03Å; Y336-V339 HydrophobicContact CD1-CG2 4.33Å; Y336-V339 WeakPolarHBondContact O-CB 3.39Å; Y336-V339 PolarHBondContact O-N 3.01Å; V339-L342 PolarHBondContact O-N 3.27Å; V339-Y343 WeakPolarHBondContact O-CB 3.34Å; V339-Y343 PolarHBondContact O-N 3.04Å |
| 340 | K | 93.8 | Very high | 91.8 | Very high | 1 Ų | 1 | 32.7 Ų | 32.7 | 0% | 0.004 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.4 | -52.4 | 176.6 | -68 | -178.1 | -158.8 | -173.1 | 0 | 111.1 | V170 T327 L330 Y336 Q337 A338 L342 Y343 C344 | V170-K340 HydrophobicContact CG2-CB 4.04Å; V170-K340 HydrophobicContact CG2-CD 4.21Å; T327-K340 WeakPolarHBondContact O-CE 2.95Å; L330-K340 HydrophobicContact CD1-CG 4.41Å; L330-K340 PolarHBondContact O-NZ 3.06Å; Y336-K340 WeakPolarHBondContact O-CG 3.3Å; Y336-K340 PolarHBondContact O-N 3.29Å; Q337-K340 PolarHBondContact O-N 2.83Å; A338-K340 PolarHBondContact O-N 3.22Å; K340-L342 PolarHBondContact O-N 3.03Å; K340-Y343 PolarHBondContact O-N 3.39Å; K340-C344 WeakPolarHBondContact O-CB 3.36Å; K340-C344 PolarHBondContact O-N 2.81Å; K340-C344 PolarHBondContact O-SG 2.89Å; K340-C344 VanDerWaalsContact O-SG 3.33Å |
| 341 | L | 95.1 | Very high | 91.9 | Very high | 78 Ų | 78 | 32.5 Ų | 32.5 | 41% | 0.408 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -63.5 | -41.1 | -179.3 | -68.8 | 177.4 | 0 | 0 | 0 | 113.1 | L167 V170 Q337 A338 C344 F345 | L167-L341 HydrophobicContact CD1-CD2 4.19Å; V170-L341 HydrophobicContact CB-CD2 4.44Å; V170-L341 HydrophobicContact CG1-CD1 4.18Å; V170-L341 HydrophobicContact CG1-CD2 4.15Å; V170-L341 HydrophobicContact CG1-CG 4.24Å; V170-L341 HydrophobicContact CG2-CD2 4.11Å; V170-L341 HydrophobicContact CG2-CG 4.12Å; Q337-L341 WeakPolarHBondContact O-CG 3.37Å; Q337-L341 PolarHBondContact O-N 3Å; A338-L341 PolarHBondContact O-N 3.16Å; L341-C344 WeakPolarHBondContact O-CB 3.44Å; L341-C344 PolarHBondContact O-N 3.26Å; L341-F345 PolarHBondContact O-N 3.32Å |
| 342 | L | 94.4 | Very high | 92 | Very high | 73 Ų | 73 | 31.4 Ų | 31.4 | 38% | 0.382 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -65.7 | -39.4 | 177.6 | -76.9 | 176.3 | 0 | 0 | 0 | 111.8 | V231 A338 V339 K340 G346 | V231-L342 HydrophobicContact CG1-CB 3.46Å; V231-L342 VanDerWaalsContact CG1-CB 3.46Å; V231-L342 HydrophobicContact CG1-CD1 4.39Å; V231-L342 HydrophobicContact CG1-CD2 3.63Å; V231-L342 HydrophobicContact CG1-CG 3.99Å; V231-L342 WeakPolarHBondContact CG1-O 3.46Å; A338-L342 WeakPolarHBondContact O-CB 3.39Å; A338-L342 WeakPolarHBondContact O-CG 3.36Å; A338-L342 PolarHBondContact O-N 3.4Å; V339-L342 PolarHBondContact O-N 3.27Å; K340-L342 PolarHBondContact O-N 3.03Å; L342-G346 PolarHBondContact O-N 3.08Å |
| 343 | Y | 93.4 | Very high | 92.1 | Very high | 2 Ų | 2 | 30.7 Ų | 30.7 | 1% | 0.008 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -67.9 | -42 | 172.7 | -143.4 | -64.8 | 0 | 0 | 0 | 111.4 | L69 F162 M232 L236 I239 V339 K340 F345 G346 I347 | L69-Y343 HydrophobicContact CD1-CD1 4.03Å; L69-Y343 HydrophobicContact CD1-CE1 3.64Å; L69-Y343 HydrophobicContact CD1-CE2 4.36Å; L69-Y343 HydrophobicContact CD2-CE2 4.14Å; L69-Y343 HydrophobicContact CG-CE1 4.44Å; F162-Y343 HydrophobicContact CE1-CD1 4.12Å; F162-Y343 HydrophobicContact CZ-CD1 4.08Å; M232-Y343 HydrophobicContact CB-CE2 4.37Å; M232-Y343 HydrophobicContact CG-CD1 4.13Å; M232-Y343 HydrophobicContact CG-CE1 4.11Å; M232-Y343 HydrophobicContact CG-CG 4.38Å; M232-Y343 HydrophobicContact SD-CD1 4.3Å; M232-Y343 HydrophobicContact SD-CE1 3.97Å; L236-Y343 HydrophobicContact CB-CE2 4.37Å; I239-Y343 HydrophobicContact CD1-CD2 4.4Å; V339-Y343 WeakPolarHBondContact O-CB 3.34Å; V339-Y343 PolarHBondContact O-N 3.04Å; K340-Y343 PolarHBondContact O-N 3.39Å; Y343-F345 PolarHBondContact O-N 3.36Å; Y343-G346 WeakPolarHBondContact O-CA 3.15Å; Y343-G346 PolarHBondContact O-N 2.97Å; Y343-I347 HydrophobicContact CD1-CD1 4.38Å; Y343-I347 HydrophobicContact CD1-CG1 3.86Å; Y343-I347 HydrophobicContact CE1-CD1 4.02Å; Y343-I347 HydrophobicContact CE1-CG1 4.01Å; Y343-I347 PolarHBondContact O-N 3.01Å |
| 344 | C | 95.1 | Very high | 92.2 | Very high | 11 Ų | 11 | 31.9 Ų | 31.9 | 7% | 0.074 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -58.5 | -43.2 | 174 | -75.4 | 0 | 0 | 0 | 0 | 112.7 | L163 N166 K340 L341 G346 I347 F348 | L163-C344 HydrophobicContact CG-CB 4.28Å; N166-C344 WeakPolarHBondContact CB-SG 3.37Å; K340-C344 WeakPolarHBondContact O-CB 3.36Å; K340-C344 PolarHBondContact O-N 2.81Å; K340-C344 PolarHBondContact O-SG 2.89Å; K340-C344 VanDerWaalsContact O-SG 3.33Å; L341-C344 WeakPolarHBondContact O-CB 3.44Å; L341-C344 PolarHBondContact O-N 3.26Å; C344-G346 VanDerWaalsContact C-N 3.28Å; C344-G346 PolarHBondContact O-N 2.96Å; C344-I347 PolarHBondContact O-N 3.31Å; C344-F348 WeakPolarHBondContact O-CB 3.36Å; C344-F348 PolarHBondContact O-N 3.34Å |
| 345 | F | 94.1 | Very high | 92.4 | Very high | 73 Ų | 73 | 25.6 Ų | 25.6 | 32% | 0.32 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -58.5 | -41.5 | 172.8 | 172.4 | -102.4 | 0 | 0 | 0 | 111.6 | L227 A228 L341 Y343 F348 I349 | L227-F345 HydrophobicContact CD2-CE1 4.45Å; A228-F345 HydrophobicContact CB-CE1 4.39Å; L341-F345 PolarHBondContact O-N 3.32Å; Y343-F345 PolarHBondContact O-N 3.36Å; F345-F348 WeakPolarHBondContact O-CB 3.16Å; F345-F348 PolarHBondContact O-N 3.49Å; F345-I349 HydrophobicContact CE1-CG1 4.39Å; F345-I349 HydrophobicContact CE2-CD1 4.26Å; F345-I349 HydrophobicContact CE2-CG1 4.07Å; F345-I349 HydrophobicContact CZ-CD1 4.4Å; F345-I349 HydrophobicContact CZ-CG1 3.99Å; F345-I349 WeakPolarHBondContact O-CG1 3.26Å; F345-I349 PolarHBondContact O-N 2.72Å; F345-I349 VanDerWaalsContact O-N 3.14Å |
| 346 | G | 92.9 | Very high | 92.3 | Very high | 0 Ų | 0 | 25.8 Ų | 25.8 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -63.6 | -44 | 177 | 0 | 0 | 0 | 0 | 0 | 114 | M232 L342 Y343 C344 T350 | M232-G346 VanDerWaalsContact SD-C 3.54Å; L342-G346 PolarHBondContact O-N 3.08Å; Y343-G346 WeakPolarHBondContact O-CA 3.15Å; Y343-G346 PolarHBondContact O-N 2.97Å; C344-G346 VanDerWaalsContact C-N 3.28Å; C344-G346 PolarHBondContact O-N 2.96Å; G346-T350 WeakPolarHBondContact O-CB 3.33Å; G346-T350 PolarHBondContact O-N 3.36Å; G346-T350 PolarHBondContact O-OG1 3.3Å |
| 347 | I | 94 | Very high | 92.1 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -68.4 | -37 | 175 | -64 | -56.8 | 0 | 0 | 0 | 111.6 | T66 Y159 F162 L163 M232 Y343 C344 I349 T350 F351 | T66-I347 HydrophobicContact CG2-CD1 3.77Å; T66-I347 HydrophobicContact CG2-CG1 4.01Å; T66-I347 HydrophobicContact CG2-CG2 4.24Å; Y159-I347 HydrophobicContact CD1-CG2 3.47Å; Y159-I347 VanDerWaalsContact CD1-CG2 3.47Å; Y159-I347 HydrophobicContact CD2-CG2 4.22Å; Y159-I347 HydrophobicContact CE1-CD1 4.47Å; Y159-I347 HydrophobicContact CE1-CG2 4.13Å; Y159-I347 HydrophobicContact CG-CG2 3.53Å; F162-I347 HydrophobicContact CD1-CB 4.33Å; F162-I347 HydrophobicContact CD1-CG1 4.07Å; F162-I347 HydrophobicContact CD1-CG2 4.31Å; F162-I347 HydrophobicContact CE1-CG1 3.96Å; L163-I347 HydrophobicContact CD1-CB 3.84Å; L163-I347 HydrophobicContact CD1-CG2 3.48Å; L163-I347 VanDerWaalsContact CD1-CG2 3.48Å; M232-I347 HydrophobicContact SD-CD1 3.99Å; M232-I347 HydrophobicContact SD-CG1 4.41Å; Y343-I347 HydrophobicContact CD1-CD1 4.38Å; Y343-I347 HydrophobicContact CD1-CG1 3.86Å; Y343-I347 HydrophobicContact CE1-CD1 4.02Å; Y343-I347 HydrophobicContact CE1-CG1 4.01Å; Y343-I347 PolarHBondContact O-N 3.01Å; C344-I347 PolarHBondContact O-N 3.31Å; I347-I349 PolarHBondContact O-N 3.01Å; I347-T350 CarbonylContact O-C 3.58Å; I347-T350 PolarHBondContact O-N 2.84Å; I347-T350 VanDerWaalsContact O-N 3.08Å; I347-F351 PolarHBondContact O-N 2.94Å |
| 348 | F | 94.6 | Very high | 92 | Very high | 39 Ų | 39 | 26.4 Ų | 26.4 | 17% | 0.171 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -55.9 | -49.5 | 174.3 | -177.9 | -103 | 0 | 0 | 0 | 111.7 | L163 F208 F209 L212 C344 F345 T350 F351 | L163-F348 HydrophobicContact CD2-CB 4.09Å; L163-F348 HydrophobicContact CD2-CD2 3.99Å; F208-F348 HydrophobicContact CB-CE2 3.84Å; F208-F348 HydrophobicContact CB-CZ 3.87Å; F209-F348 AromaticContact CD1-CD2 3.78Å; F209-F348 HydrophobicContact CD1-CD2 3.78Å; F209-F348 AromaticContact CD1-CE2 3.6Å; F209-F348 HydrophobicContact CD1-CE2 3.6Å; F209-F348 AromaticContact CE1-CD2 3.31Å; F209-F348 HydrophobicContact CE1-CD2 3.31Å; F209-F348 AromaticContact CE1-CE2 3.67Å; F209-F348 HydrophobicContact CE1-CE2 3.67Å; F209-F348 HydrophobicContact CE1-CG 4.21Å; F209-F348 HydrophobicContact CE2-CD2 4.48Å; F209-F348 HydrophobicContact CG-CE2 4.12Å; F209-F348 AromaticContact CZ-CD2 3.75Å; F209-F348 HydrophobicContact CZ-CD2 3.75Å; F209-F348 HydrophobicContact CZ-CE2 4.27Å; L212-F348 HydrophobicContact CB-CZ 4.15Å; L212-F348 HydrophobicContact CD1-CE1 3.93Å; L212-F348 HydrophobicContact CD1-CZ 4.37Å; L212-F348 HydrophobicContact CD2-CD1 4.24Å; L212-F348 HydrophobicContact CD2-CE1 3.92Å; L212-F348 HydrophobicContact CD2-CE2 4.37Å; L212-F348 HydrophobicContact CD2-CZ 3.97Å; L212-F348 WeakPolarHBondContact CD2-O 3.3Å; L212-F348 HydrophobicContact CG-CE1 4.35Å; L212-F348 HydrophobicContact CG-CZ 4.39Å; C344-F348 WeakPolarHBondContact O-CB 3.36Å; C344-F348 PolarHBondContact O-N 3.34Å; F345-F348 WeakPolarHBondContact O-CB 3.16Å; F345-F348 PolarHBondContact O-N 3.49Å; F348-T350 VanDerWaalsContact C-N 3.31Å; F348-T350 PolarHBondContact O-N 2.73Å; F348-F351 WeakPolarHBondContact O-CB 3.25Å; F348-F351 PolarHBondContact O-N 3.47Å |
| 349 | I | 92 | Very high | 91.9 | Very high | 8 Ų | 8 | 24.4 Ų | 24.4 | 4% | 0.041 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -67.9 | -32.1 | 176.3 | -59.7 | -60.5 | 0 | 0 | 0 | 111.8 | L212 L221 F224 A228 F345 I347 | L212-I349 HydrophobicContact CD1-CD1 4.43Å; L221-I349 HydrophobicContact CD2-CG2 4.16Å; L221-I349 HydrophobicContact CG-CG2 4.14Å; F224-I349 HydrophobicContact CB-CD1 4.12Å; F224-I349 HydrophobicContact CB-CG1 4.45Å; F224-I349 HydrophobicContact CB-CG2 4.3Å; A228-I349 HydrophobicContact CB-CB 4.14Å; A228-I349 HydrophobicContact CB-CG1 4.42Å; A228-I349 HydrophobicContact CB-CG2 4.37Å; F345-I349 HydrophobicContact CE1-CG1 4.39Å; F345-I349 HydrophobicContact CE2-CD1 4.26Å; F345-I349 HydrophobicContact CE2-CG1 4.07Å; F345-I349 HydrophobicContact CZ-CD1 4.4Å; F345-I349 HydrophobicContact CZ-CG1 3.99Å; F345-I349 WeakPolarHBondContact O-CG1 3.26Å; F345-I349 PolarHBondContact O-N 2.72Å; F345-I349 VanDerWaalsContact O-N 3.14Å; I347-I349 PolarHBondContact O-N 3.01Å |
| 350 | T | 90.7 | Very high | 91.5 | Very high | 17 Ų | 17 | 28.6 Ų | 28.6 | 10% | 0.104 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -69.8 | -31.1 | 178.8 | -58 | 0 | 0 | 0 | 0 | 112.2 | Y159 G346 I347 F348 A352 L353 Q354 | Y159-T350 HydrophobicContact CE2-CG2 4.23Å; G346-T350 WeakPolarHBondContact O-CB 3.33Å; G346-T350 PolarHBondContact O-N 3.36Å; G346-T350 PolarHBondContact O-OG1 3.3Å; I347-T350 CarbonylContact O-C 3.58Å; I347-T350 PolarHBondContact O-N 2.84Å; I347-T350 VanDerWaalsContact O-N 3.08Å; F348-T350 VanDerWaalsContact C-N 3.31Å; F348-T350 PolarHBondContact O-N 2.73Å; T350-A352 VanDerWaalsContact C-N 3.31Å; T350-A352 PolarHBondContact O-N 3.05Å; T350-L353 WeakPolarHBondContact O-CB 3.24Å; T350-L353 PolarHBondContact O-N 3.45Å; T350-Q354 PolarHBondContact O-N 3.41Å |
| 351 | F | 93.2 | Very high | 91.3 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -50.2 | -47.6 | 174.6 | -177.7 | -80.3 | 0 | 0 | 0 | 112.6 | C156 Y159 F160 F209 V213 I347 F348 L353 Q354 F355 V387 | C156-F351 HydrophobicContact CB-CD2 4.04Å; C156-F351 HydrophobicContact CB-CE2 3.49Å; C156-F351 VanDerWaalsContact CB-CE2 3.49Å; C156-F351 HydrophobicContact CB-CZ 3.98Å; Y159-F351 HydrophobicContact CD2-CB 3.94Å; Y159-F351 AromaticContact CD2-CD2 4Å; Y159-F351 HydrophobicContact CD2-CD2 4Å; Y159-F351 HydrophobicContact CD2-CG 4.38Å; F160-F351 AromaticContact CD2-CE2 3.9Å; F160-F351 HydrophobicContact CD2-CE2 3.9Å; F160-F351 AromaticContact CE2-CE2 3.68Å; F160-F351 HydrophobicContact CE2-CE2 3.68Å; F160-F351 AromaticContact CE2-CZ 3.92Å; F160-F351 HydrophobicContact CE2-CZ 3.92Å; F209-F351 HydrophobicContact CB-CD1 4.5Å; F209-F351 HydrophobicContact CB-CE1 4.09Å; F209-F351 HydrophobicContact CB-CZ 4.25Å; F209-F351 HydrophobicContact CD1-CB 3.87Å; F209-F351 AromaticContact CD1-CD1 3.46Å; F209-F351 HydrophobicContact CD1-CD1 3.46Å; F209-F351 VanDerWaalsContact CD1-CD1 3.46Å; F209-F351 AromaticContact CD1-CD2 3.76Å; F209-F351 HydrophobicContact CD1-CD2 3.76Å; F209-F351 AromaticContact CD1-CE1 3.87Å; F209-F351 HydrophobicContact CD1-CE1 3.87Å; F209-F351 HydrophobicContact CD1-CE2 4.12Å; F209-F351 AromaticContact CD1-CG 3.43Å; F209-F351 HydrophobicContact CD1-CG 3.43Å; F209-F351 VanDerWaalsContact CD1-CG 3.43Å; F209-F351 HydrophobicContact CD1-CZ 4.18Å; F209-F351 HydrophobicContact CD2-CE2 4.49Å; F209-F351 HydrophobicContact CE1-CB 3.38Å; F209-F351 AromaticContact CE1-CD1 3.9Å; F209-F351 HydrophobicContact CE1-CD1 3.9Å; F209-F351 AromaticContact CE1-CD2 3.51Å; F209-F351 HydrophobicContact CE1-CD2 3.51Å; F209-F351 HydrophobicContact CE1-CE2 4.22Å; F209-F351 AromaticContact CE1-CG 3.33Å; F209-F351 HydrophobicContact CE1-CG 3.33Å; F209-F351 HydrophobicContact CE2-CD2 4.4Å; F209-F351 HydrophobicContact CG-CD1 4.21Å; F209-F351 HydrophobicContact CG-CD2 4.32Å; F209-F351 HydrophobicContact CG-CE1 4.15Å; F209-F351 HydrophobicContact CG-CE2 4.25Å; F209-F351 HydrophobicContact CG-CG 4.32Å; F209-F351 HydrophobicContact CG-CZ 4.18Å; F209-F351 HydrophobicContact CZ-CB 4.28Å; F209-F351 AromaticContact CZ-CD2 3.84Å; F209-F351 HydrophobicContact CZ-CD2 3.84Å; F209-F351 HydrophobicContact CZ-CE2 4.4Å; F209-F351 HydrophobicContact CZ-CG 4.13Å; V213-F351 HydrophobicContact CG2-CD1 4.16Å; V213-F351 HydrophobicContact CG2-CE1 3.76Å; I347-F351 PolarHBondContact O-N 2.94Å; F348-F351 WeakPolarHBondContact O-CB 3.25Å; F348-F351 PolarHBondContact O-N 3.47Å; F351-L353 VanDerWaalsContact C-N 3.31Å; F351-L353 PolarHBondContact O-N 2.95Å; F351-Q354 PolarHBondContact O-N 2.93Å; F351-F355 HydrophobicContact CD1-CB 4.28Å; F351-F355 HydrophobicContact CE1-CB 4.17Å; F351-F355 HydrophobicContact CE1-CD2 4.05Å; F351-F355 HydrophobicContact CE1-CG 4.3Å; F351-F355 HydrophobicContact CZ-CD2 4.35Å; F351-F355 WeakPolarHBondContact O-CB 3.48Å; F351-F355 PolarHBondContact O-N 2.84Å; F351-V387 HydrophobicContact CE1-CG2 4.21Å; F351-V387 HydrophobicContact CZ-CG1 4.26Å; F351-V387 HydrophobicContact CZ-CG2 4.34Å |
