| 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 | 68.7 | Low | 83.3 | Confident | 242 Ų | 242 | 148.9 Ų | 148.9 | 100% | 1.192 | 84% | 0.839 | S | S | * | * | 0 | 121.2 | 0 | -67 | -59.4 | -176.7 | 0 | 0 | 107.6 | |||||
| 2 | A | 74.6 | Confident | 83.5 | Confident | 104 Ų | 104 | 152.6 Ų | 152.6 | 86% | 0.86 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 137.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||
| 3 | A | 80.8 | Confident | 83.8 | Confident | 89 Ų | 89 | 146.8 Ų | 146.8 | 74% | 0.736 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 139.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 4 | P | 81.4 | Confident | 82.8 | Confident | 126 Ų | 126 | 152.2 Ų | 152.2 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 136.1 | 177.1 | 26.8 | -33.5 | 0 | 0 | 0 | 110.6 | ||
| 5 | R | 83.7 | Confident | 81.5 | Confident | 232 Ų | 232 | 150.1 Ų | 150.1 | 88% | 0.875 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 141 | 179 | -63.6 | -174.4 | -178.2 | -139.3 | 0.7 | 110.3 | I7 | R5-I7 PolarHBondContact O-N 3.17Š|
| 6 | P | 83.4 | Confident | 80.1 | Confident | 118 Ų | 118 | 147.6 Ų | 147.6 | 77% | 0.766 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 130.2 | 176.9 | 26 | -33.7 | 0 | 0 | 0 | 111.2 | ||
| 7 | I | 86.8 | Confident | 78.9 | Confident | 171 Ų | 171 | 143 Ų | 143 | 88% | 0.877 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 126.8 | -180 | -56.6 | 174.1 | 0 | 0 | 0 | 109 | R5 | R5-I7 PolarHBondContact O-N 3.17Š|
| 8 | K | 86.9 | Confident | 77.3 | Confident | 194 Ų | 194 | 148.5 Ų | 148.5 | 84% | 0.843 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -91.5 | 127.3 | 176.5 | -61 | 177.6 | -177.4 | 179.6 | 0 | 109.4 | ||
| 9 | G | 88.5 | Confident | 75.5 | Confident | 75 Ų | 75 | 147.8 Ų | 147.8 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 158.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 10 | I | 90.9 | Very high | 74.2 | Confident | 145 Ų | 145 | 149.7 Ų | 149.7 | 74% | 0.744 | 81% | 0.809 | S | S | * | * | trans | -94.5 | -8.7 | -179.7 | 63.1 | 170.7 | 0 | 0 | 0 | 114.7 | K12 | I10-K12 VanDerWaalsContact O-CD 3.28Å; I10-K12 WeakPolarHBondContact O-CD 3.24Å; I10-K12 VanDerWaalsContact O-CE 3.25Å; I10-K12 WeakPolarHBondContact O-CE 3.39Å; I10-K12 PolarHBondContact O-N 3.46Å | ||
| 11 | L | 90.4 | Very high | 73.1 | Confident | 142 Ų | 142 | 151.4 Ų | 151.4 | 74% | 0.743 | 81% | 0.809 | S | S | * | * | trans | -69.1 | 112.2 | 179.9 | -177.7 | 64.5 | 0 | 0 | 0 | 110.3 | ||||
| 12 | K | 86.4 | Confident | 71.7 | Confident | 193 Ų | 193 | 145.3 Ų | 145.3 | 84% | 0.839 | 79% | 0.79 | S | S | * | * | trans | -107.8 | 83.2 | -178.4 | -60.6 | 128.1 | -174.6 | 164.7 | 0 | 110.1 | I10 | I10-K12 VanDerWaalsContact O-CD 3.28Å; I10-K12 WeakPolarHBondContact O-CD 3.24Å; I10-K12 VanDerWaalsContact O-CE 3.25Å; I10-K12 WeakPolarHBondContact O-CE 3.39Å; I10-K12 PolarHBondContact O-N 3.46Å | ||
| 13 | N | 86.8 | Confident | 69.8 | Low | 77 Ų | 77 | 147 Ų | 147 | 41% | 0.412 | 79% | 0.789 | S | S | . | * | trans | -104.5 | 136.4 | 169.9 | 55.4 | 3.6 | 0 | 0 | 0 | 110.8 | N15 S16 | N13-N15 WeakPolarHBondContact CB-OD1 3.31Å; N13-N15 VanDerWaalsContact CG-OD1 3.31Å; N13-N15 PolarHBondContact O-N 3.02Å; N13-S16 PolarHBondContact O-N 2.98Å | ||
| 14 | K | 70.4 | Confident | 68.1 | Low | 223 Ų | 223 | 147.9 Ų | 147.9 | 97% | 0.97 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | 11.7 | -167.4 | -162.4 | 158.7 | 179.9 | 172 | 0 | 114.4 | ||
| 15 | N | 62.1 | Low | 65.8 | Low | 121 Ų | 121 | 149.8 Ų | 149.8 | 65% | 0.647 | 79% | 0.794 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.1 | 0.4 | -174.8 | 53.4 | 5.1 | 0 | 0 | 0 | 114 | N13 G17 | N13-N15 WeakPolarHBondContact CB-OD1 3.31Å; N13-N15 VanDerWaalsContact CG-OD1 3.31Å; N13-N15 PolarHBondContact O-N 3.02Å; N15-G17 PolarHBondContact O-N 3.18Å |
| 16 | S | 60.1 | Low | 63.7 | Low | 110 Ų | 110 | 147 Ų | 147 | 77% | 0.769 | 79% | 0.791 | S | S | * | * | trans | -76.3 | 52.7 | 173.7 | -159.4 | 0 | 0 | 0 | 0 | 112.5 | N13 | N13-S16 PolarHBondContact O-N 2.98Š| ||
| 17 | G | 58.6 | Low | 61.5 | Low | 69 Ų | 69 | 145 Ų | 145 | 71% | 0.711 | 79% | 0.785 | S | S | * | * | trans | -129.5 | 30.2 | -170 | 0 | 0 | 0 | 0 | 0 | 114 | N15 | N15-G17 PolarHBondContact O-N 3.18Š| ||
| 18 | R | 51.2 | Low | 59.5 | Low | 242 Ų | 242 | 142.8 Ų | 142.8 | 91% | 0.913 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -99.8 | 84.7 | 177.2 | -69.6 | -175.8 | 72.1 | 148.7 | -0.8 | 111.9 | ||
| 19 | N | 42 | Very low | 57.3 | Low | 135 Ų | 135 | 138.5 Ų | 138.5 | 72% | 0.722 | 78% | 0.782 | S | S | * | * | trans | 61.2 | 77.7 | 145 | -162.7 | 28.2 | 0 | 0 | 0 | 118.1 | K21 | N19-K21 VanDerWaalsContact OD1-CB 3.31Å; N19-K21 WeakPolarHBondContact OD1-CB 3.27Å | ||
| 20 | L | 50.9 | Low | 54.5 | Low | 185 Ų | 185 | 144.2 Ų | 144.2 | 97% | 0.969 | 79% | 0.788 | S | S | * | * | trans | -85 | 105.4 | 150.4 | -74.7 | 170.5 | 0 | 0 | 0 | 108.4 | ||||
| 21 | K | 51.1 | Low | 52.4 | Low | 186 Ų | 186 | 143.7 Ų | 143.7 | 81% | 0.809 | 79% | 0.791 | S | S | * | * | trans | -144.3 | 81.1 | 174.9 | -163.4 | 160.5 | -171.3 | 168.2 | 0 | 113.6 | N19 | N19-K21 VanDerWaalsContact OD1-CB 3.31Å; N19-K21 WeakPolarHBondContact OD1-CB 3.27Å | ||
| 22 | S | 38.4 | Very low | 49.7 | Very low | 115 Ų | 115 | 142.8 Ų | 142.8 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | trans | -170.9 | 147.2 | 152.1 | 48.9 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 23 | V | 36 | Very low | 47.3 | Very low | 138 Ų | 138 | 142.1 Ų | 142.1 | 84% | 0.836 | 79% | 0.792 | S | S | * | * | cis | -148.2 | 149.1 | -18.6 | 128.5 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 24 | S | 43.7 | Very low | 45.1 | Very low | 109 Ų | 109 | 148 Ų | 148 | 76% | 0.762 | 82% | 0.817 | S | S | * | * | trans | -68.9 | 147 | 176 | -49.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 25 | D | 34.2 | Very low | 43.5 | Very low | 166 Ų | 166 | 140.1 Ų | 140.1 | 89% | 0.888 | 80% | 0.799 | S | S | * | * | trans | -144.9 | 159.9 | 145.7 | -144.3 | -73.1 | 0 | 0 | 0 | 109 | ||||
| 26 | E | 39.1 | Very low | 42.7 | Very low | 173 Ų | 173 | 140.4 Ų | 140.4 | 81% | 0.808 | 81% | 0.807 | S | S | * | * | trans | -118.6 | 139.5 | -146.6 | -146.6 | -151.5 | 129.7 | 0 | 0 | 116 | ||||
| 27 | A | 36.3 | Very low | 41.6 | Very low | 77 Ų | 77 | 144 Ų | 144 | 64% | 0.636 | 81% | 0.812 | S | S | * | * | trans | 64 | 169.8 | 148.2 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 28 | P | 45.1 | Very low | 41.1 | Very low | 124 Ų | 124 | 148.1 Ų | 148.1 | 81% | 0.805 | 82% | 0.817 | S | S | * | * | cis | -127.9 | 159.1 | -16.4 | 21.1 | 1.7 | 0 | 0 | 0 | 116.2 | ||||
| 29 | A | 40 | Very low | 40.7 | Very low | 103 Ų | 103 | 141.3 Ų | 141.3 | 85% | 0.851 | 81% | 0.806 | S | S | * | * | trans | 32.7 | 122 | 144.8 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 30 | E | 31.6 | Very low | 41.1 | Very low | 195 Ų | 195 | 144.3 Ų | 144.3 | 91% | 0.911 | 82% | 0.816 | S | S | * | * | trans | -148 | 153.5 | 131.3 | -161.8 | 164.6 | -172.8 | 0 | 0 | 110.7 | ||||
| 31 | V | 45.3 | Very low | 41.1 | Very low | 134 Ų | 134 | 142.6 Ų | 142.6 | 81% | 0.812 | 81% | 0.808 | S | S | * | * | trans | -97.9 | 133.5 | -171 | 169.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 32 | T | 34.7 | Very low | 40.9 | Very low | 124 Ų | 124 | 139 Ų | 139 | 76% | 0.761 | 80% | 0.797 | S | S | * | * | trans | -153.4 | 127.2 | 156.1 | -35.4 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 33 | E | 36.6 | Very low | 41.6 | Very low | 179 Ų | 179 | 142.8 Ų | 142.8 | 84% | 0.836 | 80% | 0.802 | S | S | * | * | trans | 26.3 | 141.8 | 161.3 | -67.8 | -174.1 | 113.3 | 0 | 0 | 124.5 | G35 | E33-G35 PolarHBondContact O-N 2.93Š| ||
| 34 | H | 38.8 | Very low | 42.6 | Very low | 200 Ų | 200 | 142.7 Ų | 142.7 | 93% | 0.926 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 121.9 | 168.5 | -66.2 | -91.2 | 0 | 0 | 0 | 113.4 | ||
| 35 | G | 37.6 | Very low | 43.8 | Very low | 58 Ų | 58 | 147 Ų | 147 | 60% | 0.598 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -101.5 | 157.8 | 148.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | E33 E37 | E33-G35 PolarHBondContact O-N 2.93Å; G35-E37 PolarHBondContact O-N 3.43Å; G35-E37 VanDerWaalsContact O-N 3.17Å |
| 36 | P | 45.1 | Very low | 46.1 | Very low | 127 Ų | 127 | 148.9 Ų | 148.9 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 119 | -178.4 | 27 | -33.4 | 0 | 0 | 0 | 110.7 | L38 | P36-L38 PolarHBondContact O-N 3.49Š|
| 37 | E | 38 | Very low | 48.3 | Very low | 185 Ų | 185 | 145.6 Ų | 145.6 | 86% | 0.864 | 79% | 0.794 | S | S | * | * | trans | -65.8 | 94.8 | 173.6 | -171.6 | 178 | 156.9 | 0 | 0 | 109.3 | G35 S39 | G35-E37 PolarHBondContact O-N 3.43Å; G35-E37 VanDerWaalsContact O-N 3.17Å; E37-S39 VanDerWaalsContact C-N 3.34Å; E37-S39 PolarHBondContact O-N 2.7Å | ||
| 38 | L | 46.9 | Very low | 51.1 | Low | 156 Ų | 156 | 146.9 Ų | 146.9 | 82% | 0.817 | 80% | 0.804 | S | S | * | * | trans | -70.6 | 95.6 | 166.7 | -70.4 | 175.6 | 0 | 0 | 0 | 107.6 | P36 E40 | P36-L38 PolarHBondContact O-N 3.49Å; L38-E40 PolarHBondContact O-N 3.41Å | ||
| 39 | S | 43.5 | Very low | 53.5 | Low | 98 Ų | 98 | 149.5 Ų | 149.5 | 69% | 0.685 | 80% | 0.803 | S | S | * | * | trans | -48.6 | 117.4 | -179.2 | 53.3 | 0 | 0 | 0 | 0 | 112 | E37 D41 | E37-S39 VanDerWaalsContact C-N 3.34Å; E37-S39 PolarHBondContact O-N 2.7Å; S39-D41 PolarHBondContact O-N 3.14Å | ||
| 40 | E | 51.4 | Low | 56.1 | Low | 198 Ų | 198 | 154 Ų | 154 | 93% | 0.925 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -78.3 | 53 | -174.1 | -60 | -171.5 | 109.9 | 0 | 0 | 113.5 | L38 | L38-E40 PolarHBondContact O-N 3.41Š|
