| 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 | 37.2 | Very low | 36.2 | Very low | 247 Ų | 247 | 143.9 Ų | 143.9 | 100% | 1.217 | 84% | 0.843 | S | S | * | * | 0 | 111.3 | 0 | -67.5 | -54.2 | -172.5 | 0 | 0 | 108.1 | |||||
| 2 | G | 29.9 | Very low | 36.3 | Very low | 77 Ų | 77 | 143.9 Ų | 143.9 | 79% | 0.794 | 84% | 0.835 | S | S | * | * | trans | -135.9 | 121.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 3 | I | 33.6 | Very low | 36.3 | Very low | 174 Ų | 174 | 144.5 Ų | 144.5 | 89% | 0.892 | 83% | 0.832 | S | S | * | * | trans | -114 | 109.1 | 171.7 | -61.8 | 174.6 | 0 | 0 | 0 | 105.7 | ||||
| 4 | V | 36.3 | Very low | 36.3 | Very low | 143 Ų | 143 | 145.4 Ų | 145.4 | 87% | 0.867 | 83% | 0.831 | S | S | * | * | trans | -103.3 | 121.5 | 173.1 | 179.5 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 5 | C | 33.3 | Very low | 36.2 | Very low | 99 Ų | 99 | 142.4 Ų | 142.4 | 67% | 0.669 | 82% | 0.823 | S | S | * | * | trans | -81 | 126.6 | -173.9 | -168.7 | 0 | 0 | 0 | 0 | 111.4 | Q7 | C5-Q7 PolarHBondContact O-N 2.93Š| ||
| 6 | A | 38.3 | Very low | 36.4 | Very low | 105 Ų | 105 | 142.4 Ų | 142.4 | 87% | 0.868 | 82% | 0.817 | S | S | * | * | trans | -88.2 | 81.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 7 | Q | 39.3 | Very low | 36.3 | Very low | 173 Ų | 173 | 144.3 Ų | 144.3 | 81% | 0.808 | 82% | 0.819 | S | S | * | * | trans | -127.3 | 69 | 171.9 | -76.3 | -172.7 | -24.2 | 0 | 0 | 111.6 | C5 | C5-Q7 PolarHBondContact O-N 2.93Š| ||
| 8 | C | 36.8 | Very low | 36.2 | Very low | 124 Ų | 124 | 150.2 Ų | 150.2 | 84% | 0.838 | 83% | 0.826 | S | S | * | * | trans | -146.7 | 6.4 | 177.4 | -104.4 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 9 | S | 35.5 | Very low | 35.9 | Very low | 104 Ų | 104 | 147.3 Ų | 147.3 | 73% | 0.727 | 83% | 0.825 | S | S | * | * | S | Bend | trans | -103.3 | -7.2 | -171.2 | -47.8 | 0 | 0 | 0 | 0 | 116.1 | ||
| 10 | F | 36.4 | Very low | 35.7 | Very low | 189 Ų | 189 | 149.3 Ų | 149.3 | 83% | 0.829 | 83% | 0.827 | S | S | * | * | S | Bend | trans | -92.5 | -13.4 | -170.5 | -98.2 | -86.7 | 0 | 0 | 0 | 116 | ||
| 11 | I | 41.6 | Very low | 36.2 | Very low | 148 Ų | 148 | 147 Ų | 147 | 76% | 0.759 | 82% | 0.819 | S | S | * | * | S | Bend | trans | -89.1 | -23.7 | -172.4 | -64 | 179.7 | 0 | 0 | 0 | 112.8 | ||
| 12 | L | 37.3 | Very low | 36.5 | Very low | 144 Ų | 144 | 140.7 Ų | 140.7 | 75% | 0.754 | 80% | 0.796 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -15.2 | -175.3 | -82.8 | 163.6 | 0 | 0 | 0 | 115.4 | ||
| 13 | L | 36.7 | Very low | 36.5 | Very low | 152 Ų | 152 | 144.7 Ų | 144.7 | 80% | 0.796 | 79% | 0.794 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.8 | -11.5 | -175.5 | -105 | 156.9 | 0 | 0 | 0 | 114.7 | ||
| 14 | L | 35.9 | Very low | 36.2 | Very low | 156 Ų | 156 | 146.9 Ų | 146.9 | 82% | 0.817 | 80% | 0.797 | S | S | * | * | S | Bend | trans | -89.3 | -8.3 | -177.3 | -95.8 | 151.4 | 0 | 0 | 0 | 114.4 | ||
| 15 | S | 35.6 | Very low | 35.9 | Very low | 101 Ų | 101 | 147.3 Ų | 147.3 | 71% | 0.706 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -96.8 | -2.3 | -167.6 | -54 | 0 | 0 | 0 | 0 | 116 | ||
| 16 | I | 38.1 | Very low | 35.6 | Very low | 143 Ų | 143 | 152.6 Ų | 152.6 | 73% | 0.733 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -106.8 | -18.5 | -169.2 | -63.4 | 178.7 | 0 | 0 | 0 | 113.9 | R18 | I16-R18 PolarHBondContact O-N 2.84Š|
| 17 | M | 35.2 | Very low | 35 | Very low | 174 Ų | 174 | 153 Ų | 153 | 86% | 0.857 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -95.8 | 37.9 | -169.6 | -68.3 | -59.5 | -61.8 | 0 | 0 | 115.8 | ||
| 18 | R | 35 | Very low | 34.6 | Very low | 250 Ų | 250 | 150.6 Ų | 150.6 | 94% | 0.943 | 80% | 0.801 | S | S | * | * | trans | -140.5 | 80.5 | 174.1 | -103.7 | -174.4 | 173.3 | 166.9 | -2.1 | 113.4 | I16 | I16-R18 PolarHBondContact O-N 2.84Š| ||
| 19 | A | 30.6 | Very low | 34.1 | Very low | 96 Ų | 96 | 152.9 Ų | 152.9 | 79% | 0.793 | 80% | 0.804 | S | S | * | * | trans | -160.1 | 138.9 | 156 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 20 | H | 30.7 | Very low | 33.7 | Very low | 187 Ų | 187 | 154 Ų | 154 | 87% | 0.866 | 81% | 0.811 | S | S | * | * | trans | -149.6 | 166.5 | 170.9 | -96.3 | 11.5 | 0 | 0 | 0 | 107.8 | ||||
| 21 | P | 47.9 | Very low | 33.3 | Very low | 102 Ų | 102 | 149.8 Ų | 149.8 | 66% | 0.662 | 81% | 0.805 | S | S | * | * | cis | -105.8 | -89.3 | -14.3 | 16.6 | 6.4 | 0 | 0 | 0 | 111.6 | ||||
| 22 | P | 42.9 | Very low | 32.6 | Very low | 113 Ų | 113 | 153.7 Ų | 153.7 | 73% | 0.734 | 81% | 0.811 | S | S | * | * | cis | -99.2 | -126.9 | -8.7 | 40.8 | -32.7 | 0 | 0 | 0 | 113.3 | ||||
| 23 | H | 28.8 | Very low | 32 | Very low | 162 Ų | 162 | 158 Ų | 158 | 75% | 0.75 | 82% | 0.817 | S | S | * | * | trans | -137 | 152.6 | -168.5 | -59.7 | -97.3 | 0 | 0 | 0 | 112.1 | ||||
| 24 | F | 28.1 | Very low | 31.7 | Very low | 219 Ų | 219 | 154.7 Ų | 154.7 | 96% | 0.961 | 81% | 0.811 | S | S | * | * | trans | -153.5 | 152.4 | 134.2 | -96.2 | -66.6 | 0 | 0 | 0 | 111.5 | ||||
| 25 | L | 29.9 | Very low | 31.3 | Very low | 153 Ų | 153 | 156.5 Ų | 156.5 | 80% | 0.801 | 82% | 0.816 | S | S | * | * | trans | -88.3 | 152.4 | -174.5 | -66.8 | 145.9 | 0 | 0 | 0 | 111.5 | ||||
| 26 | F | 26.9 | Very low | 31.2 | Very low | 209 Ų | 209 | 156.9 Ų | 156.9 | 92% | 0.917 | 82% | 0.818 | S | S | * | * | 178.1 | 130.9 | 120.2 | -100.6 | -70.5 | 0 | 0 | 0 | 111 | |||||
| 27 | C | 25.6 | Very low | 31.3 | Very low | 115 Ų | 115 | 154.5 Ų | 154.5 | 78% | 0.777 | 81% | 0.812 | S | S | * | * | trans | -92.5 | 161.5 | 157.9 | -59.1 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 28 | P | 30.3 | Very low | 31 | Very low | 122 Ų | 122 | 156.8 Ų | 156.8 | 79% | 0.792 | 81% | 0.813 | S | S | * | * | -138.7 | 168 | 101.4 | 37 | -25.5 | 0 | 0 | 0 | 115 | |||||
| 29 | L | 27.5 | Very low | 31 | Very low | 172 Ų | 172 | 154 Ų | 154 | 90% | 0.901 | 81% | 0.807 | S | S | * | * | trans | -67.8 | 153.9 | 174.4 | -54.7 | 98.2 | 0 | 0 | 0 | 112.2 | ||||
| 30 | S | 26.1 | Very low | 31.1 | Very low | 127 Ų | 127 | 154.8 Ų | 154.8 | 89% | 0.888 | 81% | 0.805 | S | S | * | * | -158.2 | 154.1 | 125.1 | -162.6 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 31 | S | 28 | Very low | 31.1 | Very low | 101 Ų | 101 | 152.4 Ų | 152.4 | 71% | 0.706 | 80% | 0.803 | S | S | * | * | trans | -107.8 | 139.7 | -176.8 | 166.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 32 | R | 27.1 | Very low | 30.2 | Very low | 230 Ų | 230 | 156.2 Ų | 156.2 | 87% | 0.868 | 81% | 0.811 | S | S | * | * | trans | 171.7 | 124.1 | 136.2 | -94 | 162.1 | -176.2 | -154.2 | 2.2 | 108.3 | ||||
| 33 | R | 26.2 | Very low | 29.6 | Very low | 234 Ų | 234 | 158.8 Ų | 158.8 | 88% | 0.883 | 82% | 0.818 | S | S | * | * | 90.9 | 117.4 | 69.2 | -164.6 | -177.9 | -157 | -178.5 | 7.4 | 110.8 | |||||
| 34 | A | 29.3 | Very low | 29.5 | Very low | 83 Ų | 83 | 154.2 Ų | 154.2 | 69% | 0.686 | 82% | 0.815 | S | S | * | * | trans | -5.3 | 139.9 | 169.5 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 35 | E | 27.8 | Very low | 29.5 | Very low | 194 Ų | 194 | 152.5 Ų | 152.5 | 91% | 0.907 | 82% | 0.815 | S | S | * | * | -166.4 | 141.6 | 110.9 | -102.4 | 156.9 | -154.8 | 0 | 0 | 111.5 | |||||
| 36 | S | 34.1 | Very low | 29.3 | Very low | 109 Ų | 109 | 148.5 Ų | 148.5 | 76% | 0.762 | 81% | 0.81 | S | S | * | * | trans | -103.8 | 142.8 | 154.6 | 72.9 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 37 | P | 39 | Very low | 29.4 | Very low | 93 Ų | 93 | 147.1 Ų | 147.1 | 60% | 0.604 | 81% | 0.812 | S | S | * | * | -153.8 | 172.7 | 109.2 | 28.1 | -5.5 | 0 | 0 | 0 | 117 | |||||
| 38 | Y | 28.7 | Very low | 29.5 | Very low | 221 Ų | 221 | 144.8 Ų | 144.8 | 87% | 0.867 | 81% | 0.807 | S | S | * | * | trans | 107 | 133.4 | 152.7 | -66.8 | -67.4 | 0 | 0 | 0 | 121.5 | ||||
| 39 | K | 35.4 | Very low | 30 | Very low | 191 Ų | 191 | 144.8 Ų | 144.8 | 83% | 0.83 | 81% | 0.807 | S | S | * | * | trans | -83.5 | 164.7 | 173 | -50.9 | 167 | 179 | 175.7 | 0 | 109.6 | ||||
| 40 | P | 33.8 | Very low | 30.2 | Very low | 114 Ų | 114 | 143.6 Ų | 143.6 | 74% | 0.74 | 81% | 0.807 | S | S | * | * | trans | -112.5 | 146.4 | 146.2 | 33.9 | -26.4 | 0 | 0 | 0 | 112.7 | ||||
| 41 | V | 29.3 | Very low | 30.4 | Very low | 136 Ų | 136 | 145 Ų | 145 | 82% | 0.824 | 80% | 0.804 | S | S | * | * | trans | -87.2 | 136.4 | 168.4 | 171.1 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 42 | H | 29 | Very low | 30.6 | Very low | 182 Ų | 182 | 150 Ų | 150 | 84% | 0.843 | 81% | 0.813 | S | S | * | * | trans | -97.1 | 114.3 | 171.2 | -90.2 | -73.2 | 0 | 0 | 0 | 111.3 | ||||
| 43 | L | 31 | Very low | 30.9 | Very low | 168 Ų | 168 | 146.2 Ų | 146.2 | 88% | 0.88 | 82% | 0.816 | S | S | * | * | trans | -86 | 134.6 | 152.7 | -101.4 | 152.9 | 0 | 0 | 0 | 107.8 | ||||
| 44 | G | 26.7 | Very low | 31.1 | Very low | 66 Ų | 66 | 138.7 Ų | 138.7 | 68% | 0.68 | 80% | 0.803 | S | S | * | * | trans | -100.9 | 152.2 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 45 | L | 28.4 | Very low | 31.3 | Very low | 183 Ų | 183 | 139.9 Ų | 139.9 | 96% | 0.958 | 81% | 0.813 | S | S | * | * | trans | -154.7 | 122.2 | 154 | -109.7 | 144 | 0 | 0 | 0 | 106.8 | ||||
| 46 | G | 25 | Very low | 31.6 | Very low | 68 Ų | 68 | 137 Ų | 137 | 70% | 0.701 | 80% | 0.802 | S | S | * | * | trans | -104.5 | 161.6 | -174.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 47 | L | 29.5 | Very low | 31.6 | Very low | 181 Ų | 181 | 136.1 Ų | 136.1 | 95% | 0.948 | 80% | 0.802 | S | S | * | * | trans | -166.6 | 139.3 | 156.6 | -101.1 | 156.7 | 0 | 0 | 0 | 106.6 | ||||
| 48 | G | 26.8 | Very low | 31.2 | Very low | 65 Ų | 65 | 138.9 Ų | 138.9 | 67% | 0.67 | 81% | 0.809 | S | S | * | * | trans | -142.5 | -157.4 | 168.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 49 | P | 42.3 | Very low | 31.5 | Very low | 123 Ų | 123 | 132 Ų | 132 | 80% | 0.799 | 80% | 0.797 | S | S | * | * | cis | -120.5 | 167.4 | -33.7 | 37.8 | -26.7 | 0 | 0 | 0 | 110.7 | ||||
| 50 | T | 31.7 | Very low | 31.6 | Very low | 146 Ų | 146 | 133.4 Ų | 133.4 | 90% | 0.896 | 80% | 0.798 | S | S | * | * | trans | -160.1 | 131.9 | 155.5 | -0.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 51 | D | 29.5 | Very low | 31.9 | Very low | 156 Ų | 156 | 134.7 Ų | 134.7 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | trans | -72.8 | 137.2 | -179.7 | -62.7 | -65.2 | 0 | 0 | 0 | 112.7 | ||||
| 52 | K | 31.8 | Very low | 32.5 | Very low | 206 Ų | 206 | 134.3 Ų | 134.3 | 90% | 0.896 | 79% | 0.789 | S | S | * | * | trans | -162.2 | 114.5 | 143.1 | -108.7 | 157.2 | -169.5 | 178.5 | 0 | 110.2 | A54 | K52-A54 PolarHBondContact O-N 2.77Š| ||
| 53 | V | 34.5 | Very low | 32.9 | Very low | 152 Ų | 152 | 132.5 Ų | 132.5 | 92% | 0.921 | 79% | 0.785 | S | S | * | * | trans | -72.3 | 111.7 | 177.8 | 177.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 54 | A | 29.7 | Very low | 33.5 | Very low | 76 Ų | 76 | 131.7 Ų | 131.7 | 63% | 0.628 | 78% | 0.781 | S | S | * | * | trans | -125 | 124.5 | 162 | 0 | 0 | 0 | 0 | 0 | 108 | K52 I56 | K52-A54 PolarHBondContact O-N 2.77Å; A54-I56 VanDerWaalsContact C-N 3.29Å; A54-I56 PolarHBondContact O-N 3.05Å | ||
| 55 | A | 33.3 | Very low | 34.4 | Very low | 108 Ų | 108 | 134.3 Ų | 134.3 | 89% | 0.893 | 78% | 0.783 | S | S | * | * | trans | -73.5 | 84.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | A57 | A55-A57 PolarHBondContact O-N 2.85Å; A55-A57 VanDerWaalsContact O-N 3.16Å | ||
| 56 | I | 33.6 | Very low | 34.9 | Very low | 132 Ų | 132 | 131 Ų | 131 | 68% | 0.677 | 77% | 0.773 | S | S | * | * | trans | -71.6 | 107.8 | 175 | -63.2 | 174.4 | 0 | 0 | 0 | 107.9 | A54 M58 | A54-I56 VanDerWaalsContact C-N 3.29Å; A54-I56 PolarHBondContact O-N 3.05Å; I56-M58 HydrophobicContact CG2-SD 4.14Å; I56-M58 PolarHBondContact O-N 3.14Å | ||
| 57 | A | 34.6 | Very low | 35.5 | Very low | 92 Ų | 92 | 138.6 Ų | 138.6 | 76% | 0.76 | 78% | 0.781 | S | S | * | * | trans | -61.4 | 108.5 | 165.1 | 0 | 0 | 0 | 0 | 0 | 108.1 | A55 A59 | A55-A57 PolarHBondContact O-N 2.85Å; A55-A57 VanDerWaalsContact O-N 3.16Å; A57-A59 PolarHBondContact O-N 3.24Å | ||
| 58 | M | 30.2 | Very low | 36.3 | Very low | 151 Ų | 151 | 137.5 Ų | 137.5 | 74% | 0.744 | 78% | 0.776 | S | S | * | * | trans | -74 | 69.1 | -175 | -70.9 | -71 | -74.5 | 0 | 0 | 111.7 | I56 R60 | I56-M58 HydrophobicContact CG2-SD 4.14Å; I56-M58 PolarHBondContact O-N 3.14Å; M58-R60 PolarHBondContact O-N 3.01Å; M58-R60 VanDerWaalsContact O-N 3.08Å | ||
| 59 | A | 34.9 | Very low | 36.9 | Very low | 75 Ų | 75 | 139.6 Ų | 139.6 | 62% | 0.62 | 77% | 0.772 | S | S | * | * | trans | -61.8 | 106.1 | 157.9 | 0 | 0 | 0 | 0 | 0 | 107.4 | A57 I61 | A57-A59 PolarHBondContact O-N 3.24Å; A59-I61 PolarHBondContact O-N 2.98Å | ||
| 60 | R | 37.4 | Very low | 37.2 | Very low | 222 Ų | 222 | 137.9 Ų | 137.9 | 84% | 0.838 | 78% | 0.776 | S | S | * | * | trans | -72.7 | 93.8 | 176.4 | -74 | -170.1 | 173 | -145.3 | -2.6 | 109.1 | M58 I62 | M58-R60 PolarHBondContact O-N 3.01Å; M58-R60 VanDerWaalsContact O-N 3.08Å; R60-I62 PolarHBondContact O-N 3.11Å | ||