| 352 | A | 90.4 | Very high | 91 | Very high | 10 Ų | 10 | 28.8 Ų | 28.8 | 8% | 0.083 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -67.6 | -30.1 | -179 | 0 | 0 | 0 | 0 | 0 | 113.4 | L212 L221 T350 Y356 | L212-A352 HydrophobicContact CD2-CB 3.68Å; L212-A352 HydrophobicContact CG-CB 3.8Å; L221-A352 HydrophobicContact CD2-CB 3.62Å; T350-A352 VanDerWaalsContact C-N 3.31Å; T350-A352 PolarHBondContact O-N 3.05Å; A352-Y356 WeakPolarHBondContact O-CB 3.34Å; A352-Y356 PolarHBondContact O-N 3.2Å; A352-Y356 VanDerWaalsContact O-N 3.08Å |
| 353 | L | 86 | Confident | 90.8 | Very high | 41 Ų | 41 | 25.5 Ų | 25.5 | 22% | 0.215 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -70.3 | -38.5 | 173.6 | -61 | 179.5 | 0 | 0 | 0 | 111.7 | L218 L221 S225 T350 F351 Y356 | L218-L353 HydrophobicContact CD2-CD2 4.09Å; L221-L353 HydrophobicContact CD2-CD2 4.29Å; S225-L353 WeakPolarHBondContact OG-CD1 3.44Å; T350-L353 WeakPolarHBondContact O-CB 3.24Å; T350-L353 PolarHBondContact O-N 3.45Å; F351-L353 VanDerWaalsContact C-N 3.31Å; F351-L353 PolarHBondContact O-N 2.95Å; L353-Y356 WeakPolarHBondContact O-CB 3.35Å |
| 354 | Q | 89.1 | Confident | 90.7 | Very high | 27 Ų | 27 | 28.2 Ų | 28.2 | 13% | 0.126 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -73.6 | -43.2 | 179.9 | -143.2 | 59 | 30.3 | 0 | 0 | 111.2 | Q152 F155 Y159 T350 F351 Y356 V357 P358 | Q152-Q354 VanDerWaalsContact OE1-CD 3.28Å; F155-Q354 HydrophobicContact CB-CG 3.91Å; F155-Q354 HydrophobicContact CD2-CG 3.84Å; F155-Q354 HydrophobicContact CG-CG 4.4Å; Y159-Q354 HydrophobicContact CE2-CB 3.91Å; Y159-Q354 HydrophobicContact CE2-CG 4.16Å; T350-Q354 PolarHBondContact O-N 3.41Å; F351-Q354 PolarHBondContact O-N 2.93Å; Q354-Y356 VanDerWaalsContact C-N 3.28Å; Q354-Y356 PolarHBondContact O-N 3.16Å; Q354-V357 PolarHBondContact O-N 3.25Å; Q354-P358 WeakPolarHBondContact O-CD 3.41Å |
| 355 | F | 91.6 | Very high | 90.3 | Very high | 6 Ų | 6 | 33.2 Ų | 33.2 | 3% | 0.026 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -63.3 | -28.9 | 174.3 | -173.8 | -81.9 | 0 | 0 | 0 | 113.4 | V213 F351 V357 P358 A359 R383 L386 V387 | V213-F355 HydrophobicContact CB-CD1 4.28Å; V213-F355 HydrophobicContact CB-CE1 4.31Å; V213-F355 HydrophobicContact CG1-CD1 3.53Å; V213-F355 HydrophobicContact CG1-CE1 3.19Å; V213-F355 HydrophobicContact CG1-CG 4.38Å; V213-F355 HydrophobicContact CG1-CZ 3.75Å; V213-F355 HydrophobicContact CG2-CB 4.28Å; V213-F355 HydrophobicContact CG2-CD1 3.68Å; V213-F355 HydrophobicContact CG2-CD2 4.23Å; V213-F355 HydrophobicContact CG2-CE1 4.1Å; V213-F355 HydrophobicContact CG2-CG 3.78Å; F351-F355 HydrophobicContact CD1-CB 4.28Å; F351-F355 HydrophobicContact CE1-CB 4.17Å; F351-F355 HydrophobicContact CE1-CD2 4.05Å; F351-F355 HydrophobicContact CE1-CG 4.3Å; F351-F355 HydrophobicContact CZ-CD2 4.35Å; F351-F355 WeakPolarHBondContact O-CB 3.48Å; F351-F355 PolarHBondContact O-N 2.84Å; F355-V357 PolarHBondContact O-N 3.01Å; F355-P358 WeakPolarHBondContact O-CD 3.19Å; F355-P358 VanDerWaalsContact O-CG 3.3Å; F355-P358 WeakPolarHBondContact O-CG 3.27Å; F355-A359 HydrophobicContact CD1-CB 4.13Å; F355-A359 HydrophobicContact CE1-CB 3.85Å; F355-A359 WeakPolarHBondContact O-CB 3.22Å; F355-A359 PolarHBondContact O-N 2.91Å; F355-R383 HydrophobicContact CE1-CG 4.27Å; F355-L386 HydrophobicContact CE2-CB 3.63Å; F355-L386 HydrophobicContact CZ-CB 3.61Å; F355-L386 HydrophobicContact CZ-CD1 3.93Å; F355-L386 HydrophobicContact CZ-CG 4.46Å; F355-V387 HydrophobicContact CD2-CG2 4.02Å; F355-V387 HydrophobicContact CE2-CG2 3.48Å; F355-V387 VanDerWaalsContact CE2-CG2 3.48Å; F355-V387 HydrophobicContact CZ-CG2 3.9Å |
| 356 | Y | 88.1 | Confident | 90.1 | Very high | 75 Ų | 75 | 32.6 Ų | 32.6 | 29% | 0.294 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -57.9 | -35.4 | 177.1 | -177.6 | -104.3 | 0 | 0 | 0 | 112.5 | L218 A352 L353 Q354 A359 E360 | L218-Y356 HydrophobicContact CD1-CD1 3.67Å; L218-Y356 HydrophobicContact CD1-CD2 3.95Å; L218-Y356 HydrophobicContact CD1-CE1 3.68Å; L218-Y356 HydrophobicContact CD1-CE2 4Å; L218-Y356 HydrophobicContact CD1-CG 3.8Å; L218-Y356 HydrophobicContact CD2-CD2 4.05Å; L218-Y356 HydrophobicContact CD2-CG 4.19Å; L218-Y356 HydrophobicContact CG-CD2 4.05Å; L218-Y356 HydrophobicContact CG-CE2 4.15Å; L218-Y356 HydrophobicContact CG-CG 4.31Å; A352-Y356 WeakPolarHBondContact O-CB 3.34Å; A352-Y356 PolarHBondContact O-N 3.2Å; A352-Y356 VanDerWaalsContact O-N 3.08Å; L353-Y356 WeakPolarHBondContact O-CB 3.35Å; Q354-Y356 VanDerWaalsContact C-N 3.28Å; Q354-Y356 PolarHBondContact O-N 3.16Å; Y356-A359 PolarHBondContact O-N 3.39Å; Y356-E360 HydrophobicContact CD1-CG 4.02Å; Y356-E360 HydrophobicContact CD2-CG 4.12Å; Y356-E360 HydrophobicContact CE1-CG 3.57Å; Y356-E360 HydrophobicContact CE2-CG 3.62Å; Y356-E360 WeakPolarHBondContact CE2-OE1 3.4Å; Y356-E360 HydrophobicContact CG-CG 4.28Å; Y356-E360 VanDerWaalsContact CZ-CD 3.42Å; Y356-E360 WeakPolarHBondContact O-CG 3.34Å; Y356-E360 PolarHBondContact O-N 3.41Å; Y356-E360 PolarHBondContact OH-OE1 3.34Å |
| 357 | V | 87.1 | Confident | 90 | Very high | 46 Ų | 46 | 34.2 Ų | 34.2 | 28% | 0.279 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -63.2 | -56.3 | -179 | -177.5 | 0 | 0 | 0 | 0 | 113 | Q152 Q354 F355 A359 E360 I361 | Q152-V357 HydrophobicContact CG-CB 4.03Å; Q152-V357 HydrophobicContact CG-CG1 3.99Å; Q354-V357 PolarHBondContact O-N 3.25Å; F355-V357 PolarHBondContact O-N 3.01Å; V357-A359 VanDerWaalsContact C-N 3.28Å; V357-A359 PolarHBondContact O-N 3.49Å; V357-E360 PolarHBondContact O-N 2.85Å; V357-I361 HydrophobicContact CG1-CD1 3.97Å; V357-I361 VanDerWaalsContact O-CG1 3.3Å; V357-I361 WeakPolarHBondContact O-CG1 3.32Å; V357-I361 PolarHBondContact O-N 3.47Å |
| 358 | P | 90.3 | Very high | 89.8 | Confident | 2 Ų | 2 | 40 Ų | 40 | 1% | 0.013 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -66.3 | -30.8 | 177.3 | 26 | -34 | 0 | 0 | 0 | 112.2 | I149 Q152 Q354 F355 I361 L362 | I149-P358 HydrophobicContact CB-CB 4.34Å; I149-P358 HydrophobicContact CG1-CB 4.03Å; I149-P358 HydrophobicContact CG2-CB 4.13Å; Q152-P358 HydrophobicContact CB-CB 4.28Å; Q152-P358 HydrophobicContact CB-CG 3.74Å; Q354-P358 WeakPolarHBondContact O-CD 3.41Å; F355-P358 WeakPolarHBondContact O-CD 3.19Å; F355-P358 VanDerWaalsContact O-CG 3.3Å; F355-P358 WeakPolarHBondContact O-CG 3.27Å; P358-I361 PolarHBondContact O-N 3.01Å; P358-L362 VanDerWaalsContact O-CB 3.26Å; P358-L362 WeakPolarHBondContact O-CB 3.41Å; P358-L362 PolarHBondContact O-N 3.2Å |
| 359 | A | 89.4 | Confident | 89.6 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.1 | -49.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | F355 Y356 V357 I361 L362 I363 | F355-A359 HydrophobicContact CD1-CB 4.13Å; F355-A359 HydrophobicContact CE1-CB 3.85Å; F355-A359 WeakPolarHBondContact O-CB 3.22Å; F355-A359 PolarHBondContact O-N 2.91Å; Y356-A359 PolarHBondContact O-N 3.39Å; V357-A359 VanDerWaalsContact C-N 3.28Å; V357-A359 PolarHBondContact O-N 3.49Å; A359-I361 VanDerWaalsContact C-N 3.32Å; A359-I361 PolarHBondContact O-N 3.41Å; A359-L362 PolarHBondContact O-N 3.32Å; A359-I363 HydrophobicContact CB-CD1 3.84Å; A359-I363 VanDerWaalsContact O-CB 3.24Å; A359-I363 WeakPolarHBondContact O-CB 3.44Å; A359-I363 WeakPolarHBondContact O-CG1 3.47Å; A359-I363 PolarHBondContact O-N 2.83Å |
| 360 | E | 86.9 | Confident | 89.5 | Confident | 92 Ų | 92 | 45.1 Ų | 45.1 | 43% | 0.43 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -66.7 | -29.1 | 177.2 | -71.4 | -74 | 149.8 | 0 | 0 | 113.4 | Y356 V357 P364 | Y356-E360 HydrophobicContact CD1-CG 4.02Å; Y356-E360 HydrophobicContact CD2-CG 4.12Å; Y356-E360 HydrophobicContact CE1-CG 3.57Å; Y356-E360 HydrophobicContact CE2-CG 3.62Å; Y356-E360 WeakPolarHBondContact CE2-OE1 3.4Å; Y356-E360 HydrophobicContact CG-CG 4.28Å; Y356-E360 VanDerWaalsContact CZ-CD 3.42Å; Y356-E360 WeakPolarHBondContact O-CG 3.34Å; Y356-E360 PolarHBondContact O-N 3.41Å; Y356-E360 PolarHBondContact OH-OE1 3.34Å; V357-E360 PolarHBondContact O-N 2.85Å; E360-P364 VanDerWaalsContact O-CD 3.25Å; E360-P364 WeakPolarHBondContact O-CD 3.44Å; E360-P364 WeakPolarHBondContact O-CG 3.39Å |
| 361 | I | 87.9 | Confident | 89.5 | Confident | 32 Ų | 32 | 47.7 Ų | 47.7 | 16% | 0.164 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -76.6 | -42.9 | 176.9 | -62.8 | 167.9 | 0 | 0 | 0 | 111 | N145 L148 I149 V357 P358 A359 Q365 | N145-I361 HydrophobicContact CB-CG2 3.93Å; L148-I361 HydrophobicContact CB-CD1 4.21Å; L148-I361 HydrophobicContact CD1-CD1 4.48Å; I149-I361 HydrophobicContact CD1-CB 4.21Å; I149-I361 HydrophobicContact CD1-CG2 3.68Å; I149-I361 HydrophobicContact CG1-CB 4.25Å; I149-I361 HydrophobicContact CG1-CD1 4.45Å; I149-I361 HydrophobicContact CG1-CG2 4.1Å; V357-I361 HydrophobicContact CG1-CD1 3.97Å; V357-I361 VanDerWaalsContact O-CG1 3.3Å; V357-I361 WeakPolarHBondContact O-CG1 3.32Å; V357-I361 PolarHBondContact O-N 3.47Å; P358-I361 PolarHBondContact O-N 3.01Å; A359-I361 VanDerWaalsContact C-N 3.32Å; A359-I361 PolarHBondContact O-N 3.41Å; I361-Q365 WeakPolarHBondContact O-CG 3.28Å; I361-Q365 PolarHBondContact O-NE2 2.87Å |
| 362 | L | 90.4 | Very high | 89.2 | Confident | 51 Ų | 51 | 55.6 Ų | 55.6 | 27% | 0.267 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -91.7 | -47.1 | -170.1 | -174.7 | 65.2 | 0 | 0 | 0 | 113.7 | I149 P358 A359 Q365 I366 L386 | I149-L362 HydrophobicContact CD1-CB 4.32Å; P358-L362 VanDerWaalsContact O-CB 3.26Å; P358-L362 WeakPolarHBondContact O-CB 3.41Å; P358-L362 PolarHBondContact O-N 3.2Å; A359-L362 PolarHBondContact O-N 3.32Å; L362-Q365 PolarHBondContact O-N 2.94Å; L362-I366 HydrophobicContact CD1-CD1 4.17Å; L362-I366 HydrophobicContact CG-CD1 3.98Å; L362-I366 PolarHBondContact O-N 3.13Å; L362-L386 HydrophobicContact CD2-CD1 4.27Å; L362-L386 HydrophobicContact CD2-CD2 4Å |
| 363 | I | 90.4 | Very high | 89.2 | Confident | 3 Ų | 3 | 66 Ų | 66 | 2% | 0.015 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -63.9 | -47.4 | -168.6 | -61.5 | 174.4 | 0 | 0 | 0 | 112.1 | A359 Q365 I366 L367 D379 L382 R383 | A359-I363 HydrophobicContact CB-CD1 3.84Å; A359-I363 VanDerWaalsContact O-CB 3.24Å; A359-I363 WeakPolarHBondContact O-CB 3.44Å; A359-I363 WeakPolarHBondContact O-CG1 3.47Å; A359-I363 PolarHBondContact O-N 2.83Å; I363-Q365 PolarHBondContact O-N 2.95Å; I363-I366 PolarHBondContact O-N 3.28Å; I363-L367 HydrophobicContact CG2-CD1 3.65Å; I363-L367 HydrophobicContact CG2-CD2 4.44Å; I363-L367 HydrophobicContact CG2-CG 3.76Å; I363-L367 WeakPolarHBondContact O-CG 3.41Å; I363-L367 PolarHBondContact O-N 3.4Å; I363-D379 HydrophobicContact CG2-CB 4.23Å; I363-L382 HydrophobicContact CG1-CB 4.22Å; I363-L382 HydrophobicContact CG1-CD1 4.38Å; I363-L382 HydrophobicContact CG2-CD1 4.14Å; I363-R383 HydrophobicContact CD1-CG 3.69Å |
| 364 | P | 89.7 | Confident | 89.5 | Confident | 59 Ų | 59 | 71.8 Ų | 71.8 | 38% | 0.383 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -58.6 | -33.2 | -179.5 | -26.5 | 36.9 | 0 | 0 | 0 | 113.6 | E360 I366 L367 T368 | E360-P364 VanDerWaalsContact O-CD 3.25Å; E360-P364 WeakPolarHBondContact O-CD 3.44Å; E360-P364 WeakPolarHBondContact O-CG 3.39Å; P364-I366 VanDerWaalsContact C-N 3.29Å; P364-I366 PolarHBondContact O-N 3Å; P364-L367 PolarHBondContact O-N 2.94Å; P364-T368 WeakPolarHBondContact O-CG2 3.07Å; P364-T368 PolarHBondContact O-N 3.41Å; P364-T368 VanDerWaalsContact O-N 3.16Å; P364-T368 PolarHBondContact O-OG1 3.01Å |
| 365 | Q | 88.3 | Confident | 89.5 | Confident | 117 Ų | 117 | 74.3 Ų | 74.3 | 55% | 0.547 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -67.6 | -29.4 | 178.3 | -57.7 | -176.4 | 16.3 | 0 | 0 | 112.6 | I361 L362 I363 T368 | I361-Q365 WeakPolarHBondContact O-CG 3.28Å; I361-Q365 PolarHBondContact O-NE2 2.87Å; L362-Q365 PolarHBondContact O-N 2.94Å; I363-Q365 PolarHBondContact O-N 2.95Å; Q365-T368 PolarHBondContact O-OG1 3.4Å |
| 366 | I | 88.9 | Confident | 89.5 | Confident | 60 Ų | 60 | 82.1 Ų | 82.1 | 31% | 0.308 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -84.6 | -42 | 177 | -59.2 | 171.3 | 0 | 0 | 0 | 109.9 | L362 I363 P364 T368 C369 L382 | L362-I366 HydrophobicContact CD1-CD1 4.17Å; L362-I366 HydrophobicContact CG-CD1 3.98Å; L362-I366 PolarHBondContact O-N 3.13Å; I363-I366 PolarHBondContact O-N 3.28Å; P364-I366 VanDerWaalsContact C-N 3.29Å; P364-I366 PolarHBondContact O-N 3Å; I366-T368 VanDerWaalsContact C-N 3.27Å; I366-T368 PolarHBondContact O-N 2.88Å; I366-C369 WeakPolarHBondContact O-CB 3.27Å; I366-C369 PolarHBondContact O-N 2.71Å; I366-L382 HydrophobicContact CB-CD1 3.95Å; I366-L382 HydrophobicContact CD1-CD1 3.9Å; I366-L382 HydrophobicContact CD1-CD2 3.75Å; I366-L382 HydrophobicContact CD1-CG 4.5Å; I366-L382 HydrophobicContact CG2-CD1 3.86Å |
| 367 | L | 90.5 | Very high | 89.7 | Confident | 34 Ų | 34 | 81.2 Ų | 81.2 | 18% | 0.178 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -60.3 | -33.2 | 179.2 | -67.3 | -177 | 0 | 0 | 0 | 112.9 | I363 P364 C369 V370 E375 V378 D379 | I363-L367 HydrophobicContact CG2-CD1 3.65Å; I363-L367 HydrophobicContact CG2-CD2 4.44Å; I363-L367 HydrophobicContact CG2-CG 3.76Å; I363-L367 WeakPolarHBondContact O-CG 3.41Å; I363-L367 PolarHBondContact O-N 3.4Å; P364-L367 PolarHBondContact O-N 2.94Å; L367-C369 PolarHBondContact O-N 2.89Å; L367-V370 PolarHBondContact O-N 3.29Å; L367-E375 HydrophobicContact CD2-CB 4.36Å; L367-E375 WeakPolarHBondContact CD2-O 3.38Å; L367-V378 HydrophobicContact CD2-CB 4.13Å; L367-V378 HydrophobicContact CD2-CG1 3.97Å; L367-D379 HydrophobicContact CD1-CB 4.38Å |