| 41 | D | 49.5 | Very low | 59.2 | Low | 150 Ų | 150 | 149.7 Ų | 149.7 | 80% | 0.802 | 78% | 0.781 | S | S | * | * | trans | -142.5 | 55.9 | 173.4 | -141.2 | -52.4 | 0 | 0 | 0 | 112.8 | S39 | S39-D41 PolarHBondContact O-N 3.14Š| ||
| 42 | D | 46.3 | Very low | 61.6 | Low | 110 Ų | 110 | 148.7 Ų | 148.7 | 59% | 0.588 | 77% | 0.768 | S | S | * | * | trans | -137 | 90 | 162 | -126.1 | -32.7 | 0 | 0 | 0 | 111.5 | Q44 | D42-Q44 HydrophobicContact CB-CB 4.41Å; D42-Q44 VanDerWaalsContact CG-NE2 3.29Å; D42-Q44 PolarHBondContact O-N 3.09Å; D42-Q44 VanDerWaalsContact OD1-CG 3.24Å; D42-Q44 WeakPolarHBondContact OD1-CG 3.38Å; D42-Q44 PolarHBondContact OD1-N 3.08Å; D42-Q44 PolarHBondContact OD1-NE2 3.02Å; D42-Q44 PolarHBondContact OD2-NE2 3.15Å | ||
| 43 | H | 53.7 | Low | 64.4 | Low | 195 Ų | 195 | 149.4 Ų | 149.4 | 90% | 0.903 | 76% | 0.764 | S | S | * | * | trans | -72.8 | 34.9 | 157.1 | -77.3 | -41.8 | 0 | 0 | 0 | 111.9 | K45 | H43-K45 PolarHBondContact O-N 3.12Å; H43-K45 VanDerWaalsContact O-N 3.12Å | ||
| 44 | Q | 56.6 | Low | 67.1 | Low | 135 Ų | 135 | 145.2 Ų | 145.2 | 63% | 0.631 | 75% | 0.748 | S | S | * | * | trans | -43.7 | 121.6 | 155.6 | -97.4 | 174.8 | 49.1 | 0 | 0 | 108.5 | D42 K46 | D42-Q44 HydrophobicContact CB-CB 4.41Å; D42-Q44 VanDerWaalsContact CG-NE2 3.29Å; D42-Q44 PolarHBondContact O-N 3.09Å; D42-Q44 VanDerWaalsContact OD1-CG 3.24Å; D42-Q44 WeakPolarHBondContact OD1-CG 3.38Å; D42-Q44 PolarHBondContact OD1-N 3.08Å; D42-Q44 PolarHBondContact OD1-NE2 3.02Å; D42-Q44 PolarHBondContact OD2-NE2 3.15Å; Q44-K46 PolarHBondContact O-N 3.41Å | ||
| 45 | K | 69 | Low | 69.6 | Low | 199 Ų | 199 | 139.3 Ų | 139.3 | 87% | 0.865 | 72% | 0.722 | S | S | * | * | trans | -59.5 | 105.8 | 178.6 | -63.1 | 168.5 | -174.9 | 172.6 | 0 | 106.7 | H43 S47 | H43-K45 PolarHBondContact O-N 3.12Å; H43-K45 VanDerWaalsContact O-N 3.12Å; K45-S47 PolarHBondContact O-N 3.35Å | ||
| 46 | K | 82.4 | Confident | 72 | Confident | 206 Ų | 206 | 142.1 Ų | 142.1 | 90% | 0.896 | 72% | 0.722 | S | S | * | * | trans | -54.7 | 103.1 | 179.9 | -48.2 | -177.6 | -171.3 | -166.3 | 0 | 107.5 | Q44 | Q44-K46 PolarHBondContact O-N 3.41Š| ||
| 47 | S | 87 | Confident | 74.1 | Confident | 105 Ų | 105 | 140 Ų | 140 | 73% | 0.734 | 72% | 0.716 | S | S | * | * | trans | -69.3 | 147.6 | 177 | 45.6 | 0 | 0 | 0 | 0 | 109 | K45 K49 | K45-S47 PolarHBondContact O-N 3.35Å; S47-K49 PolarHBondContact O-N 3.25Å | ||
| 48 | A | 93.9 | Very high | 76.4 | Confident | 103 Ų | 103 | 135.3 Ų | 135.3 | 85% | 0.851 | 70% | 0.7 | S | S | * | * | trans | -63.3 | 136.1 | 163.7 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 49 | K | 95.2 | Very high | 78.2 | Confident | 179 Ų | 179 | 134.7 Ų | 134.7 | 78% | 0.778 | 69% | 0.688 | S | S | * | * | trans | -136.1 | 137.4 | 173.5 | 178.7 | 175.1 | 177.7 | -179.3 | 0 | 108.1 | S47 | S47-K49 PolarHBondContact O-N 3.25Š| ||
| 50 | W | 96.1 | Very high | 79.8 | Confident | 199 Ų | 199 | 135.3 Ų | 135.3 | 75% | 0.754 | 68% | 0.679 | S | S | * | * | trans | -80.4 | 150.5 | 175.1 | -60.2 | 111.1 | 0 | 0 | 0 | 111.2 | E52 | W50-E52 PolarHBondContact O-N 2.98Š| ||
| 51 | D | 96.6 | Very high | 80.9 | Confident | 104 Ų | 104 | 128 Ų | 128 | 56% | 0.556 | 65% | 0.65 | S | S | * | * | trans | -89.1 | 94.1 | 169.1 | 179.9 | 5.4 | 0 | 0 | 0 | 108.5 | M53 N54 I55 | D51-M53 PolarHBondContact O-N 2.9Å; D51-M53 VanDerWaalsContact O-N 3.08Å; D51-M53 WeakPolarHBondContact OD1-CB 3.46Å; D51-M53 PolarHBondContact OD1-N 3.31Å; D51-M53 VanDerWaalsContact OD1-N 3.14Å; D51-N54 HydrophobicContact CB-CB 3.95Å; D51-N54 WeakPolarHBondContact O-CA 3.25Å; D51-N54 WeakPolarHBondContact O-CB 3.28Å; D51-N54 PolarHBondContact O-N 2.97Å; D51-I55 PolarHBondContact O-N 3.42Å | ||
| 52 | E | 94.8 | Very high | 81.7 | Confident | 112 Ų | 112 | 126.2 Ų | 126.2 | 52% | 0.523 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -54.7 | -29.2 | -178.8 | -48 | -55.7 | 158.5 | 0 | 0 | 112.5 | W50 L56 | W50-E52 PolarHBondContact O-N 2.98Å; E52-L56 WeakPolarHBondContact O-CB 3.24Å; E52-L56 VanDerWaalsContact O-CG 3.24Å; E52-L56 WeakPolarHBondContact O-CG 3.37Å; E52-L56 PolarHBondContact O-N 3.04Å |
| 53 | M | 94.2 | Very high | 82.4 | Confident | 140 Ų | 140 | 128.2 Ų | 128.2 | 69% | 0.69 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -70.5 | -36.6 | 176.5 | -170.6 | 61.8 | 62.8 | 0 | 0 | 111.5 | D51 A57 | D51-M53 PolarHBondContact O-N 2.9Å; D51-M53 VanDerWaalsContact O-N 3.08Å; D51-M53 WeakPolarHBondContact OD1-CB 3.46Å; D51-M53 PolarHBondContact OD1-N 3.31Å; D51-M53 VanDerWaalsContact OD1-N 3.14Å; M53-A57 VanDerWaalsContact O-CB 3.27Å; M53-A57 WeakPolarHBondContact O-CB 3.18Å; M53-A57 PolarHBondContact O-N 2.85Å |
| 54 | N | 92.3 | Very high | 82.9 | Confident | 91 Ų | 91 | 125 Ų | 125 | 49% | 0.487 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -69.4 | -43 | 174.1 | -179.3 | -112.5 | 0 | 0 | 0 | 111.6 | D51 A57 T58 | D51-N54 HydrophobicContact CB-CB 3.95Å; D51-N54 WeakPolarHBondContact O-CA 3.25Å; D51-N54 WeakPolarHBondContact O-CB 3.28Å; D51-N54 PolarHBondContact O-N 2.97Å; N54-A57 PolarHBondContact O-N 2.89Å; N54-T58 PolarHBondContact O-N 3.36Å; N54-T58 VanDerWaalsContact O-N 3.15Å; N54-T58 PolarHBondContact O-OG1 2.94Å |
| 55 | I | 91.4 | Very high | 83.1 | Confident | 75 Ų | 75 | 122.5 Ų | 122.5 | 39% | 0.385 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -57.4 | -52.8 | 175.1 | -57.4 | -55.2 | 0 | 0 | 0 | 109.9 | D51 A57 T58 Y59 | D51-I55 PolarHBondContact O-N 3.42Å; I55-A57 VanDerWaalsContact C-N 3.32Å; I55-A57 PolarHBondContact O-N 2.84Å; I55-T58 CarbonylContact O-C 3.54Å; I55-T58 PolarHBondContact O-N 3.19Å; I55-T58 VanDerWaalsContact O-N 3.09Å; I55-T58 PolarHBondContact O-OG1 2.96Å; I55-Y59 PolarHBondContact O-N 3.3Å |
| 56 | L | 89.1 | Confident | 82.7 | Confident | 117 Ų | 117 | 120 Ų | 120 | 61% | 0.613 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -60.7 | -35.7 | 177.7 | -71.9 | 170.8 | 0 | 0 | 0 | 113.5 | E52 T58 Y59 | E52-L56 WeakPolarHBondContact O-CB 3.24Å; E52-L56 VanDerWaalsContact O-CG 3.24Å; E52-L56 WeakPolarHBondContact O-CG 3.37Å; E52-L56 PolarHBondContact O-N 3.04Å; L56-T58 VanDerWaalsContact C-N 3.26Å; L56-T58 PolarHBondContact O-N 3.38Å; L56-Y59 PolarHBondContact O-N 3.49Å |
| 57 | A | 88.5 | Confident | 81.8 | Confident | 83 Ų | 83 | 113.9 Ų | 113.9 | 69% | 0.686 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -67.4 | -26.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | M53 N54 I55 | M53-A57 VanDerWaalsContact O-CB 3.27Å; M53-A57 WeakPolarHBondContact O-CB 3.18Å; M53-A57 PolarHBondContact O-N 2.85Å; N54-A57 PolarHBondContact O-N 2.89Å; I55-A57 VanDerWaalsContact C-N 3.32Å; I55-A57 PolarHBondContact O-N 2.84Å |
| 58 | T | 86.8 | Confident | 80.6 | Confident | 86 Ų | 86 | 114 Ų | 114 | 53% | 0.528 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -96.4 | -10.4 | 174.3 | 59.9 | 0 | 0 | 0 | 0 | 114 | N54 I55 L56 H60 | N54-T58 PolarHBondContact O-N 3.36Å; N54-T58 VanDerWaalsContact O-N 3.15Å; N54-T58 PolarHBondContact O-OG1 2.94Å; I55-T58 CarbonylContact O-C 3.54Å; I55-T58 PolarHBondContact O-N 3.19Å; I55-T58 VanDerWaalsContact O-N 3.09Å; I55-T58 PolarHBondContact O-OG1 2.96Å; L56-T58 VanDerWaalsContact C-N 3.26Å; L56-T58 PolarHBondContact O-N 3.38Å; T58-H60 PolarHBondContact O-CE1 2.9Å; T58-H60 PolarHBondContact O-N 2.81Å; T58-H60 PolarHBondContact O-ND1 3.39Å |
| 59 | Y | 83.6 | Confident | 79.3 | Confident | 144 Ų | 144 | 116.5 Ų | 116.5 | 57% | 0.565 | 60% | 0.6 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 124.3 | 179.3 | -176.4 | -103.7 | 0 | 0 | 0 | 110.6 | I55 L56 P61 | I55-Y59 PolarHBondContact O-N 3.3Å; L56-Y59 PolarHBondContact O-N 3.49Å; Y59-P61 WeakPolarHBondContact O-CD 3.27Å |
| 60 | H | 76.9 | Confident | 78.2 | Confident | 110 Ų | 110 | 117.5 Ų | 117.5 | 51% | 0.509 | 60% | 0.604 | S | S | . | * | P | Polyproline II helix | trans | -86.8 | 119.9 | 179.1 | -66.4 | 40.9 | 0 | 0 | 0 | 108 | T58 Y66 | T58-H60 PolarHBondContact O-CE1 2.9Å; T58-H60 PolarHBondContact O-N 2.81Å; T58-H60 PolarHBondContact O-ND1 3.39Å; H60-Y66 HydrophobicContact CB-CD2 4Å; H60-Y66 HydrophobicContact CB-CE2 3.84Å; H60-Y66 AromaticContact CD2-CD2 3.18Å; H60-Y66 WeakPolarHBondContact CD2-CD2 3.49Å; H60-Y66 AromaticContact CD2-CE2 3.64Å; H60-Y66 AromaticContact CD2-CG 3.67Å; H60-Y66 AromaticContact CG-CD2 3.74Å; H60-Y66 AromaticContact CG-CE2 3.74Å; H60-Y66 AromaticContact NE2-CD2 3.97Å |
| 61 | P | 74.5 | Confident | 76.9 | Confident | 46 Ų | 46 | 113.7 Ų | 113.7 | 30% | 0.299 | 60% | 0.598 | S | S | . | * | P | Polyproline II helix | trans | -59.9 | 145.9 | 179.6 | -24.5 | 35.3 | 0 | 0 | 0 | 111.4 | Y59 D63 K64 | Y59-P61 WeakPolarHBondContact O-CD 3.27Å; P61-D63 PolarHBondContact O-N 3.05Å; P61-K64 PolarHBondContact O-N 3.26Å |
| 62 | P | 66.6 | Low | 75.9 | Confident | 111 Ų | 111 | 116.9 Ų | 116.9 | 72% | 0.721 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.6 | -27.8 | -177.3 | 23 | -34.4 | 0 | 0 | 0 | 113.2 | K64 | P62-K64 VanDerWaalsContact C-N 3.28Å; P62-K64 PolarHBondContact O-N 3.49Å |
| 63 | D | 62.1 | Low | 75.1 | Confident | 152 Ų | 152 | 117.8 Ų | 117.8 | 81% | 0.813 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | 3.1 | 179.5 | -48.1 | -40.3 | 0 | 0 | 0 | 114.1 | P61 | P61-D63 PolarHBondContact O-N 3.05Š|
| 64 | K | 64.2 | Low | 74.3 | Confident | 128 Ų | 128 | 116.8 Ų | 116.8 | 56% | 0.557 | 62% | 0.623 | S | S | * | * | trans | -135.3 | 94.3 | -173.6 | -69 | -175.8 | -178.8 | 176.7 | 0 | 112.6 | P61 P62 Y66 | P61-K64 PolarHBondContact O-N 3.26Å; P62-K64 VanDerWaalsContact C-N 3.28Å; P62-K64 PolarHBondContact O-N 3.49Å; K64-Y66 HydrophobicContact CB-CD2 4.2Å; K64-Y66 HydrophobicContact CB-CE2 4.04Å; K64-Y66 VanDerWaalsContact O-CD2 3.27Å; K64-Y66 WeakPolarHBondContact O-CD2 3.42Å; K64-Y66 PolarHBondContact O-N 2.98Å | ||