| 61 | I | 39.8 | Very low | 37.7 | Very low | 141 Ų | 141 | 135.5 Ų | 135.5 | 72% | 0.723 | 77% | 0.766 | S | S | * | * | trans | -61.1 | 121.8 | 159.9 | -58.4 | 174.7 | 0 | 0 | 0 | 106.2 | A59 | A59-I61 PolarHBondContact O-N 2.98Š| ||
| 62 | I | 42.2 | Very low | 38.2 | Very low | 128 Ų | 128 | 134.3 Ų | 134.3 | 66% | 0.656 | 76% | 0.764 | S | S | * | * | trans | -91.7 | 107.1 | 170 | -60.3 | 175.5 | 0 | 0 | 0 | 105.3 | R60 L64 | R60-I62 PolarHBondContact O-N 3.11Å; I62-L64 VanDerWaalsContact C-N 3.35Å; I62-L64 HydrophobicContact CG2-CD2 4.17Å; I62-L64 HydrophobicContact CG2-CG 4.47Å; I62-L64 PolarHBondContact O-N 2.9Å | ||
| 63 | D | 38.5 | Very low | 38.6 | Very low | 144 Ų | 144 | 134.2 Ų | 134.2 | 77% | 0.77 | 77% | 0.766 | S | S | * | * | trans | -67.1 | 99.4 | 166.1 | -74.4 | -28.4 | 0 | 0 | 0 | 107.9 | V65 | D63-V65 PolarHBondContact O-N 2.88Å; D63-V65 VanDerWaalsContact O-N 3.11Å | ||
| 64 | L | 43.8 | Very low | 38.8 | Very low | 151 Ų | 151 | 133.1 Ų | 133.1 | 79% | 0.791 | 76% | 0.76 | S | S | * | * | trans | -70.1 | 102.6 | 165 | -67.6 | 173.8 | 0 | 0 | 0 | 106.9 | I62 P66 | I62-L64 VanDerWaalsContact C-N 3.35Å; I62-L64 HydrophobicContact CG2-CD2 4.17Å; I62-L64 HydrophobicContact CG2-CG 4.47Å; I62-L64 PolarHBondContact O-N 2.9Å; L64-P66 WeakPolarHBondContact O-CD 3.44Å | ||
| 65 | V | 44.6 | Very low | 39.3 | Very low | 120 Ų | 120 | 138.8 Ų | 138.8 | 73% | 0.727 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 122.2 | 170.2 | 176.2 | 0 | 0 | 0 | 0 | 108 | D63 W67 | D63-V65 PolarHBondContact O-N 2.88Å; D63-V65 VanDerWaalsContact O-N 3.11Å; V65-W67 PolarHBondContact O-N 3.31Å |
| 66 | P | 40.2 | Very low | 39.9 | Very low | 115 Ų | 115 | 137.8 Ų | 137.8 | 75% | 0.747 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 124.5 | 178.4 | -21.7 | 32.9 | 0 | 0 | 0 | 110.1 | L64 | L64-P66 WeakPolarHBondContact O-CD 3.44Š|
| 67 | W | 37.2 | Very low | 40 | Very low | 227 Ų | 227 | 135.4 Ų | 135.4 | 86% | 0.86 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 124.7 | 157.8 | -93 | 77.1 | 0 | 0 | 0 | 107.6 | V65 D69 | V65-W67 PolarHBondContact O-N 3.31Å; W67-D69 VanDerWaalsContact C-N 3.28Å; W67-D69 PolarHBondContact O-N 2.85Å |
| 68 | D | 44.6 | Very low | 40.5 | Very low | 157 Ų | 157 | 136 Ų | 136 | 84% | 0.84 | 75% | 0.749 | S | S | * | * | trans | -88.4 | 65.8 | -167.9 | -160.9 | 15.6 | 0 | 0 | 0 | 111.2 | ||||
| 69 | D | 40.3 | Very low | 41.5 | Very low | 110 Ų | 110 | 133.1 Ų | 133.1 | 59% | 0.588 | 75% | 0.749 | S | S | * | * | trans | -111 | 44.8 | -172.2 | -71.2 | 60 | 0 | 0 | 0 | 111.7 | W67 S71 | W67-D69 VanDerWaalsContact C-N 3.28Å; W67-D69 PolarHBondContact O-N 2.85Å; D69-S71 VanDerWaalsContact C-N 3.26Å; D69-S71 WeakPolarHBondContact O-CB 3.42Å; D69-S71 PolarHBondContact O-N 3.06Å; D69-S71 PolarHBondContact O-OG 3.31Å | ||
| 70 | G | 48.9 | Very low | 42.2 | Very low | 86 Ų | 86 | 135.8 Ų | 135.8 | 89% | 0.887 | 75% | 0.752 | S | S | * | * | trans | 49.6 | 21.7 | 148.7 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 71 | S | 41.8 | Very low | 42.6 | Very low | 97 Ų | 97 | 132.5 Ų | 132.5 | 68% | 0.678 | 75% | 0.75 | S | S | * | * | trans | -133 | 126.7 | -170.7 | 52.3 | 0 | 0 | 0 | 0 | 113.5 | D69 | D69-S71 VanDerWaalsContact C-N 3.26Å; D69-S71 WeakPolarHBondContact O-CB 3.42Å; D69-S71 PolarHBondContact O-N 3.06Å; D69-S71 PolarHBondContact O-OG 3.31Å | ||
| 72 | T | 40.6 | Very low | 43.1 | Very low | 131 Ų | 131 | 132.3 Ų | 132.3 | 80% | 0.804 | 75% | 0.75 | S | S | * | * | trans | 11.2 | 110.1 | 167.9 | 39.1 | 0 | 0 | 0 | 0 | 118.2 | V74 | T72-V74 PolarHBondContact O-N 3.08Š| ||
| 73 | H | 39.1 | Very low | 43.7 | Very low | 203 Ų | 203 | 131.8 Ų | 131.8 | 94% | 0.94 | 75% | 0.754 | S | S | * | * | trans | -49 | 100.4 | 171.5 | -65.3 | -78.3 | 0 | 0 | 0 | 113.7 | ||||
| 74 | V | 39.1 | Very low | 44.7 | Very low | 129 Ų | 129 | 131.2 Ų | 131.2 | 78% | 0.782 | 76% | 0.756 | S | S | * | * | trans | -90.4 | 112.4 | 154.9 | 178.7 | 0 | 0 | 0 | 0 | 107 | T72 A76 | T72-V74 PolarHBondContact O-N 3.08Å; V74-A76 VanDerWaalsContact C-N 3.26Å; V74-A76 PolarHBondContact O-N 2.96Å | ||
| 75 | Y | 40.1 | Very low | 45.4 | Very low | 196 Ų | 196 | 132.6 Ų | 132.6 | 77% | 0.769 | 76% | 0.758 | S | S | * | * | trans | -70.1 | 85 | 173.7 | -174.9 | -95.2 | 0 | 0 | 0 | 109.4 | S77 | Y75-S77 PolarHBondContact O-N 2.92Å; Y75-S77 VanDerWaalsContact O-N 3.14Å | ||
| 76 | A | 45.4 | Very low | 46.3 | Very low | 86 Ų | 86 | 135.3 Ų | 135.3 | 71% | 0.711 | 76% | 0.756 | S | S | * | * | trans | -74 | 98.2 | 170.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | V74 | V74-A76 VanDerWaalsContact C-N 3.26Å; V74-A76 PolarHBondContact O-N 2.96Å | ||
| 77 | S | 35.8 | Very low | 47.8 | Very low | 83 Ų | 83 | 140 Ų | 140 | 58% | 0.58 | 76% | 0.758 | S | S | * | * | trans | -51 | 134.6 | 171.9 | -63.7 | 0 | 0 | 0 | 0 | 110.1 | Y75 A79 | Y75-S77 PolarHBondContact O-N 2.92Å; Y75-S77 VanDerWaalsContact O-N 3.14Å; S77-A79 PolarHBondContact O-N 2.91Å | ||
| 78 | P | 45.5 | Very low | 49.6 | Very low | 104 Ų | 104 | 132.8 Ų | 132.8 | 68% | 0.675 | 73% | 0.731 | S | S | * | * | trans | -60.4 | 115.1 | -179.4 | 23.7 | -33 | 0 | 0 | 0 | 109.6 | I80 | P78-I80 PolarHBondContact O-N 3.05Š| ||
| 79 | A | 51.2 | Low | 51.2 | Low | 90 Ų | 90 | 128.2 Ų | 128.2 | 74% | 0.744 | 71% | 0.706 | S | S | * | * | trans | -69.2 | 95 | 177.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | S77 L81 | S77-A79 PolarHBondContact O-N 2.91Å; A79-L81 VanDerWaalsContact C-N 3.33Å; A79-L81 PolarHBondContact O-N 2.78Å | ||
| 80 | I | 49.6 | Very low | 53.1 | Low | 132 Ų | 132 | 128.3 Ų | 128.3 | 68% | 0.677 | 70% | 0.703 | S | S | * | * | trans | -64.5 | 98.5 | 169.8 | -57.9 | 175.2 | 0 | 0 | 0 | 106.9 | P78 L82 | P78-I80 PolarHBondContact O-N 3.05Å; I80-L82 HydrophobicContact CG2-CD2 4.2Å; I80-L82 PolarHBondContact O-N 3.16Å | ||
| 81 | L | 46 | Very low | 54.5 | Low | 152 Ų | 152 | 127.4 Ų | 127.4 | 80% | 0.796 | 68% | 0.678 | S | S | * | * | trans | -65.8 | 91.7 | 165.7 | -69.1 | 177.9 | 0 | 0 | 0 | 107.5 | A79 | A79-L81 VanDerWaalsContact C-N 3.33Å; A79-L81 PolarHBondContact O-N 2.78Å | ||
| 82 | L | 50.8 | Low | 55.7 | Low | 138 Ų | 138 | 128.4 Ų | 128.4 | 72% | 0.723 | 69% | 0.692 | S | S | * | * | trans | -50.8 | 127.4 | 166.5 | -65.6 | 178 | 0 | 0 | 0 | 107.4 | I80 V84 | I80-L82 HydrophobicContact CG2-CD2 4.2Å; I80-L82 PolarHBondContact O-N 3.16Å; L82-V84 PolarHBondContact O-N 2.9Å | ||
| 83 | P | 54.4 | Low | 57 | Low | 116 Ų | 116 | 125.4 Ų | 125.4 | 75% | 0.753 | 69% | 0.687 | S | S | * | * | trans | -52.9 | 121.7 | 177.7 | -25.6 | 34 | 0 | 0 | 0 | 109 | E85 | P83-E85 PolarHBondContact O-N 3.08Š| ||
| 84 | V | 60.4 | Low | 58.3 | Low | 133 Ų | 133 | 117.1 Ų | 117.1 | 81% | 0.806 | 65% | 0.651 | S | S | * | * | trans | -58.2 | 112 | 176 | 175.3 | 0 | 0 | 0 | 0 | 107.2 | L82 R86 | L82-V84 PolarHBondContact O-N 2.9Å; V84-R86 PolarHBondContact O-N 2.87Å | ||
| 85 | E | 56.9 | Low | 59.7 | Low | 179 Ų | 179 | 118.1 Ų | 118.1 | 84% | 0.836 | 64% | 0.644 | S | S | * | * | trans | -50.3 | 106.3 | -173.3 | -155.1 | 73.7 | -130.4 | 0 | 0 | 109.1 | P83 R87 | P83-E85 PolarHBondContact O-N 3.08Å; E85-R87 PolarHBondContact O-N 3.27Å | ||
| 86 | R | 64.6 | Low | 60.7 | Low | 178 Ų | 178 | 117.7 Ų | 117.7 | 67% | 0.672 | 65% | 0.65 | S | S | * | * | trans | -73.7 | 97.1 | -171.7 | -72.3 | -170.5 | 173.7 | -155.8 | -3.6 | 108.6 | V84 R88 Y128 | V84-R86 PolarHBondContact O-N 2.87Å; R86-R88 PolarHBondContact O-N 2.78Å; R86-R88 VanDerWaalsContact O-N 3.08Å; R86-Y128 HydrophobicContact CB-CD1 3.47Å; R86-Y128 VanDerWaalsContact CB-CD1 3.47Å; R86-Y128 HydrophobicContact CB-CE1 3.87Å; R86-Y128 HydrophobicContact CB-CG 4.44Å; R86-Y128 VanDerWaalsContact O-CD1 3.26Å; R86-Y128 WeakPolarHBondContact O-CD1 3.25Å; R86-Y128 VanDerWaalsContact O-CE1 3.25Å; R86-Y128 WeakPolarHBondContact O-CE1 3.26Å | ||
| 87 | R | 70.6 | Confident | 61.6 | Low | 214 Ų | 214 | 119.7 Ų | 119.7 | 81% | 0.808 | 64% | 0.644 | S | S | * | * | trans | -51.2 | 116.8 | 175 | -177.8 | 178.9 | 179.6 | 179.4 | 1.5 | 110.2 | E85 | E85-R87 PolarHBondContact O-N 3.27Š| ||
| 88 | R | 75.4 | Confident | 62.9 | Low | 75 Ų | 75 | 119 Ų | 119 | 28% | 0.283 | 63% | 0.633 | S | S | . | * | trans | -78.6 | 144 | 176.1 | -65.3 | 171.2 | 85.6 | -173.1 | 19.4 | 110.8 | R86 D120 T126 T127 Y128 | R86-R88 PolarHBondContact O-N 2.78Å; R86-R88 VanDerWaalsContact O-N 3.08Å; R88-D120 IonicContact CZ-OD1 3.05Å; R88-D120 VanDerWaalsContact NH1-CG 3.26Å; R88-D120 IonicContact NH1-OD1 3.14Å; R88-D120 PolarHBondContact NH1-OD1 2.99Å; R88-D120 IonicContact NH1-OD2 3.76Å; R88-D120 PolarHBondContact NH2-O 3.01Å; R88-D120 IonicContact NH2-OD1 3.16Å; R88-D120 PolarHBondContact NH2-OD1 2.75Å; R88-D120 VanDerWaalsContact NH2-OD1 3.14Å; R88-T126 PolarHBondContact NE-OG1 3.03Å; R88-T126 VanDerWaalsContact NE-OG1 3.17Å; R88-T126 PolarHBondContact NH2-OG1 3.18Å; R88-T126 VanDerWaalsContact NH2-OG1 3.14Å; R88-T127 WeakPolarHBondContact CA-O 3.21Å; R88-Y128 HydrophobicContact CG-CD1 3.49Å; R88-Y128 VanDerWaalsContact CG-CD1 3.49Å; R88-Y128 HydrophobicContact CG-CE1 3.27Å; R88-Y128 HydrophobicContact CG-CE2 4.46Å; R88-Y128 HydrophobicContact CG-CG 4.23Å | ||
| 89 | N | 78.9 | Confident | 63.8 | Low | 60 Ų | 60 | 120.4 Ų | 120.4 | 32% | 0.321 | 63% | 0.626 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -109.8 | 139.6 | 176.6 | -57.8 | -50.4 | 0 | 0 | 0 | 109.1 | T126 T127 Y129 | N89-T126 CarbonylContact O-C 3.58Å; N89-T126 VanDerWaalsContact O-CA 3.29Å; N89-T126 WeakPolarHBondContact O-CA 3.34Å; N89-T127 HydrophobicContact CB-CG2 4.37Å; N89-T127 PolarHBondContact N-O 3.29Å; N89-T127 PolarHBondContact O-N 3.25Å; N89-Y129 PolarHBondContact ND2-O 3.5Å; N89-Y129 VanDerWaalsContact ND2-O 3.17Å |
| 90 | Q | 79.2 | Confident | 64.5 | Low | 112 Ų | 112 | 120.3 Ų | 120.3 | 52% | 0.523 | 61% | 0.61 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -70.6 | 140.1 | 169.4 | -68.2 | -68.1 | -12.8 | 0 | 0 | 109.5 | S125 T126 | Q90-S125 PolarHBondContact OE1-O 3.04Å; Q90-T126 HydrophobicContact CG-CG2 4.49Å |
| 91 | L | 78.8 | Confident | 65.2 | Low | 67 Ų | 67 | 119.2 Ų | 119.2 | 35% | 0.351 | 61% | 0.612 | S | S | . | * | trans | -70.3 | 148.7 | 175.1 | -64.9 | 175.8 | 0 | 0 | 0 | 110.8 | G93 V94 Q124 S125 T127 | L91-G93 PolarHBondContact O-N 3.23Å; L91-V94 HydrophobicContact CB-CG2 4.17Å; L91-V94 WeakPolarHBondContact O-CB 3.4Å; L91-V94 WeakPolarHBondContact O-CG2 3.48Å; L91-V94 PolarHBondContact O-N 3.25Å; L91-Q124 WeakPolarHBondContact CD1-O 3.42Å; L91-S125 WeakPolarHBondContact CG-O 3.12Å; L91-S125 PolarHBondContact N-O 2.67Å; L91-T127 HydrophobicContact CD2-CG2 3.6Å | ||
| 92 | A | 67.7 | Low | 66.3 | Low | 118 Ų | 118 | 115.8 Ų | 115.8 | 98% | 0.975 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60 | -20.6 | -172.7 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 93 | G | 66.7 | Low | 67 | Low | 68 Ų | 68 | 114 Ų | 114 | 70% | 0.701 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | -7.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | L91 K95 | L91-G93 PolarHBondContact O-N 3.23Å; G93-K95 PolarHBondContact O-N 3.26Å |
| 94 | V | 67.5 | Low | 67.6 | Low | 30 Ų | 30 | 114.4 Ų | 114.4 | 18% | 0.182 | 60% | 0.598 | C | S | . | * | trans | -74.4 | 111.2 | -178.4 | 179.5 | 0 | 0 | 0 | 0 | 109.9 | L91 Q96 M109 S125 | L91-V94 HydrophobicContact CB-CG2 4.17Å; L91-V94 WeakPolarHBondContact O-CB 3.4Å; L91-V94 WeakPolarHBondContact O-CG2 3.48Å; L91-V94 PolarHBondContact O-N 3.25Å; V94-Q96 PolarHBondContact O-N 2.84Å; V94-M109 HydrophobicContact CB-CE 4.5Å; V94-M109 HydrophobicContact CB-SD 4.48Å; V94-M109 HydrophobicContact CG1-CE 3.75Å; V94-M109 HydrophobicContact CG1-SD 4.2Å; V94-M109 HydrophobicContact CG2-SD 4.29Å; V94-S125 VanDerWaalsContact CG2-O 3.32Å; V94-S125 WeakPolarHBondContact CG2-O 3.29Å | ||
| 95 | K | 68.7 | Low | 67.8 | Low | 149 Ų | 149 | 111.6 Ų | 111.6 | 65% | 0.648 | 58% | 0.582 | S | S | * | * | trans | -70.4 | 121.8 | 176.7 | -63.3 | -178.8 | -179.4 | -179.6 | 0 | 110.1 | G93 Q97 R107 | G93-K95 PolarHBondContact O-N 3.26Å; K95-Q97 PolarHBondContact O-N 3.17Å; K95-R107 VanDerWaalsContact CB-NH1 3.33Å | ||
| 96 | Q | 60.4 | Low | 68.3 | Low | 188 Ų | 188 | 106.2 Ų | 106.2 | 88% | 0.879 | 56% | 0.558 | S | S | * | * | S | Bend | trans | -69.2 | 91.7 | 172.5 | -62.7 | 178.4 | 2.2 | 0 | 0 | 110.3 | V94 | V94-Q96 PolarHBondContact O-N 2.84Š|
| 97 | Q | 65 | Low | 68.4 | Low | 128 Ų | 128 | 99.7 Ų | 99.7 | 60% | 0.598 | 53% | 0.534 | S | S | * | . | trans | 173.5 | 124 | 161.8 | -101.8 | 157.8 | 9.4 | 0 | 0 | 109.7 | K95 Y99 R107 | K95-Q97 PolarHBondContact O-N 3.17Å; Q97-Y99 VanDerWaalsContact C-N 3.32Å; Q97-Y99 PolarHBondContact O-N 3.17Å; Q97-R107 WeakPolarHBondContact O-CD 3.26Å; Q97-R107 VanDerWaalsContact O-CZ 3.23Å; Q97-R107 PolarHBondContact O-NE 3.06Å; Q97-R107 PolarHBondContact O-NH1 2.68Å | ||
| 98 | L | 62.8 | Low | 68.2 | Low | 67 Ų | 67 | 96.5 Ų | 96.5 | 35% | 0.351 | 53% | 0.528 | S | S | . | . | S | Bend | trans | -63 | -31.8 | -177.8 | -179.7 | 60.3 | 0 | 0 | 0 | 114.5 | L106 R107 D110 V114 | L98-L106 HydrophobicContact CD1-CD2 3.71Å; L98-L106 HydrophobicContact CD2-CD2 4.02Å; L98-L106 HydrophobicContact CG-CD2 3.59Å; L98-R107 PolarHBondContact O-N 3.06Å; L98-D110 HydrophobicContact CD1-CB 3.79Å; L98-V114 HydrophobicContact CD1-CG2 3.68Å |
