| 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 | 48.3 | Very low | 51.5 | Low | 228 Ų | 228 | 148.8 Ų | 148.8 | 100% | 1.123 | 81% | 0.805 | S | S | * | * | 0 | 113.9 | 0 | -78.6 | -76.5 | -136.8 | 0 | 0 | 107.5 | |||||
| 2 | L | 51.8 | Low | 52 | Low | 153 Ų | 153 | 149.3 Ų | 149.3 | 80% | 0.801 | 80% | 0.801 | S | S | * | * | trans | 55.9 | 109.2 | 158.8 | -50.9 | 173.1 | 0 | 0 | 0 | 117.3 | ||||
| 3 | T | 48.8 | Very low | 51.3 | Low | 116 Ų | 116 | 145.6 Ų | 145.6 | 71% | 0.712 | 79% | 0.79 | S | S | * | * | cis | 53.4 | 129.4 | 46.6 | 72.5 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 4 | L | 57.2 | Low | 50.6 | Low | 160 Ų | 160 | 148.3 Ų | 148.3 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | cis | -158.3 | 175.4 | 1.7 | -105.1 | 165.2 | 0 | 0 | 0 | 107.6 | ||||
| 5 | P | 54.5 | Low | 50.2 | Low | 110 Ų | 110 | 146.3 Ų | 146.3 | 71% | 0.714 | 80% | 0.797 | S | S | * | * | trans | -87.7 | 172.7 | -169.4 | 37.7 | -37.9 | 0 | 0 | 0 | 114.5 | ||||
| 6 | F | 55.2 | Low | 49.6 | Very low | 211 Ų | 211 | 149.8 Ų | 149.8 | 93% | 0.925 | 81% | 0.806 | S | S | * | * | trans | -118.9 | 141.1 | 166.8 | -121.3 | -94.9 | 0 | 0 | 0 | 111.2 | ||||
| 7 | D | 47.6 | Very low | 49.1 | Very low | 141 Ų | 141 | 151.4 Ų | 151.4 | 75% | 0.754 | 81% | 0.81 | S | S | * | * | trans | -95.3 | 134.5 | 175 | -168.4 | -39.8 | 0 | 0 | 0 | 108.1 | ||||
| 8 | E | 54.4 | Low | 48.6 | Very low | 178 Ų | 178 | 148.4 Ų | 148.4 | 83% | 0.832 | 80% | 0.802 | S | S | * | * | trans | -140.3 | 118 | 165.6 | -162.6 | 170.8 | 157.2 | 0 | 0 | 111.2 | V10 | E8-V10 PolarHBondContact O-N 3.32Š| ||
| 9 | S | 47 | Very low | 48.1 | Very low | 98 Ų | 98 | 153.9 Ų | 153.9 | 69% | 0.685 | 81% | 0.81 | S | S | * | * | trans | -75 | 116.4 | -176.2 | 55.2 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 10 | V | 52.7 | Low | 47.7 | Very low | 120 Ų | 120 | 155.8 Ų | 155.8 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | trans | -106.3 | 107.4 | 164.1 | 178 | 0 | 0 | 0 | 0 | 109.8 | E8 M12 | E8-V10 PolarHBondContact O-N 3.32Å; V10-M12 HydrophobicContact CG1-CE 4.1Å; V10-M12 PolarHBondContact O-N 3.49Å | ||
| 11 | V | 48.7 | Very low | 47.3 | Very low | 122 Ų | 122 | 157.6 Ų | 157.6 | 74% | 0.739 | 81% | 0.813 | S | S | * | * | trans | -74.4 | 119.8 | 176 | 178.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 12 | M | 57.2 | Low | 46.6 | Very low | 155 Ų | 155 | 152.7 Ų | 152.7 | 76% | 0.764 | 80% | 0.801 | S | S | * | * | trans | -108.7 | 115.9 | 171.1 | -74.3 | -77.7 | 96.3 | 0 | 0 | 110.5 | V10 | V10-M12 HydrophobicContact CG1-CE 4.1Å; V10-M12 PolarHBondContact O-N 3.49Å | ||
| 13 | P | 42.9 | Very low | 46 | Very low | 101 Ų | 101 | 156 Ų | 156 | 66% | 0.656 | 80% | 0.803 | S | S | * | * | trans | -80.6 | 174.2 | 162 | 35.1 | -32.1 | 0 | 0 | 0 | 110.9 | ||||
| 14 | E | 41.8 | Very low | 45.7 | Very low | 183 Ų | 183 | 158.6 Ų | 158.6 | 86% | 0.855 | 81% | 0.807 | S | S | * | * | trans | 74.1 | 100.4 | 169.6 | -50.2 | -163.1 | 148.2 | 0 | 0 | 119 | ||||
| 15 | S | 44.6 | Very low | 44.8 | Very low | 119 Ų | 119 | 156.9 Ų | 156.9 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | -163.5 | 98.7 | 120.1 | -87.5 | 0 | 0 | 0 | 0 | 110.9 | M17 | S15-M17 VanDerWaalsContact C-N 3.32Å; S15-M17 PolarHBondContact O-N 2.81Å | |||
| 16 | Q | 40.9 | Very low | 44.1 | Very low | 201 Ų | 201 | 159.5 Ų | 159.5 | 94% | 0.939 | 81% | 0.809 | S | S | * | * | trans | -77.4 | 74.7 | 179.8 | -174.2 | -174.4 | 86.2 | 0 | 0 | 110.7 | ||||
| 17 | M | 40.7 | Very low | 43.8 | Very low | 177 Ų | 177 | 157 Ų | 157 | 87% | 0.872 | 81% | 0.806 | S | S | * | * | trans | -140.3 | 142.1 | 179.7 | -141.4 | 55.6 | 153.6 | 0 | 0 | 112.8 | S15 | S15-M17 VanDerWaalsContact C-N 3.32Å; S15-M17 PolarHBondContact O-N 2.81Å | ||
| 18 | C | 39.7 | Very low | 43.4 | Very low | 99 Ų | 99 | 157.4 Ų | 157.4 | 67% | 0.669 | 80% | 0.803 | S | S | * | * | trans | 77.9 | 54 | 179.1 | -139.1 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 19 | R | 39.6 | Very low | 43.1 | Very low | 252 Ų | 252 | 158 Ų | 158 | 95% | 0.951 | 80% | 0.803 | S | S | * | * | trans | -109.6 | 47.6 | 155.2 | -82.5 | -168 | 178.2 | 176.5 | 1.2 | 112.6 | ||||
| 20 | K | 40.8 | Very low | 42.7 | Very low | 192 Ų | 192 | 161.6 Ų | 161.6 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | trans | -148 | 87.7 | 174.1 | -69.6 | -169 | -179.3 | 176.7 | 0 | 113.1 | ||||
| 21 | F | 38.1 | Very low | 42.3 | Very low | 194 Ų | 194 | 162.9 Ų | 162.9 | 85% | 0.851 | 81% | 0.81 | S | S | * | * | trans | -132.2 | 55.2 | 158.9 | -80.6 | -68.1 | 0 | 0 | 0 | 111.1 | ||||
| 22 | S | 34.4 | Very low | 41.9 | Very low | 124 Ų | 124 | 166.4 Ų | 166.4 | 87% | 0.867 | 82% | 0.816 | S | S | * | * | trans | -97.5 | 104.4 | 153.5 | -74.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 23 | R | 40.4 | Very low | 41.2 | Very low | 223 Ų | 223 | 168.1 Ų | 168.1 | 84% | 0.842 | 82% | 0.819 | S | S | * | * | trans | -158.5 | 100.2 | 157.9 | -124.8 | 173.9 | -175.5 | 171.6 | 5.1 | 111.4 | ||||
| 24 | E | 40.6 | Very low | 41.1 | Very low | 170 Ų | 170 | 169.1 Ų | 169.1 | 79% | 0.794 | 83% | 0.825 | S | S | * | * | 42.7 | 105.9 | 128.7 | -61.4 | 165.6 | 147.8 | 0 | 0 | 117.4 | |||||
| 25 | C | 38.8 | Very low | 40.8 | Very low | 124 Ų | 124 | 169.7 Ų | 169.7 | 84% | 0.838 | 83% | 0.828 | S | S | * | * | trans | -146.4 | 84.7 | 142.7 | -161.9 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 26 | E | 40.8 | Very low | 40.8 | Very low | 165 Ų | 165 | 169.4 Ų | 169.4 | 77% | 0.771 | 83% | 0.826 | S | S | * | * | trans | -67.4 | 134.4 | 163.2 | -68.5 | -161 | 119.2 | 0 | 0 | 108.6 | ||||
| 27 | D | 49.1 | Very low | 40.6 | Very low | 158 Ų | 158 | 168.7 Ų | 168.7 | 85% | 0.845 | 82% | 0.82 | S | S | * | * | trans | -140.9 | 111.6 | 161 | -140.4 | -18.4 | 0 | 0 | 0 | 108.4 | K29 | D27-K29 PolarHBondContact O-N 3.35Š| ||
| 28 | Q | 39.5 | Very low | 40.6 | Very low | 150 Ų | 150 | 166.1 Ų | 166.1 | 70% | 0.701 | 82% | 0.819 | S | S | * | * | trans | -81.2 | 115.4 | -165.1 | -66.2 | 173.3 | 8.5 | 0 | 0 | 111 | ||||
| 29 | K | 48 | Very low | 41 | Very low | 192 Ų | 192 | 170.1 Ų | 170.1 | 84% | 0.835 | 83% | 0.825 | S | S | * | * | trans | -126.2 | 91.3 | 157.2 | -78.4 | -167.7 | 175 | 179.7 | 0 | 111.8 | D27 I31 | D27-K29 PolarHBondContact O-N 3.35Å; K29-I31 PolarHBondContact O-N 3.14Å | ||
| 30 | Q | 38 | Very low | 40.9 | Very low | 172 Ų | 172 | 166.3 Ų | 166.3 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | trans | -49.7 | 103.9 | 161.9 | -71.3 | -88.3 | 7.9 | 0 | 0 | 110.4 | ||||
| 31 | I | 44.5 | Very low | 41 | Very low | 147 Ų | 147 | 164.2 Ų | 164.2 | 75% | 0.754 | 82% | 0.815 | S | S | * | * | trans | -114.2 | 97.8 | 164.2 | -63.3 | 179.7 | 0 | 0 | 0 | 107.1 | K29 K33 | K29-I31 PolarHBondContact O-N 3.14Å; I31-K33 PolarHBondContact O-N 3.21Å | ||
| 32 | K | 39.2 | Very low | 40.9 | Very low | 197 Ų | 197 | 160.4 Ų | 160.4 | 86% | 0.857 | 81% | 0.807 | S | S | * | * | trans | -58.4 | 119.2 | 170.5 | -68.7 | 178.3 | 175.9 | -179.9 | 0 | 108.7 | ||||
| 33 | K | 42.3 | Very low | 41.7 | Very low | 190 Ų | 190 | 161.9 Ų | 161.9 | 83% | 0.826 | 81% | 0.805 | S | S | * | * | trans | -112.1 | 133.2 | 164 | -118.8 | -176.3 | 176.8 | -177.7 | 0 | 108 | I31 | I31-K33 PolarHBondContact O-N 3.21Š| ||
| 34 | P | 41.9 | Very low | 41.6 | Very low | 123 Ų | 123 | 162.9 Ų | 162.9 | 80% | 0.799 | 81% | 0.808 | S | S | * | * | trans | -70.3 | 150.4 | -173.7 | 29 | -34.9 | 0 | 0 | 0 | 111.7 | ||||
| 35 | E | 35.3 | Very low | 41.5 | Very low | 195 Ų | 195 | 158.1 Ų | 158.1 | 91% | 0.911 | 81% | 0.805 | S | S | * | * | trans | -63.5 | 140.9 | 178.3 | -58.6 | 173.4 | 130.8 | 0 | 0 | 111.4 | ||||
| 36 | S | 44.8 | Very low | 41.9 | Very low | 112 Ų | 112 | 162 Ų | 162 | 78% | 0.783 | 81% | 0.808 | S | S | * | * | trans | -128.8 | 80.7 | 170.1 | 66.8 | 0 | 0 | 0 | 0 | 110.9 | S38 | S36-S38 PolarHBondContact O-N 2.88Š| ||
| 37 | F | 36.3 | Very low | 41.8 | Very low | 186 Ų | 186 | 159.6 Ų | 159.6 | 82% | 0.816 | 81% | 0.809 | S | S | * | * | trans | 32.2 | 82.4 | 151.1 | -100.8 | -95.7 | 0 | 0 | 0 | 117.6 | K39 | F37-K39 PolarHBondContact O-N 3.09Š| ||
| 38 | S | 39.8 | Very low | 41.6 | Very low | 123 Ų | 123 | 160 Ų | 160 | 86% | 0.86 | 81% | 0.81 | S | S | * | * | trans | -71.4 | 104.1 | 154.2 | -72.6 | 0 | 0 | 0 | 0 | 109 | S36 Q40 | S36-S38 PolarHBondContact O-N 2.88Å; S38-Q40 PolarHBondContact O-N 3.23Å; S38-Q40 VanDerWaalsContact O-N 3.14Å | ||
| 39 | K | 49.4 | Very low | 41.7 | Very low | 183 Ų | 183 | 161.3 Ų | 161.3 | 80% | 0.796 | 81% | 0.813 | S | S | * | * | trans | -66.9 | 113.9 | 173.7 | -77 | -171.5 | 176.6 | -176 | 0 | 110.2 | F37 I41 | F37-K39 PolarHBondContact O-N 3.09Å; K39-I41 PolarHBondContact O-N 3.35Å | ||
| 40 | Q | 36.9 | Very low | 41.4 | Very low | 173 Ų | 173 | 163.9 Ų | 163.9 | 81% | 0.808 | 82% | 0.817 | S | S | * | * | trans | -60 | 114 | 175.1 | -179.9 | 178.7 | 18.3 | 0 | 0 | 111.2 | S38 V42 | S38-Q40 PolarHBondContact O-N 3.23Å; S38-Q40 VanDerWaalsContact O-N 3.14Å; Q40-V42 HydrophobicContact CG-CG2 3.84Å | ||
| 41 | I | 43.1 | Very low | 41.3 | Very low | 148 Ų | 148 | 159.4 Ų | 159.4 | 76% | 0.759 | 81% | 0.81 | S | S | * | * | trans | -115.8 | 107.7 | 160.7 | -64.4 | 179.5 | 0 | 0 | 0 | 107.2 | K39 L43 | K39-I41 PolarHBondContact O-N 3.35Å; I41-L43 HydrophobicContact CG2-CD1 4.39Å; I41-L43 HydrophobicContact CG2-CG 4.34Å; I41-L43 PolarHBondContact O-N 3.44Å | ||
| 42 | V | 35.6 | Very low | 41.5 | Very low | 114 Ų | 114 | 158 Ų | 158 | 69% | 0.691 | 81% | 0.811 | S | S | * | * | trans | -81.9 | 98.7 | 179 | 177.4 | 0 | 0 | 0 | 0 | 109.1 | Q40 | Q40-V42 HydrophobicContact CG-CG2 3.84Š| ||
| 43 | L | 50.5 | Low | 42 | Very low | 154 Ų | 154 | 150.7 Ų | 150.7 | 81% | 0.806 | 79% | 0.791 | S | S | * | * | trans | -131.4 | 79.4 | 166.2 | -76 | 178.5 | 0 | 0 | 0 | 111.8 | I41 G45 | I41-L43 HydrophobicContact CG2-CD1 4.39Å; I41-L43 HydrophobicContact CG2-CG 4.34Å; I41-L43 PolarHBondContact O-N 3.44Å; L43-G45 PolarHBondContact O-N 2.85Å | ||
| 44 | R | 39.8 | Very low | 42.3 | Very low | 244 Ų | 244 | 149.4 Ų | 149.4 | 92% | 0.921 | 79% | 0.788 | S | S | * | * | trans | 21.2 | 84.3 | 140.5 | -160.7 | 173 | -169.8 | -103.3 | 4.7 | 117.6 | ||||
| 45 | G | 37.8 | Very low | 42.5 | Very low | 71 Ų | 71 | 150.6 Ų | 150.6 | 73% | 0.732 | 78% | 0.783 | S | S | * | * | trans | 44.7 | 101.5 | 143.7 | 0 | 0 | 0 | 0 | 0 | 119.8 | L43 | L43-G45 PolarHBondContact O-N 2.85Š| ||
| 46 | K | 47.9 | Very low | 43.3 | Very low | 206 Ų | 206 | 144.1 Ų | 144.1 | 90% | 0.896 | 76% | 0.757 | S | S | * | * | trans | -149.9 | 153.4 | 146.5 | -113.2 | 164.3 | -177.1 | 177.3 | 0 | 110.8 | I48 | K46-I48 PolarHBondContact O-N 2.97Š| ||
| 47 | S | 37.2 | Very low | 43.6 | Very low | 113 Ų | 113 | 144.4 Ų | 144.4 | 79% | 0.79 | 75% | 0.745 | S | S | * | * | trans | -61.6 | 120 | -165.7 | -155.7 | 0 | 0 | 0 | 0 | 113.3 | K49 | S47-K49 PolarHBondContact O-N 3.02Å; S47-K49 VanDerWaalsContact O-N 3.12Å | ||
| 48 | I | 45.8 | Very low | 44.4 | Very low | 168 Ų | 168 | 143.2 Ų | 143.2 | 86% | 0.862 | 74% | 0.74 | S | S | * | * | trans | -80.6 | 93.1 | 174.1 | -58.9 | 176 | 0 | 0 | 0 | 108.8 | K46 | K46-I48 PolarHBondContact O-N 2.97Š| ||
| 49 | K | 42.4 | Very low | 44.9 | Very low | 177 Ų | 177 | 143.4 Ų | 143.4 | 77% | 0.77 | 73% | 0.727 | S | S | * | * | trans | -140.2 | 139.4 | 161.4 | -76.9 | -170 | 176.7 | -177.1 | 0 | 109.4 | S47 | S47-K49 PolarHBondContact O-N 3.02Å; S47-K49 VanDerWaalsContact O-N 3.12Å | ||
| 50 | R | 40.2 | Very low | 45 | Very low | 246 Ų | 246 | 138 Ų | 138 | 93% | 0.928 | 71% | 0.705 | S | S | * | * | S | Bend | trans | 92.4 | 151.3 | 175.7 | -55.7 | 178.1 | -69.8 | -164.9 | 6.7 | 115.2 | ||
| 51 | A | 37.4 | Very low | 45.6 | Very low | 78 Ų | 78 | 135.4 Ų | 135.4 | 65% | 0.645 | 69% | 0.693 | S | S | * | * | trans | -92.4 | 139.8 | -159.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | G53 | A51-G53 PolarHBondContact O-N 3.22Š| ||
| 52 | P | 47.8 | Very low | 45.9 | Very low | 118 Ų | 118 | 134.4 Ų | 134.4 | 77% | 0.766 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | 32 | -177.8 | 37.3 | -37.8 | 0 | 0 | 0 | 113 | ||
| 53 | G | 50.4 | Low | 46.6 | Very low | 43 Ų | 43 | 135.4 Ų | 135.4 | 44% | 0.443 | 68% | 0.682 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -95.6 | -38.4 | -171.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | A51 | A51-G53 PolarHBondContact O-N 3.22Š|
| 54 | E | 48.4 | Very low | 46.6 | Very low | 163 Ų | 163 | 133.3 Ų | 133.3 | 76% | 0.762 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -101.8 | -25.7 | -167.1 | -64.8 | 174.3 | 176.6 | 0 | 0 | 113.6 | E57 | E54-E57 PolarHBondContact O-N 3.45Š|
| 55 | E | 45.1 | Very low | 47.2 | Very low | 148 Ų | 148 | 129.7 Ų | 129.7 | 69% | 0.692 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -70.2 | -34.2 | -178.9 | -65.6 | 178.6 | 170.8 | 0 | 0 | 111.5 | E57 K58 | E55-E57 VanDerWaalsContact C-N 3.31Å; E55-E57 PolarHBondContact O-N 2.91Å; E55-K58 PolarHBondContact O-N 3.3Å |
| 56 | T | 51.7 | Low | 47.8 | Very low | 59 Ų | 59 | 134 Ų | 134 | 36% | 0.362 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -82.1 | -0.1 | -179.4 | 56.2 | 0 | 0 | 0 | 0 | 114.8 | R91 | T56-R91 PolarHBondContact O-NH1 3.02Å; T56-R91 PolarHBondContact O-NH2 2.98Å |
| 57 | E | 53 | Low | 47.7 | Very low | 118 Ų | 118 | 130.8 Ų | 130.8 | 55% | 0.551 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -90.3 | -30.8 | 170.7 | -62.4 | -162.9 | 145.9 | 0 | 0 | 111.7 | E54 E55 E61 | E54-E57 PolarHBondContact O-N 3.45Å; E55-E57 VanDerWaalsContact C-N 3.31Å; E55-E57 PolarHBondContact O-N 2.91Å; E57-E61 PolarHBondContact O-N 2.7Å |
| 58 | K | 51.8 | Low | 48.1 | Very low | 160 Ų | 160 | 134.2 Ų | 134.2 | 70% | 0.696 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -72.3 | -42.1 | 177.6 | -65.8 | -175.6 | 178.5 | -178.8 | 0 | 112.9 | E55 E60 E61 E62 | E55-K58 PolarHBondContact O-N 3.3Å; K58-E60 VanDerWaalsContact C-N 3.3Å; K58-E60 PolarHBondContact O-N 2.72Å; K58-E61 PolarHBondContact O-N 3.32Å; K58-E62 PolarHBondContact O-N 3.49Å |
| 59 | E | 51.9 | Low | 48.4 | Very low | 128 Ų | 128 | 129.1 Ų | 129.1 | 60% | 0.598 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -62.9 | -32.2 | 178.8 | -65 | 177.7 | 161.3 | 0 | 0 | 112.9 | E62 E63 | E59-E62 PolarHBondContact O-N 3.4Å; E59-E63 PolarHBondContact O-N 3.29Å; E59-E63 VanDerWaalsContact O-N 3.12Å |
| 60 | E | 49.9 | Very low | 49.2 | Very low | 68 Ų | 68 | 130.2 Ų | 130.2 | 32% | 0.318 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -79.6 | -22.8 | 176.9 | -80.8 | -167 | 174 | 0 | 0 | 113.5 | K58 E62 D64 R91 | K58-E60 VanDerWaalsContact C-N 3.3Å; K58-E60 PolarHBondContact O-N 2.72Å; E60-E62 VanDerWaalsContact C-N 3.3Å; E60-D64 PolarHBondContact O-N 2.92Å; E60-R91 VanDerWaalsContact CD-NH1 3.28Å; E60-R91 IonicContact OE1-CZ 2.63Å; E60-R91 IonicContact OE1-NE 3.3Å; E60-R91 PolarHBondContact OE1-NE 3.5Å; E60-R91 IonicContact OE1-NH1 3.8Å; E60-R91 IonicContact OE1-NH2 2.79Å; E60-R91 PolarHBondContact OE1-NH2 3.4Å; E60-R91 VanDerWaalsContact OE1-NH2 3.11Å; E60-R91 WeakPolarHBondContact OE2-CD 3.49Å; E60-R91 IonicContact OE2-CZ 3.96Å; E60-R91 IonicContact OE2-NE 3.98Å; E60-R91 PolarHBondContact OE2-NE 3.35Å; E60-R91 VanDerWaalsContact OE2-NE 3.1Å; E60-R91 IonicContact OE2-NH1 2.88Å; E60-R91 PolarHBondContact OE2-NH1 3.14Å; E60-R91 IonicContact OE2-NH2 3.04Å |