| 368 | T | 90 | Very high | 90 | Very high | 120 Ų | 120 | 80.5 Ų | 80.5 | 74% | 0.736 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.4 | -12.9 | 174 | 46.8 | 0 | 0 | 0 | 0 | 114.9 | P364 Q365 I366 | P364-T368 WeakPolarHBondContact O-CG2 3.07Å; P364-T368 PolarHBondContact O-N 3.41Å; P364-T368 VanDerWaalsContact O-N 3.16Å; P364-T368 PolarHBondContact O-OG1 3.01Å; Q365-T368 PolarHBondContact O-OG1 3.4Å; I366-T368 VanDerWaalsContact C-N 3.27Å; I366-T368 PolarHBondContact O-N 2.88Å |
| 369 | C | 89.6 | Confident | 90.1 | Very high | 113 Ų | 113 | 81.8 Ų | 81.8 | 76% | 0.764 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.2 | 1.8 | 175.6 | -59.8 | 0 | 0 | 0 | 0 | 113.1 | I366 L367 | I366-C369 WeakPolarHBondContact O-CB 3.27Å; I366-C369 PolarHBondContact O-N 2.71Å; L367-C369 PolarHBondContact O-N 2.89Å |
| 370 | V | 91.1 | Very high | 90.2 | Very high | 43 Ų | 43 | 85 Ų | 85 | 26% | 0.261 | 43% | 0.427 | S | S | . | . | S | Bend | trans | -112.4 | 152.5 | -173.8 | 178.1 | 0 | 0 | 0 | 0 | 109.2 | L367 W374 V378 | L367-V370 PolarHBondContact O-N 3.29Å; V370-W374 HydrophobicContact CG1-CB 3.56Å; V370-V378 HydrophobicContact CG1-CG2 4.14Å; V370-V378 HydrophobicContact CG2-CG1 4.34Å |
| 371 | S | 89.5 | Confident | 90.6 | Very high | 71 Ų | 71 | 86 Ų | 86 | 50% | 0.497 | 44% | 0.435 | S | S | . | . | trans | -81.3 | 146.7 | 174.7 | 55.3 | 0 | 0 | 0 | 0 | 111.4 | R373 W374 E375 | S371-R373 PolarHBondContact O-N 3.34Å; S371-W374 PolarHBondContact O-N 2.78Å; S371-E375 PolarHBondContact O-N 3.48Å | ||
| 372 | E | 88.6 | Confident | 90.9 | Very high | 166 Ų | 166 | 85.8 Ų | 85.8 | 78% | 0.776 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -46.3 | -36.9 | -175 | -62.6 | -178.9 | 167.4 | 0 | 0 | 114.3 | W374 E375 | E372-W374 PolarHBondContact O-N 3.15Å; E372-E375 PolarHBondContact O-N 3.25Å |
| 373 | R | 90.5 | Very high | 91.1 | Very high | 229 Ų | 229 | 84.3 Ų | 84.3 | 86% | 0.864 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -61 | -29.2 | 178.4 | -64.1 | -175.5 | -178.2 | -175.7 | 1.1 | 113.7 | S371 | S371-R373 PolarHBondContact O-N 3.34Å |
| 374 | W | 91.5 | Very high | 91.3 | Very high | 162 Ų | 162 | 85.6 Ų | 85.6 | 61% | 0.614 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -104.6 | -3.1 | -176.1 | -70.3 | 97.5 | 0 | 0 | 0 | 113.5 | V370 S371 E372 K376 P377 V378 | V370-W374 HydrophobicContact CG1-CB 3.56Å; S371-W374 PolarHBondContact O-N 2.78Å; E372-W374 PolarHBondContact O-N 3.15Å; W374-K376 PolarHBondContact O-N 3.11Å; W374-P377 HydrophobicContact CE3-CG 3.91Å; W374-P377 VanDerWaalsContact O-CD 3.27Å; W374-P377 WeakPolarHBondContact O-CD 3.28Å; W374-P377 WeakPolarHBondContact O-CG 3.27Å; W374-V378 HydrophobicContact CB-CG2 4.34Å; W374-V378 VanDerWaalsContact O-CB 3.28Å; W374-V378 WeakPolarHBondContact O-CB 3.38Å; W374-V378 VanDerWaalsContact O-CG2 3.23Å; W374-V378 WeakPolarHBondContact O-CG2 3.44Å; W374-V378 PolarHBondContact O-N 3.32Å |
| 375 | E | 90.1 | Very high | 91.6 | Very high | 80 Ų | 80 | 87.1 Ų | 87.1 | 37% | 0.374 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -56.7 | -52.2 | -177.7 | -75.5 | 177 | -170.7 | 0 | 0 | 113.1 | L367 S371 E372 V378 D379 | L367-E375 HydrophobicContact CD2-CB 4.36Å; L367-E375 WeakPolarHBondContact CD2-O 3.38Å; S371-E375 PolarHBondContact O-N 3.48Å; E372-E375 PolarHBondContact O-N 3.25Å; E375-V378 PolarHBondContact O-N 3.4Å; E375-D379 WeakPolarHBondContact O-CB 3.39Å; E375-D379 PolarHBondContact O-N 3.44Å |
| 376 | K | 89.8 | Confident | 91.9 | Very high | 169 Ų | 169 | 82.2 Ų | 82.2 | 74% | 0.735 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -62.1 | -50.8 | -179.6 | -67.5 | -177.5 | -179.6 | 177.2 | 0 | 113.7 | W374 V378 D379 L380 | W374-K376 PolarHBondContact O-N 3.11Å; K376-V378 VanDerWaalsContact C-N 3.28Å; K376-V378 PolarHBondContact O-N 3.27Å; K376-D379 PolarHBondContact O-N 3.38Å; K376-L380 WeakPolarHBondContact O-CG 3.41Å; K376-L380 PolarHBondContact O-N 3.44Å; K376-L380 VanDerWaalsContact O-N 3.11Å |
| 377 | P | 92.9 | Very high | 92.3 | Very high | 57 Ų | 57 | 79.3 Ų | 79.3 | 37% | 0.37 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -65.3 | -31 | 176.8 | 23.8 | -32.8 | 0 | 0 | 0 | 112.6 | W374 L381 | W374-P377 HydrophobicContact CE3-CG 3.91Å; W374-P377 VanDerWaalsContact O-CD 3.27Å; W374-P377 WeakPolarHBondContact O-CD 3.28Å; W374-P377 WeakPolarHBondContact O-CG 3.27Å; P377-L381 WeakPolarHBondContact O-CB 3.32Å; P377-L381 PolarHBondContact O-N 3.26Å |
| 378 | V | 93.1 | Very high | 92.6 | Very high | 30 Ų | 30 | 81.4 Ų | 81.4 | 18% | 0.182 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -72.5 | -41.1 | 175.4 | 173 | 0 | 0 | 0 | 0 | 112.2 | L367 V370 W374 E375 K376 L380 L381 L382 | L367-V378 HydrophobicContact CD2-CB 4.13Å; L367-V378 HydrophobicContact CD2-CG1 3.97Å; V370-V378 HydrophobicContact CG1-CG2 4.14Å; V370-V378 HydrophobicContact CG2-CG1 4.34Å; W374-V378 HydrophobicContact CB-CG2 4.34Å; W374-V378 VanDerWaalsContact O-CB 3.28Å; W374-V378 WeakPolarHBondContact O-CB 3.38Å; W374-V378 VanDerWaalsContact O-CG2 3.23Å; W374-V378 WeakPolarHBondContact O-CG2 3.44Å; W374-V378 PolarHBondContact O-N 3.32Å; E375-V378 PolarHBondContact O-N 3.4Å; K376-V378 VanDerWaalsContact C-N 3.28Å; K376-V378 PolarHBondContact O-N 3.27Å; V378-L380 PolarHBondContact O-N 3Å; V378-L381 PolarHBondContact O-N 3.23Å; V378-L382 HydrophobicContact CG1-CD1 3.7Å; V378-L382 HydrophobicContact CG1-CG 4.09Å; V378-L382 WeakPolarHBondContact O-CB 3.44Å; V378-L382 WeakPolarHBondContact O-CG 3.48Å; V378-L382 PolarHBondContact O-N 2.96Å |
| 379 | D | 92.1 | Very high | 92.9 | Very high | 29 Ų | 29 | 79.1 Ų | 79.1 | 16% | 0.155 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -56.5 | -50.2 | 172 | 168.3 | 87.3 | 0 | 0 | 0 | 111.1 | I363 L367 E375 K376 L381 L382 R383 | I363-D379 HydrophobicContact CG2-CB 4.23Å; L367-D379 HydrophobicContact CD1-CB 4.38Å; E375-D379 WeakPolarHBondContact O-CB 3.39Å; E375-D379 PolarHBondContact O-N 3.44Å; K376-D379 PolarHBondContact O-N 3.38Å; D379-L381 PolarHBondContact O-N 3.29Å; D379-L382 PolarHBondContact O-N 3.34Å; D379-R383 WeakPolarHBondContact O-CB 3.1Å; D379-R383 VanDerWaalsContact O-CG 3.26Å; D379-R383 WeakPolarHBondContact O-CG 3.34Å; D379-R383 PolarHBondContact O-N 2.71Å; D379-R383 IonicContact OD1-CZ 2.88Å; D379-R383 IonicContact OD1-NE 3.71Å; D379-R383 PolarHBondContact OD1-NE 2.82Å; D379-R383 IonicContact OD1-NH2 3.09Å; D379-R383 PolarHBondContact OD1-NH2 3.44Å; D379-R383 WeakPolarHBondContact OD2-CD 3.36Å; D379-R383 IonicContact OD2-CZ 3.45Å; D379-R383 IonicContact OD2-NE 3.91Å; D379-R383 PolarHBondContact OD2-NE 3.42Å; D379-R383 IonicContact OD2-NH2 2.76Å |
| 380 | L | 92.9 | Very high | 93.2 | Very high | 68 Ų | 68 | 73.8 Ų | 73.8 | 36% | 0.356 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63 | -39.8 | 178.3 | -70.1 | 166.9 | 0 | 0 | 0 | 112.4 | F214 K376 V378 T384 | F214-L380 HydrophobicContact CB-CD2 4.16Å; F214-L380 HydrophobicContact CD1-CD2 3.49Å; F214-L380 VanDerWaalsContact CD1-CD2 3.49Å; F214-L380 HydrophobicContact CD2-CD2 4.35Å; F214-L380 HydrophobicContact CE1-CB 4.36Å; F214-L380 HydrophobicContact CE1-CD2 3.87Å; F214-L380 HydrophobicContact CG-CD2 3.76Å; F214-L380 HydrophobicContact CZ-CD2 4.44Å; K376-L380 WeakPolarHBondContact O-CG 3.41Å; K376-L380 PolarHBondContact O-N 3.44Å; K376-L380 VanDerWaalsContact O-N 3.11Å; V378-L380 PolarHBondContact O-N 3Å; L380-T384 WeakPolarHBondContact O-CB 3.47Å; L380-T384 PolarHBondContact O-N 2.98Å; L380-T384 PolarHBondContact O-OG1 2.88Å |
| 381 | L | 94.4 | Very high | 93.5 | Very high | 114 Ų | 114 | 71.9 Ų | 71.9 | 60% | 0.597 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -66.1 | -45.7 | 176.4 | 179.6 | 62.5 | 0 | 0 | 0 | 111.8 | P377 V378 D379 T384 L385 | P377-L381 WeakPolarHBondContact O-CB 3.32Å; P377-L381 PolarHBondContact O-N 3.26Å; V378-L381 PolarHBondContact O-N 3.23Å; D379-L381 PolarHBondContact O-N 3.29Å; L381-T384 PolarHBondContact O-N 3.2Å; L381-L385 WeakPolarHBondContact O-CB 3.48Å; L381-L385 PolarHBondContact O-N 3.16Å |
| 382 | L | 93.9 | Very high | 93.8 | Very high | 27 Ų | 27 | 71.2 Ų | 71.2 | 14% | 0.141 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -62.7 | -43.5 | 177.3 | -72.3 | 169.3 | 0 | 0 | 0 | 111.3 | I363 I366 V378 D379 L385 L386 | I363-L382 HydrophobicContact CG1-CB 4.22Å; I363-L382 HydrophobicContact CG1-CD1 4.38Å; I363-L382 HydrophobicContact CG2-CD1 4.14Å; I366-L382 HydrophobicContact CB-CD1 3.95Å; I366-L382 HydrophobicContact CD1-CD1 3.9Å; I366-L382 HydrophobicContact CD1-CD2 3.75Å; I366-L382 HydrophobicContact CD1-CG 4.5Å; I366-L382 HydrophobicContact CG2-CD1 3.86Å; V378-L382 HydrophobicContact CG1-CD1 3.7Å; V378-L382 HydrophobicContact CG1-CG 4.09Å; V378-L382 WeakPolarHBondContact O-CB 3.44Å; V378-L382 WeakPolarHBondContact O-CG 3.48Å; V378-L382 PolarHBondContact O-N 2.96Å; D379-L382 PolarHBondContact O-N 3.34Å; L382-L385 PolarHBondContact O-N 3.41Å; L382-L386 WeakPolarHBondContact O-CB 3.48Å; L382-L386 VanDerWaalsContact O-CG 3.29Å; L382-L386 WeakPolarHBondContact O-CG 3.18Å; L382-L386 PolarHBondContact O-N 3.38Å |
| 383 | R | 94.9 | Very high | 94.1 | Very high | 20 Ų | 20 | 67 Ų | 67 | 8% | 0.075 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -55.6 | -50.7 | 172.1 | -78 | 175.7 | -165.7 | -79.7 | -18.6 | 111.7 | V213 F355 I363 D379 L385 L386 V387 | V213-R383 HydrophobicContact CG1-CB 3.72Å; V213-R383 HydrophobicContact CG1-CG 3.85Å; F355-R383 HydrophobicContact CE1-CG 4.27Å; I363-R383 HydrophobicContact CD1-CG 3.69Å; D379-R383 WeakPolarHBondContact O-CB 3.1Å; D379-R383 VanDerWaalsContact O-CG 3.26Å; D379-R383 WeakPolarHBondContact O-CG 3.34Å; D379-R383 PolarHBondContact O-N 2.71Å; D379-R383 IonicContact OD1-CZ 2.88Å; D379-R383 IonicContact OD1-NE 3.71Å; D379-R383 PolarHBondContact OD1-NE 2.82Å; D379-R383 IonicContact OD1-NH2 3.09Å; D379-R383 PolarHBondContact OD1-NH2 3.44Å; D379-R383 WeakPolarHBondContact OD2-CD 3.36Å; D379-R383 IonicContact OD2-CZ 3.45Å; D379-R383 IonicContact OD2-NE 3.91Å; D379-R383 PolarHBondContact OD2-NE 3.42Å; D379-R383 IonicContact OD2-NH2 2.76Å; R383-L385 PolarHBondContact O-N 3.36Å; R383-L386 PolarHBondContact O-N 2.95Å; R383-V387 WeakPolarHBondContact O-CG2 3.4Å; R383-V387 PolarHBondContact O-N 3.33Å; R383-V387 VanDerWaalsContact O-N 3.12Å |
| 384 | T | 95.5 | Very high | 94.3 | Very high | 30 Ų | 30 | 56 Ų | 56 | 18% | 0.184 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.9 | -47.7 | 179 | -54.9 | 0 | 0 | 0 | 0 | 111.3 | I210 F214 L380 L381 L386 V387 I388 | I210-T384 HydrophobicContact CD1-CG2 4.1Å; I210-T384 HydrophobicContact CG1-CG2 4.36Å; I210-T384 HydrophobicContact CG2-CG2 4.17Å; F214-T384 VanDerWaalsContact CE1-OG1 3.23Å; F214-T384 WeakPolarHBondContact CE1-OG1 3.38Å; F214-T384 VanDerWaalsContact CZ-OG1 3.29Å; F214-T384 WeakPolarHBondContact CZ-OG1 3.45Å; L380-T384 WeakPolarHBondContact O-CB 3.47Å; L380-T384 PolarHBondContact O-N 2.98Å; L380-T384 PolarHBondContact O-OG1 2.88Å; L381-T384 PolarHBondContact O-N 3.2Å; T384-L386 PolarHBondContact O-N 3.34Å; T384-V387 PolarHBondContact O-N 2.91Å; T384-I388 HydrophobicContact CG2-CD1 3.84Å; T384-I388 HydrophobicContact CG2-CG1 4.49Å; T384-I388 WeakPolarHBondContact O-CG1 3.23Å; T384-I388 PolarHBondContact O-N 3.38Å |
| 385 | L | 95.8 | Very high | 94.4 | Very high | 90 Ų | 90 | 50.2 Ų | 50.2 | 47% | 0.471 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -61.7 | -42.9 | -179.6 | -178.5 | 62.4 | 0 | 0 | 0 | 112 | L381 L382 R383 V387 I388 I389 | L381-L385 WeakPolarHBondContact O-CB 3.48Å; L381-L385 PolarHBondContact O-N 3.16Å; L382-L385 PolarHBondContact O-N 3.41Å; R383-L385 PolarHBondContact O-N 3.36Å; L385-V387 PolarHBondContact O-N 2.9Å; L385-I388 PolarHBondContact O-N 2.82Å; L385-I389 HydrophobicContact CD1-CD1 4.29Å; L385-I389 HydrophobicContact CG-CD1 3.99Å; L385-I389 VanDerWaalsContact O-CG1 3.26Å; L385-I389 WeakPolarHBondContact O-CG1 3.4Å; L385-I389 PolarHBondContact O-N 3.43Å |
| 386 | L | 95.3 | Very high | 94.5 | Very high | 14 Ų | 14 | 51.6 Ų | 51.6 | 7% | 0.073 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -62.5 | -40.2 | 175.7 | -74.1 | 169.3 | 0 | 0 | 0 | 112.4 | I153 F355 L362 L382 R383 T384 I389 T390 | I153-L386 HydrophobicContact CD1-CD2 4.24Å; F355-L386 HydrophobicContact CE2-CB 3.63Å; F355-L386 HydrophobicContact CZ-CB 3.61Å; F355-L386 HydrophobicContact CZ-CD1 3.93Å; F355-L386 HydrophobicContact CZ-CG 4.46Å; L362-L386 HydrophobicContact CD2-CD1 4.27Å; L362-L386 HydrophobicContact CD2-CD2 4Å; L382-L386 WeakPolarHBondContact O-CB 3.48Å; L382-L386 VanDerWaalsContact O-CG 3.29Å; L382-L386 WeakPolarHBondContact O-CG 3.18Å; L382-L386 PolarHBondContact O-N 3.38Å; R383-L386 PolarHBondContact O-N 2.95Å; T384-L386 PolarHBondContact O-N 3.34Å; L386-I389 PolarHBondContact O-N 3.34Å; L386-T390 WeakPolarHBondContact O-CG2 3.44Å; L386-T390 PolarHBondContact O-N 3.08Å; L386-T390 PolarHBondContact O-OG1 3.47Å |
| 387 | V | 97 | Very high | 94.5 | Very high | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -69.1 | -36.2 | 175.5 | 179.6 | 0 | 0 | 0 | 0 | 111.7 | F160 L206 F209 I210 V213 F351 F355 R383 T384 L385 T390 C391 | F160-V387 HydrophobicContact CE2-CG1 4.31Å; F160-V387 HydrophobicContact CZ-CG1 4.09Å; L206-V387 HydrophobicContact CD1-CG1 3.86Å; F209-V387 HydrophobicContact CB-CG1 3.89Å; I210-V387 HydrophobicContact CG1-CB 4.14Å; I210-V387 HydrophobicContact CG1-CG1 3.87Å; V213-V387 HydrophobicContact CB-CG2 4.23Å; V213-V387 HydrophobicContact CG1-CG2 4.29Å; V213-V387 HydrophobicContact CG2-CG2 3.86Å; F351-V387 HydrophobicContact CE1-CG2 4.21Å; F351-V387 HydrophobicContact CZ-CG1 4.26Å; F351-V387 HydrophobicContact CZ-CG2 4.34Å; F355-V387 HydrophobicContact CD2-CG2 4.02Å; F355-V387 HydrophobicContact CE2-CG2 3.48Å; F355-V387 VanDerWaalsContact CE2-CG2 3.48Å; F355-V387 HydrophobicContact CZ-CG2 3.9Å; R383-V387 WeakPolarHBondContact O-CG2 3.4Å; R383-V387 PolarHBondContact O-N 3.33Å; R383-V387 VanDerWaalsContact O-N 3.12Å; T384-V387 PolarHBondContact O-N 2.91Å; L385-V387 PolarHBondContact O-N 2.9Å; V387-T390 WeakPolarHBondContact CA-OG1 3.43Å; V387-T390 PolarHBondContact O-N 2.84Å; V387-T390 PolarHBondContact O-OG1 2.94Å; V387-C391 WeakPolarHBondContact O-CB 3.24Å; V387-C391 PolarHBondContact O-N 2.03Å |
