| 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 | 40.6 | Very low | 45.8 | Very low | 244 Ų | 244 | 138.5 Ų | 138.5 | 100% | 1.202 | 89% | 0.891 | S | S | * | * | 0 | 108.4 | 0 | -69.6 | -161 | 164.9 | 0 | 0 | 108.8 | |||||
| 2 | P | 40.4 | Very low | 46.7 | Very low | 139 Ų | 139 | 137 Ų | 137 | 90% | 0.903 | 88% | 0.881 | S | S | * | * | trans | -105.3 | 124.6 | 170.8 | 32.6 | -20.2 | 0 | 0 | 0 | 110.1 | ||||
| 3 | G | 43 | Very low | 46.9 | Very low | 85 Ų | 85 | 135.8 Ų | 135.8 | 88% | 0.876 | 87% | 0.874 | S | S | * | * | trans | -126.3 | 127.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 4 | G | 46.4 | Very low | 47.1 | Very low | 87 Ų | 87 | 137.9 Ų | 137.9 | 90% | 0.897 | 87% | 0.867 | S | S | * | * | trans | 154.9 | 68.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 5 | A | 45.5 | Very low | 47.6 | Very low | 104 Ų | 104 | 145.8 Ų | 145.8 | 86% | 0.86 | 87% | 0.874 | S | S | * | * | trans | -124.7 | 116.7 | 162.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 6 | S | 48.5 | Very low | 47.6 | Very low | 122 Ų | 122 | 141.4 Ų | 141.4 | 85% | 0.853 | 85% | 0.852 | S | S | * | * | trans | -106.9 | 152.2 | 177.9 | -166.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 7 | L | 48.1 | Very low | 47.4 | Very low | 162 Ų | 162 | 141.3 Ų | 141.3 | 85% | 0.848 | 85% | 0.846 | S | S | * | * | trans | -66 | 151.4 | -156.6 | -79.9 | 63.6 | 0 | 0 | 0 | 117.4 | ||||
| 8 | S | 43.2 | Very low | 47.3 | Very low | 113 Ų | 113 | 146.6 Ų | 146.6 | 79% | 0.79 | 85% | 0.848 | S | S | * | * | trans | -73.9 | -170.4 | 159.2 | -51.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 9 | P | 56.3 | Low | 47.4 | Very low | 126 Ų | 126 | 146.6 Ų | 146.6 | 82% | 0.818 | 84% | 0.843 | S | S | * | * | cis | -138.2 | 168.6 | -8 | 39 | -20.2 | 0 | 0 | 0 | 115.6 | ||||
| 10 | A | 43.4 | Very low | 47.2 | Very low | 102 Ų | 102 | 147.9 Ų | 147.9 | 84% | 0.843 | 84% | 0.841 | S | S | * | * | trans | -162 | 105.4 | 159.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 11 | R | 48.6 | Very low | 46.9 | Very low | 240 Ų | 240 | 146.2 Ų | 146.2 | 91% | 0.906 | 84% | 0.839 | S | S | * | * | trans | 41.7 | 128.7 | 142.9 | -120.7 | -178.4 | -76 | 172.3 | -3.7 | 122.3 | ||||
| 12 | P | 55.9 | Low | 47.1 | Very low | 120 Ų | 120 | 140 Ų | 140 | 78% | 0.779 | 82% | 0.819 | S | S | * | * | trans | -96.5 | 158.5 | 165.6 | 37.5 | -30.1 | 0 | 0 | 0 | 112.5 | ||||
| 13 | P | 49.8 | Very low | 47.6 | Very low | 122 Ų | 122 | 144.2 Ų | 144.2 | 79% | 0.792 | 82% | 0.817 | S | S | * | * | trans | -123.3 | 134 | 156.4 | 32.7 | -18.9 | 0 | 0 | 0 | 114.9 | ||||
| 14 | Q | 50 | Low | 47.4 | Very low | 164 Ų | 164 | 143.4 Ų | 143.4 | 77% | 0.766 | 81% | 0.809 | S | S | * | * | trans | 64.4 | 88.2 | 141.2 | -80.3 | -159.9 | -47.2 | 0 | 0 | 122.7 | S16 | Q14-S16 PolarHBondContact O-N 2.84Å; Q14-S16 VanDerWaalsContact O-N 3.15Å | ||
| 15 | R | 54.4 | Low | 47.2 | Very low | 257 Ų | 257 | 143.6 Ų | 143.6 | 97% | 0.97 | 80% | 0.802 | S | S | * | * | trans | -57.3 | 76.8 | 139.8 | -175.1 | -165.6 | -151.5 | -153.7 | 5.5 | 112.9 | ||||
| 16 | S | 48.1 | Very low | 47.3 | Very low | 75 Ų | 75 | 147.6 Ų | 147.6 | 52% | 0.524 | 80% | 0.802 | S | S | . | * | trans | -151.3 | 3.9 | 172.3 | -152.3 | 0 | 0 | 0 | 0 | 119.6 | Q14 | Q14-S16 PolarHBondContact O-N 2.84Å; Q14-S16 VanDerWaalsContact O-N 3.15Å | ||
| 17 | D | 42.9 | Very low | 47.3 | Very low | 140 Ų | 140 | 153.3 Ų | 153.3 | 75% | 0.749 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -117.7 | -7.6 | -173.5 | -66.4 | -37.4 | 0 | 0 | 0 | 116.5 | ||
| 18 | R | 47 | Very low | 47 | Very low | 237 Ų | 237 | 151.9 Ų | 151.9 | 89% | 0.894 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -94.7 | -11.5 | -172.9 | -148.4 | -175.5 | -83 | -154.1 | -2 | 115.6 | ||
| 19 | I | 48.2 | Very low | 47 | Very low | 147 Ų | 147 | 154.6 Ų | 154.6 | 75% | 0.754 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -96 | -17.5 | -172.3 | -60.7 | -167.1 | 0 | 0 | 0 | 113.4 | ||
| 20 | Q | 43.8 | Very low | 46.1 | Very low | 172 Ų | 172 | 153.4 Ų | 153.4 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | S | Bend | trans | -91.1 | -20.2 | -174.7 | -155.1 | 163.5 | -2 | 0 | 0 | 114.3 | S22 | Q20-S22 VanDerWaalsContact C-N 3.32Å; Q20-S22 PolarHBondContact O-N 3.18Å |
| 21 | S | 41 | Very low | 46 | Very low | 113 Ų | 113 | 154.9 Ų | 154.9 | 79% | 0.79 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | -4.8 | -175.6 | -163.7 | 0 | 0 | 0 | 0 | 115 | ||
| 22 | S | 44 | Very low | 45.9 | Very low | 112 Ų | 112 | 152 Ų | 152 | 78% | 0.783 | 80% | 0.795 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.9 | -0.1 | -177.7 | -161.1 | 0 | 0 | 0 | 0 | 114.8 | Q20 | Q20-S22 VanDerWaalsContact C-N 3.32Å; Q20-S22 PolarHBondContact O-N 3.18Å |
| 23 | R | 51.6 | Low | 44.9 | Very low | 229 Ų | 229 | 150 Ų | 150 | 86% | 0.864 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -108.4 | 1.6 | -176.5 | -76.9 | -175.4 | 172.2 | 163.3 | -1.6 | 114.9 | ||
| 24 | G | 39.5 | Very low | 44.6 | Very low | 68 Ų | 68 | 153 Ų | 153 | 70% | 0.701 | 80% | 0.797 | S | S | * | * | trans | -110.6 | 2.2 | -171 | 0 | 0 | 0 | 0 | 0 | 116.9 | E26 | G24-E26 PolarHBondContact O-N 2.94Š| ||
| 25 | A | 41.1 | Very low | 44.4 | Very low | 90 Ų | 90 | 151 Ų | 151 | 74% | 0.744 | 80% | 0.802 | S | S | * | * | S | Bend | trans | -94.7 | 84.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 26 | E | 47.6 | Very low | 43.8 | Very low | 188 Ų | 188 | 141.8 Ų | 141.8 | 88% | 0.879 | 79% | 0.786 | S | S | * | * | trans | 63.4 | 61.8 | 134.7 | -57.7 | -174 | 117.5 | 0 | 0 | 117.3 | G24 | G24-E26 PolarHBondContact O-N 2.94Š| ||
| 27 | R | 48 | Very low | 43.5 | Very low | 242 Ų | 242 | 142.9 Ų | 142.9 | 91% | 0.913 | 79% | 0.794 | S | S | * | * | trans | -79.5 | 113.9 | 137.6 | -156.8 | -170.5 | -67.3 | -161.2 | 0.4 | 106 | ||||
| 28 | V | 42.5 | Very low | 43.6 | Very low | 133 Ų | 133 | 139.2 Ų | 139.2 | 81% | 0.806 | 79% | 0.79 | S | S | * | * | trans | 156.4 | 103.3 | 147.2 | 164.4 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 29 | M | 44 | Very low | 43.5 | Very low | 170 Ų | 170 | 138.9 Ų | 138.9 | 84% | 0.837 | 79% | 0.788 | S | S | * | * | 75.7 | 123.5 | 129.8 | -147.6 | 77.6 | 174.6 | 0 | 0 | 121.3 | |||||
| 30 | S | 37.6 | Very low | 43.3 | Very low | 100 Ų | 100 | 139 Ų | 139 | 70% | 0.699 | 79% | 0.79 | S | S | * | * | trans | 131.3 | 126.7 | 146.5 | -59.1 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 31 | T | 41.3 | Very low | 43.2 | Very low | 133 Ų | 133 | 139.1 Ų | 139.1 | 82% | 0.816 | 78% | 0.783 | S | S | * | * | cis | -167.9 | 155.1 | 24.5 | -2.9 | 0 | 0 | 0 | 0 | 108.2 | G33 | T31-G33 PolarHBondContact O-N 3.39Š| ||
| 32 | H | 44.9 | Very low | 43.7 | Very low | 180 Ų | 180 | 137.4 Ų | 137.4 | 83% | 0.833 | 77% | 0.771 | S | S | * | * | trans | -33.6 | 116.2 | 172.7 | -90.3 | -117.8 | 0 | 0 | 0 | 115.5 | ||||
| 33 | G | 35.8 | Very low | 44.1 | Very low | 78 Ų | 78 | 135.6 Ų | 135.6 | 80% | 0.804 | 76% | 0.758 | S | S | * | * | trans | -106.8 | 75.8 | 155.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | T31 S35 | T31-G33 PolarHBondContact O-N 3.39Å; G33-S35 VanDerWaalsContact C-N 3.26Å; G33-S35 PolarHBondContact O-N 3.32Å | ||
| 34 | F | 42.4 | Very low | 43.8 | Very low | 184 Ų | 184 | 135.4 Ų | 135.4 | 81% | 0.807 | 76% | 0.757 | S | S | * | * | trans | -73.2 | 81.1 | 172.3 | -166.9 | -91.9 | 0 | 0 | 0 | 108.7 | ||||
| 35 | S | 46.7 | Very low | 44.3 | Very low | 123 Ų | 123 | 135.8 Ų | 135.8 | 86% | 0.86 | 74% | 0.743 | S | S | * | * | trans | -156.4 | 81.6 | 168.5 | -156.2 | 0 | 0 | 0 | 0 | 110.5 | G33 | G33-S35 VanDerWaalsContact C-N 3.26Å; G33-S35 PolarHBondContact O-N 3.32Å | ||
| 36 | G | 41.4 | Very low | 45 | Very low | 63 Ų | 63 | 133.7 Ų | 133.7 | 65% | 0.649 | 72% | 0.721 | S | S | * | * | trans | -170.1 | 2.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | G38 | G36-G38 PolarHBondContact O-N 2.77Š| ||
| 37 | S | 42.7 | Very low | 45.3 | Very low | 98 Ų | 98 | 128.5 Ų | 128.5 | 69% | 0.685 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.8 | 38.6 | -176.7 | -169.9 | 0 | 0 | 0 | 0 | 113.2 | ||
| 38 | G | 44.4 | Very low | 45.6 | Very low | 64 Ų | 64 | 126.2 Ų | 126.2 | 66% | 0.66 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.1 | -21.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | G36 | G36-G38 PolarHBondContact O-N 2.77Š|
| 39 | R | 45.2 | Very low | 46.3 | Very low | 229 Ų | 229 | 124.1 Ų | 124.1 | 86% | 0.864 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -114.1 | -11.5 | -170.2 | -82.8 | -172.3 | -84.8 | -126.2 | -0.6 | 116 | ||
| 40 | L | 44.2 | Very low | 46.8 | Very low | 149 Ų | 149 | 119.9 Ų | 119.9 | 78% | 0.78 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -95.3 | -5.6 | 177.4 | -105.2 | 85.3 | 0 | 0 | 0 | 114.5 | ||
| 41 | R | 41.9 | Very low | 47.8 | Very low | 176 Ų | 176 | 117.8 Ų | 117.8 | 66% | 0.664 | 64% | 0.644 | S | S | * | * | S | Bend | trans | -93.4 | -6.2 | -177 | -153.6 | 174.5 | 76.3 | -137.6 | 1.9 | 113.6 | L45 | R41-L45 HydrophobicContact CG-CD1 3.61Å; R41-L45 WeakPolarHBondContact O-CD1 3.39Å |
| 42 | S | 51.9 | Low | 49.1 | Very low | 76 Ų | 76 | 115.3 Ų | 115.3 | 53% | 0.531 | 63% | 0.629 | S | S | . | * | S | Bend | trans | -87.5 | -26.2 | 178.9 | 50.8 | 0 | 0 | 0 | 0 | 113.4 | T46 | S42-T46 WeakPolarHBondContact O-CG2 3.46Å; S42-T46 PolarHBondContact O-N 2.77Å; S42-T46 PolarHBondContact O-OG1 3.11Å |
| 43 | S | 51.3 | Low | 50.1 | Low | 74 Ų | 74 | 110.3 Ų | 110.3 | 52% | 0.517 | 61% | 0.605 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78.4 | -22.1 | -173 | 55.3 | 0 | 0 | 0 | 0 | 115 | T46 | S43-T46 PolarHBondContact O-OG1 3.09Š|
| 44 | W | 44.9 | Very low | 51.5 | Low | 225 Ų | 225 | 110.2 Ų | 110.2 | 85% | 0.852 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.9 | -12.4 | 176.8 | -81.3 | 69.5 | 0 | 0 | 0 | 113.8 | ||