| 99 | Y | 63.8 | Low | 67.7 | Low | 134 Ų | 134 | 96.4 Ų | 96.4 | 53% | 0.525 | 53% | 0.531 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105 | 151.2 | -172 | -64.8 | -76.8 | 0 | 0 | 0 | 112.7 | Q97 L106 R107 | Q97-Y99 VanDerWaalsContact C-N 3.32Å; Q97-Y99 PolarHBondContact O-N 3.17Å; Y99-L106 HydrophobicContact CD1-CD2 4.11Å; Y99-L106 HydrophobicContact CE1-CD2 3.7Å; Y99-R107 PolarHBondContact O-NE 2.87Å; Y99-R107 PolarHBondContact O-NH2 3.25Å |
| 100 | H | 65.6 | Low | 67.1 | Low | 88 Ų | 88 | 94.5 Ų | 94.5 | 41% | 0.407 | 52% | 0.521 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.1 | 132.3 | 167.1 | -168.4 | -96.5 | 0 | 0 | 0 | 109.8 | A102 L103 T105 | H100-A102 PolarHBondContact ND1-N 3.4Å; H100-A102 PolarHBondContact O-N 2.94Å; H100-A102 VanDerWaalsContact O-N 3.1Å; H100-L103 HydrophobicContact CB-CB 4.32Å; H100-L103 PolarHBondContact O-N 3.14Å; H100-T105 PolarHBondContact N-O 3.13Å |
| 101 | P | 65.4 | Low | 66.7 | Low | 110 Ų | 110 | 94.6 Ų | 94.6 | 71% | 0.714 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.7 | -19.7 | -173.3 | 26.4 | -35 | 0 | 0 | 0 | 113.8 | ||
| 102 | A | 68.9 | Low | 66.2 | Low | 79 Ų | 79 | 94.2 Ų | 94.2 | 65% | 0.653 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108 | -1.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | H100 | H100-A102 PolarHBondContact ND1-N 3.4Å; H100-A102 PolarHBondContact O-N 2.94Å; H100-A102 VanDerWaalsContact O-N 3.1Å |
| 103 | L | 66.1 | Low | 66.3 | Low | 102 Ų | 102 | 91.5 Ų | 91.5 | 53% | 0.534 | 49% | 0.486 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.3 | 142.7 | -177.6 | -70.4 | 174.9 | 0 | 0 | 0 | 110.8 | H100 T105 | H100-L103 HydrophobicContact CB-CB 4.32Å; H100-L103 PolarHBondContact O-N 3.14Å; L103-T105 HydrophobicContact CB-CG2 4.48Å; L103-T105 PolarHBondContact O-N 3.35Å |
| 104 | P | 65.5 | Low | 66.4 | Low | 123 Ų | 123 | 92.6 Ų | 92.6 | 80% | 0.799 | 48% | 0.479 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -74.3 | 35.9 | 175.9 | 34.1 | -37.3 | 0 | 0 | 0 | 112.8 | ||
| 105 | T | 66.1 | Low | 66.7 | Low | 75 Ų | 75 | 96.8 Ų | 96.8 | 46% | 0.46 | 50% | 0.495 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.5 | 140.2 | 177.2 | 51.3 | 0 | 0 | 0 | 0 | 110.4 | H100 L103 | H100-T105 PolarHBondContact N-O 3.13Å; L103-T105 HydrophobicContact CB-CG2 4.48Å; L103-T105 PolarHBondContact O-N 3.35Å |
| 106 | L | 65.6 | Low | 66.8 | Low | 65 Ų | 65 | 93.6 Ų | 93.6 | 34% | 0.34 | 50% | 0.497 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -61.9 | 136.8 | 168.8 | -60.6 | -178.6 | 0 | 0 | 0 | 109.1 | L98 Y99 | L98-L106 HydrophobicContact CD1-CD2 3.71Å; L98-L106 HydrophobicContact CD2-CD2 4.02Å; L98-L106 HydrophobicContact CG-CD2 3.59Å; Y99-L106 HydrophobicContact CD1-CD2 4.11Å; Y99-L106 HydrophobicContact CE1-CD2 3.7Å |
| 107 | R | 67.4 | Low | 67 | Low | 41 Ų | 41 | 88.4 Ų | 88.4 | 16% | 0.155 | 48% | 0.48 | C | S | . | . | P | Polyproline II helix | trans | -64.1 | 141.6 | 171.3 | -62.4 | 179.7 | 177.7 | 163.4 | -0.3 | 109.2 | K95 Q97 L98 Y99 M109 D110 R111 | K95-R107 VanDerWaalsContact CB-NH1 3.33Å; Q97-R107 WeakPolarHBondContact O-CD 3.26Å; Q97-R107 VanDerWaalsContact O-CZ 3.23Å; Q97-R107 PolarHBondContact O-NE 3.06Å; Q97-R107 PolarHBondContact O-NH1 2.68Å; L98-R107 PolarHBondContact O-N 3.06Å; Y99-R107 PolarHBondContact O-NE 2.87Å; Y99-R107 PolarHBondContact O-NH2 3.25Å; R107-M109 PolarHBondContact O-N 2.65Å; R107-D110 WeakPolarHBondContact CB-OD2 3.33Å; R107-D110 PolarHBondContact O-N 3.05Å; R107-R111 PolarHBondContact O-N 2.72Å |
| 108 | H | 66.4 | Low | 67 | Low | 148 Ų | 148 | 85.1 Ų | 85.1 | 69% | 0.685 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -56.5 | -36.7 | -179.1 | -111 | -87.7 | 0 | 0 | 0 | 113 | D110 R111 | H108-D110 PolarHBondContact O-N 2.9Å; H108-R111 PolarHBondContact O-N 2.85Å |
| 109 | M | 64.9 | Low | 67 | Low | 72 Ų | 72 | 85.8 Ų | 85.8 | 36% | 0.355 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.7 | -38.4 | 175.2 | -178.4 | -175.4 | 69.6 | 0 | 0 | 113.3 | V94 R107 T113 | V94-M109 HydrophobicContact CB-CE 4.5Å; V94-M109 HydrophobicContact CB-SD 4.48Å; V94-M109 HydrophobicContact CG1-CE 3.75Å; V94-M109 HydrophobicContact CG1-SD 4.2Å; V94-M109 HydrophobicContact CG2-SD 4.29Å; R107-M109 PolarHBondContact O-N 2.65Å; M109-T113 PolarHBondContact O-OG1 3.17Å |
| 110 | D | 67.2 | Low | 66.9 | Low | 21 Ų | 21 | 83.3 Ų | 83.3 | 11% | 0.112 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -84.7 | -26.3 | -176.8 | -57.8 | -42.8 | 0 | 0 | 0 | 111.4 | L98 R107 H108 D112 T113 V114 | L98-D110 HydrophobicContact CD1-CB 3.79Å; R107-D110 WeakPolarHBondContact CB-OD2 3.33Å; R107-D110 PolarHBondContact O-N 3.05Å; H108-D110 PolarHBondContact O-N 2.9Å; D110-D112 VanDerWaalsContact C-N 3.33Å; D110-D112 PolarHBondContact O-N 3.01Å; D110-T113 PolarHBondContact O-N 3.14Å; D110-V114 WeakPolarHBondContact O-CB 3.43Å; D110-V114 VanDerWaalsContact O-CG2 3.28Å; D110-V114 WeakPolarHBondContact O-CG2 3.5Å; D110-V114 PolarHBondContact O-N 3.2Å |
| 111 | R | 70.3 | Confident | 66.7 | Low | 114 Ų | 114 | 86.1 Ų | 86.1 | 43% | 0.43 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -53.5 | -45.8 | 178.1 | 176.2 | 176.2 | 168.9 | 147.4 | -3.1 | 112.7 | R107 H108 T113 K115 | R107-R111 PolarHBondContact O-N 2.72Å; H108-R111 PolarHBondContact O-N 2.85Å; R111-T113 VanDerWaalsContact C-N 3.35Å; R111-K115 HydrophobicContact CG-CD 4.19Å; R111-K115 VanDerWaalsContact O-CB 3.31Å; R111-K115 WeakPolarHBondContact O-CB 3.2Å; R111-K115 VanDerWaalsContact O-CG 3.31Å; R111-K115 WeakPolarHBondContact O-CG 3.23Å; R111-K115 PolarHBondContact O-N 2.94Å |
| 112 | D | 69 | Low | 66.5 | Low | 59 Ų | 59 | 85.2 Ų | 85.2 | 32% | 0.316 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -74.3 | -30.4 | -176.8 | -61.8 | -18.2 | 0 | 0 | 0 | 111.8 | D110 A116 C117 L118 | D110-D112 VanDerWaalsContact C-N 3.33Å; D110-D112 PolarHBondContact O-N 3.01Å; D112-A116 WeakPolarHBondContact O-CA 3.22Å; D112-A116 PolarHBondContact O-N 3.32Å; D112-C117 PolarHBondContact O-N 3.28Å; D112-L118 HydrophobicContact CB-CD1 4.23Å; D112-L118 HydrophobicContact CB-CG 4.44Å |
| 113 | T | 68.8 | Low | 66.4 | Low | 60 Ų | 60 | 82.6 Ų | 82.6 | 37% | 0.368 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -71.4 | -46.7 | 174.9 | -51.9 | 0 | 0 | 0 | 0 | 110.9 | M109 D110 R111 K115 A116 S125 | M109-T113 PolarHBondContact O-OG1 3.17Å; D110-T113 PolarHBondContact O-N 3.14Å; R111-T113 VanDerWaalsContact C-N 3.35Å; T113-K115 PolarHBondContact O-N 3.14Å; T113-A116 PolarHBondContact O-N 2.86Å; T113-S125 PolarHBondContact OG1-OG 2.63Å; T113-S125 VanDerWaalsContact OG1-OG 3.05Å |
| 114 | V | 69.9 | Low | 66.5 | Low | 91 Ų | 91 | 85.7 Ų | 85.7 | 55% | 0.552 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -67.1 | -35.6 | 179.9 | 168.7 | 0 | 0 | 0 | 0 | 112.5 | L98 D110 | L98-V114 HydrophobicContact CD1-CG2 3.68Å; D110-V114 WeakPolarHBondContact O-CB 3.43Å; D110-V114 VanDerWaalsContact O-CG2 3.28Å; D110-V114 WeakPolarHBondContact O-CG2 3.5Å; D110-V114 PolarHBondContact O-N 3.2Å |
| 115 | K | 72.9 | Confident | 66.8 | Low | 118 Ų | 118 | 80.1 Ų | 80.1 | 51% | 0.513 | 42% | 0.422 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.5 | -0.9 | 178.8 | -65.6 | -173.2 | 174 | -157.9 | 0 | 113.9 | R111 T113 C117 | R111-K115 HydrophobicContact CG-CD 4.19Å; R111-K115 VanDerWaalsContact O-CB 3.31Å; R111-K115 WeakPolarHBondContact O-CB 3.2Å; R111-K115 VanDerWaalsContact O-CG 3.31Å; R111-K115 WeakPolarHBondContact O-CG 3.23Å; R111-K115 PolarHBondContact O-N 2.94Å; T113-K115 PolarHBondContact O-N 3.14Å; K115-C117 HydrophobicContact CB-CB 4.49Å; K115-C117 WeakPolarHBondContact CB-SG 3.29Å; K115-C117 PolarHBondContact O-N 2.64Å; K115-C117 VanDerWaalsContact O-N 3.14Å |
| 116 | A | 69.8 | Low | 67.3 | Low | 83 Ų | 83 | 77.3 Ų | 77.3 | 69% | 0.686 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47.4 | 37.3 | -171.8 | 0 | 0 | 0 | 0 | 0 | 113 | D112 T113 L118 | D112-A116 WeakPolarHBondContact O-CA 3.22Å; D112-A116 PolarHBondContact O-N 3.32Å; T113-A116 PolarHBondContact O-N 2.86Å; A116-L118 VanDerWaalsContact C-N 3.26Å; A116-L118 PolarHBondContact O-N 3.06Å |
| 117 | C | 65.7 | Low | 68 | Low | 78 Ų | 78 | 75.2 Ų | 75.2 | 53% | 0.527 | 40% | 0.395 | S | S | . | . | trans | -74.9 | -12.9 | -172.2 | -75.6 | 0 | 0 | 0 | 0 | 114 | D112 K115 | D112-C117 PolarHBondContact O-N 3.28Å; K115-C117 HydrophobicContact CB-CB 4.49Å; K115-C117 WeakPolarHBondContact CB-SG 3.29Å; K115-C117 PolarHBondContact O-N 2.64Å; K115-C117 VanDerWaalsContact O-N 3.14Å | ||
| 118 | L | 64.3 | Low | 68.5 | Low | 59 Ų | 59 | 77.2 Ų | 77.2 | 31% | 0.309 | 40% | 0.403 | S | S | . | . | S | Bend | trans | -116.5 | 134 | 178.2 | -65.7 | 175 | 0 | 0 | 0 | 109.3 | D112 A116 | D112-L118 HydrophobicContact CB-CD1 4.23Å; D112-L118 HydrophobicContact CB-CG 4.44Å; A116-L118 VanDerWaalsContact C-N 3.26Å; A116-L118 PolarHBondContact O-N 3.06Å |
| 119 | P | 63 | Low | 69 | Low | 81 Ų | 81 | 76 Ų | 76 | 53% | 0.526 | 39% | 0.393 | S | S | . | . | trans | -53.7 | 151.7 | 168.2 | -24 | 33.7 | 0 | 0 | 0 | 111 | E121 H122 C123 | P119-E121 PolarHBondContact O-N 2.9Å; P119-H122 PolarHBondContact O-N 3.49Å; P119-C123 PolarHBondContact O-N 2.95Å | ||
| 120 | D | 61.5 | Low | 69.5 | Low | 83 Ų | 83 | 80.5 Ų | 80.5 | 44% | 0.444 | 41% | 0.406 | S | S | . | . | G | 310 helix | trans | -62.5 | -24.2 | -172.3 | -78.2 | -17.9 | 0 | 0 | 0 | 114.5 | R88 H122 Y128 | R88-D120 IonicContact CZ-OD1 3.05Å; R88-D120 VanDerWaalsContact NH1-CG 3.26Å; R88-D120 IonicContact NH1-OD1 3.14Å; R88-D120 PolarHBondContact NH1-OD1 2.99Å; R88-D120 IonicContact NH1-OD2 3.76Å; R88-D120 PolarHBondContact NH2-O 3.01Å; R88-D120 IonicContact NH2-OD1 3.16Å; R88-D120 PolarHBondContact NH2-OD1 2.75Å; R88-D120 VanDerWaalsContact NH2-OD1 3.14Å; D120-H122 VanDerWaalsContact C-N 3.29Å; D120-H122 PolarHBondContact O-N 3.36Å; D120-Y128 HydrophobicContact CB-CE2 4.21Å; D120-Y128 VanDerWaalsContact CB-OH 3.26Å; D120-Y128 WeakPolarHBondContact CB-OH 3.05Å; D120-Y128 PolarHBondContact OD2-OH 3.1Å |
| 121 | E | 62.7 | Low | 70 | Confident | 147 Ų | 147 | 86.3 Ų | 86.3 | 69% | 0.687 | 43% | 0.431 | S | S | * | . | G | 310 helix | trans | -72.6 | -16.5 | 174.3 | -54.6 | -172 | 177.2 | 0 | 0 | 114 | P119 Q150 | P119-E121 PolarHBondContact O-N 2.9Å; E121-Q150 PolarHBondContact OE2-NE2 3.32Å |
| 122 | H | 61.4 | Low | 70.2 | Confident | 90 Ų | 90 | 85.6 Ų | 85.6 | 42% | 0.417 | 44% | 0.435 | S | S | . | . | G | 310 helix | trans | -119.5 | 7.9 | -175.4 | -62.8 | -36.6 | 0 | 0 | 0 | 113.4 | P119 D120 Q124 Q150 | P119-H122 PolarHBondContact O-N 3.49Å; D120-H122 VanDerWaalsContact C-N 3.29Å; D120-H122 PolarHBondContact O-N 3.36Å; H122-Q124 PolarHBondContact O-N 3Å; H122-Q150 PolarHBondContact CE1-OE1 3.05Å |
| 123 | C | 66.4 | Low | 70.6 | Confident | 25 Ų | 25 | 87.1 Ų | 87.1 | 17% | 0.169 | 44% | 0.441 | C | S | . | . | trans | -67.5 | 126.4 | 178.5 | -171 | 0 | 0 | 0 | 0 | 111.4 | P119 S125 T126 | P119-C123 PolarHBondContact O-N 2.95Å; C123-S125 PolarHBondContact SG-OG 3.2Å; C123-T126 PolarHBondContact SG-OG1 3.15Å | ||
| 124 | Q | 67.1 | Low | 70.8 | Confident | 167 Ų | 167 | 89.5 Ų | 89.5 | 78% | 0.78 | 45% | 0.446 | S | S | * | . | S | Bend | trans | -85.1 | -12.6 | -177.3 | -60 | -178.2 | 13.1 | 0 | 0 | 113.9 | L91 H122 | L91-Q124 WeakPolarHBondContact CD1-O 3.42Å; H122-Q124 PolarHBondContact O-N 3Å |
| 125 | S | 72.1 | Confident | 70.9 | Confident | 5 Ų | 5 | 90.1 Ų | 90.1 | 4% | 0.035 | 45% | 0.446 | C | S | . | . | S | Bend | trans | -101.7 | -23.4 | -176.5 | 52.5 | 0 | 0 | 0 | 0 | 113.6 | Q90 L91 V94 T113 C123 | Q90-S125 PolarHBondContact OE1-O 3.04Å; L91-S125 WeakPolarHBondContact CG-O 3.12Å; L91-S125 PolarHBondContact N-O 2.67Å; V94-S125 VanDerWaalsContact CG2-O 3.32Å; V94-S125 WeakPolarHBondContact CG2-O 3.29Å; T113-S125 PolarHBondContact OG1-OG 2.63Å; T113-S125 VanDerWaalsContact OG1-OG 3.05Å; C123-S125 PolarHBondContact SG-OG 3.2Å |
| 126 | T | 77 | Confident | 70.6 | Confident | 16 Ų | 16 | 90.3 Ų | 90.3 | 10% | 0.098 | 45% | 0.453 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.1 | 155.6 | -172.6 | 61.4 | 0 | 0 | 0 | 0 | 113.1 | R88 N89 Q90 C123 | R88-T126 PolarHBondContact NE-OG1 3.03Å; R88-T126 VanDerWaalsContact NE-OG1 3.17Å; R88-T126 PolarHBondContact NH2-OG1 3.18Å; R88-T126 VanDerWaalsContact NH2-OG1 3.14Å; N89-T126 CarbonylContact O-C 3.58Å; N89-T126 VanDerWaalsContact O-CA 3.29Å; N89-T126 WeakPolarHBondContact O-CA 3.34Å; Q90-T126 HydrophobicContact CG-CG2 4.49Å; C123-T126 PolarHBondContact SG-OG1 3.15Å |
| 127 | T | 79.8 | Confident | 70.6 | Confident | 22 Ų | 22 | 89.8 Ų | 89.8 | 14% | 0.135 | 45% | 0.448 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.3 | 149.4 | 179.8 | -177.1 | 0 | 0 | 0 | 0 | 111.2 | R88 N89 L91 Y129 F134 | R88-T127 WeakPolarHBondContact CA-O 3.21Å; N89-T127 HydrophobicContact CB-CG2 4.37Å; N89-T127 PolarHBondContact N-O 3.29Å; N89-T127 PolarHBondContact O-N 3.25Å; L91-T127 HydrophobicContact CD2-CG2 3.6Å; T127-Y129 VanDerWaalsContact C-N 3.32Å; T127-Y129 WeakPolarHBondContact OG1-CD2 3.39Å; T127-Y129 PolarHBondContact OG1-N 3.48Å; T127-F134 HydrophobicContact CG2-CE2 4.18Å; T127-F134 HydrophobicContact CG2-CZ 4.11Å |