| 61 | E | 49.1 | Very low | 49.8 | Very low | 119 Ų | 119 | 124.3 Ų | 124.3 | 56% | 0.556 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -73.2 | -23.2 | 169.6 | -76.9 | -162.4 | 177.5 | 0 | 0 | 112.6 | E57 K58 R65 | E57-E61 PolarHBondContact O-N 2.7Å; K58-E61 PolarHBondContact O-N 3.32Å; E61-R65 WeakPolarHBondContact O-CB 3.41Å; E61-R65 WeakPolarHBondContact O-CD 3.5Å; E61-R65 WeakPolarHBondContact O-CG 3.4Å; E61-R65 PolarHBondContact O-NE 2.91Å; E61-R65 IonicContact OE2-CZ 3.11Å; E61-R65 IonicContact OE2-NH2 2.81Å; E61-R65 PolarHBondContact OE2-NH2 3.31Å |
| 62 | E | 49.5 | Very low | 50.5 | Low | 127 Ų | 127 | 124.1 Ų | 124.1 | 59% | 0.593 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -79 | -45.6 | 170.2 | -67.8 | -179.6 | 159.2 | 0 | 0 | 110.4 | K58 E59 E60 D64 R65 E66 | K58-E62 PolarHBondContact O-N 3.49Å; E59-E62 PolarHBondContact O-N 3.4Å; E60-E62 VanDerWaalsContact C-N 3.3Å; E62-D64 PolarHBondContact O-N 3.48Å; E62-R65 WeakPolarHBondContact O-CA 3.24Å; E62-R65 WeakPolarHBondContact O-CB 3.27Å; E62-R65 PolarHBondContact O-N 3.44Å; E62-E66 PolarHBondContact O-N 3.4Å |
| 63 | E | 50.7 | Low | 51 | Low | 136 Ų | 136 | 124.8 Ų | 124.8 | 64% | 0.636 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -66 | -31.9 | -175.9 | -152.2 | -174.9 | -144.1 | 0 | 0 | 114.7 | E59 | E59-E63 PolarHBondContact O-N 3.29Å; E59-E63 VanDerWaalsContact O-N 3.12Å |
| 64 | D | 50.9 | Low | 51.1 | Low | 109 Ų | 109 | 128.2 Ų | 128.2 | 58% | 0.583 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.7 | -0.3 | 172.1 | -110.1 | -14.6 | 0 | 0 | 0 | 112.5 | E60 E62 K82 | E60-D64 PolarHBondContact O-N 2.92Å; E62-D64 PolarHBondContact O-N 3.48Å; D64-K82 IonicContact OD1-NZ 2.66Å; D64-K82 PolarHBondContact OD1-NZ 3.39Å |
| 65 | R | 52.5 | Low | 51.5 | Low | 169 Ų | 169 | 128.6 Ų | 128.6 | 64% | 0.638 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96 | -21.6 | 172.1 | -77.7 | 177.1 | -142.6 | -143.5 | 7.6 | 114.1 | E61 E62 E67 | E61-R65 WeakPolarHBondContact O-CB 3.41Å; E61-R65 WeakPolarHBondContact O-CD 3.5Å; E61-R65 WeakPolarHBondContact O-CG 3.4Å; E61-R65 PolarHBondContact O-NE 2.91Å; E61-R65 IonicContact OE2-CZ 3.11Å; E61-R65 IonicContact OE2-NH2 2.81Å; E61-R65 PolarHBondContact OE2-NH2 3.31Å; E62-R65 WeakPolarHBondContact O-CA 3.24Å; E62-R65 WeakPolarHBondContact O-CB 3.27Å; E62-R65 PolarHBondContact O-N 3.44Å; R65-E67 PolarHBondContact O-N 3.33Å |
| 66 | E | 49.8 | Very low | 51.8 | Low | 160 Ų | 160 | 133.3 Ų | 133.3 | 75% | 0.748 | 64% | 0.642 | S | S | * | * | trans | -83.7 | 6.4 | -172.1 | -72.7 | -174.3 | 175.6 | 0 | 0 | 116.1 | E62 E68 | E62-E66 PolarHBondContact O-N 3.4Å; E66-E68 VanDerWaalsContact C-N 3.34Å; E66-E68 PolarHBondContact O-N 2.91Å | ||
| 67 | E | 45.9 | Very low | 51.6 | Low | 139 Ų | 139 | 143 Ų | 143 | 65% | 0.65 | 67% | 0.672 | S | S | * | * | trans | -90.9 | 48.8 | 169.8 | -91.7 | -160.7 | -125.9 | 0 | 0 | 113.1 | R65 R75 | R65-E67 PolarHBondContact O-N 3.33Å; E67-R75 IonicContact OE2-NH1 2.69Å; E67-R75 PolarHBondContact OE2-NH1 3.25Å | ||
| 68 | E | 47.1 | Very low | 51.5 | Low | 186 Ų | 186 | 139.9 Ų | 139.9 | 87% | 0.869 | 67% | 0.672 | S | S | * | * | trans | -81.4 | 115.5 | 160.2 | -71.4 | -162.5 | 150.1 | 0 | 0 | 109.6 | E66 | E66-E68 VanDerWaalsContact C-N 3.34Å; E66-E68 PolarHBondContact O-N 2.91Å | ||
| 69 | D | 50.4 | Low | 52.1 | Low | 61 Ų | 61 | 140.6 Ų | 140.6 | 33% | 0.326 | 68% | 0.682 | S | S | . | * | trans | -84 | 147.6 | 169.7 | 92.3 | 56.6 | 0 | 0 | 0 | 111.3 | N71 G72 R75 | D69-N71 PolarHBondContact O-N 3.08Å; D69-N71 WeakPolarHBondContact OD1-CB 3.22Å; D69-N71 PolarHBondContact OD1-N 2.95Å; D69-N71 PolarHBondContact OD1-ND2 3.32Å; D69-G72 PolarHBondContact O-N 3.47Å; D69-R75 IonicContact OD2-CZ 2.94Å; D69-R75 IonicContact OD2-NE 3.57Å; D69-R75 PolarHBondContact OD2-NE 2.81Å; D69-R75 IonicContact OD2-NH2 2.97Å; D69-R75 PolarHBondContact OD2-NH2 3.36Å | ||
| 70 | E | 60.7 | Low | 52.3 | Low | 199 Ų | 199 | 145.4 Ų | 145.4 | 93% | 0.93 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.7 | 0.5 | -167.8 | -151.1 | -179.8 | 177.5 | 0 | 0 | 115 | ||
| 71 | N | 52.8 | Low | 52.9 | Low | 122 Ų | 122 | 151.5 Ų | 151.5 | 65% | 0.652 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113 | 5.3 | -176.3 | -51.6 | -86.1 | 0 | 0 | 0 | 114.6 | D69 L73 | D69-N71 PolarHBondContact O-N 3.08Å; D69-N71 WeakPolarHBondContact OD1-CB 3.22Å; D69-N71 PolarHBondContact OD1-N 2.95Å; D69-N71 PolarHBondContact OD1-ND2 3.32Å; N71-L73 PolarHBondContact O-N 3.33Å |
| 72 | G | 51.6 | Low | 53.7 | Low | 74 Ų | 74 | 151.6 Ų | 151.6 | 76% | 0.763 | 72% | 0.719 | S | S | * | * | trans | 61 | 18.2 | 165 | 0 | 0 | 0 | 0 | 0 | 117 | D69 | D69-G72 PolarHBondContact O-N 3.47Š| ||
| 73 | L | 58.1 | Low | 54.6 | Low | 132 Ų | 132 | 154.9 Ų | 154.9 | 69% | 0.691 | 73% | 0.731 | S | S | * | * | trans | -101.5 | 121.3 | -176.1 | -83.2 | 158 | 0 | 0 | 0 | 111.1 | N71 R75 | N71-L73 PolarHBondContact O-N 3.33Å; L73-R75 PolarHBondContact O-N 2.93Å | ||
| 74 | P | 52.4 | Low | 55.8 | Low | 116 Ų | 116 | 152.3 Ų | 152.3 | 75% | 0.753 | 73% | 0.725 | S | S | * | * | trans | -65.2 | 109.5 | -176.4 | 25.4 | -33.8 | 0 | 0 | 0 | 110.8 | R76 | P74-R76 PolarHBondContact O-N 2.94Š| ||
| 75 | R | 56.1 | Low | 57.4 | Low | 171 Ų | 171 | 150.9 Ų | 150.9 | 65% | 0.645 | 72% | 0.721 | S | S | * | * | trans | -55 | 114.1 | -178.6 | -73.8 | -178.8 | 168.6 | -173.6 | -2.9 | 110.3 | E67 D69 L73 R77 | E67-R75 IonicContact OE2-NH1 2.69Å; E67-R75 PolarHBondContact OE2-NH1 3.25Å; D69-R75 IonicContact OD2-CZ 2.94Å; D69-R75 IonicContact OD2-NE 3.57Å; D69-R75 PolarHBondContact OD2-NE 2.81Å; D69-R75 IonicContact OD2-NH2 2.97Å; D69-R75 PolarHBondContact OD2-NH2 3.36Å; L73-R75 PolarHBondContact O-N 2.93Å; R75-R77 PolarHBondContact O-N 3.31Å | ||
| 76 | R | 51.4 | Low | 59.2 | Low | 247 Ų | 247 | 150.7 Ų | 150.7 | 93% | 0.932 | 72% | 0.724 | S | S | * | * | trans | -56.8 | 135.9 | -170.2 | -76.9 | -158.5 | 168.5 | -145.9 | -2.2 | 112.2 | P74 G78 | P74-R76 PolarHBondContact O-N 2.94Å; R76-G78 VanDerWaalsContact C-N 3.29Å; R76-G78 PolarHBondContact O-N 3.42Å | ||
| 77 | R | 48.1 | Very low | 61.1 | Low | 262 Ų | 262 | 148.4 Ų | 148.4 | 99% | 0.989 | 72% | 0.716 | S | S | * | * | trans | -57.3 | 80.9 | 178.6 | -64.8 | 173 | 179.1 | 163 | -1.6 | 112.1 | R75 | R75-R77 PolarHBondContact O-N 3.31Š| ||
| 78 | G | 51.8 | Low | 63.3 | Low | 53 Ų | 53 | 147.9 Ų | 147.9 | 55% | 0.546 | 71% | 0.709 | S | S | . | * | trans | -102.2 | 141.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | R76 R80 | R76-G78 VanDerWaalsContact C-N 3.29Å; R76-G78 PolarHBondContact O-N 3.42Å; G78-R80 PolarHBondContact O-N 3.41Å | ||
| 79 | L | 63.2 | Low | 65.5 | Low | 175 Ų | 175 | 142.5 Ų | 142.5 | 92% | 0.916 | 69% | 0.685 | S | S | * | * | trans | -70.1 | 58.9 | 175.6 | -172.7 | 63.5 | 0 | 0 | 0 | 111.6 | K81 | L79-K81 PolarHBondContact O-N 3.09Š| ||
| 80 | R | 56.8 | Low | 67.7 | Low | 229 Ų | 229 | 143.7 Ų | 143.7 | 86% | 0.864 | 69% | 0.689 | S | S | * | * | trans | -74.2 | 115.5 | 168.7 | -58 | -168.4 | 89.1 | -176.7 | 7.3 | 106.7 | G78 K82 | G78-R80 PolarHBondContact O-N 3.41Å; R80-K82 PolarHBondContact O-N 3.07Å | ||
| 81 | K | 62.7 | Low | 69.2 | Low | 195 Ų | 195 | 136.8 Ų | 136.8 | 85% | 0.848 | 65% | 0.654 | S | S | * | * | trans | -62.4 | 84.3 | 164.7 | -66.6 | 177.3 | 178.6 | 176.5 | 0 | 107.7 | L79 K83 | L79-K81 PolarHBondContact O-N 3.09Å; K81-K83 PolarHBondContact O-N 3.49Å | ||
| 82 | K | 65.9 | Low | 71.2 | Confident | 121 Ų | 121 | 134.7 Ų | 134.7 | 53% | 0.526 | 65% | 0.646 | S | S | . | * | trans | -51.9 | 110.5 | 173.2 | -169.7 | 171.9 | -178.5 | 176.6 | 0 | 104.4 | D64 R80 T84 | D64-K82 IonicContact OD1-NZ 2.66Å; D64-K82 PolarHBondContact OD1-NZ 3.39Å; R80-K82 PolarHBondContact O-N 3.07Å; K82-T84 PolarHBondContact O-N 2.84Å | ||
| 83 | K | 67.5 | Low | 73.3 | Confident | 197 Ų | 197 | 135.9 Ų | 135.9 | 86% | 0.857 | 63% | 0.63 | S | S | * | * | trans | -54.7 | 114.6 | 178.1 | -73.6 | 178.8 | 179.7 | 175.7 | 0 | 104.9 | K81 T85 | K81-K83 PolarHBondContact O-N 3.49Å; K83-T85 PolarHBondContact O-N 2.85Å; K83-T85 VanDerWaalsContact O-N 3.09Å | ||
| 84 | T | 75.2 | Confident | 75.2 | Confident | 81 Ų | 81 | 135.9 Ų | 135.9 | 50% | 0.497 | 63% | 0.625 | S | S | . | * | trans | -59.5 | 121.9 | -172.4 | 33.6 | 0 | 0 | 0 | 0 | 108.1 | K82 L89 | K82-T84 PolarHBondContact O-N 2.84Å; T84-L89 WeakPolarHBondContact O-CD1 3.43Å; T84-L89 VanDerWaalsContact OG1-CD1 3.29Å; T84-L89 WeakPolarHBondContact OG1-CD1 3.4Å | ||
| 85 | T | 85.6 | Confident | 77.3 | Confident | 80 Ų | 80 | 136.2 Ų | 136.2 | 49% | 0.491 | 61% | 0.611 | S | S | . | * | trans | -56.2 | 144.2 | -179.6 | -47.8 | 0 | 0 | 0 | 0 | 109.1 | K83 L87 R88 L89 | K83-T85 PolarHBondContact O-N 2.85Å; K83-T85 VanDerWaalsContact O-N 3.09Å; T85-L87 PolarHBondContact O-N 2.99Å; T85-L87 VanDerWaalsContact O-N 3.1Å; T85-R88 WeakPolarHBondContact O-CA 3.45Å; T85-R88 WeakPolarHBondContact O-CB 3.48Å; T85-R88 PolarHBondContact O-N 2.99Å; T85-L89 VanDerWaalsContact O-CD1 3.28Å; T85-L89 WeakPolarHBondContact O-CD1 3.49Å; T85-L89 PolarHBondContact O-N 2.75Å; T85-L89 VanDerWaalsContact O-N 3.08Å | ||
| 86 | K | 90 | Very high | 79.3 | Confident | 164 Ų | 164 | 136.7 Ų | 136.7 | 71% | 0.713 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -49.2 | -42.8 | -178.8 | -174.7 | -177.6 | 175.2 | -172.1 | 0 | 111.7 | R88 L89 E90 | K86-R88 PolarHBondContact O-N 3.19Å; K86-L89 PolarHBondContact O-N 3.4Å; K86-E90 PolarHBondContact O-N 3.31Å |
| 87 | L | 90.4 | Very high | 81.5 | Confident | 112 Ų | 112 | 131 Ų | 131 | 59% | 0.586 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -55.6 | -48.9 | 174.3 | -59.5 | 178.3 | 0 | 0 | 0 | 112.5 | T85 L89 E90 R91 | T85-L87 PolarHBondContact O-N 2.99Å; T85-L87 VanDerWaalsContact O-N 3.1Å; L87-L89 VanDerWaalsContact C-N 3.33Å; L87-L89 PolarHBondContact O-N 2.96Å; L87-E90 PolarHBondContact O-N 2.91Å; L87-E90 VanDerWaalsContact O-N 3.1Å; L87-R91 PolarHBondContact O-N 2.94Å |
| 88 | R | 92.1 | Very high | 83.9 | Confident | 129 Ų | 129 | 123.1 Ų | 123.1 | 49% | 0.487 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -62 | -34.6 | 176.3 | -173.4 | 170 | 174.4 | 156.4 | 0.5 | 113 | T85 K86 V92 | T85-R88 WeakPolarHBondContact O-CA 3.45Å; T85-R88 WeakPolarHBondContact O-CB 3.48Å; T85-R88 PolarHBondContact O-N 2.99Å; K86-R88 PolarHBondContact O-N 3.19Å; R88-V92 WeakPolarHBondContact O-CB 3.37Å; R88-V92 VanDerWaalsContact O-CG2 3.28Å; R88-V92 WeakPolarHBondContact O-CG2 3.48Å; R88-V92 PolarHBondContact O-N 3.32Å; R88-V92 VanDerWaalsContact O-N 3.09Å |
| 89 | L | 93.3 | Very high | 86.1 | Confident | 72 Ų | 72 | 122.5 Ų | 122.5 | 38% | 0.377 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66.3 | -45.3 | 170.7 | -78.1 | 88.9 | 0 | 0 | 0 | 111.5 | T84 T85 K86 L87 V92 K93 | T84-L89 WeakPolarHBondContact O-CD1 3.43Å; T84-L89 VanDerWaalsContact OG1-CD1 3.29Å; T84-L89 WeakPolarHBondContact OG1-CD1 3.4Å; T85-L89 VanDerWaalsContact O-CD1 3.28Å; T85-L89 WeakPolarHBondContact O-CD1 3.49Å; T85-L89 PolarHBondContact O-N 2.75Å; T85-L89 VanDerWaalsContact O-N 3.08Å; K86-L89 PolarHBondContact O-N 3.4Å; L87-L89 VanDerWaalsContact C-N 3.33Å; L87-L89 PolarHBondContact O-N 2.96Å; L89-V92 PolarHBondContact O-N 3.38Å; L89-K93 WeakPolarHBondContact O-CG 3.17Å; L89-K93 PolarHBondContact O-N 2.95Å |
| 90 | E | 95.1 | Very high | 87.8 | Confident | 86 Ų | 86 | 118.6 Ų | 118.6 | 40% | 0.402 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.9 | -41.3 | 178.3 | -61.5 | -47.2 | 137.4 | 0 | 0 | 111.7 | K86 L87 V92 K93 F94 | K86-E90 PolarHBondContact O-N 3.31Å; L87-E90 PolarHBondContact O-N 2.91Å; L87-E90 VanDerWaalsContact O-N 3.1Å; E90-V92 VanDerWaalsContact C-N 3.35Å; E90-V92 PolarHBondContact O-N 3Å; E90-K93 WeakPolarHBondContact O-CB 3.48Å; E90-K93 PolarHBondContact O-N 2.88Å; E90-K93 IonicContact OE1-NZ 2.71Å; E90-K93 PolarHBondContact OE1-NZ 3.05Å; E90-K93 WeakPolarHBondContact OE2-CD 3.49Å; E90-K93 IonicContact OE2-NZ 3.68Å; E90-K93 PolarHBondContact OE2-NZ 2.67Å; E90-F94 WeakPolarHBondContact O-CB 3.16Å; E90-F94 PolarHBondContact O-N 2.74Å |
| 91 | R | 92.9 | Very high | 89.7 | Confident | 54 Ų | 54 | 109.5 Ų | 109.5 | 20% | 0.204 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -59.4 | -41.8 | 172.7 | -173.7 | 179.8 | -73.3 | -127.5 | -12.3 | 112.2 | T56 E60 L87 F94 R95 | T56-R91 PolarHBondContact O-NH1 3.02Å; T56-R91 PolarHBondContact O-NH2 2.98Å; E60-R91 VanDerWaalsContact CD-NH1 3.28Å; E60-R91 IonicContact OE1-CZ 2.63Å; E60-R91 IonicContact OE1-NE 3.3Å; E60-R91 PolarHBondContact OE1-NE 3.5Å; E60-R91 IonicContact OE1-NH1 3.8Å; E60-R91 IonicContact OE1-NH2 2.79Å; E60-R91 PolarHBondContact OE1-NH2 3.4Å; E60-R91 VanDerWaalsContact OE1-NH2 3.11Å; E60-R91 WeakPolarHBondContact OE2-CD 3.49Å; E60-R91 IonicContact OE2-CZ 3.96Å; E60-R91 IonicContact OE2-NE 3.98Å; E60-R91 PolarHBondContact OE2-NE 3.35Å; E60-R91 VanDerWaalsContact OE2-NE 3.1Å; E60-R91 IonicContact OE2-NH1 2.88Å; E60-R91 PolarHBondContact OE2-NH1 3.14Å; E60-R91 IonicContact OE2-NH2 3.04Å; L87-R91 PolarHBondContact O-N 2.94Å; R91-F94 PolarHBondContact O-N 2.8Å; R91-R95 WeakPolarHBondContact O-CG 3.48Å; R91-R95 PolarHBondContact O-N 3.26Å |
| 92 | V | 95.2 | Very high | 91.5 | Very high | 79 Ų | 79 | 107.9 Ų | 107.9 | 48% | 0.479 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -67.9 | -39.9 | 175.2 | 169.7 | 0 | 0 | 0 | 0 | 111.8 | R88 L89 E90 R96 | R88-V92 WeakPolarHBondContact O-CB 3.37Å; R88-V92 VanDerWaalsContact O-CG2 3.28Å; R88-V92 WeakPolarHBondContact O-CG2 3.48Å; R88-V92 PolarHBondContact O-N 3.32Å; R88-V92 VanDerWaalsContact O-N 3.09Å; L89-V92 PolarHBondContact O-N 3.38Å; E90-V92 VanDerWaalsContact C-N 3.35Å; E90-V92 PolarHBondContact O-N 3Å; V92-R96 WeakPolarHBondContact O-CB 3.47Å; V92-R96 PolarHBondContact O-N 3.42Å |
| 93 | K | 96.2 | Very high | 93 | Very high | 99 Ų | 99 | 106.2 Ų | 106.2 | 43% | 0.43 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.2 | -44.9 | 173.6 | -72.8 | 166.7 | 178.8 | 177.9 | 0 | 111.4 | L89 E90 R96 Q97 | L89-K93 WeakPolarHBondContact O-CG 3.17Å; L89-K93 PolarHBondContact O-N 2.95Å; E90-K93 WeakPolarHBondContact O-CB 3.48Å; E90-K93 PolarHBondContact O-N 2.88Å; E90-K93 IonicContact OE1-NZ 2.71Å; E90-K93 PolarHBondContact OE1-NZ 3.05Å; E90-K93 WeakPolarHBondContact OE2-CD 3.49Å; E90-K93 IonicContact OE2-NZ 3.68Å; E90-K93 PolarHBondContact OE2-NZ 2.67Å; K93-R96 PolarHBondContact O-N 2.89Å; K93-Q97 WeakPolarHBondContact O-CG 3.49Å; K93-Q97 PolarHBondContact O-N 3.38Å |
| 94 | F | 96.5 | Very high | 94.5 | Very high | 131 Ų | 131 | 104 Ų | 104 | 58% | 0.575 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.1 | -52.5 | 179 | -176.6 | -95.1 | 0 | 0 | 0 | 111.3 | E90 R91 R96 Q97 E98 | E90-F94 WeakPolarHBondContact O-CB 3.16Å; E90-F94 PolarHBondContact O-N 2.74Å; R91-F94 PolarHBondContact O-N 2.8Å; F94-R96 PolarHBondContact O-N 2.83Å; F94-Q97 WeakPolarHBondContact O-CA 3.28Å; F94-Q97 WeakPolarHBondContact O-CB 3.45Å; F94-Q97 PolarHBondContact O-N 2.87Å; F94-E98 PolarHBondContact O-N 2.83Å |
| 95 | R | 97.6 | Very high | 95.6 | Very high | 124 Ų | 124 | 105.3 Ų | 105.3 | 47% | 0.468 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -57.3 | -35.2 | 175.6 | -71.8 | -168.6 | -74.6 | -153.9 | -1.3 | 112.6 | R91 A99 | R91-R95 WeakPolarHBondContact O-CG 3.48Å; R91-R95 PolarHBondContact O-N 3.26Å; R95-A99 WeakPolarHBondContact O-CB 3.44Å; R95-A99 PolarHBondContact O-N 2.95Å |