| 45 | L | 49.9 | Very low | 53 | Low | 76 Ų | 76 | 106.3 Ų | 106.3 | 40% | 0.398 | 58% | 0.584 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -93.7 | -17.8 | 179.8 | -95.6 | 142 | 0 | 0 | 0 | 113.7 | R41 W48 L49 | R41-L45 HydrophobicContact CG-CD1 3.61Å; R41-L45 WeakPolarHBondContact O-CD1 3.39Å; L45-W48 PolarHBondContact O-N 2.96Å; L45-L49 HydrophobicContact CB-CD1 4.42Å; L45-L49 WeakPolarHBondContact O-CB 3.42Å; L45-L49 PolarHBondContact O-N 3.45Å |
| 46 | T | 55.7 | Low | 54.4 | Low | 47 Ų | 47 | 105.4 Ų | 105.4 | 29% | 0.288 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -56.1 | -44.4 | 175.5 | 32.9 | 0 | 0 | 0 | 0 | 114.5 | S42 S43 W48 K50 | S42-T46 WeakPolarHBondContact O-CG2 3.46Å; S42-T46 PolarHBondContact O-N 2.77Å; S42-T46 PolarHBondContact O-OG1 3.11Å; S43-T46 PolarHBondContact O-OG1 3.09Å; T46-W48 VanDerWaalsContact C-N 3.31Å; T46-W48 PolarHBondContact O-N 3.25Å; T46-K50 WeakPolarHBondContact O-CB 3.39Å; T46-K50 VanDerWaalsContact O-CG 3.31Å; T46-K50 WeakPolarHBondContact O-CG 3.49Å; T46-K50 PolarHBondContact O-N 3.38Å |
| 47 | P | 55.5 | Low | 55.8 | Low | 78 Ų | 78 | 103.4 Ų | 103.4 | 51% | 0.506 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -68.4 | -31.2 | 176.4 | 24.5 | -32.5 | 0 | 0 | 0 | 112.6 | K50 A51 | P47-K50 PolarHBondContact O-N 2.77Å; P47-A51 PolarHBondContact O-N 3.5Å; P47-A51 VanDerWaalsContact O-N 3.07Å |
| 48 | W | 54.1 | Low | 57.1 | Low | 194 Ų | 194 | 102.2 Ų | 102.2 | 74% | 0.735 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -71.6 | -47.9 | 175.6 | -98.9 | 73.7 | 0 | 0 | 0 | 111.8 | L45 T46 K50 A51 T52 | L45-W48 PolarHBondContact O-N 2.96Å; T46-W48 VanDerWaalsContact C-N 3.31Å; T46-W48 PolarHBondContact O-N 3.25Å; W48-K50 PolarHBondContact O-N 2.72Å; W48-A51 PolarHBondContact O-N 2.74Å; W48-A51 VanDerWaalsContact O-N 3.08Å; W48-T52 PolarHBondContact O-N 2.76Å; W48-T52 PolarHBondContact O-OG1 2.75Å |
| 49 | L | 56.1 | Low | 58.8 | Low | 90 Ų | 90 | 101.7 Ų | 101.7 | 47% | 0.471 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -54.7 | -39.2 | 171.5 | -84.3 | 155.8 | 0 | 0 | 0 | 110.9 | L45 T52 F53 | L45-L49 HydrophobicContact CB-CD1 4.42Å; L45-L49 WeakPolarHBondContact O-CB 3.42Å; L45-L49 PolarHBondContact O-N 3.45Å; L49-T52 PolarHBondContact O-N 3.44Å; L49-F53 WeakPolarHBondContact O-CB 3.26Å; L49-F53 PolarHBondContact O-N 3.39Å |
| 50 | K | 54.8 | Low | 60.3 | Low | 80 Ų | 80 | 95.1 Ų | 95.1 | 35% | 0.348 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.8 | -48.6 | 175.2 | -78.9 | -177.4 | 97.7 | 163.5 | 0 | 112.6 | T46 P47 W48 S54 W116 Q120 | T46-K50 WeakPolarHBondContact O-CB 3.39Å; T46-K50 VanDerWaalsContact O-CG 3.31Å; T46-K50 WeakPolarHBondContact O-CG 3.49Å; T46-K50 PolarHBondContact O-N 3.38Å; P47-K50 PolarHBondContact O-N 2.77Å; W48-K50 PolarHBondContact O-N 2.72Å; K50-S54 WeakPolarHBondContact O-CB 3.07Å; K50-S54 PolarHBondContact O-N 3.21Å; K50-W116 HydrophobicContact CB-CH2 3.29Å; K50-W116 HydrophobicContact CB-CZ2 4.08Å; K50-W116 HydrophobicContact CB-CZ3 3.9Å; K50-W116 HydrophobicContact CD-CH2 4.17Å; K50-W116 HydrophobicContact CD-CZ2 4.13Å; K50-W116 HydrophobicContact CG-CH2 3.31Å; K50-W116 HydrophobicContact CG-CZ2 3.72Å; K50-W116 HydrophobicContact CG-CZ3 3.85Å; K50-W116 WeakPolarHBondContact O-CH2 3.23Å; K50-W116 WeakPolarHBondContact O-CZ3 3.4Å; K50-Q120 VanDerWaalsContact CE-CD 3.43Å; K50-Q120 VanDerWaalsContact NZ-CD 3.33Å |
| 51 | A | 59 | Low | 61.8 | Low | 56 Ų | 56 | 89.8 Ų | 89.8 | 46% | 0.463 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.4 | -45.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112 | P47 W48 F53 S54 V55 | P47-A51 PolarHBondContact O-N 3.5Å; P47-A51 VanDerWaalsContact O-N 3.07Å; W48-A51 PolarHBondContact O-N 2.74Å; W48-A51 VanDerWaalsContact O-N 3.08Å; A51-F53 PolarHBondContact O-N 2.79Å; A51-S54 PolarHBondContact O-N 2.79Å; A51-V55 VanDerWaalsContact O-CG2 3.31Å; A51-V55 WeakPolarHBondContact O-CG2 3.28Å; A51-V55 PolarHBondContact O-N 2.9Å |
| 52 | T | 68.4 | Low | 63.6 | Low | 81 Ų | 81 | 88 Ų | 88 | 50% | 0.497 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.8 | -40.4 | -177.9 | -37.7 | 0 | 0 | 0 | 0 | 111.9 | W48 L49 L56 | W48-T52 PolarHBondContact O-N 2.76Å; W48-T52 PolarHBondContact O-OG1 2.75Å; L49-T52 PolarHBondContact O-N 3.44Å; T52-L56 WeakPolarHBondContact O-CB 2.85Å; T52-L56 PolarHBondContact O-N 3.31Å |
| 53 | F | 66.7 | Low | 65 | Low | 75 Ų | 75 | 92.1 Ų | 92.1 | 33% | 0.329 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -70 | -35.1 | 176 | -119.9 | -95.3 | 0 | 0 | 0 | 112.5 | L49 A51 G57 W116 | L49-F53 WeakPolarHBondContact O-CB 3.26Å; L49-F53 PolarHBondContact O-N 3.39Å; A51-F53 PolarHBondContact O-N 2.79Å; F53-G57 PolarHBondContact O-N 2.81Å; F53-W116 HydrophobicContact CB-CE3 3.75Å; F53-W116 HydrophobicContact CB-CZ3 3.56Å; F53-W116 HydrophobicContact CD1-CE3 4.42Å; F53-W116 HydrophobicContact CG-CE3 4.31Å |
| 54 | S | 64.1 | Low | 66.2 | Low | 77 Ų | 77 | 90.5 Ų | 90.5 | 54% | 0.538 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -67.4 | -43 | 175.7 | -179.5 | 0 | 0 | 0 | 0 | 111.7 | K50 A51 S58 | K50-S54 WeakPolarHBondContact O-CB 3.07Å; K50-S54 PolarHBondContact O-N 3.21Å; A51-S54 PolarHBondContact O-N 2.79Å; S54-S58 WeakPolarHBondContact O-CB 3.43Å; S54-S58 PolarHBondContact O-N 3.39Å |
| 55 | V | 74.9 | Confident | 67.7 | Low | 102 Ų | 102 | 83.8 Ų | 83.8 | 62% | 0.618 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -65.2 | -43.7 | 174.8 | 172.3 | 0 | 0 | 0 | 0 | 110.7 | A51 S58 A59 | A51-V55 VanDerWaalsContact O-CG2 3.31Å; A51-V55 WeakPolarHBondContact O-CG2 3.28Å; A51-V55 PolarHBondContact O-N 2.9Å; V55-S58 PolarHBondContact O-N 3.45Å; V55-A59 VanDerWaalsContact O-CB 3.28Å; V55-A59 WeakPolarHBondContact O-CB 3.43Å; V55-A59 PolarHBondContact O-N 2.65Å |
| 56 | L | 74.3 | Confident | 69.2 | Low | 103 Ų | 103 | 82 Ų | 82 | 54% | 0.539 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -66 | -42.2 | 178.7 | -167 | 66.4 | 0 | 0 | 0 | 111.5 | T52 A59 V60 | T52-L56 WeakPolarHBondContact O-CB 2.85Å; T52-L56 PolarHBondContact O-N 3.31Å; L56-A59 PolarHBondContact O-N 2.73Å; L56-V60 WeakPolarHBondContact O-CB 3.29Å; L56-V60 VanDerWaalsContact O-CG2 3.23Å; L56-V60 WeakPolarHBondContact O-CG2 3.16Å; L56-V60 PolarHBondContact O-N 2.84Å |
| 57 | G | 71.3 | Confident | 70.2 | Confident | 22 Ų | 22 | 81.6 Ų | 81.6 | 23% | 0.227 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -62.9 | -42.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | F53 A61 | F53-G57 PolarHBondContact O-N 2.81Å; G57-A61 VanDerWaalsContact O-CB 3.25Å; G57-A61 WeakPolarHBondContact O-CB 3.09Å; G57-A61 PolarHBondContact O-N 3.48Å |
| 58 | S | 71 | Confident | 71.1 | Confident | 72 Ų | 72 | 79.9 Ų | 79.9 | 50% | 0.503 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -66.7 | -40.3 | 175 | -177.3 | 0 | 0 | 0 | 0 | 112.2 | S54 V55 A61 M62 | S54-S58 WeakPolarHBondContact O-CB 3.43Å; S54-S58 PolarHBondContact O-N 3.39Å; V55-S58 PolarHBondContact O-N 3.45Å; S58-A61 PolarHBondContact O-N 3.32Å; S58-M62 WeakPolarHBondContact O-CB 3.2Å; S58-M62 WeakPolarHBondContact O-CG 3.41Å; S58-M62 PolarHBondContact O-N 3.3Å |
| 59 | A | 78.9 | Confident | 71.9 | Confident | 53 Ų | 53 | 74 Ų | 74 | 44% | 0.438 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -64.8 | -44 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | V55 L56 M62 F63 | V55-A59 VanDerWaalsContact O-CB 3.28Å; V55-A59 WeakPolarHBondContact O-CB 3.43Å; V55-A59 PolarHBondContact O-N 2.65Å; L56-A59 PolarHBondContact O-N 2.73Å; A59-M62 PolarHBondContact O-N 3.48Å; A59-F63 WeakPolarHBondContact O-CB 3.34Å; A59-F63 PolarHBondContact O-N 2.81Å |
| 60 | V | 78 | Confident | 73 | Confident | 91 Ų | 91 | 72.8 Ų | 72.8 | 55% | 0.552 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -65.2 | -41.4 | 175.5 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | L56 F63 A64 | L56-V60 WeakPolarHBondContact O-CB 3.29Å; L56-V60 VanDerWaalsContact O-CG2 3.23Å; L56-V60 WeakPolarHBondContact O-CG2 3.16Å; L56-V60 PolarHBondContact O-N 2.84Å; V60-F63 PolarHBondContact O-N 3.38Å; V60-A64 VanDerWaalsContact O-CB 3.22Å; V60-A64 WeakPolarHBondContact O-CB 3.18Å; V60-A64 PolarHBondContact O-N 2.78Å |
| 61 | A | 75.4 | Confident | 73.8 | Confident | 38 Ų | 38 | 73.2 Ų | 73.2 | 31% | 0.314 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.6 | -46.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | G57 S58 F63 A64 V65 | G57-A61 VanDerWaalsContact O-CB 3.25Å; G57-A61 WeakPolarHBondContact O-CB 3.09Å; G57-A61 PolarHBondContact O-N 3.48Å; S58-A61 PolarHBondContact O-N 3.32Å; A61-F63 VanDerWaalsContact C-N 3.32Å; A61-F63 PolarHBondContact O-N 3.45Å; A61-A64 PolarHBondContact O-N 3.33Å; A61-V65 VanDerWaalsContact O-CB 3.31Å; A61-V65 WeakPolarHBondContact O-CB 3.48Å; A61-V65 WeakPolarHBondContact O-CG2 3.36Å; A61-V65 PolarHBondContact O-N 3.37Å |
| 62 | M | 79.6 | Confident | 74.5 | Confident | 138 Ų | 138 | 71.2 Ų | 71.2 | 68% | 0.68 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -64.2 | -37 | 176.2 | -78 | -69 | -129.3 | 0 | 0 | 112.1 | S58 A59 G66 | S58-M62 WeakPolarHBondContact O-CB 3.2Å; S58-M62 WeakPolarHBondContact O-CG 3.41Å; S58-M62 PolarHBondContact O-N 3.3Å; A59-M62 PolarHBondContact O-N 3.48Å; M62-G66 WeakPolarHBondContact O-CA 3.34Å; M62-G66 PolarHBondContact O-N 3.39Å |
| 63 | F | 80.5 | Confident | 74.6 | Confident | 162 Ų | 162 | 75.3 Ų | 75.3 | 71% | 0.711 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -69 | -43.6 | 175.6 | -172.7 | -98.5 | 0 | 0 | 0 | 111.4 | A59 V60 A61 G66 A67 | A59-F63 WeakPolarHBondContact O-CB 3.34Å; A59-F63 PolarHBondContact O-N 2.81Å; V60-F63 PolarHBondContact O-N 3.38Å; A61-F63 VanDerWaalsContact C-N 3.32Å; A61-F63 PolarHBondContact O-N 3.45Å; F63-G66 PolarHBondContact O-N 3.44Å; F63-A67 WeakPolarHBondContact O-CB 2.95Å; F63-A67 PolarHBondContact O-N 2.82Å |
| 64 | A | 76.2 | Confident | 74.9 | Confident | 41 Ų | 41 | 74.5 Ų | 74.5 | 34% | 0.339 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -63.1 | -46.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | V60 A61 F68 | V60-A64 VanDerWaalsContact O-CB 3.22Å; V60-A64 WeakPolarHBondContact O-CB 3.18Å; V60-A64 PolarHBondContact O-N 2.78Å; A61-A64 PolarHBondContact O-N 3.33Å; A64-F68 WeakPolarHBondContact O-CA 3.43Å; A64-F68 WeakPolarHBondContact O-CB 3.3Å; A64-F68 PolarHBondContact O-N 3.42Å |