| 65 | D | 59.8 | Low | 73.6 | Confident | 83 Ų | 83 | 116.5 Ų | 116.5 | 44% | 0.444 | 63% | 0.628 | S | S | . | * | trans | -76.6 | 95.9 | 164.1 | -160.1 | -17 | 0 | 0 | 0 | 108.9 | G67 L68 K143 | D65-G67 PolarHBondContact O-N 3.06Å; D65-L68 HydrophobicContact CB-CB 3.87Å; D65-L68 VanDerWaalsContact CG-CB 3.42Å; D65-L68 PolarHBondContact O-N 3.1Å; D65-L68 VanDerWaalsContact O-N 3.09Å; D65-L68 WeakPolarHBondContact OD2-CB 3.45Å; D65-L68 VanDerWaalsContact OD2-CD2 3.29Å; D65-L68 WeakPolarHBondContact OD2-CD2 3.33Å; D65-K143 IonicContact OD2-NZ 2.92Å; D65-K143 PolarHBondContact OD2-NZ 3Å | ||
| 66 | Y | 60.6 | Low | 72.9 | Confident | 146 Ų | 146 | 116.9 Ų | 116.9 | 57% | 0.573 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.9 | 97.3 | -176 | -78.3 | -112.3 | 0 | 0 | 0 | 110.4 | H60 K64 | H60-Y66 HydrophobicContact CB-CD2 4Å; H60-Y66 HydrophobicContact CB-CE2 3.84Å; H60-Y66 AromaticContact CD2-CD2 3.18Å; H60-Y66 WeakPolarHBondContact CD2-CD2 3.49Å; H60-Y66 AromaticContact CD2-CE2 3.64Å; H60-Y66 AromaticContact CD2-CG 3.67Å; H60-Y66 AromaticContact CG-CD2 3.74Å; H60-Y66 AromaticContact CG-CE2 3.74Å; H60-Y66 AromaticContact NE2-CD2 3.97Å; K64-Y66 HydrophobicContact CB-CD2 4.2Å; K64-Y66 HydrophobicContact CB-CE2 4.04Å; K64-Y66 VanDerWaalsContact O-CD2 3.27Å; K64-Y66 WeakPolarHBondContact O-CD2 3.42Å; K64-Y66 PolarHBondContact O-N 2.98Å |
| 67 | G | 64.5 | Low | 72.6 | Confident | 77 Ų | 77 | 117.2 Ų | 117.2 | 79% | 0.794 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 111.7 | -3.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | D65 | D65-G67 PolarHBondContact O-N 3.06Š|
| 68 | L | 60.1 | Low | 71.6 | Confident | 107 Ų | 107 | 122 Ų | 122 | 56% | 0.56 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.3 | 2.4 | -179.8 | -135.5 | 78.4 | 0 | 0 | 0 | 115.5 | D65 K70 | D65-L68 HydrophobicContact CB-CB 3.87Å; D65-L68 VanDerWaalsContact CG-CB 3.42Å; D65-L68 PolarHBondContact O-N 3.1Å; D65-L68 VanDerWaalsContact O-N 3.09Å; D65-L68 WeakPolarHBondContact OD2-CB 3.45Å; D65-L68 VanDerWaalsContact OD2-CD2 3.29Å; D65-L68 WeakPolarHBondContact OD2-CD2 3.33Å; L68-K70 PolarHBondContact O-N 3.11Å |
| 69 | M | 66.9 | Low | 70.5 | Confident | 157 Ų | 157 | 122.6 Ų | 122.6 | 77% | 0.773 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -66.9 | 124.4 | 164 | -69.4 | -167.9 | -67.1 | 0 | 0 | 109.4 | I71 | M69-I71 PolarHBondContact O-N 2.85Å; M69-I71 VanDerWaalsContact O-N 3.11Å |
| 70 | K | 72.8 | Confident | 69.5 | Low | 199 Ų | 199 | 126.9 Ų | 126.9 | 87% | 0.865 | 66% | 0.66 | S | S | * | * | trans | -63.1 | 113 | 161.7 | -60.2 | -62.8 | -176.3 | -180 | 0 | 106.6 | L68 | L68-K70 PolarHBondContact O-N 3.11Š| ||
| 71 | I | 69.4 | Low | 68.6 | Low | 120 Ų | 120 | 129.6 Ų | 129.6 | 62% | 0.615 | 68% | 0.675 | S | S | * | * | trans | -74.8 | 130.1 | 176.8 | -44.2 | 176.6 | 0 | 0 | 0 | 106.9 | M69 E73 | M69-I71 PolarHBondContact O-N 2.85Å; M69-I71 VanDerWaalsContact O-N 3.11Å; I71-E73 HydrophobicContact CB-CB 4.42Å; I71-E73 HydrophobicContact CB-CG 4.47Å; I71-E73 HydrophobicContact CG2-CB 4.07Å; I71-E73 HydrophobicContact CG2-CG 3.67Å; I71-E73 PolarHBondContact O-N 3.35Å | ||
| 72 | D | 74 | Confident | 67.9 | Low | 171 Ų | 171 | 135 Ų | 135 | 91% | 0.914 | 70% | 0.7 | S | S | * | * | trans | -70.3 | 29.1 | 170.6 | -73.9 | -36.1 | 0 | 0 | 0 | 112.6 | ||||
| 73 | E | 78.7 | Confident | 67 | Low | 130 Ų | 130 | 132.9 Ų | 132.9 | 61% | 0.607 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -68.6 | 133.4 | 166.6 | -85.1 | 173.4 | -152 | 0 | 0 | 108.6 | I71 S75 | I71-E73 HydrophobicContact CB-CB 4.42Å; I71-E73 HydrophobicContact CB-CG 4.47Å; I71-E73 HydrophobicContact CG2-CB 4.07Å; I71-E73 HydrophobicContact CG2-CG 3.67Å; I71-E73 PolarHBondContact O-N 3.35Å; E73-S75 PolarHBondContact O-N 3.09Å; E73-S75 VanDerWaalsContact O-N 3.1Å |
| 74 | P | 77.6 | Confident | 66.2 | Low | 120 Ų | 120 | 131.7 Ų | 131.7 | 78% | 0.779 | 70% | 0.696 | S | S | * | * | trans | -58.9 | 122.7 | 176.5 | 25.3 | -33.3 | 0 | 0 | 0 | 108.7 | T76 | P74-T76 PolarHBondContact O-N 2.91Š| ||
| 75 | S | 77.6 | Confident | 65.4 | Low | 85 Ų | 85 | 132.7 Ų | 132.7 | 59% | 0.594 | 71% | 0.708 | S | S | * | * | trans | -41 | 116.6 | -176.1 | -172.5 | 0 | 0 | 0 | 0 | 110.8 | E73 N79 | E73-S75 PolarHBondContact O-N 3.09Å; E73-S75 VanDerWaalsContact O-N 3.1Å; S75-N79 WeakPolarHBondContact OG-CB 3.45Å; S75-N79 PolarHBondContact OG-ND2 2.92Å | ||
| 76 | T | 76.4 | Confident | 64.7 | Low | 83 Ų | 83 | 136.6 Ų | 136.6 | 51% | 0.509 | 73% | 0.729 | S | S | . | * | trans | -58.8 | 141 | -178.1 | 64.7 | 0 | 0 | 0 | 0 | 108.6 | P74 Y78 N79 | P74-T76 PolarHBondContact O-N 2.91Å; T76-Y78 PolarHBondContact O-N 3.17Å; T76-N79 WeakPolarHBondContact O-CB 3.29Å; T76-N79 PolarHBondContact O-N 2.77Å | ||
| 77 | P | 82.9 | Confident | 63.9 | Low | 123 Ų | 123 | 137.5 Ų | 137.5 | 80% | 0.799 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57 | -11.1 | -169.1 | -30.6 | 36.9 | 0 | 0 | 0 | 116.7 | ||
| 78 | Y | 66.6 | Low | 63.2 | Low | 183 Ų | 183 | 140.4 Ų | 140.4 | 72% | 0.718 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93 | -7.5 | -178.2 | -58.7 | -75.9 | 0 | 0 | 0 | 114.6 | T76 R80 M81 | T76-Y78 PolarHBondContact O-N 3.17Å; Y78-R80 PolarHBondContact O-N 2.88Å; Y78-M81 PolarHBondContact O-N 3.04Å |
| 79 | N | 65.3 | Low | 62.6 | Low | 99 Ų | 99 | 143.3 Ų | 143.3 | 53% | 0.529 | 75% | 0.752 | S | S | . | * | G | 310 helix | trans | -61.5 | -17.9 | -172.1 | -149 | 7.3 | 0 | 0 | 0 | 114.4 | S75 T76 M81 | S75-N79 WeakPolarHBondContact OG-CB 3.45Å; S75-N79 PolarHBondContact OG-ND2 2.92Å; T76-N79 WeakPolarHBondContact O-CB 3.29Å; T76-N79 PolarHBondContact O-N 2.77Å; N79-M81 VanDerWaalsContact C-N 3.27Å; N79-M81 PolarHBondContact O-N 3Å |
| 80 | R | 62.7 | Low | 61.8 | Low | 235 Ų | 235 | 138.9 Ų | 138.9 | 89% | 0.887 | 75% | 0.746 | S | S | * | * | G | 310 helix | trans | -67.8 | -18.7 | 178.2 | -179.3 | 177 | -73.6 | -91 | 1.1 | 114.2 | Y78 L82 | Y78-R80 PolarHBondContact O-N 2.88Å; R80-L82 PolarHBondContact O-N 3.27Å |
| 81 | M | 57.8 | Low | 60.3 | Low | 166 Ų | 166 | 134.6 Ų | 134.6 | 82% | 0.818 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -85 | 0.8 | -173.5 | -77.9 | 177.4 | 66.3 | 0 | 0 | 115.2 | Y78 N79 | Y78-M81 PolarHBondContact O-N 3.04Å; N79-M81 VanDerWaalsContact C-N 3.27Å; N79-M81 PolarHBondContact O-N 3Å |
| 82 | L | 58.7 | Low | 59.4 | Low | 160 Ų | 160 | 137.5 Ų | 137.5 | 84% | 0.838 | 76% | 0.763 | S | S | * | * | G | 310 helix | trans | -127 | 17.2 | -168.8 | -61.4 | 177.3 | 0 | 0 | 0 | 115.4 | R80 | R80-L82 PolarHBondContact O-N 3.27Š|
| 83 | G | 48 | Very low | 57.9 | Low | 66 Ų | 66 | 135.5 Ų | 135.5 | 68% | 0.68 | 76% | 0.763 | S | S | * | * | trans | -132.5 | 96.8 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 84 | V | 46.4 | Very low | 56.9 | Low | 127 Ų | 127 | 136.6 Ų | 136.6 | 77% | 0.77 | 77% | 0.773 | S | S | * | * | trans | -158.4 | 109.9 | 168.7 | 171.7 | 0 | 0 | 0 | 0 | 103.9 | ||||
| 85 | D | 45.9 | Very low | 55.1 | Low | 150 Ų | 150 | 136.7 Ų | 136.7 | 80% | 0.802 | 78% | 0.777 | S | S | * | * | cis | -144.8 | 160.5 | -0.1 | -65.8 | -53.7 | 0 | 0 | 0 | 108.9 | ||||
| 86 | D | 45.3 | Very low | 53.4 | Low | 164 Ų | 164 | 141.7 Ų | 141.7 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | trans | -136.5 | 132.5 | 177.1 | -98.3 | -37.2 | 0 | 0 | 0 | 110.5 | ||||
| 87 | D | 45 | Very low | 52 | Low | 166 Ų | 166 | 140.8 Ų | 140.8 | 89% | 0.888 | 80% | 0.798 | S | S | * | * | trans | -177.2 | 155.4 | 169.3 | -88.9 | -35.7 | 0 | 0 | 0 | 107.8 | ||||
| 88 | D | 48.2 | Very low | 50 | Low | 138 Ų | 138 | 144.4 Ų | 144.4 | 74% | 0.738 | 80% | 0.804 | S | S | * | * | cis | -163.9 | 172.3 | -32.9 | -165.9 | 10.5 | 0 | 0 | 0 | 108.8 | ||||
| 89 | E | 48.1 | Very low | 49.2 | Very low | 168 Ų | 168 | 141.2 Ų | 141.2 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | trans | 66.2 | 148.5 | 170.6 | -62.7 | -80.7 | -165.6 | 0 | 0 | 119 | ||||
| 90 | G | 50.1 | Low | 48.7 | Very low | 64 Ų | 64 | 139.8 Ų | 139.8 | 66% | 0.66 | 82% | 0.817 | S | S | * | * | cis | 133.3 | 90.5 | -5.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 91 | A | 42.7 | Very low | 48.3 | Very low | 108 Ų | 108 | 132.7 Ų | 132.7 | 89% | 0.893 | 82% | 0.817 | S | S | * | * | trans | -163.9 | 159.9 | 169.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 92 | L | 50.5 | Low | 48.4 | Very low | 181 Ų | 181 | 129.2 Ų | 129.2 | 95% | 0.948 | 80% | 0.801 | S | S | * | * | trans | -127.2 | 157.4 | -170.3 | -57.1 | 164.7 | 0 | 0 | 0 | 113 | ||||
| 93 | S | 42.5 | Very low | 49.2 | Very low | 130 Ų | 130 | 123.7 Ų | 123.7 | 91% | 0.909 | 78% | 0.778 | S | S | * | * | trans | -167.3 | 151 | 145.4 | -163.3 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 94 | D | 56 | Low | 50.2 | Low | 152 Ų | 152 | 125.9 Ų | 125.9 | 81% | 0.813 | 78% | 0.78 | S | S | * | * | trans | -131.7 | 154.3 | -177.4 | 176.9 | 24.6 | 0 | 0 | 0 | 110.7 | ||||
| 95 | S | 40.8 | Very low | 51.4 | Low | 122 Ų | 122 | 127 Ų | 127 | 85% | 0.853 | 78% | 0.777 | S | S | * | * | trans | -168.8 | 142 | 165.8 | -169.8 | 0 | 0 | 0 | 0 | 114 | ||||
| 96 | E | 42.3 | Very low | 52.8 | Low | 190 Ų | 190 | 123.1 Ų | 123.1 | 89% | 0.888 | 76% | 0.757 | S | S | * | * | trans | -104.1 | 138.1 | -158.2 | 178.7 | 176.8 | 104 | 0 | 0 | 116.6 | ||||