| 96 | R | 97.7 | Very high | 96.2 | Very high | 181 Ų | 181 | 109.1 Ų | 109.1 | 68% | 0.683 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -69.9 | -39.7 | 173.4 | -172.6 | 174.2 | -177.2 | 173.4 | 0.2 | 112.8 | V92 K93 F94 N100 | V92-R96 WeakPolarHBondContact O-CB 3.47Å; V92-R96 PolarHBondContact O-N 3.42Å; K93-R96 PolarHBondContact O-N 2.89Å; F94-R96 PolarHBondContact O-N 2.83Å; R96-N100 WeakPolarHBondContact O-CB 3.38Å; R96-N100 PolarHBondContact O-N 3.28Å; R96-N100 PolarHBondContact O-ND2 2.98Å; R96-N100 PolarHBondContact O-OD1 3.46Å |
| 97 | Q | 97.7 | Very high | 96.7 | Very high | 127 Ų | 127 | 104.3 Ų | 104.3 | 59% | 0.593 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -64.5 | -43 | 175.5 | -73.8 | 173.3 | 3.1 | 0 | 0 | 111.4 | K93 F94 N100 A101 | K93-Q97 WeakPolarHBondContact O-CG 3.49Å; K93-Q97 PolarHBondContact O-N 3.38Å; F94-Q97 WeakPolarHBondContact O-CA 3.28Å; F94-Q97 WeakPolarHBondContact O-CB 3.45Å; F94-Q97 PolarHBondContact O-N 2.87Å; Q97-N100 PolarHBondContact O-N 3.42Å; Q97-A101 PolarHBondContact O-N 3.29Å |
| 98 | E | 98.1 | Very high | 97 | Very high | 97 Ų | 97 | 103.6 Ų | 103.6 | 45% | 0.453 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.8 | -46.5 | 175.4 | -175.6 | -175.9 | -164.5 | 0 | 0 | 111.9 | F94 N100 A101 R102 | F94-E98 PolarHBondContact O-N 2.83Å; E98-N100 VanDerWaalsContact C-N 3.31Å; E98-N100 PolarHBondContact O-N 2.96Å; E98-A101 WeakPolarHBondContact O-CB 3.39Å; E98-A101 PolarHBondContact O-N 3.48Å; E98-A101 VanDerWaalsContact O-N 3.09Å; E98-R102 WeakPolarHBondContact O-CG 3.47Å; E98-R102 PolarHBondContact O-N 3.46Å |
| 99 | A | 98 | Very high | 97.3 | Very high | 40 Ų | 40 | 99.4 Ų | 99.4 | 33% | 0.331 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -58.2 | -42.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | R95 A101 R102 E103 | R95-A99 WeakPolarHBondContact O-CB 3.44Å; R95-A99 PolarHBondContact O-N 2.95Å; A99-A101 VanDerWaalsContact C-N 3.33Å; A99-A101 PolarHBondContact O-N 2.9Å; A99-R102 PolarHBondContact O-N 3.42Å; A99-E103 PolarHBondContact O-N 3.02Å |
| 100 | N | 98.6 | Very high | 97.6 | Very high | 92 Ų | 92 | 100.7 Ų | 100.7 | 49% | 0.492 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63.3 | -36.6 | 174.3 | -70 | -16.1 | 0 | 0 | 0 | 112.4 | R96 Q97 E98 R104 | R96-N100 WeakPolarHBondContact O-CB 3.38Å; R96-N100 PolarHBondContact O-N 3.28Å; R96-N100 PolarHBondContact O-ND2 2.98Å; R96-N100 PolarHBondContact O-OD1 3.46Å; Q97-N100 PolarHBondContact O-N 3.42Å; E98-N100 VanDerWaalsContact C-N 3.31Å; E98-N100 PolarHBondContact O-N 2.96Å; N100-R104 WeakPolarHBondContact O-CB 3.42Å; N100-R104 PolarHBondContact O-N 3.41Å |
| 101 | A | 98.5 | Very high | 97.7 | Very high | 38 Ų | 38 | 99 Ų | 99 | 31% | 0.314 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -68 | -42.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q97 E98 A99 R104 N105 | Q97-A101 PolarHBondContact O-N 3.29Å; E98-A101 WeakPolarHBondContact O-CB 3.39Å; E98-A101 PolarHBondContact O-N 3.48Å; E98-A101 VanDerWaalsContact O-N 3.09Å; A99-A101 VanDerWaalsContact C-N 3.33Å; A99-A101 PolarHBondContact O-N 2.9Å; A101-R104 PolarHBondContact O-N 3.27Å; A101-N105 VanDerWaalsContact O-CG 3.3Å; A101-N105 PolarHBondContact O-N 3.41Å; A101-N105 PolarHBondContact O-OD1 2.86Å |
| 102 | R | 98.6 | Very high | 98 | Very high | 162 Ų | 162 | 100.7 Ų | 100.7 | 61% | 0.611 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -60.7 | -46.7 | 174.6 | -71 | -170.3 | -69.6 | 136.5 | -6.3 | 112.1 | E98 A99 R104 N105 R106 | E98-R102 WeakPolarHBondContact O-CG 3.47Å; E98-R102 PolarHBondContact O-N 3.46Å; A99-R102 PolarHBondContact O-N 3.42Å; R102-R104 PolarHBondContact O-N 3.09Å; R102-N105 PolarHBondContact O-N 3.45Å; R102-R106 PolarHBondContact O-N 3.38Å |
| 103 | E | 98.7 | Very high | 98.1 | Very high | 85 Ų | 85 | 99.6 Ų | 99.6 | 40% | 0.397 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -67 | -36.1 | 177.6 | 178.4 | 55.8 | -166.6 | 0 | 0 | 112.2 | A99 N105 R106 M107 | A99-E103 PolarHBondContact O-N 3.02Å; E103-N105 VanDerWaalsContact C-N 3.34Å; E103-N105 PolarHBondContact O-N 3.07Å; E103-R106 PolarHBondContact O-N 2.93Å; E103-R106 IonicContact OE1-NH1 2.96Å; E103-R106 PolarHBondContact OE1-NH1 3.5Å; E103-R106 WeakPolarHBondContact OE2-CD 3.22Å; E103-R106 IonicContact OE2-CZ 3.2Å; E103-R106 IonicContact OE2-NE 3.9Å; E103-R106 IonicContact OE2-NH1 2.8Å; E103-R106 PolarHBondContact OE2-NH1 3.01Å; E103-M107 HydrophobicContact CG-CG 4.46Å; E103-M107 WeakPolarHBondContact O-CB 3.39Å; E103-M107 WeakPolarHBondContact O-CG 3.44Å; E103-M107 PolarHBondContact O-N 3.28Å; E103-M107 WeakPolarHBondContact OE1-CG 3.26Å |
| 104 | R | 98.7 | Very high | 98.2 | Very high | 150 Ų | 150 | 95.9 Ų | 95.9 | 57% | 0.566 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -58.7 | -45.8 | 171.4 | -175.5 | -177.6 | -65.6 | 112.8 | -1.7 | 111.3 | N100 A101 R102 M107 H108 | N100-R104 WeakPolarHBondContact O-CB 3.42Å; N100-R104 PolarHBondContact O-N 3.41Å; A101-R104 PolarHBondContact O-N 3.27Å; R102-R104 PolarHBondContact O-N 3.09Å; R104-M107 PolarHBondContact O-N 3.27Å; R104-H108 WeakPolarHBondContact CG-NE2 3.42Å; R104-H108 PolarHBondContact O-CD2 2.93Å; R104-H108 PolarHBondContact O-N 3.08Å |
| 105 | N | 98.5 | Very high | 98.2 | Very high | 110 Ų | 110 | 91.5 Ų | 91.5 | 59% | 0.588 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -63.9 | -42.6 | 178.5 | -68.1 | -8.9 | 0 | 0 | 0 | 112 | A101 R102 E103 M107 H108 G109 | A101-N105 VanDerWaalsContact O-CG 3.3Å; A101-N105 PolarHBondContact O-N 3.41Å; A101-N105 PolarHBondContact O-OD1 2.86Å; R102-N105 PolarHBondContact O-N 3.45Å; E103-N105 VanDerWaalsContact C-N 3.34Å; E103-N105 PolarHBondContact O-N 3.07Å; N105-M107 VanDerWaalsContact C-N 3.32Å; N105-M107 PolarHBondContact O-N 3.37Å; N105-H108 PolarHBondContact O-N 3.26Å; N105-G109 PolarHBondContact O-N 3.29Å; N105-G109 VanDerWaalsContact O-N 3.15Å |
| 106 | R | 98.8 | Very high | 98.2 | Very high | 160 Ų | 160 | 89.8 Ų | 89.8 | 60% | 0.604 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -58.4 | -43.7 | 172.6 | 176.2 | 173.3 | 163.3 | -79.5 | -6.7 | 111.8 | R102 E103 G109 L110 | R102-R106 PolarHBondContact O-N 3.38Å; E103-R106 PolarHBondContact O-N 2.93Å; E103-R106 IonicContact OE1-NH1 2.96Å; E103-R106 PolarHBondContact OE1-NH1 3.5Å; E103-R106 WeakPolarHBondContact OE2-CD 3.22Å; E103-R106 IonicContact OE2-CZ 3.2Å; E103-R106 IonicContact OE2-NE 3.9Å; E103-R106 IonicContact OE2-NH1 2.8Å; E103-R106 PolarHBondContact OE2-NH1 3.01Å; R106-G109 PolarHBondContact O-N 3.48Å; R106-L110 PolarHBondContact O-N 3.41Å; R106-L110 VanDerWaalsContact O-N 3.12Å |
| 107 | M | 98.7 | Very high | 98.2 | Very high | 62 Ų | 62 | 83.8 Ų | 83.8 | 31% | 0.305 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -69.5 | -30 | 177.7 | -73.7 | -59.1 | -60 | 0 | 0 | 113.5 | E103 R104 N105 L110 N111 | E103-M107 HydrophobicContact CG-CG 4.46Å; E103-M107 WeakPolarHBondContact O-CB 3.39Å; E103-M107 WeakPolarHBondContact O-CG 3.44Å; E103-M107 PolarHBondContact O-N 3.28Å; E103-M107 WeakPolarHBondContact OE1-CG 3.26Å; R104-M107 PolarHBondContact O-N 3.27Å; N105-M107 VanDerWaalsContact C-N 3.32Å; N105-M107 PolarHBondContact O-N 3.37Å; M107-L110 HydrophobicContact CE-CD2 4.14Å; M107-L110 HydrophobicContact SD-CD2 4.04Å; M107-N111 VanDerWaalsContact O-CG 3.24Å; M107-N111 PolarHBondContact O-N 2.72Å; M107-N111 PolarHBondContact O-ND2 2.98Å |
| 108 | H | 98.4 | Very high | 98.2 | Very high | 97 Ų | 97 | 79.2 Ų | 79.2 | 45% | 0.449 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62 | -53.1 | 169.5 | -76.3 | -63 | 0 | 0 | 0 | 110.9 | R104 N105 L110 N111 D112 | R104-H108 WeakPolarHBondContact CG-NE2 3.42Å; R104-H108 PolarHBondContact O-CD2 2.93Å; R104-H108 PolarHBondContact O-N 3.08Å; N105-H108 PolarHBondContact O-N 3.26Å; H108-L110 VanDerWaalsContact C-N 3.27Å; H108-L110 PolarHBondContact O-N 3.27Å; H108-N111 WeakPolarHBondContact O-CA 3.34Å; H108-N111 PolarHBondContact O-N 2.96Å; H108-D112 VanDerWaalsContact O-CG 3.26Å; H108-D112 PolarHBondContact O-N 3.4Å |
| 109 | G | 98.2 | Very high | 98 | Very high | 42 Ų | 42 | 80 Ų | 80 | 43% | 0.433 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -56.6 | -37 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114 | N105 R106 D112 A113 | N105-G109 PolarHBondContact O-N 3.29Å; N105-G109 VanDerWaalsContact O-N 3.15Å; R106-G109 PolarHBondContact O-N 3.48Å; G109-D112 PolarHBondContact O-N 3.49Å; G109-A113 WeakPolarHBondContact O-CB 3.49Å; G109-A113 PolarHBondContact O-N 3.46Å |
| 110 | L | 98.5 | Very high | 97.9 | Very high | 98 Ų | 98 | 83 Ų | 83 | 51% | 0.513 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -66.7 | -39.8 | 173.5 | -178.7 | 63.3 | 0 | 0 | 0 | 112.9 | R106 M107 H108 L114 | R106-L110 PolarHBondContact O-N 3.41Å; R106-L110 VanDerWaalsContact O-N 3.12Å; M107-L110 HydrophobicContact CE-CD2 4.14Å; M107-L110 HydrophobicContact SD-CD2 4.04Å; H108-L110 VanDerWaalsContact C-N 3.27Å; H108-L110 PolarHBondContact O-N 3.27Å; L110-L114 PolarHBondContact O-N 3.25Å |
| 111 | N | 98.2 | Very high | 97.7 | Very high | 50 Ų | 50 | 79 Ų | 79 | 27% | 0.267 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -69.7 | -35.7 | 176.6 | -69.5 | -43.5 | 0 | 0 | 0 | 111.6 | M107 H108 L114 D115 K132 | M107-N111 VanDerWaalsContact O-CG 3.24Å; M107-N111 PolarHBondContact O-N 2.72Å; M107-N111 PolarHBondContact O-ND2 2.98Å; H108-N111 WeakPolarHBondContact O-CA 3.34Å; H108-N111 PolarHBondContact O-N 2.96Å; N111-L114 WeakPolarHBondContact O-CB 3.3Å; N111-L114 PolarHBondContact O-N 3.06Å; N111-D115 PolarHBondContact O-N 3.28Å; N111-K132 WeakPolarHBondContact OD1-CE 3.36Å; N111-K132 PolarHBondContact OD1-NZ 2.8Å |
| 112 | D | 98 | Very high | 97.3 | Very high | 91 Ų | 91 | 78.3 Ų | 78.3 | 49% | 0.487 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -66.5 | -42 | 175.9 | -62 | -27.2 | 0 | 0 | 0 | 111.2 | H108 G109 L114 D115 N116 | H108-D112 VanDerWaalsContact O-CG 3.26Å; H108-D112 PolarHBondContact O-N 3.4Å; G109-D112 PolarHBondContact O-N 3.49Å; D112-L114 VanDerWaalsContact C-N 3.32Å; D112-L114 PolarHBondContact O-N 3.26Å; D112-D115 PolarHBondContact O-N 2.85Å; D112-N116 PolarHBondContact O-N 3.44Å; D112-N116 PolarHBondContact O-ND2 3.49Å |
| 113 | A | 98.4 | Very high | 96.7 | Very high | 55 Ų | 55 | 71.4 Ų | 71.4 | 46% | 0.455 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -60.6 | -40.6 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112 | G109 N116 L117 | G109-A113 WeakPolarHBondContact O-CB 3.49Å; G109-A113 PolarHBondContact O-N 3.46Å; A113-N116 PolarHBondContact O-N 3.29Å; A113-L117 PolarHBondContact O-N 2.99Å |
| 114 | L | 98.2 | Very high | 96.2 | Very high | 21 Ų | 21 | 72 Ų | 72 | 11% | 0.11 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -67.4 | -37.5 | 175.3 | -174.3 | 68.2 | 0 | 0 | 0 | 112.4 | L110 N111 D112 N116 L117 R118 K132 T135 | L110-L114 PolarHBondContact O-N 3.25Å; N111-L114 WeakPolarHBondContact O-CB 3.3Å; N111-L114 PolarHBondContact O-N 3.06Å; D112-L114 VanDerWaalsContact C-N 3.32Å; D112-L114 PolarHBondContact O-N 3.26Å; L114-N116 VanDerWaalsContact C-N 3.33Å; L114-L117 HydrophobicContact CD1-CD2 4.32Å; L114-L117 WeakPolarHBondContact O-CB 3.49Å; L114-L117 PolarHBondContact O-N 3.28Å; L114-R118 WeakPolarHBondContact O-CG 3.33Å; L114-R118 PolarHBondContact O-N 3.11Å; L114-K132 HydrophobicContact CD2-CB 4.17Å; L114-K132 HydrophobicContact CD2-CD 4.1Å; L114-K132 HydrophobicContact CD2-CG 3.72Å; L114-T135 HydrophobicContact CD1-CG2 3.85Å |
| 115 | D | 96.5 | Very high | 95.6 | Very high | 39 Ų | 39 | 66.1 Ų | 66.1 | 21% | 0.209 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -68.8 | -30.4 | 173.1 | -91.8 | -14.7 | 0 | 0 | 0 | 112.5 | N111 D112 R118 K119 K129 | N111-D115 PolarHBondContact O-N 3.28Å; D112-D115 PolarHBondContact O-N 2.85Å; D115-R118 PolarHBondContact O-N 3.38Å; D115-R118 IonicContact OD1-CZ 2.7Å; D115-R118 IonicContact OD1-NE 3.5Å; D115-R118 IonicContact OD1-NH1 2.75Å; D115-R118 PolarHBondContact OD1-NH1 3.46Å; D115-K119 WeakPolarHBondContact O-CG 3.39Å; D115-K119 PolarHBondContact O-N 3.16Å; D115-K129 IonicContact OD1-NZ 3.81Å; D115-K129 PolarHBondContact OD1-NZ 3.39Å; D115-K129 IonicContact OD2-NZ 3.4Å; D115-K129 PolarHBondContact OD2-NZ 3.35Å |
| 116 | N | 97 | Very high | 95 | Very high | 88 Ų | 88 | 69.7 Ų | 69.7 | 47% | 0.471 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -68.7 | -40.9 | 169.1 | -72.1 | -27.2 | 0 | 0 | 0 | 111.7 | D112 A113 L114 R118 K119 | D112-N116 PolarHBondContact O-N 3.44Å; D112-N116 PolarHBondContact O-ND2 3.49Å; A113-N116 PolarHBondContact O-N 3.29Å; L114-N116 VanDerWaalsContact C-N 3.33Å; N116-R118 VanDerWaalsContact C-N 3.32Å; N116-R118 PolarHBondContact O-N 2.71Å; N116-K119 WeakPolarHBondContact O-CB 3.38Å; N116-K119 PolarHBondContact O-N 3.18Å; N116-K119 VanDerWaalsContact O-N 3.16Å; N116-K119 PolarHBondContact OD1-NZ 3.3Å |
| 117 | L | 98.2 | Very high | 94.5 | Very high | 55 Ų | 55 | 68.7 Ų | 68.7 | 29% | 0.288 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -58.9 | -42.6 | 172.2 | -179.4 | 61 | 0 | 0 | 0 | 111.5 | A113 L114 K119 V120 V121 T135 L136 A139 | A113-L117 PolarHBondContact O-N 2.99Å; L114-L117 HydrophobicContact CD1-CD2 4.32Å; L114-L117 WeakPolarHBondContact O-CB 3.49Å; L114-L117 PolarHBondContact O-N 3.28Å; L117-K119 PolarHBondContact O-N 3.16Å; L117-V120 HydrophobicContact CD1-CG2 4.11Å; L117-V120 VanDerWaalsContact O-CG2 3.26Å; L117-V120 WeakPolarHBondContact O-CG2 3.48Å; L117-V120 PolarHBondContact O-N 3.05Å; L117-V120 VanDerWaalsContact O-N 3.17Å; L117-V121 HydrophobicContact CD1-CG2 3.9Å; L117-V121 HydrophobicContact CG-CG2 4.1Å; L117-V121 VanDerWaalsContact O-CG2 3.27Å; L117-V121 WeakPolarHBondContact O-CG2 3.48Å; L117-V121 PolarHBondContact O-N 3.31Å; L117-T135 HydrophobicContact CD2-CG2 4.15Å; L117-T135 HydrophobicContact CG-CG2 4.22Å; L117-L136 HydrophobicContact CD2-CD2 4.22Å; L117-A139 HydrophobicContact CD1-CB 4.07Å; L117-A139 HydrophobicContact CD2-CB 4.09Å; L117-A139 HydrophobicContact CG-CB 4.35Å |
| 118 | R | 96.8 | Very high | 94 | Very high | 31 Ų | 31 | 70.6 Ų | 70.6 | 12% | 0.117 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -56.1 | -33.3 | 176.3 | -74.4 | -179.7 | -178.3 | 102.6 | 6.4 | 113.4 | L114 D115 N116 Y124 L130 T135 | L114-R118 WeakPolarHBondContact O-CG 3.33Å; L114-R118 PolarHBondContact O-N 3.11Å; D115-R118 PolarHBondContact O-N 3.38Å; D115-R118 IonicContact OD1-CZ 2.7Å; D115-R118 IonicContact OD1-NE 3.5Å; D115-R118 IonicContact OD1-NH1 2.75Å; D115-R118 PolarHBondContact OD1-NH1 3.46Å; N116-R118 VanDerWaalsContact C-N 3.32Å; N116-R118 PolarHBondContact O-N 2.71Å; R118-Y124 HydrophobicContact CB-CD2 4.09Å; R118-Y124 HydrophobicContact CB-CE2 4.25Å; R118-Y124 WeakPolarHBondContact O-CB 3.35Å; R118-Y124 WeakPolarHBondContact O-CD2 3.49Å; R118-L130 PolarHBondContact NE-O 3.26Å; R118-L130 PolarHBondContact NH2-O 3.14Å; R118-T135 HydrophobicContact CG-CG2 3.63Å; R118-T135 PolarHBondContact NE-OG1 3.41Å |
| 119 | K | 95.2 | Very high | 93.8 | Very high | 115 Ų | 115 | 71.5 Ų | 71.5 | 50% | 0.5 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -72.1 | -26.6 | -178.6 | -64.2 | 164.9 | -165.1 | 168 | 0 | 113.6 | D115 N116 L117 Y124 | D115-K119 WeakPolarHBondContact O-CG 3.39Å; D115-K119 PolarHBondContact O-N 3.16Å; N116-K119 WeakPolarHBondContact O-CB 3.38Å; N116-K119 PolarHBondContact O-N 3.18Å; N116-K119 VanDerWaalsContact O-N 3.16Å; N116-K119 PolarHBondContact OD1-NZ 3.3Å; L117-K119 PolarHBondContact O-N 3.16Å; K119-Y124 HydrophobicContact CG-CE1 4.44Å; K119-Y124 HydrophobicContact CG-CE2 4.05Å |
| 120 | V | 95.6 | Very high | 93.6 | Very high | 103 Ų | 103 | 70.8 Ų | 70.8 | 62% | 0.624 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -100.1 | -13.6 | -176.3 | -60.1 | 0 | 0 | 0 | 0 | 113.6 | L117 | L117-V120 HydrophobicContact CD1-CG2 4.11Å; L117-V120 VanDerWaalsContact O-CG2 3.26Å; L117-V120 WeakPolarHBondContact O-CG2 3.48Å; L117-V120 PolarHBondContact O-N 3.05Å; L117-V120 VanDerWaalsContact O-N 3.17Å |