| 65 | V | 77.6 | Confident | 75.2 | Confident | 83 Ų | 83 | 72.4 Ų | 72.4 | 50% | 0.503 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -64.8 | -42.7 | 176.1 | 170.6 | 0 | 0 | 0 | 0 | 111.2 | A61 F68 C69 | A61-V65 VanDerWaalsContact O-CB 3.31Å; A61-V65 WeakPolarHBondContact O-CB 3.48Å; A61-V65 WeakPolarHBondContact O-CG2 3.36Å; A61-V65 PolarHBondContact O-N 3.37Å; V65-F68 PolarHBondContact O-N 2.82Å; V65-C69 WeakPolarHBondContact O-CB 3.43Å; V65-C69 PolarHBondContact O-N 2.81Å |
| 66 | G | 81.4 | Confident | 74.7 | Confident | 39 Ų | 39 | 71.9 Ų | 71.9 | 40% | 0.402 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -67.2 | -47.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | M62 F63 F68 C69 A70 | M62-G66 WeakPolarHBondContact O-CA 3.34Å; M62-G66 PolarHBondContact O-N 3.39Å; F63-G66 PolarHBondContact O-N 3.44Å; G66-F68 VanDerWaalsContact C-N 3.3Å; G66-F68 PolarHBondContact O-N 2.77Å; G66-C69 PolarHBondContact O-N 2.96Å; G66-A70 VanDerWaalsContact O-CB 3.3Å; G66-A70 WeakPolarHBondContact O-CB 3.09Å; G66-A70 PolarHBondContact O-N 3.41Å |
| 67 | A | 75.4 | Confident | 74.3 | Confident | 38 Ų | 38 | 74.9 Ų | 74.9 | 31% | 0.314 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61 | -43.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | F63 A70 L71 | F63-A67 WeakPolarHBondContact O-CB 2.95Å; F63-A67 PolarHBondContact O-N 2.82Å; A67-A70 PolarHBondContact O-N 3.43Å; A67-L71 WeakPolarHBondContact O-CB 3.15Å; A67-L71 VanDerWaalsContact O-CG 3.24Å; A67-L71 WeakPolarHBondContact O-CG 2.94Å; A67-L71 PolarHBondContact O-N 3.28Å |
| 68 | F | 74.9 | Confident | 74.2 | Confident | 42 Ų | 42 | 79.2 Ų | 79.2 | 18% | 0.184 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -62 | -47 | 174.9 | 171.9 | -101.5 | 0 | 0 | 0 | 112.2 | A64 V65 G66 A70 L71 T72 W98 L101 M102 | A64-F68 WeakPolarHBondContact O-CA 3.43Å; A64-F68 WeakPolarHBondContact O-CB 3.3Å; A64-F68 PolarHBondContact O-N 3.42Å; V65-F68 PolarHBondContact O-N 2.82Å; G66-F68 VanDerWaalsContact C-N 3.3Å; G66-F68 PolarHBondContact O-N 2.77Å; F68-A70 VanDerWaalsContact C-N 3.32Å; F68-A70 PolarHBondContact O-N 2.93Å; F68-L71 PolarHBondContact O-N 3.47Å; F68-T72 VanDerWaalsContact CE2-OG1 3.32Å; F68-T72 WeakPolarHBondContact CE2-OG1 3.32Å; F68-T72 VanDerWaalsContact CZ-OG1 3.32Å; F68-T72 WeakPolarHBondContact CZ-OG1 3.32Å; F68-T72 WeakPolarHBondContact O-CB 3.44Å; F68-T72 PolarHBondContact O-N 3.47Å; F68-T72 PolarHBondContact O-OG1 2.9Å; F68-W98 HydrophobicContact CE1-CH2 4.08Å; F68-W98 AromaticContact CE2-CD2 3.85Å; F68-W98 HydrophobicContact CE2-CD2 3.85Å; F68-W98 AromaticContact CE2-CE2 3.64Å; F68-W98 AromaticContact CE2-CE3 3.71Å; F68-W98 HydrophobicContact CE2-CE3 3.71Å; F68-W98 AromaticContact CE2-CH2 3.38Å; F68-W98 HydrophobicContact CE2-CH2 3.38Å; F68-W98 AromaticContact CE2-CZ2 3.44Å; F68-W98 HydrophobicContact CE2-CZ2 3.44Å; F68-W98 VanDerWaalsContact CE2-CZ2 3.44Å; F68-W98 AromaticContact CE2-CZ3 3.46Å; F68-W98 HydrophobicContact CE2-CZ3 3.46Å; F68-W98 VanDerWaalsContact CE2-CZ3 3.46Å; F68-W98 HydrophobicContact CZ-CD2 4.46Å; F68-W98 HydrophobicContact CZ-CE3 4.01Å; F68-W98 AromaticContact CZ-CH2 2.99Å; F68-W98 HydrophobicContact CZ-CH2 2.99Å; F68-W98 AromaticContact CZ-CZ2 3.47Å; F68-W98 HydrophobicContact CZ-CZ2 3.47Å; F68-W98 VanDerWaalsContact CZ-CZ2 3.47Å; F68-W98 AromaticContact CZ-CZ3 3.26Å; F68-W98 HydrophobicContact CZ-CZ3 3.26Å; F68-L101 HydrophobicContact CD2-CD2 3.78Å; F68-L101 HydrophobicContact CE2-CD2 4.49Å; F68-M102 HydrophobicContact CD1-CE 4.24Å; F68-M102 HydrophobicContact CD2-CE 3.83Å; F68-M102 HydrophobicContact CE1-CE 3.6Å; F68-M102 HydrophobicContact CE2-CE 3.11Å; F68-M102 HydrophobicContact CG-CE 4.3Å; F68-M102 HydrophobicContact CZ-CE 2.93Å |
| 69 | C | 72.2 | Confident | 73.9 | Confident | 70 Ų | 70 | 78.1 Ų | 78.1 | 47% | 0.473 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61 | -42 | 175 | -86.3 | 0 | 0 | 0 | 0 | 111.3 | V65 G66 L71 T72 Y73 | V65-C69 WeakPolarHBondContact O-CB 3.43Å; V65-C69 PolarHBondContact O-N 2.81Å; G66-C69 PolarHBondContact O-N 2.96Å; C69-L71 VanDerWaalsContact C-N 3.27Å; C69-L71 PolarHBondContact O-N 3.36Å; C69-T72 PolarHBondContact O-N 3.26Å; C69-Y73 WeakPolarHBondContact O-CB 3.11Å; C69-Y73 PolarHBondContact O-N 3.31Å |
| 70 | A | 79 | Confident | 73.2 | Confident | 66 Ų | 66 | 84.1 Ų | 84.1 | 55% | 0.545 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -66.7 | -27.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113 | G66 A67 F68 P74 | G66-A70 VanDerWaalsContact O-CB 3.3Å; G66-A70 WeakPolarHBondContact O-CB 3.09Å; G66-A70 PolarHBondContact O-N 3.41Å; A67-A70 PolarHBondContact O-N 3.43Å; F68-A70 VanDerWaalsContact C-N 3.32Å; F68-A70 PolarHBondContact O-N 2.93Å; A70-P74 WeakPolarHBondContact O-CD 3.35Å; A70-P74 WeakPolarHBondContact O-CG 3.12Å |
| 71 | L | 71.2 | Confident | 72.3 | Confident | 89 Ų | 89 | 82.5 Ų | 82.5 | 47% | 0.466 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -84.1 | -42.6 | 172.8 | -69 | 170.3 | 0 | 0 | 0 | 111.3 | A67 F68 C69 Y73 P74 I75 L101 | A67-L71 WeakPolarHBondContact O-CB 3.15Å; A67-L71 VanDerWaalsContact O-CG 3.24Å; A67-L71 WeakPolarHBondContact O-CG 2.94Å; A67-L71 PolarHBondContact O-N 3.28Å; F68-L71 PolarHBondContact O-N 3.47Å; C69-L71 VanDerWaalsContact C-N 3.27Å; C69-L71 PolarHBondContact O-N 3.36Å; L71-Y73 PolarHBondContact O-N 2.81Å; L71-P74 VanDerWaalsContact O-CD 3.28Å; L71-P74 WeakPolarHBondContact O-CD 3.33Å; L71-P74 VanDerWaalsContact O-CG 3.29Å; L71-P74 WeakPolarHBondContact O-CG 3.24Å; L71-I75 WeakPolarHBondContact O-CB 2.99Å; L71-I75 WeakPolarHBondContact O-CD1 3.37Å; L71-I75 WeakPolarHBondContact O-CG1 3.41Å; L71-I75 PolarHBondContact O-N 2.83Å; L71-L101 HydrophobicContact CD1-CD1 4.29Å |
| 72 | T | 73.1 | Confident | 71.5 | Confident | 14 Ų | 14 | 83.6 Ų | 83.6 | 9% | 0.086 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -65.2 | -38.6 | 179.3 | -59.7 | 0 | 0 | 0 | 0 | 112.6 | F68 C69 I75 L76 W98 | F68-T72 VanDerWaalsContact CE2-OG1 3.32Å; F68-T72 WeakPolarHBondContact CE2-OG1 3.32Å; F68-T72 VanDerWaalsContact CZ-OG1 3.32Å; F68-T72 WeakPolarHBondContact CZ-OG1 3.32Å; F68-T72 WeakPolarHBondContact O-CB 3.44Å; F68-T72 PolarHBondContact O-N 3.47Å; F68-T72 PolarHBondContact O-OG1 2.9Å; C69-T72 PolarHBondContact O-N 3.26Å; T72-I75 PolarHBondContact O-N 2.9Å; T72-L76 HydrophobicContact CG2-CD1 3.46Å; T72-L76 VanDerWaalsContact CG2-CD1 3.46Å; T72-L76 HydrophobicContact CG2-CG 3.94Å; T72-L76 WeakPolarHBondContact O-CB 3.49Å; T72-L76 WeakPolarHBondContact O-CG 3.38Å; T72-L76 PolarHBondContact O-N 2.87Å; T72-W98 HydrophobicContact CG2-CH2 3.86Å; T72-W98 HydrophobicContact CG2-CZ2 3.38Å; T72-W98 WeakPolarHBondContact OG1-CZ2 3.44Å |
| 73 | Y | 70.1 | Confident | 70.2 | Confident | 166 Ų | 166 | 87.2 Ų | 87.2 | 65% | 0.651 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -63 | -50.7 | -176.3 | -172.1 | -93.4 | 0 | 0 | 0 | 113.6 | C69 L71 I75 R77 | C69-Y73 WeakPolarHBondContact O-CB 3.11Å; C69-Y73 PolarHBondContact O-N 3.31Å; L71-Y73 PolarHBondContact O-N 2.81Å; Y73-I75 VanDerWaalsContact C-N 3.31Å; Y73-R77 WeakPolarHBondContact O-CB 3.28Å; Y73-R77 PolarHBondContact O-N 2.87Å; Y73-R77 VanDerWaalsContact O-N 3.09Å |
| 74 | P | 74.6 | Confident | 69 | Low | 58 Ų | 58 | 87 Ų | 87 | 38% | 0.377 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -64.9 | -37.2 | 172.5 | 23.7 | -31 | 0 | 0 | 0 | 111 | A70 L71 R77 E78 | A70-P74 WeakPolarHBondContact O-CD 3.35Å; A70-P74 WeakPolarHBondContact O-CG 3.12Å; L71-P74 VanDerWaalsContact O-CD 3.28Å; L71-P74 WeakPolarHBondContact O-CD 3.33Å; L71-P74 VanDerWaalsContact O-CG 3.29Å; L71-P74 WeakPolarHBondContact O-CG 3.24Å; P74-R77 CarbonylContact O-C 3.47Å; P74-R77 WeakPolarHBondContact O-CB 3.19Å; P74-R77 PolarHBondContact O-N 2.89Å; P74-R77 VanDerWaalsContact O-N 3.11Å; P74-E78 WeakPolarHBondContact O-CB 3.44Å; P74-E78 PolarHBondContact O-N 3.37Å |
| 75 | I | 69.1 | Low | 68.1 | Low | 33 Ų | 33 | 94 Ų | 94 | 17% | 0.169 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -64.1 | -46.2 | 179.5 | -67.3 | 173.2 | 0 | 0 | 0 | 112.3 | L71 T72 Y73 R77 E78 L79 M94 | L71-I75 WeakPolarHBondContact O-CB 2.99Å; L71-I75 WeakPolarHBondContact O-CD1 3.37Å; L71-I75 WeakPolarHBondContact O-CG1 3.41Å; L71-I75 PolarHBondContact O-N 2.83Å; T72-I75 PolarHBondContact O-N 2.9Å; Y73-I75 VanDerWaalsContact C-N 3.31Å; I75-R77 PolarHBondContact O-N 2.99Å; I75-E78 PolarHBondContact O-N 3Å; I75-L79 HydrophobicContact CG2-CD1 3.57Å; I75-L79 HydrophobicContact CG2-CG 4.46Å; I75-L79 WeakPolarHBondContact O-CB 3.19Å; I75-L79 WeakPolarHBondContact O-CD1 2.98Å; I75-L79 WeakPolarHBondContact O-CG 3.31Å; I75-L79 PolarHBondContact O-N 3.37Å; I75-M94 HydrophobicContact CB-CE 3.8Å; I75-M94 HydrophobicContact CB-SD 4.48Å; I75-M94 HydrophobicContact CD1-CE 3.79Å; I75-M94 HydrophobicContact CG1-CE 3.35Å; I75-M94 HydrophobicContact CG2-CE 3.38Å; I75-M94 HydrophobicContact CG2-CG 4.32Å; I75-M94 HydrophobicContact CG2-SD 3.44Å; I75-M94 WeakPolarHBondContact CG2-SD 3.46Å |
| 76 | L | 65.4 | Low | 67 | Low | 91 Ų | 91 | 93 Ų | 93 | 48% | 0.476 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -65.6 | -28.7 | 173.8 | -77.6 | 170.3 | 0 | 0 | 0 | 111.9 | T72 R80 | T72-L76 HydrophobicContact CG2-CD1 3.46Å; T72-L76 VanDerWaalsContact CG2-CD1 3.46Å; T72-L76 HydrophobicContact CG2-CG 3.94Å; T72-L76 WeakPolarHBondContact O-CB 3.49Å; T72-L76 WeakPolarHBondContact O-CG 3.38Å; T72-L76 PolarHBondContact O-N 2.87Å; L76-R80 WeakPolarHBondContact O-CB 3.46Å; L76-R80 PolarHBondContact O-N 3.35Å |