| 128 | Y | 78.8 | Confident | 70.1 | Confident | 83 Ų | 83 | 92.6 Ų | 92.6 | 33% | 0.325 | 45% | 0.453 | S | S | . | . | S | Bend | trans | -81.4 | -14.8 | 167.8 | -66.9 | -74.2 | 0 | 0 | 0 | 112.9 | R86 R88 D120 | R86-Y128 HydrophobicContact CB-CD1 3.47Å; R86-Y128 VanDerWaalsContact CB-CD1 3.47Å; R86-Y128 HydrophobicContact CB-CE1 3.87Å; R86-Y128 HydrophobicContact CB-CG 4.44Å; R86-Y128 VanDerWaalsContact O-CD1 3.26Å; R86-Y128 WeakPolarHBondContact O-CD1 3.25Å; R86-Y128 VanDerWaalsContact O-CE1 3.25Å; R86-Y128 WeakPolarHBondContact O-CE1 3.26Å; R88-Y128 HydrophobicContact CG-CD1 3.49Å; R88-Y128 VanDerWaalsContact CG-CD1 3.49Å; R88-Y128 HydrophobicContact CG-CE1 3.27Å; R88-Y128 HydrophobicContact CG-CE2 4.46Å; R88-Y128 HydrophobicContact CG-CG 4.23Å; D120-Y128 HydrophobicContact CB-CE2 4.21Å; D120-Y128 VanDerWaalsContact CB-OH 3.26Å; D120-Y128 WeakPolarHBondContact CB-OH 3.05Å; D120-Y128 PolarHBondContact OD2-OH 3.1Å |
| 129 | Y | 75.5 | Confident | 69.7 | Low | 121 Ų | 121 | 96.3 Ų | 96.3 | 48% | 0.475 | 47% | 0.467 | S | S | . | . | trans | -74.6 | 145 | -175.1 | -64.6 | -69.8 | 0 | 0 | 0 | 112.3 | N89 T127 E133 | N89-Y129 PolarHBondContact ND2-O 3.5Å; N89-Y129 VanDerWaalsContact ND2-O 3.17Å; T127-Y129 VanDerWaalsContact C-N 3.32Å; T127-Y129 WeakPolarHBondContact OG1-CD2 3.39Å; T127-Y129 PolarHBondContact OG1-N 3.48Å; Y129-E133 WeakPolarHBondContact CA-OE2 3.47Å; Y129-E133 HydrophobicContact CD1-CB 4.24Å | ||
| 130 | R | 76.7 | Confident | 69.2 | Low | 167 Ų | 167 | 96.3 Ų | 96.3 | 63% | 0.63 | 47% | 0.466 | S | S | * | . | trans | -94.4 | 161.6 | 174.7 | -63.4 | -175.1 | 178.1 | -169.9 | 1.1 | 111 | D132 E133 F134 | R130-D132 PolarHBondContact O-N 3.33Å; R130-E133 HydrophobicContact CB-CG 4.44Å; R130-E133 PolarHBondContact N-OE2 3.07Å; R130-E133 WeakPolarHBondContact O-CB 3.38Å; R130-E133 PolarHBondContact O-N 3.06Å; R130-F134 WeakPolarHBondContact O-CD2 3.46Å; R130-F134 PolarHBondContact O-N 2.9Å; R130-F134 VanDerWaalsContact O-N 3.17Å | ||
| 131 | K | 77.8 | Confident | 68.7 | Low | 143 Ų | 143 | 95.2 Ų | 95.2 | 62% | 0.622 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -50.8 | -46.4 | 176.7 | -171 | -174.5 | 174.7 | -72.4 | 0 | 111.6 | E133 F134 D135 | K131-E133 PolarHBondContact O-N 3.39Å; K131-F134 WeakPolarHBondContact O-CB 3.5Å; K131-F134 PolarHBondContact O-N 2.81Å; K131-D135 IonicContact NZ-OD1 2.68Å; K131-D135 IonicContact NZ-OD2 3.75Å; K131-D135 PolarHBondContact NZ-OD2 2.98Å; K131-D135 PolarHBondContact O-N 3.3Å |
| 132 | D | 74.9 | Confident | 68.2 | Low | 99 Ų | 99 | 92.1 Ų | 92.1 | 53% | 0.529 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63.9 | -29.8 | -178.6 | -39.4 | -57.4 | 0 | 0 | 0 | 112.3 | R130 N136 | R130-D132 PolarHBondContact O-N 3.33Å; D132-N136 WeakPolarHBondContact O-CB 3.44Å; D132-N136 PolarHBondContact O-N 3.08Å; D132-N136 PolarHBondContact O-ND2 3.49Å |
| 133 | E | 75.8 | Confident | 67.7 | Low | 92 Ų | 92 | 89.2 Ų | 89.2 | 43% | 0.43 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -77 | -28.3 | 176.1 | -63.5 | 172.8 | 136 | 0 | 0 | 112 | Y129 R130 K131 A137 | Y129-E133 WeakPolarHBondContact CA-OE2 3.47Å; Y129-E133 HydrophobicContact CD1-CB 4.24Å; R130-E133 HydrophobicContact CB-CG 4.44Å; R130-E133 PolarHBondContact N-OE2 3.07Å; R130-E133 WeakPolarHBondContact O-CB 3.38Å; R130-E133 PolarHBondContact O-N 3.06Å; K131-E133 PolarHBondContact O-N 3.39Å; E133-A137 PolarHBondContact O-N 3.05Å |
| 134 | F | 73.7 | Confident | 67.1 | Low | 110 Ų | 110 | 93.5 Ų | 93.5 | 48% | 0.482 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -72.6 | -42.3 | 168.1 | -71.4 | -74.9 | 0 | 0 | 0 | 111.7 | T127 R130 K131 N136 A137 | T127-F134 HydrophobicContact CG2-CE2 4.18Å; T127-F134 HydrophobicContact CG2-CZ 4.11Å; R130-F134 WeakPolarHBondContact O-CD2 3.46Å; R130-F134 PolarHBondContact O-N 2.9Å; R130-F134 VanDerWaalsContact O-N 3.17Å; K131-F134 WeakPolarHBondContact O-CB 3.5Å; K131-F134 PolarHBondContact O-N 2.81Å; F134-N136 VanDerWaalsContact C-N 3.27Å; F134-N136 PolarHBondContact O-N 2.67Å; F134-A137 WeakPolarHBondContact O-CB 3.22Å; F134-A137 PolarHBondContact O-N 2.87Å; F134-A137 VanDerWaalsContact O-N 3.14Å |
| 135 | D | 72.1 | Confident | 66.4 | Low | 103 Ų | 103 | 88.2 Ų | 88.2 | 55% | 0.551 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -66.3 | -30.6 | 179.4 | -66.9 | -23.4 | 0 | 0 | 0 | 111.5 | K131 | K131-D135 IonicContact NZ-OD1 2.68Å; K131-D135 IonicContact NZ-OD2 3.75Å; K131-D135 PolarHBondContact NZ-OD2 2.98Å; K131-D135 PolarHBondContact O-N 3.3Å |
| 136 | N | 67.6 | Low | 65.8 | Low | 123 Ų | 123 | 95 Ų | 95 | 66% | 0.658 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94 | 9.1 | 174 | -68.7 | -69.5 | 0 | 0 | 0 | 114.1 | D132 F134 H138 | D132-N136 WeakPolarHBondContact O-CB 3.44Å; D132-N136 PolarHBondContact O-N 3.08Å; D132-N136 PolarHBondContact O-ND2 3.49Å; F134-N136 VanDerWaalsContact C-N 3.27Å; F134-N136 PolarHBondContact O-N 2.67Å; N136-H138 PolarHBondContact O-N 2.95Å; N136-H138 PolarHBondContact O-ND1 3.42Å |
| 137 | A | 68.1 | Low | 65.2 | Low | 71 Ų | 71 | 101.4 Ų | 101.4 | 59% | 0.587 | 51% | 0.51 | S | S | * | . | trans | -71.9 | 100.5 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | E133 F134 | E133-A137 PolarHBondContact O-N 3.05Å; F134-A137 WeakPolarHBondContact O-CB 3.22Å; F134-A137 PolarHBondContact O-N 2.87Å; F134-A137 VanDerWaalsContact O-N 3.14Å | ||
| 138 | H | 56.6 | Low | 64.4 | Low | 137 Ų | 137 | 105.3 Ų | 105.3 | 63% | 0.634 | 54% | 0.536 | S | S | * | . | trans | -88.9 | 128.7 | 171.7 | 56.5 | -83.6 | 0 | 0 | 0 | 110.4 | N136 | N136-H138 PolarHBondContact O-N 2.95Å; N136-H138 PolarHBondContact O-ND1 3.42Å | ||
| 139 | F | 54.9 | Low | 64 | Low | 137 Ų | 137 | 105.8 Ų | 105.8 | 60% | 0.601 | 54% | 0.543 | S | S | * | . | trans | -97.5 | 114.3 | 171.4 | 165.2 | -135 | 0 | 0 | 0 | 109.9 | L141 | F139-L141 HydrophobicContact CD1-CD2 4.48Å; F139-L141 HydrophobicContact CD1-CG 4.05Å; F139-L141 HydrophobicContact CE1-CB 4.42Å; F139-L141 HydrophobicContact CE1-CD1 4.4Å; F139-L141 HydrophobicContact CE1-CD2 3.41Å; F139-L141 VanDerWaalsContact CE1-CD2 3.41Å; F139-L141 HydrophobicContact CE1-CG 3.41Å; F139-L141 VanDerWaalsContact CE1-CG 3.41Å; F139-L141 HydrophobicContact CZ-CB 4.35Å; F139-L141 HydrophobicContact CZ-CD2 3.48Å; F139-L141 VanDerWaalsContact CZ-CD2 3.48Å; F139-L141 HydrophobicContact CZ-CG 3.72Å; F139-L141 PolarHBondContact O-N 3.17Å | ||
| 140 | T | 52.8 | Low | 63.5 | Low | 81 Ų | 81 | 105.2 Ų | 105.2 | 50% | 0.497 | 55% | 0.545 | S | S | . | . | trans | -89.4 | 90.4 | 175.3 | -34.6 | 0 | 0 | 0 | 0 | 109.8 | L142 G143 | T140-L142 PolarHBondContact O-N 3.15Å; T140-G143 VanDerWaalsContact CG2-CA 3.49Å; T140-G143 PolarHBondContact O-N 2.97Å; T140-G143 VanDerWaalsContact O-N 3.13Å | ||
| 141 | L | 51.8 | Low | 63 | Low | 60 Ų | 60 | 100.2 Ų | 100.2 | 31% | 0.314 | 54% | 0.535 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -44.3 | -34.5 | 176.7 | -92.6 | 161.6 | 0 | 0 | 0 | 114.5 | F139 F185 | F139-L141 HydrophobicContact CD1-CD2 4.48Å; F139-L141 HydrophobicContact CD1-CG 4.05Å; F139-L141 HydrophobicContact CE1-CB 4.42Å; F139-L141 HydrophobicContact CE1-CD1 4.4Å; F139-L141 HydrophobicContact CE1-CD2 3.41Å; F139-L141 VanDerWaalsContact CE1-CD2 3.41Å; F139-L141 HydrophobicContact CE1-CG 3.41Å; F139-L141 VanDerWaalsContact CE1-CG 3.41Å; F139-L141 HydrophobicContact CZ-CB 4.35Å; F139-L141 HydrophobicContact CZ-CD2 3.48Å; F139-L141 VanDerWaalsContact CZ-CD2 3.48Å; F139-L141 HydrophobicContact CZ-CG 3.72Å; F139-L141 PolarHBondContact O-N 3.17Å; L141-F185 HydrophobicContact CD1-CD2 4.28Å |
| 142 | L | 52.2 | Low | 62.6 | Low | 82 Ų | 82 | 94.5 Ų | 94.5 | 43% | 0.429 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -123.3 | 6.9 | -171.7 | -53.9 | 175 | 0 | 0 | 0 | 112.7 | T140 I173 | T140-L142 PolarHBondContact O-N 3.15Å; L142-I173 HydrophobicContact CD1-CB 4.22Å; L142-I173 HydrophobicContact CD1-CD1 3.78Å; L142-I173 HydrophobicContact CD1-CG1 4.23Å; L142-I173 HydrophobicContact CD2-CD1 3.55Å; L142-I173 HydrophobicContact CD2-CG1 3.84Å; L142-I173 HydrophobicContact CG-CD1 4.31Å |
| 143 | G | 50.7 | Low | 62.4 | Low | 29 Ų | 29 | 94 Ų | 94 | 30% | 0.299 | 51% | 0.509 | S | S | . | . | S | Bend | trans | -85.6 | 146.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | T140 | T140-G143 VanDerWaalsContact CG2-CA 3.49Å; T140-G143 PolarHBondContact O-N 2.97Å; T140-G143 VanDerWaalsContact O-N 3.13Å |
| 144 | V | 53 | Low | 62.3 | Low | 116 Ų | 116 | 96.1 Ų | 96.1 | 70% | 0.703 | 52% | 0.521 | S | S | * | . | P | Polyproline II helix | trans | -59.2 | 124 | 162.3 | -179.1 | 0 | 0 | 0 | 0 | 107.1 | N146 | V144-N146 PolarHBondContact O-N 3.17Š|
| 145 | P | 52.9 | Low | 62.5 | Low | 56 Ų | 56 | 93.5 Ų | 93.5 | 36% | 0.364 | 51% | 0.514 | S | S | . | . | P | Polyproline II helix | trans | -66.2 | 130.8 | -176.4 | 27.2 | -34.8 | 0 | 0 | 0 | 109.9 | K147 | P145-K147 WeakPolarHBondContact CB-O 3.24Å; P145-K147 PolarHBondContact O-N 3.48Å |
| 146 | N | 59.3 | Low | 62.5 | Low | 148 Ų | 148 | 92.4 Ų | 92.4 | 79% | 0.791 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -58.4 | -15.2 | -177.9 | -66.3 | -35 | 0 | 0 | 0 | 114 | V144 | V144-N146 PolarHBondContact O-N 3.17Š|
| 147 | K | 64 | Low | 62.7 | Low | 150 Ų | 150 | 90.3 Ų | 90.3 | 65% | 0.652 | 51% | 0.511 | S | S | * | . | S | Bend | trans | -133.4 | 138.4 | 170.2 | -64.9 | -178.7 | 179.3 | 179.2 | 0 | 108.7 | P145 | P145-K147 WeakPolarHBondContact CB-O 3.24Å; P145-K147 PolarHBondContact O-N 3.48Å |
| 148 | P | 64.1 | Low | 63.1 | Low | 104 Ų | 104 | 87.2 Ų | 87.2 | 68% | 0.675 | 49% | 0.486 | S | S | * | . | trans | -59.8 | 145.2 | 169.8 | 26.9 | -33.8 | 0 | 0 | 0 | 110.1 | Q150 L152 | P148-Q150 PolarHBondContact O-N 3.14Å; P148-L152 HydrophobicContact CB-CD1 3.91Å | ||
| 149 | L | 69.3 | Low | 64.1 | Low | 92 Ų | 92 | 85.1 Ų | 85.1 | 48% | 0.482 | 48% | 0.477 | S | S | . | . | trans | -67.2 | 127.3 | 175.6 | -56.1 | 169.9 | 0 | 0 | 0 | 108.7 | C151 L152 L161 | L149-C151 PolarHBondContact O-N 2.92Å; L149-L152 HydrophobicContact CB-CD1 4.36Å; L149-L152 HydrophobicContact CB-CG 4.03Å; L149-L152 WeakPolarHBondContact O-CB 3.48Å; L149-L152 VanDerWaalsContact O-CG 3.23Å; L149-L152 WeakPolarHBondContact O-CG 3.39Å; L149-L152 PolarHBondContact O-N 3.03Å; L149-L161 HydrophobicContact CD1-CD2 4.33Å | ||
| 150 | Q | 65.4 | Low | 65.1 | Low | 109 Ų | 109 | 85.6 Ų | 85.6 | 51% | 0.509 | 48% | 0.478 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.1 | -24.2 | -174.7 | -71.1 | 164.7 | -41.9 | 0 | 0 | 113.7 | E121 H122 P148 I154 | E121-Q150 PolarHBondContact OE2-NE2 3.32Å; H122-Q150 PolarHBondContact CE1-OE1 3.05Å; P148-Q150 PolarHBondContact O-N 3.14Å; Q150-I154 WeakPolarHBondContact O-CD1 3.39Å |
| 151 | C | 65.4 | Low | 65.9 | Low | 62 Ų | 62 | 83.7 Ų | 83.7 | 42% | 0.419 | 47% | 0.465 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.4 | 0.1 | -179 | 62.1 | 0 | 0 | 0 | 0 | 115.4 | L149 D153 I154 T155 | L149-C151 PolarHBondContact O-N 2.92Å; C151-D153 VanDerWaalsContact C-N 3.32Å; C151-D153 PolarHBondContact O-N 2.83Å; C151-I154 PolarHBondContact O-N 3.32Å; C151-T155 HydrophobicContact CB-CG2 4.4Å; C151-T155 PolarHBondContact O-N 3.17Å; C151-T155 PolarHBondContact O-OG1 3.5Å; C151-T155 VanDerWaalsContact O-OG1 3.06Å |
| 152 | L | 69.7 | Low | 66.9 | Low | 23 Ų | 23 | 85.7 Ų | 85.7 | 12% | 0.12 | 47% | 0.468 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.8 | -41.6 | -176.8 | -76.9 | 170.3 | 0 | 0 | 0 | 113 | P148 L149 G158 Q159 L161 R162 | P148-L152 HydrophobicContact CB-CD1 3.91Å; L149-L152 HydrophobicContact CB-CD1 4.36Å; L149-L152 HydrophobicContact CB-CG 4.03Å; L149-L152 WeakPolarHBondContact O-CB 3.48Å; L149-L152 VanDerWaalsContact O-CG 3.23Å; L149-L152 WeakPolarHBondContact O-CG 3.39Å; L149-L152 PolarHBondContact O-N 3.03Å; L152-G158 CarbonylContact O-C 2.86Å; L152-G158 WeakPolarHBondContact O-CA 3.47Å; L152-Q159 VanDerWaalsContact O-CA 3.28Å; L152-Q159 WeakPolarHBondContact O-CA 3.32Å; L152-Q159 WeakPolarHBondContact O-CG 3.48Å; L152-Q159 PolarHBondContact O-N 3.03Å; L152-L161 HydrophobicContact CD2-CB 4.37Å; L152-L161 HydrophobicContact CD2-CD2 3.49Å; L152-L161 VanDerWaalsContact CD2-CD2 3.49Å; L152-R162 HydrophobicContact CD2-CB 4.18Å |
| 153 | D | 71.6 | Confident | 67.8 | Low | 90 Ų | 90 | 85.6 Ų | 85.6 | 48% | 0.481 | 47% | 0.468 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.8 | -16.5 | -174.7 | -60.9 | -39.7 | 0 | 0 | 0 | 112.9 | C151 Q159 R162 | C151-D153 VanDerWaalsContact C-N 3.32Å; C151-D153 PolarHBondContact O-N 2.83Å; D153-Q159 PolarHBondContact O-NE2 3.18Å; D153-R162 WeakPolarHBondContact OD1-CD 3.43Å; D153-R162 IonicContact OD1-CZ 3.75Å; D153-R162 IonicContact OD1-NE 2.67Å; D153-R162 IonicContact OD1-NH1 2.65Å; D153-R162 PolarHBondContact OD1-NH1 3.02Å; D153-R162 IonicContact OD2-NH1 3.59Å |