| 121 | V | 94.4 | Very high | 93.5 | Very high | 8 Ų | 8 | 68.8 Ų | 68.8 | 5% | 0.048 | 36% | 0.361 | C | S | . | . | S | Bend | trans | -80.1 | 144.1 | 174.8 | 173.3 | 0 | 0 | 0 | 0 | 109.5 | L117 L138 A139 | L117-V121 HydrophobicContact CD1-CG2 3.9Å; L117-V121 HydrophobicContact CG-CG2 4.1Å; L117-V121 VanDerWaalsContact O-CG2 3.27Å; L117-V121 WeakPolarHBondContact O-CG2 3.48Å; L117-V121 PolarHBondContact O-N 3.31Å; V121-L138 HydrophobicContact CG1-CB 4.02Å; V121-L138 HydrophobicContact CG1-CD2 3.48Å; V121-L138 VanDerWaalsContact CG1-CD2 3.48Å; V121-L138 HydrophobicContact CG1-CG 3.43Å; V121-L138 VanDerWaalsContact CG1-CG 3.43Å; V121-A139 HydrophobicContact CG2-CB 3.81Å |
| 122 | P | 90.9 | Very high | 93.5 | Very high | 23 Ų | 23 | 71.4 Ų | 71.4 | 15% | 0.149 | 37% | 0.37 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -54.8 | 150.6 | 176.9 | -27.2 | 35.9 | 0 | 0 | 0 | 112.1 | L138 Y142 L165 | P122-L138 WeakPolarHBondContact O-CD2 3.36Å; P122-Y142 VanDerWaalsContact CD-CD1 3.48Å; P122-Y142 HydrophobicContact CG-CD1 4.08Å; P122-Y142 HydrophobicContact CG-CD2 3.58Å; P122-Y142 HydrophobicContact CG-CE1 4.14Å; P122-Y142 HydrophobicContact CG-CE2 3.66Å; P122-Y142 HydrophobicContact CG-CG 3.78Å; P122-L165 HydrophobicContact CB-CD1 4.1Å; P122-L165 HydrophobicContact CG-CD1 4.13Å; P122-L165 HydrophobicContact CG-CD2 4.23Å |
| 123 | C | 85.4 | Confident | 93.5 | Very high | 17 Ų | 17 | 71.4 Ų | 71.4 | 12% | 0.115 | 37% | 0.369 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 67.9 | 31 | 174.9 | -38.4 | 0 | 0 | 0 | 0 | 114.1 | S125 V177 C180 | C123-S125 PolarHBondContact O-N 2.96Å; C123-V177 HydrophobicContact CB-CG2 4.26Å; C123-V177 VanDerWaalsContact SG-CA 3.59Å; C123-C180 HydrophobicContact CB-CB 3.61Å; C123-C180 VanDerWaalsContact SG-CB 3.56Å |
| 124 | Y | 88.1 | Confident | 93.4 | Very high | 97 Ų | 97 | 69.2 Ų | 69.2 | 38% | 0.38 | 35% | 0.349 | S | S | . | . | trans | -58 | 121 | 169 | 176.5 | -112.4 | 0 | 0 | 0 | 111.4 | R118 K119 K126 | R118-Y124 HydrophobicContact CB-CD2 4.09Å; R118-Y124 HydrophobicContact CB-CE2 4.25Å; R118-Y124 WeakPolarHBondContact O-CB 3.35Å; R118-Y124 WeakPolarHBondContact O-CD2 3.49Å; K119-Y124 HydrophobicContact CG-CE1 4.44Å; K119-Y124 HydrophobicContact CG-CE2 4.05Å; Y124-K126 HydrophobicContact CE1-CG 3.87Å | ||
| 125 | S | 86.7 | Confident | 93.4 | Very high | 26 Ų | 26 | 68.2 Ų | 68.2 | 18% | 0.182 | 34% | 0.344 | C | S | . | . | trans | -115.1 | 131.8 | 170.7 | 173.9 | 0 | 0 | 0 | 0 | 110.7 | C123 T127 Q128 | C123-S125 PolarHBondContact O-N 2.96Å; S125-T127 VanDerWaalsContact C-N 3.3Å; S125-T127 PolarHBondContact OG-N 3.42Å; S125-T127 PolarHBondContact OG-OG1 3.17Å; S125-T127 VanDerWaalsContact OG-OG1 3.11Å; S125-Q128 WeakPolarHBondContact CB-O 3.49Å; S125-Q128 PolarHBondContact OG-N 3.23Å; S125-Q128 VanDerWaalsContact OG-N 3.08Å | ||
| 126 | K | 84.8 | Confident | 93.4 | Very high | 185 Ų | 185 | 71 Ų | 71 | 80% | 0.804 | 36% | 0.358 | S | S | * | . | S | Bend | trans | -68.2 | -30.5 | 173.4 | -68.7 | -175.6 | 179.1 | -178.7 | 0 | 112.1 | Y124 | Y124-K126 HydrophobicContact CE1-CG 3.87Š|
| 127 | T | 88.3 | Confident | 93.5 | Very high | 139 Ų | 139 | 72 Ų | 72 | 85% | 0.853 | 36% | 0.355 | S | S | * | . | S | Bend | trans | -93.1 | -30.6 | -175.6 | 53.1 | 0 | 0 | 0 | 0 | 112.8 | S125 | S125-T127 VanDerWaalsContact C-N 3.3Å; S125-T127 PolarHBondContact OG-N 3.42Å; S125-T127 PolarHBondContact OG-OG1 3.17Å; S125-T127 VanDerWaalsContact OG-OG1 3.11Å |
| 128 | Q | 89.3 | Confident | 93.4 | Very high | 103 Ų | 103 | 69.4 Ų | 69.4 | 48% | 0.481 | 34% | 0.342 | S | S | . | . | S | Bend | trans | -122.7 | 96.6 | -177.8 | -170.6 | 180 | 13.8 | 0 | 0 | 110.8 | S125 | S125-Q128 WeakPolarHBondContact CB-O 3.49Å; S125-Q128 PolarHBondContact OG-N 3.23Å; S125-Q128 VanDerWaalsContact OG-N 3.08Å |
| 129 | K | 92.6 | Very high | 93.5 | Very high | 116 Ų | 116 | 68.4 Ų | 68.4 | 50% | 0.504 | 34% | 0.34 | S | S | . | . | P | Polyproline II helix | trans | -77.1 | 132.8 | 175 | -68.3 | -170.3 | 177.4 | -172.2 | 0 | 111.3 | D115 | D115-K129 IonicContact OD1-NZ 3.81Å; D115-K129 PolarHBondContact OD1-NZ 3.39Å; D115-K129 IonicContact OD2-NZ 3.4Å; D115-K129 PolarHBondContact OD2-NZ 3.35Å |
| 130 | L | 94.7 | Very high | 93.7 | Very high | 26 Ų | 26 | 70.1 Ų | 70.1 | 14% | 0.136 | 35% | 0.348 | C | S | . | . | P | Polyproline II helix | trans | -63.4 | 146.2 | 167.9 | -64.5 | -178.7 | 0 | 0 | 0 | 111.5 | R118 E134 T135 L138 T173 L176 | R118-L130 PolarHBondContact NE-O 3.26Å; R118-L130 PolarHBondContact NH2-O 3.14Å; L130-E134 HydrophobicContact CB-CB 4.34Å; L130-T135 WeakPolarHBondContact CB-OG1 3.4Å; L130-T135 PolarHBondContact O-OG1 2.63Å; L130-L138 HydrophobicContact CD1-CD2 3.68Å; L130-T173 HydrophobicContact CD1-CG2 4.44Å; L130-T173 HydrophobicContact CD2-CG2 3.78Å; L130-L176 HydrophobicContact CD2-CD2 4Å |
| 131 | S | 96 | Very high | 93.8 | Very high | 57 Ų | 57 | 66.1 Ų | 66.1 | 40% | 0.399 | 32% | 0.323 | S | S | . | . | P | Polyproline II helix | trans | -61.1 | 165.5 | 173.6 | 82.9 | 0 | 0 | 0 | 0 | 111.3 | I133 E134 T135 | S131-I133 VanDerWaalsContact C-N 3.35Å; S131-I133 PolarHBondContact O-N 2.95Å; S131-I133 WeakPolarHBondContact OG-CG2 3.48Å; S131-E134 PolarHBondContact O-N 2.87Å; S131-E134 WeakPolarHBondContact OG-CB 3.27Å; S131-E134 VanDerWaalsContact OG-CG 3.22Å; S131-E134 WeakPolarHBondContact OG-CG 3.27Å; S131-E134 PolarHBondContact OG-N 3.49Å; S131-T135 WeakPolarHBondContact O-CB 3.49Å; S131-T135 PolarHBondContact O-N 3.04Å; S131-T135 PolarHBondContact O-OG1 2.76Å |
| 132 | K | 97.7 | Very high | 93.9 | Very high | 104 Ų | 104 | 69 Ų | 69 | 45% | 0.452 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -57.9 | -47.1 | -179.1 | -60.5 | -161.7 | 168.6 | -169.2 | 0 | 111.7 | N111 L114 L136 | N111-K132 WeakPolarHBondContact OD1-CE 3.36Å; N111-K132 PolarHBondContact OD1-NZ 2.8Å; L114-K132 HydrophobicContact CD2-CB 4.17Å; L114-K132 HydrophobicContact CD2-CD 4.1Å; L114-K132 HydrophobicContact CD2-CG 3.72Å; K132-L136 WeakPolarHBondContact O-CG 3.34Å; K132-L136 PolarHBondContact O-N 3Å |
| 133 | I | 98 | Very high | 94.3 | Very high | 92 Ų | 92 | 73.2 Ų | 73.2 | 47% | 0.472 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -68.1 | -41.5 | -179.6 | -175.9 | 59.6 | 0 | 0 | 0 | 112.4 | S131 T135 L136 R137 | S131-I133 VanDerWaalsContact C-N 3.35Å; S131-I133 PolarHBondContact O-N 2.95Å; S131-I133 WeakPolarHBondContact OG-CG2 3.48Å; I133-T135 PolarHBondContact O-N 3.06Å; I133-L136 PolarHBondContact O-N 3.07Å; I133-R137 HydrophobicContact CD1-CG 4.3Å; I133-R137 HydrophobicContact CG1-CG 4.41Å; I133-R137 WeakPolarHBondContact O-CG 3.41Å; I133-R137 PolarHBondContact O-N 3.26Å |
| 134 | E | 97.2 | Very high | 94.9 | Very high | 8 Ų | 8 | 78.2 Ų | 78.2 | 4% | 0.037 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -67.9 | -36.8 | 179.8 | -64.2 | -69.8 | 95.9 | 0 | 0 | 111.7 | L130 S131 L136 R137 L138 S170 T173 | L130-E134 HydrophobicContact CB-CB 4.34Å; S131-E134 PolarHBondContact O-N 2.87Å; S131-E134 WeakPolarHBondContact OG-CB 3.27Å; S131-E134 VanDerWaalsContact OG-CG 3.22Å; S131-E134 WeakPolarHBondContact OG-CG 3.27Å; S131-E134 PolarHBondContact OG-N 3.49Å; E134-L136 PolarHBondContact O-N 3.27Å; E134-R137 PolarHBondContact O-N 3.46Å; E134-R137 WeakPolarHBondContact OE1-CD 3.4Å; E134-R137 IonicContact OE1-CZ 3.63Å; E134-R137 IonicContact OE1-NH1 3.58Å; E134-R137 PolarHBondContact OE1-NH1 3Å; E134-L138 WeakPolarHBondContact O-CB 3.42Å; E134-L138 PolarHBondContact O-N 3.43Å; E134-S170 WeakPolarHBondContact OE2-CB 3.47Å; E134-S170 PolarHBondContact OE2-N 3.08Å; E134-S170 PolarHBondContact OE2-OG 2.81Å; E134-T173 VanDerWaalsContact OE2-CB 3.26Å; E134-T173 WeakPolarHBondContact OE2-CB 3.37Å; E134-T173 PolarHBondContact OE2-OG1 2.94Å |
| 135 | T | 97.5 | Very high | 95.3 | Very high | 1 Ų | 1 | 73.8 Ų | 73.8 | 1% | 0.006 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -59.8 | -46 | 173.5 | -52.8 | 0 | 0 | 0 | 0 | 111 | L114 L117 R118 L130 S131 I133 A139 | L114-T135 HydrophobicContact CD1-CG2 3.85Å; L117-T135 HydrophobicContact CD2-CG2 4.15Å; L117-T135 HydrophobicContact CG-CG2 4.22Å; R118-T135 HydrophobicContact CG-CG2 3.63Å; R118-T135 PolarHBondContact NE-OG1 3.41Å; L130-T135 WeakPolarHBondContact CB-OG1 3.4Å; L130-T135 PolarHBondContact O-OG1 2.63Å; S131-T135 WeakPolarHBondContact O-CB 3.49Å; S131-T135 PolarHBondContact O-N 3.04Å; S131-T135 PolarHBondContact O-OG1 2.76Å; I133-T135 PolarHBondContact O-N 3.06Å; T135-A139 VanDerWaalsContact O-CB 3.27Å; T135-A139 WeakPolarHBondContact O-CB 3.45Å; T135-A139 PolarHBondContact O-N 3.31Å |
| 136 | L | 98.3 | Very high | 95.7 | Very high | 97 Ų | 97 | 75.8 Ų | 75.8 | 51% | 0.508 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -69.1 | -40.8 | -179.8 | -67.1 | 172.6 | 0 | 0 | 0 | 112.4 | L117 K132 I133 E134 A139 K140 | L117-L136 HydrophobicContact CD2-CD2 4.22Å; K132-L136 WeakPolarHBondContact O-CG 3.34Å; K132-L136 PolarHBondContact O-N 3Å; I133-L136 PolarHBondContact O-N 3.07Å; E134-L136 PolarHBondContact O-N 3.27Å; L136-A139 PolarHBondContact O-N 2.93Å; L136-K140 PolarHBondContact O-N 2.92Å |
| 137 | R | 98 | Very high | 96.3 | Very high | 108 Ų | 108 | 70.1 Ų | 70.1 | 41% | 0.408 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -61 | -50.9 | 175 | -74.4 | 170.5 | 170.6 | 172.3 | -8 | 111.5 | I133 E134 A139 K140 N141 G168 L169 | I133-R137 HydrophobicContact CD1-CG 4.3Å; I133-R137 HydrophobicContact CG1-CG 4.41Å; I133-R137 WeakPolarHBondContact O-CG 3.41Å; I133-R137 PolarHBondContact O-N 3.26Å; E134-R137 PolarHBondContact O-N 3.46Å; E134-R137 WeakPolarHBondContact OE1-CD 3.4Å; E134-R137 IonicContact OE1-CZ 3.63Å; E134-R137 IonicContact OE1-NH1 3.58Å; E134-R137 PolarHBondContact OE1-NH1 3Å; R137-A139 VanDerWaalsContact C-N 3.33Å; R137-A139 PolarHBondContact O-N 3.28Å; R137-K140 PolarHBondContact O-N 2.93Å; R137-N141 WeakPolarHBondContact O-CB 3.16Å; R137-N141 PolarHBondContact O-N 3.29Å; R137-N141 PolarHBondContact O-OD1 3.24Å; R137-G168 WeakPolarHBondContact CD-O 3.28Å; R137-G168 PolarHBondContact NH1-O 3.29Å; R137-L169 HydrophobicContact CB-CD2 3.49Å; R137-L169 VanDerWaalsContact CB-CD2 3.49Å |
| 138 | L | 97.3 | Very high | 96.7 | Very high | 1 Ų | 1 | 66.1 Ų | 66.1 | 1% | 0.005 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66.3 | -35.7 | -179.4 | -176.6 | 60.8 | 0 | 0 | 0 | 111.6 | V121 P122 L130 E134 N141 Y142 L165 L169 V177 | V121-L138 HydrophobicContact CG1-CB 4.02Å; V121-L138 HydrophobicContact CG1-CD2 3.48Å; V121-L138 VanDerWaalsContact CG1-CD2 3.48Å; V121-L138 HydrophobicContact CG1-CG 3.43Å; V121-L138 VanDerWaalsContact CG1-CG 3.43Å; P122-L138 WeakPolarHBondContact O-CD2 3.36Å; L130-L138 HydrophobicContact CD1-CD2 3.68Å; E134-L138 WeakPolarHBondContact O-CB 3.42Å; E134-L138 PolarHBondContact O-N 3.43Å; L138-N141 PolarHBondContact O-N 2.89Å; L138-Y142 VanDerWaalsContact O-CB 3.3Å; L138-Y142 WeakPolarHBondContact O-CB 3.48Å; L138-Y142 PolarHBondContact O-N 3.4Å; L138-L165 HydrophobicContact CD1-CB 3.93Å; L138-L165 HydrophobicContact CD1-CD2 4.08Å; L138-L165 HydrophobicContact CD1-CG 4.47Å; L138-L169 HydrophobicContact CB-CD1 4.18Å; L138-L169 HydrophobicContact CB-CD2 4.24Å; L138-L169 HydrophobicContact CD1-CD1 3.81Å; L138-L169 HydrophobicContact CG-CD1 4.4Å; L138-V177 HydrophobicContact CD1-CG2 4.43Å; L138-V177 HydrophobicContact CD2-CG2 4.34Å |
| 139 | A | 98.3 | Very high | 97 | Very high | 10 Ų | 10 | 63.1 Ų | 63.1 | 8% | 0.083 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -62.1 | -47.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | L117 V121 T135 L136 R137 N141 Y142 I143 | L117-A139 HydrophobicContact CD1-CB 4.07Å; L117-A139 HydrophobicContact CD2-CB 4.09Å; L117-A139 HydrophobicContact CG-CB 4.35Å; V121-A139 HydrophobicContact CG2-CB 3.81Å; T135-A139 VanDerWaalsContact O-CB 3.27Å; T135-A139 WeakPolarHBondContact O-CB 3.45Å; T135-A139 PolarHBondContact O-N 3.31Å; L136-A139 PolarHBondContact O-N 2.93Å; R137-A139 VanDerWaalsContact C-N 3.33Å; R137-A139 PolarHBondContact O-N 3.28Å; A139-N141 VanDerWaalsContact C-N 3.34Å; A139-N141 PolarHBondContact O-N 3.39Å; A139-Y142 PolarHBondContact O-N 2.91Å; A139-I143 WeakPolarHBondContact O-CG1 3.42Å; A139-I143 PolarHBondContact O-N 2.89Å |
| 140 | K | 98.3 | Very high | 97.2 | Very high | 152 Ų | 152 | 64.6 Ų | 64.6 | 66% | 0.661 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -56.9 | -48.2 | 174.3 | 179.2 | -165.4 | 173.1 | -173.1 | 0 | 111.2 | L136 R137 Y142 I143 W144 | L136-K140 PolarHBondContact O-N 2.92Å; R137-K140 PolarHBondContact O-N 2.93Å; K140-Y142 VanDerWaalsContact C-N 3.32Å; K140-Y142 PolarHBondContact O-N 3.47Å; K140-I143 PolarHBondContact O-N 2.88Å; K140-W144 PolarHBondContact O-N 3.15Å |
| 141 | N | 97.8 | Very high | 97.3 | Very high | 19 Ų | 19 | 71.4 Ų | 71.4 | 10% | 0.102 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -64.5 | -37.3 | -179.1 | -68.1 | -6.7 | 0 | 0 | 0 | 111.8 | R137 L138 A139 W144 A145 L165 K167 | R137-N141 WeakPolarHBondContact O-CB 3.16Å; R137-N141 PolarHBondContact O-N 3.29Å; R137-N141 PolarHBondContact O-OD1 3.24Å; L138-N141 PolarHBondContact O-N 2.89Å; A139-N141 VanDerWaalsContact C-N 3.34Å; A139-N141 PolarHBondContact O-N 3.39Å; N141-W144 PolarHBondContact O-N 3.2Å; N141-A145 WeakPolarHBondContact O-CB 3.26Å; N141-A145 PolarHBondContact O-N 2.88Å; N141-L165 WeakPolarHBondContact CB-O 3.29Å; N141-L165 PolarHBondContact ND2-O 3.31Å; N141-K167 PolarHBondContact ND2-O 3.1Å |
| 142 | Y | 97.8 | Very high | 97.3 | Very high | 69 Ų | 69 | 72.8 Ų | 72.8 | 27% | 0.271 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -68.1 | -44.6 | 176.7 | -176.7 | -138.1 | 0 | 0 | 0 | 112.4 | P122 L138 A139 K140 W144 A145 L146 F161 L165 | P122-Y142 VanDerWaalsContact CD-CD1 3.48Å; P122-Y142 HydrophobicContact CG-CD1 4.08Å; P122-Y142 HydrophobicContact CG-CD2 3.58Å; P122-Y142 HydrophobicContact CG-CE1 4.14Å; P122-Y142 HydrophobicContact CG-CE2 3.66Å; P122-Y142 HydrophobicContact CG-CG 3.78Å; L138-Y142 VanDerWaalsContact O-CB 3.3Å; L138-Y142 WeakPolarHBondContact O-CB 3.48Å; L138-Y142 PolarHBondContact O-N 3.4Å; A139-Y142 PolarHBondContact O-N 2.91Å; K140-Y142 VanDerWaalsContact C-N 3.32Å; K140-Y142 PolarHBondContact O-N 3.47Å; Y142-W144 VanDerWaalsContact C-N 3.33Å; Y142-W144 PolarHBondContact O-N 2.79Å; Y142-A145 PolarHBondContact O-N 3.34Å; Y142-L146 HydrophobicContact CD1-CD1 4.31Å; Y142-L146 HydrophobicContact CD2-CD1 4.13Å; Y142-L146 HydrophobicContact CD2-CD2 4.47Å; Y142-L146 HydrophobicContact CD2-CG 3.94Å; Y142-L146 HydrophobicContact CE1-CD1 3.93Å; Y142-L146 HydrophobicContact CE2-CD1 3.71Å; Y142-L146 HydrophobicContact CE2-CD2 3.83Å; Y142-L146 HydrophobicContact CE2-CG 3.68Å; Y142-L146 HydrophobicContact CG-CD1 4.43Å; Y142-L146 WeakPolarHBondContact O-CG 3.48Å; Y142-L146 PolarHBondContact O-N 3.22Å; Y142-F161 HydrophobicContact CD2-CZ 4.25Å; Y142-F161 HydrophobicContact CE2-CZ 4.12Å; Y142-L165 HydrophobicContact CD2-CD2 3.99Å; Y142-L165 HydrophobicContact CG-CD2 4.35Å |
| 143 | I | 98.1 | Very high | 97.1 | Very high | 110 Ų | 110 | 71 Ų | 71 | 56% | 0.564 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -55.8 | -50.8 | 172.9 | -67.9 | 165.8 | 0 | 0 | 0 | 109.7 | A139 K140 A145 L146 S147 | A139-I143 WeakPolarHBondContact O-CG1 3.42Å; A139-I143 PolarHBondContact O-N 2.89Å; K140-I143 PolarHBondContact O-N 2.88Å; I143-A145 PolarHBondContact O-N 3.12Å; I143-L146 PolarHBondContact O-N 3.05Å; I143-S147 WeakPolarHBondContact O-CB 3.5Å; I143-S147 PolarHBondContact O-N 3.21Å; I143-S147 PolarHBondContact O-OG 3.01Å; I143-S147 VanDerWaalsContact O-OG 3.07Å |