| 77 | R | 66.4 | Low | 65.9 | Low | 167 Ų | 167 | 98.2 Ų | 98.2 | 63% | 0.63 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -77.8 | -40.5 | -179.8 | -163.3 | 169.4 | 173.5 | -92 | -1.9 | 110.6 | Y73 P74 I75 A81 | Y73-R77 WeakPolarHBondContact O-CB 3.28Å; Y73-R77 PolarHBondContact O-N 2.87Å; Y73-R77 VanDerWaalsContact O-N 3.09Å; P74-R77 CarbonylContact O-C 3.47Å; P74-R77 WeakPolarHBondContact O-CB 3.19Å; P74-R77 PolarHBondContact O-N 2.89Å; P74-R77 VanDerWaalsContact O-N 3.11Å; I75-R77 PolarHBondContact O-N 2.99Å; R77-A81 WeakPolarHBondContact O-CB 3.45Å; R77-A81 PolarHBondContact O-N 3.41Å |
| 78 | E | 69.1 | Low | 65.2 | Low | 113 Ų | 113 | 102.9 Ų | 102.9 | 53% | 0.528 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.7 | -53.4 | 169.9 | -127.9 | 73.1 | -165.8 | 0 | 0 | 110.2 | P74 I75 R80 A81 E82 | P74-E78 WeakPolarHBondContact O-CB 3.44Å; P74-E78 PolarHBondContact O-N 3.37Å; I75-E78 PolarHBondContact O-N 3Å; E78-R80 VanDerWaalsContact C-N 3.29Å; E78-R80 PolarHBondContact O-N 3.46Å; E78-A81 CarbonylContact O-C 3.27Å; E78-A81 WeakPolarHBondContact O-CA 3.33Å; E78-A81 WeakPolarHBondContact O-CB 3.31Å; E78-A81 PolarHBondContact O-N 3.35Å; E78-E82 WeakPolarHBondContact O-CB 3.42Å; E78-E82 PolarHBondContact O-N 3.21Å |
| 79 | L | 63.5 | Low | 64.4 | Low | 49 Ų | 49 | 103.1 Ų | 103.1 | 26% | 0.257 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -58.3 | -37.3 | 177.4 | -83 | 159.6 | 0 | 0 | 0 | 112.5 | I75 A81 E82 R83 E91 M94 | I75-L79 HydrophobicContact CG2-CD1 3.57Å; I75-L79 HydrophobicContact CG2-CG 4.46Å; I75-L79 WeakPolarHBondContact O-CB 3.19Å; I75-L79 WeakPolarHBondContact O-CD1 2.98Å; I75-L79 WeakPolarHBondContact O-CG 3.31Å; I75-L79 PolarHBondContact O-N 3.37Å; L79-A81 VanDerWaalsContact C-N 3.3Å; L79-E82 PolarHBondContact O-N 2.93Å; L79-R83 WeakPolarHBondContact O-CA 3.19Å; L79-R83 WeakPolarHBondContact O-CB 3.22Å; L79-R83 PolarHBondContact O-N 3.22Å; L79-E91 HydrophobicContact CD2-CB 4.43Å; L79-E91 HydrophobicContact CD2-CG 3.73Å; L79-E91 WeakPolarHBondContact CD2-OE1 3.34Å; L79-M94 HydrophobicContact CD1-SD 4.11Å; L79-M94 HydrophobicContact CG-SD 4.41Å |
| 80 | R | 64.6 | Low | 63.8 | Low | 179 Ų | 179 | 105 Ų | 105 | 68% | 0.675 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -70 | -31.5 | 176.2 | -161.3 | -165.5 | -48.8 | -122.2 | 4.6 | 111.5 | L76 E78 L84 | L76-R80 WeakPolarHBondContact O-CB 3.46Å; L76-R80 PolarHBondContact O-N 3.35Å; E78-R80 VanDerWaalsContact C-N 3.29Å; E78-R80 PolarHBondContact O-N 3.46Å; R80-L84 WeakPolarHBondContact O-CD1 3.34Å |
| 81 | A | 59.3 | Low | 62.8 | Low | 57 Ų | 57 | 104.8 Ų | 104.8 | 47% | 0.471 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -76.6 | -37.1 | 174 | 0 | 0 | 0 | 0 | 0 | 112.4 | R77 E78 L79 L84 | R77-A81 WeakPolarHBondContact O-CB 3.45Å; R77-A81 PolarHBondContact O-N 3.41Å; E78-A81 CarbonylContact O-C 3.27Å; E78-A81 WeakPolarHBondContact O-CA 3.33Å; E78-A81 WeakPolarHBondContact O-CB 3.31Å; E78-A81 PolarHBondContact O-N 3.35Å; L79-A81 VanDerWaalsContact C-N 3.3Å; A81-L84 WeakPolarHBondContact O-CB 3.23Å |
| 82 | E | 58.8 | Low | 62 | Low | 61 Ų | 61 | 107.6 Ų | 107.6 | 29% | 0.285 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -81.6 | -33.8 | -179.4 | -133 | 74.5 | -131 | 0 | 0 | 112.3 | E78 L79 L84 R85 G86 | E78-E82 WeakPolarHBondContact O-CB 3.42Å; E78-E82 PolarHBondContact O-N 3.21Å; L79-E82 PolarHBondContact O-N 2.93Å; E82-L84 PolarHBondContact O-N 3.32Å; E82-R85 CarbonylContact O-C 3.6Å; E82-R85 VanDerWaalsContact O-C 3.27Å; E82-R85 VanDerWaalsContact O-CA 3.26Å; E82-R85 WeakPolarHBondContact O-CA 3.35Å; E82-R85 PolarHBondContact O-N 2.85Å; E82-R85 IonicContact OE1-CZ 3.56Å; E82-R85 IonicContact OE1-NE 3.39Å; E82-R85 PolarHBondContact OE1-NE 3.41Å; E82-R85 IonicContact OE1-NH2 2.84Å; E82-R85 PolarHBondContact OE1-NH2 3.28Å; E82-G86 PolarHBondContact O-N 3.07Å |
| 83 | R | 51.4 | Low | 61.5 | Low | 213 Ų | 213 | 117.4 Ų | 117.4 | 80% | 0.804 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.3 | -25.2 | 171.6 | -170.1 | -174.6 | -163.3 | -162.8 | 6.6 | 112.1 | L79 | L79-R83 WeakPolarHBondContact O-CA 3.19Å; L79-R83 WeakPolarHBondContact O-CB 3.22Å; L79-R83 PolarHBondContact O-N 3.22Å |
| 84 | L | 55.2 | Low | 61.3 | Low | 157 Ų | 157 | 112.3 Ų | 112.3 | 82% | 0.822 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.4 | -14.8 | 167 | -97 | 157.6 | 0 | 0 | 0 | 112.5 | R80 A81 E82 | R80-L84 WeakPolarHBondContact O-CD1 3.34Å; A81-L84 WeakPolarHBondContact O-CB 3.23Å; E82-L84 PolarHBondContact O-N 3.32Å |
| 85 | R | 57.5 | Low | 60.9 | Low | 190 Ų | 190 | 115.3 Ų | 115.3 | 72% | 0.717 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.9 | -5 | -173.1 | -156.6 | 156.8 | 69.1 | 161.9 | 1.5 | 115.2 | E82 | E82-R85 CarbonylContact O-C 3.6Å; E82-R85 VanDerWaalsContact O-C 3.27Å; E82-R85 VanDerWaalsContact O-CA 3.26Å; E82-R85 WeakPolarHBondContact O-CA 3.35Å; E82-R85 PolarHBondContact O-N 2.85Å; E82-R85 IonicContact OE1-CZ 3.56Å; E82-R85 IonicContact OE1-NE 3.39Å; E82-R85 PolarHBondContact OE1-NE 3.41Å; E82-R85 IonicContact OE1-NH2 2.84Å; E82-R85 PolarHBondContact OE1-NH2 3.28Å |
| 86 | G | 55.4 | Low | 61 | Low | 61 Ų | 61 | 114.8 Ų | 114.8 | 63% | 0.629 | 56% | 0.563 | S | S | * | * | trans | 62.3 | 69.6 | 163.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | E82 | E82-G86 PolarHBondContact O-N 3.07Š| ||
| 87 | E | 57.7 | Low | 61.1 | Low | 149 Ų | 149 | 116.9 Ų | 116.9 | 70% | 0.696 | 57% | 0.569 | S | S | * | * | trans | -140.5 | 115.8 | 169.6 | -161.3 | 151.2 | 88.2 | 0 | 0 | 111.6 | ||||
| 88 | N | 59.9 | Low | 61.4 | Low | 135 Ų | 135 | 112.5 Ų | 112.5 | 72% | 0.722 | 55% | 0.552 | S | S | * | * | trans | -111.9 | 35.5 | -154.3 | 47.5 | -10.3 | 0 | 0 | 0 | 113.7 | ||||
| 89 | G | 59.8 | Low | 61.5 | Low | 47 Ų | 47 | 108 Ų | 108 | 49% | 0.485 | 53% | 0.533 | S | S | . | . | S | Bend | trans | -114.8 | -27.2 | 177 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 90 | T | 59.2 | Low | 62 | Low | 110 Ų | 110 | 111 Ų | 111 | 68% | 0.675 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -87.5 | -25.3 | -176.6 | -55.8 | 0 | 0 | 0 | 0 | 112.2 | E92 M94 | T90-E92 PolarHBondContact O-N 3.11Å; T90-M94 PolarHBondContact O-N 2.79Å |
| 91 | E | 57.9 | Low | 62.4 | Low | 62 Ų | 62 | 104.9 Ų | 104.9 | 29% | 0.29 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.5 | -37.3 | -176.9 | -54.7 | -174.7 | 128.5 | 0 | 0 | 112 | L79 M94 L95 | L79-E91 HydrophobicContact CD2-CB 4.43Å; L79-E91 HydrophobicContact CD2-CG 3.73Å; L79-E91 WeakPolarHBondContact CD2-OE1 3.34Å; E91-M94 WeakPolarHBondContact O-CB 3.38Å; E91-M94 PolarHBondContact O-N 3.08Å; E91-L95 WeakPolarHBondContact O-CB 3.37Å; E91-L95 WeakPolarHBondContact O-CD1 3.46Å; E91-L95 WeakPolarHBondContact O-CG 3.25Å; E91-L95 PolarHBondContact O-N 3.45Å |
| 92 | E | 54.4 | Low | 63 | Low | 148 Ų | 148 | 104.9 Ų | 104.9 | 69% | 0.692 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -66 | -42.8 | -178.4 | -62.1 | -171.2 | 155.9 | 0 | 0 | 112.7 | T90 M94 L95 G96 | T90-E92 PolarHBondContact O-N 3.11Å; E92-M94 VanDerWaalsContact C-N 3.26Å; E92-M94 PolarHBondContact O-N 3.07Å; E92-L95 PolarHBondContact O-N 2.96Å; E92-G96 PolarHBondContact O-N 2.82Å; E92-G96 VanDerWaalsContact O-N 3.11Å |
| 93 | R | 61.6 | Low | 63.7 | Low | 220 Ų | 220 | 104.2 Ų | 104.2 | 83% | 0.83 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -68.1 | -31.2 | 176.6 | -64.3 | -167.9 | -177.8 | -173.1 | 2 | 112.1 | F97 | R93-F97 PolarHBondContact O-N 3.45Å |
| 94 | M | 66.3 | Low | 64.8 | Low | 59 Ų | 59 | 98 Ų | 98 | 29% | 0.291 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -73.2 | -42.8 | 178.8 | -165.3 | -179 | -133.9 | 0 | 0 | 111.7 | I75 L79 T90 E91 E92 F97 W98 | I75-M94 HydrophobicContact CB-CE 3.8Å; I75-M94 HydrophobicContact CB-SD 4.48Å; I75-M94 HydrophobicContact CD1-CE 3.79Å; I75-M94 HydrophobicContact CG1-CE 3.35Å; I75-M94 HydrophobicContact CG2-CE 3.38Å; I75-M94 HydrophobicContact CG2-CG 4.32Å; I75-M94 HydrophobicContact CG2-SD 3.44Å; I75-M94 WeakPolarHBondContact CG2-SD 3.46Å; L79-M94 HydrophobicContact CD1-SD 4.11Å; L79-M94 HydrophobicContact CG-SD 4.41Å; T90-M94 PolarHBondContact O-N 2.79Å; E91-M94 WeakPolarHBondContact O-CB 3.38Å; E91-M94 PolarHBondContact O-N 3.08Å; E92-M94 VanDerWaalsContact C-N 3.26Å; E92-M94 PolarHBondContact O-N 3.07Å; M94-F97 PolarHBondContact O-N 3.22Å; M94-W98 WeakPolarHBondContact O-CB 3.45Å; M94-W98 PolarHBondContact O-N 3.25Å |
| 95 | L | 66.3 | Low | 65.6 | Low | 121 Ų | 121 | 92.4 Ų | 92.4 | 63% | 0.634 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.5 | -42.7 | 174.4 | -78 | 155.1 | 0 | 0 | 0 | 111.7 | E91 E92 W98 S99 | E91-L95 WeakPolarHBondContact O-CB 3.37Å; E91-L95 WeakPolarHBondContact O-CD1 3.46Å; E91-L95 WeakPolarHBondContact O-CG 3.25Å; E91-L95 PolarHBondContact O-N 3.45Å; E92-L95 PolarHBondContact O-N 2.96Å; L95-W98 WeakPolarHBondContact O-CB 3.42Å; L95-W98 PolarHBondContact O-N 2.93Å; L95-S99 WeakPolarHBondContact O-CB 3.36Å; L95-S99 PolarHBondContact O-N 2.99Å |
| 96 | G | 71.9 | Confident | 66.3 | Low | 21 Ų | 21 | 85 Ų | 85 | 22% | 0.216 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -60.6 | -46.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | E92 W98 S99 I100 | E92-G96 PolarHBondContact O-N 2.82Å; E92-G96 VanDerWaalsContact O-N 3.11Å; G96-W98 VanDerWaalsContact C-N 3.31Å; G96-W98 PolarHBondContact O-N 3.45Å; G96-S99 PolarHBondContact O-N 3.23Å; G96-I100 WeakPolarHBondContact O-CD1 3.4Å; G96-I100 VanDerWaalsContact O-CG1 3.27Å; G96-I100 WeakPolarHBondContact O-CG1 3.12Å; G96-I100 PolarHBondContact O-N 2.84Å |
| 97 | F | 66.8 | Low | 67.1 | Low | 135 Ų | 135 | 84.2 Ų | 84.2 | 59% | 0.592 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -62 | -39.8 | 175.9 | -174.6 | -97 | 0 | 0 | 0 | 112.3 | R93 M94 I100 L101 | R93-F97 PolarHBondContact O-N 3.45Å; M94-F97 PolarHBondContact O-N 3.22Å; F97-I100 PolarHBondContact O-N 3.06Å; F97-L101 HydrophobicContact CE1-CD1 4.02Å; F97-L101 WeakPolarHBondContact O-CB 3.41Å; F97-L101 PolarHBondContact O-N 3.38Å |