| 154 | I | 73.8 | Confident | 68.6 | Low | 135 Ų | 135 | 89.1 Ų | 89.1 | 69% | 0.692 | 47% | 0.473 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.5 | -40.3 | -171.2 | -54.1 | 175.4 | 0 | 0 | 0 | 112 | Q150 C151 | Q150-I154 WeakPolarHBondContact O-CD1 3.39Å; C151-I154 PolarHBondContact O-N 3.32Å |
| 155 | T | 76.6 | Confident | 69.2 | Low | 56 Ų | 56 | 88.7 Ų | 88.7 | 34% | 0.344 | 46% | 0.459 | S | S | . | . | S | Bend | trans | -106.7 | 144.4 | -172.3 | 63.5 | 0 | 0 | 0 | 0 | 111.3 | C151 T157 G158 Q159 | C151-T155 HydrophobicContact CB-CG2 4.4Å; C151-T155 PolarHBondContact O-N 3.17Å; C151-T155 PolarHBondContact O-OG1 3.5Å; C151-T155 VanDerWaalsContact O-OG1 3.06Å; T155-T157 PolarHBondContact O-N 3.18Å; T155-T157 VanDerWaalsContact O-N 3.17Å; T155-G158 CarbonylContact O-C 3.27Å; T155-G158 WeakPolarHBondContact O-CA 3.49Å; T155-G158 PolarHBondContact O-N 3.22Å; T155-G158 PolarHBondContact OG1-N 3.46Å; T155-Q159 WeakPolarHBondContact O-CG 3.47Å; T155-Q159 PolarHBondContact O-N 3.05Å |
| 156 | A | 73.6 | Confident | 69.8 | Low | 80 Ų | 80 | 93.9 Ų | 93.9 | 66% | 0.661 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -55.4 | -35.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | K160 | A156-K160 WeakPolarHBondContact O-CB 3.28Å; A156-K160 PolarHBondContact O-N 2.91Å |
| 157 | T | 71 | Confident | 70.4 | Confident | 79 Ų | 79 | 91.8 Ų | 91.8 | 49% | 0.485 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -64.6 | -43.8 | 172.7 | -52.3 | 0 | 0 | 0 | 0 | 112.3 | T155 L161 F286 | T155-T157 PolarHBondContact O-N 3.18Å; T155-T157 VanDerWaalsContact O-N 3.17Å; T157-L161 WeakPolarHBondContact O-CB 3.49Å; T157-L161 PolarHBondContact O-N 3.01Å; T157-F286 HydrophobicContact CG2-CD1 4.03Å; T157-F286 HydrophobicContact CG2-CE1 3.52Å; T157-F286 HydrophobicContact CG2-CZ 4.43Å |
| 158 | G | 75.6 | Confident | 70.1 | Confident | 5 Ų | 5 | 86.9 Ų | 86.9 | 5% | 0.052 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -62.4 | -45.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L152 T155 K160 L161 R162 | L152-G158 CarbonylContact O-C 2.86Å; L152-G158 WeakPolarHBondContact O-CA 3.47Å; T155-G158 CarbonylContact O-C 3.27Å; T155-G158 WeakPolarHBondContact O-CA 3.49Å; T155-G158 PolarHBondContact O-N 3.22Å; T155-G158 PolarHBondContact OG1-N 3.46Å; G158-K160 PolarHBondContact O-N 2.94Å; G158-L161 CarbonylContact O-C 3.52Å; G158-L161 WeakPolarHBondContact O-CA 3.49Å; G158-L161 WeakPolarHBondContact O-CB 3.35Å; G158-L161 PolarHBondContact O-N 3.4Å; G158-R162 PolarHBondContact O-N 3.36Å |
| 159 | Q | 77.7 | Confident | 69.9 | Low | 94 Ų | 94 | 89.1 Ų | 89.1 | 44% | 0.439 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -65.2 | -42.3 | -178.9 | -69 | 174.5 | -0.5 | 0 | 0 | 110.4 | L152 D153 T155 L161 R162 N163 | L152-Q159 VanDerWaalsContact O-CA 3.28Å; L152-Q159 WeakPolarHBondContact O-CA 3.32Å; L152-Q159 WeakPolarHBondContact O-CG 3.48Å; L152-Q159 PolarHBondContact O-N 3.03Å; D153-Q159 PolarHBondContact O-NE2 3.18Å; T155-Q159 WeakPolarHBondContact O-CG 3.47Å; T155-Q159 PolarHBondContact O-N 3.05Å; Q159-L161 PolarHBondContact O-N 3.36Å; Q159-R162 PolarHBondContact O-N 2.88Å; Q159-N163 WeakPolarHBondContact O-CB 3.4Å; Q159-N163 PolarHBondContact O-N 3.42Å; Q159-N163 PolarHBondContact O-OD1 2.79Å |
| 160 | K | 76.2 | Confident | 69.3 | Low | 146 Ų | 146 | 87.1 Ų | 87.1 | 64% | 0.635 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -59.5 | -33 | 170.9 | -173.2 | 175.7 | -177.4 | 178.2 | 0 | 112.5 | A156 G158 R164 | A156-K160 WeakPolarHBondContact O-CB 3.28Å; A156-K160 PolarHBondContact O-N 2.91Å; G158-K160 PolarHBondContact O-N 2.94Å; K160-R164 WeakPolarHBondContact O-CG 3.31Å; K160-R164 PolarHBondContact O-N 3.31Å |
| 161 | L | 69.3 | Low | 68.5 | Low | 42 Ų | 42 | 85.2 Ų | 85.2 | 22% | 0.22 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -77.5 | -41.2 | 177.9 | -165.3 | 134 | 0 | 0 | 0 | 111.9 | L149 L152 T157 G158 Q159 R164 Y165 L170 | L149-L161 HydrophobicContact CD1-CD2 4.33Å; L152-L161 HydrophobicContact CD2-CB 4.37Å; L152-L161 HydrophobicContact CD2-CD2 3.49Å; L152-L161 VanDerWaalsContact CD2-CD2 3.49Å; T157-L161 WeakPolarHBondContact O-CB 3.49Å; T157-L161 PolarHBondContact O-N 3.01Å; G158-L161 CarbonylContact O-C 3.52Å; G158-L161 WeakPolarHBondContact O-CA 3.49Å; G158-L161 WeakPolarHBondContact O-CB 3.35Å; G158-L161 PolarHBondContact O-N 3.4Å; Q159-L161 PolarHBondContact O-N 3.36Å; L161-R164 PolarHBondContact O-N 2.85Å; L161-Y165 HydrophobicContact CD2-CD2 3.91Å; L161-Y165 HydrophobicContact CD2-CE2 3.47Å; L161-Y165 VanDerWaalsContact CD2-CE2 3.47Å; L161-Y165 HydrophobicContact CG-CE2 4.4Å; L161-Y165 WeakPolarHBondContact O-CD2 3.17Å; L161-Y165 PolarHBondContact O-N 2.98Å; L161-Y165 VanDerWaalsContact O-N 3.1Å; L161-L170 HydrophobicContact CG-CD1 4.26Å |
| 162 | R | 73.1 | Confident | 67.7 | Low | 101 Ų | 101 | 86.3 Ų | 86.3 | 38% | 0.381 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -57.4 | -46.5 | 169.8 | 172.5 | 175.1 | 166.2 | -178.9 | -0.2 | 111.4 | L152 D153 G158 Q159 R164 Y165 H166 | L152-R162 HydrophobicContact CD2-CB 4.18Å; D153-R162 WeakPolarHBondContact OD1-CD 3.43Å; D153-R162 IonicContact OD1-CZ 3.75Å; D153-R162 IonicContact OD1-NE 2.67Å; D153-R162 IonicContact OD1-NH1 2.65Å; D153-R162 PolarHBondContact OD1-NH1 3.02Å; D153-R162 IonicContact OD2-NH1 3.59Å; G158-R162 PolarHBondContact O-N 3.36Å; Q159-R162 PolarHBondContact O-N 2.88Å; R162-R164 PolarHBondContact O-N 3.06Å; R162-Y165 WeakPolarHBondContact O-CB 3.27Å; R162-Y165 PolarHBondContact O-N 3.47Å; R162-Y165 VanDerWaalsContact O-N 3.15Å; R162-H166 VanDerWaalsContact CD-NE2 3.29Å; R162-H166 WeakPolarHBondContact CD-NE2 3.34Å; R162-H166 WeakPolarHBondContact CG-NE2 3.37Å; R162-H166 PolarHBondContact NE-NE2 3.33Å; R162-H166 PolarHBondContact O-CD2 3.24Å; R162-H166 PolarHBondContact O-N 2.87Å |
| 163 | N | 71.1 | Confident | 66.7 | Low | 81 Ų | 81 | 88.4 Ų | 88.4 | 43% | 0.433 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.5 | -43.4 | 178.5 | -67.1 | -2.6 | 0 | 0 | 0 | 111.2 | Q159 Y165 H166 E167 | Q159-N163 WeakPolarHBondContact O-CB 3.4Å; Q159-N163 PolarHBondContact O-N 3.42Å; Q159-N163 PolarHBondContact O-OD1 2.79Å; N163-Y165 VanDerWaalsContact C-N 3.28Å; N163-Y165 PolarHBondContact O-N 3.31Å; N163-H166 PolarHBondContact O-N 3.3Å; N163-E167 VanDerWaalsContact O-CB 3.31Å; N163-E167 WeakPolarHBondContact O-CB 3.17Å; N163-E167 WeakPolarHBondContact O-CG 3.38Å; N163-E167 PolarHBondContact O-N 3.27Å |
| 164 | R | 68.3 | Low | 65.3 | Low | 102 Ų | 102 | 87 Ų | 87 | 39% | 0.385 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.6 | -28.6 | 174 | -72.6 | -170.2 | -58.3 | 161.5 | 4 | 114.5 | K160 L161 R162 G168 K169 L170 | K160-R164 WeakPolarHBondContact O-CG 3.31Å; K160-R164 PolarHBondContact O-N 3.31Å; L161-R164 PolarHBondContact O-N 2.85Å; R162-R164 PolarHBondContact O-N 3.06Å; R164-G168 PolarHBondContact O-N 2.81Å; R164-K169 HydrophobicContact CB-CB 4.46Å; R164-K169 PolarHBondContact O-N 3.18Å; R164-L170 HydrophobicContact CB-CD1 3.91Å; R164-L170 HydrophobicContact CB-CG 3.98Å; R164-L170 PolarHBondContact O-N 2.65Å |
| 165 | Y | 65.6 | Low | 63.9 | Low | 108 Ų | 108 | 87.6 Ų | 87.6 | 42% | 0.424 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -69.8 | -49.2 | 170.7 | -85.1 | -61.7 | 0 | 0 | 0 | 111.5 | L161 R162 N163 E167 G168 L170 | L161-Y165 HydrophobicContact CD2-CD2 3.91Å; L161-Y165 HydrophobicContact CD2-CE2 3.47Å; L161-Y165 VanDerWaalsContact CD2-CE2 3.47Å; L161-Y165 HydrophobicContact CG-CE2 4.4Å; L161-Y165 WeakPolarHBondContact O-CD2 3.17Å; L161-Y165 PolarHBondContact O-N 2.98Å; L161-Y165 VanDerWaalsContact O-N 3.1Å; R162-Y165 WeakPolarHBondContact O-CB 3.27Å; R162-Y165 PolarHBondContact O-N 3.47Å; R162-Y165 VanDerWaalsContact O-N 3.15Å; N163-Y165 VanDerWaalsContact C-N 3.28Å; N163-Y165 PolarHBondContact O-N 3.31Å; Y165-E167 VanDerWaalsContact C-N 3.29Å; Y165-E167 PolarHBondContact O-N 3.22Å; Y165-G168 PolarHBondContact O-N 3.36Å; Y165-G168 VanDerWaalsContact O-N 3.08Å; Y165-L170 HydrophobicContact CD1-CB 3.73Å; Y165-L170 HydrophobicContact CD1-CD1 3.92Å; Y165-L170 HydrophobicContact CD1-CG 4.48Å; Y165-L170 HydrophobicContact CD2-CD1 3.8Å; Y165-L170 HydrophobicContact CE1-CB 3.82Å; Y165-L170 HydrophobicContact CE1-CD1 3.92Å; Y165-L170 HydrophobicContact CE2-CD1 3.82Å; Y165-L170 HydrophobicContact CG-CB 4.36Å; Y165-L170 HydrophobicContact CG-CD1 3.86Å |
| 166 | H | 66 | Low | 62.3 | Low | 165 Ų | 165 | 88.4 Ų | 88.4 | 76% | 0.764 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.4 | -34.8 | 177.2 | -71.5 | -58.3 | 0 | 0 | 0 | 112.8 | R162 N163 G168 | R162-H166 VanDerWaalsContact CD-NE2 3.29Å; R162-H166 WeakPolarHBondContact CD-NE2 3.34Å; R162-H166 WeakPolarHBondContact CG-NE2 3.37Å; R162-H166 PolarHBondContact NE-NE2 3.33Å; R162-H166 PolarHBondContact O-CD2 3.24Å; R162-H166 PolarHBondContact O-N 2.87Å; N163-H166 PolarHBondContact O-N 3.3Å; H166-G168 PolarHBondContact O-N 3.37Å |
| 167 | E | 70.4 | Confident | 60.8 | Low | 104 Ų | 104 | 88.8 Ų | 88.8 | 49% | 0.486 | 49% | 0.487 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.8 | -1.2 | 175.9 | -68.7 | 165.1 | -149.8 | 0 | 0 | 113.7 | N163 Y165 K169 | N163-E167 VanDerWaalsContact O-CB 3.31Å; N163-E167 WeakPolarHBondContact O-CB 3.17Å; N163-E167 WeakPolarHBondContact O-CG 3.38Å; N163-E167 PolarHBondContact O-N 3.27Å; Y165-E167 VanDerWaalsContact C-N 3.29Å; Y165-E167 PolarHBondContact O-N 3.22Å; E167-K169 HydrophobicContact CB-CD 4.16Å; E167-K169 HydrophobicContact CB-CG 4.07Å; E167-K169 PolarHBondContact O-N 2.83Å; E167-K169 VanDerWaalsContact OE2-CD 3.27Å; E167-K169 WeakPolarHBondContact OE2-CD 3.28Å; E167-K169 WeakPolarHBondContact OE2-CE 3.21Å; E167-K169 IonicContact OE2-NZ 2.64Å; E167-K169 PolarHBondContact OE2-NZ 3.06Å |
| 168 | G | 58.3 | Low | 59.3 | Low | 47 Ų | 47 | 89.8 Ų | 89.8 | 49% | 0.485 | 49% | 0.49 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 66.8 | 4.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | R164 Y165 H166 L170 A171 | R164-G168 PolarHBondContact O-N 2.81Å; Y165-G168 PolarHBondContact O-N 3.36Å; Y165-G168 VanDerWaalsContact O-N 3.08Å; H166-G168 PolarHBondContact O-N 3.37Å; G168-L170 PolarHBondContact O-N 3.1Å; G168-A171 PolarHBondContact O-N 2.67Å; G168-A171 VanDerWaalsContact O-N 3.15Å |
| 169 | K | 59.4 | Low | 57.7 | Low | 151 Ų | 151 | 99.3 Ų | 99.3 | 66% | 0.657 | 52% | 0.524 | S | S | * | . | trans | -73.4 | -15.6 | -179.9 | -66.1 | 178.5 | -172.2 | 161.3 | 0 | 113.1 | R164 E167 A171 | R164-K169 HydrophobicContact CB-CB 4.46Å; R164-K169 PolarHBondContact O-N 3.18Å; E167-K169 HydrophobicContact CB-CD 4.16Å; E167-K169 HydrophobicContact CB-CG 4.07Å; E167-K169 PolarHBondContact O-N 2.83Å; E167-K169 VanDerWaalsContact OE2-CD 3.27Å; E167-K169 WeakPolarHBondContact OE2-CD 3.28Å; E167-K169 WeakPolarHBondContact OE2-CE 3.21Å; E167-K169 IonicContact OE2-NZ 2.64Å; E167-K169 PolarHBondContact OE2-NZ 3.06Å; K169-A171 VanDerWaalsContact C-N 3.34Å | ||
| 170 | L | 56.9 | Low | 56 | Low | 49 Ų | 49 | 100.4 Ų | 100.4 | 26% | 0.257 | 54% | 0.537 | S | S | . | . | S | Bend | trans | -99.1 | 57.2 | 162.3 | -67.9 | 170.2 | 0 | 0 | 0 | 109.3 | L161 R164 Y165 G168 | L161-L170 HydrophobicContact CG-CD1 4.26Å; R164-L170 HydrophobicContact CB-CD1 3.91Å; R164-L170 HydrophobicContact CB-CG 3.98Å; R164-L170 PolarHBondContact O-N 2.65Å; Y165-L170 HydrophobicContact CD1-CB 3.73Å; Y165-L170 HydrophobicContact CD1-CD1 3.92Å; Y165-L170 HydrophobicContact CD1-CG 4.48Å; Y165-L170 HydrophobicContact CD2-CD1 3.8Å; Y165-L170 HydrophobicContact CE1-CB 3.82Å; Y165-L170 HydrophobicContact CE1-CD1 3.92Å; Y165-L170 HydrophobicContact CE2-CD1 3.82Å; Y165-L170 HydrophobicContact CG-CB 4.36Å; Y165-L170 HydrophobicContact CG-CD1 3.86Å; G168-L170 PolarHBondContact O-N 3.1Å |
| 171 | A | 49 | Very low | 54.5 | Low | 70 Ų | 70 | 98.7 Ų | 98.7 | 58% | 0.579 | 54% | 0.535 | S | S | * | . | P | Polyproline II helix | trans | -58.9 | 133.5 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | G168 K169 I173 | G168-A171 PolarHBondContact O-N 2.67Å; G168-A171 VanDerWaalsContact O-N 3.15Å; K169-A171 VanDerWaalsContact C-N 3.34Å; A171-I173 PolarHBondContact O-N 2.91Å |
| 172 | P | 48.1 | Very low | 53.2 | Low | 85 Ų | 85 | 104.4 Ų | 104.4 | 55% | 0.552 | 55% | 0.553 | S | S | * | * | P | Polyproline II helix | trans | -52 | 139 | 156.4 | -18.6 | 31.2 | 0 | 0 | 0 | 107.6 | A174 | P172-A174 PolarHBondContact O-N 3.04Å; P172-A174 VanDerWaalsContact O-N 3.17Å |
| 173 | I | 49.2 | Very low | 51.8 | Low | 66 Ų | 66 | 102.3 Ų | 102.3 | 34% | 0.338 | 55% | 0.553 | S | S | . | * | S | Bend | trans | -49.7 | 128.5 | 173.1 | -66.5 | -174.3 | 0 | 0 | 0 | 107.6 | L142 A171 I177 | L142-I173 HydrophobicContact CD1-CB 4.22Å; L142-I173 HydrophobicContact CD1-CD1 3.78Å; L142-I173 HydrophobicContact CD1-CG1 4.23Å; L142-I173 HydrophobicContact CD2-CD1 3.55Å; L142-I173 HydrophobicContact CD2-CG1 3.84Å; L142-I173 HydrophobicContact CG-CD1 4.31Å; A171-I173 PolarHBondContact O-N 2.91Å; I173-I177 HydrophobicContact CG2-CB 3.59Å; I173-I177 HydrophobicContact CG2-CD1 3.39Å; I173-I177 HydrophobicContact CG2-CG1 4.02Å; I173-I177 HydrophobicContact CG2-CG2 3.79Å |