| 144 | W | 97.7 | Very high | 96.8 | Very high | 122 Ų | 122 | 74 Ų | 74 | 46% | 0.462 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -59 | -44.3 | 178.9 | -177.9 | 88.1 | 0 | 0 | 0 | 112.6 | K140 N141 Y142 L146 S147 E148 N164 | K140-W144 PolarHBondContact O-N 3.15Å; N141-W144 PolarHBondContact O-N 3.2Å; Y142-W144 VanDerWaalsContact C-N 3.33Å; Y142-W144 PolarHBondContact O-N 2.79Å; W144-L146 PolarHBondContact O-N 3.39Å; W144-S147 PolarHBondContact O-N 3.32Å; W144-E148 WeakPolarHBondContact O-CB 3.42Å; W144-E148 PolarHBondContact O-N 3.07Å; W144-N164 HydrophobicContact CE3-CB 4.27Å; W144-N164 HydrophobicContact CZ3-CB 3.79Å; W144-N164 VanDerWaalsContact CZ3-CG 3.4Å; W144-N164 WeakPolarHBondContact CZ3-OD1 3.49Å |
| 145 | A | 96.2 | Very high | 96.5 | Very high | 4 Ų | 4 | 83.5 Ų | 83.5 | 3% | 0.033 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -65.6 | -38.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | N141 Y142 I143 I149 F161 N164 | N141-A145 WeakPolarHBondContact O-CB 3.26Å; N141-A145 PolarHBondContact O-N 2.88Å; Y142-A145 PolarHBondContact O-N 3.34Å; I143-A145 PolarHBondContact O-N 3.12Å; A145-I149 WeakPolarHBondContact O-CD1 3.49Å; A145-I149 VanDerWaalsContact O-CG1 3.28Å; A145-I149 WeakPolarHBondContact O-CG1 3.39Å; A145-I149 PolarHBondContact O-N 3.16Å; A145-I149 VanDerWaalsContact O-N 3.09Å; A145-F161 HydrophobicContact CB-CD2 4.15Å; A145-F161 HydrophobicContact CB-CE2 3.86Å; A145-N164 HydrophobicContact CB-CB 4.39Å |
| 146 | L | 96.8 | Very high | 96.1 | Very high | 68 Ų | 68 | 85.3 Ų | 85.3 | 36% | 0.356 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -69.2 | -42.4 | 173.9 | -69.4 | -179 | 0 | 0 | 0 | 112.1 | Y142 I143 W144 E148 I149 L150 | Y142-L146 HydrophobicContact CD1-CD1 4.31Å; Y142-L146 HydrophobicContact CD2-CD1 4.13Å; Y142-L146 HydrophobicContact CD2-CD2 4.47Å; Y142-L146 HydrophobicContact CD2-CG 3.94Å; Y142-L146 HydrophobicContact CE1-CD1 3.93Å; Y142-L146 HydrophobicContact CE2-CD1 3.71Å; Y142-L146 HydrophobicContact CE2-CD2 3.83Å; Y142-L146 HydrophobicContact CE2-CG 3.68Å; Y142-L146 HydrophobicContact CG-CD1 4.43Å; Y142-L146 WeakPolarHBondContact O-CG 3.48Å; Y142-L146 PolarHBondContact O-N 3.22Å; I143-L146 PolarHBondContact O-N 3.05Å; W144-L146 PolarHBondContact O-N 3.39Å; L146-E148 VanDerWaalsContact C-N 3.27Å; L146-E148 PolarHBondContact O-N 3.47Å; L146-I149 HydrophobicContact CD2-CD1 4.25Å; L146-I149 WeakPolarHBondContact O-CB 3.36Å; L146-I149 PolarHBondContact O-N 3.33Å; L146-L150 WeakPolarHBondContact O-CG 3.44Å; L146-L150 PolarHBondContact O-N 3.44Å |
| 147 | S | 97.3 | Very high | 95.8 | Very high | 67 Ų | 67 | 85.6 Ų | 85.6 | 47% | 0.469 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -58 | -40.6 | 174 | -63.9 | 0 | 0 | 0 | 0 | 111.7 | I143 W144 L150 R151 | I143-S147 WeakPolarHBondContact O-CB 3.5Å; I143-S147 PolarHBondContact O-N 3.21Å; I143-S147 PolarHBondContact O-OG 3.01Å; I143-S147 VanDerWaalsContact O-OG 3.07Å; W144-S147 PolarHBondContact O-N 3.32Å; S147-L150 PolarHBondContact O-N 3.45Å; S147-R151 WeakPolarHBondContact O-CB 3.45Å; S147-R151 PolarHBondContact O-N 2.99Å |
| 148 | E | 95.9 | Very high | 95.5 | Very high | 54 Ų | 54 | 84 Ų | 84 | 25% | 0.252 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -69.8 | -37.7 | 178.4 | -172.1 | 65.5 | 175.7 | 0 | 0 | 112.6 | W144 L146 L150 R151 I152 | W144-E148 WeakPolarHBondContact O-CB 3.42Å; W144-E148 PolarHBondContact O-N 3.07Å; L146-E148 VanDerWaalsContact C-N 3.27Å; L146-E148 PolarHBondContact O-N 3.47Å; E148-L150 PolarHBondContact O-N 3Å; E148-R151 PolarHBondContact O-N 3.39Å; E148-R151 IonicContact OE1-CZ 3.1Å; E148-R151 IonicContact OE1-NE 3.7Å; E148-R151 IonicContact OE1-NH2 2.74Å; E148-R151 PolarHBondContact OE1-NH2 3.23Å; E148-R151 IonicContact OE2-CZ 3.35Å; E148-R151 IonicContact OE2-NE 2.8Å; E148-R151 PolarHBondContact OE2-NE 3.45Å; E148-R151 IonicContact OE2-NH2 3.48Å; E148-R151 PolarHBondContact OE2-NH2 3.24Å; E148-I152 HydrophobicContact CG-CD1 3.89Å; E148-I152 HydrophobicContact CG-CG1 4.46Å; E148-I152 WeakPolarHBondContact O-CG1 3.4Å; E148-I152 PolarHBondContact O-N 2.99Å; E148-I152 WeakPolarHBondContact OE1-CD1 3.34Å |
| 149 | I | 96.4 | Very high | 95.2 | Very high | 41 Ų | 41 | 86.8 Ų | 86.8 | 21% | 0.21 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -57.9 | -48 | 171 | -73 | 160.4 | 0 | 0 | 0 | 110.9 | A145 L146 R151 G153 P156 F161 | A145-I149 WeakPolarHBondContact O-CD1 3.49Å; A145-I149 VanDerWaalsContact O-CG1 3.28Å; A145-I149 WeakPolarHBondContact O-CG1 3.39Å; A145-I149 PolarHBondContact O-N 3.16Å; A145-I149 VanDerWaalsContact O-N 3.09Å; L146-I149 HydrophobicContact CD2-CD1 4.25Å; L146-I149 WeakPolarHBondContact O-CB 3.36Å; L146-I149 PolarHBondContact O-N 3.33Å; I149-R151 VanDerWaalsContact C-N 3.34Å; I149-G153 PolarHBondContact O-N 3.49Å; I149-P156 HydrophobicContact CD1-CG 4.23Å; I149-P156 VanDerWaalsContact CG1-CD 3.4Å; I149-P156 HydrophobicContact CG1-CG 3.98Å; I149-F161 HydrophobicContact CD1-CD2 4.14Å; I149-F161 HydrophobicContact CD1-CE2 4.02Å |
| 150 | L | 96.9 | Very high | 94.9 | Very high | 147 Ų | 147 | 89.1 Ų | 89.1 | 77% | 0.77 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -65.9 | -36.6 | 179.3 | -67.3 | 171.8 | 0 | 0 | 0 | 111.9 | L146 S147 E148 | L146-L150 WeakPolarHBondContact O-CG 3.44Å; L146-L150 PolarHBondContact O-N 3.44Å; S147-L150 PolarHBondContact O-N 3.45Å; E148-L150 PolarHBondContact O-N 3Å |
| 151 | R | 96.6 | Very high | 94.7 | Very high | 169 Ų | 169 | 83.3 Ų | 83.3 | 64% | 0.638 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -70.2 | -40.4 | 178.5 | -168 | -166.1 | 67.5 | 74.3 | -2.3 | 113.1 | S147 E148 I149 | S147-R151 WeakPolarHBondContact O-CB 3.45Å; S147-R151 PolarHBondContact O-N 2.99Å; E148-R151 PolarHBondContact O-N 3.39Å; E148-R151 IonicContact OE1-CZ 3.1Å; E148-R151 IonicContact OE1-NE 3.7Å; E148-R151 IonicContact OE1-NH2 2.74Å; E148-R151 PolarHBondContact OE1-NH2 3.23Å; E148-R151 IonicContact OE2-CZ 3.35Å; E148-R151 IonicContact OE2-NE 2.8Å; E148-R151 PolarHBondContact OE2-NE 3.45Å; E148-R151 IonicContact OE2-NH2 3.48Å; E148-R151 PolarHBondContact OE2-NH2 3.24Å; I149-R151 VanDerWaalsContact C-N 3.34Å |
| 152 | I | 94.8 | Very high | 94.6 | Very high | 85 Ų | 85 | 82.5 Ų | 82.5 | 44% | 0.436 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -80.7 | -27.8 | 179.5 | -63.4 | 175.3 | 0 | 0 | 0 | 111.3 | E148 K154 | E148-I152 HydrophobicContact CG-CD1 3.89Å; E148-I152 HydrophobicContact CG-CG1 4.46Å; E148-I152 WeakPolarHBondContact O-CG1 3.4Å; E148-I152 PolarHBondContact O-N 2.99Å; E148-I152 WeakPolarHBondContact OE1-CD1 3.34Å; I152-K154 HydrophobicContact CG2-CB 3.88Å; I152-K154 HydrophobicContact CG2-CD 4.46Å; I152-K154 HydrophobicContact CG2-CG 4.17Å; I152-K154 PolarHBondContact O-N 3.33Å |
| 153 | G | 94.3 | Very high | 94.4 | Very high | 67 Ų | 67 | 83.8 Ų | 83.8 | 69% | 0.691 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.4 | 13.3 | -172.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | I149 | I149-G153 PolarHBondContact O-N 3.49Š|
| 154 | K | 91.6 | Very high | 94.2 | Very high | 156 Ų | 156 | 79.7 Ų | 79.7 | 68% | 0.678 | 40% | 0.398 | S | S | * | . | S | Bend | trans | -131.3 | 144 | 178.1 | -59.3 | -177.9 | -179.6 | 179.4 | 0 | 110.2 | I152 | I152-K154 HydrophobicContact CG2-CB 3.88Å; I152-K154 HydrophobicContact CG2-CD 4.46Å; I152-K154 HydrophobicContact CG2-CG 4.17Å; I152-K154 PolarHBondContact O-N 3.33Å |
| 155 | R | 90.1 | Very high | 94.1 | Very high | 207 Ų | 207 | 73.9 Ų | 73.9 | 78% | 0.781 | 38% | 0.376 | S | S | * | . | P | Polyproline II helix | trans | -72 | 125 | 171.6 | -173 | 178.7 | 175.3 | 87.4 | 1.4 | 109 | ||
| 156 | P | 90.4 | Very high | 94.1 | Very high | 39 Ų | 39 | 74.5 Ų | 74.5 | 25% | 0.253 | 38% | 0.38 | S | S | . | . | P | Polyproline II helix | trans | -67.2 | 159.6 | 173 | 29.8 | -36.6 | 0 | 0 | 0 | 110.2 | I149 T160 F161 | I149-P156 HydrophobicContact CD1-CG 4.23Å; I149-P156 VanDerWaalsContact CG1-CD 3.4Å; I149-P156 HydrophobicContact CG1-CG 3.98Å; P156-T160 HydrophobicContact CB-CG2 4.24Å; P156-F161 HydrophobicContact CG-CB 4.17Å; P156-F161 HydrophobicContact CG-CD2 4.34Å |
| 157 | D | 91.4 | Very high | 94 | Very high | 103 Ų | 103 | 76.2 Ų | 76.2 | 55% | 0.551 | 39% | 0.385 | S | S | * | . | P | Polyproline II helix | trans | -56.2 | 150.3 | 166.4 | 176.8 | 49.8 | 0 | 0 | 0 | 111.3 | L159 T160 F161 | D157-L159 VanDerWaalsContact C-N 3.29Å; D157-L159 PolarHBondContact O-N 2.86Å; D157-L159 VanDerWaalsContact OD2-CB 3.24Å; D157-L159 WeakPolarHBondContact OD2-CB 3.4Å; D157-L159 PolarHBondContact OD2-N 3.25Å; D157-L159 VanDerWaalsContact OD2-N 3.09Å; D157-T160 WeakPolarHBondContact O-CB 3.41Å; D157-T160 PolarHBondContact O-N 3.45Å; D157-F161 PolarHBondContact O-N 2.96Å |
| 158 | L | 91.1 | Very high | 94 | Very high | 74 Ų | 74 | 75.9 Ų | 75.9 | 39% | 0.387 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -58.8 | -40.9 | -178.1 | 178.7 | 61.3 | 0 | 0 | 0 | 111.4 | F161 V162 L183 | L158-F161 PolarHBondContact O-N 3.48Å; L158-V162 HydrophobicContact CD1-CG2 4.25Å; L158-V162 HydrophobicContact CG-CG2 4.46Å; L158-V162 WeakPolarHBondContact O-CG2 3.5Å; L158-V162 PolarHBondContact O-N 3.45Å; L158-L183 HydrophobicContact CD2-CD2 3.83Å; L158-L183 HydrophobicContact CG-CD2 3.94Å |
| 159 | L | 91.9 | Very high | 94 | Very high | 59 Ų | 59 | 74.3 Ų | 74.3 | 31% | 0.309 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63.8 | -45.7 | 178.9 | -176.7 | 61.1 | 0 | 0 | 0 | 110.8 | D157 F161 V162 Q163 F188 | D157-L159 VanDerWaalsContact C-N 3.29Å; D157-L159 PolarHBondContact O-N 2.86Å; D157-L159 VanDerWaalsContact OD2-CB 3.24Å; D157-L159 WeakPolarHBondContact OD2-CB 3.4Å; D157-L159 PolarHBondContact OD2-N 3.25Å; D157-L159 VanDerWaalsContact OD2-N 3.09Å; L159-F161 VanDerWaalsContact C-N 3.35Å; L159-F161 PolarHBondContact O-N 2.92Å; L159-V162 PolarHBondContact O-N 3.09Å; L159-Q163 HydrophobicContact CD1-CG 4.46Å; L159-Q163 HydrophobicContact CG-CG 4.5Å; L159-Q163 WeakPolarHBondContact O-CB 3.45Å; L159-Q163 VanDerWaalsContact O-CG 3.27Å; L159-Q163 WeakPolarHBondContact O-CG 3.34Å; L159-Q163 PolarHBondContact O-N 2.89Å; L159-F188 HydrophobicContact CD1-CZ 4.17Å |
| 160 | T | 92.5 | Very high | 94 | Very high | 59 Ų | 59 | 74.6 Ų | 74.6 | 36% | 0.362 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -60 | -43.4 | 175.4 | -57.3 | 0 | 0 | 0 | 0 | 111.5 | P156 D157 Q163 N164 | P156-T160 HydrophobicContact CB-CG2 4.24Å; D157-T160 WeakPolarHBondContact O-CB 3.41Å; D157-T160 PolarHBondContact O-N 3.45Å; T160-Q163 PolarHBondContact O-N 2.99Å; T160-N164 WeakPolarHBondContact O-CB 3.33Å; T160-N164 PolarHBondContact O-N 3.36Å; T160-N164 PolarHBondContact O-ND2 3.05Å |
| 161 | F | 94.1 | Very high | 93.9 | Very high | 30 Ų | 30 | 73.5 Ų | 73.5 | 13% | 0.132 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -61.5 | -45.3 | 176.7 | -176.5 | -108.1 | 0 | 0 | 0 | 112.1 | Y142 A145 I149 P156 D157 L158 L159 N164 L165 | Y142-F161 HydrophobicContact CD2-CZ 4.25Å; Y142-F161 HydrophobicContact CE2-CZ 4.12Å; A145-F161 HydrophobicContact CB-CD2 4.15Å; A145-F161 HydrophobicContact CB-CE2 3.86Å; I149-F161 HydrophobicContact CD1-CD2 4.14Å; I149-F161 HydrophobicContact CD1-CE2 4.02Å; P156-F161 HydrophobicContact CG-CB 4.17Å; P156-F161 HydrophobicContact CG-CD2 4.34Å; D157-F161 PolarHBondContact O-N 2.96Å; L158-F161 PolarHBondContact O-N 3.48Å; L159-F161 VanDerWaalsContact C-N 3.35Å; L159-F161 PolarHBondContact O-N 2.92Å; F161-N164 WeakPolarHBondContact O-CB 3.35Å; F161-N164 PolarHBondContact O-N 3.2Å; F161-L165 HydrophobicContact CD1-CD1 4.02Å; F161-L165 HydrophobicContact CE1-CD1 3.53Å; F161-L165 HydrophobicContact CE1-CG 4.18Å; F161-L165 HydrophobicContact CZ-CD1 3.99Å; F161-L165 HydrophobicContact CZ-CD2 4.39Å; F161-L165 HydrophobicContact CZ-CG 4.28Å; F161-L165 WeakPolarHBondContact O-CG 3.45Å; F161-L165 PolarHBondContact O-N 2.89Å |
| 162 | V | 93.9 | Very high | 93.7 | Very high | 2 Ų | 2 | 69.4 Ų | 69.4 | 1% | 0.012 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -62.5 | -49.9 | 175.7 | 172.6 | 0 | 0 | 0 | 0 | 111.1 | L158 L159 N164 L165 C166 V177 L181 L183 | L158-V162 HydrophobicContact CD1-CG2 4.25Å; L158-V162 HydrophobicContact CG-CG2 4.46Å; L158-V162 WeakPolarHBondContact O-CG2 3.5Å; L158-V162 PolarHBondContact O-N 3.45Å; L159-V162 PolarHBondContact O-N 3.09Å; V162-N164 PolarHBondContact O-N 2.99Å; V162-L165 WeakPolarHBondContact O-CA 3.21Å; V162-L165 WeakPolarHBondContact O-CB 3.47Å; V162-L165 PolarHBondContact O-N 2.98Å; V162-C166 WeakPolarHBondContact O-CB 3Å; V162-C166 PolarHBondContact O-N 3.4Å; V162-C166 PolarHBondContact O-SG 3.41Å; V162-C166 VanDerWaalsContact O-SG 3.36Å; V162-V177 HydrophobicContact CG1-CG1 4.38Å; V162-L181 HydrophobicContact CG2-CB 4.4Å; V162-L181 HydrophobicContact CG2-CD1 3.66Å; V162-L183 HydrophobicContact CB-CD1 3.89Å; V162-L183 HydrophobicContact CG1-CD1 3.39Å; V162-L183 HydrophobicContact CG2-CD1 3.47Å; V162-L183 VanDerWaalsContact CG2-CD1 3.47Å; V162-L183 HydrophobicContact CG2-CD2 3.9Å; V162-L183 HydrophobicContact CG2-CG 4.18Å |
| 163 | Q | 93.5 | Very high | 93.7 | Very high | 97 Ų | 97 | 65.8 Ų | 65.8 | 45% | 0.453 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -54.7 | -38.5 | 179.3 | -77 | 174.6 | -5.3 | 0 | 0 | 110.7 | L159 T160 K167 | L159-Q163 HydrophobicContact CD1-CG 4.46Å; L159-Q163 HydrophobicContact CG-CG 4.5Å; L159-Q163 WeakPolarHBondContact O-CB 3.45Å; L159-Q163 VanDerWaalsContact O-CG 3.27Å; L159-Q163 WeakPolarHBondContact O-CG 3.34Å; L159-Q163 PolarHBondContact O-N 2.89Å; T160-Q163 PolarHBondContact O-N 2.99Å; Q163-K167 WeakPolarHBondContact O-CG 3.39Å; Q163-K167 PolarHBondContact O-N 3.3Å |
| 164 | N | 94.6 | Very high | 93.7 | Very high | 23 Ų | 23 | 63.8 Ų | 63.8 | 12% | 0.123 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -68 | -41.5 | 174.6 | -68.4 | -33.2 | 0 | 0 | 0 | 113.4 | W144 A145 T160 F161 V162 K167 | W144-N164 HydrophobicContact CE3-CB 4.27Å; W144-N164 HydrophobicContact CZ3-CB 3.79Å; W144-N164 VanDerWaalsContact CZ3-CG 3.4Å; W144-N164 WeakPolarHBondContact CZ3-OD1 3.49Å; A145-N164 HydrophobicContact CB-CB 4.39Å; T160-N164 WeakPolarHBondContact O-CB 3.33Å; T160-N164 PolarHBondContact O-N 3.36Å; T160-N164 PolarHBondContact O-ND2 3.05Å; F161-N164 WeakPolarHBondContact O-CB 3.35Å; F161-N164 PolarHBondContact O-N 3.2Å; V162-N164 PolarHBondContact O-N 2.99Å; N164-K167 VanDerWaalsContact OD1-CE 3.22Å; N164-K167 WeakPolarHBondContact OD1-CE 3.28Å; N164-K167 PolarHBondContact OD1-NZ 3Å |
| 165 | L | 96 | Very high | 93.7 | Very high | 0 Ų | 0 | 60.8 Ų | 60.8 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.3 | -41.6 | 173.3 | -71.7 | -179.1 | 0 | 0 | 0 | 112.7 | P122 L138 N141 Y142 F161 V162 K167 L169 V177 L181 | P122-L165 HydrophobicContact CB-CD1 4.1Å; P122-L165 HydrophobicContact CG-CD1 4.13Å; P122-L165 HydrophobicContact CG-CD2 4.23Å; L138-L165 HydrophobicContact CD1-CB 3.93Å; L138-L165 HydrophobicContact CD1-CD2 4.08Å; L138-L165 HydrophobicContact CD1-CG 4.47Å; N141-L165 WeakPolarHBondContact CB-O 3.29Å; N141-L165 PolarHBondContact ND2-O 3.31Å; Y142-L165 HydrophobicContact CD2-CD2 3.99Å; Y142-L165 HydrophobicContact CG-CD2 4.35Å; F161-L165 HydrophobicContact CD1-CD1 4.02Å; F161-L165 HydrophobicContact CE1-CD1 3.53Å; F161-L165 HydrophobicContact CE1-CG 4.18Å; F161-L165 HydrophobicContact CZ-CD1 3.99Å; F161-L165 HydrophobicContact CZ-CD2 4.39Å; F161-L165 HydrophobicContact CZ-CG 4.28Å; F161-L165 WeakPolarHBondContact O-CG 3.45Å; F161-L165 PolarHBondContact O-N 2.89Å; V162-L165 WeakPolarHBondContact O-CA 3.21Å; V162-L165 WeakPolarHBondContact O-CB 3.47Å; V162-L165 PolarHBondContact O-N 2.98Å; L165-K167 VanDerWaalsContact C-N 3.34Å; L165-K167 PolarHBondContact O-N 2.66Å; L165-L169 WeakPolarHBondContact O-CD1 3.5Å; L165-V177 HydrophobicContact CD1-CG1 4.47Å; L165-L181 HydrophobicContact CD1-CD1 4.03Å |