| 98 | W | 72.2 | Confident | 67.7 | Low | 76 Ų | 76 | 79.1 Ų | 79.1 | 29% | 0.288 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -66 | -40.1 | 177.3 | -122.6 | 82.5 | 0 | 0 | 0 | 113.5 | F68 T72 M94 L95 G96 L101 M102 | F68-W98 HydrophobicContact CE1-CH2 4.08Å; F68-W98 AromaticContact CE2-CD2 3.85Å; F68-W98 HydrophobicContact CE2-CD2 3.85Å; F68-W98 AromaticContact CE2-CE2 3.64Å; F68-W98 AromaticContact CE2-CE3 3.71Å; F68-W98 HydrophobicContact CE2-CE3 3.71Å; F68-W98 AromaticContact CE2-CH2 3.38Å; F68-W98 HydrophobicContact CE2-CH2 3.38Å; F68-W98 AromaticContact CE2-CZ2 3.44Å; F68-W98 HydrophobicContact CE2-CZ2 3.44Å; F68-W98 VanDerWaalsContact CE2-CZ2 3.44Å; F68-W98 AromaticContact CE2-CZ3 3.46Å; F68-W98 HydrophobicContact CE2-CZ3 3.46Å; F68-W98 VanDerWaalsContact CE2-CZ3 3.46Å; F68-W98 HydrophobicContact CZ-CD2 4.46Å; F68-W98 HydrophobicContact CZ-CE3 4.01Å; F68-W98 AromaticContact CZ-CH2 2.99Å; F68-W98 HydrophobicContact CZ-CH2 2.99Å; F68-W98 AromaticContact CZ-CZ2 3.47Å; F68-W98 HydrophobicContact CZ-CZ2 3.47Å; F68-W98 VanDerWaalsContact CZ-CZ2 3.47Å; F68-W98 AromaticContact CZ-CZ3 3.26Å; F68-W98 HydrophobicContact CZ-CZ3 3.26Å; T72-W98 HydrophobicContact CG2-CH2 3.86Å; T72-W98 HydrophobicContact CG2-CZ2 3.38Å; T72-W98 WeakPolarHBondContact OG1-CZ2 3.44Å; M94-W98 WeakPolarHBondContact O-CB 3.45Å; M94-W98 PolarHBondContact O-N 3.25Å; L95-W98 WeakPolarHBondContact O-CB 3.42Å; L95-W98 PolarHBondContact O-N 2.93Å; G96-W98 VanDerWaalsContact C-N 3.31Å; G96-W98 PolarHBondContact O-N 3.45Å; W98-L101 PolarHBondContact O-N 3.35Å; W98-M102 HydrophobicContact CE3-CE 4.42Å; W98-M102 HydrophobicContact CE3-CG 4.24Å; W98-M102 HydrophobicContact CZ3-CE 4.04Å; W98-M102 PolarHBondContact O-N 3.37Å |
| 99 | S | 71.3 | Confident | 68.1 | Low | 18 Ų | 18 | 75.7 Ų | 75.7 | 13% | 0.126 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -61.7 | -47.7 | 175.2 | -178.5 | 0 | 0 | 0 | 0 | 110.7 | L95 G96 L101 M102 I103 I166 | L95-S99 WeakPolarHBondContact O-CB 3.36Å; L95-S99 PolarHBondContact O-N 2.99Å; G96-S99 PolarHBondContact O-N 3.23Å; S99-L101 VanDerWaalsContact C-N 3.3Å; S99-L101 PolarHBondContact O-N 3.42Å; S99-M102 WeakPolarHBondContact O-CB 3.37Å; S99-M102 PolarHBondContact O-N 3.35Å; S99-I103 WeakPolarHBondContact O-CB 3.27Å; S99-I103 WeakPolarHBondContact O-CD1 3.22Å; S99-I103 VanDerWaalsContact O-CG1 3.23Å; S99-I103 WeakPolarHBondContact O-CG1 3.32Å; S99-I103 PolarHBondContact O-N 3.43Å; S99-I166 WeakPolarHBondContact OG-CG2 3.19Å |
| 100 | I | 74 | Confident | 68.5 | Low | 112 Ų | 112 | 75 Ų | 75 | 57% | 0.574 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -61.8 | -39.2 | 176.8 | -63.3 | 159.5 | 0 | 0 | 0 | 111.3 | G96 F97 I103 S104 | G96-I100 WeakPolarHBondContact O-CD1 3.4Å; G96-I100 VanDerWaalsContact O-CG1 3.27Å; G96-I100 WeakPolarHBondContact O-CG1 3.12Å; G96-I100 PolarHBondContact O-N 2.84Å; F97-I100 PolarHBondContact O-N 3.06Å; I100-I103 PolarHBondContact O-N 2.95Å; I100-S104 WeakPolarHBondContact O-CB 3.26Å; I100-S104 PolarHBondContact O-N 2.91Å |
| 101 | L | 74.1 | Confident | 68.9 | Low | 50 Ų | 50 | 73.4 Ų | 73.4 | 26% | 0.262 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -66.3 | -41.3 | 177.6 | -166.8 | 153.8 | 0 | 0 | 0 | 111.5 | F68 L71 F97 W98 S99 S104 A105 | F68-L101 HydrophobicContact CD2-CD2 3.78Å; F68-L101 HydrophobicContact CE2-CD2 4.49Å; L71-L101 HydrophobicContact CD1-CD1 4.29Å; F97-L101 HydrophobicContact CE1-CD1 4.02Å; F97-L101 WeakPolarHBondContact O-CB 3.41Å; F97-L101 PolarHBondContact O-N 3.38Å; W98-L101 PolarHBondContact O-N 3.35Å; S99-L101 VanDerWaalsContact C-N 3.3Å; S99-L101 PolarHBondContact O-N 3.42Å; L101-S104 PolarHBondContact O-N 2.89Å; L101-A105 WeakPolarHBondContact O-CB 3.42Å; L101-A105 PolarHBondContact O-N 3.4Å |
| 102 | M | 71.5 | Confident | 69.1 | Low | 57 Ų | 57 | 72.5 Ų | 72.5 | 28% | 0.281 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -62.4 | -45.8 | 172.6 | -84.1 | -71.3 | 159.5 | 0 | 0 | 112.4 | F68 W98 S99 S104 A105 V106 | F68-M102 HydrophobicContact CD1-CE 4.24Å; F68-M102 HydrophobicContact CD2-CE 3.83Å; F68-M102 HydrophobicContact CE1-CE 3.6Å; F68-M102 HydrophobicContact CE2-CE 3.11Å; F68-M102 HydrophobicContact CG-CE 4.3Å; F68-M102 HydrophobicContact CZ-CE 2.93Å; W98-M102 HydrophobicContact CE3-CE 4.42Å; W98-M102 HydrophobicContact CE3-CG 4.24Å; W98-M102 HydrophobicContact CZ3-CE 4.04Å; W98-M102 PolarHBondContact O-N 3.37Å; S99-M102 WeakPolarHBondContact O-CB 3.37Å; S99-M102 PolarHBondContact O-N 3.35Å; M102-S104 VanDerWaalsContact C-N 3.32Å; M102-S104 PolarHBondContact O-N 3.4Å; M102-A105 PolarHBondContact O-N 2.91Å; M102-V106 WeakPolarHBondContact O-CB 3.43Å; M102-V106 VanDerWaalsContact O-CG2 3.26Å; M102-V106 WeakPolarHBondContact O-CG2 3.48Å; M102-V106 PolarHBondContact O-N 2.89Å |
| 103 | I | 73.5 | Confident | 69.6 | Low | 47 Ų | 47 | 70 Ų | 70 | 24% | 0.241 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -58.6 | -45.2 | 176.5 | -71 | 161.9 | 0 | 0 | 0 | 110.6 | S99 I100 A107 L163 I166 | S99-I103 WeakPolarHBondContact O-CB 3.27Å; S99-I103 WeakPolarHBondContact O-CD1 3.22Å; S99-I103 VanDerWaalsContact O-CG1 3.23Å; S99-I103 WeakPolarHBondContact O-CG1 3.32Å; S99-I103 PolarHBondContact O-N 3.43Å; I100-I103 PolarHBondContact O-N 2.95Å; I103-A107 VanDerWaalsContact O-CB 3.26Å; I103-A107 WeakPolarHBondContact O-CB 3.14Å; I103-A107 PolarHBondContact O-N 3.26Å; I103-L163 HydrophobicContact CB-CD2 4.08Å; I103-L163 HydrophobicContact CG1-CD2 3.91Å; I103-L163 HydrophobicContact CG2-CD2 3.71Å; I103-I166 HydrophobicContact CD1-CG2 3.9Å; I103-I166 HydrophobicContact CG1-CG2 3.77Å |
| 104 | S | 74.4 | Confident | 69.7 | Low | 83 Ų | 83 | 64.4 Ų | 64.4 | 58% | 0.58 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -65.8 | -44.3 | 179.4 | -174.5 | 0 | 0 | 0 | 0 | 112.5 | I100 L101 M102 A107 G108 | I100-S104 WeakPolarHBondContact O-CB 3.26Å; I100-S104 PolarHBondContact O-N 2.91Å; L101-S104 PolarHBondContact O-N 2.89Å; M102-S104 VanDerWaalsContact C-N 3.32Å; M102-S104 PolarHBondContact O-N 3.4Å; S104-A107 PolarHBondContact O-N 2.91Å; S104-G108 PolarHBondContact O-N 3.47Å |
| 105 | A | 72 | Confident | 69.7 | Low | 39 Ų | 39 | 63.9 Ų | 63.9 | 32% | 0.322 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -62.3 | -45.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | L101 M102 G108 C109 | L101-A105 WeakPolarHBondContact O-CB 3.42Å; L101-A105 PolarHBondContact O-N 3.4Å; M102-A105 PolarHBondContact O-N 2.91Å; A105-G108 PolarHBondContact O-N 3.28Å; A105-C109 PolarHBondContact O-N 3.41Å; A105-C109 PolarHBondContact O-SG 2.97Å; A105-C109 VanDerWaalsContact O-SG 3.4Å |
| 106 | V | 71.9 | Confident | 69.7 | Low | 34 Ų | 34 | 61.6 Ų | 61.6 | 21% | 0.206 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -63.5 | -45.1 | 176.8 | 172 | 0 | 0 | 0 | 0 | 110.6 | M102 G108 C109 I110 I159 | M102-V106 WeakPolarHBondContact O-CB 3.43Å; M102-V106 VanDerWaalsContact O-CG2 3.26Å; M102-V106 WeakPolarHBondContact O-CG2 3.48Å; M102-V106 PolarHBondContact O-N 2.89Å; V106-G108 VanDerWaalsContact C-N 3.35Å; V106-G108 PolarHBondContact O-N 2.89Å; V106-C109 PolarHBondContact O-N 3.4Å; V106-I110 HydrophobicContact CG1-CD1 4.16Å; V106-I110 HydrophobicContact CG1-CG1 4.48Å; V106-I110 WeakPolarHBondContact O-CG1 3.23Å; V106-I110 PolarHBondContact O-N 3.5Å; V106-I159 HydrophobicContact CG1-CG2 3.26Å |
| 107 | A | 71.6 | Confident | 69.2 | Low | 46 Ų | 46 | 63.5 Ų | 63.5 | 38% | 0.38 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -60.8 | -40.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | I103 S104 I110 S111 | I103-A107 VanDerWaalsContact O-CB 3.26Å; I103-A107 WeakPolarHBondContact O-CB 3.14Å; I103-A107 PolarHBondContact O-N 3.26Å; S104-A107 PolarHBondContact O-N 2.91Å; A107-I110 PolarHBondContact O-N 2.81Å; A107-S111 WeakPolarHBondContact O-CB 3.17Å; A107-S111 PolarHBondContact O-N 3.06Å |
| 108 | G | 71.5 | Confident | 69 | Low | 41 Ų | 41 | 61.3 Ų | 61.3 | 42% | 0.423 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63.5 | -43 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | S104 A105 V106 S111 C112 | S104-G108 PolarHBondContact O-N 3.47Å; A105-G108 PolarHBondContact O-N 3.28Å; V106-G108 VanDerWaalsContact C-N 3.35Å; V106-G108 PolarHBondContact O-N 2.89Å; G108-S111 PolarHBondContact O-N 2.8Å; G108-C112 WeakPolarHBondContact O-CB 3.46Å; G108-C112 PolarHBondContact O-N 3.39Å |
| 109 | C | 67.8 | Low | 68.7 | Low | 64 Ų | 64 | 60.7 Ų | 60.7 | 43% | 0.432 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -62.7 | -44.8 | 174.7 | -74.4 | 0 | 0 | 0 | 0 | 112.1 | A105 V106 C112 I113 | A105-C109 PolarHBondContact O-N 3.41Å; A105-C109 PolarHBondContact O-SG 2.97Å; A105-C109 VanDerWaalsContact O-SG 3.4Å; V106-C109 PolarHBondContact O-N 3.4Å; C109-C112 PolarHBondContact O-N 2.94Å; C109-I113 VanDerWaalsContact O-CG1 3.32Å; C109-I113 WeakPolarHBondContact O-CG1 3.5Å; C109-I113 PolarHBondContact O-N 2.87Å |
| 110 | I | 68.8 | Low | 68 | Low | 33 Ų | 33 | 61.4 Ų | 61.4 | 17% | 0.169 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -58.8 | -50.6 | 174.5 | -60.7 | 158.5 | 0 | 0 | 0 | 110.3 | V106 A107 C112 I113 F114 L156 I159 L163 | V106-I110 HydrophobicContact CG1-CD1 4.16Å; V106-I110 HydrophobicContact CG1-CG1 4.48Å; V106-I110 WeakPolarHBondContact O-CG1 3.23Å; V106-I110 PolarHBondContact O-N 3.5Å; A107-I110 PolarHBondContact O-N 2.81Å; I110-C112 VanDerWaalsContact C-N 3.26Å; I110-C112 PolarHBondContact O-N 3.1Å; I110-I113 PolarHBondContact O-N 3.22Å; I110-F114 WeakPolarHBondContact O-CB 3.34Å; I110-F114 PolarHBondContact O-N 3.5Å; I110-L156 HydrophobicContact CG2-CD2 3.6Å; I110-I159 HydrophobicContact CD1-CB 4.1Å; I110-I159 HydrophobicContact CD1-CD1 4.36Å; I110-I159 HydrophobicContact CD1-CG2 3.11Å; I110-I159 HydrophobicContact CG1-CB 4.19Å; I110-I159 HydrophobicContact CG1-CD1 3.5Å; I110-I159 HydrophobicContact CG1-CG1 4.33Å; I110-I159 HydrophobicContact CG1-CG2 3.51Å; I110-L163 HydrophobicContact CD1-CD1 4.33Å |
| 111 | S | 66.4 | Low | 67.3 | Low | 75 Ų | 75 | 60.2 Ų | 60.2 | 52% | 0.524 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -59.7 | -39.4 | -177.5 | -176.8 | 0 | 0 | 0 | 0 | 111.3 | A107 G108 F114 S115 | A107-S111 WeakPolarHBondContact O-CB 3.17Å; A107-S111 PolarHBondContact O-N 3.06Å; G108-S111 PolarHBondContact O-N 2.8Å; S111-F114 PolarHBondContact O-N 3.42Å; S111-S115 WeakPolarHBondContact O-CB 3Å; S111-S115 PolarHBondContact O-N 2.94Å |