| 97 | G | 47.1 | Very low | 54.2 | Low | 65 Ų | 65 | 119.7 Ų | 119.7 | 67% | 0.67 | 74% | 0.737 | S | S | * | * | 73.7 | 128.3 | 128.2 | 0 | 0 | 0 | 0 | 0 | 123.6 | |||||
| 98 | H | 39.4 | Very low | 55.9 | Low | 198 Ų | 198 | 114.5 Ų | 114.5 | 92% | 0.917 | 72% | 0.718 | S | S | * | * | trans | -158.4 | 140.1 | 142.7 | -133.9 | 67.1 | 0 | 0 | 0 | 115.5 | ||||
| 99 | S | 51 | Low | 57.4 | Low | 117 Ų | 117 | 111 Ų | 111 | 82% | 0.818 | 70% | 0.704 | S | S | * | * | trans | -128.8 | 129.6 | 172.6 | 58.9 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 100 | G | 53.5 | Low | 58.8 | Low | 68 Ų | 68 | 108.4 Ų | 108.4 | 70% | 0.701 | 69% | 0.69 | S | S | * | * | trans | 170.3 | 119.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 101 | G | 55.3 | Low | 60.1 | Low | 86 Ų | 86 | 111.6 Ų | 111.6 | 89% | 0.887 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 151.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 102 | L | 60.6 | Low | 62 | Low | 94 Ų | 94 | 113.5 Ų | 113.5 | 49% | 0.492 | 68% | 0.682 | S | S | . | * | P | Polyproline II helix | trans | -92.1 | 145 | -164.7 | -54.1 | 162.8 | 0 | 0 | 0 | 113.2 | D106 K110 | L102-D106 HydrophobicContact CB-CB 4.42Å; L102-K110 HydrophobicContact CD1-CD 4.15Å; L102-K110 VanDerWaalsContact CD2-NZ 3.33Å |
| 103 | A | 75.4 | Confident | 63.1 | Low | 43 Ų | 43 | 108.7 Ų | 108.7 | 36% | 0.355 | 67% | 0.668 | S | S | . | * | P | Polyproline II helix | trans | -82 | 161.5 | 179 | 0 | 0 | 0 | 0 | 0 | 112.9 | H105 D106 L107 | A103-H105 PolarHBondContact O-N 3.01Å; A103-D106 VanDerWaalsContact CB-OD2 3.3Å; A103-D106 WeakPolarHBondContact CB-OD2 3.43Å; A103-D106 PolarHBondContact N-OD2 2.79Å; A103-D106 WeakPolarHBondContact O-CB 3.36Å; A103-D106 PolarHBondContact O-N 3.14Å; A103-L107 PolarHBondContact O-N 3.01Å |
| 104 | P | 67.6 | Low | 64.4 | Low | 112 Ų | 112 | 105 Ų | 105 | 73% | 0.727 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -60.2 | -30.6 | -178.4 | -25.4 | 35.2 | 0 | 0 | 0 | 114.5 | A108 | P104-A108 PolarHBondContact O-N 2.99Å; P104-A108 VanDerWaalsContact O-N 3.09Å |
| 105 | H | 72.6 | Confident | 64.9 | Low | 150 Ų | 150 | 106 Ų | 106 | 69% | 0.694 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -70.5 | -38 | 174.4 | -174.8 | -83.2 | 0 | 0 | 0 | 111.8 | A103 L107 A108 S109 | A103-H105 PolarHBondContact O-N 3.01Å; H105-L107 VanDerWaalsContact C-N 3.31Å; H105-L107 PolarHBondContact O-N 3.17Å; H105-A108 PolarHBondContact O-N 3.34Å; H105-S109 PolarHBondContact O-N 3.21Å |
| 106 | D | 75 | Confident | 66.1 | Low | 70 Ų | 70 | 104.2 Ų | 104.2 | 37% | 0.374 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -67.1 | -36 | 175.5 | -47.3 | -30.3 | 0 | 0 | 0 | 110.7 | L102 A103 K110 | L102-D106 HydrophobicContact CB-CB 4.42Å; A103-D106 VanDerWaalsContact CB-OD2 3.3Å; A103-D106 WeakPolarHBondContact CB-OD2 3.43Å; A103-D106 PolarHBondContact N-OD2 2.79Å; A103-D106 WeakPolarHBondContact O-CB 3.36Å; A103-D106 PolarHBondContact O-N 3.14Å; D106-K110 VanDerWaalsContact O-CB 3.28Å; D106-K110 WeakPolarHBondContact O-CB 3.4Å; D106-K110 WeakPolarHBondContact O-CG 3.39Å; D106-K110 PolarHBondContact O-N 2.81Å |
| 107 | L | 74.7 | Confident | 67.1 | Low | 91 Ų | 91 | 98.3 Ų | 98.3 | 48% | 0.476 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -65 | -44.1 | 173.5 | -72.9 | 169.9 | 0 | 0 | 0 | 111.9 | A103 H105 K110 L111 | A103-L107 PolarHBondContact O-N 3.01Å; H105-L107 VanDerWaalsContact C-N 3.31Å; H105-L107 PolarHBondContact O-N 3.17Å; L107-K110 PolarHBondContact O-N 3.13Å; L107-L111 WeakPolarHBondContact O-CG 3.3Å; L107-L111 PolarHBondContact O-N 2.9Å; L107-L111 VanDerWaalsContact O-N 3.07Å |
| 108 | A | 81 | Confident | 68 | Low | 57 Ų | 57 | 101.2 Ų | 101.2 | 47% | 0.471 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -61 | -47.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | P104 H105 K110 L111 E112 | P104-A108 PolarHBondContact O-N 2.99Å; P104-A108 VanDerWaalsContact O-N 3.09Å; H105-A108 PolarHBondContact O-N 3.34Å; A108-K110 VanDerWaalsContact C-N 3.33Å; A108-K110 PolarHBondContact O-N 3.44Å; A108-L111 PolarHBondContact O-N 3.3Å; A108-E112 PolarHBondContact O-N 3.01Å |
| 109 | S | 79.3 | Confident | 69.2 | Low | 66 Ų | 66 | 95.4 Ų | 95.4 | 46% | 0.462 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -65.2 | -33.6 | 177.6 | -174.4 | 0 | 0 | 0 | 0 | 112.8 | H105 A113 | H105-S109 PolarHBondContact O-N 3.21Å; S109-A113 WeakPolarHBondContact O-CB 3.47Å; S109-A113 PolarHBondContact O-N 2.83Å |
| 110 | K | 77.3 | Confident | 69.6 | Low | 112 Ų | 112 | 99 Ų | 99 | 49% | 0.487 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -68.3 | -30.3 | 173.2 | -79.9 | 178.6 | -179.3 | -161.8 | 0 | 113.8 | L102 D106 L107 A108 A114 | L102-K110 HydrophobicContact CD1-CD 4.15Å; L102-K110 VanDerWaalsContact CD2-NZ 3.33Å; D106-K110 VanDerWaalsContact O-CB 3.28Å; D106-K110 WeakPolarHBondContact O-CB 3.4Å; D106-K110 WeakPolarHBondContact O-CG 3.39Å; D106-K110 PolarHBondContact O-N 2.81Å; L107-K110 PolarHBondContact O-N 3.13Å; A108-K110 VanDerWaalsContact C-N 3.33Å; A108-K110 PolarHBondContact O-N 3.44Å; K110-A114 WeakPolarHBondContact O-CB 3.46Å; K110-A114 PolarHBondContact O-N 3.08Å; K110-A114 VanDerWaalsContact O-N 3.15Å |
| 111 | L | 77.7 | Confident | 69.7 | Low | 131 Ų | 131 | 103.6 Ų | 103.6 | 69% | 0.686 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -72.6 | -44 | 175.8 | -71.5 | 169.1 | 0 | 0 | 0 | 111.2 | L107 A108 A113 A114 E115 | L107-L111 WeakPolarHBondContact O-CG 3.3Å; L107-L111 PolarHBondContact O-N 2.9Å; L107-L111 VanDerWaalsContact O-N 3.07Å; A108-L111 PolarHBondContact O-N 3.3Å; L111-A113 VanDerWaalsContact C-N 3.35Å; L111-A113 PolarHBondContact O-N 3.43Å; L111-A114 PolarHBondContact O-N 3.14Å; L111-A114 VanDerWaalsContact O-N 3.09Å; L111-E115 PolarHBondContact O-N 3.5Å |
| 112 | E | 83.5 | Confident | 69.7 | Low | 149 Ų | 149 | 104.3 Ų | 104.3 | 70% | 0.696 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -63.9 | -39.1 | 175.4 | -168.6 | 170.6 | -149.1 | 0 | 0 | 111.6 | A108 A114 E115 | A108-E112 PolarHBondContact O-N 3.01Å; E112-A114 VanDerWaalsContact C-N 3.26Å; E112-A114 PolarHBondContact O-N 2.87Å; E112-E115 WeakPolarHBondContact O-CB 3.43Å; E112-E115 PolarHBondContact O-N 3.11Å |
| 113 | A | 73.5 | Confident | 69.6 | Low | 80 Ų | 80 | 106.1 Ų | 106.1 | 66% | 0.661 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -70.1 | -17.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | S109 L111 | S109-A113 WeakPolarHBondContact O-CB 3.47Å; S109-A113 PolarHBondContact O-N 2.83Å; L111-A113 VanDerWaalsContact C-N 3.35Å; L111-A113 PolarHBondContact O-N 3.43Å |
| 114 | A | 68.4 | Low | 68.7 | Low | 53 Ų | 53 | 110.5 Ų | 110.5 | 44% | 0.438 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -88.2 | -12.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | K110 L111 E112 G116 A117 | K110-A114 WeakPolarHBondContact O-CB 3.46Å; K110-A114 PolarHBondContact O-N 3.08Å; K110-A114 VanDerWaalsContact O-N 3.15Å; L111-A114 PolarHBondContact O-N 3.14Å; L111-A114 VanDerWaalsContact O-N 3.09Å; E112-A114 VanDerWaalsContact C-N 3.26Å; E112-A114 PolarHBondContact O-N 2.87Å; A114-G116 VanDerWaalsContact C-N 3.3Å; A114-G116 PolarHBondContact O-N 2.9Å; A114-A117 PolarHBondContact O-N 2.68Å |
| 115 | E | 67.6 | Low | 68 | Low | 172 Ų | 172 | 109.4 Ų | 109.4 | 80% | 0.804 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.6 | 81.5 | 177 | -166.9 | 166.9 | -173.9 | 0 | 0 | 110.4 | L111 E112 | L111-E115 PolarHBondContact O-N 3.5Å; E112-E115 WeakPolarHBondContact O-CB 3.43Å; E112-E115 PolarHBondContact O-N 3.11Å |
| 116 | G | 64.6 | Low | 67 | Low | 85 Ų | 85 | 109 Ų | 109 | 88% | 0.876 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 130.5 | -8.1 | -171.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | A114 | A114-G116 VanDerWaalsContact C-N 3.3Å; A114-G116 PolarHBondContact O-N 2.9Å |
| 117 | A | 64 | Low | 65.6 | Low | 66 Ų | 66 | 111.6 Ų | 111.6 | 55% | 0.545 | 61% | 0.61 | S | S | . | * | S | Bend | trans | -83.6 | 136.2 | 172 | 0 | 0 | 0 | 0 | 0 | 111 | A114 | A114-A117 PolarHBondContact O-N 2.68Š|
| 118 | E | 66.1 | Low | 64.2 | Low | 125 Ų | 125 | 112.4 Ų | 112.4 | 58% | 0.584 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 138.3 | -177.9 | -154.6 | 172.5 | -166.9 | 0 | 0 | 111.7 | M122 | E118-M122 HydrophobicContact CB-CB 4.47Å; E118-M122 HydrophobicContact CG-CB 3.65Å; E118-M122 HydrophobicContact CG-CG 3.76Å; E118-M122 WeakPolarHBondContact OE1-CG 3.33Å |
| 119 | P | 64.8 | Low | 62.6 | Low | 76 Ų | 76 | 111 Ų | 111 | 49% | 0.494 | 61% | 0.61 | S | S | . | * | P | Polyproline II helix | trans | -60.2 | 147.5 | -175.5 | 22.7 | -35.9 | 0 | 0 | 0 | 113.1 | F121 M122 | P119-F121 HydrophobicContact CB-CD1 4.12Å; P119-F121 HydrophobicContact CB-CE1 4.41Å; P119-F121 HydrophobicContact CG-CD1 3.93Å; P119-F121 HydrophobicContact CG-CE1 3.74Å; P119-F121 PolarHBondContact O-N 2.88Å; P119-M122 HydrophobicContact CG-CG 4.46Å; P119-M122 WeakPolarHBondContact O-CB 3.45Å; P119-M122 PolarHBondContact O-N 3.48Å |
| 120 | R | 59.4 | Low | 60.9 | Low | 192 Ų | 192 | 114.3 Ų | 114.3 | 73% | 0.725 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.4 | -20.7 | -173.2 | -76.6 | -174.3 | 173.4 | -115.3 | 0.9 | 116.6 | M122 K123 E127 | R120-M122 VanDerWaalsContact C-N 3.32Å; R120-K123 PolarHBondContact O-N 3.31Å; R120-E127 IonicContact CZ-OE2 3.41Å; R120-E127 IonicContact NH1-OE2 3.15Å; R120-E127 PolarHBondContact NH1-OE2 3.37Å |
| 121 | F | 55.5 | Low | 59.2 | Low | 165 Ų | 165 | 118 Ų | 118 | 72% | 0.724 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -20.6 | 176.3 | 91.8 | -91.3 | 0 | 0 | 0 | 113.7 | P119 | P119-F121 HydrophobicContact CB-CD1 4.12Å; P119-F121 HydrophobicContact CB-CE1 4.41Å; P119-F121 HydrophobicContact CG-CD1 3.93Å; P119-F121 HydrophobicContact CG-CE1 3.74Å; P119-F121 PolarHBondContact O-N 2.88Å |