| 166 | C | 95.6 | Very high | 93.7 | Very high | 17 Ų | 17 | 52.4 Ų | 52.4 | 12% | 0.115 | 30% | 0.295 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.4 | -3.4 | -171.2 | -63.7 | 0 | 0 | 0 | 0 | 115.2 | V162 G168 L169 T174 | V162-C166 WeakPolarHBondContact O-CB 3Å; V162-C166 PolarHBondContact O-N 3.4Å; V162-C166 PolarHBondContact O-SG 3.41Å; V162-C166 VanDerWaalsContact O-SG 3.36Å; C166-G168 PolarHBondContact O-N 2.87Å; C166-L169 PolarHBondContact O-N 3.37Å; C166-L169 VanDerWaalsContact O-N 3.09Å; C166-T174 HydrophobicContact CB-CG2 4.13Å |
| 167 | K | 95.6 | Very high | 93.8 | Very high | 105 Ų | 105 | 50.6 Ų | 50.6 | 46% | 0.457 | 28% | 0.283 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.3 | 114.4 | -177.3 | -63.8 | -174.2 | 178.2 | 161 | 0 | 111.9 | N141 Q163 N164 L165 L169 | N141-K167 PolarHBondContact ND2-O 3.1Å; Q163-K167 WeakPolarHBondContact O-CG 3.39Å; Q163-K167 PolarHBondContact O-N 3.3Å; N164-K167 VanDerWaalsContact OD1-CE 3.22Å; N164-K167 WeakPolarHBondContact OD1-CE 3.28Å; N164-K167 PolarHBondContact OD1-NZ 3Å; L165-K167 VanDerWaalsContact C-N 3.34Å; L165-K167 PolarHBondContact O-N 2.66Å; K167-L169 VanDerWaalsContact C-N 3.29Å; K167-L169 PolarHBondContact O-N 3.18Å |
| 168 | G | 96.1 | Very high | 93.7 | Very high | 60 Ų | 60 | 46.5 Ų | 46.5 | 62% | 0.619 | 26% | 0.264 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.4 | 15.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | R137 C166 | R137-G168 WeakPolarHBondContact CD-O 3.28Å; R137-G168 PolarHBondContact NH1-O 3.29Å; C166-G168 PolarHBondContact O-N 2.87Å |
| 169 | L | 96.4 | Very high | 93.5 | Very high | 20 Ų | 20 | 45.6 Ų | 45.6 | 11% | 0.105 | 27% | 0.273 | C | S | . | . | trans | -83.1 | 155.6 | 169.2 | -57.6 | -175.9 | 0 | 0 | 0 | 111 | R137 L138 L165 C166 K167 T173 V177 | R137-L169 HydrophobicContact CB-CD2 3.49Å; R137-L169 VanDerWaalsContact CB-CD2 3.49Å; L138-L169 HydrophobicContact CB-CD1 4.18Å; L138-L169 HydrophobicContact CB-CD2 4.24Å; L138-L169 HydrophobicContact CD1-CD1 3.81Å; L138-L169 HydrophobicContact CG-CD1 4.4Å; L165-L169 WeakPolarHBondContact O-CD1 3.5Å; C166-L169 PolarHBondContact O-N 3.37Å; C166-L169 VanDerWaalsContact O-N 3.09Å; K167-L169 VanDerWaalsContact C-N 3.29Å; K167-L169 PolarHBondContact O-N 3.18Å; L169-T173 HydrophobicContact CB-CG2 4.05Å; L169-T173 HydrophobicContact CD1-CG2 3.61Å; L169-T173 HydrophobicContact CD2-CG2 4.43Å; L169-T173 HydrophobicContact CG-CG2 4.24Å; L169-V177 HydrophobicContact CD1-CG2 4.5Å | ||
| 170 | S | 95.9 | Very high | 93.2 | Very high | 48 Ų | 48 | 45.8 Ų | 45.8 | 34% | 0.336 | 28% | 0.278 | S | S | . | . | trans | -69 | 151.5 | 172.8 | 64.4 | 0 | 0 | 0 | 0 | 111.6 | E134 P172 T173 T174 | E134-S170 WeakPolarHBondContact OE2-CB 3.47Å; E134-S170 PolarHBondContact OE2-N 3.08Å; E134-S170 PolarHBondContact OE2-OG 2.81Å; S170-P172 VanDerWaalsContact C-CD 3.47Å; S170-P172 VanDerWaalsContact C-N 3.34Å; S170-T173 WeakPolarHBondContact O-CA 3.42Å; S170-T173 WeakPolarHBondContact O-CB 3.41Å; S170-T173 PolarHBondContact O-N 2.83Å; S170-T173 PolarHBondContact OG-OG1 2.95Å; S170-T173 VanDerWaalsContact OG-OG1 3.05Å; S170-T174 PolarHBondContact O-N 3.09Å; S170-T174 PolarHBondContact O-OG1 3.48Å | ||
| 171 | Q | 94.6 | Very high | 92.9 | Very high | 123 Ų | 123 | 45.2 Ų | 45.2 | 58% | 0.575 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -53 | -41.5 | -179.2 | -168.9 | 64.2 | 38.2 | 0 | 0 | 113.9 | T173 T174 N175 | Q171-T173 VanDerWaalsContact C-N 3.34Å; Q171-T173 PolarHBondContact O-N 3.19Å; Q171-T174 PolarHBondContact O-N 3.41Å; Q171-N175 PolarHBondContact NE2-OD1 3.03Å; Q171-N175 WeakPolarHBondContact O-CB 3.45Å; Q171-N175 PolarHBondContact O-N 2.76Å; Q171-N175 PolarHBondContact O-OD1 3.48Å |
| 172 | P | 93.2 | Very high | 92 | Very high | 83 Ų | 83 | 51.9 Ų | 51.9 | 54% | 0.539 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -62.3 | -38.3 | 175.3 | -23.5 | 35.7 | 0 | 0 | 0 | 113.2 | S170 N175 L176 | S170-P172 VanDerWaalsContact C-CD 3.47Å; S170-P172 VanDerWaalsContact C-N 3.34Å; P172-N175 PolarHBondContact O-N 2.76Å; P172-L176 PolarHBondContact O-N 3.21Å |
| 173 | T | 94 | Very high | 90.8 | Very high | 10 Ų | 10 | 53.3 Ų | 53.3 | 6% | 0.061 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -66.6 | -44.5 | 174.3 | -56.1 | 0 | 0 | 0 | 0 | 111 | L130 E134 L169 S170 Q171 N175 L176 V177 | L130-T173 HydrophobicContact CD1-CG2 4.44Å; L130-T173 HydrophobicContact CD2-CG2 3.78Å; E134-T173 VanDerWaalsContact OE2-CB 3.26Å; E134-T173 WeakPolarHBondContact OE2-CB 3.37Å; E134-T173 PolarHBondContact OE2-OG1 2.94Å; L169-T173 HydrophobicContact CB-CG2 4.05Å; L169-T173 HydrophobicContact CD1-CG2 3.61Å; L169-T173 HydrophobicContact CD2-CG2 4.43Å; L169-T173 HydrophobicContact CG-CG2 4.24Å; S170-T173 WeakPolarHBondContact O-CA 3.42Å; S170-T173 WeakPolarHBondContact O-CB 3.41Å; S170-T173 PolarHBondContact O-N 2.83Å; S170-T173 PolarHBondContact OG-OG1 2.95Å; S170-T173 VanDerWaalsContact OG-OG1 3.05Å; Q171-T173 VanDerWaalsContact C-N 3.34Å; Q171-T173 PolarHBondContact O-N 3.19Å; T173-N175 VanDerWaalsContact C-N 3.3Å; T173-N175 PolarHBondContact O-N 3.42Å; T173-L176 WeakPolarHBondContact O-CB 3.09Å; T173-L176 PolarHBondContact O-N 3.14Å; T173-L176 VanDerWaalsContact O-N 3.14Å; T173-V177 WeakPolarHBondContact O-CG2 3.43Å; T173-V177 PolarHBondContact O-N 3.1Å |
| 174 | T | 94.1 | Very high | 89 | Confident | 24 Ų | 24 | 55 Ų | 55 | 15% | 0.147 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -59.1 | -41.5 | 176.1 | -61.4 | 0 | 0 | 0 | 0 | 111.5 | C166 S170 Q171 V177 A178 | C166-T174 HydrophobicContact CB-CG2 4.13Å; S170-T174 PolarHBondContact O-N 3.09Å; S170-T174 PolarHBondContact O-OG1 3.48Å; Q171-T174 PolarHBondContact O-N 3.41Å; T174-V177 PolarHBondContact O-N 2.74Å; T174-A178 WeakPolarHBondContact O-CB 3.5Å; T174-A178 PolarHBondContact O-N 3.11Å |
| 175 | N | 92.1 | Very high | 87.2 | Confident | 94 Ų | 94 | 58.1 Ų | 58.1 | 50% | 0.503 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -64.6 | -40.2 | 174.8 | -67.7 | -5.4 | 0 | 0 | 0 | 112 | Q171 P172 T173 A178 G179 | Q171-N175 PolarHBondContact NE2-OD1 3.03Å; Q171-N175 WeakPolarHBondContact O-CB 3.45Å; Q171-N175 PolarHBondContact O-N 2.76Å; Q171-N175 PolarHBondContact O-OD1 3.48Å; P172-N175 PolarHBondContact O-N 2.76Å; T173-N175 VanDerWaalsContact C-N 3.3Å; T173-N175 PolarHBondContact O-N 3.42Å; N175-A178 PolarHBondContact O-N 2.77Å; N175-G179 PolarHBondContact O-N 2.96Å |
| 176 | L | 91.5 | Very high | 85.2 | Confident | 30 Ų | 30 | 68.7 Ų | 68.7 | 16% | 0.157 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -63.5 | -42.8 | 174.3 | 179.8 | 63.4 | 0 | 0 | 0 | 111.4 | L130 P172 T173 G179 C180 | L130-L176 HydrophobicContact CD2-CD2 4Å; P172-L176 PolarHBondContact O-N 3.21Å; T173-L176 WeakPolarHBondContact O-CB 3.09Å; T173-L176 PolarHBondContact O-N 3.14Å; T173-L176 VanDerWaalsContact O-N 3.14Å; L176-G179 PolarHBondContact O-N 3.1Å; L176-C180 WeakPolarHBondContact O-CB 3.05Å; L176-C180 PolarHBondContact O-N 2.87Å; L176-C180 PolarHBondContact O-SG 3.07Å; L176-C180 VanDerWaalsContact O-SG 3.4Å |
| 177 | V | 92.2 | Very high | 83.3 | Confident | 1 Ų | 1 | 71.8 Ų | 71.8 | 1% | 0.006 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -62.4 | -44.1 | 175.9 | 174.2 | 0 | 0 | 0 | 0 | 111.2 | C123 L138 V162 L165 L169 T173 T174 G179 C180 L181 | C123-V177 HydrophobicContact CB-CG2 4.26Å; C123-V177 VanDerWaalsContact SG-CA 3.59Å; L138-V177 HydrophobicContact CD1-CG2 4.43Å; L138-V177 HydrophobicContact CD2-CG2 4.34Å; V162-V177 HydrophobicContact CG1-CG1 4.38Å; L165-V177 HydrophobicContact CD1-CG1 4.47Å; L169-V177 HydrophobicContact CD1-CG2 4.5Å; T173-V177 WeakPolarHBondContact O-CG2 3.43Å; T173-V177 PolarHBondContact O-N 3.1Å; T174-V177 PolarHBondContact O-N 2.74Å; V177-G179 PolarHBondContact O-N 2.74Å; V177-C180 PolarHBondContact O-N 3.09Å; V177-L181 HydrophobicContact CG1-CD1 3.8Å; V177-L181 WeakPolarHBondContact O-CB 3.49Å; V177-L181 WeakPolarHBondContact O-CG 3.45Å; V177-L181 PolarHBondContact O-N 3.49Å |
| 178 | A | 88.6 | Confident | 81.2 | Confident | 18 Ų | 18 | 72 Ų | 72 | 15% | 0.149 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -61.9 | -41.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | T174 N175 L181 Q182 L183 | T174-A178 WeakPolarHBondContact O-CB 3.5Å; T174-A178 PolarHBondContact O-N 3.11Å; N175-A178 PolarHBondContact O-N 2.77Å; A178-L181 CarbonylContact O-C 3.58Å; A178-L181 PolarHBondContact O-N 2.81Å; A178-Q182 PolarHBondContact O-N 3.05Å; A178-Q182 VanDerWaalsContact O-N 3.08Å; A178-L183 HydrophobicContact CB-CB 4.2Å; A178-L183 HydrophobicContact CB-CD1 3.93Å; A178-L183 HydrophobicContact CB-CG 4.37Å; A178-L183 PolarHBondContact O-N 3.37Å |
| 179 | G | 87.1 | Confident | 79.1 | Confident | 55 Ų | 55 | 76.6 Ų | 76.6 | 57% | 0.567 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -66 | -45.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | N175 L176 V177 L181 Q182 | N175-G179 PolarHBondContact O-N 2.96Å; L176-G179 PolarHBondContact O-N 3.1Å; V177-G179 PolarHBondContact O-N 2.74Å; G179-L181 VanDerWaalsContact C-N 3.27Å; G179-L181 PolarHBondContact O-N 2.8Å; G179-Q182 PolarHBondContact O-N 3.31Å |
| 180 | C | 86.3 | Confident | 76.4 | Confident | 63 Ų | 63 | 84.3 Ų | 84.3 | 43% | 0.426 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -68.2 | -23.5 | 177.4 | -72.5 | 0 | 0 | 0 | 0 | 113.8 | C123 L176 V177 | C123-C180 HydrophobicContact CB-CB 3.61Å; C123-C180 VanDerWaalsContact SG-CB 3.56Å; L176-C180 WeakPolarHBondContact O-CB 3.05Å; L176-C180 PolarHBondContact O-N 2.87Å; L176-C180 PolarHBondContact O-SG 3.07Å; L176-C180 VanDerWaalsContact O-SG 3.4Å; V177-C180 PolarHBondContact O-N 3.09Å |
| 181 | L | 84.7 | Confident | 73.6 | Confident | 46 Ų | 46 | 84.8 Ų | 84.8 | 24% | 0.241 | 48% | 0.476 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -104.8 | 12.9 | 177.6 | -62.5 | 175.6 | 0 | 0 | 0 | 113.3 | V162 L165 V177 A178 G179 L183 | V162-L181 HydrophobicContact CG2-CB 4.4Å; V162-L181 HydrophobicContact CG2-CD1 3.66Å; L165-L181 HydrophobicContact CD1-CD1 4.03Å; V177-L181 HydrophobicContact CG1-CD1 3.8Å; V177-L181 WeakPolarHBondContact O-CB 3.49Å; V177-L181 WeakPolarHBondContact O-CG 3.45Å; V177-L181 PolarHBondContact O-N 3.49Å; A178-L181 CarbonylContact O-C 3.58Å; A178-L181 PolarHBondContact O-N 2.81Å; G179-L181 VanDerWaalsContact C-N 3.27Å; G179-L181 PolarHBondContact O-N 2.8Å; L181-L183 VanDerWaalsContact C-N 3.29Å; L181-L183 HydrophobicContact CB-CD2 4.42Å; L181-L183 HydrophobicContact CB-CG 4.32Å; L181-L183 PolarHBondContact O-N 3.49Å |
| 182 | Q | 75.9 | Confident | 71.2 | Confident | 171 Ų | 171 | 88.9 Ų | 88.9 | 80% | 0.799 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.2 | 43.5 | 177.2 | -62.2 | -173.2 | -65 | 0 | 0 | 114.6 | A178 G179 N184 | A178-Q182 PolarHBondContact O-N 3.05Å; A178-Q182 VanDerWaalsContact O-N 3.08Å; G179-Q182 PolarHBondContact O-N 3.31Å; Q182-N184 PolarHBondContact O-N 3.48Å |
| 183 | L | 68.9 | Low | 68.5 | Low | 31 Ų | 31 | 88.8 Ų | 88.8 | 16% | 0.162 | 51% | 0.509 | C | S | . | . | trans | -78.3 | 109.7 | 175.1 | -50.3 | 178.7 | 0 | 0 | 0 | 109 | L158 V162 A178 L181 A185 F188 | L158-L183 HydrophobicContact CD2-CD2 3.83Å; L158-L183 HydrophobicContact CG-CD2 3.94Å; V162-L183 HydrophobicContact CB-CD1 3.89Å; V162-L183 HydrophobicContact CG1-CD1 3.39Å; V162-L183 HydrophobicContact CG2-CD1 3.47Å; V162-L183 VanDerWaalsContact CG2-CD1 3.47Å; V162-L183 HydrophobicContact CG2-CD2 3.9Å; V162-L183 HydrophobicContact CG2-CG 4.18Å; A178-L183 HydrophobicContact CB-CB 4.2Å; A178-L183 HydrophobicContact CB-CD1 3.93Å; A178-L183 HydrophobicContact CB-CG 4.37Å; A178-L183 PolarHBondContact O-N 3.37Å; L181-L183 VanDerWaalsContact C-N 3.29Å; L181-L183 HydrophobicContact CB-CD2 4.42Å; L181-L183 HydrophobicContact CB-CG 4.32Å; L181-L183 PolarHBondContact O-N 3.49Å; L183-A185 PolarHBondContact O-N 3.35Å; L183-F188 HydrophobicContact CB-CE2 4.46Å; L183-F188 HydrophobicContact CD1-CE2 4.02Å; L183-F188 HydrophobicContact CD1-CZ 4.32Å | ||
| 184 | N | 54.8 | Low | 65.8 | Low | 133 Ų | 133 | 91.8 Ų | 91.8 | 71% | 0.711 | 54% | 0.542 | S | S | * | . | trans | -55.1 | 125.6 | 173.7 | -75 | -53.6 | 0 | 0 | 0 | 109.7 | Q182 R186 S187 | Q182-N184 PolarHBondContact O-N 3.48Å; N184-R186 PolarHBondContact O-N 3.27Å; N184-S187 PolarHBondContact O-N 3.35Å; N184-S187 VanDerWaalsContact O-N 3.14Å | ||
| 185 | A | 56.7 | Low | 63.2 | Low | 89 Ų | 89 | 99.9 Ų | 99.9 | 74% | 0.736 | 58% | 0.578 | S | S | * | * | G | 310 helix | trans | -57.9 | -10.2 | -171.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | L183 | L183-A185 PolarHBondContact O-N 3.35Š|
| 186 | R | 55.3 | Low | 60.7 | Low | 221 Ų | 221 | 99.8 Ų | 99.8 | 83% | 0.834 | 59% | 0.59 | S | S | * | * | G | 310 helix | trans | -70.4 | -21.7 | 176 | -72.7 | -177.1 | 165.3 | 166.1 | -4.5 | 114.5 | N184 F188 | N184-R186 PolarHBondContact O-N 3.27Å; R186-F188 VanDerWaalsContact C-N 3.32Å; R186-F188 PolarHBondContact O-N 3.12Å |
| 187 | S | 55.9 | Low | 58.3 | Low | 83 Ų | 83 | 102.1 Ų | 102.1 | 58% | 0.58 | 61% | 0.614 | S | S | * | * | G | 310 helix | trans | -76.5 | -8.7 | -176.2 | -65.9 | 0 | 0 | 0 | 0 | 115.8 | N184 | N184-S187 PolarHBondContact O-N 3.35Å; N184-S187 VanDerWaalsContact O-N 3.14Å |
| 188 | F | 50.9 | Low | 56.1 | Low | 108 Ų | 108 | 110.1 Ų | 110.1 | 47% | 0.474 | 65% | 0.651 | S | S | . | * | G | 310 helix | trans | -107.4 | -0.4 | -171.6 | -78.5 | -79.1 | 0 | 0 | 0 | 115.8 | L159 L183 R186 | L159-F188 HydrophobicContact CD1-CZ 4.17Å; L183-F188 HydrophobicContact CB-CE2 4.46Å; L183-F188 HydrophobicContact CD1-CE2 4.02Å; L183-F188 HydrophobicContact CD1-CZ 4.32Å; R186-F188 VanDerWaalsContact C-N 3.32Å; R186-F188 PolarHBondContact O-N 3.12Å |
| 189 | L | 51.2 | Low | 53.8 | Low | 158 Ų | 158 | 118.1 Ų | 118.1 | 83% | 0.827 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -117.6 | -0.1 | -176.2 | -86.5 | 167.1 | 0 | 0 | 0 | 115.4 | ||
| 190 | M | 40.2 | Very low | 52.2 | Low | 182 Ų | 182 | 122.3 Ų | 122.3 | 90% | 0.897 | 70% | 0.699 | S | S | * | * | trans | -109.1 | 76.3 | 179.4 | -67.3 | -177.6 | 72.4 | 0 | 0 | 110.9 | ||||
| 191 | G | 38 | Very low | 50.1 | Low | 58 Ų | 58 | 131 Ų | 131 | 60% | 0.598 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -170.5 | 96.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||
| 192 | Q | 44.6 | Very low | 48.2 | Very low | 208 Ų | 208 | 134 Ų | 134 | 97% | 0.972 | 75% | 0.748 | S | S | * | * | S | Bend | trans | 80.7 | 100.8 | -171.5 | -52.3 | 169.6 | 89 | 0 | 0 | 114.4 | ||
| 193 | G | 35.2 | Very low | 46.7 | Very low | 81 Ų | 81 | 130.9 Ų | 130.9 | 84% | 0.835 | 74% | 0.743 | S | S | * | * | trans | 159.7 | 95.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 194 | G | 37.7 | Very low | 45.7 | Very low | 74 Ų | 74 | 140.6 Ų | 140.6 | 76% | 0.763 | 78% | 0.779 | S | S | * | * | trans | -5 | 145 | 167.7 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 195 | E | 39.2 | Very low | 45.3 | Very low | 194 Ų | 194 | 138.7 Ų | 138.7 | 91% | 0.907 | 78% | 0.776 | S | S | * | * | trans | 76.4 | 145.3 | 143.9 | -71.5 | -74.5 | 108.9 | 0 | 0 | 120.9 | ||||