| 112 | C | 63.1 | Low | 66.4 | Low | 44 Ų | 44 | 65.4 Ų | 65.4 | 30% | 0.297 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -64.2 | -48.5 | 175.3 | -173.5 | 0 | 0 | 0 | 0 | 112.3 | G108 C109 I110 F114 W116 | G108-C112 WeakPolarHBondContact O-CB 3.46Å; G108-C112 PolarHBondContact O-N 3.39Å; C109-C112 PolarHBondContact O-N 2.94Å; I110-C112 VanDerWaalsContact C-N 3.26Å; I110-C112 PolarHBondContact O-N 3.1Å; C112-F114 VanDerWaalsContact C-N 3.3Å; C112-F114 PolarHBondContact O-N 2.9Å; C112-W116 VanDerWaalsContact O-CB 3.32Å; C112-W116 WeakPolarHBondContact O-CB 3.31Å; C112-W116 PolarHBondContact O-N 3.48Å |
| 113 | I | 65.1 | Low | 65.3 | Low | 94 Ų | 94 | 64.9 Ų | 64.9 | 48% | 0.482 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -65.1 | -37.3 | 178.1 | -65.1 | 167.4 | 0 | 0 | 0 | 110.7 | C109 I110 W116 T117 | C109-I113 VanDerWaalsContact O-CG1 3.32Å; C109-I113 WeakPolarHBondContact O-CG1 3.5Å; C109-I113 PolarHBondContact O-N 2.87Å; I110-I113 PolarHBondContact O-N 3.22Å; I113-W116 WeakPolarHBondContact O-CB 3.43Å; I113-T117 WeakPolarHBondContact O-CB 3.27Å; I113-T117 PolarHBondContact O-N 3.08Å; I113-T117 PolarHBondContact O-OG1 3.43Å |
| 114 | F | 64.1 | Low | 64.4 | Low | 104 Ų | 104 | 71.6 Ų | 71.6 | 46% | 0.456 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -71.6 | -45.5 | -180 | -172 | -104 | 0 | 0 | 0 | 112 | I110 S111 C112 W116 T117 L118 | I110-F114 WeakPolarHBondContact O-CB 3.34Å; I110-F114 PolarHBondContact O-N 3.5Å; S111-F114 PolarHBondContact O-N 3.42Å; C112-F114 VanDerWaalsContact C-N 3.3Å; C112-F114 PolarHBondContact O-N 2.9Å; F114-W116 VanDerWaalsContact C-N 3.29Å; F114-W116 PolarHBondContact O-N 2.9Å; F114-T117 CarbonylContact O-C 3.6Å; F114-T117 WeakPolarHBondContact O-CB 3.32Å; F114-T117 PolarHBondContact O-N 2.89Å; F114-T117 VanDerWaalsContact O-N 3.08Å; F114-L118 HydrophobicContact CD1-CD1 3.72Å; F114-L118 HydrophobicContact CD1-CG 4.24Å; F114-L118 HydrophobicContact CE1-CD1 3.36Å; F114-L118 HydrophobicContact CE1-CG 3.94Å; F114-L118 HydrophobicContact CZ-CD1 4.06Å; F114-L118 HydrophobicContact CZ-CD2 4.45Å; F114-L118 HydrophobicContact CZ-CG 4.22Å; F114-L118 PolarHBondContact O-N 3.46Å |
| 115 | S | 66.3 | Low | 63.3 | Low | 48 Ų | 48 | 74.4 Ų | 74.4 | 34% | 0.336 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -59.6 | -42.7 | 173.9 | -171.1 | 0 | 0 | 0 | 0 | 110.7 | S111 T117 L118 T119 | S111-S115 WeakPolarHBondContact O-CB 3Å; S111-S115 PolarHBondContact O-N 2.94Å; S115-T117 PolarHBondContact O-N 2.99Å; S115-L118 PolarHBondContact O-N 3.21Å; S115-T119 PolarHBondContact O-N 3.34Å; S115-T119 PolarHBondContact O-OG1 2.81Å |
| 116 | W | 65.1 | Low | 62.1 | Low | 73 Ų | 73 | 77.9 Ų | 77.9 | 28% | 0.277 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -57.7 | -46.8 | 170.4 | 173 | -96.5 | 0 | 0 | 0 | 113.1 | K50 F53 C112 I113 F114 L118 T119 Q120 | K50-W116 HydrophobicContact CB-CH2 3.29Å; K50-W116 HydrophobicContact CB-CZ2 4.08Å; K50-W116 HydrophobicContact CB-CZ3 3.9Å; K50-W116 HydrophobicContact CD-CH2 4.17Å; K50-W116 HydrophobicContact CD-CZ2 4.13Å; K50-W116 HydrophobicContact CG-CH2 3.31Å; K50-W116 HydrophobicContact CG-CZ2 3.72Å; K50-W116 HydrophobicContact CG-CZ3 3.85Å; K50-W116 WeakPolarHBondContact O-CH2 3.23Å; K50-W116 WeakPolarHBondContact O-CZ3 3.4Å; F53-W116 HydrophobicContact CB-CE3 3.75Å; F53-W116 HydrophobicContact CB-CZ3 3.56Å; F53-W116 HydrophobicContact CD1-CE3 4.42Å; F53-W116 HydrophobicContact CG-CE3 4.31Å; C112-W116 VanDerWaalsContact O-CB 3.32Å; C112-W116 WeakPolarHBondContact O-CB 3.31Å; C112-W116 PolarHBondContact O-N 3.48Å; I113-W116 WeakPolarHBondContact O-CB 3.43Å; F114-W116 VanDerWaalsContact C-N 3.29Å; F114-W116 PolarHBondContact O-N 2.9Å; W116-L118 VanDerWaalsContact C-N 3.33Å; W116-L118 PolarHBondContact O-N 3.38Å; W116-T119 PolarHBondContact O-N 3.47Å; W116-Q120 WeakPolarHBondContact O-CB 3.45Å; W116-Q120 VanDerWaalsContact O-CG 3.23Å; W116-Q120 WeakPolarHBondContact O-CG 3.26Å; W116-Q120 PolarHBondContact O-N 3.47Å |
| 117 | T | 62.7 | Low | 61 | Low | 61 Ų | 61 | 79.1 Ų | 79.1 | 37% | 0.374 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -64.8 | -38.5 | -179.6 | -57.4 | 0 | 0 | 0 | 0 | 111.3 | I113 F114 S115 Q120 L121 | I113-T117 WeakPolarHBondContact O-CB 3.27Å; I113-T117 PolarHBondContact O-N 3.08Å; I113-T117 PolarHBondContact O-OG1 3.43Å; F114-T117 CarbonylContact O-C 3.6Å; F114-T117 WeakPolarHBondContact O-CB 3.32Å; F114-T117 PolarHBondContact O-N 2.89Å; F114-T117 VanDerWaalsContact O-N 3.08Å; S115-T117 PolarHBondContact O-N 2.99Å; T117-Q120 WeakPolarHBondContact O-CB 3.2Å; T117-Q120 PolarHBondContact O-N 3.44Å; T117-L121 WeakPolarHBondContact O-CB 3.32Å; T117-L121 PolarHBondContact O-N 3.39Å |
| 118 | L | 62.7 | Low | 59.6 | Low | 88 Ų | 88 | 85.4 Ų | 85.4 | 46% | 0.461 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -66.1 | -47.1 | 174.5 | -78.7 | 175.5 | 0 | 0 | 0 | 111.9 | F114 S115 W116 Q120 L121 E122 | F114-L118 HydrophobicContact CD1-CD1 3.72Å; F114-L118 HydrophobicContact CD1-CG 4.24Å; F114-L118 HydrophobicContact CE1-CD1 3.36Å; F114-L118 HydrophobicContact CE1-CG 3.94Å; F114-L118 HydrophobicContact CZ-CD1 4.06Å; F114-L118 HydrophobicContact CZ-CD2 4.45Å; F114-L118 HydrophobicContact CZ-CG 4.22Å; F114-L118 PolarHBondContact O-N 3.46Å; S115-L118 PolarHBondContact O-N 3.21Å; W116-L118 VanDerWaalsContact C-N 3.33Å; W116-L118 PolarHBondContact O-N 3.38Å; L118-Q120 VanDerWaalsContact C-N 3.25Å; L118-Q120 PolarHBondContact O-N 2.91Å; L118-L121 PolarHBondContact O-N 2.97Å; L118-L121 VanDerWaalsContact O-N 3.11Å; L118-E122 WeakPolarHBondContact O-CB 3.42Å; L118-E122 PolarHBondContact O-N 3.03Å |
| 119 | T | 65.4 | Low | 58.1 | Low | 64 Ų | 64 | 87.5 Ų | 87.5 | 39% | 0.393 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60.7 | -38.2 | 175.8 | -57.9 | 0 | 0 | 0 | 0 | 111.3 | S115 W116 S123 | S115-T119 PolarHBondContact O-N 3.34Å; S115-T119 PolarHBondContact O-OG1 2.81Å; W116-T119 PolarHBondContact O-N 3.47Å; T119-S123 VanDerWaalsContact O-CB 3.27Å; T119-S123 WeakPolarHBondContact O-CB 3.37Å; T119-S123 PolarHBondContact O-N 3.38Å; T119-S123 PolarHBondContact O-OG 2.83Å |
| 120 | Q | 55.3 | Low | 57.1 | Low | 32 Ų | 32 | 93 Ų | 93 | 15% | 0.15 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -61.7 | -49.3 | 172.5 | -75.6 | -63.3 | 117.5 | 0 | 0 | 111.2 | K50 W116 T117 L118 E122 S123 Y124 | K50-Q120 VanDerWaalsContact CE-CD 3.43Å; K50-Q120 VanDerWaalsContact NZ-CD 3.33Å; W116-Q120 WeakPolarHBondContact O-CB 3.45Å; W116-Q120 VanDerWaalsContact O-CG 3.23Å; W116-Q120 WeakPolarHBondContact O-CG 3.26Å; W116-Q120 PolarHBondContact O-N 3.47Å; T117-Q120 WeakPolarHBondContact O-CB 3.2Å; T117-Q120 PolarHBondContact O-N 3.44Å; L118-Q120 VanDerWaalsContact C-N 3.25Å; L118-Q120 PolarHBondContact O-N 2.91Å; Q120-E122 VanDerWaalsContact C-N 3.35Å; Q120-E122 PolarHBondContact O-N 3.43Å; Q120-S123 PolarHBondContact O-N 2.69Å; Q120-S123 PolarHBondContact O-OG 3.44Å; Q120-Y124 WeakPolarHBondContact O-CD2 3.34Å; Q120-Y124 PolarHBondContact O-N 2.78Å |
| 121 | L | 60.2 | Low | 55.7 | Low | 87 Ų | 87 | 96.3 Ų | 96.3 | 46% | 0.455 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.3 | -42 | 179.6 | -130.4 | 76.1 | 0 | 0 | 0 | 112.5 | T117 L118 Y124 | T117-L121 WeakPolarHBondContact O-CB 3.32Å; T117-L121 PolarHBondContact O-N 3.39Å; L118-L121 PolarHBondContact O-N 2.97Å; L118-L121 VanDerWaalsContact O-N 3.11Å; L121-Y124 PolarHBondContact O-N 3.41Å |
| 122 | E | 54.4 | Low | 54.5 | Low | 159 Ų | 159 | 95.9 Ų | 95.9 | 74% | 0.743 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -68.6 | -37 | 179.3 | -154 | -170.6 | -175.8 | 0 | 0 | 111.2 | L118 Q120 Y124 Q125 | L118-E122 WeakPolarHBondContact O-CB 3.42Å; L118-E122 PolarHBondContact O-N 3.03Å; Q120-E122 VanDerWaalsContact C-N 3.35Å; Q120-E122 PolarHBondContact O-N 3.43Å; E122-Y124 VanDerWaalsContact C-N 3.28Å; E122-Y124 PolarHBondContact O-N 3.31Å; E122-Q125 PolarHBondContact O-N 2.93Å |
| 123 | S | 49.8 | Very low | 53.6 | Low | 46 Ų | 46 | 99 Ų | 99 | 32% | 0.322 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -69.3 | -20.4 | 176.4 | 76.2 | 0 | 0 | 0 | 0 | 114.5 | T119 Q120 Q125 | T119-S123 VanDerWaalsContact O-CB 3.27Å; T119-S123 WeakPolarHBondContact O-CB 3.37Å; T119-S123 PolarHBondContact O-N 3.38Å; T119-S123 PolarHBondContact O-OG 2.83Å; Q120-S123 PolarHBondContact O-N 2.69Å; Q120-S123 PolarHBondContact O-OG 3.44Å; S123-Q125 VanDerWaalsContact C-N 3.27Å; S123-Q125 PolarHBondContact O-N 2.77Å |
| 124 | Y | 52.7 | Low | 52.5 | Low | 188 Ų | 188 | 102.3 Ų | 102.3 | 74% | 0.737 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.2 | -1.3 | 176.7 | -90.7 | -75.9 | 0 | 0 | 0 | 113.9 | Q120 L121 E122 | Q120-Y124 WeakPolarHBondContact O-CD2 3.34Å; Q120-Y124 PolarHBondContact O-N 2.78Å; L121-Y124 PolarHBondContact O-N 3.41Å; E122-Y124 VanDerWaalsContact C-N 3.28Å; E122-Y124 PolarHBondContact O-N 3.31Å |
| 125 | Q | 52.6 | Low | 51.4 | Low | 142 Ų | 142 | 102 Ų | 102 | 66% | 0.664 | 57% | 0.565 | S | S | * | * | trans | -119.2 | 90.3 | 174.5 | -115.8 | -79.7 | 24.3 | 0 | 0 | 110.9 | E122 S123 | E122-Q125 PolarHBondContact O-N 2.93Å; S123-Q125 VanDerWaalsContact C-N 3.27Å; S123-Q125 PolarHBondContact O-N 2.77Å | ||
| 126 | P | 47.3 | Very low | 50.2 | Low | 113 Ų | 113 | 103.5 Ų | 103.5 | 73% | 0.734 | 57% | 0.569 | S | S | * | * | trans | -140.4 | 98 | 148 | 32.6 | -13.7 | 0 | 0 | 0 | 110.9 | ||||
| 127 | G | 48.2 | Very low | 49.3 | Very low | 59 Ų | 59 | 106.8 Ų | 106.8 | 61% | 0.608 | 59% | 0.591 | S | S | * | * | S | Bend | trans | 114 | 75 | 151.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 128 | M | 41.8 | Very low | 48.4 | Very low | 179 Ų | 179 | 110.9 Ų | 110.9 | 88% | 0.882 | 61% | 0.611 | S | S | * | * | S | Bend | -158.1 | 126.9 | 127.6 | -107 | 171.3 | -110 | 0 | 0 | 109 | |||