| 388 | I | 97.2 | Very high | 94.3 | Very high | 77 Ų | 77 | 42.4 Ų | 42.4 | 40% | 0.395 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -64.3 | -41.9 | 173 | -69.9 | 167.7 | 0 | 0 | 0 | 110.6 | L206 I210 T384 L385 C391 A392 | L206-I388 HydrophobicContact CD1-CG1 4.33Å; I210-I388 HydrophobicContact CD1-CG1 4.48Å; T384-I388 HydrophobicContact CG2-CD1 3.84Å; T384-I388 HydrophobicContact CG2-CG1 4.49Å; T384-I388 WeakPolarHBondContact O-CG1 3.23Å; T384-I388 PolarHBondContact O-N 3.38Å; L385-I388 PolarHBondContact O-N 2.82Å; I388-C391 PolarHBondContact O-N 2.98Å; I388-A392 WeakPolarHBondContact O-CB 3.21Å; I388-A392 PolarHBondContact O-N 2.89Å |
| 389 | I | 96 | Very high | 94.2 | Very high | 73 Ų | 73 | 42.7 Ų | 42.7 | 37% | 0.374 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -62.9 | -44 | 176.3 | -70.2 | 164.3 | 0 | 0 | 0 | 111.1 | L385 L386 C391 A392 L393 | L385-I389 HydrophobicContact CD1-CD1 4.29Å; L385-I389 HydrophobicContact CG-CD1 3.99Å; L385-I389 VanDerWaalsContact O-CG1 3.26Å; L385-I389 WeakPolarHBondContact O-CG1 3.4Å; L385-I389 PolarHBondContact O-N 3.43Å; L386-I389 PolarHBondContact O-N 3.34Å; I389-C391 VanDerWaalsContact C-N 3.34Å; I389-C391 PolarHBondContact O-N 3.47Å; I389-A392 PolarHBondContact O-N 3.29Å; I389-L393 HydrophobicContact CG2-CD1 4.11Å; I389-L393 WeakPolarHBondContact O-CG 3.46Å; I389-L393 PolarHBondContact O-N 3.42Å |
| 390 | T | 96 | Very high | 94.2 | Very high | 1 Ų | 1 | 41.5 Ų | 41.5 | 1% | 0.006 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64 | -38.9 | 176.7 | 54.2 | 0 | 0 | 0 | 0 | 112.2 | I153 C156 C157 L386 V387 L393 A394 | I153-T390 HydrophobicContact CB-CG2 4.18Å; I153-T390 HydrophobicContact CG1-CG2 4.27Å; I153-T390 HydrophobicContact CG2-CG2 3.74Å; C156-T390 HydrophobicContact CB-CG2 3.69Å; C157-T390 PolarHBondContact SG-O 2.81Å; L386-T390 WeakPolarHBondContact O-CG2 3.44Å; L386-T390 PolarHBondContact O-N 3.08Å; L386-T390 PolarHBondContact O-OG1 3.47Å; V387-T390 WeakPolarHBondContact CA-OG1 3.43Å; V387-T390 PolarHBondContact O-N 2.84Å; V387-T390 PolarHBondContact O-OG1 2.94Å; T390-L393 PolarHBondContact O-N 3.25Å; T390-A394 PolarHBondContact O-N 3.49Å |
| 391 | C | 96.9 | Very high | 94.2 | Very high | 2 Ų | 2 | 39.3 Ų | 39.3 | 1% | 0.014 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -65.8 | -43.2 | 174.9 | -171.2 | 0 | 0 | 0 | 0 | 112.2 | F160 L206 V387 I388 I389 L393 A394 I395 | F160-C391 HydrophobicContact CD1-CB 4.41Å; F160-C391 HydrophobicContact CD2-CB 4.45Å; F160-C391 HydrophobicContact CE1-CB 3.9Å; F160-C391 HydrophobicContact CE2-CB 3.96Å; F160-C391 HydrophobicContact CZ-CB 3.66Å; L206-C391 HydrophobicContact CD1-CB 3.89Å; V387-C391 WeakPolarHBondContact O-CB 3.24Å; V387-C391 PolarHBondContact O-N 2.03Å; I388-C391 PolarHBondContact O-N 2.98Å; I389-C391 VanDerWaalsContact C-N 3.34Å; I389-C391 PolarHBondContact O-N 3.47Å; C391-L393 VanDerWaalsContact C-N 3.33Å; C391-L393 PolarHBondContact O-N 3.03Å; C391-A394 PolarHBondContact O-N 2.83Å; C391-I395 WeakPolarHBondContact O-CG1 3.41Å; C391-I395 PolarHBondContact O-N 3.31Å |
| 392 | A | 96.3 | Very high | 94.2 | Very high | 57 Ų | 57 | 33.9 Ų | 33.9 | 47% | 0.471 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -61.8 | -39.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | I388 I389 I395 L396 | I388-A392 WeakPolarHBondContact O-CB 3.21Å; I388-A392 PolarHBondContact O-N 2.89Å; I389-A392 PolarHBondContact O-N 3.29Å; A392-I395 PolarHBondContact O-N 3.33Å; A392-L396 PolarHBondContact O-N 2.94Å |
| 393 | L | 94.4 | Very high | 94.3 | Very high | 77 Ų | 77 | 33 Ų | 33 | 40% | 0.403 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -66.9 | -39.6 | 174.4 | -70.5 | 172 | 0 | 0 | 0 | 112.3 | I153 I389 T390 C391 L396 I397 | I153-L393 HydrophobicContact CG2-CD1 3.9Å; I389-L393 HydrophobicContact CG2-CD1 4.11Å; I389-L393 WeakPolarHBondContact O-CG 3.46Å; I389-L393 PolarHBondContact O-N 3.42Å; T390-L393 PolarHBondContact O-N 3.25Å; C391-L393 VanDerWaalsContact C-N 3.33Å; C391-L393 PolarHBondContact O-N 3.03Å; L393-L396 PolarHBondContact O-N 3.49Å; L393-I397 PolarHBondContact O-N 2.93Å |
| 394 | A | 94.6 | Very high | 94.3 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -64.1 | -39.4 | 174 | 0 | 0 | 0 | 0 | 0 | 112.5 | C157 F160 V161 M202 T390 C391 L396 I397 | C157-A394 HydrophobicContact CB-CB 4.39Å; F160-A394 HydrophobicContact CB-CB 3.68Å; F160-A394 HydrophobicContact CG-CB 4.43Å; V161-A394 HydrophobicContact CG2-CB 3.86Å; M202-A394 HydrophobicContact SD-CB 3.88Å; T390-A394 PolarHBondContact O-N 3.49Å; C391-A394 PolarHBondContact O-N 2.83Å; A394-L396 VanDerWaalsContact C-N 3.33Å; A394-L396 PolarHBondContact O-N 3.41Å; A394-I397 CarbonylContact O-C 3.19Å; A394-I397 PolarHBondContact O-N 3.07Å |
| 395 | I | 93.8 | Very high | 94.3 | Very high | 39 Ų | 39 | 30.8 Ų | 30.8 | 20% | 0.2 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -68.7 | -30.8 | 176.5 | -70 | 167.1 | 0 | 0 | 0 | 112 | R199 M202 L203 C391 A392 | R199-I395 HydrophobicContact CB-CG2 4.43Å; R199-I395 HydrophobicContact CG-CG2 4.2Å; R199-I395 PolarHBondContact NH1-O 3.37Å; M202-I395 HydrophobicContact CB-CG1 4.22Å; M202-I395 HydrophobicContact SD-CG1 3.84Å; L203-I395 HydrophobicContact CD2-CD1 3.75Å; L203-I395 HydrophobicContact CG-CD1 3.92Å; C391-I395 WeakPolarHBondContact O-CG1 3.41Å; C391-I395 PolarHBondContact O-N 3.31Å; A392-I395 PolarHBondContact O-N 3.33Å |
| 396 | L | 91.4 | Very high | 94.3 | Very high | 110 Ų | 110 | 28.1 Ų | 28.1 | 58% | 0.576 | 16% | 0.155 | S | C | * | . | H | α-helix | trans | -69.5 | -34.8 | 177.1 | -177.2 | 63.3 | 0 | 0 | 0 | 112.4 | A392 L393 A394 | A392-L396 PolarHBondContact O-N 2.94Å; L393-L396 PolarHBondContact O-N 3.49Å; A394-L396 VanDerWaalsContact C-N 3.33Å; A394-L396 PolarHBondContact O-N 3.41Å |
| 397 | I | 90.3 | Very high | 94.4 | Very high | 27 Ų | 27 | 28.3 Ų | 28.3 | 14% | 0.138 | 16% | 0.156 | C | C | . | . | trans | -130 | 77.5 | -179.9 | -49.9 | 165.7 | 0 | 0 | 0 | 108.8 | L393 A394 E399 L402 V403 L406 I463 | L393-I397 PolarHBondContact O-N 2.93Å; A394-I397 CarbonylContact O-C 3.19Å; A394-I397 PolarHBondContact O-N 3.07Å; I397-E399 HydrophobicContact CG2-CB 4.38Å; I397-E399 PolarHBondContact O-N 3.18Å; I397-L402 HydrophobicContact CG2-CB 4.4Å; I397-V403 HydrophobicContact CB-CG2 3.78Å; I397-V403 HydrophobicContact CG2-CG2 3.6Å; I397-V403 WeakPolarHBondContact O-CG2 3.44Å; I397-L406 HydrophobicContact CD1-CD2 3.86Å; I397-I463 HydrophobicContact CD1-CD1 3.88Å; I397-I463 HydrophobicContact CG1-CD1 4.25Å; I397-I463 HydrophobicContact CG1-CG2 4.39Å; I397-I463 HydrophobicContact CG2-CD1 3.8Å; I397-I463 HydrophobicContact CG2-CG1 3.85Å; I397-I463 HydrophobicContact CG2-CG2 4.45Å | ||
| 398 | P | 89.1 | Confident | 94.3 | Very high | 6 Ų | 6 | 28.3 Ų | 28.3 | 4% | 0.039 | 16% | 0.156 | C | C | . | . | trans | -81 | 47.1 | -177.9 | 36.6 | -38 | 0 | 0 | 0 | 111.6 | R199 M202 | R199-P398 HydrophobicContact CG-CB 4.48Å; M202-P398 HydrophobicContact CE-CB 3.66Å | ||
| 399 | E | 90.8 | Very high | 94.3 | Very high | 35 Ų | 35 | 24.6 Ų | 24.6 | 16% | 0.164 | 14% | 0.137 | C | C | . | . | trans | -133.6 | 98.5 | -174.6 | -66.1 | -68.1 | 145.2 | 0 | 0 | 108.3 | I397 D401 L402 V403 R466 K470 | I397-E399 HydrophobicContact CG2-CB 4.38Å; I397-E399 PolarHBondContact O-N 3.18Å; E399-D401 VanDerWaalsContact C-N 3.3Å; E399-D401 PolarHBondContact O-N 3.45Å; E399-L402 HydrophobicContact CB-CB 3.99Å; E399-L402 HydrophobicContact CB-CD1 3.83Å; E399-L402 HydrophobicContact CB-CG 3.91Å; E399-L402 HydrophobicContact CG-CD1 4.1Å; E399-L402 PolarHBondContact O-N 3.32Å; E399-L402 VanDerWaalsContact O-N 3.1Å; E399-V403 WeakPolarHBondContact O-CG2 3.29Å; E399-V403 PolarHBondContact O-N 3.14Å; E399-R466 WeakPolarHBondContact OE2-CD 3.38Å; E399-R466 IonicContact OE2-CZ 3.9Å; E399-R466 IonicContact OE2-NE 3.24Å; E399-R466 IonicContact OE2-NH1 2.83Å; E399-R466 PolarHBondContact OE2-NH1 2.92Å; E399-K470 WeakPolarHBondContact OE1-CE 3.49Å; E399-K470 IonicContact OE1-NZ 3.42Å; E399-K470 PolarHBondContact OE1-NZ 2.88Å | ||
| 400 | L | 91.6 | Very high | 94.2 | Very high | 4 Ų | 4 | 23 Ų | 23 | 2% | 0.021 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -55.8 | -42.2 | -168.5 | -176.5 | 64.5 | 0 | 0 | 0 | 113.3 | V158 V161 F162 S325 L328 I404 | V158-L400 HydrophobicContact CG1-CD1 3.82Å; V161-L400 HydrophobicContact CB-CD1 4.12Å; V161-L400 HydrophobicContact CG1-CB 3.88Å; V161-L400 HydrophobicContact CG1-CD1 4.14Å; F162-L400 HydrophobicContact CB-CD1 4.02Å; F162-L400 HydrophobicContact CD2-CD2 3.97Å; S325-L400 WeakPolarHBondContact OG-CD2 3.44Å; L328-L400 HydrophobicContact CD1-CD2 4.5Å; L400-I404 HydrophobicContact CD1-CD1 4.05Å; L400-I404 HydrophobicContact CG-CD1 3.95Å; L400-I404 WeakPolarHBondContact O-CB 3.35Å; L400-I404 WeakPolarHBondContact O-CD1 3.49Å; L400-I404 WeakPolarHBondContact O-CG1 3.23Å; L400-I404 PolarHBondContact O-N 3.37Å; L400-I404 VanDerWaalsContact O-N 3.11Å |
| 401 | D | 93.5 | Very high | 94.1 | Very high | 22 Ų | 22 | 23 Ų | 23 | 12% | 0.118 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -65.6 | -40.7 | 179.1 | 61.6 | -43.9 | 0 | 0 | 0 | 112.4 | L73 E399 S405 R466 | L73-D401 HydrophobicContact CD2-CB 3.38Å; E399-D401 VanDerWaalsContact C-N 3.3Å; E399-D401 PolarHBondContact O-N 3.45Å; D401-S405 WeakPolarHBondContact O-CB 3.34Å; D401-S405 PolarHBondContact O-N 3.21Å; D401-R466 IonicContact OD1-CZ 2.7Å; D401-R466 IonicContact OD1-NH1 3.14Å; D401-R466 PolarHBondContact OD1-NH1 3.36Å; D401-R466 IonicContact OD2-CZ 2.75Å; D401-R466 IonicContact OD2-NH1 3.1Å; D401-R466 PolarHBondContact OD2-NH1 2.9Å; D401-R466 VanDerWaalsContact OD2-NH1 3.09Å; D401-R466 IonicContact OD2-NH2 3.98Å; D401-R466 PolarHBondContact OD2-NH2 2.87Å |
| 402 | L | 94.3 | Very high | 94 | Very high | 1 Ų | 1 | 23 Ų | 23 | 1% | 0.005 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -73.8 | -38.5 | -178.5 | -54.6 | -176 | 0 | 0 | 0 | 111.8 | L264 I397 E399 S405 L406 E462 I463 | L264-L402 HydrophobicContact CD2-CD2 4.39Å; I397-L402 HydrophobicContact CG2-CB 4.4Å; E399-L402 HydrophobicContact CB-CB 3.99Å; E399-L402 HydrophobicContact CB-CD1 3.83Å; E399-L402 HydrophobicContact CB-CG 3.91Å; E399-L402 HydrophobicContact CG-CD1 4.1Å; E399-L402 PolarHBondContact O-N 3.32Å; E399-L402 VanDerWaalsContact O-N 3.1Å; L402-S405 PolarHBondContact O-N 2.89Å; L402-L406 WeakPolarHBondContact O-CB 3.22Å; L402-L406 PolarHBondContact O-N 3.03Å; L402-E462 HydrophobicContact CD1-CB 4.3Å; L402-E462 HydrophobicContact CD1-CG 3.86Å; L402-E462 HydrophobicContact CD2-CB 4.06Å; L402-E462 HydrophobicContact CD2-CG 3.56Å; L402-E462 HydrophobicContact CG-CG 4.37Å; L402-I463 HydrophobicContact CB-CD1 4.33Å; L402-I463 HydrophobicContact CB-CG1 3.9Å; L402-I463 HydrophobicContact CD1-CB 4.43Å; L402-I463 HydrophobicContact CD1-CG1 3.63Å; L402-I463 HydrophobicContact CG-CG1 4.37Å |
| 403 | V | 94.9 | Very high | 94 | Very high | 9 Ų | 9 | 20.2 Ų | 20.2 | 6% | 0.055 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -65 | -45.4 | 174.1 | -177.5 | 0 | 0 | 0 | 0 | 110.8 | C157 V158 I397 E399 S405 L406 V407 | C157-V403 HydrophobicContact CB-CG1 4.26Å; V158-V403 HydrophobicContact CG2-CB 4.21Å; V158-V403 HydrophobicContact CG2-CG1 3.59Å; I397-V403 HydrophobicContact CB-CG2 3.78Å; I397-V403 HydrophobicContact CG2-CG2 3.6Å; I397-V403 WeakPolarHBondContact O-CG2 3.44Å; E399-V403 WeakPolarHBondContact O-CG2 3.29Å; E399-V403 PolarHBondContact O-N 3.14Å; V403-S405 PolarHBondContact O-N 3.45Å; V403-L406 PolarHBondContact O-N 3.17Å; V403-V407 HydrophobicContact CG1-CG2 4.27Å; V403-V407 WeakPolarHBondContact O-CB 3.38Å; V403-V407 VanDerWaalsContact O-CG2 3.3Å; V403-V407 WeakPolarHBondContact O-CG2 3.44Å; V403-V407 PolarHBondContact O-N 3.43Å |
| 404 | I | 95.1 | Very high | 94.1 | Very high | 2 Ų | 2 | 18.4 Ų | 18.4 | 1% | 0.01 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -58.2 | -49.9 | 176.2 | -73.2 | 170.5 | 0 | 0 | 0 | 110.4 | V158 T268 F271 L400 L406 G408 | V158-I404 HydrophobicContact CB-CG1 4.33Å; V158-I404 HydrophobicContact CG1-CD1 3.91Å; V158-I404 HydrophobicContact CG1-CG1 3.6Å; V158-I404 HydrophobicContact CG2-CG1 3.67Å; T268-I404 HydrophobicContact CG2-CG2 3.74Å; F271-I404 HydrophobicContact CB-CG2 4.05Å; F271-I404 HydrophobicContact CD1-CG2 3.79Å; F271-I404 HydrophobicContact CD2-CG2 4.23Å; F271-I404 WeakPolarHBondContact CD2-O 3.43Å; F271-I404 HydrophobicContact CE1-CG1 4.32Å; F271-I404 HydrophobicContact CE1-CG2 4.3Å; F271-I404 HydrophobicContact CG-CG2 3.78Å; F271-I404 HydrophobicContact CZ-CG1 4.27Å; L400-I404 HydrophobicContact CD1-CD1 4.05Å; L400-I404 HydrophobicContact CG-CD1 3.95Å; L400-I404 WeakPolarHBondContact O-CB 3.35Å; L400-I404 WeakPolarHBondContact O-CD1 3.49Å; L400-I404 WeakPolarHBondContact O-CG1 3.23Å; L400-I404 PolarHBondContact O-N 3.37Å; L400-I404 VanDerWaalsContact O-N 3.11Å; I404-L406 PolarHBondContact O-N 3.24Å; I404-G408 PolarHBondContact O-N 3.12Å |
| 405 | S | 96.3 | Very high | 94.1 | Very high | 1 Ų | 1 | 18.4 Ų | 18.4 | 1% | 0.007 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -61.8 | -43.9 | 178.7 | 179.4 | 0 | 0 | 0 | 0 | 112.4 | L264 G267 D401 L402 V403 G408 S409 | L264-S405 WeakPolarHBondContact CA-OG 3.42Å; L264-S405 WeakPolarHBondContact CD2-OG 3.35Å; G267-S405 WeakPolarHBondContact CA-O 3.38Å; D401-S405 WeakPolarHBondContact O-CB 3.34Å; D401-S405 PolarHBondContact O-N 3.21Å; L402-S405 PolarHBondContact O-N 2.89Å; V403-S405 PolarHBondContact O-N 3.45Å; S405-G408 PolarHBondContact O-N 3.19Å; S405-S409 WeakPolarHBondContact O-CB 3.26Å; S405-S409 PolarHBondContact O-N 3.3Å; S405-S409 PolarHBondContact O-OG 2.58Å; S405-S409 VanDerWaalsContact O-OG 3.13Å |