| 196 | A | 40.1 | Very low | 44.8 | Very low | 91 Ų | 91 | 139.8 Ų | 139.8 | 75% | 0.752 | 77% | 0.774 | S | S | * | * | trans | 69.3 | 98.1 | 162.3 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 197 | A | 40.9 | Very low | 44.9 | Very low | 80 Ų | 80 | 138.1 Ų | 138.1 | 66% | 0.661 | 77% | 0.773 | S | S | * | * | 103.8 | 145.8 | 122.9 | 0 | 0 | 0 | 0 | 0 | 121.4 | |||||
| 198 | H | 45 | Very low | 44.7 | Very low | 168 Ų | 168 | 144.7 Ų | 144.7 | 78% | 0.778 | 79% | 0.787 | S | S | * | * | trans | 82.4 | 87.4 | 167.3 | -52.5 | -59.7 | 0 | 0 | 0 | 118.7 | ||||
| 199 | H | 41.3 | Very low | 45.2 | Very low | 187 Ų | 187 | 144.8 Ų | 144.8 | 87% | 0.866 | 80% | 0.798 | S | S | * | * | trans | -44.9 | 127.7 | 168 | -35.7 | -79.1 | 0 | 0 | 0 | 114.6 | ||||
| 200 | T | 52.7 | Low | 45.6 | Very low | 142 Ų | 142 | 143.4 Ų | 143.4 | 87% | 0.871 | 80% | 0.799 | S | S | * | * | trans | -128.5 | 128.8 | 146.7 | 52.4 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 201 | R | 42.1 | Very low | 46.2 | Very low | 245 Ų | 245 | 146 Ų | 146 | 93% | 0.925 | 80% | 0.8 | S | S | * | * | trans | -79.5 | 119.2 | -167.9 | 173.8 | -176.1 | 178.9 | -175.1 | 0.6 | 110.9 | ||||
| 202 | S | 45.6 | Very low | 46.8 | Very low | 109 Ų | 109 | 151.7 Ų | 151.7 | 76% | 0.762 | 81% | 0.811 | S | S | * | * | trans | -116.2 | 123.5 | 167.9 | -176.4 | 0 | 0 | 0 | 0 | 110.2 | Y204 | S202-Y204 PolarHBondContact O-N 3.43Š| ||
| 203 | P | 44.5 | Very low | 47 | Very low | 107 Ų | 107 | 147.2 Ų | 147.2 | 70% | 0.695 | 80% | 0.803 | S | S | * | * | trans | -99.1 | 80.5 | -176.7 | 37.3 | -31.9 | 0 | 0 | 0 | 111.9 | ||||
| 204 | Y | 48.6 | Very low | 47.8 | Very low | 234 Ų | 234 | 148.1 Ų | 148.1 | 92% | 0.918 | 79% | 0.794 | S | S | * | * | trans | -130.9 | 105.8 | 154 | -106 | -83 | 0 | 0 | 0 | 110.3 | S202 | S202-Y204 PolarHBondContact O-N 3.43Š| ||
| 205 | S | 46.3 | Very low | 47.9 | Very low | 93 Ų | 93 | 153 Ų | 153 | 65% | 0.65 | 80% | 0.797 | S | S | * | * | trans | -86 | 125.9 | -168.7 | -170.4 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 206 | T | 45.8 | Very low | 48.5 | Very low | 113 Ų | 113 | 151 Ų | 151 | 69% | 0.693 | 79% | 0.792 | S | S | * | * | 54.9 | 96.3 | 128.2 | -44.7 | 0 | 0 | 0 | 0 | 118.7 | |||||
| 207 | F | 56.3 | Low | 48.7 | Very low | 185 Ų | 185 | 152.7 Ų | 152.7 | 81% | 0.811 | 79% | 0.793 | S | S | * | * | trans | -142.2 | 131.6 | 142.2 | -61.3 | -76.6 | 0 | 0 | 0 | 110 | ||||
| 208 | Y | 52.5 | Low | 49.2 | Very low | 221 Ų | 221 | 155 Ų | 155 | 87% | 0.867 | 80% | 0.799 | S | S | * | * | trans | 74.8 | 115.8 | 173.6 | -56.8 | -76.4 | 0 | 0 | 0 | 120 | ||||
| 209 | P | 60.6 | Low | 49.5 | Very low | 110 Ų | 110 | 152.5 Ų | 152.5 | 71% | 0.714 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -85.1 | 159.9 | 156.5 | 35.7 | -32.1 | 0 | 0 | 0 | 111.6 | ||
| 210 | P | 59.7 | Low | 49.9 | Very low | 130 Ų | 130 | 149.8 Ų | 149.8 | 84% | 0.844 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 142.3 | 178.9 | -0.2 | 18 | 0 | 0 | 0 | 112.1 | ||
| 211 | Y | 53.1 | Low | 49.8 | Very low | 235 Ų | 235 | 146.9 Ų | 146.9 | 92% | 0.922 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 132.1 | 175 | -90.2 | -94.7 | 0 | 0 | 0 | 112.4 | ||
| 212 | H | 51.2 | Low | 50.1 | Low | 179 Ų | 179 | 143.9 Ų | 143.9 | 83% | 0.829 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -85.5 | 144.2 | 165.1 | -137.8 | -84.6 | 0 | 0 | 0 | 109.2 | ||
| 213 | S | 47.9 | Very low | 50.3 | Low | 114 Ų | 114 | 142 Ų | 142 | 80% | 0.797 | 79% | 0.789 | S | S | * | * | trans | -144.8 | 121.2 | 175.7 | -174.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 214 | P | 52.2 | Low | 50.6 | Low | 100 Ų | 100 | 141.7 Ų | 141.7 | 65% | 0.649 | 79% | 0.785 | S | S | * | * | trans | -123.8 | 164.6 | 168.2 | 38 | -25.6 | 0 | 0 | 0 | 114.4 | ||||
| 215 | E | 41 | Very low | 50.7 | Low | 177 Ų | 177 | 137.9 Ų | 137.9 | 83% | 0.827 | 78% | 0.78 | S | S | * | * | trans | 68.3 | 120.9 | 164.1 | -79.8 | 178.7 | 109 | 0 | 0 | 120.8 | ||||
| 216 | L | 51.8 | Low | 50.8 | Low | 151 Ų | 151 | 139.5 Ų | 139.5 | 79% | 0.791 | 78% | 0.781 | S | S | * | * | 177 | 114.9 | 111.8 | -92.3 | 158.5 | 0 | 0 | 0 | 113.8 | |||||
| 217 | T | 43.9 | Very low | 50.8 | Low | 127 Ų | 127 | 140.2 Ų | 140.2 | 78% | 0.779 | 78% | 0.781 | S | S | * | * | trans | 59.3 | 132.1 | 140.1 | 52.5 | 0 | 0 | 0 | 0 | 125.5 | ||||
| 218 | T | 51.3 | Low | 50.5 | Low | 128 Ų | 128 | 135.7 Ų | 135.7 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | trans | -59.4 | -176.1 | 162.3 | 12.9 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 219 | P | 52.1 | Low | 50.4 | Low | 116 Ų | 116 | 134.8 Ų | 134.8 | 75% | 0.753 | 77% | 0.772 | S | S | * | * | cis | -133.8 | -175.7 | 0.1 | 23.5 | 3.8 | 0 | 0 | 0 | 116 | ||||
| 220 | P | 48.8 | Very low | 49.5 | Very low | 129 Ų | 129 | 134.7 Ų | 134.7 | 84% | 0.838 | 77% | 0.774 | S | S | * | * | trans | -99.5 | 169 | -172 | 38.9 | -36.1 | 0 | 0 | 0 | 117.1 | ||||
| 221 | G | 51.3 | Low | 49 | Very low | 81 Ų | 81 | 137.7 Ų | 137.7 | 84% | 0.835 | 78% | 0.78 | S | S | * | * | trans | -95.2 | -179.7 | -178 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 222 | H | 47.7 | Very low | 48.7 | Very low | 182 Ų | 182 | 136 Ų | 136 | 84% | 0.843 | 78% | 0.777 | S | S | * | * | trans | -122 | 142 | -155 | 168.7 | 55.6 | 0 | 0 | 0 | 113 | T224 | H222-T224 PolarHBondContact CE1-OG1 3.34Å; H222-T224 VanDerWaalsContact CE1-OG1 3.32Å | ||
| 223 | G | 50.2 | Low | 48.5 | Very low | 70 Ų | 70 | 133.1 Ų | 133.1 | 72% | 0.722 | 77% | 0.774 | S | S | * | * | trans | -166.1 | 147.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 224 | T | 51.1 | Low | 48 | Very low | 101 Ų | 101 | 139 Ų | 139 | 62% | 0.62 | 78% | 0.78 | S | S | * | * | trans | -157.9 | 136.5 | -154.4 | -60.4 | 0 | 0 | 0 | 0 | 113.4 | H222 | H222-T224 PolarHBondContact CE1-OG1 3.34Å; H222-T224 VanDerWaalsContact CE1-OG1 3.32Å | ||
| 225 | L | 50.2 | Low | 47.6 | Very low | 154 Ų | 154 | 142.1 Ų | 142.1 | 81% | 0.806 | 79% | 0.792 | S | S | * | * | trans | 63.5 | 157.5 | 168.5 | -72.7 | 160.2 | 0 | 0 | 0 | 115.6 | ||||
| 226 | D | 48.8 | Very low | 48 | Very low | 126 Ų | 126 | 144.9 Ų | 144.9 | 67% | 0.674 | 80% | 0.796 | S | S | * | * | cis | -155 | 162.5 | 12.8 | -151.2 | -11.5 | 0 | 0 | 0 | 114.4 | ||||
| 227 | N | 45.4 | Very low | 47.5 | Very low | 129 Ų | 129 | 143.5 Ų | 143.5 | 69% | 0.69 | 80% | 0.798 | S | S | * | * | trans | 39.9 | 119.2 | 148 | -107.3 | -30 | 0 | 0 | 0 | 126.4 | ||||
| 228 | S | 50.6 | Low | 47.5 | Very low | 89 Ų | 89 | 143.1 Ų | 143.1 | 62% | 0.622 | 80% | 0.8 | S | S | * | * | 105.7 | 141.7 | 110.4 | 82.5 | 0 | 0 | 0 | 0 | 123.5 | |||||
| 229 | K | 49.7 | Very low | 47.6 | Very low | 202 Ų | 202 | 141.4 Ų | 141.4 | 88% | 0.878 | 80% | 0.799 | S | S | * | * | trans | 90.8 | 117.2 | 155.5 | -56.9 | -173 | -171.9 | 177.2 | 0 | 119.6 | ||||
| 230 | S | 41.6 | Very low | 47.6 | Very low | 108 Ų | 108 | 146.2 Ų | 146.2 | 76% | 0.755 | 80% | 0.804 | S | S | * | * | trans | -91.3 | 142.9 | 178.3 | 53 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 231 | M | 50.3 | Low | 47.7 | Very low | 194 Ų | 194 | 148.4 Ų | 148.4 | 96% | 0.956 | 80% | 0.803 | S | S | * | * | trans | -142.6 | 144.9 | 151.1 | -78.3 | -60.4 | 171.4 | 0 | 0 | 109.1 | ||||
| 232 | K | 45.8 | Very low | 47.7 | Very low | 200 Ų | 200 | 149.9 Ų | 149.9 | 87% | 0.87 | 80% | 0.8 | S | S | * | * | trans | -133.8 | 119.7 | -171.2 | -173 | 167.8 | -176.9 | 165.7 | 0 | 110.9 | ||||
| 233 | P | 48.1 | Very low | 47.8 | Very low | 118 Ų | 118 | 150.2 Ų | 150.2 | 77% | 0.766 | 80% | 0.799 | S | S | * | * | trans | -85.4 | 153.6 | 177.4 | 33 | -32.9 | 0 | 0 | 0 | 112.5 | ||||
| 234 | Y | 36.7 | Very low | 47.8 | Very low | 237 Ų | 237 | 157.2 Ų | 157.2 | 93% | 0.929 | 81% | 0.806 | S | S | * | * | trans | -69.9 | 140 | 173.5 | -92.2 | -111.5 | 0 | 0 | 0 | 111.5 | ||||
| 235 | N | 43.8 | Very low | 47.4 | Very low | 166 Ų | 166 | 160.6 Ų | 160.6 | 89% | 0.888 | 82% | 0.815 | S | S | * | * | trans | -124.7 | 127.8 | 171.8 | -129 | 11.2 | 0 | 0 | 0 | 110 | ||||
| 236 | Y | 49.2 | Very low | 47.2 | Very low | 235 Ų | 235 | 159 Ų | 159 | 92% | 0.922 | 82% | 0.816 | S | S | * | * | trans | -120.7 | 74.4 | -175.2 | -179.4 | -93.9 | 0 | 0 | 0 | 110.2 | ||||
| 237 | C | 41.3 | Very low | 47.2 | Very low | 122 Ų | 122 | 159.2 Ų | 159.2 | 82% | 0.824 | 82% | 0.822 | S | S | * | * | trans | -174.7 | 115.7 | 159.3 | -164 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 238 | S | 44.5 | Very low | 46.8 | Very low | 118 Ų | 118 | 158.4 Ų | 158.4 | 83% | 0.825 | 83% | 0.826 | S | S | * | * | trans | -163.5 | 26.6 | 172.9 | -149.3 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 239 | A | 53.3 | Low | 47.2 | Very low | 92 Ų | 92 | 159.8 Ų | 159.8 | 76% | 0.76 | 83% | 0.834 | S | S | * | * | S | Bend | trans | -105.4 | 10 | -162.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 240 | Y | 51.8 | Low | 46.6 | Very low | 218 Ų | 218 | 158.9 Ų | 158.9 | 86% | 0.855 | 83% | 0.832 | S | S | * | * | S | Bend | trans | -135.3 | -1.5 | -167.9 | -107.5 | -88.1 | 0 | 0 | 0 | 118 | ||
| 241 | E | 49.9 | Very low | 46.7 | Very low | 174 Ų | 174 | 160 Ų | 160 | 81% | 0.813 | 84% | 0.839 | S | S | * | * | trans | -102.2 | -16 | -172.9 | -94.4 | -82.1 | 117.9 | 0 | 0 | 115.4 | F243 | E241-F243 PolarHBondContact O-N 3.2Š| ||
| 242 | S | 50.9 | Low | 46.6 | Very low | 112 Ų | 112 | 155.2 Ų | 155.2 | 78% | 0.783 | 83% | 0.83 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | 22.9 | -168.2 | -50.8 | 0 | 0 | 0 | 0 | 116.8 | ||
| 243 | F | 50.6 | Low | 46.3 | Very low | 189 Ų | 189 | 151.6 Ų | 151.6 | 83% | 0.829 | 83% | 0.83 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.2 | -7 | -173.8 | -79.9 | -75 | 0 | 0 | 0 | 116.1 | E241 | E241-F243 PolarHBondContact O-N 3.2Š|
| 244 | Y | 49.9 | Very low | 46.7 | Very low | 218 Ų | 218 | 151.8 Ų | 151.8 | 86% | 0.855 | 83% | 0.831 | S | S | * | * | S | Bend | trans | -118.3 | -10.5 | -173.8 | -90.5 | -81.4 | 0 | 0 | 0 | 117 | ||
| 245 | E | 43 | Very low | 47.1 | Very low | 172 Ų | 172 | 149.7 Ų | 149.7 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | trans | -117.2 | 97.8 | -178.9 | -146.6 | 74.8 | -141.5 | 0 | 0 | 110.8 | ||||
| 246 | S | 46.4 | Very low | 47.3 | Very low | 121 Ų | 121 | 151.5 Ų | 151.5 | 85% | 0.846 | 83% | 0.83 | S | S | * | * | trans | -150.3 | 103.2 | 167.1 | -77.4 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 247 | T | 47.9 | Very low | 47.2 | Very low | 130 Ų | 130 | 149 Ų | 149 | 80% | 0.798 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 153.6 | 178.7 | 39 | 0 | 0 | 0 | 0 | 112.2 | ||
| 248 | S | 37 | Very low | 47.8 | Very low | 111 Ų | 111 | 146.6 Ų | 146.6 | 78% | 0.776 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 138.6 | -173.7 | -173 | 0 | 0 | 0 | 0 | 113.7 | ||
| 249 | P | 59.2 | Low | 48.1 | Very low | 119 Ų | 119 | 146.7 Ų | 146.7 | 77% | 0.773 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -93.6 | 131.4 | 157.6 | 32.5 | -25.9 | 0 | 0 | 0 | 111.3 | ||
| 250 | E | 38 | Very low | 48.3 | Very low | 183 Ų | 183 | 151 Ų | 151 | 86% | 0.855 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 136.1 | 169.8 | -61.7 | 162.8 | 111.3 | 0 | 0 | 110.5 | ||
| 251 | C | 43.6 | Very low | 48.2 | Very low | 131 Ų | 131 | 146 Ų | 146 | 89% | 0.885 | 83% | 0.827 | S | S | * | * | trans | -177.2 | 147.7 | 141.4 | -103 | 0 | 0 | 0 | 0 | 115 | ||||
| 252 | A | 47.5 | Very low | 49.1 | Very low | 94 Ų | 94 | 143 Ų | 143 | 78% | 0.777 | 82% | 0.823 | S | S | * | * | trans | 59.4 | 94.4 | 152.6 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 253 | S | 39 | Very low | 50 | Low | 123 Ų | 123 | 143.1 Ų | 143.1 | 86% | 0.86 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 138.7 | 160.1 | -48.5 | 0 | 0 | 0 | 0 | 112.7 | ||
| 254 | P | 58.1 | Low | 50.7 | Low | 122 Ų | 122 | 140 Ų | 140 | 79% | 0.792 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -95.4 | 140.2 | 150.3 | 4.3 | 15.6 | 0 | 0 | 0 | 110.3 | ||
| 255 | Q | 44.5 | Very low | 51.6 | Low | 193 Ų | 193 | 137 Ų | 137 | 90% | 0.902 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 133.6 | 173.6 | -63.5 | 167.1 | -82.4 | 0 | 0 | 111 | ||
| 256 | F | 47.9 | Very low | 52.4 | Low | 205 Ų | 205 | 135.7 Ų | 135.7 | 90% | 0.899 | 82% | 0.815 | S | S | * | * | trans | -152.6 | 149.6 | 144.1 | -140.9 | -97.1 | 0 | 0 | 0 | 111.4 | ||||
| 257 | E | 47.4 | Very low | 52.6 | Low | 181 Ų | 181 | 140.4 Ų | 140.4 | 85% | 0.846 | 82% | 0.816 | S | S | * | * | trans | -81.5 | 153 | -170.3 | -62.2 | 178.5 | 116.5 | 0 | 0 | 114 | ||||
| 258 | G | 54 | Low | 52.4 | Low | 72 Ų | 72 | 141.7 Ų | 141.7 | 74% | 0.742 | 82% | 0.818 | S | S | * | * | trans | 100.9 | 139.1 | 131.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 259 | P | 50.2 | Low | 52.9 | Low | 121 Ų | 121 | 139.3 Ų | 139.3 | 79% | 0.786 | 81% | 0.811 | S | S | * | * | trans | -122.1 | 140.1 | -151 | 36.7 | -20.5 | 0 | 0 | 0 | 114.7 | ||||
| 260 | L | 56.9 | Low | 52.6 | Low | 181 Ų | 181 | 141.1 Ų | 141.1 | 95% | 0.948 | 81% | 0.812 | S | S | * | * | trans | -139.3 | 121.2 | 159.2 | -71.3 | 177.4 | 0 | 0 | 0 | 110.6 | ||||
| 261 | S | 51.3 | Low | 53.1 | Low | 113 Ų | 113 | 142.7 Ų | 142.7 | 79% | 0.79 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 137.2 | -178.5 | -169.7 | 0 | 0 | 0 | 0 | 111.4 | ||
| 262 | P | 67.6 | Low | 53.9 | Low | 112 Ų | 112 | 141.1 Ų | 141.1 | 73% | 0.727 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 138.5 | 171.2 | -12.4 | 27.6 | 0 | 0 | 0 | 111.4 | ||
| 263 | P | 69.2 | Low | 53.9 | Low | 114 Ų | 114 | 144.7 Ų | 144.7 | 74% | 0.74 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 155.4 | 176.1 | 32.1 | -35 | 0 | 0 | 0 | 112.2 | ||
| 264 | P | 65.1 | Low | 54.8 | Low | 125 Ų | 125 | 148.4 Ų | 148.4 | 81% | 0.812 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 132 | 179.1 | 29.5 | -34.4 | 0 | 0 | 0 | 112.2 | N266 | P264-N266 PolarHBondContact O-N 3.46Š|
| 265 | I | 70.6 | Confident | 54.2 | Low | 155 Ų | 155 | 151.1 Ų | 151.1 | 80% | 0.795 | 82% | 0.815 | S | S | * | * | trans | -69.4 | 112 | 173.2 | 26.6 | 172 | 0 | 0 | 0 | 111.1 | ||||
| 266 | N | 58.1 | Low | 54 | Low | 144 Ų | 144 | 151.1 Ų | 151.1 | 77% | 0.77 | 82% | 0.815 | S | S | * | * | trans | -87.5 | 112.4 | 175.4 | -173.6 | -8.8 | 0 | 0 | 0 | 110.5 | P264 N268 | P264-N266 PolarHBondContact O-N 3.46Å; N266-N268 PolarHBondContact O-N 3.35Å | ||
| 267 | Y | 51.3 | Low | 53.7 | Low | 219 Ų | 219 | 149.4 Ų | 149.4 | 86% | 0.859 | 81% | 0.81 | S | S | * | * | trans | -83.4 | 92.5 | 172.4 | -93.8 | -89.7 | 0 | 0 | 0 | 110.7 | ||||
| 268 | N | 43.5 | Very low | 53.4 | Low | 157 Ų | 157 | 147 Ų | 147 | 84% | 0.84 | 81% | 0.808 | S | S | * | * | trans | -148.9 | 97.7 | 165.6 | -147 | 22.2 | 0 | 0 | 0 | 110.4 | N266 | N266-N268 PolarHBondContact O-N 3.35Š| ||
| 269 | G | 47.5 | Very low | 52.9 | Low | 61 Ų | 61 | 151.1 Ų | 151.1 | 63% | 0.629 | 81% | 0.812 | S | S | * | * | trans | -175.3 | 87.5 | -171.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 270 | I | 53.7 | Low | 52.4 | Low | 157 Ų | 157 | 152.7 Ų | 152.7 | 81% | 0.805 | 81% | 0.814 | S | S | * | * | trans | 32.4 | 93.8 | 139.1 | 52.2 | 164.7 | 0 | 0 | 0 | 119.5 | S272 | I270-S272 PolarHBondContact O-N 2.96Š| ||
| 271 | F | 48.3 | Very low | 51.6 | Low | 217 Ų | 217 | 154 Ų | 154 | 95% | 0.952 | 81% | 0.807 | S | S | * | * | trans | -81.8 | 92.7 | 149.6 | -97 | -86.3 | 0 | 0 | 0 | 109.8 | ||||