| 122 | M | 55.4 | Low | 57.7 | Low | 102 Ų | 102 | 118.1 Ų | 118.1 | 50% | 0.502 | 63% | 0.634 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.7 | -15.7 | 173.9 | -66 | -72.1 | -145.1 | 0 | 0 | 112.2 | E118 P119 R120 | E118-M122 HydrophobicContact CB-CB 4.47Å; E118-M122 HydrophobicContact CG-CB 3.65Å; E118-M122 HydrophobicContact CG-CG 3.76Å; E118-M122 WeakPolarHBondContact OE1-CG 3.33Å; P119-M122 HydrophobicContact CG-CG 4.46Å; P119-M122 WeakPolarHBondContact O-CB 3.45Å; P119-M122 PolarHBondContact O-N 3.48Å; R120-M122 VanDerWaalsContact C-N 3.32Å |
| 123 | K | 57.4 | Low | 56 | Low | 131 Ų | 131 | 112.3 Ų | 112.3 | 57% | 0.57 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -72.4 | 128.7 | 164.2 | -70.5 | -173.1 | 171 | -169.8 | 0 | 107.9 | R120 | R120-K123 PolarHBondContact O-N 3.31Š|
| 124 | E | 58.3 | Low | 54.9 | Low | 136 Ų | 136 | 117.2 Ų | 117.2 | 64% | 0.636 | 62% | 0.616 | S | S | * | * | trans | -53.2 | 142.8 | 173.6 | -65.6 | -164.2 | -168.5 | 0 | 0 | 109.9 | E126 K152 | E124-E126 HydrophobicContact CB-CG 4.39Å; E124-E126 PolarHBondContact O-N 3.34Å; E124-K152 IonicContact OE2-NZ 2.81Å; E124-K152 PolarHBondContact OE2-NZ 3.2Å | ||
| 125 | A | 52.2 | Low | 54.2 | Low | 89 Ų | 89 | 123.9 Ų | 123.9 | 74% | 0.736 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | 46.9 | -164.8 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 126 | E | 52.3 | Low | 53.8 | Low | 142 Ų | 142 | 118.8 Ų | 118.8 | 66% | 0.664 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | -41.7 | -177.4 | -52.9 | -145.2 | 141.8 | 0 | 0 | 111.4 | E124 S128 S129 | E124-E126 HydrophobicContact CB-CG 4.39Å; E124-E126 PolarHBondContact O-N 3.34Å; E126-S128 PolarHBondContact O-N 2.85Å; E126-S128 VanDerWaalsContact O-N 3.11Å; E126-S129 PolarHBondContact O-N 3.41Å |
| 127 | E | 43.7 | Very low | 54.4 | Low | 123 Ų | 123 | 118.7 Ų | 118.7 | 58% | 0.575 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.7 | -20.4 | -178.5 | -66.8 | -178.6 | -174.6 | 0 | 0 | 114.3 | R120 | R120-E127 IonicContact CZ-OE2 3.41Å; R120-E127 IonicContact NH1-OE2 3.15Å; R120-E127 PolarHBondContact NH1-OE2 3.37Å |
| 128 | S | 45.9 | Very low | 55.1 | Low | 108 Ų | 108 | 120.4 Ų | 120.4 | 76% | 0.755 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88 | -8.8 | -176.4 | -169.9 | 0 | 0 | 0 | 0 | 114.2 | E126 | E126-S128 PolarHBondContact O-N 2.85Å; E126-S128 VanDerWaalsContact O-N 3.11Å |
| 129 | S | 47.4 | Very low | 55.5 | Low | 27 Ų | 27 | 121 Ų | 121 | 19% | 0.189 | 61% | 0.607 | C | S | . | * | S | Bend | trans | -91.1 | -11.9 | 176.1 | -172.9 | 0 | 0 | 0 | 0 | 112.5 | E126 | E126-S129 PolarHBondContact O-N 3.41Š|
| 130 | E | 43.5 | Very low | 56.2 | Low | 137 Ų | 137 | 120 Ų | 120 | 64% | 0.64 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -77.3 | -40.1 | -166.6 | -147.5 | 164.4 | 138.2 | 0 | 0 | 112.7 | E132 E133 | E130-E132 PolarHBondContact O-N 2.91Å; E130-E132 VanDerWaalsContact O-N 3.17Å; E130-E133 PolarHBondContact O-N 3.39Å |
| 131 | E | 41.4 | Very low | 57.2 | Low | 188 Ų | 188 | 113.1 Ų | 113.1 | 88% | 0.879 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.3 | -17.8 | 176.3 | -76.5 | -173.2 | 151.4 | 0 | 0 | 113.9 | ||
| 132 | E | 47.7 | Very low | 58.7 | Low | 135 Ų | 135 | 108 Ų | 108 | 63% | 0.631 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | -6.5 | 173 | -85.2 | -167.4 | 174.6 | 0 | 0 | 113.9 | E130 K144 | E130-E132 PolarHBondContact O-N 2.91Å; E130-E132 VanDerWaalsContact O-N 3.17Å; E132-K144 IonicContact OE2-NZ 2.77Å; E132-K144 PolarHBondContact OE2-NZ 3.48Å |
| 133 | E | 47.1 | Very low | 60.1 | Low | 26 Ų | 26 | 107.2 Ų | 107.2 | 12% | 0.121 | 56% | 0.558 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -84.1 | -27.5 | -178.8 | -73.6 | -165.9 | 173.3 | 0 | 0 | 113.4 | E130 E135 L136 Q141 K145 | E130-E133 PolarHBondContact O-N 3.39Å; E133-E135 VanDerWaalsContact C-N 3.29Å; E133-E135 PolarHBondContact O-N 3.5Å; E133-E135 VanDerWaalsContact O-N 3.17Å; E133-L136 PolarHBondContact O-N 2.93Å; E133-L136 VanDerWaalsContact O-N 3.14Å; E133-Q141 HydrophobicContact CB-CG 4.48Å; E133-Q141 PolarHBondContact O-NE2 2.79Å; E133-K145 WeakPolarHBondContact OE1-CE 2.86Å; E133-K145 IonicContact OE1-NZ 2.79Å; E133-K145 WeakPolarHBondContact OE2-CE 3.39Å; E133-K145 IonicContact OE2-NZ 3.56Å; E133-K145 PolarHBondContact OE2-NZ 3.29Å |
| 134 | E | 49.6 | Very low | 61.5 | Low | 183 Ų | 183 | 103.2 Ų | 103.2 | 86% | 0.855 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | -26.7 | -171.9 | -71.2 | -164.7 | 140.8 | 0 | 0 | 115.3 | ||
| 135 | E | 54.6 | Low | 63.1 | Low | 194 Ų | 194 | 101.9 Ų | 101.9 | 91% | 0.907 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.3 | -3.9 | 179.5 | -65.8 | -165.2 | 159 | 0 | 0 | 114.4 | E133 | E133-E135 VanDerWaalsContact C-N 3.29Å; E133-E135 PolarHBondContact O-N 3.5Å; E133-E135 VanDerWaalsContact O-N 3.17Å |
| 136 | L | 59.5 | Low | 65 | Low | 65 Ų | 65 | 102.9 Ų | 102.9 | 34% | 0.34 | 52% | 0.522 | S | S | . | . | S | Bend | trans | -93.4 | 143.3 | -176.6 | -72 | 169.3 | 0 | 0 | 0 | 112.3 | E133 V140 Q141 K144 | E133-L136 PolarHBondContact O-N 2.93Å; E133-L136 VanDerWaalsContact O-N 3.14Å; L136-V140 HydrophobicContact CD2-CG1 3.94Å; L136-Q141 HydrophobicContact CB-CG 3.89Å; L136-Q141 PolarHBondContact O-NE2 3.45Å; L136-K144 HydrophobicContact CD1-CD 4.27Å |
| 137 | T | 76.3 | Confident | 66.9 | Low | 83 Ų | 83 | 102.4 Ų | 102.4 | 51% | 0.509 | 52% | 0.517 | S | S | . | . | trans | -63.3 | 146.3 | 172.6 | 64.7 | 0 | 0 | 0 | 0 | 110.4 | Q139 V140 Q141 | T137-Q139 PolarHBondContact O-N 2.88Å; T137-Q139 VanDerWaalsContact O-N 3.08Å; T137-V140 PolarHBondContact O-N 2.96Å; T137-V140 WeakPolarHBondContact OG1-CG2 3.23Å; T137-Q141 PolarHBondContact O-N 3.43Å | ||
| 138 | P | 78.3 | Confident | 69.2 | Low | 101 Ų | 101 | 99.6 Ų | 99.6 | 66% | 0.656 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -59.3 | -28.8 | -174.5 | 20.7 | -33.2 | 0 | 0 | 0 | 113.1 | A142 | P138-A142 WeakPolarHBondContact O-CB 3.44Å; P138-A142 PolarHBondContact O-N 2.88Å |
| 139 | Q | 75.1 | Confident | 71.6 | Confident | 137 Ų | 137 | 99.5 Ų | 99.5 | 64% | 0.64 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -68.2 | -36.6 | 174.2 | -165.5 | -177.4 | 19.8 | 0 | 0 | 112.6 | T137 K143 | T137-Q139 PolarHBondContact O-N 2.88Å; T137-Q139 VanDerWaalsContact O-N 3.08Å; Q139-K143 WeakPolarHBondContact O-CG 3.48Å; Q139-K143 PolarHBondContact O-N 2.89Å; Q139-K143 VanDerWaalsContact O-N 3.14Å |
| 140 | V | 79.2 | Confident | 73.9 | Confident | 56 Ų | 56 | 103.1 Ų | 103.1 | 34% | 0.339 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -76.2 | -36.5 | 176.7 | 177.8 | 0 | 0 | 0 | 0 | 110.9 | L136 T137 A142 K143 K144 | L136-V140 HydrophobicContact CD2-CG1 3.94Å; T137-V140 PolarHBondContact O-N 2.96Å; T137-V140 WeakPolarHBondContact OG1-CG2 3.23Å; V140-A142 PolarHBondContact O-N 3.29Å; V140-K143 PolarHBondContact O-N 3.33Å; V140-K144 WeakPolarHBondContact O-CB 3.4Å; V140-K144 PolarHBondContact O-N 3.2Å |
| 141 | Q | 80.9 | Confident | 76.4 | Confident | 47 Ų | 47 | 102.6 Ų | 102.6 | 22% | 0.22 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -57.4 | -47.6 | 169.9 | -66.1 | 175.5 | -4.2 | 0 | 0 | 111.3 | E133 L136 T137 K143 K144 K145 | E133-Q141 HydrophobicContact CB-CG 4.48Å; E133-Q141 PolarHBondContact O-NE2 2.79Å; L136-Q141 HydrophobicContact CB-CG 3.89Å; L136-Q141 PolarHBondContact O-NE2 3.45Å; T137-Q141 PolarHBondContact O-N 3.43Å; Q141-K143 PolarHBondContact O-N 3.09Å; Q141-K144 WeakPolarHBondContact O-CB 3.02Å; Q141-K144 PolarHBondContact O-N 3.27Å; Q141-K144 VanDerWaalsContact O-N 3.13Å; Q141-K145 WeakPolarHBondContact O-CG 3.42Å; Q141-K145 PolarHBondContact O-N 2.93Å |
| 142 | A | 86.3 | Confident | 78.9 | Confident | 58 Ų | 58 | 100.1 Ų | 100.1 | 48% | 0.479 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.9 | -43.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | P138 V140 K145 H146 | P138-A142 WeakPolarHBondContact O-CB 3.44Å; P138-A142 PolarHBondContact O-N 2.88Å; V140-A142 PolarHBondContact O-N 3.29Å; A142-K145 PolarHBondContact O-N 2.84Å; A142-H146 WeakPolarHBondContact O-CB 3.2Å; A142-H146 PolarHBondContact O-N 3.32Å |
| 143 | K | 85.6 | Confident | 81.1 | Confident | 85 Ų | 85 | 100.4 Ų | 100.4 | 37% | 0.37 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.5 | -43.8 | 171.8 | -71.9 | 176.1 | -179 | 178.4 | 0 | 112 | D65 Q139 V140 Q141 H146 F147 | D65-K143 IonicContact OD2-NZ 2.92Å; D65-K143 PolarHBondContact OD2-NZ 3Å; Q139-K143 WeakPolarHBondContact O-CG 3.48Å; Q139-K143 PolarHBondContact O-N 2.89Å; Q139-K143 VanDerWaalsContact O-N 3.14Å; V140-K143 PolarHBondContact O-N 3.33Å; Q141-K143 PolarHBondContact O-N 3.09Å; K143-H146 PolarHBondContact O-N 3.01Å; K143-F147 WeakPolarHBondContact O-CB 3.28Å; K143-F147 PolarHBondContact O-N 3.5Å |
| 144 | K | 85.6 | Confident | 83.4 | Confident | 48 Ų | 48 | 105.2 Ų | 105.2 | 21% | 0.209 | 51% | 0.512 | C | S | . | . | H | α-helix | trans | -60 | -47.7 | 177.3 | -168.3 | -177.8 | -175.2 | 179.4 | 0 | 110.1 | E132 L136 V140 Q141 F147 Q148 | E132-K144 IonicContact OE2-NZ 2.77Å; E132-K144 PolarHBondContact OE2-NZ 3.48Å; L136-K144 HydrophobicContact CD1-CD 4.27Å; V140-K144 WeakPolarHBondContact O-CB 3.4Å; V140-K144 PolarHBondContact O-N 3.2Å; Q141-K144 WeakPolarHBondContact O-CB 3.02Å; Q141-K144 PolarHBondContact O-N 3.27Å; Q141-K144 VanDerWaalsContact O-N 3.13Å; K144-F147 PolarHBondContact O-N 3.13Å; K144-Q148 VanDerWaalsContact O-CG 3.3Å; K144-Q148 WeakPolarHBondContact O-CG 3.45Å; K144-Q148 PolarHBondContact O-N 3.18Å |