| 174 | A | 42.4 | Very low | 50.5 | Low | 60 Ų | 60 | 100.5 Ų | 100.5 | 50% | 0.496 | 55% | 0.546 | S | S | . | . | P | Polyproline II helix | trans | -53.8 | 146.5 | -163.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | P172 G176 I177 | P172-A174 PolarHBondContact O-N 3.04Å; P172-A174 VanDerWaalsContact O-N 3.17Å; A174-G176 PolarHBondContact O-N 2.95Å; A174-I177 PolarHBondContact O-N 2.95Å |
| 175 | P | 44.6 | Very low | 49.6 | Very low | 149 Ų | 149 | 98.6 Ų | 98.6 | 97% | 0.968 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.5 | 6 | -173.6 | -25.2 | 34.8 | 0 | 0 | 0 | 117.5 | ||
| 176 | G | 41.5 | Very low | 48.9 | Very low | 72 Ų | 72 | 98.2 Ų | 98.2 | 74% | 0.742 | 55% | 0.55 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.4 | -3.7 | 176 | 0 | 0 | 0 | 0 | 0 | 115.3 | A174 N178 | A174-G176 PolarHBondContact O-N 2.95Å; G176-N178 PolarHBondContact O-N 3.34Å |
| 177 | I | 44 | Very low | 48.3 | Very low | 89 Ų | 89 | 97.9 Ų | 97.9 | 46% | 0.456 | 54% | 0.542 | S | S | . | . | S | Bend | trans | -77.3 | 113.2 | 166.6 | -73.2 | 166.1 | 0 | 0 | 0 | 106.7 | I173 A174 | I173-I177 HydrophobicContact CG2-CB 3.59Å; I173-I177 HydrophobicContact CG2-CD1 3.39Å; I173-I177 HydrophobicContact CG2-CG1 4.02Å; I173-I177 HydrophobicContact CG2-CG2 3.79Å; A174-I177 PolarHBondContact O-N 2.95Å |
| 178 | N | 39.1 | Very low | 47.5 | Very low | 100 Ų | 100 | 95.4 Ų | 95.4 | 54% | 0.535 | 54% | 0.539 | S | S | . | . | trans | -67.8 | 146.5 | -167.4 | -146.5 | -24.8 | 0 | 0 | 0 | 109.3 | G176 V180 D181 | G176-N178 PolarHBondContact O-N 3.34Å; N178-V180 HydrophobicContact CB-CB 4.36Å; N178-V180 HydrophobicContact CB-CG2 4.45Å; N178-V180 PolarHBondContact O-N 3.06Å; N178-D181 PolarHBondContact O-N 3.15Å | ||
| 179 | R | 42.4 | Very low | 47.4 | Very low | 204 Ų | 204 | 96 Ų | 96 | 77% | 0.77 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.8 | -3.9 | 178.9 | -147 | 177.4 | -176.6 | -175.4 | -0 | 113.2 | ||
| 180 | V | 41.7 | Very low | 47.3 | Very low | 117 Ų | 117 | 92.7 Ų | 92.7 | 71% | 0.709 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.1 | -33.6 | 179.4 | -175.7 | 0 | 0 | 0 | 0 | 112 | N178 | N178-V180 HydrophobicContact CB-CB 4.36Å; N178-V180 HydrophobicContact CB-CG2 4.45Å; N178-V180 PolarHBondContact O-N 3.06Å |
| 181 | D | 43.5 | Very low | 47.3 | Very low | 111 Ų | 111 | 92.4 Ų | 92.4 | 59% | 0.594 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | -19.9 | -171.6 | -57.7 | -42.7 | 0 | 0 | 0 | 113.2 | N178 | N178-D181 PolarHBondContact O-N 3.15Š|
| 182 | W | 41.8 | Very low | 47.6 | Very low | 162 Ų | 162 | 93.8 Ų | 93.8 | 61% | 0.614 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -122.4 | 115.6 | 174.8 | -82.4 | 92.5 | 0 | 0 | 0 | 110.4 | C184 | W182-C184 PolarHBondContact O-N 3.42Š|
| 183 | P | 43.5 | Very low | 48.3 | Very low | 56 Ų | 56 | 90.3 Ų | 90.3 | 36% | 0.364 | 49% | 0.485 | S | S | . | . | trans | -62.7 | 106.9 | 178.6 | 24.3 | -32.1 | 0 | 0 | 0 | 109.9 | F185 | P183-F185 VanDerWaalsContact C-N 3.3Å; P183-F185 HydrophobicContact CB-CE1 4.31Å; P183-F185 HydrophobicContact CB-CE2 4.28Å; P183-F185 HydrophobicContact CB-CZ 4.08Å; P183-F185 HydrophobicContact CG-CE1 4.4Å; P183-F185 HydrophobicContact CG-CE2 3.87Å; P183-F185 HydrophobicContact CG-CZ 3.72Å; P183-F185 WeakPolarHBondContact O-CD2 3.32Å; P183-F185 PolarHBondContact O-N 3.46Å | ||
| 184 | C | 44.7 | Very low | 48.9 | Very low | 44 Ų | 44 | 93.2 Ų | 93.2 | 30% | 0.297 | 50% | 0.496 | S | S | . | . | trans | -72.4 | 88.8 | 170.1 | -67.1 | 0 | 0 | 0 | 0 | 107.9 | W182 T186 | W182-C184 PolarHBondContact O-N 3.42Å; C184-T186 PolarHBondContact O-N 3.39Å; C184-T186 PolarHBondContact O-OG1 2.89Å | ||
| 185 | F | 48.5 | Very low | 49.7 | Very low | 61 Ų | 61 | 96.4 Ų | 96.4 | 27% | 0.268 | 50% | 0.499 | S | S | . | . | trans | -59.2 | 77.9 | 179.6 | -62.9 | -78.4 | 0 | 0 | 0 | 111.8 | L141 P183 D191 W192 | L141-F185 HydrophobicContact CD1-CD2 4.28Å; P183-F185 VanDerWaalsContact C-N 3.3Å; P183-F185 HydrophobicContact CB-CE1 4.31Å; P183-F185 HydrophobicContact CB-CE2 4.28Å; P183-F185 HydrophobicContact CB-CZ 4.08Å; P183-F185 HydrophobicContact CG-CE1 4.4Å; P183-F185 HydrophobicContact CG-CE2 3.87Å; P183-F185 HydrophobicContact CG-CZ 3.72Å; P183-F185 WeakPolarHBondContact O-CD2 3.32Å; P183-F185 PolarHBondContact O-N 3.46Å; F185-D191 WeakPolarHBondContact CA-OD2 3.34Å; F185-D191 HydrophobicContact CD1-CB 3.63Å; F185-D191 HydrophobicContact CE1-CB 4.19Å; F185-W192 HydrophobicContact CD1-CD2 4.47Å; F185-W192 HydrophobicContact CD1-CG 4.42Å; F185-W192 AromaticContact CD1-NE1 3.87Å; F185-W192 AromaticContact CE1-CD2 3.8Å; F185-W192 HydrophobicContact CE1-CD2 3.8Å; F185-W192 AromaticContact CE1-CE2 3.69Å; F185-W192 HydrophobicContact CE1-CE3 4.32Å; F185-W192 HydrophobicContact CE1-CG 4.09Å; F185-W192 HydrophobicContact CE1-CZ2 4.11Å; F185-W192 AromaticContact CE1-NE1 3.88Å; F185-W192 HydrophobicContact CZ-CD2 4.4Å; F185-W192 HydrophobicContact CZ-CH2 4.27Å; F185-W192 HydrophobicContact CZ-CZ2 4.02Å | ||
| 186 | T | 51.6 | Low | 50.4 | Low | 100 Ų | 100 | 93.6 Ų | 93.6 | 61% | 0.613 | 48% | 0.479 | S | S | * | . | S | Bend | trans | -102.5 | -21.1 | -176.9 | 38.2 | 0 | 0 | 0 | 0 | 110.7 | C184 D191 | C184-T186 PolarHBondContact O-N 3.39Å; C184-T186 PolarHBondContact O-OG1 2.89Å; T186-D191 PolarHBondContact N-OD2 3.22Å |
| 187 | R | 52.6 | Low | 51.7 | Low | 158 Ų | 158 | 90.8 Ų | 90.8 | 60% | 0.596 | 45% | 0.448 | S | S | * | . | S | Bend | trans | -132.8 | 76.6 | 169.4 | -65.7 | -172.7 | 66.4 | 155 | 1.9 | 107.7 | I189 E190 D191 | R187-I189 VanDerWaalsContact C-N 3.29Å; R187-I189 PolarHBondContact O-N 3.49Å; R187-I189 VanDerWaalsContact O-N 3.07Å; R187-E190 HydrophobicContact CB-CB 4.32Å; R187-E190 WeakPolarHBondContact CB-OE2 3.31Å; R187-E190 IonicContact CZ-OE1 3.87Å; R187-E190 IonicContact NE-OE1 3.85Å; R187-E190 PolarHBondContact NE-OE1 2.92Å; R187-E190 IonicContact NE-OE2 2.65Å; R187-E190 IonicContact NH2-OE1 3.21Å; R187-E190 PolarHBondContact NH2-OE1 3.39Å; R187-E190 PolarHBondContact O-N 2.92Å; R187-D191 VanDerWaalsContact C-OD2 3.23Å; R187-D191 WeakPolarHBondContact CA-OD2 3.49Å; R187-D191 PolarHBondContact N-OD2 3.28Å; R187-D191 WeakPolarHBondContact O-CB 3.48Å; R187-D191 PolarHBondContact O-N 3.19Å; R187-D191 VanDerWaalsContact O-OD2 3.12Å |
| 188 | A | 54.1 | Low | 52.3 | Low | 53 Ų | 53 | 91.3 Ų | 91.3 | 44% | 0.438 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -48.8 | -45.4 | -163.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | W192 | A188-W192 VanDerWaalsContact O-CB 3.28Å; A188-W192 WeakPolarHBondContact O-CB 3.28Å; A188-W192 PolarHBondContact O-N 3.33Å |
| 189 | I | 55.5 | Low | 53.3 | Low | 59 Ų | 59 | 90 Ų | 90 | 30% | 0.303 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -68.1 | -39.4 | -176.9 | -173.1 | 174.6 | 0 | 0 | 0 | 112.8 | R187 S193 L204 P205 C206 | R187-I189 VanDerWaalsContact C-N 3.29Å; R187-I189 PolarHBondContact O-N 3.49Å; R187-I189 VanDerWaalsContact O-N 3.07Å; I189-S193 WeakPolarHBondContact O-CB 3.47Å; I189-S193 PolarHBondContact O-N 3.47Å; I189-S193 PolarHBondContact O-OG 3.02Å; I189-L204 HydrophobicContact CD1-CB 4.32Å; I189-L204 HydrophobicContact CG1-CB 3.81Å; I189-P205 WeakPolarHBondContact CD1-O 3.36Å; I189-C206 HydrophobicContact CD1-CB 3.93Å |
| 190 | E | 59 | Low | 54.1 | Low | 82 Ų | 82 | 81.7 Ų | 81.7 | 38% | 0.383 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -69.9 | -45.4 | 175.2 | -62.4 | 92.2 | 148.9 | 0 | 0 | 111.6 | R187 W192 S193 H194 | R187-E190 HydrophobicContact CB-CB 4.32Å; R187-E190 WeakPolarHBondContact CB-OE2 3.31Å; R187-E190 IonicContact CZ-OE1 3.87Å; R187-E190 IonicContact NE-OE1 3.85Å; R187-E190 PolarHBondContact NE-OE1 2.92Å; R187-E190 IonicContact NE-OE2 2.65Å; R187-E190 IonicContact NH2-OE1 3.21Å; R187-E190 PolarHBondContact NH2-OE1 3.39Å; R187-E190 PolarHBondContact O-N 2.92Å; E190-W192 PolarHBondContact O-N 3.38Å; E190-S193 WeakPolarHBondContact O-CB 3.35Å; E190-S193 PolarHBondContact O-N 2.93Å; E190-H194 PolarHBondContact O-N 3.38Å |
| 191 | D | 57.2 | Low | 55 | Low | 43 Ų | 43 | 83.4 Ų | 83.4 | 23% | 0.23 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -63 | -42.6 | -179.7 | -63.4 | -31.9 | 0 | 0 | 0 | 111.3 | F185 T186 R187 F195 | F185-D191 WeakPolarHBondContact CA-OD2 3.34Å; F185-D191 HydrophobicContact CD1-CB 3.63Å; F185-D191 HydrophobicContact CE1-CB 4.19Å; T186-D191 PolarHBondContact N-OD2 3.22Å; R187-D191 VanDerWaalsContact C-OD2 3.23Å; R187-D191 WeakPolarHBondContact CA-OD2 3.49Å; R187-D191 PolarHBondContact N-OD2 3.28Å; R187-D191 WeakPolarHBondContact O-CB 3.48Å; R187-D191 PolarHBondContact O-N 3.19Å; R187-D191 VanDerWaalsContact O-OD2 3.12Å; D191-F195 WeakPolarHBondContact O-CB 3.31Å; D191-F195 PolarHBondContact O-N 3.48Å |
| 192 | W | 55.1 | Low | 55.6 | Low | 98 Ų | 98 | 85 Ų | 85 | 37% | 0.371 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -69.1 | -35.2 | 173.3 | -79.2 | 114 | 0 | 0 | 0 | 112.9 | F185 A188 E190 F195 V196 L204 | F185-W192 HydrophobicContact CD1-CD2 4.47Å; F185-W192 HydrophobicContact CD1-CG 4.42Å; F185-W192 AromaticContact CD1-NE1 3.87Å; F185-W192 AromaticContact CE1-CD2 3.8Å; F185-W192 HydrophobicContact CE1-CD2 3.8Å; F185-W192 AromaticContact CE1-CE2 3.69Å; F185-W192 HydrophobicContact CE1-CE3 4.32Å; F185-W192 HydrophobicContact CE1-CG 4.09Å; F185-W192 HydrophobicContact CE1-CZ2 4.11Å; F185-W192 AromaticContact CE1-NE1 3.88Å; F185-W192 HydrophobicContact CZ-CD2 4.4Å; F185-W192 HydrophobicContact CZ-CH2 4.27Å; F185-W192 HydrophobicContact CZ-CZ2 4.02Å; A188-W192 VanDerWaalsContact O-CB 3.28Å; A188-W192 WeakPolarHBondContact O-CB 3.28Å; A188-W192 PolarHBondContact O-N 3.33Å; E190-W192 PolarHBondContact O-N 3.38Å; W192-F195 AromaticContact CE3-CD1 3.99Å; W192-F195 HydrophobicContact CE3-CD1 3.99Å; W192-F195 AromaticContact CZ3-CD1 3.94Å; W192-F195 HydrophobicContact CZ3-CD1 3.94Å; W192-F195 HydrophobicContact CZ3-CE1 4.21Å; W192-F195 PolarHBondContact O-N 2.98Å; W192-V196 WeakPolarHBondContact O-CB 3.4Å; W192-V196 WeakPolarHBondContact O-CG2 3.34Å; W192-V196 PolarHBondContact O-N 2.93Å; W192-L204 HydrophobicContact CB-CD1 3.5Å; W192-L204 HydrophobicContact CG-CD1 4.47Å |
| 193 | S | 62.7 | Low | 56.4 | Low | 13 Ų | 13 | 84.9 Ų | 84.9 | 9% | 0.091 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -63 | -45 | 175.6 | -62.8 | 0 | 0 | 0 | 0 | 111.3 | I189 E190 F195 V196 S197 L204 | I189-S193 WeakPolarHBondContact O-CB 3.47Å; I189-S193 PolarHBondContact O-N 3.47Å; I189-S193 PolarHBondContact O-OG 3.02Å; E190-S193 WeakPolarHBondContact O-CB 3.35Å; E190-S193 PolarHBondContact O-N 2.93Å; S193-F195 VanDerWaalsContact C-N 3.34Å; S193-F195 PolarHBondContact O-N 3.02Å; S193-V196 PolarHBondContact O-N 3.17Å; S193-S197 PolarHBondContact O-N 2.85Å; S193-L204 PolarHBondContact OG-N 3.36Å |
| 194 | H | 61.2 | Low | 57.1 | Low | 127 Ų | 127 | 85.6 Ų | 85.6 | 59% | 0.588 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -66.3 | -34.1 | 176.3 | -176.1 | -86.6 | 0 | 0 | 0 | 112.6 | E190 S197 S198 | E190-H194 PolarHBondContact O-N 3.38Å; H194-S197 CarbonylContact O-C 3.56Å; H194-S197 VanDerWaalsContact O-C 3.27Å; H194-S198 WeakPolarHBondContact O-CA 3.43Å; H194-S198 PolarHBondContact O-N 3.06Å |
| 195 | F | 59 | Low | 57.6 | Low | 126 Ų | 126 | 89.2 Ų | 89.2 | 55% | 0.553 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -68.3 | -41.6 | 174.5 | 179.8 | -99.2 | 0 | 0 | 0 | 112.9 | D191 W192 S193 | D191-F195 WeakPolarHBondContact O-CB 3.31Å; D191-F195 PolarHBondContact O-N 3.48Å; W192-F195 AromaticContact CE3-CD1 3.99Å; W192-F195 HydrophobicContact CE3-CD1 3.99Å; W192-F195 AromaticContact CZ3-CD1 3.94Å; W192-F195 HydrophobicContact CZ3-CD1 3.94Å; W192-F195 HydrophobicContact CZ3-CE1 4.21Å; W192-F195 PolarHBondContact O-N 2.98Å; S193-F195 VanDerWaalsContact C-N 3.34Å; S193-F195 PolarHBondContact O-N 3.02Å |
| 196 | V | 60.4 | Low | 57.6 | Low | 90 Ų | 90 | 90.3 Ų | 90.3 | 55% | 0.545 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -73.8 | -35 | 179.3 | 172.2 | 0 | 0 | 0 | 0 | 111.8 | W192 S193 | W192-V196 WeakPolarHBondContact O-CB 3.4Å; W192-V196 WeakPolarHBondContact O-CG2 3.34Å; W192-V196 PolarHBondContact O-N 2.93Å; S193-V196 PolarHBondContact O-N 3.17Å |
| 197 | S | 67.7 | Low | 57.4 | Low | 13 Ų | 13 | 93.1 Ų | 93.1 | 9% | 0.091 | 50% | 0.495 | C | S | . | . | trans | -143.3 | 102.3 | 173.9 | -179.7 | 0 | 0 | 0 | 0 | 110 | S193 H194 A199 G200 E201 F202 | S193-S197 PolarHBondContact O-N 2.85Å; H194-S197 CarbonylContact O-C 3.56Å; H194-S197 VanDerWaalsContact O-C 3.27Å; S197-A199 PolarHBondContact O-N 3.33Å; S197-G200 WeakPolarHBondContact O-CA 3.39Å; S197-G200 PolarHBondContact O-N 3.07Å; S197-G200 PolarHBondContact OG-N 2.96Å; S197-E201 PolarHBondContact OG-N 3Å; S197-E201 VanDerWaalsContact OG-N 3.15Å; S197-F202 PolarHBondContact OG-N 3.03Å | ||
| 198 | S | 56.9 | Low | 57.1 | Low | 100 Ų | 100 | 90.3 Ų | 90.3 | 70% | 0.699 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.2 | -23.8 | 175.8 | 51.7 | 0 | 0 | 0 | 0 | 113.1 | H194 G200 | H194-S198 WeakPolarHBondContact O-CA 3.43Å; H194-S198 PolarHBondContact O-N 3.06Å; S198-G200 VanDerWaalsContact C-N 3.28Å |