| 272 | S | 60 | Low | 51.2 | Low | 97 Ų | 97 | 151.4 Ų | 151.4 | 68% | 0.678 | 80% | 0.799 | S | S | * | * | trans | -81.4 | 112.9 | 167.2 | -69 | 0 | 0 | 0 | 0 | 110.1 | I270 K274 | I270-S272 PolarHBondContact O-N 2.96Å; S272-K274 PolarHBondContact O-N 3.2Å; S272-K274 VanDerWaalsContact O-N 3.16Å | ||
| 273 | L | 48.7 | Very low | 50.2 | Low | 170 Ų | 170 | 155.5 Ų | 155.5 | 89% | 0.89 | 81% | 0.805 | S | S | * | * | trans | -64.4 | 108.4 | 171.2 | 178.5 | 68.4 | 0 | 0 | 0 | 109.7 | ||||
| 274 | K | 57.3 | Low | 49.1 | Very low | 200 Ų | 200 | 157 Ų | 157 | 87% | 0.87 | 81% | 0.807 | S | S | * | * | trans | -95.4 | 122.7 | 160.4 | -90.6 | -160.5 | 170.3 | -168.3 | 0 | 109.9 | S272 | S272-K274 PolarHBondContact O-N 3.2Å; S272-K274 VanDerWaalsContact O-N 3.16Å | ||
| 275 | Q | 45.4 | Very low | 48.1 | Very low | 180 Ų | 180 | 159.5 Ų | 159.5 | 84% | 0.841 | 80% | 0.802 | S | S | * | * | trans | -78.9 | 123.4 | 168.6 | 172.3 | -178.4 | -6.7 | 0 | 0 | 108.4 | ||||
| 276 | E | 40.7 | Very low | 47 | Very low | 192 Ų | 192 | 159.9 Ų | 159.9 | 90% | 0.897 | 81% | 0.805 | S | S | * | * | trans | -140.6 | 145.8 | 163.4 | -163.9 | 165.4 | 173.3 | 0 | 0 | 108.2 | ||||
| 277 | E | 40 | Very low | 46.9 | Very low | 169 Ų | 169 | 162.6 Ų | 162.6 | 79% | 0.79 | 81% | 0.806 | S | S | * | * | trans | -81.8 | 159.8 | -159.5 | -78.6 | 174.6 | 108.3 | 0 | 0 | 115 | ||||
| 278 | T | 42.9 | Very low | 46.9 | Very low | 132 Ų | 132 | 154.3 Ų | 154.3 | 81% | 0.81 | 79% | 0.787 | S | S | * | * | trans | -26.4 | 121.3 | 172 | 37 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 279 | L | 42.9 | Very low | 47.5 | Very low | 158 Ų | 158 | 153.6 Ų | 153.6 | 83% | 0.827 | 78% | 0.781 | S | S | * | * | trans | -139.5 | 154.6 | 149.2 | -142.4 | 76.2 | 0 | 0 | 0 | 110.5 | Y281 | L279-Y281 PolarHBondContact O-N 2.69Š| ||
| 280 | D | 38.8 | Very low | 47.8 | Very low | 153 Ų | 153 | 159.3 Ų | 159.3 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | trans | -58.7 | 123.5 | -160.1 | -63.4 | -95.8 | 0 | 0 | 0 | 117.2 | G282 | D280-G282 PolarHBondContact O-N 2.83Š| ||
| 281 | Y | 40.7 | Very low | 47.8 | Very low | 208 Ų | 208 | 161.7 Ų | 161.7 | 82% | 0.816 | 79% | 0.791 | S | S | * | * | trans | -95.6 | 76.3 | 167.1 | -103.1 | -85.2 | 0 | 0 | 0 | 112.2 | L279 Y285 | L279-Y281 PolarHBondContact O-N 2.69Å; Y281-Y285 HydrophobicContact CD1-CE2 4.48Å; Y281-Y285 HydrophobicContact CE1-CE2 4.28Å; Y281-Y285 WeakPolarHBondContact CE1-OH 3.49Å | ||
| 282 | G | 43.1 | Very low | 47.9 | Very low | 60 Ų | 60 | 157.3 Ų | 157.3 | 62% | 0.619 | 79% | 0.786 | S | S | * | * | trans | -116.7 | 106.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | D280 | D280-G282 PolarHBondContact O-N 2.83Š| ||
| 283 | K | 47.3 | Very low | 47.4 | Very low | 197 Ų | 197 | 157.4 Ų | 157.4 | 86% | 0.857 | 79% | 0.792 | S | S | * | * | S | Bend | trans | 69.8 | 109.9 | 175.3 | -49.6 | 163 | -177 | 168.5 | 0 | 115.5 | ||
| 284 | N | 44.4 | Very low | 47.6 | Very low | 145 Ų | 145 | 155.6 Ų | 155.6 | 78% | 0.775 | 79% | 0.788 | S | S | * | * | 158.6 | 92.3 | 129.1 | -80.9 | -8.7 | 0 | 0 | 0 | 111.6 | |||||
| 285 | Y | 44 | Very low | 47.6 | Very low | 178 Ų | 178 | 151.2 Ų | 151.2 | 70% | 0.698 | 78% | 0.78 | S | S | * | * | trans | -125.3 | 77.4 | 159.8 | -74 | -69.7 | 0 | 0 | 0 | 108.8 | Y281 Y287 | Y281-Y285 HydrophobicContact CD1-CE2 4.48Å; Y281-Y285 HydrophobicContact CE1-CE2 4.28Å; Y281-Y285 WeakPolarHBondContact CE1-OH 3.49Å; Y285-Y287 PolarHBondContact O-N 2.98Å | ||
| 286 | N | 47.5 | Very low | 48.1 | Very low | 163 Ų | 163 | 149 Ų | 149 | 87% | 0.872 | 78% | 0.781 | S | S | * | * | trans | -85.6 | 84.6 | 177.3 | -139.8 | 35.2 | 0 | 0 | 0 | 108.5 | G288 | N286-G288 VanDerWaalsContact C-N 3.29Å; N286-G288 PolarHBondContact O-N 3.25Å | ||
| 287 | Y | 56.3 | Low | 48.8 | Very low | 202 Ų | 202 | 151.3 Ų | 151.3 | 79% | 0.792 | 78% | 0.781 | S | S | * | * | trans | -71.2 | 88.9 | 169.9 | -94.6 | -91.1 | 0 | 0 | 0 | 109.1 | Y285 M289 | Y285-Y287 PolarHBondContact O-N 2.98Å; Y287-M289 PolarHBondContact O-N 3.27Å | ||
| 288 | G | 51.4 | Low | 49.2 | Very low | 44 Ų | 44 | 146.7 Ų | 146.7 | 45% | 0.454 | 78% | 0.779 | S | S | . | * | trans | -65 | 115.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | N286 H290 | N286-G288 VanDerWaalsContact C-N 3.29Å; N286-G288 PolarHBondContact O-N 3.25Å; G288-H290 PolarHBondContact O-CD2 3.12Å; G288-H290 VanDerWaalsContact O-CD2 3.26Å; G288-H290 PolarHBondContact O-N 3.36Å; G288-H290 VanDerWaalsContact O-N 3.14Å | ||
| 289 | M | 57.1 | Low | 49.4 | Very low | 143 Ų | 143 | 146.8 Ų | 146.8 | 70% | 0.704 | 78% | 0.782 | S | S | * | * | trans | -75.4 | 96.4 | 168.6 | -69.3 | -69.1 | 115.2 | 0 | 0 | 109 | Y287 Y291 | Y287-M289 PolarHBondContact O-N 3.27Å; M289-Y291 VanDerWaalsContact C-N 3.32Å; M289-Y291 HydrophobicContact CB-CD2 4.23Å; M289-Y291 HydrophobicContact CB-CE2 4.43Å; M289-Y291 PolarHBondContact O-N 3.37Å | ||
| 290 | H | 52.6 | Low | 49.7 | Very low | 180 Ų | 180 | 147.5 Ų | 147.5 | 83% | 0.833 | 79% | 0.786 | S | S | * | * | trans | -77.6 | 79.7 | 175 | -65.5 | -83 | 0 | 0 | 0 | 110.9 | G288 | G288-H290 PolarHBondContact O-CD2 3.12Å; G288-H290 VanDerWaalsContact O-CD2 3.26Å; G288-H290 PolarHBondContact O-N 3.36Å; G288-H290 VanDerWaalsContact O-N 3.14Å | ||
| 291 | Y | 53.9 | Low | 49.8 | Very low | 208 Ų | 208 | 143.2 Ų | 143.2 | 82% | 0.816 | 78% | 0.778 | S | S | * | * | trans | -80.5 | 124.8 | 160.8 | -82 | -91.4 | 0 | 0 | 0 | 109.1 | M289 A293 | M289-Y291 VanDerWaalsContact C-N 3.32Å; M289-Y291 HydrophobicContact CB-CD2 4.23Å; M289-Y291 HydrophobicContact CB-CE2 4.43Å; M289-Y291 PolarHBondContact O-N 3.37Å; Y291-A293 PolarHBondContact O-N 3.26Å; Y291-A293 VanDerWaalsContact O-N 3.16Å | ||
| 292 | C | 50.8 | Low | 50.2 | Low | 125 Ų | 125 | 142.9 Ų | 142.9 | 85% | 0.845 | 78% | 0.784 | S | S | * | * | trans | -62.8 | 115.3 | 175.5 | -75.1 | 0 | 0 | 0 | 0 | 110.3 | V294 | C292-V294 PolarHBondContact O-N 3.35Š| ||
| 293 | A | 49.2 | Very low | 50.2 | Low | 98 Ų | 98 | 143.9 Ų | 143.9 | 81% | 0.81 | 79% | 0.794 | S | S | * | * | trans | -74.6 | 110.8 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | Y291 | Y291-A293 PolarHBondContact O-N 3.26Å; Y291-A293 VanDerWaalsContact O-N 3.16Å | ||
| 294 | V | 53 | Low | 50 | Low | 133 Ų | 133 | 139 Ų | 139 | 81% | 0.806 | 79% | 0.791 | S | S | * | * | trans | -71.5 | 132.2 | 170 | -79.5 | 0 | 0 | 0 | 0 | 110.3 | C292 | C292-V294 PolarHBondContact O-N 3.35Š| ||
| 295 | P | 58.2 | Low | 50.1 | Low | 107 Ų | 107 | 140.2 Ų | 140.2 | 70% | 0.695 | 79% | 0.793 | S | S | * | * | trans | -76.9 | 143.4 | 175.5 | 31.3 | -33.8 | 0 | 0 | 0 | 110.8 | R297 | P295-R297 PolarHBondContact O-N 2.96Š| ||
| 296 | P | 54.1 | Low | 50.2 | Low | 134 Ų | 134 | 141.9 Ų | 141.9 | 87% | 0.87 | 81% | 0.805 | S | S | * | * | trans | -74.4 | 115.9 | 177.1 | 29.9 | -32.8 | 0 | 0 | 0 | 110.6 | ||||
| 297 | R | 56.4 | Low | 50.2 | Low | 240 Ų | 240 | 145.2 Ų | 145.2 | 91% | 0.906 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -99.4 | 122.2 | 161.8 | -83.6 | -167.2 | 167 | -163.7 | -3.3 | 109.7 | P295 | P295-R297 PolarHBondContact O-N 2.96Š|
| 298 | G | 47.7 | Very low | 49.7 | Very low | 72 Ų | 72 | 143.3 Ų | 143.3 | 74% | 0.742 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 147.7 | 166.6 | 0 | 0 | 0 | 0 | 0 | 111 | ||
| 299 | P | 48.8 | Very low | 49.1 | Very low | 135 Ų | 135 | 146.7 Ų | 146.7 | 88% | 0.877 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -89.4 | 137.1 | -178.6 | 33.9 | -32.4 | 0 | 0 | 0 | 112 | ||
| 300 | L | 47.9 | Very low | 48.8 | Very low | 173 Ų | 173 | 146.6 Ų | 146.6 | 91% | 0.906 | 83% | 0.83 | S | S | * | * | trans | -121.3 | 122 | 164.3 | -167.5 | 78.3 | 0 | 0 | 0 | 108.8 | ||||
| 301 | G | 41.6 | Very low | 48.2 | Very low | 62 Ų | 62 | 144.8 Ų | 144.8 | 64% | 0.639 | 83% | 0.826 | S | S | * | * | trans | 71.8 | 98.4 | 145.6 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 302 | Q | 49.3 | Very low | 48.1 | Very low | 202 Ų | 202 | 141 Ų | 141 | 94% | 0.944 | 83% | 0.83 | S | S | * | * | 67.2 | 127.2 | 125.3 | -62.9 | 174.2 | 3.1 | 0 | 0 | 122.7 | |||||
| 303 | G | 42.7 | Very low | 47.7 | Very low | 81 Ų | 81 | 142.8 Ų | 142.8 | 84% | 0.835 | 83% | 0.825 | S | S | * | * | trans | 90.4 | 145.6 | 151.5 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 304 | A | 43.5 | Very low | 47.3 | Very low | 95 Ų | 95 | 148.2 Ų | 148.2 | 79% | 0.785 | 83% | 0.831 | S | S | * | * | cis | -159 | 140.2 | -17.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 305 | M | 46.4 | Very low | 46.8 | Very low | 169 Ų | 169 | 146.5 Ų | 146.5 | 83% | 0.833 | 82% | 0.822 | S | S | * | * | trans | 27.5 | 125.1 | 145.6 | -51.2 | -65.8 | -103.2 | 0 | 0 | 121.1 | ||||
| 306 | F | 46.7 | Very low | 46.2 | Very low | 214 Ų | 214 | 152.8 Ų | 152.8 | 94% | 0.939 | 83% | 0.834 | S | S | * | * | -175 | 162.2 | 110.6 | -99.5 | -72.1 | 0 | 0 | 0 | 110.8 | |||||
| 307 | R | 46.2 | Very low | 45.9 | Very low | 232 Ų | 232 | 153.9 Ų | 153.9 | 88% | 0.875 | 83% | 0.832 | S | S | * | * | trans | -131.2 | 150.3 | -170.3 | -61.1 | -179.2 | 175.6 | -174.3 | 0.7 | 112.3 | ||||
| 308 | L | 45.2 | Very low | 45.7 | Very low | 163 Ų | 163 | 149.7 Ų | 149.7 | 85% | 0.853 | 83% | 0.827 | S | S | * | * | -176.9 | 143 | 120.1 | -143.6 | 67 | 0 | 0 | 0 | 113.1 | |||||
| 309 | P | 39.8 | Very low | 45.9 | Very low | 115 Ų | 115 | 155 Ų | 155 | 75% | 0.747 | 83% | 0.833 | S | S | * | * | trans | -119.8 | 172.1 | 170.3 | 41 | -30.7 | 0 | 0 | 0 | 114 | ||||
| 310 | T | 51.3 | Low | 45.9 | Very low | 141 Ų | 141 | 156.6 Ų | 156.6 | 87% | 0.865 | 83% | 0.833 | S | S | * | * | trans | -137.3 | 138.7 | 171.7 | 49.4 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 311 | D | 39.9 | Very low | 45.8 | Very low | 141 Ų | 141 | 159.6 Ų | 159.6 | 75% | 0.754 | 83% | 0.832 | S | S | * | * | trans | -68.2 | 158.5 | -177.4 | -68.8 | -93.4 | 0 | 0 | 0 | 116.8 | ||||
| 312 | S | 51.7 | Low | 45.8 | Very low | 128 Ų | 128 | 162 Ų | 162 | 90% | 0.895 | 84% | 0.839 | S | S | * | * | trans | -167.2 | 110.8 | 134.6 | -82.3 | 0 | 0 | 0 | 0 | 112 | ||||
| 313 | H | 43 | Very low | 45.5 | Very low | 163 Ų | 163 | 160.4 Ų | 160.4 | 76% | 0.755 | 83% | 0.832 | S | S | * | * | trans | -94.4 | 141.4 | 175 | -94 | -87.4 | 0 | 0 | 0 | 112 | ||||
| 314 | F | 40.5 | Very low | 45.3 | Very low | 213 Ų | 213 | 161.4 Ų | 161.4 | 93% | 0.934 | 83% | 0.826 | S | S | * | * | trans | -144.3 | 121.6 | 150 | -103.6 | -79.4 | 0 | 0 | 0 | 110.2 | ||||
| 315 | P | 42.7 | Very low | 45.2 | Very low | 96 Ų | 96 | 164.4 Ų | 164.4 | 62% | 0.623 | 83% | 0.828 | S | S | * | * | trans | -104.2 | 143.7 | -176.4 | 37.1 | -31.2 | 0 | 0 | 0 | 112.9 | ||||
| 316 | Y | 44.5 | Very low | 45.1 | Very low | 240 Ų | 240 | 162.3 Ų | 162.3 | 94% | 0.941 | 83% | 0.825 | S | S | * | * | trans | -179.4 | 109.2 | 142.5 | -91.5 | -61.2 | 0 | 0 | 0 | 109.1 | ||||
| 317 | D | 47.8 | Very low | 45.3 | Very low | 156 Ų | 156 | 159.7 Ų | 159.7 | 83% | 0.834 | 82% | 0.818 | S | S | * | * | trans | -150.1 | 149.9 | 149.3 | -144 | -23.4 | 0 | 0 | 0 | 111.4 | ||||
| 318 | L | 52.8 | Low | 45.1 | Very low | 152 Ų | 152 | 157.3 Ų | 157.3 | 80% | 0.796 | 82% | 0.816 | S | S | * | * | trans | -112.2 | 93.8 | -159.8 | -174.2 | 72.5 | 0 | 0 | 0 | 110.9 | L320 | L318-L320 PolarHBondContact O-N 3.04Š| ||
| 319 | H | 51.1 | Low | 45.5 | Very low | 185 Ų | 185 | 157.4 Ų | 157.4 | 86% | 0.856 | 82% | 0.818 | S | S | * | * | trans | -73.3 | 99.6 | 179.8 | -70.3 | 164 | 0 | 0 | 0 | 113 | R321 | H319-R321 PolarHBondContact O-N 3.26Š| ||
| 320 | L | 49.7 | Very low | 46.2 | Very low | 168 Ų | 168 | 160.2 Ų | 160.2 | 88% | 0.88 | 82% | 0.821 | S | S | * | * | trans | -78.1 | 104.9 | 169.6 | -149.9 | 75.6 | 0 | 0 | 0 | 110.5 | L318 S322 | L318-L320 PolarHBondContact O-N 3.04Å; L320-S322 PolarHBondContact O-N 3.19Å | ||
| 321 | R | 44.4 | Very low | 46.4 | Very low | 235 Ų | 235 | 161.1 Ų | 161.1 | 89% | 0.887 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 119.7 | -179.3 | 174.2 | 176.1 | 172.7 | 158.2 | -4.1 | 111.5 | H319 Q323 | H319-R321 PolarHBondContact O-N 3.26Å; R321-Q323 PolarHBondContact O-N 2.98Å |
| 322 | S | 42.8 | Very low | 46.9 | Very low | 113 Ų | 113 | 162.2 Ų | 162.2 | 79% | 0.79 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 126.4 | 168 | -178.9 | 0 | 0 | 0 | 0 | 110.5 | L320 | L320-S322 PolarHBondContact O-N 3.19Š|
| 323 | Q | 42.2 | Very low | 47.2 | Very low | 168 Ų | 168 | 160.6 Ų | 160.6 | 79% | 0.785 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -98.7 | 125.6 | 173.6 | -171.3 | 176.1 | 52.6 | 0 | 0 | 108.7 | R321 L325 | R321-Q323 PolarHBondContact O-N 2.98Å; Q323-L325 PolarHBondContact O-N 2.76Å |
| 324 | S | 39.7 | Very low | 48.1 | Very low | 103 Ų | 103 | 158.3 Ų | 158.3 | 72% | 0.72 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 120.9 | 176.5 | 49.2 | 0 | 0 | 0 | 0 | 111.3 | ||
| 325 | L | 40.6 | Very low | 48.8 | Very low | 158 Ų | 158 | 157.2 Ų | 157.2 | 83% | 0.827 | 81% | 0.812 | S | S | * | * | trans | -103.8 | 104.7 | 170.2 | -91.2 | 158 | 0 | 0 | 0 | 109.8 | Q323 | Q323-L325 PolarHBondContact O-N 2.76Š| ||
| 326 | T | 44.3 | Very low | 49.4 | Very low | 124 Ų | 124 | 162 Ų | 162 | 76% | 0.761 | 83% | 0.826 | S | S | * | * | trans | -104.6 | 73.9 | 174.4 | 50.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 327 | M | 50.4 | Low | 49.8 | Very low | 160 Ų | 160 | 162.2 Ų | 162.2 | 79% | 0.788 | 84% | 0.843 | S | S | * | * | trans | -153.8 | 76.3 | 177.5 | -75.3 | -60 | 175.7 | 0 | 0 | 110.9 | ||||
| 328 | Q | 43.6 | Very low | 49.9 | Very low | 181 Ų | 181 | 162.5 Ų | 162.5 | 85% | 0.846 | 84% | 0.844 | S | S | * | * | trans | -152.9 | 21.2 | 173.4 | -156.5 | 118.4 | 47.9 | 0 | 0 | 115.7 | ||||
| 329 | D | 52.7 | Low | 49.8 | Very low | 166 Ų | 166 | 163.1 Ų | 163.1 | 89% | 0.888 | 85% | 0.846 | S | S | * | * | S | Bend | trans | -103.5 | -3.6 | -176.9 | -80.7 | -59.2 | 0 | 0 | 0 | 115.5 | ||
| 330 | E | 54.8 | Low | 49.7 | Very low | 174 Ų | 174 | 161.8 Ų | 161.8 | 81% | 0.813 | 85% | 0.846 | S | S | * | * | S | Bend | trans | -104.8 | 4.8 | -170.5 | -77.5 | -174.2 | 112.3 | 0 | 0 | 116.7 | ||
| 331 | L | 55.3 | Low | 49.7 | Very low | 159 Ų | 159 | 161.5 Ų | 161.5 | 83% | 0.832 | 84% | 0.844 | S | S | * | * | S | Bend | trans | -101.1 | 1 | -174.2 | -71.7 | 177.6 | 0 | 0 | 0 | 116.6 | ||
| 332 | N | 50.5 | Low | 50 | Low | 165 Ų | 165 | 156.9 Ų | 156.9 | 88% | 0.882 | 84% | 0.841 | S | S | * | * | S | Bend | trans | -107.6 | 11 | -179.4 | -75.7 | -15.6 | 0 | 0 | 0 | 114.5 | ||
| 333 | A | 58.5 | Low | 50.5 | Low | 94 Ų | 94 | 159.8 Ų | 159.8 | 78% | 0.777 | 84% | 0.844 | S | S | * | * | trans | -92.2 | 10 | -173.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 334 | V | 61.3 | Low | 51.1 | Low | 115 Ų | 115 | 159.2 Ų | 159.2 | 70% | 0.697 | 85% | 0.848 | S | S | * | * | trans | -123 | 132.1 | -178.8 | -178.3 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 335 | F | 55.9 | Low | 52 | Low | 189 Ų | 189 | 163.5 Ų | 163.5 | 83% | 0.829 | 86% | 0.858 | S | S | * | * | trans | 104.3 | 53.2 | -176 | -58.3 | -63 | 0 | 0 | 0 | 117.3 | ||||
| 336 | H | 54.8 | Low | 52.9 | Low | 196 Ų | 196 | 164 Ų | 164 | 91% | 0.907 | 86% | 0.861 | S | S | * | * | trans | -149.6 | 107.7 | 147 | -93 | -66.8 | 0 | 0 | 0 | 111.2 | ||||
| 337 | N | 53.1 | Low | 53.7 | Low | 245 Ų | 245 | 167.6 Ų | 167.6 | 100% | 1.31 | 87% | 0.87 | S | S | * | * | trans | -155.3 | 0 | 157.3 | -114 | -94.5 | 0 | 0 | 0 | 107.1 |
Retrieved 337 of 337 residues in 137 ms
(Link to these results)