| 145 | K | 91.9 | Very high | 85.6 | Confident | 107 Ų | 107 | 103.5 Ų | 103.5 | 47% | 0.465 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.1 | -45.5 | 177.7 | -70.3 | 177.5 | -175.7 | 178.3 | 0 | 112.2 | E133 Q141 A142 Q148 M149 | E133-K145 WeakPolarHBondContact OE1-CE 2.86Å; E133-K145 IonicContact OE1-NZ 2.79Å; E133-K145 WeakPolarHBondContact OE2-CE 3.39Å; E133-K145 IonicContact OE2-NZ 3.56Å; E133-K145 PolarHBondContact OE2-NZ 3.29Å; Q141-K145 WeakPolarHBondContact O-CG 3.42Å; Q141-K145 PolarHBondContact O-N 2.93Å; A142-K145 PolarHBondContact O-N 2.84Å; K145-Q148 PolarHBondContact O-N 2.77Å; K145-M149 PolarHBondContact O-N 2.87Å |
| 146 | H | 92.4 | Very high | 87.5 | Confident | 111 Ų | 111 | 98.3 Ų | 98.3 | 51% | 0.514 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.4 | -43.8 | 175.6 | -176.3 | 74.6 | 0 | 0 | 0 | 112.4 | A142 K143 Q148 M149 M150 | A142-H146 WeakPolarHBondContact O-CB 3.2Å; A142-H146 PolarHBondContact O-N 3.32Å; K143-H146 PolarHBondContact O-N 3.01Å; H146-Q148 PolarHBondContact O-N 3.38Å; H146-M149 PolarHBondContact O-N 2.97Å; H146-M150 WeakPolarHBondContact O-CG 3.43Å; H146-M150 PolarHBondContact O-N 2.9Å |
| 147 | F | 92.9 | Very high | 89 | Confident | 131 Ų | 131 | 99.8 Ų | 99.8 | 58% | 0.575 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -62.8 | -41.5 | 174.9 | 175.9 | -99.6 | 0 | 0 | 0 | 112.3 | K143 K144 M149 M150 R151 | K143-F147 WeakPolarHBondContact O-CB 3.28Å; K143-F147 PolarHBondContact O-N 3.5Å; K144-F147 PolarHBondContact O-N 3.13Å; F147-M149 VanDerWaalsContact C-N 3.34Å; F147-M149 PolarHBondContact O-N 2.89Å; F147-M150 PolarHBondContact O-N 3.2Å; F147-R151 VanDerWaalsContact O-CB 3.23Å; F147-R151 WeakPolarHBondContact O-CB 3.4Å; F147-R151 PolarHBondContact O-N 3.49Å |
| 148 | Q | 92.8 | Very high | 89.7 | Confident | 64 Ų | 64 | 99.4 Ų | 99.4 | 30% | 0.299 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.1 | -42.4 | 175.1 | -74.1 | -174.5 | 42.7 | 0 | 0 | 111.9 | K144 K145 H146 R151 K152 | K144-Q148 VanDerWaalsContact O-CG 3.3Å; K144-Q148 WeakPolarHBondContact O-CG 3.45Å; K144-Q148 PolarHBondContact O-N 3.18Å; K145-Q148 PolarHBondContact O-N 2.77Å; H146-Q148 PolarHBondContact O-N 3.38Å; Q148-R151 PolarHBondContact O-N 3.09Å; Q148-K152 WeakPolarHBondContact O-CB 3.3Å; Q148-K152 PolarHBondContact O-N 3.36Å |
| 149 | M | 94.5 | Very high | 90.1 | Very high | 106 Ų | 106 | 101.5 Ų | 101.5 | 52% | 0.522 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.4 | -50.1 | 175.1 | -175.1 | -174.1 | 75.5 | 0 | 0 | 111.6 | K145 H146 F147 R151 K152 M153 | K145-M149 PolarHBondContact O-N 2.87Å; H146-M149 PolarHBondContact O-N 2.97Å; F147-M149 VanDerWaalsContact C-N 3.34Å; F147-M149 PolarHBondContact O-N 2.89Å; M149-R151 VanDerWaalsContact C-N 3.27Å; M149-R151 PolarHBondContact O-N 3.15Å; M149-K152 PolarHBondContact O-N 3.03Å; M149-K152 VanDerWaalsContact O-N 3.13Å; M149-M153 WeakPolarHBondContact O-CG 3.22Å; M149-M153 PolarHBondContact O-N 3.19Å |
| 150 | M | 95.6 | Very high | 90.7 | Very high | 104 Ų | 104 | 99.2 Ų | 99.2 | 51% | 0.512 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59 | -39.2 | 176.2 | -72 | -59.5 | -62.9 | 0 | 0 | 111.9 | H146 F147 M153 H154 | H146-M150 WeakPolarHBondContact O-CG 3.43Å; H146-M150 PolarHBondContact O-N 2.9Å; F147-M150 PolarHBondContact O-N 3.2Å; M150-M153 PolarHBondContact O-N 3.07Å; M150-H154 WeakPolarHBondContact O-CB 3.42Å; M150-H154 PolarHBondContact O-N 3.42Å |
| 151 | R | 95.9 | Very high | 91.3 | Very high | 125 Ų | 125 | 100.6 Ų | 100.6 | 47% | 0.472 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66 | -40.4 | 174.8 | -172.6 | -178.6 | 66.9 | 178 | -1.1 | 112.5 | F147 Q148 M149 M153 H154 Y155 | F147-R151 VanDerWaalsContact O-CB 3.23Å; F147-R151 WeakPolarHBondContact O-CB 3.4Å; F147-R151 PolarHBondContact O-N 3.49Å; Q148-R151 PolarHBondContact O-N 3.09Å; M149-R151 VanDerWaalsContact C-N 3.27Å; M149-R151 PolarHBondContact O-N 3.15Å; R151-M153 VanDerWaalsContact C-N 3.3Å; R151-H154 PolarHBondContact O-N 3.34Å; R151-Y155 HydrophobicContact CG-CD2 3.7Å; R151-Y155 HydrophobicContact CG-CE2 3.7Å; R151-Y155 WeakPolarHBondContact O-CD2 3.48Å; R151-Y155 PolarHBondContact O-N 2.99Å |
| 152 | K | 95.4 | Very high | 91.7 | Very high | 136 Ų | 136 | 107 Ų | 107 | 59% | 0.591 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.7 | -36.3 | 175.3 | -171.9 | 172.1 | -172.7 | 168.1 | 0 | 111.2 | E124 Q148 M149 | E124-K152 IonicContact OE2-NZ 2.81Å; E124-K152 PolarHBondContact OE2-NZ 3.2Å; Q148-K152 WeakPolarHBondContact O-CB 3.3Å; Q148-K152 PolarHBondContact O-N 3.36Å; M149-K152 PolarHBondContact O-N 3.03Å; M149-K152 VanDerWaalsContact O-N 3.13Å |
| 153 | M | 93.6 | Very high | 92 | Very high | 141 Ų | 141 | 108.6 Ų | 108.6 | 70% | 0.695 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -77.1 | -27 | 175.4 | -67 | -57.4 | -56.6 | 0 | 0 | 114 | M149 M150 R151 | M149-M153 WeakPolarHBondContact O-CG 3.22Å; M149-M153 PolarHBondContact O-N 3.19Å; M150-M153 PolarHBondContact O-N 3.07Å; R151-M153 VanDerWaalsContact C-N 3.3Å |
| 154 | H | 95.9 | Very high | 92.4 | Very high | 128 Ų | 128 | 106.6 Ų | 106.6 | 59% | 0.593 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -79.8 | -38 | -177.1 | -179.6 | 38.3 | 0 | 0 | 0 | 113.7 | M150 R151 D156 | M150-H154 WeakPolarHBondContact O-CB 3.42Å; M150-H154 PolarHBondContact O-N 3.42Å; R151-H154 PolarHBondContact O-N 3.34Å; H154-D156 PolarHBondContact O-N 3.01Å |
| 155 | Y | 95.3 | Very high | 92.8 | Very high | 147 Ų | 147 | 112.7 Ų | 112.7 | 58% | 0.576 | 53% | 0.53 | S | S | * | . | trans | -90.1 | 70.3 | -177.6 | -70.1 | -63.6 | 0 | 0 | 0 | 111.6 | R151 E157 | R151-Y155 HydrophobicContact CG-CD2 3.7Å; R151-Y155 HydrophobicContact CG-CE2 3.7Å; R151-Y155 WeakPolarHBondContact O-CD2 3.48Å; R151-Y155 PolarHBondContact O-N 2.99Å; Y155-E157 VanDerWaalsContact C-OE2 3.24Å; Y155-E157 WeakPolarHBondContact CA-OE2 3.36Å; Y155-E157 WeakPolarHBondContact CD1-OE1 3.36Å | ||
| 156 | D | 93.4 | Very high | 92.9 | Very high | 84 Ų | 84 | 113.7 Ų | 113.7 | 45% | 0.449 | 54% | 0.537 | S | S | . | . | trans | -97.7 | 3.9 | -179.6 | 75.2 | -9 | 0 | 0 | 0 | 114 | H154 A158 M159 | H154-D156 PolarHBondContact O-N 3.01Å; D156-A158 PolarHBondContact O-N 3.38Å; D156-M159 PolarHBondContact O-N 3.07Å | ||
| 157 | E | 91.7 | Very high | 92.9 | Very high | 97 Ų | 97 | 113.4 Ų | 113.4 | 45% | 0.453 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -60.4 | -22.9 | -163.8 | -55.6 | 99.3 | 137.4 | 0 | 0 | 113.2 | Y155 M159 N160 I161 | Y155-E157 VanDerWaalsContact C-OE2 3.24Å; Y155-E157 WeakPolarHBondContact CA-OE2 3.36Å; Y155-E157 WeakPolarHBondContact CD1-OE1 3.36Å; E157-M159 PolarHBondContact O-N 3.22Å; E157-N160 CarbonylContact O-C 3.58Å; E157-N160 WeakPolarHBondContact O-CA 3.3Å; E157-N160 PolarHBondContact O-N 3.01Å; E157-I161 WeakPolarHBondContact O-CG1 3.34Å; E157-I161 PolarHBondContact O-N 2.95Å |
| 158 | A | 90.3 | Very high | 93 | Very high | 74 Ų | 74 | 111.6 Ų | 111.6 | 61% | 0.612 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -55.7 | -30.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | D156 | D156-A158 PolarHBondContact O-N 3.38Å |
| 159 | M | 86.7 | Confident | 93 | Very high | 146 Ų | 146 | 111.3 Ų | 111.3 | 72% | 0.719 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -68.5 | -43.3 | 173.2 | -61.7 | -171.3 | 73.9 | 0 | 0 | 110.7 | D156 E157 I161 | D156-M159 PolarHBondContact O-N 3.07Å; E157-M159 PolarHBondContact O-N 3.22Å; M159-I161 PolarHBondContact O-N 2.86Å |
| 160 | N | 87.6 | Confident | 92.9 | Very high | 89 Ų | 89 | 111.9 Ų | 111.9 | 48% | 0.476 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -74.2 | -23.6 | -178.1 | -63.4 | -34.9 | 0 | 0 | 0 | 113.3 | E157 R162 L163 A164 | E157-N160 CarbonylContact O-C 3.58Å; E157-N160 WeakPolarHBondContact O-CA 3.3Å; E157-N160 PolarHBondContact O-N 3.01Å; N160-R162 PolarHBondContact O-N 3.35Å; N160-L163 PolarHBondContact O-N 3.23Å; N160-A164 VanDerWaalsContact O-CB 3.29Å; N160-A164 WeakPolarHBondContact O-CB 3.49Å; N160-A164 PolarHBondContact O-N 3.49Å |
| 161 | I | 93.6 | Very high | 92.6 | Very high | 85 Ų | 85 | 113.7 Ų | 113.7 | 44% | 0.436 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -57.2 | -33.8 | 175.9 | -72.9 | 173.3 | 0 | 0 | 0 | 112.6 | E157 M159 R165 | E157-I161 WeakPolarHBondContact O-CG1 3.34Å; E157-I161 PolarHBondContact O-N 2.95Å; M159-I161 PolarHBondContact O-N 2.86Å; I161-R165 WeakPolarHBondContact O-CD 3.42Å; I161-R165 VanDerWaalsContact O-CG 3.26Å; I161-R165 WeakPolarHBondContact O-CG 3.17Å; I161-R165 PolarHBondContact O-N 2.92Å |
| 162 | R | 89.6 | Confident | 92.2 | Very high | 182 Ų | 182 | 113.3 Ų | 113.3 | 69% | 0.687 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -70.8 | -53.5 | 178.5 | -67.7 | -176.6 | -176.8 | 147.3 | 2.3 | 111.2 | N160 A164 R165 E166 | N160-R162 PolarHBondContact O-N 3.35Å; R162-A164 VanDerWaalsContact C-N 3.3Å; R162-A164 PolarHBondContact O-N 2.98Å; R162-R165 WeakPolarHBondContact O-CB 3.29Å; R162-R165 PolarHBondContact O-N 3.22Å; R162-R165 VanDerWaalsContact O-N 3.07Å; R162-E166 PolarHBondContact O-N 3.48Å; R162-E166 VanDerWaalsContact O-N 3.08Å |
| 163 | L | 91.9 | Very high | 91.6 | Very high | 91 Ų | 91 | 113.7 Ų | 113.7 | 48% | 0.476 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -58.3 | -42.1 | 177.3 | 179.7 | 60.8 | 0 | 0 | 0 | 111.7 | N160 R165 E166 L167 | N160-L163 PolarHBondContact O-N 3.23Å; L163-R165 VanDerWaalsContact C-N 3.31Å; L163-R165 PolarHBondContact O-N 2.88Å; L163-E166 PolarHBondContact O-N 3.34Å; L163-L167 HydrophobicContact CD1-CD1 4.25Å; L163-L167 HydrophobicContact CD1-CG 4.17Å; L163-L167 HydrophobicContact CG-CD1 3.99Å; L163-L167 HydrophobicContact CG-CG 4.37Å; L163-L167 WeakPolarHBondContact O-CB 3.26Å; L163-L167 WeakPolarHBondContact O-CG 3.49Å; L163-L167 PolarHBondContact O-N 3.11Å |