| 129 | A | 40.1 | Very low | 47.4 | Very low | 85 Ų | 85 | 115.5 Ų | 115.5 | 70% | 0.702 | 63% | 0.627 | S | S | * | * | trans | -9.5 | 131.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 118.1 | P131 | A129-P131 VanDerWaalsContact C-CD 3.45Å; A129-P131 WeakPolarHBondContact O-CD 3.18Å; A129-P131 VanDerWaalsContact O-N 3.15Å | ||
| 130 | F | 46.7 | Very low | 46.2 | Very low | 178 Ų | 178 | 120.2 Ų | 120.2 | 78% | 0.781 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -55.9 | 103 | 143.4 | -121.7 | -100.1 | 0 | 0 | 0 | 107.8 | L133 | F130-L133 HydrophobicContact CE1-CB 4.16Å; F130-L133 HydrophobicContact CE1-CD1 3.85Å; F130-L133 HydrophobicContact CE2-CD1 3.75Å; F130-L133 HydrophobicContact CZ-CB 4.38Å; F130-L133 HydrophobicContact CZ-CD1 3.24Å; F130-L133 HydrophobicContact CZ-CG 4.41Å |
| 131 | P | 40.7 | Very low | 45.4 | Very low | 104 Ų | 104 | 124.1 Ų | 124.1 | 68% | 0.675 | 66% | 0.66 | S | S | * | * | S | Bend | -149.4 | 60.1 | 124.5 | 37.1 | -18.1 | 0 | 0 | 0 | 110.1 | A129 | A129-P131 VanDerWaalsContact C-CD 3.45Å; A129-P131 WeakPolarHBondContact O-CD 3.18Å; A129-P131 VanDerWaalsContact O-N 3.15Å | |
| 132 | S | 40 | Very low | 44.9 | Very low | 66 Ų | 66 | 123.4 Ų | 123.4 | 46% | 0.462 | 66% | 0.66 | S | S | . | * | trans | -153 | 8.6 | 178.6 | -61.9 | 0 | 0 | 0 | 0 | 115.2 | L134 S135 L136 | S132-L134 PolarHBondContact O-N 3.45Å; S132-L134 VanDerWaalsContact O-N 3.16Å; S132-S135 PolarHBondContact O-N 3.49Å; S132-L136 WeakPolarHBondContact O-CB 3.23Å; S132-L136 PolarHBondContact O-N 3.26Å | ||
| 133 | L | 43.5 | Very low | 44.5 | Very low | 109 Ų | 109 | 119.1 Ų | 119.1 | 57% | 0.571 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | -18.5 | -178 | -133.1 | 167 | 0 | 0 | 0 | 113 | F130 | F130-L133 HydrophobicContact CE1-CB 4.16Å; F130-L133 HydrophobicContact CE1-CD1 3.85Å; F130-L133 HydrophobicContact CE2-CD1 3.75Å; F130-L133 HydrophobicContact CZ-CB 4.38Å; F130-L133 HydrophobicContact CZ-CD1 3.24Å; F130-L133 HydrophobicContact CZ-CG 4.41Å |
| 134 | L | 44 | Very low | 44.3 | Very low | 163 Ų | 163 | 122.5 Ų | 122.5 | 85% | 0.853 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.3 | -31.1 | 176.8 | -107.4 | 157.7 | 0 | 0 | 0 | 114.4 | S132 | S132-L134 PolarHBondContact O-N 3.45Å; S132-L134 VanDerWaalsContact O-N 3.16Å |
| 135 | S | 40 | Very low | 44.1 | Very low | 98 Ų | 98 | 118.6 Ų | 118.6 | 69% | 0.685 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.7 | -19.5 | 177 | -71.7 | 0 | 0 | 0 | 0 | 114 | S132 L137 | S132-S135 PolarHBondContact O-N 3.49Å; S135-L137 VanDerWaalsContact C-N 3.28Å; S135-L137 PolarHBondContact O-N 2.94Å |
| 136 | L | 42 | Very low | 43.7 | Very low | 80 Ų | 80 | 119.2 Ų | 119.2 | 42% | 0.419 | 66% | 0.656 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.7 | 4.6 | 178.2 | -162 | 115.1 | 0 | 0 | 0 | 113.1 | S132 R140 | S132-L136 WeakPolarHBondContact O-CB 3.23Å; S132-L136 PolarHBondContact O-N 3.26Å; L136-R140 VanDerWaalsContact CD2-NE 3.34Å; L136-R140 VanDerWaalsContact O-CB 3.27Å; L136-R140 WeakPolarHBondContact O-CB 3.42Å |
| 137 | L | 45.7 | Very low | 43.7 | Very low | 141 Ų | 141 | 121.5 Ų | 121.5 | 74% | 0.738 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | -24.3 | 173.3 | -141.3 | 71.3 | 0 | 0 | 0 | 112.2 | S135 | S135-L137 VanDerWaalsContact C-N 3.28Å; S135-L137 PolarHBondContact O-N 2.94Å |
| 138 | D | 43.1 | Very low | 44 | Very low | 148 Ų | 148 | 124.5 Ų | 124.5 | 79% | 0.791 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | -21.9 | -175.2 | -155 | 54.8 | 0 | 0 | 0 | 113 | ||
| 139 | F | 41 | Very low | 44.4 | Very low | 185 Ų | 185 | 121.3 Ų | 121.3 | 81% | 0.811 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -121.5 | 5.6 | -173.3 | -118.8 | -88.3 | 0 | 0 | 0 | 115.4 | D141 | F139-D141 VanDerWaalsContact C-N 3.32Å; F139-D141 PolarHBondContact O-N 2.8Å |
| 140 | R | 40.2 | Very low | 45.3 | Very low | 163 Ų | 163 | 122.1 Ų | 122.1 | 62% | 0.615 | 63% | 0.634 | S | S | * | * | trans | -78.2 | 88.2 | -178.5 | -174.8 | 139 | 64.6 | 163.6 | 2.3 | 110.8 | L136 | L136-R140 VanDerWaalsContact CD2-NE 3.34Å; L136-R140 VanDerWaalsContact O-CB 3.27Å; L136-R140 WeakPolarHBondContact O-CB 3.42Å | ||
| 141 | D | 40.5 | Very low | 45.9 | Very low | 113 Ų | 113 | 116.9 Ų | 116.9 | 60% | 0.604 | 62% | 0.619 | S | S | * | * | trans | -37 | 117.5 | 159.4 | -163.2 | -58.5 | 0 | 0 | 0 | 109.9 | F139 S143 | F139-D141 VanDerWaalsContact C-N 3.32Å; F139-D141 PolarHBondContact O-N 2.8Å; D141-S143 PolarHBondContact O-N 3.47Å; D141-S143 VanDerWaalsContact O-N 3.09Å; D141-S143 WeakPolarHBondContact OD1-CB 3.17Å; D141-S143 PolarHBondContact OD1-N 3.24Å; D141-S143 PolarHBondContact OD1-OG 3.33Å | ||
| 142 | P | 48.5 | Very low | 46.9 | Very low | 72 Ų | 72 | 113.3 Ų | 113.3 | 47% | 0.468 | 60% | 0.602 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.4 | 9.7 | -165.1 | 28.7 | -35.5 | 0 | 0 | 0 | 114.6 | R146 | P142-R146 VanDerWaalsContact O-CB 3.25Å; P142-R146 WeakPolarHBondContact O-CB 3.49Å; P142-R146 WeakPolarHBondContact O-CD 3.48Å; P142-R146 WeakPolarHBondContact O-CG 3.26Å |
| 143 | S | 47.2 | Very low | 48.1 | Very low | 70 Ų | 70 | 115.8 Ų | 115.8 | 49% | 0.49 | 61% | 0.609 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -90.9 | -25.8 | -161.4 | 54.6 | 0 | 0 | 0 | 0 | 116.1 | D141 F147 | D141-S143 PolarHBondContact O-N 3.47Å; D141-S143 VanDerWaalsContact O-N 3.09Å; D141-S143 WeakPolarHBondContact OD1-CB 3.17Å; D141-S143 PolarHBondContact OD1-N 3.24Å; D141-S143 PolarHBondContact OD1-OG 3.33Å; S143-F147 WeakPolarHBondContact O-CD2 3.36Å |
| 144 | S | 45.4 | Very low | 49.2 | Very low | 117 Ų | 117 | 113.6 Ų | 113.6 | 82% | 0.818 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -99.6 | -14.5 | -173.6 | -163.5 | 0 | 0 | 0 | 0 | 115.6 | ||
| 145 | H | 47.8 | Very low | 50.3 | Low | 106 Ų | 106 | 109.5 Ų | 109.5 | 49% | 0.491 | 59% | 0.588 | S | S | . | * | S | Bend | trans | -110.1 | 2.5 | 173.2 | -163.2 | 73.7 | 0 | 0 | 0 | 112.9 | ||
| 146 | R | 44.2 | Very low | 51.5 | Low | 154 Ų | 154 | 107.7 Ų | 107.7 | 58% | 0.581 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -78.9 | -24.8 | 172.6 | -95 | -174.5 | -171.7 | -159.7 | 7.6 | 113.5 | P142 N148 N150 | P142-R146 VanDerWaalsContact O-CB 3.25Å; P142-R146 WeakPolarHBondContact O-CB 3.49Å; P142-R146 WeakPolarHBondContact O-CD 3.48Å; P142-R146 WeakPolarHBondContact O-CG 3.26Å; R146-N148 PolarHBondContact O-N 2.92Å; R146-N150 VanDerWaalsContact O-CB 3.3Å; R146-N150 WeakPolarHBondContact O-CB 3.4Å; R146-N150 PolarHBondContact O-N 2.87Å; R146-N150 PolarHBondContact O-OD1 3.02Å |
| 147 | F | 47.7 | Very low | 53 | Low | 161 Ų | 161 | 109.1 Ų | 109.1 | 71% | 0.706 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -71.2 | -31.5 | -172.8 | -86.9 | -85.5 | 0 | 0 | 0 | 114.1 | S143 S151 | S143-F147 WeakPolarHBondContact O-CD2 3.36Å; F147-S151 PolarHBondContact O-OG 3.3Å |
| 148 | N | 53.3 | Low | 54.3 | Low | 123 Ų | 123 | 104.2 Ų | 104.2 | 66% | 0.658 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -87.1 | -33.7 | 175.7 | -79.6 | -45.2 | 0 | 0 | 0 | 113.6 | R146 G152 | R146-N148 PolarHBondContact O-N 2.92Å; N148-G152 PolarHBondContact O-N 3.24Å |
| 149 | M | 51.5 | Low | 55.6 | Low | 112 Ų | 112 | 98.6 Ų | 98.6 | 55% | 0.552 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -71.6 | -36 | 176.5 | -80.4 | 172.2 | 84.6 | 0 | 0 | 112.3 | L153 | M149-L153 WeakPolarHBondContact O-CB 3.35Å; M149-L153 WeakPolarHBondContact O-CD1 3.49Å; M149-L153 PolarHBondContact O-N 3.48Å |
| 150 | N | 59 | Low | 57.2 | Low | 102 Ų | 102 | 94.5 Ų | 94.5 | 55% | 0.545 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -69.7 | -35.6 | 173.6 | -86.9 | 68.3 | 0 | 0 | 0 | 112.6 | R146 A154 | R146-N150 VanDerWaalsContact O-CB 3.3Å; R146-N150 WeakPolarHBondContact O-CB 3.4Å; R146-N150 PolarHBondContact O-N 2.87Å; R146-N150 PolarHBondContact O-OD1 3.02Å; N150-A154 WeakPolarHBondContact O-CB 3.29Å; N150-A154 PolarHBondContact O-N 2.72Å |
| 151 | S | 57.8 | Low | 58.8 | Low | 68 Ų | 68 | 89.2 Ų | 89.2 | 48% | 0.476 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.4 | -43 | 174.2 | -66 | 0 | 0 | 0 | 0 | 111.7 | F147 A154 V155 | F147-S151 PolarHBondContact O-OG 3.3Å; S151-A154 PolarHBondContact O-N 3Å; S151-V155 WeakPolarHBondContact O-CB 3.4Å; S151-V155 VanDerWaalsContact O-CG2 3.23Å; S151-V155 WeakPolarHBondContact O-CG2 3.23Å; S151-V155 PolarHBondContact O-N 2.76Å |
| 152 | G | 63.5 | Low | 60.5 | Low | 29 Ų | 29 | 89.9 Ų | 89.9 | 30% | 0.299 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.5 | -47.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | N148 V155 L156 | N148-G152 PolarHBondContact O-N 3.24Å; G152-V155 PolarHBondContact O-N 3.29Å; G152-L156 VanDerWaalsContact O-CB 3.27Å; G152-L156 WeakPolarHBondContact O-CB 3.47Å; G152-L156 WeakPolarHBondContact O-CD1 3.4Å; G152-L156 WeakPolarHBondContact O-CG 3.49Å; G152-L156 PolarHBondContact O-N 2.96Å |
| 153 | L | 64.4 | Low | 61.2 | Low | 117 Ų | 117 | 88.2 Ų | 88.2 | 61% | 0.613 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.4 | -38.8 | 175.9 | -103.4 | 93.2 | 0 | 0 | 0 | 112.7 | M149 L156 N157 | M149-L153 WeakPolarHBondContact O-CB 3.35Å; M149-L153 WeakPolarHBondContact O-CD1 3.49Å; M149-L153 PolarHBondContact O-N 3.48Å; L153-L156 PolarHBondContact O-N 2.9Å; L153-N157 WeakPolarHBondContact O-CB 3.15Å; L153-N157 PolarHBondContact O-N 3.45Å |
| 154 | A | 67.4 | Low | 62.5 | Low | 64 Ų | 64 | 88.9 Ų | 88.9 | 53% | 0.529 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.1 | -41.1 | 179 | 0 | 0 | 0 | 0 | 0 | 111.4 | N150 S151 G158 | N150-A154 WeakPolarHBondContact O-CB 3.29Å; N150-A154 PolarHBondContact O-N 2.72Å; S151-A154 PolarHBondContact O-N 3Å; A154-G158 PolarHBondContact O-N 3.11Å |
| 155 | V | 66.7 | Low | 63.7 | Low | 77 Ų | 77 | 87.3 Ų | 87.3 | 47% | 0.467 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.9 | -47.2 | 173.6 | 172.4 | 0 | 0 | 0 | 0 | 110.3 | S151 G152 N157 G158 I159 | S151-V155 WeakPolarHBondContact O-CB 3.4Å; S151-V155 VanDerWaalsContact O-CG2 3.23Å; S151-V155 WeakPolarHBondContact O-CG2 3.23Å; S151-V155 PolarHBondContact O-N 2.76Å; G152-V155 PolarHBondContact O-N 3.29Å; V155-N157 VanDerWaalsContact C-N 3.33Å; V155-N157 PolarHBondContact O-N 2.93Å; V155-G158 PolarHBondContact O-N 3.36Å; V155-I159 HydrophobicContact CG1-CD1 3.63Å; V155-I159 HydrophobicContact CG1-CG1 4.46Å; V155-I159 WeakPolarHBondContact O-CB 3.49Å; V155-I159 WeakPolarHBondContact O-CD1 3.21Å; V155-I159 WeakPolarHBondContact O-CG1 3.27Å; V155-I159 PolarHBondContact O-N 3.44Å |