| 406 | L | 96.1 | Very high | 94.1 | Very high | 34 Ų | 34 | 16.8 Ų | 16.8 | 18% | 0.178 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -66.9 | -44.2 | -177.5 | -177.4 | 66.4 | 0 | 0 | 0 | 111.9 | I397 L402 V403 I404 G408 S409 V410 T456 A459 V460 I463 | I397-L406 HydrophobicContact CD1-CD2 3.86Å; L402-L406 WeakPolarHBondContact O-CB 3.22Å; L402-L406 PolarHBondContact O-N 3.03Å; V403-L406 PolarHBondContact O-N 3.17Å; I404-L406 PolarHBondContact O-N 3.24Å; L406-G408 VanDerWaalsContact C-N 3.33Å; L406-S409 PolarHBondContact O-OG 3.41Å; L406-V410 HydrophobicContact CD1-CG2 3.8Å; L406-V410 HydrophobicContact CG-CG2 4.3Å; L406-V410 VanDerWaalsContact O-CB 3.25Å; L406-V410 WeakPolarHBondContact O-CB 3.06Å; L406-V410 VanDerWaalsContact O-CG2 3.23Å; L406-V410 WeakPolarHBondContact O-CG2 3.06Å; L406-V410 PolarHBondContact O-N 3.49Å; L406-T456 HydrophobicContact CD1-CG2 4.01Å; L406-A459 HydrophobicContact CB-CB 4.28Å; L406-A459 HydrophobicContact CD1-CB 4.19Å; L406-V460 HydrophobicContact CD1-CG2 4.41Å; L406-I463 HydrophobicContact CD2-CD1 4.22Å |
| 407 | V | 96 | Very high | 94.4 | Very high | 17 Ų | 17 | 11.6 Ų | 11.6 | 10% | 0.103 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -64.2 | -41.9 | 176.2 | 174.5 | 0 | 0 | 0 | 0 | 110.3 | F155 F271 V403 S411 S412 | F155-V407 HydrophobicContact CD1-CG1 4.02Å; F155-V407 HydrophobicContact CE1-CG1 4.05Å; F271-V407 HydrophobicContact CD2-CB 3.89Å; F271-V407 HydrophobicContact CD2-CG1 3.86Å; F271-V407 HydrophobicContact CE2-CB 3.98Å; F271-V407 HydrophobicContact CE2-CG1 3.85Å; V403-V407 HydrophobicContact CG1-CG2 4.27Å; V403-V407 WeakPolarHBondContact O-CB 3.38Å; V403-V407 VanDerWaalsContact O-CG2 3.3Å; V403-V407 WeakPolarHBondContact O-CG2 3.44Å; V403-V407 PolarHBondContact O-N 3.43Å; V407-S411 PolarHBondContact O-N 3.4Å; V407-S411 PolarHBondContact O-OG 3.1Å; V407-S412 PolarHBondContact O-N 2.92Å |
| 408 | G | 95.7 | Very high | 94.7 | Very high | 0 Ų | 0 | 11 Ų | 11 | 0% | 0 | 6% | 0.059 | C | C | . | . | I | π-helix | trans | -62.1 | -48.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | G267 I270 I404 S405 L406 S413 | G267-G408 WeakPolarHBondContact O-CA 3.3Å; I270-G408 VanDerWaalsContact CG2-O 3.29Å; I270-G408 WeakPolarHBondContact CG2-O 3.45Å; I404-G408 PolarHBondContact O-N 3.12Å; S405-G408 PolarHBondContact O-N 3.19Å; L406-G408 VanDerWaalsContact C-N 3.33Å; G408-S413 PolarHBondContact O-N 3.44Å; G408-S413 PolarHBondContact O-OG 3.04Å |
| 409 | S | 96.1 | Very high | 95.1 | Very high | 0 Ų | 0 | 11.5 Ų | 11.5 | 0% | 0 | 6% | 0.061 | C | C | . | . | I | π-helix | trans | -69.6 | -41.2 | 178.6 | 65.3 | 0 | 0 | 0 | 0 | 112.2 | S405 L406 S413 F452 T456 | S405-S409 WeakPolarHBondContact O-CB 3.26Å; S405-S409 PolarHBondContact O-N 3.3Å; S405-S409 PolarHBondContact O-OG 2.58Å; S405-S409 VanDerWaalsContact O-OG 3.13Å; L406-S409 PolarHBondContact O-OG 3.41Å; S409-S413 VanDerWaalsContact O-CB 3.24Å; S409-S413 WeakPolarHBondContact O-CB 3.47Å; S409-S413 PolarHBondContact O-OG 3.46Å; S409-F452 VanDerWaalsContact O-CA 3.3Å; S409-F452 WeakPolarHBondContact O-CA 3.26Å; S409-F452 WeakPolarHBondContact O-CB 3.08Å; S409-F452 WeakPolarHBondContact O-CD2 3.43Å; S409-T456 PolarHBondContact OG-N 3.23Å; S409-T456 PolarHBondContact OG-OG1 3.03Å |
| 410 | V | 94.9 | Very high | 95.3 | Very high | 40 Ų | 40 | 9.9 Ų | 9.9 | 24% | 0.242 | 5% | 0.053 | C | C | . | . | I | π-helix | trans | -76.3 | -63.9 | -177.2 | 177.4 | 0 | 0 | 0 | 0 | 112.3 | L406 F414 F452 T456 | L406-V410 HydrophobicContact CD1-CG2 3.8Å; L406-V410 HydrophobicContact CG-CG2 4.3Å; L406-V410 VanDerWaalsContact O-CB 3.25Å; L406-V410 WeakPolarHBondContact O-CB 3.06Å; L406-V410 VanDerWaalsContact O-CG2 3.23Å; L406-V410 WeakPolarHBondContact O-CG2 3.06Å; L406-V410 PolarHBondContact O-N 3.49Å; V410-F414 VanDerWaalsContact O-CD2 3.28Å; V410-F414 WeakPolarHBondContact O-CD2 3.47Å; V410-F452 HydrophobicContact CG1-CE2 4.39Å; V410-F452 HydrophobicContact CG2-CE2 4.3Å; V410-T456 HydrophobicContact CG2-CG2 3.86Å; V410-T456 VanDerWaalsContact CG2-OG1 3.32Å; V410-T456 WeakPolarHBondContact CG2-OG1 3.35Å |
| 411 | S | 94.4 | Very high | 95.6 | Very high | 1 Ų | 1 | 9.7 Ų | 9.7 | 1% | 0.007 | 5% | 0.052 | C | C | . | . | I | π-helix | trans | -101.5 | -42.6 | -163.7 | 65.2 | 0 | 0 | 0 | 0 | 113.1 | T151 V407 S413 F414 L415 | T151-S411 VanDerWaalsContact CA-OG 3.29Å; T151-S411 WeakPolarHBondContact CA-OG 3.4Å; T151-S411 WeakPolarHBondContact OG1-CB 3.41Å; T151-S411 PolarHBondContact OG1-OG 3.05Å; V407-S411 PolarHBondContact O-N 3.4Å; V407-S411 PolarHBondContact O-OG 3.1Å; S411-S413 VanDerWaalsContact C-N 3.34Å; S411-S413 PolarHBondContact O-N 3.21Å; S411-F414 PolarHBondContact O-N 3.41Å; S411-L415 PolarHBondContact O-N 2.84Å |
| 412 | S | 94.3 | Very high | 95.7 | Very high | 0 Ų | 0 | 11.8 Ų | 11.8 | 0% | 0 | 6% | 0.062 | C | C | . | . | I | π-helix | trans | -65.1 | -34.9 | 176.6 | -54.1 | 0 | 0 | 0 | 0 | 112.2 | E274 V407 F414 L415 A416 | E274-S412 WeakPolarHBondContact CG-OG 3.43Å; V407-S412 PolarHBondContact O-N 2.92Å; S412-F414 VanDerWaalsContact C-N 3.27Å; S412-F414 PolarHBondContact O-N 3.02Å; S412-L415 PolarHBondContact O-N 3.17Å; S412-A416 VanDerWaalsContact O-CB 3.27Å; S412-A416 WeakPolarHBondContact O-CB 3.47Å; S412-A416 PolarHBondContact O-N 2.88Å |
| 413 | S | 96.3 | Very high | 95.8 | Very high | 0 Ų | 0 | 11.7 Ų | 11.7 | 0% | 0 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -61.9 | -34.6 | 176.6 | -64.7 | 0 | 0 | 0 | 0 | 112.8 | F266 G408 S409 S411 L417 I418 | F266-S413 WeakPolarHBondContact CE1-OG 3.35Å; G408-S413 PolarHBondContact O-N 3.44Å; G408-S413 PolarHBondContact O-OG 3.04Å; S409-S413 VanDerWaalsContact O-CB 3.24Å; S409-S413 WeakPolarHBondContact O-CB 3.47Å; S409-S413 PolarHBondContact O-OG 3.46Å; S411-S413 VanDerWaalsContact C-N 3.34Å; S411-S413 PolarHBondContact O-N 3.21Å; S413-L417 WeakPolarHBondContact O-CB 3.31Å; S413-L417 PolarHBondContact O-N 3.47Å; S413-L417 VanDerWaalsContact O-N 3.08Å; S413-I418 PolarHBondContact O-N 3.03Å |
| 414 | F | 96.5 | Very high | 95.8 | Very high | 38 Ų | 38 | 12.2 Ų | 12.2 | 17% | 0.167 | 6% | 0.064 | C | C | . | . | I | π-helix | trans | -70 | -45.5 | 173.7 | -86.3 | -99 | 0 | 0 | 0 | 112.3 | F147 V410 S411 S412 I418 F419 F452 | F147-F414 HydrophobicContact CD1-CB 3.55Å; F147-F414 HydrophobicContact CD1-CD2 4.37Å; F147-F414 HydrophobicContact CD1-CG 4Å; F147-F414 HydrophobicContact CE1-CB 3.51Å; F147-F414 HydrophobicContact CE1-CD1 4.05Å; F147-F414 AromaticContact CE1-CD2 3.48Å; F147-F414 HydrophobicContact CE1-CD2 3.48Å; F147-F414 VanDerWaalsContact CE1-CD2 3.48Å; F147-F414 HydrophobicContact CE1-CE2 4.15Å; F147-F414 AromaticContact CE1-CG 3.4Å; F147-F414 HydrophobicContact CE1-CG 3.4Å; F147-F414 HydrophobicContact CE2-CD1 4.31Å; F147-F414 HydrophobicContact CE2-CG 4.44Å; F147-F414 HydrophobicContact CG-CB 4.2Å; F147-F414 HydrophobicContact CZ-CB 4.12Å; F147-F414 AromaticContact CZ-CD1 3.8Å; F147-F414 HydrophobicContact CZ-CD1 3.8Å; F147-F414 AromaticContact CZ-CD2 3.86Å; F147-F414 HydrophobicContact CZ-CD2 3.86Å; F147-F414 HydrophobicContact CZ-CE1 4.12Å; F147-F414 HydrophobicContact CZ-CE2 4.16Å; F147-F414 AromaticContact CZ-CG 3.65Å; F147-F414 HydrophobicContact CZ-CG 3.65Å; F147-F414 HydrophobicContact CZ-CZ 4.28Å; V410-F414 VanDerWaalsContact O-CD2 3.28Å; V410-F414 WeakPolarHBondContact O-CD2 3.47Å; S411-F414 PolarHBondContact O-N 3.41Å; S412-F414 VanDerWaalsContact C-N 3.27Å; S412-F414 PolarHBondContact O-N 3.02Å; F414-I418 HydrophobicContact CD1-CB 4.29Å; F414-I418 HydrophobicContact CD1-CD1 3.84Å; F414-I418 HydrophobicContact CD1-CG2 4.2Å; F414-I418 HydrophobicContact CD2-CD1 3.86Å; F414-I418 HydrophobicContact CE1-CD1 3.94Å; F414-I418 HydrophobicContact CE1-CG2 4.46Å; F414-I418 HydrophobicContact CE2-CD1 3.97Å; F414-I418 HydrophobicContact CG-CD1 3.82Å; F414-I418 HydrophobicContact CZ-CD1 4.02Å; F414-I418 PolarHBondContact O-N 3.35Å; F414-F419 HydrophobicContact CB-CD2 4.41Å; F414-F419 HydrophobicContact CB-CE2 3.92Å; F414-F419 HydrophobicContact CB-CZ 3.97Å; F414-F419 AromaticContact CD1-CE1 3.77Å; F414-F419 HydrophobicContact CD1-CE1 3.77Å; F414-F419 AromaticContact CD1-CZ 3.72Å; F414-F419 HydrophobicContact CD1-CZ 3.72Å; F414-F419 HydrophobicContact CG-CZ 4.29Å; F414-F419 WeakPolarHBondContact O-CB 3.38Å; F414-F419 WeakPolarHBondContact O-CD2 3.13Å; F414-F419 WeakPolarHBondContact O-CG 3.14Å; F414-F419 PolarHBondContact O-N 3.49Å; F414-F452 HydrophobicContact CE2-CB 4.37Å; F414-F452 AromaticContact CE2-CD1 3.84Å; F414-F452 HydrophobicContact CE2-CD1 3.84Å; F414-F452 HydrophobicContact CE2-CD2 4.03Å; F414-F452 HydrophobicContact CE2-CE1 4.09Å; F414-F452 HydrophobicContact CE2-CE2 4.27Å; F414-F452 AromaticContact CE2-CG 3.8Å; F414-F452 HydrophobicContact CE2-CG 3.8Å; F414-F452 HydrophobicContact CE2-CZ 4.29Å; F414-F452 HydrophobicContact CZ-CD1 4.31Å; F414-F452 HydrophobicContact CZ-CE1 4.38Å |
| 415 | L | 95.4 | Very high | 95.8 | Very high | 0 Ų | 0 | 14.6 Ų | 14.6 | 0% | 0 | 8% | 0.076 | C | C | . | . | I | π-helix | trans | -68.9 | -44.6 | -179.6 | -65 | 171.2 | 0 | 0 | 0 | 112.8 | Y119 V144 F147 L148 T151 E274 I276 S411 S412 F419 P420 | Y119-L415 HydrophobicContact CE1-CD2 4.07Å; Y119-L415 PolarHBondContact OH-O 3.34Å; Y119-L415 VanDerWaalsContact OH-O 3.07Å; V144-L415 HydrophobicContact CG1-CD2 4.48Å; F147-L415 HydrophobicContact CB-CD2 3.87Å; F147-L415 HydrophobicContact CB-CG 4.11Å; L148-L415 HydrophobicContact CD2-CD1 3.97Å; L148-L415 HydrophobicContact CD2-CD2 4.12Å; L148-L415 HydrophobicContact CG-CD1 4.38Å; L148-L415 HydrophobicContact CG-CD2 3.95Å; T151-L415 HydrophobicContact CG2-CD1 4.33Å; T151-L415 VanDerWaalsContact OG1-CD1 3.22Å; T151-L415 WeakPolarHBondContact OG1-CD1 3.48Å; E274-L415 WeakPolarHBondContact OE1-CB 3.35Å; E274-L415 WeakPolarHBondContact OE1-CD1 3.16Å; I276-L415 WeakPolarHBondContact CD1-O 3.43Å; I276-L415 HydrophobicContact CG2-CB 3.91Å; S411-L415 PolarHBondContact O-N 2.84Å; S412-L415 PolarHBondContact O-N 3.17Å; L415-F419 HydrophobicContact CD2-CD2 4.09Å; L415-F419 HydrophobicContact CD2-CE2 4.23Å; L415-P420 WeakPolarHBondContact O-CD 3.45Å; L415-P420 WeakPolarHBondContact O-CG 3.49Å |
| 416 | A | 94 | Very high | 95.7 | Very high | 5 Ų | 5 | 15.5 Ų | 15.5 | 4% | 0.041 | 8% | 0.081 | C | C | . | . | I | π-helix | trans | -81 | -39.5 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | C97 I270 S412 | C97-A416 WeakPolarHBondContact CB-O 3.09Å; C97-A416 PolarHBondContact SG-O 2.92Å; I270-A416 HydrophobicContact CD1-CB 4.42Å; S412-A416 VanDerWaalsContact O-CB 3.27Å; S412-A416 WeakPolarHBondContact O-CB 3.47Å; S412-A416 PolarHBondContact O-N 2.88Å |
| 417 | L | 96.2 | Very high | 95.5 | Very high | 1 Ų | 1 | 13.9 Ų | 13.9 | 1% | 0.005 | 7% | 0.072 | C | C | . | . | I | π-helix | trans | -117.2 | -30.3 | -167.2 | -58.6 | -175.8 | 0 | 0 | 0 | 115.3 | M90 I93 F266 I270 S413 P421 I444 | M90-L417 HydrophobicContact CE-CD1 4.33Å; I93-L417 HydrophobicContact CG2-CD2 3.43Å; I93-L417 VanDerWaalsContact CG2-CD2 3.43Å; F266-L417 HydrophobicContact CE2-CD1 4.2Å; F266-L417 HydrophobicContact CZ-CD1 3.74Å; I270-L417 HydrophobicContact CD1-CD1 3.74Å; I270-L417 HydrophobicContact CD1-CD2 4.12Å; I270-L417 HydrophobicContact CD1-CG 3.85Å; I270-L417 HydrophobicContact CG1-CD1 4.26Å; S413-L417 WeakPolarHBondContact O-CB 3.31Å; S413-L417 PolarHBondContact O-N 3.47Å; S413-L417 VanDerWaalsContact O-N 3.08Å; L417-P421 WeakPolarHBondContact O-CD 3.47Å; L417-P421 VanDerWaalsContact O-CG 3.25Å; L417-P421 WeakPolarHBondContact O-CG 3.4Å; L417-I444 HydrophobicContact CB-CG2 4.39Å; L417-I444 HydrophobicContact CD2-CG2 4.19Å |
| 418 | I | 96.9 | Very high | 95.3 | Very high | 14 Ų | 14 | 15.2 Ų | 15.2 | 7% | 0.072 | 8% | 0.077 | C | C | . | . | I | π-helix | trans | -94 | -52.5 | -173.9 | -61.4 | 167.7 | 0 | 0 | 0 | 110.7 | S413 F414 P421 I422 S445 | S413-I418 PolarHBondContact O-N 3.03Å; F414-I418 HydrophobicContact CD1-CB 4.29Å; F414-I418 HydrophobicContact CD1-CD1 3.84Å; F414-I418 HydrophobicContact CD1-CG2 4.2Å; F414-I418 HydrophobicContact CD2-CD1 3.86Å; F414-I418 HydrophobicContact CE1-CD1 3.94Å; F414-I418 HydrophobicContact CE1-CG2 4.46Å; F414-I418 HydrophobicContact CE2-CD1 3.97Å; F414-I418 HydrophobicContact CG-CD1 3.82Å; F414-I418 HydrophobicContact CZ-CD1 4.02Å; F414-I418 PolarHBondContact O-N 3.35Å; I418-P421 WeakPolarHBondContact O-CD 3.41Å; I418-I422 HydrophobicContact CG2-CD1 3.62Å; I418-I422 WeakPolarHBondContact O-CB 3.33Å; I418-I422 WeakPolarHBondContact O-CD1 3.35Å; I418-I422 VanDerWaalsContact O-CG1 3.25Å; I418-I422 WeakPolarHBondContact O-CG1 3.26Å; I418-I422 PolarHBondContact O-N 2.91Å; I418-S445 PolarHBondContact O-OG 2.95Å |
| 419 | F | 96.9 | Very high | 95 | Very high | 18 Ų | 18 | 20.2 Ų | 20.2 | 8% | 0.079 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -68.5 | -40.3 | -175.8 | -64.3 | -28.1 | 0 | 0 | 0 | 114.8 | Y119 M123 T143 V144 F147 F414 L415 L423 | Y119-F419 VanDerWaalsContact OH-CB 3.25Å; Y119-F419 WeakPolarHBondContact OH-CB 3.04Å; M123-F419 HydrophobicContact CE-CB 3.71Å; M123-F419 HydrophobicContact CE-CD1 4.16Å; M123-F419 HydrophobicContact CE-CG 4.04Å; T143-F419 HydrophobicContact CG2-CE1 4.21Å; T143-F419 HydrophobicContact CG2-CZ 3.69Å; V144-F419 HydrophobicContact CG2-CD2 3.87Å; V144-F419 HydrophobicContact CG2-CE2 4.14Å; V144-F419 HydrophobicContact CG2-CG 4.3Å; F147-F419 HydrophobicContact CB-CE2 3.97Å; F147-F419 AromaticContact CD2-CE2 3.93Å; F147-F419 HydrophobicContact CD2-CE2 3.93Å; F147-F419 AromaticContact CD2-CZ 3.72Å; F147-F419 HydrophobicContact CD2-CZ 3.72Å; F147-F419 HydrophobicContact CE2-CZ 4.02Å; F147-F419 AromaticContact CG-CE2 3.91Å; F147-F419 HydrophobicContact CG-CE2 3.91Å; F147-F419 HydrophobicContact CG-CZ 4.13Å; F414-F419 HydrophobicContact CB-CD2 4.41Å; F414-F419 HydrophobicContact CB-CE2 3.92Å; F414-F419 HydrophobicContact CB-CZ 3.97Å; F414-F419 AromaticContact CD1-CE1 3.77Å; F414-F419 HydrophobicContact CD1-CE1 3.77Å; F414-F419 AromaticContact CD1-CZ 3.72Å; F414-F419 HydrophobicContact CD1-CZ 3.72Å; F414-F419 HydrophobicContact CG-CZ 4.29Å; F414-F419 WeakPolarHBondContact O-CB 3.38Å; F414-F419 WeakPolarHBondContact O-CD2 3.13Å; F414-F419 WeakPolarHBondContact O-CG 3.14Å; F414-F419 PolarHBondContact O-N 3.49Å; L415-F419 HydrophobicContact CD2-CD2 4.09Å; L415-F419 HydrophobicContact CD2-CE2 4.23Å; F419-L423 WeakPolarHBondContact O-CB 3.49Å; F419-L423 PolarHBondContact O-N 2.95Å |