| 164 | A | 93.3 | Very high | 90.2 | Very high | 43 Ų | 43 | 111.4 Ų | 111.4 | 36% | 0.355 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -61.4 | -37.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | N160 R162 I168 | N160-A164 VanDerWaalsContact O-CB 3.29Å; N160-A164 WeakPolarHBondContact O-CB 3.49Å; N160-A164 PolarHBondContact O-N 3.49Å; R162-A164 VanDerWaalsContact C-N 3.3Å; R162-A164 PolarHBondContact O-N 2.98Å; A164-I168 WeakPolarHBondContact O-CB 3.47Å; A164-I168 WeakPolarHBondContact O-CD1 3.33Å; A164-I168 WeakPolarHBondContact O-CG1 3.4Å; A164-I168 PolarHBondContact O-N 3.22Å |
| 165 | R | 94.2 | Very high | 88.5 | Confident | 175 Ų | 175 | 111.8 Ų | 111.8 | 66% | 0.66 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -66.9 | -40.1 | 174.5 | -73.8 | 168.6 | -178.4 | -178.2 | 2.2 | 112.3 | I161 R162 L163 A169 | I161-R165 WeakPolarHBondContact O-CD 3.42Å; I161-R165 VanDerWaalsContact O-CG 3.26Å; I161-R165 WeakPolarHBondContact O-CG 3.17Å; I161-R165 PolarHBondContact O-N 2.92Å; R162-R165 WeakPolarHBondContact O-CB 3.29Å; R162-R165 PolarHBondContact O-N 3.22Å; R162-R165 VanDerWaalsContact O-N 3.07Å; L163-R165 VanDerWaalsContact C-N 3.31Å; L163-R165 PolarHBondContact O-N 2.88Å; R165-A169 VanDerWaalsContact O-CB 3.29Å; R165-A169 WeakPolarHBondContact O-CB 3.5Å; R165-A169 PolarHBondContact O-N 3.15Å |
| 166 | E | 93.8 | Very high | 86.6 | Confident | 129 Ų | 129 | 111.6 Ų | 111.6 | 60% | 0.603 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -66.9 | -42.9 | 177.7 | -71 | 165.3 | -158.7 | 0 | 0 | 111.3 | R162 L163 A169 K170 | R162-E166 PolarHBondContact O-N 3.48Å; R162-E166 VanDerWaalsContact O-N 3.08Å; L163-E166 PolarHBondContact O-N 3.34Å; E166-A169 PolarHBondContact O-N 2.98Å; E166-K170 PolarHBondContact O-N 3.35Å |
| 167 | L | 93.8 | Very high | 84.8 | Confident | 105 Ų | 105 | 113.2 Ų | 113.2 | 55% | 0.55 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.4 | -44.6 | 175.3 | -69.6 | 172.6 | 0 | 0 | 0 | 112.2 | L163 K170 E171 | L163-L167 HydrophobicContact CD1-CD1 4.25Å; L163-L167 HydrophobicContact CD1-CG 4.17Å; L163-L167 HydrophobicContact CG-CD1 3.99Å; L163-L167 HydrophobicContact CG-CG 4.37Å; L163-L167 WeakPolarHBondContact O-CB 3.26Å; L163-L167 WeakPolarHBondContact O-CG 3.49Å; L163-L167 PolarHBondContact O-N 3.11Å; L167-K170 PolarHBondContact O-N 3.42Å; L167-E171 WeakPolarHBondContact O-CB 3.29Å; L167-E171 PolarHBondContact O-N 3.2Å |
| 168 | I | 93.1 | Very high | 82.8 | Confident | 93 Ų | 93 | 115.8 Ų | 115.8 | 48% | 0.477 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -65 | -39.2 | 175.9 | -68.5 | 164 | 0 | 0 | 0 | 111.2 | A164 K170 E171 L172 | A164-I168 WeakPolarHBondContact O-CB 3.47Å; A164-I168 WeakPolarHBondContact O-CD1 3.33Å; A164-I168 WeakPolarHBondContact O-CG1 3.4Å; A164-I168 PolarHBondContact O-N 3.22Å; I168-K170 VanDerWaalsContact C-N 3.33Å; I168-E171 PolarHBondContact O-N 3.08Å; I168-L172 HydrophobicContact CG2-CD1 4Å; I168-L172 VanDerWaalsContact O-CG 3.3Å; I168-L172 WeakPolarHBondContact O-CG 3.43Å; I168-L172 PolarHBondContact O-N 3.35Å; I168-L172 VanDerWaalsContact O-N 3.15Å |
| 169 | A | 94.1 | Very high | 81 | Confident | 57 Ų | 57 | 121 Ų | 121 | 47% | 0.471 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -62.5 | -42.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | R165 E166 L172 E173 | R165-A169 VanDerWaalsContact O-CB 3.29Å; R165-A169 WeakPolarHBondContact O-CB 3.5Å; R165-A169 PolarHBondContact O-N 3.15Å; E166-A169 PolarHBondContact O-N 2.98Å; A169-L172 PolarHBondContact O-N 2.94Å; A169-E173 WeakPolarHBondContact O-CB 3.47Å; A169-E173 PolarHBondContact O-N 3.44Å; A169-E173 VanDerWaalsContact O-N 3.11Å |
| 170 | K | 90.9 | Very high | 79.3 | Confident | 119 Ų | 119 | 122.1 Ų | 122.1 | 52% | 0.517 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -67.3 | -44.6 | 176 | -179.8 | 170.3 | 177.1 | 171.4 | 0 | 112.9 | E166 L167 I168 L172 E173 D174 | E166-K170 PolarHBondContact O-N 3.35Å; L167-K170 PolarHBondContact O-N 3.42Å; I168-K170 VanDerWaalsContact C-N 3.33Å; K170-L172 PolarHBondContact O-N 2.93Å; K170-E173 PolarHBondContact O-N 2.88Å; K170-D174 WeakPolarHBondContact CE-OD2 2.98Å; K170-D174 PolarHBondContact O-N 3.21Å |
| 171 | E | 89.9 | Confident | 77.4 | Confident | 142 Ų | 142 | 126.6 Ų | 126.6 | 66% | 0.664 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -57.8 | -30.3 | 177.1 | -174.8 | 178 | -176.4 | 0 | 0 | 112 | L167 I168 | L167-E171 WeakPolarHBondContact O-CB 3.29Å; L167-E171 PolarHBondContact O-N 3.2Å; I168-E171 PolarHBondContact O-N 3.08Å |
| 172 | L | 88.2 | Confident | 75.3 | Confident | 117 Ų | 117 | 133 Ų | 133 | 61% | 0.613 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -85.6 | -20.7 | 175.2 | -67.7 | 171 | 0 | 0 | 0 | 114.4 | I168 A169 K170 | I168-L172 HydrophobicContact CG2-CD1 4Å; I168-L172 VanDerWaalsContact O-CG 3.3Å; I168-L172 WeakPolarHBondContact O-CG 3.43Å; I168-L172 PolarHBondContact O-N 3.35Å; I168-L172 VanDerWaalsContact O-N 3.15Å; A169-L172 PolarHBondContact O-N 2.94Å; K170-L172 PolarHBondContact O-N 2.93Å |
| 173 | E | 82.3 | Confident | 73.1 | Confident | 143 Ų | 143 | 131.4 Ų | 131.4 | 67% | 0.668 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -86.3 | -38.1 | 178.9 | -168.3 | 167.7 | -136.9 | 0 | 0 | 110.9 | A169 K170 D175 D176 | A169-E173 WeakPolarHBondContact O-CB 3.47Å; A169-E173 PolarHBondContact O-N 3.44Å; A169-E173 VanDerWaalsContact O-N 3.11Å; K170-E173 PolarHBondContact O-N 2.88Å; E173-D175 PolarHBondContact O-N 2.93Å; E173-D176 PolarHBondContact O-N 3.01Å |
| 174 | D | 65 | Low | 71.3 | Confident | 94 Ų | 94 | 134.8 Ų | 134.8 | 50% | 0.503 | 67% | 0.669 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64.8 | -17.4 | 175.4 | -71.2 | -23.3 | 0 | 0 | 0 | 112.8 | K170 | K170-D174 WeakPolarHBondContact CE-OD2 2.98Å; K170-D174 PolarHBondContact O-N 3.21Å |
| 175 | D | 58.9 | Low | 69.4 | Low | 135 Ų | 135 | 137.7 Ų | 137.7 | 72% | 0.722 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.5 | -17 | 178.7 | -108.7 | 9.8 | 0 | 0 | 0 | 113.7 | E173 | E173-D175 PolarHBondContact O-N 2.93Š|
| 176 | D | 57.2 | Low | 67.3 | Low | 143 Ų | 143 | 138.2 Ų | 138.2 | 77% | 0.765 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.1 | -11.4 | 178.5 | -90.6 | -22.8 | 0 | 0 | 0 | 112.8 | E173 | E173-D176 PolarHBondContact O-N 3.01Š|
| 177 | D | 54.6 | Low | 65.1 | Low | 118 Ų | 118 | 136.7 Ų | 136.7 | 63% | 0.631 | 69% | 0.688 | S | S | * | * | trans | -90.1 | 4.9 | -173.9 | -109.8 | 5.9 | 0 | 0 | 0 | 114.5 | E179 | D177-E179 VanDerWaalsContact C-N 3.34Å; D177-E179 PolarHBondContact O-N 3.19Å | ||
| 178 | D | 50.7 | Low | 63.2 | Low | 151 Ų | 151 | 138 Ų | 138 | 81% | 0.807 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.7 | 12.1 | -177 | -123.2 | 15.7 | 0 | 0 | 0 | 113.9 | ||
| 179 | E | 51.9 | Low | 61.4 | Low | 185 Ų | 185 | 142.2 Ų | 142.2 | 86% | 0.864 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.9 | -3.9 | 174 | -80.1 | -156.5 | 178.9 | 0 | 0 | 116 | D177 M181 | D177-E179 VanDerWaalsContact C-N 3.34Å; D177-E179 PolarHBondContact O-N 3.19Å; E179-M181 PolarHBondContact O-N 3.14Å |
| 180 | E | 50.7 | Low | 59.2 | Low | 168 Ų | 168 | 147.5 Ų | 147.5 | 79% | 0.785 | 73% | 0.734 | S | S | * | * | trans | -90.4 | 98.4 | 172.9 | -70.2 | -139.9 | 159.3 | 0 | 0 | 113.3 | R182 | E180-R182 WeakPolarHBondContact O-CG 3.48Å; E180-R182 PolarHBondContact O-N 3.27Å | ||
| 181 | M | 46.6 | Very low | 56.9 | Low | 184 Ų | 184 | 149.1 Ų | 149.1 | 91% | 0.906 | 75% | 0.748 | S | S | * | * | trans | -54.2 | 97.4 | 166.6 | -73.2 | -83.5 | -68.9 | 0 | 0 | 111.4 | E179 D183 | E179-M181 PolarHBondContact O-N 3.14Å; M181-D183 PolarHBondContact O-N 2.91Å; M181-D183 VanDerWaalsContact O-N 3.07Å | ||
| 182 | R | 50.8 | Low | 55.2 | Low | 219 Ų | 219 | 148.9 Ų | 148.9 | 83% | 0.826 | 76% | 0.756 | S | S | * | * | trans | -68.1 | 101.7 | 173.7 | -40.5 | 179.7 | -156.7 | -129.7 | -4 | 108.4 | E180 D184 | E180-R182 WeakPolarHBondContact O-CG 3.48Å; E180-R182 PolarHBondContact O-N 3.27Å; R182-D184 PolarHBondContact O-N 3.09Å | ||
| 183 | D | 43.7 | Very low | 53.5 | Low | 149 Ų | 149 | 151.6 Ų | 151.6 | 80% | 0.797 | 77% | 0.766 | S | S | * | * | trans | -65.1 | 130.3 | 178.4 | -163.5 | 11.7 | 0 | 0 | 0 | 110.1 | M181 T185 | M181-D183 PolarHBondContact O-N 2.91Å; M181-D183 VanDerWaalsContact O-N 3.07Å; D183-T185 VanDerWaalsContact C-N 3.25Å; D183-T185 PolarHBondContact O-N 3.35Å | ||
| 184 | D | 52.7 | Low | 52 | Low | 162 Ų | 162 | 152.5 Ų | 152.5 | 87% | 0.866 | 77% | 0.77 | S | S | * | * | trans | -88.7 | 57.1 | -161.3 | -160.1 | 9.1 | 0 | 0 | 0 | 111.5 | R182 | R182-D184 PolarHBondContact O-N 3.09Š| ||
| 185 | T | 55.3 | Low | 50.9 | Low | 104 Ų | 104 | 154.9 Ų | 154.9 | 64% | 0.638 | 79% | 0.788 | S | S | * | * | trans | -154.8 | 128.7 | 172 | -32.1 | 0 | 0 | 0 | 0 | 105.9 | D183 | D183-T185 VanDerWaalsContact C-N 3.25Å; D183-T185 PolarHBondContact O-N 3.35Å | ||
| 186 | E | 49.3 | Very low | 50.6 | Low | 185 Ų | 185 | 156.1 Ų | 156.1 | 86% | 0.864 | 79% | 0.789 | S | S | * | * | S | Bend | cis | -151.8 | 155 | 44.9 | -32.6 | -162.2 | 133.8 | 0 | 0 | 114.1 | ||