| 199 | A | 61 | Low | 56.8 | Low | 73 Ų | 73 | 96.3 Ų | 96.3 | 60% | 0.603 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.2 | -10.9 | 170.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | S197 E201 | S197-A199 PolarHBondContact O-N 3.33Å; A199-E201 VanDerWaalsContact C-N 3.28Å; A199-E201 HydrophobicContact CB-CG 3.96Å; A199-E201 PolarHBondContact O-N 3.27Å |
| 200 | G | 58.6 | Low | 56.2 | Low | 30 Ų | 30 | 105.4 Ų | 105.4 | 31% | 0.309 | 55% | 0.546 | S | S | . | . | S | Bend | trans | 74 | 13.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 115 | S197 S198 K203 | S197-G200 WeakPolarHBondContact O-CA 3.39Å; S197-G200 PolarHBondContact O-N 3.07Å; S197-G200 PolarHBondContact OG-N 2.96Å; S198-G200 VanDerWaalsContact C-N 3.28Å; G200-K203 VanDerWaalsContact O-CE 3.24Å; G200-K203 WeakPolarHBondContact O-CE 3.4Å |
| 201 | E | 60.2 | Low | 55.6 | Low | 153 Ų | 153 | 107.6 Ų | 107.6 | 72% | 0.715 | 57% | 0.565 | S | S | * | * | trans | -70.5 | -38.5 | -179.9 | -63.7 | 175.7 | 161.1 | 0 | 0 | 111.5 | S197 A199 | S197-E201 PolarHBondContact OG-N 3Å; S197-E201 VanDerWaalsContact OG-N 3.15Å; A199-E201 VanDerWaalsContact C-N 3.28Å; A199-E201 HydrophobicContact CB-CG 3.96Å; A199-E201 PolarHBondContact O-N 3.27Å | ||
| 202 | F | 56.2 | Low | 55 | Low | 143 Ų | 143 | 114.8 Ų | 114.8 | 63% | 0.627 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -106.3 | 98.5 | 175.9 | -62.4 | -86.6 | 0 | 0 | 0 | 110.5 | S197 | S197-F202 PolarHBondContact OG-N 3.03Š|
| 203 | K | 59.4 | Low | 54.3 | Low | 160 Ų | 160 | 112.9 Ų | 112.9 | 70% | 0.696 | 61% | 0.608 | S | S | * | * | trans | -95.1 | 136.2 | 172.7 | -64.3 | 178.9 | -176.4 | 174.4 | 0 | 110 | G200 | G200-K203 VanDerWaalsContact O-CE 3.24Å; G200-K203 WeakPolarHBondContact O-CE 3.4Å | ||
| 204 | L | 57 | Low | 53.4 | Low | 71 Ų | 71 | 119.5 Ų | 119.5 | 37% | 0.372 | 64% | 0.642 | S | S | . | * | trans | -64.2 | 143.2 | 173.4 | -69.6 | -179.8 | 0 | 0 | 0 | 110.4 | I189 W192 S193 C206 | I189-L204 HydrophobicContact CD1-CB 4.32Å; I189-L204 HydrophobicContact CG1-CB 3.81Å; W192-L204 HydrophobicContact CB-CD1 3.5Å; W192-L204 HydrophobicContact CG-CD1 4.47Å; S193-L204 PolarHBondContact OG-N 3.36Å; L204-C206 PolarHBondContact O-N 3.07Å; L204-C206 VanDerWaalsContact O-N 3.1Å | ||
| 205 | P | 55.4 | Low | 52.7 | Low | 120 Ų | 120 | 117.7 Ų | 117.7 | 78% | 0.779 | 64% | 0.643 | S | S | * | * | trans | -59 | 115 | -178.6 | -25.4 | 34.6 | 0 | 0 | 0 | 112.4 | I189 L207 | I189-P205 WeakPolarHBondContact CD1-O 3.36Å; P205-L207 PolarHBondContact O-N 3.2Å | ||
| 206 | C | 48.1 | Very low | 52 | Low | 84 Ų | 84 | 113.9 Ų | 113.9 | 57% | 0.568 | 64% | 0.64 | S | S | * | * | trans | -79.8 | 113.1 | 176.6 | 56.7 | 0 | 0 | 0 | 0 | 110.9 | I189 L204 S208 | I189-C206 HydrophobicContact CD1-CB 3.93Å; L204-C206 PolarHBondContact O-N 3.07Å; L204-C206 VanDerWaalsContact O-N 3.1Å; C206-S208 PolarHBondContact O-N 3Å | ||
| 207 | L | 48.3 | Very low | 51.3 | Low | 159 Ų | 159 | 120.1 Ų | 120.1 | 83% | 0.832 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | 36.1 | -177 | -158.6 | 78.2 | 0 | 0 | 0 | 113.5 | P205 | P205-L207 PolarHBondContact O-N 3.2Š|
| 208 | S | 46.8 | Very low | 50 | Low | 100 Ų | 100 | 121.2 Ų | 121.2 | 70% | 0.699 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.2 | -13.8 | 175.9 | 61.8 | 0 | 0 | 0 | 0 | 113.1 | C206 | C206-S208 PolarHBondContact O-N 3Š|
| 209 | K | 46.3 | Very low | 49.7 | Very low | 179 Ų | 179 | 121.2 Ų | 121.2 | 78% | 0.778 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -101.9 | 137.7 | 173.5 | -64.2 | -177.6 | -178.2 | 178.8 | 0 | 109.9 | V211 | K209-V211 PolarHBondContact O-N 2.91Š|
| 210 | R | 44.2 | Very low | 49.2 | Very low | 250 Ų | 250 | 128.6 Ų | 128.6 | 94% | 0.943 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -61.5 | 119.7 | -174 | -75 | 178.2 | 172 | 173.5 | -3.3 | 111.5 | ||
| 211 | V | 45.1 | Very low | 48.8 | Very low | 127 Ų | 127 | 136.9 Ų | 136.9 | 77% | 0.77 | 70% | 0.696 | S | S | * | * | trans | 44.7 | 76.1 | 151.7 | -163.4 | 0 | 0 | 0 | 0 | 115.3 | K209 | K209-V211 PolarHBondContact O-N 2.91Š| ||
| 212 | E | 44.8 | Very low | 48.4 | Very low | 194 Ų | 194 | 134.9 Ų | 134.9 | 91% | 0.907 | 69% | 0.69 | S | S | * | * | trans | -83.6 | 114.7 | 130.1 | -75.3 | 177.4 | -176.9 | 0 | 0 | 106.1 | ||||
| 213 | G | 40.2 | Very low | 48.1 | Very low | 58 Ų | 58 | 136.8 Ų | 136.8 | 60% | 0.598 | 70% | 0.697 | S | S | * | * | trans | -65.1 | 135.9 | -170.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | S215 | G213-S215 VanDerWaalsContact C-N 3.27Å; G213-S215 PolarHBondContact O-N 2.87Å | ||
| 214 | L | 44.5 | Very low | 47.8 | Very low | 153 Ų | 153 | 134.8 Ų | 134.8 | 80% | 0.801 | 70% | 0.701 | S | S | * | * | trans | -63.8 | 85.3 | 172.1 | -105 | 136.5 | 0 | 0 | 0 | 110.6 | G216 | L214-G216 PolarHBondContact O-N 2.83Š| ||
| 215 | S | 46.4 | Very low | 47.6 | Very low | 89 Ų | 89 | 138.6 Ų | 138.6 | 62% | 0.622 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.8 | 25.9 | 176.8 | -159.2 | 0 | 0 | 0 | 0 | 113.3 | G213 | G213-S215 VanDerWaalsContact C-N 3.27Å; G213-S215 PolarHBondContact O-N 2.87Å |
| 216 | G | 45.5 | Very low | 47.4 | Very low | 46 Ų | 46 | 139.5 Ų | 139.5 | 47% | 0.474 | 73% | 0.725 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78.8 | -25.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114 | L214 V219 | L214-G216 PolarHBondContact O-N 2.83Å; G216-V219 VanDerWaalsContact O-CG2 3.29Å; G216-V219 WeakPolarHBondContact O-CG2 3.19Å |
| 217 | Y | 43.8 | Very low | 47.4 | Very low | 220 Ų | 220 | 141.3 Ų | 141.3 | 86% | 0.863 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.6 | -13.3 | -178.1 | -75.4 | -80.2 | 0 | 0 | 0 | 114 | ||
| 218 | A | 41 | Very low | 47.1 | Very low | 37 Ų | 37 | 141.7 Ų | 141.7 | 31% | 0.306 | 73% | 0.731 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -84 | -6.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114 | R220 Y221 L222 | A218-R220 PolarHBondContact O-N 3.08Å; A218-Y221 PolarHBondContact O-N 2.77Å; A218-L222 PolarHBondContact O-N 2.97Å |
| 219 | V | 50 | Low | 47.1 | Very low | 99 Ų | 99 | 140.7 Ų | 140.7 | 60% | 0.6 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.2 | -25.5 | -173.3 | 174.9 | 0 | 0 | 0 | 0 | 113.8 | G216 Y221 | G216-V219 VanDerWaalsContact O-CG2 3.29Å; G216-V219 WeakPolarHBondContact O-CG2 3.19Å; V219-Y221 VanDerWaalsContact C-N 3.29Å; V219-Y221 PolarHBondContact O-N 3.09Å |
| 220 | R | 50.6 | Low | 46.9 | Very low | 228 Ų | 228 | 142.6 Ų | 142.6 | 86% | 0.86 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.3 | -14.4 | 175.7 | -61.8 | -171.8 | -175.5 | -144.3 | 0.8 | 114.8 | A218 | A218-R220 PolarHBondContact O-N 3.08Š|
| 221 | Y | 50 | Low | 47 | Very low | 204 Ų | 204 | 141.4 Ų | 141.4 | 80% | 0.8 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.8 | -2.4 | -175.5 | -57.6 | -71.3 | 0 | 0 | 0 | 113.1 | A218 V219 | A218-Y221 PolarHBondContact O-N 2.77Å; V219-Y221 VanDerWaalsContact C-N 3.29Å; V219-Y221 PolarHBondContact O-N 3.09Å |
| 222 | L | 53.8 | Low | 46.7 | Very low | 112 Ų | 112 | 143.8 Ų | 143.8 | 59% | 0.586 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -77.6 | 128.7 | 170.4 | -65.8 | 175.6 | 0 | 0 | 0 | 109.2 | A218 | A218-L222 PolarHBondContact O-N 2.97Š|
| 223 | K | 48 | Very low | 46.5 | Very low | 182 Ų | 182 | 143.7 Ų | 143.7 | 79% | 0.791 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 137.1 | 164.4 | -171.9 | 179.3 | -179.6 | -177 | 0 | 107.5 | D225 | K223-D225 PolarHBondContact O-N 3.41Å; K223-D225 VanDerWaalsContact O-N 3.13Å |
| 224 | P | 53.7 | Low | 46.2 | Very low | 118 Ų | 118 | 145.4 Ų | 145.4 | 77% | 0.766 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 118.5 | 176.3 | 25.3 | -33.4 | 0 | 0 | 0 | 109.5 | ||
| 225 | D | 52.4 | Low | 45.9 | Very low | 152 Ų | 152 | 146.6 Ų | 146.6 | 81% | 0.813 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 139.9 | 171.6 | -78.4 | -39.1 | 0 | 0 | 0 | 109.9 | K223 T227 | K223-D225 PolarHBondContact O-N 3.41Å; K223-D225 VanDerWaalsContact O-N 3.13Å; D225-T227 PolarHBondContact O-N 2.67Å |
| 226 | V | 51.5 | Low | 45.3 | Very low | 138 Ų | 138 | 148.5 Ų | 148.5 | 84% | 0.836 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 121.2 | 174.5 | 179.9 | 0 | 0 | 0 | 0 | 108 | Q228 | V226-Q228 PolarHBondContact O-N 2.95Š|
| 227 | T | 47.8 | Very low | 44.7 | Very low | 123 Ų | 123 | 149.6 Ų | 149.6 | 76% | 0.755 | 76% | 0.762 | S | S | * | * | trans | -60.3 | 112 | -179 | 41.4 | 0 | 0 | 0 | 0 | 110.7 | D225 S229 | D225-T227 PolarHBondContact O-N 2.67Å; T227-S229 PolarHBondContact O-N 2.79Å | ||
| 228 | Q | 43.5 | Very low | 44.6 | Very low | 166 Ų | 166 | 143 Ų | 143 | 78% | 0.776 | 75% | 0.754 | S | S | * | * | trans | -71.2 | 80.2 | 171 | -69.1 | -166.3 | 29.5 | 0 | 0 | 109.7 | V226 | V226-Q228 PolarHBondContact O-N 2.95Š| ||
| 229 | S | 46.4 | Very low | 44.2 | Very low | 80 Ų | 80 | 154 Ų | 154 | 56% | 0.559 | 79% | 0.787 | S | S | * | * | trans | -75.3 | 146.4 | 159.5 | 52.6 | 0 | 0 | 0 | 0 | 109.2 | T227 | T227-S229 PolarHBondContact O-N 2.79Š| ||
| 230 | W | 42.3 | Very low | 43.5 | Very low | 218 Ų | 218 | 154.4 Ų | 154.4 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | trans | 70.4 | 62.6 | 174.5 | -37.1 | 100.8 | 0 | 0 | 0 | 116.8 | ||||
| 231 | R | 46.3 | Very low | 42.8 | Very low | 226 Ų | 226 | 147.1 Ų | 147.1 | 85% | 0.853 | 80% | 0.797 | S | S | * | * | trans | -117.7 | 87.2 | 138.6 | -72 | -170.7 | -167.7 | -96.5 | 0.7 | 109.3 | ||||
| 232 | Q | 37.9 | Very low | 42 | Very low | 176 Ų | 176 | 148.9 Ų | 148.9 | 82% | 0.822 | 80% | 0.802 | S | S | * | * | trans | -125.5 | 112.8 | 166.3 | -162.7 | 166.4 | 17.7 | 0 | 0 | 107 | A234 | Q232-A234 PolarHBondContact O-N 3.36Š| ||
| 233 | E | 40.1 | Very low | 41.3 | Very low | 193 Ų | 193 | 149.7 Ų | 149.7 | 90% | 0.902 | 81% | 0.814 | S | S | * | * | trans | -64 | 116.2 | 176.6 | -73.6 | 179.6 | 129.3 | 0 | 0 | 109.2 | L235 | E233-L235 PolarHBondContact O-N 3.24Å; E233-L235 VanDerWaalsContact O-N 3.11Å | ||
| 234 | A | 34.5 | Very low | 40.8 | Very low | 94 Ų | 94 | 147 Ų | 147 | 78% | 0.777 | 82% | 0.817 | S | S | * | * | trans | -75.8 | 97.7 | 170.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | Q232 C236 | Q232-A234 PolarHBondContact O-N 3.36Å; A234-C236 VanDerWaalsContact C-N 3.31Å; A234-C236 PolarHBondContact O-N 3.1Å | ||
| 235 | L | 38.8 | Very low | 39.9 | Very low | 177 Ų | 177 | 146.8 Ų | 146.8 | 93% | 0.927 | 82% | 0.818 | S | S | * | * | trans | -60.8 | 95.5 | 161.8 | -88.6 | 164 | 0 | 0 | 0 | 108.6 | E233 G237 | E233-L235 PolarHBondContact O-N 3.24Å; E233-L235 VanDerWaalsContact O-N 3.11Å; L235-G237 PolarHBondContact O-N 3.41Å | ||
| 236 | C | 33.5 | Very low | 39.5 | Very low | 129 Ų | 129 | 145.4 Ų | 145.4 | 87% | 0.872 | 82% | 0.817 | S | S | * | * | trans | -75.2 | 94.8 | -177.2 | -156.1 | 0 | 0 | 0 | 0 | 110 | A234 A238 | A234-C236 VanDerWaalsContact C-N 3.31Å; A234-C236 PolarHBondContact O-N 3.1Å; C236-A238 PolarHBondContact O-N 2.88Å | ||
| 237 | G | 33.5 | Very low | 39.2 | Very low | 69 Ų | 69 | 146.3 Ų | 146.3 | 71% | 0.711 | 82% | 0.817 | S | S | * | * | trans | -69.6 | 96.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L235 | L235-G237 PolarHBondContact O-N 3.41Š| ||
| 238 | A | 40.3 | Very low | 38.7 | Very low | 83 Ų | 83 | 145.8 Ų | 145.8 | 69% | 0.686 | 82% | 0.819 | S | S | * | * | trans | 30.2 | 103.7 | 146.4 | 0 | 0 | 0 | 0 | 0 | 119.5 | C236 | C236-A238 PolarHBondContact O-N 2.88Š| ||
| 239 | W | 32.5 | Very low | 38.4 | Very low | 268 Ų | 268 | 143.3 Ų | 143.3 | 100% | 1.015 | 82% | 0.82 | S | S | * | * | trans | -143.6 | 71.3 | 138.2 | -76.1 | 95.8 | 0 | 0 | 0 | 109.9 | ||||
| 240 | A | 36.7 | Very low | 37.8 | Very low | 107 Ų | 107 | 145.1 Ų | 145.1 | 88% | 0.884 | 83% | 0.831 | S | S | * | * | trans | -97.4 | 126 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 241 | G | 35.2 | Very low | 37.7 | Very low | 75 Ų | 75 | 140 Ų | 140 | 77% | 0.773 | 83% | 0.826 | S | S | * | * | trans | 134.7 | 61.5 | 158.9 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 242 | R | 32.7 | Very low | 37.4 | Very low | 240 Ų | 240 | 139 Ų | 139 | 91% | 0.906 | 82% | 0.824 | S | S | * | * | trans | -144.4 | 136.4 | 137.8 | -72.3 | -161.4 | -176 | -109.9 | -3.5 | 110 | ||||
| 243 | P | 40.3 | Very low | 37.6 | Very low | 129 Ų | 129 | 136.3 Ų | 136.3 | 84% | 0.838 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 147.4 | 173.2 | -12.4 | 28.5 | 0 | 0 | 0 | 111.7 | ||
| 244 | C | 36.3 | Very low | 37.9 | Very low | 127 Ų | 127 | 132.8 Ų | 132.8 | 86% | 0.858 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 140.5 | 169.5 | -58.1 | 0 | 0 | 0 | 0 | 110.8 | ||
| 245 | S | 35.6 | Very low | 38.1 | Very low | 112 Ų | 112 | 133.5 Ų | 133.5 | 78% | 0.783 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 150.3 | 168.6 | -71.5 | 0 | 0 | 0 | 0 | 111.5 | D247 | S245-D247 PolarHBondContact O-N 2.87Å; S245-D247 VanDerWaalsContact O-N 3.11Å |
| 246 | P | 44.6 | Very low | 38.3 | Very low | 123 Ų | 123 | 130.3 Ų | 130.3 | 80% | 0.799 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -90.8 | 58.5 | -168.2 | 38.6 | -37.6 | 0 | 0 | 0 | 113 | ||