| 420 | P | 96.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -66 | -42.4 | -177.8 | -19.3 | 31.6 | 0 | 0 | 0 | 114.4 | C97 L100 Y119 I276 L415 L423 E424 | C97-P420 HydrophobicContact CB-CB 3.9Å; C97-P420 HydrophobicContact CB-CG 4Å; C97-P420 WeakPolarHBondContact O-CB 3.45Å; L100-P420 HydrophobicContact CB-CB 4.34Å; Y119-P420 WeakPolarHBondContact OH-CD 3.42Å; Y119-P420 WeakPolarHBondContact OH-CG 3.44Å; I276-P420 HydrophobicContact CD1-CG 3.57Å; L415-P420 WeakPolarHBondContact O-CD 3.45Å; L415-P420 WeakPolarHBondContact O-CG 3.49Å; P420-L423 WeakPolarHBondContact O-CB 3.48Å; P420-L423 PolarHBondContact O-N 3.46Å; P420-E424 PolarHBondContact O-N 2.84Å |
| 421 | P | 96.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -69 | -38.2 | 174.7 | -22.5 | 35.6 | 0 | 0 | 0 | 113.7 | L100 L417 I418 L423 E424 I425 N441 I444 | L100-P421 HydrophobicContact CD1-CB 4.41Å; L100-P421 HydrophobicContact CD1-CG 4.33Å; L417-P421 WeakPolarHBondContact O-CD 3.47Å; L417-P421 VanDerWaalsContact O-CG 3.25Å; L417-P421 WeakPolarHBondContact O-CG 3.4Å; I418-P421 WeakPolarHBondContact O-CD 3.41Å; P421-L423 VanDerWaalsContact C-N 3.28Å; P421-L423 PolarHBondContact O-N 2.88Å; P421-E424 PolarHBondContact O-N 3.28Å; P421-I425 WeakPolarHBondContact O-CG1 3.29Å; P421-I425 PolarHBondContact O-N 3.45Å; P421-N441 HydrophobicContact CB-CB 3.59Å; P421-N441 PolarHBondContact O-ND2 3.02Å; P421-I444 HydrophobicContact CG-CB 4.06Å; P421-I444 HydrophobicContact CG-CG2 3.78Å |
| 422 | I | 95.8 | Very high | 93.2 | Very high | 66 Ų | 66 | 30.7 Ų | 30.7 | 34% | 0.338 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -60.2 | -42.9 | 171.6 | -69.8 | 173.8 | 0 | 0 | 0 | 110 | I418 E424 I425 L426 | I418-I422 HydrophobicContact CG2-CD1 3.62Å; I418-I422 WeakPolarHBondContact O-CB 3.33Å; I418-I422 WeakPolarHBondContact O-CD1 3.35Å; I418-I422 VanDerWaalsContact O-CG1 3.25Å; I418-I422 WeakPolarHBondContact O-CG1 3.26Å; I418-I422 PolarHBondContact O-N 2.91Å; I422-E424 PolarHBondContact O-N 3.49Å; I422-I425 WeakPolarHBondContact O-CB 3.41Å; I422-I425 PolarHBondContact O-N 2.84Å; I422-L426 HydrophobicContact CG2-CD1 3.87Å; I422-L426 HydrophobicContact CG2-CG 4.21Å; I422-L426 WeakPolarHBondContact O-CG 3.44Å; I422-L426 PolarHBondContact O-N 3.4Å |
| 423 | L | 95.7 | Very high | 92.9 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.4 | -38.6 | 178.8 | -179.7 | 56.7 | 0 | 0 | 0 | 112.7 | L101 C104 Y119 V122 M123 F419 P420 P421 I425 L426 A427 | L101-L423 HydrophobicContact CD1-CD2 3.62Å; C104-L423 HydrophobicContact CB-CD2 4.1Å; C104-L423 HydrophobicContact CB-CG 3.89Å; Y119-L423 HydrophobicContact CE2-CD2 4.15Å; V122-L423 HydrophobicContact CB-CD2 4.34Å; V122-L423 HydrophobicContact CG1-CD1 4.21Å; V122-L423 HydrophobicContact CG1-CD2 3.71Å; V122-L423 HydrophobicContact CG1-CG 4.34Å; V122-L423 WeakPolarHBondContact O-CD1 3.17Å; M123-L423 HydrophobicContact CE-CB 4.21Å; M123-L423 HydrophobicContact SD-CD1 4.3Å; F419-L423 WeakPolarHBondContact O-CB 3.49Å; F419-L423 PolarHBondContact O-N 2.95Å; P420-L423 WeakPolarHBondContact O-CB 3.48Å; P420-L423 PolarHBondContact O-N 3.46Å; P421-L423 VanDerWaalsContact C-N 3.28Å; P421-L423 PolarHBondContact O-N 2.88Å; L423-I425 VanDerWaalsContact C-N 3.34Å; L423-I425 PolarHBondContact O-N 3.47Å; L423-L426 PolarHBondContact O-N 2.95Å; L423-A427 WeakPolarHBondContact O-CB 3.23Å; L423-A427 PolarHBondContact O-N 2.98Å |
| 424 | E | 95.9 | Very high | 92.6 | Very high | 20 Ų | 20 | 35.9 Ų | 35.9 | 9% | 0.093 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.9 | -41.9 | 172.9 | -173.1 | 178.7 | -134.6 | 0 | 0 | 111.2 | L100 C104 P420 P421 I422 L426 F428 L433 K440 N441 | L100-E424 HydrophobicContact CD1-CB 4.21Å; L100-E424 VanDerWaalsContact CD2-CD 3.49Å; L100-E424 VanDerWaalsContact CD2-OE1 3.28Å; L100-E424 WeakPolarHBondContact CD2-OE1 3.21Å; C104-E424 VanDerWaalsContact SG-CA 3.56Å; P420-E424 PolarHBondContact O-N 2.84Å; P421-E424 PolarHBondContact O-N 3.28Å; I422-E424 PolarHBondContact O-N 3.49Å; E424-L426 PolarHBondContact O-N 3.42Å; E424-F428 HydrophobicContact CG-CD2 4.09Å; E424-F428 HydrophobicContact CG-CE2 4.46Å; E424-F428 WeakPolarHBondContact O-CD2 3.25Å; E424-F428 PolarHBondContact O-N 2.99Å; E424-L433 HydrophobicContact CG-CD2 3.93Å; E424-K440 IonicContact OE1-NZ 3.97Å; E424-K440 IonicContact OE2-NZ 3.48Å; E424-K440 PolarHBondContact OE2-NZ 3.16Å; E424-N441 PolarHBondContact OE2-ND2 3.32Å; E424-N441 PolarHBondContact OE2-OD1 3.11Å; E424-N441 VanDerWaalsContact OE2-OD1 3.07Å |
| 425 | I | 94.8 | Very high | 92.3 | Very high | 51 Ų | 51 | 38.9 Ų | 38.9 | 26% | 0.262 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -63.2 | -41.6 | 176.1 | -64.2 | 166.2 | 0 | 0 | 0 | 111.6 | P421 I422 L423 H429 T438 N441 | P421-I425 WeakPolarHBondContact O-CG1 3.29Å; P421-I425 PolarHBondContact O-N 3.45Å; I422-I425 WeakPolarHBondContact O-CB 3.41Å; I422-I425 PolarHBondContact O-N 2.84Å; L423-I425 VanDerWaalsContact C-N 3.34Å; L423-I425 PolarHBondContact O-N 3.47Å; I425-H429 WeakPolarHBondContact O-CB 3.41Å; I425-H429 PolarHBondContact O-N 3.12Å; I425-T438 HydrophobicContact CD1-CG2 4.39Å; I425-N441 HydrophobicContact CD1-CB 3.85Å; I425-N441 HydrophobicContact CG1-CB 4.19Å |
| 426 | L | 93.8 | Very high | 92.2 | Very high | 21 Ų | 21 | 45.3 Ų | 45.3 | 11% | 0.11 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -72.1 | -45.3 | 179.6 | -68.1 | 176.8 | 0 | 0 | 0 | 112.6 | M123 M127 V130 L133 I422 L423 E424 F428 H429 | M123-L426 HydrophobicContact SD-CD1 4.08Å; M127-L426 HydrophobicContact CG-CD1 3.92Å; V130-L426 HydrophobicContact CG2-CD2 3.77Å; L133-L426 HydrophobicContact CD2-CD1 4.29Å; L133-L426 HydrophobicContact CD2-CD2 3.54Å; I422-L426 HydrophobicContact CG2-CD1 3.87Å; I422-L426 HydrophobicContact CG2-CG 4.21Å; I422-L426 WeakPolarHBondContact O-CG 3.44Å; I422-L426 PolarHBondContact O-N 3.4Å; L423-L426 PolarHBondContact O-N 2.95Å; E424-L426 PolarHBondContact O-N 3.42Å; L426-F428 PolarHBondContact O-N 3.25Å; L426-H429 WeakPolarHBondContact O-CB 3.2Å; L426-H429 PolarHBondContact O-N 3.5Å |
| 427 | A | 92.8 | Very high | 92.1 | Very high | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.2 | -44.6 | -176.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | C104 L108 N129 L423 | C104-A427 HydrophobicContact CB-CB 4.15Å; L108-A427 HydrophobicContact CD1-CB 4.15Å; L108-A427 HydrophobicContact CG-CB 4.38Å; N129-A427 PolarHBondContact ND2-O 3.01Å; L423-A427 WeakPolarHBondContact O-CB 3.23Å; L423-A427 PolarHBondContact O-N 2.98Å |
| 428 | F | 92.3 | Very high | 91.9 | Very high | 45 Ų | 45 | 48.4 Ų | 48.4 | 20% | 0.197 | 28% | 0.278 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.8 | 12.1 | -177.4 | -64.2 | -82.8 | 0 | 0 | 0 | 113.9 | H107 E424 L426 T430 E431 G432 L433 | H107-F428 HydrophobicContact CB-CE1 4.12Å; H107-F428 HydrophobicContact CB-CZ 3.77Å; H107-F428 AromaticContact CG-CE1 3.69Å; H107-F428 AromaticContact CG-CZ 3.83Å; H107-F428 AromaticContact ND1-CE1 3.59Å; E424-F428 HydrophobicContact CG-CD2 4.09Å; E424-F428 HydrophobicContact CG-CE2 4.46Å; E424-F428 WeakPolarHBondContact O-CD2 3.25Å; E424-F428 PolarHBondContact O-N 2.99Å; L426-F428 PolarHBondContact O-N 3.25Å; F428-T430 VanDerWaalsContact C-N 3.26Å; F428-T430 PolarHBondContact O-N 3.23Å; F428-E431 WeakPolarHBondContact CD1-OE2 3.23Å; F428-E431 PolarHBondContact O-N 2.85Å; F428-G432 PolarHBondContact O-N 2.91Å; F428-L433 HydrophobicContact CB-CD1 3.75Å; F428-L433 HydrophobicContact CB-CD2 4.08Å; F428-L433 HydrophobicContact CB-CG 3.72Å |
| 429 | H | 87.9 | Confident | 91.8 | Very high | 104 Ų | 104 | 52.3 Ų | 52.3 | 48% | 0.481 | 30% | 0.298 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.4 | -41 | -178.1 | -178.6 | 67.7 | 0 | 0 | 0 | 113.4 | V130 I425 L426 E431 | V130-H429 HydrophobicContact CG2-CB 3.99Å; I425-H429 WeakPolarHBondContact O-CB 3.41Å; I425-H429 PolarHBondContact O-N 3.12Å; L426-H429 WeakPolarHBondContact O-CB 3.2Å; L426-H429 PolarHBondContact O-N 3.5Å; H429-E431 VanDerWaalsContact C-N 3.31Å; H429-E431 PolarHBondContact O-N 2.71Å |
| 430 | T | 83.1 | Confident | 91.8 | Very high | 83 Ų | 83 | 54 Ų | 54 | 51% | 0.509 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.4 | -13.4 | -178.5 | 52.8 | 0 | 0 | 0 | 0 | 114.2 | N129 F428 | N129-T430 HydrophobicContact CB-CG2 4.47Å; F428-T430 VanDerWaalsContact C-N 3.26Å; F428-T430 PolarHBondContact O-N 3.23Å |
| 431 | E | 85.7 | Confident | 91.7 | Very high | 119 Ų | 119 | 54 Ų | 54 | 56% | 0.556 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105 | -11.2 | -173.9 | -56.8 | -168.8 | 157.7 | 0 | 0 | 112.6 | H107 F428 H429 | H107-E431 IonicContact CE1-OE1 3.75Å; H107-E431 PolarHBondContact CE1-OE1 3.27Å; H107-E431 VanDerWaalsContact CE1-OE1 3.25Å; H107-E431 IonicContact CE1-OE2 2.88Å; H107-E431 PolarHBondContact CE1-OE2 2.96Å; H107-E431 IonicContact ND1-OE2 2.71Å; F428-E431 WeakPolarHBondContact CD1-OE2 3.23Å; F428-E431 PolarHBondContact O-N 2.85Å; H429-E431 VanDerWaalsContact C-N 3.31Å; H429-E431 PolarHBondContact O-N 2.71Å |
| 432 | G | 79.5 | Confident | 91.6 | Very high | 60 Ų | 60 | 59.3 Ų | 59.3 | 62% | 0.619 | 33% | 0.333 | S | S | * | . | trans | 80 | 90.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | F428 | F428-G432 PolarHBondContact O-N 2.91Š| ||
| 433 | L | 87.3 | Confident | 91.7 | Very high | 41 Ų | 41 | 61 Ų | 61 | 22% | 0.215 | 34% | 0.342 | C | S | . | . | trans | -65.4 | 145.2 | 172 | -67.7 | 108.3 | 0 | 0 | 0 | 111.5 | E424 F428 | E424-L433 HydrophobicContact CG-CD2 3.93Å; F428-L433 HydrophobicContact CB-CD1 3.75Å; F428-L433 HydrophobicContact CB-CD2 4.08Å; F428-L433 HydrophobicContact CB-CG 3.72Å | ||
| 434 | S | 91.1 | Very high | 91.7 | Very high | 67 Ų | 67 | 61.8 Ų | 61.8 | 47% | 0.469 | 35% | 0.346 | S | S | . | . | trans | -61.6 | 140.6 | 170.5 | 69.6 | 0 | 0 | 0 | 0 | 110.6 | L436 A437 T438 | S434-L436 PolarHBondContact O-N 3.45Å; S434-L436 VanDerWaalsContact O-N 3.12Å; S434-A437 WeakPolarHBondContact O-CB 3.28Å; S434-A437 PolarHBondContact O-N 2.94Å; S434-A437 WeakPolarHBondContact OG-CB 3.43Å; S434-A437 PolarHBondContact OG-N 3.49Å; S434-T438 PolarHBondContact O-N 2.85Å; S434-T438 PolarHBondContact O-OG1 3.15Å | ||
| 435 | P | 90.7 | Very high | 91.8 | Very high | 101 Ų | 101 | 61.6 Ų | 61.6 | 66% | 0.656 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -55 | -34.9 | 179.5 | -28.3 | 35.3 | 0 | 0 | 0 | 113.2 | T438 I439 | P435-T438 PolarHBondContact O-N 3.36Å; P435-I439 VanDerWaalsContact O-CG1 3.3Å; P435-I439 WeakPolarHBondContact O-CG1 3.36Å; P435-I439 PolarHBondContact O-N 3.31Å |
| 436 | L | 92 | Very high | 91.9 | Very high | 135 Ų | 135 | 62.4 Ų | 62.4 | 71% | 0.707 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -62.6 | -41.6 | 175.9 | -175.5 | 65 | 0 | 0 | 0 | 112.5 | S434 K440 | S434-L436 PolarHBondContact O-N 3.45Å; S434-L436 VanDerWaalsContact O-N 3.12Å; L436-K440 VanDerWaalsContact O-CB 3.23Å; L436-K440 WeakPolarHBondContact O-CB 3.43Å; L436-K440 PolarHBondContact O-N 2.94Å |
| 437 | A | 91.9 | Very high | 92 | Very high | 18 Ų | 18 | 64.2 Ų | 64.2 | 15% | 0.149 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.4 | -41.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | S434 K440 N441 | S434-A437 WeakPolarHBondContact O-CB 3.28Å; S434-A437 PolarHBondContact O-N 2.94Å; S434-A437 WeakPolarHBondContact OG-CB 3.43Å; S434-A437 PolarHBondContact OG-N 3.49Å; A437-K440 WeakPolarHBondContact O-CE 3.4Å; A437-K440 PolarHBondContact O-N 3.3Å; A437-N441 WeakPolarHBondContact O-CB 3.23Å; A437-N441 VanDerWaalsContact O-CG 3.23Å; A437-N441 PolarHBondContact O-N 2.86Å; A437-N441 PolarHBondContact O-ND2 3.11Å |
| 438 | T | 92.6 | Very high | 92.2 | Very high | 53 Ų | 53 | 64.2 Ų | 64.2 | 33% | 0.325 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.8 | -44.5 | 176.5 | -54.2 | 0 | 0 | 0 | 0 | 112 | I425 S434 P435 N441 L442 | I425-T438 HydrophobicContact CD1-CG2 4.39Å; S434-T438 PolarHBondContact O-N 2.85Å; S434-T438 PolarHBondContact O-OG1 3.15Å; P435-T438 PolarHBondContact O-N 3.36Å; T438-N441 PolarHBondContact O-N 3.46Å; T438-L442 WeakPolarHBondContact O-CB 3.42Å; T438-L442 PolarHBondContact O-N 2.9Å |
| 439 | I | 94.6 | Very high | 92.4 | Very high | 96 Ų | 96 | 65.8 Ų | 65.8 | 49% | 0.492 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62.5 | -47.9 | 175.8 | -70.5 | 162.9 | 0 | 0 | 0 | 110.8 | P435 N441 L442 I443 | P435-I439 VanDerWaalsContact O-CG1 3.3Å; P435-I439 WeakPolarHBondContact O-CG1 3.36Å; P435-I439 PolarHBondContact O-N 3.31Å; I439-N441 VanDerWaalsContact C-N 3.3Å; I439-N441 PolarHBondContact O-N 3.24Å; I439-L442 PolarHBondContact O-N 3.04Å; I439-I443 HydrophobicContact CG2-CD1 3.77Å; I439-I443 HydrophobicContact CG2-CG1 4.47Å; I439-I443 VanDerWaalsContact O-CG1 3.32Å; I439-I443 WeakPolarHBondContact O-CG1 3.48Å; I439-I443 PolarHBondContact O-N 3.5Å |
| 440 | K | 96.1 | Very high | 92.8 | Very high | 55 Ų | 55 | 65.2 Ų | 65.2 | 24% | 0.239 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -54.4 | -45.8 | 174.2 | 173.6 | -137.1 | 71 | -169.1 | 0 | 111.3 | H96 E424 L436 A437 I443 I444 | H96-K440 PolarHBondContact CE1-NZ 3.2Å; H96-K440 VanDerWaalsContact NE2-CD 3.31Å; H96-K440 WeakPolarHBondContact NE2-CD 3.32Å; H96-K440 WeakPolarHBondContact NE2-CE 3.37Å; H96-K440 PolarHBondContact NE2-NZ 2.98Å; E424-K440 IonicContact OE1-NZ 3.97Å; E424-K440 IonicContact OE2-NZ 3.48Å; E424-K440 PolarHBondContact OE2-NZ 3.16Å; L436-K440 VanDerWaalsContact O-CB 3.23Å; L436-K440 WeakPolarHBondContact O-CB 3.43Å; L436-K440 PolarHBondContact O-N 2.94Å; A437-K440 WeakPolarHBondContact O-CE 3.4Å; A437-K440 PolarHBondContact O-N 3.3Å; K440-I443 PolarHBondContact O-N 3.42Å; K440-I444 HydrophobicContact CG-CD1 4.18Å; K440-I444 WeakPolarHBondContact O-CG1 3.37Å; K440-I444 PolarHBondContact O-N 3.43Å; K440-I444 VanDerWaalsContact O-N 3.11Å |