| 156 | L | 65.6 | Low | 64.5 | Low | 59 Ų | 59 | 84.1 Ų | 84.1 | 31% | 0.309 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -60.7 | -41.4 | 176.4 | -74.7 | 167.6 | 0 | 0 | 0 | 112.1 | I110 G152 L153 I159 L160 | I110-L156 HydrophobicContact CG2-CD2 3.6Å; G152-L156 VanDerWaalsContact O-CB 3.27Å; G152-L156 WeakPolarHBondContact O-CB 3.47Å; G152-L156 WeakPolarHBondContact O-CD1 3.4Å; G152-L156 WeakPolarHBondContact O-CG 3.49Å; G152-L156 PolarHBondContact O-N 2.96Å; L153-L156 PolarHBondContact O-N 2.9Å; L156-I159 PolarHBondContact O-N 2.82Å; L156-L160 WeakPolarHBondContact O-CB 3.4Å; L156-L160 VanDerWaalsContact O-CG 3.26Å; L156-L160 WeakPolarHBondContact O-CG 3.5Å; L156-L160 PolarHBondContact O-N 3.45Å |
| 157 | N | 73.4 | Confident | 65.5 | Low | 111 Ų | 111 | 86.1 Ų | 86.1 | 59% | 0.594 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -69 | -39.3 | 179.3 | -164.2 | 31.3 | 0 | 0 | 0 | 111.4 | L153 V155 I159 L160 A161 | L153-N157 WeakPolarHBondContact O-CB 3.15Å; L153-N157 PolarHBondContact O-N 3.45Å; V155-N157 VanDerWaalsContact C-N 3.33Å; V155-N157 PolarHBondContact O-N 2.93Å; N157-I159 VanDerWaalsContact C-N 3.29Å; N157-I159 PolarHBondContact O-N 3.46Å; N157-L160 PolarHBondContact O-N 2.8Å; N157-A161 VanDerWaalsContact O-CB 3.29Å; N157-A161 WeakPolarHBondContact O-CB 3.42Å; N157-A161 PolarHBondContact O-N 2.83Å |
| 158 | G | 72.6 | Confident | 66 | Low | 37 Ų | 37 | 82.7 Ų | 82.7 | 38% | 0.381 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63 | -36.3 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | A154 V155 A161 M162 | A154-G158 PolarHBondContact O-N 3.11Å; V155-G158 PolarHBondContact O-N 3.36Å; G158-A161 PolarHBondContact O-N 3.34Å; G158-M162 PolarHBondContact O-N 3.17Å |
| 159 | I | 70.6 | Confident | 66 | Low | 31 Ų | 31 | 83.6 Ų | 83.6 | 16% | 0.159 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -77.3 | -39.1 | 178.9 | -63.3 | 167 | 0 | 0 | 0 | 111.9 | V106 I110 V155 L156 N157 A161 M162 L163 | V106-I159 HydrophobicContact CG1-CG2 3.26Å; I110-I159 HydrophobicContact CD1-CB 4.1Å; I110-I159 HydrophobicContact CD1-CD1 4.36Å; I110-I159 HydrophobicContact CD1-CG2 3.11Å; I110-I159 HydrophobicContact CG1-CB 4.19Å; I110-I159 HydrophobicContact CG1-CD1 3.5Å; I110-I159 HydrophobicContact CG1-CG1 4.33Å; I110-I159 HydrophobicContact CG1-CG2 3.51Å; V155-I159 HydrophobicContact CG1-CD1 3.63Å; V155-I159 HydrophobicContact CG1-CG1 4.46Å; V155-I159 WeakPolarHBondContact O-CB 3.49Å; V155-I159 WeakPolarHBondContact O-CD1 3.21Å; V155-I159 WeakPolarHBondContact O-CG1 3.27Å; V155-I159 PolarHBondContact O-N 3.44Å; L156-I159 PolarHBondContact O-N 2.82Å; N157-I159 VanDerWaalsContact C-N 3.29Å; N157-I159 PolarHBondContact O-N 3.46Å; I159-A161 VanDerWaalsContact C-N 3.28Å; I159-A161 PolarHBondContact O-N 3.05Å; I159-M162 PolarHBondContact O-N 2.91Å; I159-L163 HydrophobicContact CG2-CD1 4.04Å; I159-L163 HydrophobicContact CG2-CG 4.44Å; I159-L163 WeakPolarHBondContact O-CB 3.47Å; I159-L163 WeakPolarHBondContact O-CG 3.06Å; I159-L163 PolarHBondContact O-N 3.35Å |
| 160 | L | 73.1 | Confident | 66 | Low | 99 Ų | 99 | 84 Ų | 84 | 52% | 0.518 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -58.5 | -43.5 | 169.2 | -75.6 | 167 | 0 | 0 | 0 | 110.3 | L156 N157 L163 T164 | L156-L160 WeakPolarHBondContact O-CB 3.4Å; L156-L160 VanDerWaalsContact O-CG 3.26Å; L156-L160 WeakPolarHBondContact O-CG 3.5Å; L156-L160 PolarHBondContact O-N 3.45Å; N157-L160 PolarHBondContact O-N 2.8Å; L160-L163 WeakPolarHBondContact O-CB 3.3Å; L160-L163 PolarHBondContact O-N 3.32Å; L160-T164 WeakPolarHBondContact O-CB 3.48Å; L160-T164 PolarHBondContact O-N 3.02Å; L160-T164 PolarHBondContact O-OG1 2.75Å |
| 161 | A | 75.6 | Confident | 66.4 | Low | 51 Ų | 51 | 83.1 Ų | 83.1 | 42% | 0.421 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.6 | -44.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | N157 G158 I159 T164 V165 | N157-A161 VanDerWaalsContact O-CB 3.29Å; N157-A161 WeakPolarHBondContact O-CB 3.42Å; N157-A161 PolarHBondContact O-N 2.83Å; G158-A161 PolarHBondContact O-N 3.34Å; I159-A161 VanDerWaalsContact C-N 3.28Å; I159-A161 PolarHBondContact O-N 3.05Å; A161-T164 PolarHBondContact O-N 3.28Å; A161-V165 WeakPolarHBondContact O-CB 3.06Å; A161-V165 VanDerWaalsContact O-CG2 3.27Å; A161-V165 WeakPolarHBondContact O-CG2 3.25Å; A161-V165 PolarHBondContact O-N 3.09Å |
| 162 | M | 74.6 | Confident | 66.8 | Low | 127 Ų | 127 | 83.8 Ų | 83.8 | 63% | 0.626 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.3 | -43.5 | 173.7 | -79 | -155.3 | -175.5 | 0 | 0 | 112.2 | G158 I159 T164 V165 I166 | G158-M162 PolarHBondContact O-N 3.17Å; I159-M162 PolarHBondContact O-N 2.91Å; M162-T164 VanDerWaalsContact C-N 3.34Å; M162-T164 PolarHBondContact O-N 3.45Å; M162-V165 PolarHBondContact O-N 3.33Å; M162-I166 WeakPolarHBondContact O-CB 3.17Å; M162-I166 WeakPolarHBondContact O-CD1 3.47Å; M162-I166 WeakPolarHBondContact O-CG1 3.27Å; M162-I166 PolarHBondContact O-N 3.35Å |
| 163 | L | 64.3 | Low | 67 | Low | 37 Ų | 37 | 86.9 Ų | 86.9 | 19% | 0.194 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -60.6 | -41.8 | 175.2 | -77.7 | 161.8 | 0 | 0 | 0 | 111.6 | I103 I110 I159 L160 I166 W167 | I103-L163 HydrophobicContact CB-CD2 4.08Å; I103-L163 HydrophobicContact CG1-CD2 3.91Å; I103-L163 HydrophobicContact CG2-CD2 3.71Å; I110-L163 HydrophobicContact CD1-CD1 4.33Å; I159-L163 HydrophobicContact CG2-CD1 4.04Å; I159-L163 HydrophobicContact CG2-CG 4.44Å; I159-L163 WeakPolarHBondContact O-CB 3.47Å; I159-L163 WeakPolarHBondContact O-CG 3.06Å; I159-L163 PolarHBondContact O-N 3.35Å; L160-L163 WeakPolarHBondContact O-CB 3.3Å; L160-L163 PolarHBondContact O-N 3.32Å; L163-I166 PolarHBondContact O-N 3.32Å; L163-W167 VanDerWaalsContact O-CB 3.23Å; L163-W167 WeakPolarHBondContact O-CB 3.19Å; L163-W167 PolarHBondContact O-N 3.16Å |
| 164 | T | 74.4 | Confident | 67.2 | Low | 84 Ų | 84 | 85.1 Ų | 85.1 | 52% | 0.515 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.4 | -38.9 | 176.4 | -61.3 | 0 | 0 | 0 | 0 | 111.9 | L160 A161 M162 W167 S168 | L160-T164 WeakPolarHBondContact O-CB 3.48Å; L160-T164 PolarHBondContact O-N 3.02Å; L160-T164 PolarHBondContact O-OG1 2.75Å; A161-T164 PolarHBondContact O-N 3.28Å; M162-T164 VanDerWaalsContact C-N 3.34Å; M162-T164 PolarHBondContact O-N 3.45Å; T164-W167 PolarHBondContact O-N 3.38Å; T164-S168 WeakPolarHBondContact O-CB 2.97Å; T164-S168 PolarHBondContact O-N 3.49Å; T164-S168 PolarHBondContact O-OG 2.96Å |
| 165 | V | 70.2 | Confident | 67.1 | Low | 84 Ų | 84 | 86.4 Ų | 86.4 | 51% | 0.509 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.3 | -46.6 | 174.9 | 167.8 | 0 | 0 | 0 | 0 | 110.1 | A161 M162 W167 S168 L169 | A161-V165 WeakPolarHBondContact O-CB 3.06Å; A161-V165 VanDerWaalsContact O-CG2 3.27Å; A161-V165 WeakPolarHBondContact O-CG2 3.25Å; A161-V165 PolarHBondContact O-N 3.09Å; M162-V165 PolarHBondContact O-N 3.33Å; V165-W167 VanDerWaalsContact C-N 3.29Å; V165-W167 PolarHBondContact O-N 3Å; V165-S168 CarbonylContact O-C 3.56Å; V165-S168 PolarHBondContact O-N 2.74Å; V165-S168 VanDerWaalsContact O-N 3.1Å; V165-L169 HydrophobicContact CG1-CD1 3.57Å; V165-L169 WeakPolarHBondContact O-CB 3.27Å; V165-L169 WeakPolarHBondContact O-CD1 3.11Å; V165-L169 PolarHBondContact O-N 3.5Å |
| 166 | I | 64.8 | Low | 67.2 | Low | 39 Ų | 39 | 87.1 Ų | 87.1 | 20% | 0.2 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -61.7 | -39.2 | 175.8 | -64.9 | 160 | 0 | 0 | 0 | 110.9 | S99 I103 M162 L163 S168 L169 S170 | S99-I166 WeakPolarHBondContact OG-CG2 3.19Å; I103-I166 HydrophobicContact CD1-CG2 3.9Å; I103-I166 HydrophobicContact CG1-CG2 3.77Å; M162-I166 WeakPolarHBondContact O-CB 3.17Å; M162-I166 WeakPolarHBondContact O-CD1 3.47Å; M162-I166 WeakPolarHBondContact O-CG1 3.27Å; M162-I166 PolarHBondContact O-N 3.35Å; L163-I166 PolarHBondContact O-N 3.32Å; I166-S168 VanDerWaalsContact C-N 3.33Å; I166-S168 PolarHBondContact O-N 2.88Å; I166-L169 PolarHBondContact O-N 3.35Å; I166-S170 PolarHBondContact O-N 3.15Å |
| 167 | W | 64.4 | Low | 67.3 | Low | 196 Ų | 196 | 89.1 Ų | 89.1 | 74% | 0.742 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -65.1 | -35.3 | 174.2 | -173.6 | -77 | 0 | 0 | 0 | 112.6 | L163 T164 V165 | L163-W167 VanDerWaalsContact O-CB 3.23Å; L163-W167 WeakPolarHBondContact O-CB 3.19Å; L163-W167 PolarHBondContact O-N 3.16Å; T164-W167 PolarHBondContact O-N 3.38Å; V165-W167 VanDerWaalsContact C-N 3.29Å; V165-W167 PolarHBondContact O-N 3Å |
| 168 | S | 58.6 | Low | 66.8 | Low | 89 Ų | 89 | 87.4 Ų | 87.4 | 62% | 0.622 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -82.8 | -15.9 | -179.5 | -55.2 | 0 | 0 | 0 | 0 | 113 | T164 V165 I166 | T164-S168 WeakPolarHBondContact O-CB 2.97Å; T164-S168 PolarHBondContact O-N 3.49Å; T164-S168 PolarHBondContact O-OG 2.96Å; V165-S168 CarbonylContact O-C 3.56Å; V165-S168 PolarHBondContact O-N 2.74Å; V165-S168 VanDerWaalsContact O-N 3.1Å; I166-S168 VanDerWaalsContact C-N 3.33Å; I166-S168 PolarHBondContact O-N 2.88Å |
| 169 | L | 53.1 | Low | 66.3 | Low | 143 Ų | 143 | 91.6 Ų | 91.6 | 75% | 0.749 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -95.7 | -12.3 | 174.3 | -88.3 | 146.3 | 0 | 0 | 0 | 112.9 | V165 I166 | V165-L169 HydrophobicContact CG1-CD1 3.57Å; V165-L169 WeakPolarHBondContact O-CB 3.27Å; V165-L169 WeakPolarHBondContact O-CD1 3.11Å; V165-L169 PolarHBondContact O-N 3.5Å; I166-L169 PolarHBondContact O-N 3.35Å |
| 170 | S | 52.6 | Low | 66 | Low | 119 Ų | 119 | 97.1 Ų | 97.1 | 83% | 0.832 | 54% | 0.539 | S | S | * | . | trans | -84.1 | 0 | 169.6 | -172.2 | 0 | 0 | 0 | 0 | 111.4 | I166 | I166-S170 PolarHBondContact O-N 3.15Š|
Retrieved 170 of 170 residues in 142.7 ms
(Link to these results)