| 187 | D | 46.7 | Very low | 50.2 | Low | 97 Ų | 97 | 157.5 Ų | 157.5 | 52% | 0.519 | 79% | 0.791 | S | S | . | * | trans | 12.3 | 115 | 170.4 | -141.2 | -26.4 | 0 | 0 | 0 | 122.4 | R189 | D187-R189 VanDerWaalsContact C-N 3.29Å; D187-R189 PolarHBondContact O-N 3.44Å; D187-R189 IonicContact OD1-CZ 2.78Å; D187-R189 IonicContact OD1-NE 3.56Å; D187-R189 PolarHBondContact OD1-NE 3.1Å; D187-R189 IonicContact OD1-NH2 3.55Å; D187-R189 PolarHBondContact OD1-NH2 2.94Å; D187-R189 VanDerWaalsContact OD1-NH2 3.15Å; D187-R189 IonicContact OD2-CZ 2.88Å; D187-R189 IonicContact OD2-NE 2.68Å; D187-R189 IonicContact OD2-NH2 3.89Å; D187-R189 PolarHBondContact OD2-NH2 3.1Å | ||
| 188 | P | 55.2 | Low | 49.6 | Very low | 134 Ų | 134 | 159 Ų | 159 | 87% | 0.87 | 80% | 0.798 | S | S | * | * | trans | -85.7 | 53.3 | 176.4 | 37.7 | -37.4 | 0 | 0 | 0 | 113.3 | ||||
| 189 | R | 54.7 | Low | 49.6 | Very low | 180 Ų | 180 | 156.8 Ų | 156.8 | 68% | 0.679 | 79% | 0.79 | S | S | * | * | trans | -136.6 | 86.3 | -179.2 | -75.7 | -178 | -75.4 | -175.8 | -0.4 | 112 | D187 | D187-R189 VanDerWaalsContact C-N 3.29Å; D187-R189 PolarHBondContact O-N 3.44Å; D187-R189 IonicContact OD1-CZ 2.78Å; D187-R189 IonicContact OD1-NE 3.56Å; D187-R189 PolarHBondContact OD1-NE 3.1Å; D187-R189 IonicContact OD1-NH2 3.55Å; D187-R189 PolarHBondContact OD1-NH2 2.94Å; D187-R189 VanDerWaalsContact OD1-NH2 3.15Å; D187-R189 IonicContact OD2-CZ 2.88Å; D187-R189 IonicContact OD2-NE 2.68Å; D187-R189 IonicContact OD2-NH2 3.89Å; D187-R189 PolarHBondContact OD2-NH2 3.1Å | ||
| 190 | D | 47.9 | Very low | 49.5 | Very low | 168 Ų | 168 | 153.6 Ų | 153.6 | 90% | 0.898 | 78% | 0.783 | S | S | * | * | S | Bend | trans | 162.3 | 72 | 143 | -82.4 | -15.4 | 0 | 0 | 0 | 110.6 | ||
| 191 | N | 43.2 | Very low | 49.6 | Very low | 154 Ų | 154 | 151.4 Ų | 151.4 | 82% | 0.824 | 78% | 0.776 | S | S | * | * | trans | -157.2 | 79 | 149.9 | -149.1 | 2.2 | 0 | 0 | 0 | 111.6 | ||||
| 192 | V | 54.3 | Low | 50.2 | Low | 137 Ų | 137 | 146.6 Ų | 146.6 | 83% | 0.83 | 76% | 0.759 | S | S | * | * | trans | -107.1 | 147.3 | 160.6 | 140.4 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 193 | E | 51.6 | Low | 50.1 | Low | 174 Ų | 174 | 142.2 Ų | 142.2 | 81% | 0.813 | 76% | 0.759 | S | S | * | * | trans | 84.2 | 125 | -158.8 | -55.3 | 179.4 | -178.8 | 0 | 0 | 110.9 | ||||
| 194 | E | 51.5 | Low | 50.1 | Low | 161 Ų | 161 | 143.1 Ų | 143.1 | 75% | 0.752 | 76% | 0.758 | S | S | * | * | cis | -152.2 | 102.8 | 12.8 | -173.9 | 170.5 | -147.7 | 0 | 0 | 109.5 | E196 | E194-E196 HydrophobicContact CG-CG 4.36Å; E194-E196 PolarHBondContact O-N 3.49Å | ||
| 195 | T | 41.7 | Very low | 49.6 | Very low | 145 Ų | 145 | 143.9 Ų | 143.9 | 89% | 0.89 | 76% | 0.756 | S | S | * | * | trans | -91 | 89.3 | 171.3 | 54.5 | 0 | 0 | 0 | 0 | 109.5 | E197 | T195-E197 PolarHBondContact O-N 3.07Š| ||
| 196 | E | 51.5 | Low | 49 | Very low | 160 Ų | 160 | 142.8 Ų | 142.8 | 75% | 0.748 | 77% | 0.766 | S | S | * | * | trans | -62.9 | 122.5 | 167.5 | -72.6 | -159 | 133.5 | 0 | 0 | 110.1 | E194 I198 | E194-E196 HydrophobicContact CG-CG 4.36Å; E194-E196 PolarHBondContact O-N 3.49Å; E196-I198 PolarHBondContact O-N 2.79Å | ||
| 197 | E | 48.8 | Very low | 48.6 | Very low | 173 Ų | 173 | 140.8 Ų | 140.8 | 81% | 0.808 | 77% | 0.766 | S | S | * | * | trans | -72.7 | 88.5 | -176.5 | -176.1 | 178.7 | -163.7 | 0 | 0 | 110.6 | T195 T199 | T195-E197 PolarHBondContact O-N 3.07Å; E197-T199 PolarHBondContact O-N 2.99Å | ||
| 198 | I | 43.4 | Very low | 48.4 | Very low | 149 Ų | 149 | 139.9 Ų | 139.9 | 76% | 0.764 | 77% | 0.772 | S | S | * | * | trans | -69.3 | 82 | 172.3 | -70.1 | 171.4 | 0 | 0 | 0 | 109.5 | E196 V200 | E196-I198 PolarHBondContact O-N 2.79Å; I198-V200 HydrophobicContact CG2-CG2 3.63Å; I198-V200 PolarHBondContact O-N 2.95Å; I198-V200 VanDerWaalsContact O-N 3.1Å | ||
| 199 | T | 50.1 | Low | 47.5 | Very low | 104 Ų | 104 | 140.4 Ų | 140.4 | 64% | 0.638 | 77% | 0.768 | S | S | * | * | trans | -74.4 | 90.7 | 165.9 | -60.2 | 0 | 0 | 0 | 0 | 108.4 | E197 D201 | E197-T199 PolarHBondContact O-N 2.99Å; T199-D201 PolarHBondContact O-N 3.28Å; T199-D201 VanDerWaalsContact O-N 3.1Å | ||
| 200 | V | 49.8 | Very low | 46.6 | Very low | 119 Ų | 119 | 142.1 Ų | 142.1 | 72% | 0.721 | 77% | 0.774 | S | S | * | * | trans | -76.5 | 92.8 | 165.8 | -172.4 | 0 | 0 | 0 | 0 | 107.9 | I198 P202 | I198-V200 HydrophobicContact CG2-CG2 3.63Å; I198-V200 PolarHBondContact O-N 2.95Å; I198-V200 VanDerWaalsContact O-N 3.1Å; V200-P202 WeakPolarHBondContact O-CD 3.44Å | ||
| 201 | D | 52.5 | Low | 46.1 | Very low | 122 Ų | 122 | 141.8 Ų | 141.8 | 65% | 0.652 | 77% | 0.772 | S | S | * | * | trans | -62.5 | 119 | 174 | -158.1 | 10 | 0 | 0 | 0 | 108.9 | T199 | T199-D201 PolarHBondContact O-N 3.28Å; T199-D201 VanDerWaalsContact O-N 3.1Å | ||
| 202 | P | 59.7 | Low | 45.9 | Very low | 83 Ų | 83 | 141.4 Ų | 141.4 | 54% | 0.539 | 77% | 0.769 | S | S | . | * | trans | -67.4 | 134.9 | -177.9 | 26.4 | -33.8 | 0 | 0 | 0 | 110 | V200 Q204 | V200-P202 WeakPolarHBondContact O-CD 3.44Å; P202-Q204 WeakPolarHBondContact O-CG 3.43Å; P202-Q204 PolarHBondContact O-N 3.4Å | ||
| 203 | P | 48.1 | Very low | 45.3 | Very low | 126 Ų | 126 | 146 Ų | 146 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | trans | -64.5 | 104.9 | 178.3 | 26 | -33.2 | 0 | 0 | 0 | 110 | E205 | P203-E205 PolarHBondContact O-N 2.79Å; P203-E205 VanDerWaalsContact O-N 3.09Å | ||
| 204 | Q | 44 | Very low | 45 | Very low | 168 Ų | 168 | 145.7 Ų | 145.7 | 79% | 0.785 | 77% | 0.774 | S | S | * | * | trans | -76.8 | 96 | -179.8 | -60.4 | -172.7 | 21.3 | 0 | 0 | 110 | P202 G206 | P202-Q204 WeakPolarHBondContact O-CG 3.43Å; P202-Q204 PolarHBondContact O-N 3.4Å; Q204-G206 PolarHBondContact O-N 3.15Å; Q204-G206 VanDerWaalsContact O-N 3.14Å | ||
| 205 | E | 42.2 | Very low | 44.5 | Very low | 178 Ų | 178 | 147.6 Ų | 147.6 | 83% | 0.832 | 78% | 0.78 | S | S | * | * | trans | -65.4 | 111.3 | 165.5 | -69.1 | -167.2 | 163.6 | 0 | 0 | 109.6 | P203 V207 | P203-E205 PolarHBondContact O-N 2.79Å; P203-E205 VanDerWaalsContact O-N 3.09Å; E205-V207 PolarHBondContact O-N 3.04Å | ||
| 206 | G | 43.3 | Very low | 44.3 | Very low | 82 Ų | 82 | 148.6 Ų | 148.6 | 85% | 0.845 | 78% | 0.78 | S | S | * | * | trans | -72.7 | 88.9 | -170.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q204 | Q204-G206 PolarHBondContact O-N 3.15Å; Q204-G206 VanDerWaalsContact O-N 3.14Å | ||
| 207 | V | 41 | Very low | 43.9 | Very low | 142 Ų | 142 | 144.5 Ų | 144.5 | 86% | 0.861 | 78% | 0.781 | S | S | * | * | trans | -80.8 | 126.2 | 163.6 | -74.1 | 0 | 0 | 0 | 0 | 111.5 | E205 | E205-V207 PolarHBondContact O-N 3.04Š| ||
| 208 | A | 42.8 | Very low | 43.7 | Very low | 79 Ų | 79 | 141.7 Ų | 141.7 | 65% | 0.653 | 78% | 0.781 | S | S | * | * | trans | -47.6 | 147.8 | -173.6 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 209 | N | 34.5 | Very low | 43.6 | Very low | 144 Ų | 144 | 140.8 Ų | 140.8 | 77% | 0.77 | 79% | 0.786 | S | S | * | * | 172.8 | 118.7 | 104.7 | -94.8 | -71.5 | 0 | 0 | 0 | 115.5 | |||||
| 210 | R | 37.5 | Very low | 43.2 | Very low | 217 Ų | 217 | 142.3 Ų | 142.3 | 82% | 0.819 | 80% | 0.795 | S | S | * | * | 44.8 | 86.7 | 120.1 | -161.5 | -171.2 | -154.2 | -133.6 | 10.1 | 120.1 | |||||
| 211 | L | 37.1 | Very low | 42.6 | Very low | 161 Ų | 161 | 141.3 Ų | 141.3 | 84% | 0.843 | 80% | 0.799 | S | S | * | * | trans | -163.2 | 137.1 | 142.5 | -134.9 | 65.2 | 0 | 0 | 0 | 107.3 | ||||
| 212 | L | 39.4 | Very low | 41.9 | Very low | 145 Ų | 145 | 147.4 Ų | 147.4 | 76% | 0.759 | 83% | 0.831 | S | S | * | * | cis | -136.5 | 138.4 | 23.2 | -69 | 139.4 | 0 | 0 | 0 | 110.4 | ||||
| 213 | R | 40.3 | Very low | 41 | Very low | 234 Ų | 234 | 150.7 Ų | 150.7 | 88% | 0.883 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 124.6 | 156.2 | -77.7 | -174.1 | 177.3 | -178.6 | -1.3 | 107.5 | F215 | R213-F215 PolarHBondContact O-N 2.78Š|
| 214 | L | 46.5 | Very low | 40.6 | Very low | 168 Ų | 168 | 151.9 Ų | 151.9 | 88% | 0.88 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -63 | 135 | 165.1 | -84.7 | 87.6 | 0 | 0 | 0 | 109.2 | ||
| 215 | F | 40.3 | Very low | 40.4 | Very low | 200 Ų | 200 | 151.1 Ų | 151.1 | 88% | 0.877 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 124.5 | 166.7 | -125.7 | -106.4 | 0 | 0 | 0 | 108.4 | R213 | R213-F215 PolarHBondContact O-N 2.78Š|
| 216 | D | 37.8 | Very low | 40.3 | Very low | 166 Ų | 166 | 149.5 Ų | 149.5 | 89% | 0.888 | 85% | 0.851 | S | S | * | * | trans | -175.8 | 149 | 137.9 | -98.2 | -24.8 | 0 | 0 | 0 | 110.3 | ||||
| 217 | G | 41.9 | Very low | 40.2 | Very low | 75 Ų | 75 | 153.7 Ų | 153.7 | 77% | 0.773 | 85% | 0.851 | S | S | * | * | trans | 111.9 | 67.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 218 | S | 45.7 | Very low | 40.1 | Very low | 114 Ų | 114 | 154.5 Ų | 154.5 | 80% | 0.797 | 85% | 0.851 | S | S | * | * | trans | -57.4 | 134.6 | 158.3 | 172.7 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 219 | C | 41 | Very low | 39.9 | Very low | 130 Ų | 130 | 159.9 Ų | 159.9 | 88% | 0.878 | 87% | 0.865 | S | S | * | * | trans | -166.1 | 148.2 | 131.6 | -112.5 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 220 | V | 40.9 | Very low | 40.3 | Very low | 136 Ų | 136 | 161.1 Ų | 161.1 | 82% | 0.824 | 87% | 0.872 | S | S | * | * | trans | -91 | 144.7 | -176.3 | 165.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 221 | A | 37.6 | Very low | 40.6 | Very low | 98 Ų | 98 | 156.4 Ų | 156.4 | 81% | 0.81 | 88% | 0.877 | S | S | * | * | trans | -156.3 | 153.6 | 143.7 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 222 | L | 38.4 | Very low | 40.9 | Very low | 250 Ų | 250 | 156 Ų | 156 | 100% | 1.309 | 88% | 0.88 | S | S | * | * | trans | -67 | 0 | -178.4 | -70 | 151.5 | 0 | 0 | 0 | 113.6 |
Retrieved 222 of 222 residues in 139.5 ms
(Link to these results)