| 441 | N | 95.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 61.7 Ų | 61.7 | 0% | 0 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -64.4 | -45.1 | 178.6 | -77.2 | -16 | 0 | 0 | 0 | 112.4 | P421 E424 I425 A437 T438 I439 I443 I444 S445 | P421-N441 HydrophobicContact CB-CB 3.59Å; P421-N441 PolarHBondContact O-ND2 3.02Å; E424-N441 PolarHBondContact OE2-ND2 3.32Å; E424-N441 PolarHBondContact OE2-OD1 3.11Å; E424-N441 VanDerWaalsContact OE2-OD1 3.07Å; I425-N441 HydrophobicContact CD1-CB 3.85Å; I425-N441 HydrophobicContact CG1-CB 4.19Å; A437-N441 WeakPolarHBondContact O-CB 3.23Å; A437-N441 VanDerWaalsContact O-CG 3.23Å; A437-N441 PolarHBondContact O-N 2.86Å; A437-N441 PolarHBondContact O-ND2 3.11Å; T438-N441 PolarHBondContact O-N 3.46Å; I439-N441 VanDerWaalsContact C-N 3.3Å; I439-N441 PolarHBondContact O-N 3.24Å; N441-I443 VanDerWaalsContact C-N 3.34Å; N441-I443 PolarHBondContact O-N 3.34Å; N441-I444 PolarHBondContact O-N 3.36Å; N441-S445 PolarHBondContact O-N 3.39Å; N441-S445 PolarHBondContact O-OG 3.48Å |
| 442 | L | 95.4 | Very high | 93.9 | Very high | 110 Ų | 110 | 58.3 Ų | 58.3 | 58% | 0.576 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -60.3 | -43.6 | 177 | -177 | 62.8 | 0 | 0 | 0 | 111.6 | T438 I439 S445 V446 | T438-L442 WeakPolarHBondContact O-CB 3.42Å; T438-L442 PolarHBondContact O-N 2.9Å; I439-L442 PolarHBondContact O-N 3.04Å; L442-S445 PolarHBondContact O-N 3.44Å; L442-V446 HydrophobicContact CD1-CG2 4.31Å; L442-V446 HydrophobicContact CG-CG2 4.47Å; L442-V446 WeakPolarHBondContact O-CB 3.4Å; L442-V446 VanDerWaalsContact O-CG2 3.27Å; L442-V446 WeakPolarHBondContact O-CG2 3.27Å; L442-V446 PolarHBondContact O-N 2.84Å |
| 443 | I | 96.6 | Very high | 94.7 | Very high | 101 Ų | 101 | 60 Ų | 60 | 52% | 0.518 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -60 | -47.8 | 176.7 | -68.9 | 165.9 | 0 | 0 | 0 | 110.9 | I439 K440 N441 S445 V446 V447 | I439-I443 HydrophobicContact CG2-CD1 3.77Å; I439-I443 HydrophobicContact CG2-CG1 4.47Å; I439-I443 VanDerWaalsContact O-CG1 3.32Å; I439-I443 WeakPolarHBondContact O-CG1 3.48Å; I439-I443 PolarHBondContact O-N 3.5Å; K440-I443 PolarHBondContact O-N 3.42Å; N441-I443 VanDerWaalsContact C-N 3.34Å; N441-I443 PolarHBondContact O-N 3.34Å; I443-S445 PolarHBondContact O-N 2.97Å; I443-V446 PolarHBondContact O-N 2.91Å; I443-V447 WeakPolarHBondContact O-CG2 3.33Å; I443-V447 PolarHBondContact O-N 3.07Å |
| 444 | I | 97 | Very high | 95.1 | Very high | 18 Ų | 18 | 62.4 Ų | 62.4 | 9% | 0.092 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -62.1 | -44.4 | 179.5 | -64.2 | 165.5 | 0 | 0 | 0 | 110.8 | I93 L417 P421 K440 N441 V446 V447 G448 | I93-I444 HydrophobicContact CG2-CG1 4.41Å; I93-I444 HydrophobicContact CG2-CG2 3.78Å; L417-I444 HydrophobicContact CB-CG2 4.39Å; L417-I444 HydrophobicContact CD2-CG2 4.19Å; P421-I444 HydrophobicContact CG-CB 4.06Å; P421-I444 HydrophobicContact CG-CG2 3.78Å; K440-I444 HydrophobicContact CG-CD1 4.18Å; K440-I444 WeakPolarHBondContact O-CG1 3.37Å; K440-I444 PolarHBondContact O-N 3.43Å; K440-I444 VanDerWaalsContact O-N 3.11Å; N441-I444 PolarHBondContact O-N 3.36Å; I444-V446 PolarHBondContact O-N 3.37Å; I444-V447 PolarHBondContact O-N 2.92Å; I444-G448 PolarHBondContact O-N 3.42Å |
| 445 | S | 96.8 | Very high | 95.3 | Very high | 15 Ų | 15 | 59.2 Ų | 59.2 | 11% | 0.105 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -66.9 | -34.4 | 177.3 | -61.7 | 0 | 0 | 0 | 0 | 113.1 | I418 N441 L442 I443 G448 L449 | I418-S445 PolarHBondContact O-OG 2.95Å; N441-S445 PolarHBondContact O-N 3.39Å; N441-S445 PolarHBondContact O-OG 3.48Å; L442-S445 PolarHBondContact O-N 3.44Å; I443-S445 PolarHBondContact O-N 2.97Å; S445-G448 PolarHBondContact O-N 3.25Å; S445-L449 WeakPolarHBondContact O-CB 3.33Å; S445-L449 PolarHBondContact O-N 2.81Å |
| 446 | V | 96.6 | Very high | 95.5 | Very high | 68 Ų | 68 | 55.9 Ų | 55.9 | 41% | 0.412 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -67.5 | -41.5 | 173.4 | 167.7 | 0 | 0 | 0 | 0 | 111.2 | L442 I443 I444 G448 L449 L450 | L442-V446 HydrophobicContact CD1-CG2 4.31Å; L442-V446 HydrophobicContact CG-CG2 4.47Å; L442-V446 WeakPolarHBondContact O-CB 3.4Å; L442-V446 VanDerWaalsContact O-CG2 3.27Å; L442-V446 WeakPolarHBondContact O-CG2 3.27Å; L442-V446 PolarHBondContact O-N 2.84Å; I443-V446 PolarHBondContact O-N 2.91Å; I444-V446 PolarHBondContact O-N 3.37Å; V446-G448 VanDerWaalsContact C-N 3.33Å; V446-G448 PolarHBondContact O-N 3.08Å; V446-L449 PolarHBondContact O-N 3.32Å; V446-L450 HydrophobicContact CG1-CD1 3.95Å; V446-L450 HydrophobicContact CG1-CG 4.32Å; V446-L450 WeakPolarHBondContact O-CB 3.5Å; V446-L450 WeakPolarHBondContact O-CG 3.1Å; V446-L450 PolarHBondContact O-N 3.15Å |
| 447 | V | 96.1 | Very high | 95.7 | Very high | 59 Ų | 59 | 56.5 Ų | 56.5 | 36% | 0.358 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.5 | -43.6 | 172.9 | 170.1 | 0 | 0 | 0 | 0 | 110.8 | F266 I443 I444 L449 L450 G451 | F266-V447 HydrophobicContact CE2-CG1 4.25Å; I443-V447 WeakPolarHBondContact O-CG2 3.33Å; I443-V447 PolarHBondContact O-N 3.07Å; I444-V447 PolarHBondContact O-N 2.92Å; V447-L449 PolarHBondContact O-N 3.47Å; V447-L450 PolarHBondContact O-N 3Å; V447-G451 PolarHBondContact O-N 3.09Å |
| 448 | G | 96.6 | Very high | 95.9 | Very high | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -60.8 | -41.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | I444 S445 V446 F452 | I444-G448 PolarHBondContact O-N 3.42Å; S445-G448 PolarHBondContact O-N 3.25Å; V446-G448 VanDerWaalsContact C-N 3.33Å; V446-G448 PolarHBondContact O-N 3.08Å; G448-F452 WeakPolarHBondContact O-CB 3.38Å; G448-F452 PolarHBondContact O-N 3.02Å |
| 449 | L | 97.1 | Very high | 96 | Very high | 79 Ų | 79 | 54.9 Ų | 54.9 | 41% | 0.414 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -69.3 | -42 | 178.8 | -176 | 67.5 | 0 | 0 | 0 | 112.4 | S445 V446 V447 F452 L453 | S445-L449 WeakPolarHBondContact O-CB 3.33Å; S445-L449 PolarHBondContact O-N 2.81Å; V446-L449 PolarHBondContact O-N 3.32Å; V447-L449 PolarHBondContact O-N 3.47Å; L449-F452 HydrophobicContact CD1-CD1 4.14Å; L449-F452 WeakPolarHBondContact O-CB 3.46Å; L449-F452 PolarHBondContact O-N 3.43Å; L449-L453 HydrophobicContact CG-CD1 4.29Å; L449-L453 VanDerWaalsContact O-CG 3.32Å; L449-L453 WeakPolarHBondContact O-CG 3.37Å; L449-L453 PolarHBondContact O-N 2.95Å |
| 450 | L | 96.2 | Very high | 95.9 | Very high | 92 Ų | 92 | 53.4 Ų | 53.4 | 48% | 0.482 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -64.4 | -43.5 | 174.8 | -71.9 | 172.4 | 0 | 0 | 0 | 111.1 | V446 V447 F452 L453 L454 | V446-L450 HydrophobicContact CG1-CD1 3.95Å; V446-L450 HydrophobicContact CG1-CG 4.32Å; V446-L450 WeakPolarHBondContact O-CB 3.5Å; V446-L450 WeakPolarHBondContact O-CG 3.1Å; V446-L450 PolarHBondContact O-N 3.15Å; V447-L450 PolarHBondContact O-N 3Å; L450-F452 VanDerWaalsContact C-N 3.35Å; L450-L453 PolarHBondContact O-N 3.3Å; L450-L454 VanDerWaalsContact O-CB 3.3Å; L450-L454 WeakPolarHBondContact O-CB 3.37Å; L450-L454 VanDerWaalsContact O-CG 3.3Å; L450-L454 WeakPolarHBondContact O-CG 3.44Å; L450-L454 PolarHBondContact O-N 3.08Å |
| 451 | G | 94.9 | Very high | 95.9 | Very high | 8 Ų | 8 | 54.3 Ų | 54.3 | 8% | 0.082 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63.8 | -37.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | V447 G455 | V447-G451 PolarHBondContact O-N 3.09Å; G451-G455 VanDerWaalsContact O-CA 3.31Å; G451-G455 WeakPolarHBondContact O-CA 3.49Å; G451-G455 PolarHBondContact O-N 2.63Å |
| 452 | F | 96.9 | Very high | 95.7 | Very high | 49 Ų | 49 | 57.2 Ų | 57.2 | 22% | 0.215 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -59.6 | -56.4 | 169.3 | 161.3 | -117.9 | 0 | 0 | 0 | 111.9 | S409 V410 F414 G448 L449 L450 T456 | S409-F452 VanDerWaalsContact O-CA 3.3Å; S409-F452 WeakPolarHBondContact O-CA 3.26Å; S409-F452 WeakPolarHBondContact O-CB 3.08Å; S409-F452 WeakPolarHBondContact O-CD2 3.43Å; V410-F452 HydrophobicContact CG1-CE2 4.39Å; V410-F452 HydrophobicContact CG2-CE2 4.3Å; F414-F452 HydrophobicContact CE2-CB 4.37Å; F414-F452 AromaticContact CE2-CD1 3.84Å; F414-F452 HydrophobicContact CE2-CD1 3.84Å; F414-F452 HydrophobicContact CE2-CD2 4.03Å; F414-F452 HydrophobicContact CE2-CE1 4.09Å; F414-F452 HydrophobicContact CE2-CE2 4.27Å; F414-F452 AromaticContact CE2-CG 3.8Å; F414-F452 HydrophobicContact CE2-CG 3.8Å; F414-F452 HydrophobicContact CE2-CZ 4.29Å; F414-F452 HydrophobicContact CZ-CD1 4.31Å; F414-F452 HydrophobicContact CZ-CE1 4.38Å; G448-F452 WeakPolarHBondContact O-CB 3.38Å; G448-F452 PolarHBondContact O-N 3.02Å; L449-F452 HydrophobicContact CD1-CD1 4.14Å; L449-F452 WeakPolarHBondContact O-CB 3.46Å; L449-F452 PolarHBondContact O-N 3.43Å; L450-F452 VanDerWaalsContact C-N 3.35Å; F452-T456 WeakPolarHBondContact CD2-OG1 2.97Å; F452-T456 WeakPolarHBondContact O-CB 3.37Å; F452-T456 PolarHBondContact O-N 2.69Å; F452-T456 PolarHBondContact O-OG1 3.43Å |
| 453 | L | 97.1 | Very high | 95.6 | Very high | 95 Ų | 95 | 52.9 Ų | 52.9 | 50% | 0.497 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -63.3 | -50.5 | -174.9 | -68.8 | 171.4 | 0 | 0 | 0 | 111.7 | L449 L450 Y457 | L449-L453 HydrophobicContact CG-CD1 4.29Å; L449-L453 VanDerWaalsContact O-CG 3.32Å; L449-L453 WeakPolarHBondContact O-CG 3.37Å; L449-L453 PolarHBondContact O-N 2.95Å; L450-L453 PolarHBondContact O-N 3.3Å; L453-Y457 WeakPolarHBondContact O-CB 3.41Å; L453-Y457 PolarHBondContact O-N 3.05Å |
| 454 | L | 95.9 | Very high | 95.3 | Very high | 92 Ų | 92 | 53 Ų | 53 | 48% | 0.482 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -71.5 | -42.4 | -178 | -62.8 | 174.1 | 0 | 0 | 0 | 112 | P263 L450 Y457 I458 | P263-L454 HydrophobicContact CB-CB 4.07Å; P263-L454 HydrophobicContact CG-CB 4.01Å; L450-L454 VanDerWaalsContact O-CB 3.3Å; L450-L454 WeakPolarHBondContact O-CB 3.37Å; L450-L454 VanDerWaalsContact O-CG 3.3Å; L450-L454 WeakPolarHBondContact O-CG 3.44Å; L450-L454 PolarHBondContact O-N 3.08Å; L454-Y457 PolarHBondContact O-N 3.1Å; L454-I458 WeakPolarHBondContact O-CG1 3.17Å; L454-I458 PolarHBondContact O-N 3.35Å |
| 455 | G | 95.1 | Very high | 95 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -64.4 | -44.5 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | G451 A459 | G451-G455 VanDerWaalsContact O-CA 3.31Å; G451-G455 WeakPolarHBondContact O-CA 3.49Å; G451-G455 PolarHBondContact O-N 2.63Å; G455-A459 WeakPolarHBondContact O-CB 3.5Å; G455-A459 PolarHBondContact O-N 3.04Å |
| 456 | T | 95.4 | Very high | 94.5 | Very high | 30 Ų | 30 | 56.4 Ų | 56.4 | 18% | 0.184 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -65.3 | -43.9 | 176.2 | -51.8 | 0 | 0 | 0 | 0 | 111.2 | L406 S409 V410 F452 A459 V460 | L406-T456 HydrophobicContact CD1-CG2 4.01Å; S409-T456 PolarHBondContact OG-N 3.23Å; S409-T456 PolarHBondContact OG-OG1 3.03Å; V410-T456 HydrophobicContact CG2-CG2 3.86Å; V410-T456 VanDerWaalsContact CG2-OG1 3.32Å; V410-T456 WeakPolarHBondContact CG2-OG1 3.35Å; F452-T456 WeakPolarHBondContact CD2-OG1 2.97Å; F452-T456 WeakPolarHBondContact O-CB 3.37Å; F452-T456 PolarHBondContact O-N 2.69Å; F452-T456 PolarHBondContact O-OG1 3.43Å; T456-A459 PolarHBondContact O-N 2.89Å; T456-V460 HydrophobicContact CG2-CG2 4.34Å; T456-V460 WeakPolarHBondContact O-CB 3.46Å; T456-V460 VanDerWaalsContact O-CG2 3.26Å; T456-V460 WeakPolarHBondContact O-CG2 3.49Å; T456-V460 PolarHBondContact O-N 3.03Å |
| 457 | Y | 95.9 | Very high | 93.9 | Very high | 149 Ų | 149 | 54.9 Ų | 54.9 | 58% | 0.584 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -60.9 | -49.8 | 179.2 | 177 | -105.6 | 0 | 0 | 0 | 112.5 | L453 L454 V460 I461 | L453-Y457 WeakPolarHBondContact O-CB 3.41Å; L453-Y457 PolarHBondContact O-N 3.05Å; L454-Y457 PolarHBondContact O-N 3.1Å; Y457-V460 PolarHBondContact O-N 3.03Å; Y457-I461 HydrophobicContact CD1-CD1 4.15Å; Y457-I461 HydrophobicContact CD2-CD1 4.2Å; Y457-I461 HydrophobicContact CE1-CD1 3.57Å; Y457-I461 HydrophobicContact CE2-CD1 3.63Å; Y457-I461 HydrophobicContact CG-CD1 4.44Å; Y457-I461 WeakPolarHBondContact O-CG1 3.38Å; Y457-I461 PolarHBondContact O-N 3.09Å; Y457-I461 WeakPolarHBondContact OH-CD1 3.47Å |
| 458 | I | 95.7 | Very high | 93.2 | Very high | 37 Ų | 37 | 56.8 Ų | 56.8 | 19% | 0.19 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -67.9 | -42 | 179.3 | -62.4 | -61 | 0 | 0 | 0 | 111.2 | P263 L264 L454 V460 I461 E462 | P263-I458 HydrophobicContact CB-CB 4.33Å; P263-I458 HydrophobicContact CB-CG1 4.1Å; P263-I458 HydrophobicContact CG-CG1 4.03Å; L264-I458 HydrophobicContact CD1-CG2 4.12Å; L264-I458 HydrophobicContact CD2-CG2 3.96Å; L264-I458 HydrophobicContact CG-CG2 3.78Å; L454-I458 WeakPolarHBondContact O-CG1 3.17Å; L454-I458 PolarHBondContact O-N 3.35Å; I458-V460 PolarHBondContact O-N 2.91Å; I458-I461 PolarHBondContact O-N 2.88Å; I458-E462 WeakPolarHBondContact O-CB 3.42Å; I458-E462 PolarHBondContact O-N 3.08Å |
| 459 | A | 93.9 | Very high | 92.3 | Very high | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -60.1 | -45.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | L264 L406 G455 T456 E462 I463 | L264-A459 HydrophobicContact CD2-CB 4.13Å; L406-A459 HydrophobicContact CB-CB 4.28Å; L406-A459 HydrophobicContact CD1-CB 4.19Å; G455-A459 WeakPolarHBondContact O-CB 3.5Å; G455-A459 PolarHBondContact O-N 3.04Å; T456-A459 PolarHBondContact O-N 2.89Å; A459-E462 PolarHBondContact O-N 3.34Å; A459-I463 WeakPolarHBondContact O-CB 3.46Å; A459-I463 WeakPolarHBondContact O-CD1 3.45Å; A459-I463 WeakPolarHBondContact O-CG1 3.39Å; A459-I463 PolarHBondContact O-N 3.11Å |
| 460 | V | 94.1 | Very high | 91 | Very high | 65 Ų | 65 | 59.9 Ų | 59.9 | 39% | 0.394 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -64.8 | -41.1 | 178.2 | 170.6 | 0 | 0 | 0 | 0 | 111.9 | L406 T456 Y457 I458 I463 L464 | L406-V460 HydrophobicContact CD1-CG2 4.41Å; T456-V460 HydrophobicContact CG2-CG2 4.34Å; T456-V460 WeakPolarHBondContact O-CB 3.46Å; T456-V460 VanDerWaalsContact O-CG2 3.26Å; T456-V460 WeakPolarHBondContact O-CG2 3.49Å; T456-V460 PolarHBondContact O-N 3.03Å; Y457-V460 PolarHBondContact O-N 3.03Å; I458-V460 PolarHBondContact O-N 2.91Å; V460-I463 PolarHBondContact O-N 3.01Å; V460-L464 HydrophobicContact CG1-CD1 4.07Å; V460-L464 VanDerWaalsContact O-CG 3.3Å; V460-L464 WeakPolarHBondContact O-CG 3.33Å; V460-L464 PolarHBondContact O-N 3.39Å |
| 461 | I | 94.6 | Very high | 89.7 | Confident | 74 Ų | 74 | 62.3 Ų | 62.3 | 38% | 0.379 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.4 | -45 | 175.7 | -76.8 | 178.5 | 0 | 0 | 0 | 111.5 | Y457 I458 L464 A465 | Y457-I461 HydrophobicContact CD1-CD1 4.15Å; Y457-I461 HydrophobicContact CD2-CD1 4.2Å; Y457-I461 HydrophobicContact CE1-CD1 3.57Å; Y457-I461 HydrophobicContact CE2-CD1 3.63Å; Y457-I461 HydrophobicContact CG-CD1 4.44Å; Y457-I461 WeakPolarHBondContact O-CG1 3.38Å; Y457-I461 PolarHBondContact O-N 3.09Å; Y457-I461 WeakPolarHBondContact OH-CD1 3.47Å; I458-I461 PolarHBondContact O-N 2.88Å; I461-L464 PolarHBondContact O-N 2.92Å; I461-A465 WeakPolarHBondContact O-CB 3.32Å; I461-A465 PolarHBondContact O-N 3.34Å |
| 462 | E | 92.6 | Very high | 88.4 | Confident | 61 Ų | 61 | 68 Ų | 68 | 29% | 0.285 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -66.4 | -37.7 | -179.9 | -173.6 | 64.2 | -163.9 | 0 | 0 | 111.5 | L402 I458 A459 A465 R466 | L402-E462 HydrophobicContact CD1-CB 4.3Å; L402-E462 HydrophobicContact CD1-CG 3.86Å; L402-E462 HydrophobicContact CD2-CB 4.06Å; L402-E462 HydrophobicContact CD2-CG 3.56Å; L402-E462 HydrophobicContact CG-CG 4.37Å; I458-E462 WeakPolarHBondContact O-CB 3.42Å; I458-E462 PolarHBondContact O-N 3.08Å; A459-E462 PolarHBondContact O-N 3.34Å; E462-A465 PolarHBondContact O-N 3.49Å; E462-R466 WeakPolarHBondContact O-CG 3.33Å; E462-R466 PolarHBondContact O-N 3.39Å; E462-R466 IonicContact OE1-CZ 2.81Å; E462-R466 IonicContact OE1-NE 2.94Å; E462-R466 PolarHBondContact OE1-NE 3.19Å; E462-R466 IonicContact OE1-NH2 3.15Å; E462-R466 PolarHBondContact OE1-NH2 3.21Å; E462-R466 VanDerWaalsContact OE1-NH2 3.14Å |
| 463 | I | 91.8 | Very high | 87.1 | Confident | 19 Ų | 19 | 71.5 Ų | 71.5 | 10% | 0.097 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60.2 | -47.7 | 172 | -69.2 | 163.1 | 0 | 0 | 0 | 110.9 | I397 L402 L406 A459 V460 N467 | I397-I463 HydrophobicContact CD1-CD1 3.88Å; I397-I463 HydrophobicContact CG1-CD1 4.25Å; I397-I463 HydrophobicContact CG1-CG2 4.39Å; I397-I463 HydrophobicContact CG2-CD1 3.8Å; I397-I463 HydrophobicContact CG2-CG1 3.85Å; I397-I463 HydrophobicContact CG2-CG2 4.45Å; L402-I463 HydrophobicContact CB-CD1 4.33Å; L402-I463 HydrophobicContact CB-CG1 3.9Å; L402-I463 HydrophobicContact CD1-CB 4.43Å; L402-I463 HydrophobicContact CD1-CG1 3.63Å; L402-I463 HydrophobicContact CG-CG1 4.37Å; L406-I463 HydrophobicContact CD2-CD1 4.22Å; A459-I463 WeakPolarHBondContact O-CB 3.46Å; A459-I463 WeakPolarHBondContact O-CD1 3.45Å; A459-I463 WeakPolarHBondContact O-CG1 3.39Å; A459-I463 PolarHBondContact O-N 3.11Å; V460-I463 PolarHBondContact O-N 3.01Å; I463-N467 WeakPolarHBondContact O-CB 3.39Å; I463-N467 PolarHBondContact O-N 3.45Å; I463-N467 PolarHBondContact O-ND2 3.33Å |
| 464 | L | 91.4 | Very high | 85.6 | Confident | 102 Ų | 102 | 70.2 Ų | 70.2 | 53% | 0.534 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -64.4 | -41.8 | 178.9 | -69.8 | 171.2 | 0 | 0 | 0 | 111.6 | V460 I461 N467 N468 | V460-L464 HydrophobicContact CG1-CD1 4.07Å; V460-L464 VanDerWaalsContact O-CG 3.3Å; V460-L464 WeakPolarHBondContact O-CG 3.33Å; V460-L464 PolarHBondContact O-N 3.39Å; I461-L464 PolarHBondContact O-N 2.92Å; L464-N467 PolarHBondContact O-N 3.03Å; L464-N468 VanDerWaalsContact O-CG 3.24Å; L464-N468 PolarHBondContact O-N 3.32Å; L464-N468 PolarHBondContact O-ND2 3.03Å |
| 465 | A | 89.9 | Confident | 83.8 | Confident | 45 Ų | 45 | 72.4 Ų | 72.4 | 37% | 0.372 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -61.6 | -51 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | I461 E462 N467 N468 V469 | I461-A465 WeakPolarHBondContact O-CB 3.32Å; I461-A465 PolarHBondContact O-N 3.34Å; E462-A465 PolarHBondContact O-N 3.49Å; A465-N467 VanDerWaalsContact C-N 3.34Å; A465-N467 PolarHBondContact O-N 3.12Å; A465-N468 PolarHBondContact O-N 3.14Å; A465-V469 WeakPolarHBondContact O-CG2 3.41Å; A465-V469 PolarHBondContact O-N 3.5Å |
| 466 | R | 86.4 | Confident | 82.1 | Confident | 60 Ų | 60 | 78.5 Ų | 78.5 | 23% | 0.226 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -64.3 | -36.3 | 178.7 | -67.5 | -171.2 | -163.9 | 170.6 | 10.2 | 112.6 | E399 D401 E462 K470 | E399-R466 WeakPolarHBondContact OE2-CD 3.38Å; E399-R466 IonicContact OE2-CZ 3.9Å; E399-R466 IonicContact OE2-NE 3.24Å; E399-R466 IonicContact OE2-NH1 2.83Å; E399-R466 PolarHBondContact OE2-NH1 2.92Å; D401-R466 IonicContact OD1-CZ 2.7Å; D401-R466 IonicContact OD1-NH1 3.14Å; D401-R466 PolarHBondContact OD1-NH1 3.36Å; D401-R466 IonicContact OD2-CZ 2.75Å; D401-R466 IonicContact OD2-NH1 3.1Å; D401-R466 PolarHBondContact OD2-NH1 2.9Å; D401-R466 VanDerWaalsContact OD2-NH1 3.09Å; D401-R466 IonicContact OD2-NH2 3.98Å; D401-R466 PolarHBondContact OD2-NH2 2.87Å; E462-R466 WeakPolarHBondContact O-CG 3.33Å; E462-R466 PolarHBondContact O-N 3.39Å; E462-R466 IonicContact OE1-CZ 2.81Å; E462-R466 IonicContact OE1-NE 2.94Å; E462-R466 PolarHBondContact OE1-NE 3.19Å; E462-R466 IonicContact OE1-NH2 3.15Å; E462-R466 PolarHBondContact OE1-NH2 3.21Å; E462-R466 VanDerWaalsContact OE1-NH2 3.14Å; R466-K470 WeakPolarHBondContact O-CG 3.2Å; R466-K470 PolarHBondContact O-N 3.3Å; R466-K470 VanDerWaalsContact O-N 3.17Å |
| 467 | N | 83.3 | Confident | 80.4 | Confident | 37 Ų | 37 | 81.1 Ų | 81.1 | 20% | 0.198 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -67.4 | -38.2 | 176.3 | -79.4 | -21 | 0 | 0 | 0 | 112.8 | I463 L464 A465 H471 | I463-N467 WeakPolarHBondContact O-CB 3.39Å; I463-N467 PolarHBondContact O-N 3.45Å; I463-N467 PolarHBondContact O-ND2 3.33Å; L464-N467 PolarHBondContact O-N 3.03Å; A465-N467 VanDerWaalsContact C-N 3.34Å; A465-N467 PolarHBondContact O-N 3.12Å; N467-H471 PolarHBondContact O-CD2 3.22Å; N467-H471 PolarHBondContact O-N 3.25Å; N467-H471 VanDerWaalsContact O-N 3.1Å |
| 468 | N | 81.6 | Confident | 78.7 | Confident | 99 Ų | 99 | 82 Ų | 82 | 53% | 0.529 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -64.8 | -45.5 | 176.5 | -71.5 | -14.5 | 0 | 0 | 0 | 111.7 | L464 A465 K470 H471 E472 | L464-N468 VanDerWaalsContact O-CG 3.24Å; L464-N468 PolarHBondContact O-N 3.32Å; L464-N468 PolarHBondContact O-ND2 3.03Å; A465-N468 PolarHBondContact O-N 3.14Å; N468-K470 PolarHBondContact O-N 2.76Å; N468-H471 WeakPolarHBondContact O-CB 3.45Å; N468-H471 PolarHBondContact O-N 3Å; N468-H471 VanDerWaalsContact O-N 3.08Å; N468-E472 PolarHBondContact O-N 3.27Å |
| 469 | V | 78 | Confident | 76.7 | Confident | 74 Ų | 74 | 86.7 Ų | 86.7 | 45% | 0.448 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -58.7 | -46.4 | 177.1 | 174.6 | 0 | 0 | 0 | 0 | 111.2 | A465 H471 E472 E473 | A465-V469 WeakPolarHBondContact O-CG2 3.41Å; A465-V469 PolarHBondContact O-N 3.5Å; V469-H471 VanDerWaalsContact C-N 3.26Å; V469-H471 PolarHBondContact O-N 2.79Å; V469-E472 PolarHBondContact O-N 3.46Å; V469-E472 VanDerWaalsContact O-N 3.15Å; V469-E473 HydrophobicContact CG1-CG 4.44Å; V469-E473 WeakPolarHBondContact O-CG 3.2Å; V469-E473 PolarHBondContact O-N 3.28Å |
| 470 | K | 71 | Confident | 74.8 | Confident | 69 Ų | 69 | 92.6 Ų | 92.6 | 30% | 0.3 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -60.3 | -35.2 | 175.9 | -71.8 | 179.7 | -176.6 | -178.2 | 0 | 112.7 | E399 R466 N468 T474 | E399-K470 WeakPolarHBondContact OE1-CE 3.49Å; E399-K470 IonicContact OE1-NZ 3.42Å; E399-K470 PolarHBondContact OE1-NZ 2.88Å; R466-K470 WeakPolarHBondContact O-CG 3.2Å; R466-K470 PolarHBondContact O-N 3.3Å; R466-K470 VanDerWaalsContact O-N 3.17Å; N468-K470 PolarHBondContact O-N 2.76Å; K470-T474 WeakPolarHBondContact O-CB 3.3Å; K470-T474 PolarHBondContact O-N 3.43Å; K470-T474 VanDerWaalsContact O-N 3.09Å; K470-T474 PolarHBondContact O-OG1 3.48Å |
| 471 | H | 68.4 | Low | 72.4 | Confident | 144 Ų | 144 | 99.5 Ų | 99.5 | 67% | 0.667 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -67.6 | -41.9 | 175.3 | -92.9 | -66.3 | 0 | 0 | 0 | 112.2 | N467 N468 V469 F475 | N467-H471 PolarHBondContact O-CD2 3.22Å; N467-H471 PolarHBondContact O-N 3.25Å; N467-H471 VanDerWaalsContact O-N 3.1Å; N468-H471 WeakPolarHBondContact O-CB 3.45Å; N468-H471 PolarHBondContact O-N 3Å; N468-H471 VanDerWaalsContact O-N 3.08Å; V469-H471 VanDerWaalsContact C-N 3.26Å; V469-H471 PolarHBondContact O-N 2.79Å; H471-F475 VanDerWaalsContact O-CB 3.3Å; H471-F475 WeakPolarHBondContact O-CB 3.41Å; H471-F475 PolarHBondContact O-N 3.12Å |
| 472 | E | 67.8 | Low | 71.3 | Confident | 128 Ų | 128 | 100.8 Ų | 100.8 | 60% | 0.598 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.7 | -45.1 | 176.8 | -70.3 | 179.1 | 169 | 0 | 0 | 112.3 | N468 V469 T474 F475 H476 | N468-E472 PolarHBondContact O-N 3.27Å; V469-E472 PolarHBondContact O-N 3.46Å; V469-E472 VanDerWaalsContact O-N 3.15Å; E472-T474 PolarHBondContact O-N 2.94Å; E472-F475 PolarHBondContact O-N 3.13Å; E472-H476 WeakPolarHBondContact O-CB 3.27Å; E472-H476 PolarHBondContact O-CD2 3.45Å; E472-H476 PolarHBondContact O-N 3.49Å |
| 473 | E | 68.4 | Low | 70.2 | Confident | 122 Ų | 122 | 102.8 Ų | 102.8 | 57% | 0.57 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -60 | -44.2 | 175.4 | -71.2 | 179 | 161.2 | 0 | 0 | 112.1 | V469 H476 T477 | V469-E473 HydrophobicContact CG1-CG 4.44Å; V469-E473 WeakPolarHBondContact O-CG 3.2Å; V469-E473 PolarHBondContact O-N 3.28Å; E473-H476 PolarHBondContact O-N 3.46Å; E473-T477 PolarHBondContact O-N 3Å; E473-T477 PolarHBondContact O-OG1 2.81Å |
| 474 | T | 65.3 | Low | 69 | Low | 67 Ų | 67 | 107.5 Ų | 107.5 | 41% | 0.411 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.4 | -42.6 | 177.3 | -52.4 | 0 | 0 | 0 | 0 | 110.9 | K470 E472 T477 Y478 | K470-T474 WeakPolarHBondContact O-CB 3.3Å; K470-T474 PolarHBondContact O-N 3.43Å; K470-T474 VanDerWaalsContact O-N 3.09Å; K470-T474 PolarHBondContact O-OG1 3.48Å; E472-T474 PolarHBondContact O-N 2.94Å; T474-T477 PolarHBondContact O-N 2.91Å; T474-Y478 HydrophobicContact CG2-CD2 3.9Å; T474-Y478 HydrophobicContact CG2-CE2 3.47Å; T474-Y478 VanDerWaalsContact CG2-CE2 3.47Å; T474-Y478 WeakPolarHBondContact O-CD2 3.3Å; T474-Y478 PolarHBondContact O-N 3.37Å; T474-Y478 VanDerWaalsContact O-N 3.13Å |
| 475 | F | 60 | Low | 67.6 | Low | 138 Ų | 138 | 107.8 Ų | 107.8 | 61% | 0.605 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -66.4 | -41.1 | 179.4 | -164 | -90.7 | 0 | 0 | 0 | 112.2 | H471 E472 T477 Y478 M479 | H471-F475 VanDerWaalsContact O-CB 3.3Å; H471-F475 WeakPolarHBondContact O-CB 3.41Å; H471-F475 PolarHBondContact O-N 3.12Å; E472-F475 PolarHBondContact O-N 3.13Å; F475-T477 VanDerWaalsContact C-N 3.34Å; F475-T477 PolarHBondContact O-N 3.19Å; F475-Y478 PolarHBondContact O-N 3.13Å; F475-M479 HydrophobicContact CD1-CG 3.98Å; F475-M479 HydrophobicContact CE1-CE 4.23Å; F475-M479 HydrophobicContact CE1-CG 3.83Å; F475-M479 HydrophobicContact CE1-SD 4.05Å; F475-M479 VanDerWaalsContact O-CG 3.23Å; F475-M479 WeakPolarHBondContact O-CG 3.23Å; F475-M479 PolarHBondContact O-N 3.14Å; F475-M479 VanDerWaalsContact O-N 3.14Å |
| 476 | H | 58.4 | Low | 66.2 | Low | 128 Ų | 128 | 111.8 Ų | 111.8 | 59% | 0.593 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.6 | -39.4 | 172.8 | -90.7 | -67.8 | 0 | 0 | 0 | 112.5 | E472 E473 Y478 M479 V480 | E472-H476 WeakPolarHBondContact O-CB 3.27Å; E472-H476 PolarHBondContact O-CD2 3.45Å; E472-H476 PolarHBondContact O-N 3.49Å; E473-H476 PolarHBondContact O-N 3.46Å; H476-Y478 VanDerWaalsContact C-N 3.33Å; H476-Y478 PolarHBondContact O-N 3.17Å; H476-M479 PolarHBondContact O-N 3.45Å; H476-M479 VanDerWaalsContact O-N 3.13Å; H476-V480 VanDerWaalsContact O-CG2 3.31Å; H476-V480 WeakPolarHBondContact O-CG2 3.31Å; H476-V480 PolarHBondContact O-N 3.44Å |
| 477 | T | 60.5 | Low | 64.9 | Low | 85 Ų | 85 | 115.2 Ų | 115.2 | 52% | 0.521 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -61.5 | -41.7 | 176.8 | -54 | 0 | 0 | 0 | 0 | 111.4 | E473 T474 F475 M479 V480 Q481 | E473-T477 PolarHBondContact O-N 3Å; E473-T477 PolarHBondContact O-OG1 2.81Å; T474-T477 PolarHBondContact O-N 2.91Å; F475-T477 VanDerWaalsContact C-N 3.34Å; F475-T477 PolarHBondContact O-N 3.19Å; T477-M479 VanDerWaalsContact C-N 3.3Å; T477-M479 PolarHBondContact O-N 3.49Å; T477-V480 PolarHBondContact O-N 3.34Å; T477-Q481 PolarHBondContact O-N 3.42Å |
| 478 | Y | 59 | Low | 63.6 | Low | 167 Ų | 167 | 120.8 Ų | 120.8 | 66% | 0.655 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -72.6 | -15.4 | 175.4 | -71.9 | -56.1 | 0 | 0 | 0 | 115 | T474 F475 H476 | T474-Y478 HydrophobicContact CG2-CD2 3.9Å; T474-Y478 HydrophobicContact CG2-CE2 3.47Å; T474-Y478 VanDerWaalsContact CG2-CE2 3.47Å; T474-Y478 WeakPolarHBondContact O-CD2 3.3Å; T474-Y478 PolarHBondContact O-N 3.37Å; T474-Y478 VanDerWaalsContact O-N 3.13Å; F475-Y478 PolarHBondContact O-N 3.13Å; H476-Y478 VanDerWaalsContact C-N 3.33Å; H476-Y478 PolarHBondContact O-N 3.17Å |
| 479 | M | 54.1 | Low | 62.2 | Low | 136 Ų | 136 | 122.5 Ų | 122.5 | 67% | 0.67 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -95.4 | -8.1 | 177.8 | -70.7 | -91.3 | -76.6 | 0 | 0 | 113 | F475 H476 T477 | F475-M479 HydrophobicContact CD1-CG 3.98Å; F475-M479 HydrophobicContact CE1-CE 4.23Å; F475-M479 HydrophobicContact CE1-CG 3.83Å; F475-M479 HydrophobicContact CE1-SD 4.05Å; F475-M479 VanDerWaalsContact O-CG 3.23Å; F475-M479 WeakPolarHBondContact O-CG 3.23Å; F475-M479 PolarHBondContact O-N 3.14Å; F475-M479 VanDerWaalsContact O-N 3.14Å; H476-M479 PolarHBondContact O-N 3.45Å; H476-M479 VanDerWaalsContact O-N 3.13Å; T477-M479 VanDerWaalsContact C-N 3.3Å; T477-M479 PolarHBondContact O-N 3.49Å |
| 480 | V | 53.8 | Low | 60.9 | Low | 125 Ų | 125 | 126.5 Ų | 126.5 | 76% | 0.758 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -108.8 | -10.3 | -178.7 | 174 | 0 | 0 | 0 | 0 | 112 | H476 T477 | H476-V480 VanDerWaalsContact O-CG2 3.31Å; H476-V480 WeakPolarHBondContact O-CG2 3.31Å; H476-V480 PolarHBondContact O-N 3.44Å; T477-V480 PolarHBondContact O-N 3.34Å |
| 481 | Q | 43.8 | Very low | 60 | Low | 209 Ų | 209 | 131.7 Ų | 131.7 | 98% | 0.977 | 64% | 0.639 | S | S | * | * | trans | -92.5 | 0 | 165.3 | -70.7 | -169.3 | -47.4 | 0 | 0 | 111.6 | T477 | T477-Q481 PolarHBondContact O-N 3.42Š|
Retrieved 481 of 481 residues in 620.1 ms
(Link to these results)