| 247 | D | 44.1 | Very low | 38.7 | Very low | 157 Ų | 157 | 128.3 Ų | 128.3 | 84% | 0.84 | 79% | 0.79 | S | S | * | * | trans | -147.2 | 80.4 | 174.8 | -90.1 | -46.5 | 0 | 0 | 0 | 112.2 | S245 | S245-D247 PolarHBondContact O-N 2.87Å; S245-D247 VanDerWaalsContact O-N 3.11Å | ||
| 248 | S | 37.1 | Very low | 39 | Very low | 113 Ų | 113 | 133.6 Ų | 133.6 | 79% | 0.79 | 80% | 0.796 | S | S | * | * | trans | -162.4 | 133.2 | 140.6 | 49.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 249 | S | 37.8 | Very low | 38.9 | Very low | 113 Ų | 113 | 139 Ų | 139 | 79% | 0.79 | 80% | 0.8 | S | S | * | * | trans | -71.3 | 125.5 | 178.1 | 42 | 0 | 0 | 0 | 0 | 111 | P251 | S249-P251 WeakPolarHBondContact O-CD 3.05Š| ||
| 250 | C | 34.5 | Very low | 39.2 | Very low | 118 Ų | 118 | 131.3 Ų | 131.3 | 80% | 0.797 | 79% | 0.786 | S | S | * | * | trans | -76.5 | 124.9 | 169.3 | -57.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 251 | P | 39.5 | Very low | 39.3 | Very low | 111 Ų | 111 | 133.8 Ų | 133.8 | 72% | 0.721 | 78% | 0.784 | S | S | * | * | trans | -110.1 | 123.9 | 133.4 | 33 | -28 | 0 | 0 | 0 | 108.1 | S249 | S249-P251 WeakPolarHBondContact O-CD 3.05Š| ||
| 252 | Y | 40.3 | Very low | 39.4 | Very low | 206 Ų | 206 | 135.9 Ų | 135.9 | 81% | 0.808 | 78% | 0.777 | S | S | * | * | trans | -57.1 | 147.8 | -179.3 | -60.8 | -86.8 | 0 | 0 | 0 | 112.5 | ||||
| 253 | P | 42 | Very low | 39.6 | Very low | 119 Ų | 119 | 133 Ų | 133 | 77% | 0.773 | 77% | 0.774 | S | S | * | * | trans | -95.9 | 112.4 | 136 | -15.8 | 32.1 | 0 | 0 | 0 | 109.9 | C255 | P253-C255 PolarHBondContact O-N 3.1Å; P253-C255 VanDerWaalsContact O-N 3.08Å | ||
| 254 | C | 46.9 | Very low | 39.6 | Very low | 118 Ų | 118 | 132.3 Ų | 132.3 | 80% | 0.797 | 76% | 0.763 | S | S | * | * | trans | -69.5 | 98.4 | 168.3 | -60.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 255 | C | 37.1 | Very low | 39.9 | Very low | 110 Ų | 110 | 132.6 Ų | 132.6 | 74% | 0.743 | 76% | 0.763 | S | S | * | * | trans | -137 | 116.6 | 166.5 | -76.3 | 0 | 0 | 0 | 0 | 109.9 | P253 | P253-C255 PolarHBondContact O-N 3.1Å; P253-C255 VanDerWaalsContact O-N 3.08Å | ||
| 256 | P | 44.5 | Very low | 40.5 | Very low | 110 Ų | 110 | 131.8 Ų | 131.8 | 71% | 0.714 | 76% | 0.758 | S | S | * | * | trans | -65.1 | 151.5 | 162 | 30.7 | -33.4 | 0 | 0 | 0 | 108.9 | Q258 | P256-Q258 PolarHBondContact O-N 3.1Š| ||
| 257 | P | 41.7 | Very low | 40.6 | Very low | 87 Ų | 87 | 133.6 Ų | 133.6 | 57% | 0.565 | 76% | 0.76 | S | S | * | * | trans | -58.6 | 116.6 | 173.8 | 23.5 | -32.4 | 0 | 0 | 0 | 109.7 | Y259 | P257-Y259 HydrophobicContact CB-CE2 4.29Å; P257-Y259 HydrophobicContact CG-CE2 3.75Å; P257-Y259 VanDerWaalsContact O-CD2 3.28Å; P257-Y259 WeakPolarHBondContact O-CD2 3.03Å; P257-Y259 PolarHBondContact O-N 3.27Å | ||
| 258 | Q | 39.4 | Very low | 40.8 | Very low | 180 Ų | 180 | 131 Ų | 131 | 84% | 0.841 | 75% | 0.746 | S | S | * | * | trans | -68.5 | 97.4 | 168.5 | -87.7 | -177.9 | -21.9 | 0 | 0 | 108.5 | P256 C260 | P256-Q258 PolarHBondContact O-N 3.1Å; Q258-C260 PolarHBondContact O-N 3.24Å | ||
| 259 | Y | 38.3 | Very low | 41.2 | Very low | 197 Ų | 197 | 136.2 Ų | 136.2 | 77% | 0.773 | 75% | 0.748 | S | S | * | * | trans | -69.4 | 82.3 | 166.7 | -59.9 | -79.1 | 0 | 0 | 0 | 109.2 | P257 L261 | P257-Y259 HydrophobicContact CB-CE2 4.29Å; P257-Y259 HydrophobicContact CG-CE2 3.75Å; P257-Y259 VanDerWaalsContact O-CD2 3.28Å; P257-Y259 WeakPolarHBondContact O-CD2 3.03Å; P257-Y259 PolarHBondContact O-N 3.27Å; Y259-L261 VanDerWaalsContact C-N 3.34Å; Y259-L261 PolarHBondContact O-N 3.43Å | ||
| 260 | C | 37.8 | Very low | 41.6 | Very low | 106 Ų | 106 | 140.4 Ų | 140.4 | 72% | 0.716 | 75% | 0.748 | S | S | * | * | trans | -63.5 | 98.4 | 164.3 | -68.6 | 0 | 0 | 0 | 0 | 108 | Q258 N262 | Q258-C260 PolarHBondContact O-N 3.24Å; C260-N262 PolarHBondContact O-N 3.28Å | ||
| 261 | L | 39 | Very low | 42.3 | Very low | 159 Ų | 159 | 136.2 Ų | 136.2 | 83% | 0.832 | 73% | 0.725 | S | S | * | * | trans | -65.9 | 77.5 | 168.6 | -87 | 166.6 | 0 | 0 | 0 | 109.3 | Y259 Q263 | Y259-L261 VanDerWaalsContact C-N 3.34Å; Y259-L261 PolarHBondContact O-N 3.43Å; L261-Q263 PolarHBondContact O-N 3.05Å; L261-Q263 VanDerWaalsContact O-N 3.11Å | ||
| 262 | N | 38.1 | Very low | 42.5 | Very low | 118 Ų | 118 | 140.2 Ų | 140.2 | 63% | 0.631 | 73% | 0.734 | S | S | * | * | trans | -71.6 | 103.7 | 172.7 | -170.7 | 8.4 | 0 | 0 | 0 | 108.2 | C260 N264 | C260-N262 PolarHBondContact O-N 3.28Å; N262-N264 PolarHBondContact O-N 3.41Å | ||
| 263 | Q | 37.7 | Very low | 42.8 | Very low | 180 Ų | 180 | 139.1 Ų | 139.1 | 84% | 0.841 | 73% | 0.733 | S | S | * | * | trans | -68.2 | 81.7 | 168 | -77.1 | -169 | -7.9 | 0 | 0 | 109.2 | L261 P265 | L261-Q263 PolarHBondContact O-N 3.05Å; L261-Q263 VanDerWaalsContact O-N 3.11Å; Q263-P265 VanDerWaalsContact O-CD 3.24Å; Q263-P265 WeakPolarHBondContact O-CD 3.48Å | ||
| 264 | N | 38.5 | Very low | 43 | Very low | 115 Ų | 115 | 139 Ų | 139 | 62% | 0.615 | 73% | 0.733 | S | S | * | * | trans | -67.7 | 118.6 | 157.1 | -71.8 | -39.4 | 0 | 0 | 0 | 107 | N262 S266 | N262-N264 PolarHBondContact O-N 3.41Å; N264-S266 PolarHBondContact O-N 2.91Å | ||
| 265 | P | 42.6 | Very low | 42.8 | Very low | 132 Ų | 132 | 139.2 Ų | 139.2 | 86% | 0.857 | 73% | 0.725 | S | S | * | * | trans | -76.8 | 56.5 | 173.6 | 34.6 | -36.1 | 0 | 0 | 0 | 109.8 | Q263 L267 | Q263-P265 VanDerWaalsContact O-CD 3.24Å; Q263-P265 WeakPolarHBondContact O-CD 3.48Å; P265-L267 PolarHBondContact O-N 2.93Å | ||
| 266 | S | 48.1 | Very low | 42.9 | Very low | 95 Ų | 95 | 138.4 Ų | 138.4 | 66% | 0.664 | 72% | 0.718 | S | S | * | * | trans | -68.4 | 112.5 | 163.3 | 55.1 | 0 | 0 | 0 | 0 | 107.1 | N264 D268 | N264-S266 PolarHBondContact O-N 2.91Å; S266-D268 PolarHBondContact O-N 3.13Å | ||
| 267 | L | 46.8 | Very low | 42.7 | Very low | 162 Ų | 162 | 142.6 Ų | 142.6 | 85% | 0.848 | 73% | 0.726 | S | S | * | * | trans | -41.8 | 114.5 | 158.3 | -92.2 | 147.5 | 0 | 0 | 0 | 107.8 | P265 R269 | P265-L267 PolarHBondContact O-N 2.93Å; L267-R269 PolarHBondContact O-N 3.01Å | ||
| 268 | D | 48.1 | Very low | 42.7 | Very low | 102 Ų | 102 | 144.8 Ų | 144.8 | 55% | 0.545 | 73% | 0.733 | S | S | . | * | trans | -54.5 | 119.1 | -178.9 | 177.2 | 5.8 | 0 | 0 | 0 | 108.1 | S266 Y270 G271 | S266-D268 PolarHBondContact O-N 3.13Å; D268-Y270 PolarHBondContact O-N 3.06Å; D268-Y270 VanDerWaalsContact O-N 3.13Å; D268-Y270 PolarHBondContact OD1-N 3.05Å; D268-G271 PolarHBondContact O-N 3Å; D268-G271 PolarHBondContact OD1-N 3.11Å; D268-G271 PolarHBondContact OD2-N 2.89Å | ||
| 269 | R | 47 | Very low | 42.7 | Very low | 223 Ų | 223 | 139.2 Ų | 139.2 | 84% | 0.842 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.6 | -22.8 | -178.5 | -174.4 | 178.8 | -71.6 | -176 | -2 | 111.1 | L267 | L267-R269 PolarHBondContact O-N 3.01Š|
| 270 | Y | 46.3 | Very low | 42.9 | Very low | 200 Ų | 200 | 135.6 Ų | 135.6 | 78% | 0.784 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.1 | -0 | 177.1 | -49.8 | -72.8 | 0 | 0 | 0 | 112.5 | D268 | D268-Y270 PolarHBondContact O-N 3.06Å; D268-Y270 VanDerWaalsContact O-N 3.13Å; D268-Y270 PolarHBondContact OD1-N 3.05Å |
| 271 | G | 48.4 | Very low | 43.1 | Very low | 30 Ų | 30 | 133.9 Ų | 133.9 | 31% | 0.309 | 69% | 0.691 | S | S | . | * | S | Bend | trans | -70.7 | 141.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | D268 K273 | D268-G271 PolarHBondContact O-N 3Å; D268-G271 PolarHBondContact OD1-N 3.11Å; D268-G271 PolarHBondContact OD2-N 2.89Å; G271-K273 PolarHBondContact O-N 2.87Å |
| 272 | Q | 43.6 | Very low | 43.1 | Very low | 196 Ų | 196 | 132.1 Ų | 132.1 | 92% | 0.916 | 69% | 0.687 | S | S | * | * | trans | -65.4 | 110.2 | 178.2 | -151.6 | 173.2 | 35.4 | 0 | 0 | 109.3 | ||||
| 273 | K | 46.9 | Very low | 43.1 | Very low | 182 Ų | 182 | 133.8 Ų | 133.8 | 79% | 0.791 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 127.7 | 178.4 | -70.3 | -179.5 | -179.3 | 174.8 | 0 | 109.2 | G271 L275 | G271-K273 PolarHBondContact O-N 2.87Å; K273-L275 PolarHBondContact O-N 3.3Å |
| 274 | P | 46.2 | Very low | 43.2 | Very low | 117 Ų | 117 | 134.3 Ų | 134.3 | 76% | 0.76 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 125.6 | 177.1 | 25.4 | -33 | 0 | 0 | 0 | 109.3 | ||
| 275 | L | 43.4 | Very low | 43.1 | Very low | 122 Ų | 122 | 132.6 Ų | 132.6 | 64% | 0.639 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -66 | 131.6 | 177 | -70.9 | 170 | 0 | 0 | 0 | 109.4 | K273 F277 | K273-L275 PolarHBondContact O-N 3.3Å; L275-F277 PolarHBondContact O-N 2.87Å |
| 276 | P | 39.5 | Very low | 43 | Very low | 93 Ų | 93 | 133.8 Ų | 133.8 | 60% | 0.604 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 135.2 | 173.1 | 24.7 | -30.6 | 0 | 0 | 0 | 109.6 | D278 S279 | P276-D278 PolarHBondContact O-N 3.4Å; P276-D278 VanDerWaalsContact O-N 3.1Å; P276-S279 VanDerWaalsContact O-CB 3.3Å; P276-S279 WeakPolarHBondContact O-CB 3.3Å; P276-S279 PolarHBondContact O-N 2.99Å; P276-S279 PolarHBondContact O-OG 3.19Å |
| 277 | F | 39.9 | Very low | 42.4 | Very low | 198 Ų | 198 | 132.3 Ų | 132.3 | 87% | 0.868 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -51.3 | -35.7 | -172.8 | 172.7 | -100.9 | 0 | 0 | 0 | 114.4 | L275 S279 | L275-F277 PolarHBondContact O-N 2.87Å; F277-S279 VanDerWaalsContact C-N 3.32Å; F277-S279 PolarHBondContact O-N 3.19Å |
| 278 | D | 42.1 | Very low | 42.2 | Very low | 133 Ų | 133 | 127.7 Ų | 127.7 | 71% | 0.711 | 65% | 0.654 | S | S | * | * | G | 310 helix | trans | -75.2 | -11.5 | 179.5 | -85.4 | -42.6 | 0 | 0 | 0 | 115.1 | P276 L280 | P276-D278 PolarHBondContact O-N 3.4Å; P276-D278 VanDerWaalsContact O-N 3.1Å; D278-L280 PolarHBondContact O-N 3.44Å; D278-L280 VanDerWaalsContact O-N 3.09Å |
| 279 | S | 38.8 | Very low | 42.1 | Very low | 64 Ų | 64 | 128.5 Ų | 128.5 | 45% | 0.448 | 67% | 0.667 | S | S | . | * | G | 310 helix | trans | -65.2 | -16.7 | -171.3 | 56.2 | 0 | 0 | 0 | 0 | 115.7 | P276 F277 | P276-S279 VanDerWaalsContact O-CB 3.3Å; P276-S279 WeakPolarHBondContact O-CB 3.3Å; P276-S279 PolarHBondContact O-N 2.99Å; P276-S279 PolarHBondContact O-OG 3.19Å; F277-S279 VanDerWaalsContact C-N 3.32Å; F277-S279 PolarHBondContact O-N 3.19Å |
| 280 | L | 43.2 | Very low | 41.8 | Very low | 120 Ų | 120 | 127.9 Ų | 127.9 | 63% | 0.628 | 67% | 0.666 | S | S | * | * | G | 310 helix | trans | -109.7 | -0.6 | -169.5 | -69.6 | 177.6 | 0 | 0 | 0 | 115.4 | D278 | D278-L280 PolarHBondContact O-N 3.44Å; D278-L280 VanDerWaalsContact O-N 3.09Å |
| 281 | N | 40.8 | Very low | 41.7 | Very low | 70 Ų | 70 | 122.1 Ų | 122.1 | 37% | 0.374 | 66% | 0.655 | S | S | . | * | trans | -151.6 | 30.6 | -160 | -122.3 | -11.5 | 0 | 0 | 0 | 122.9 | F283 R284 S285 | N281-F283 PolarHBondContact O-N 2.92Å; N281-R284 PolarHBondContact O-N 3.13Å; N281-R284 VanDerWaalsContact O-N 3.07Å; N281-R284 WeakPolarHBondContact OD1-CB 3.24Å; N281-R284 WeakPolarHBondContact OD1-CD 3.28Å; N281-R284 WeakPolarHBondContact OD1-CG 3.46Å; N281-R284 PolarHBondContact OD1-N 3.25Å; N281-S285 WeakPolarHBondContact O-CB 3.29Å; N281-S285 PolarHBondContact O-N 2.82Å; N281-S285 PolarHBondContact O-OG 3.24Å; N281-S285 VanDerWaalsContact O-OG 3.08Å | ||
| 282 | T | 39.3 | Very low | 41.3 | Very low | 122 Ų | 122 | 130.7 Ų | 130.7 | 75% | 0.748 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.1 | -22.9 | 170.6 | -39.9 | 0 | 0 | 0 | 0 | 114.2 | ||
| 283 | F | 38 | Very low | 41 | Very low | 154 Ų | 154 | 126.9 Ų | 126.9 | 68% | 0.675 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.3 | -4.2 | -179.9 | -66.8 | -73.6 | 0 | 0 | 0 | 115.8 | N281 | N281-F283 PolarHBondContact O-N 2.92Š|
| 284 | R | 39.2 | Very low | 40.5 | Very low | 190 Ų | 190 | 125 Ų | 125 | 72% | 0.717 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.3 | 3.1 | 171.1 | -39.8 | 166.4 | 170.7 | -104.4 | 1 | 114.2 | N281 F286 | N281-R284 PolarHBondContact O-N 3.13Å; N281-R284 VanDerWaalsContact O-N 3.07Å; N281-R284 WeakPolarHBondContact OD1-CB 3.24Å; N281-R284 WeakPolarHBondContact OD1-CD 3.28Å; N281-R284 WeakPolarHBondContact OD1-CG 3.46Å; N281-R284 PolarHBondContact OD1-N 3.25Å; R284-F286 PolarHBondContact O-N 3.07Å |
| 285 | S | 36 | Very low | 39.9 | Very low | 80 Ų | 80 | 129.4 Ų | 129.4 | 56% | 0.559 | 67% | 0.67 | S | S | * | * | trans | -70.4 | 81.5 | 168 | 52.4 | 0 | 0 | 0 | 0 | 110.7 | N281 G287 | N281-S285 WeakPolarHBondContact O-CB 3.29Å; N281-S285 PolarHBondContact O-N 2.82Å; N281-S285 PolarHBondContact O-OG 3.24Å; N281-S285 VanDerWaalsContact O-OG 3.08Å; S285-G287 PolarHBondContact O-N 2.84Å | ||
| 286 | F | 40.9 | Very low | 39.7 | Very low | 156 Ų | 156 | 131.2 Ų | 131.2 | 68% | 0.684 | 68% | 0.679 | S | S | * | * | trans | -71.5 | 70.5 | 161.6 | -62.6 | -65.6 | 0 | 0 | 0 | 109.4 | T157 R284 S288 | T157-F286 HydrophobicContact CG2-CD1 4.03Å; T157-F286 HydrophobicContact CG2-CE1 3.52Å; T157-F286 HydrophobicContact CG2-CZ 4.43Å; R284-F286 PolarHBondContact O-N 3.07Å; F286-S288 PolarHBondContact O-N 2.8Å | ||
| 287 | G | 37 | Very low | 39.5 | Very low | 64 Ų | 64 | 132.8 Ų | 132.8 | 66% | 0.66 | 69% | 0.687 | S | S | * | * | trans | -62.1 | 95.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | S285 | S285-G287 PolarHBondContact O-N 2.84Š| ||
| 288 | S | 41.4 | Very low | 39.3 | Very low | 66 Ų | 66 | 128.6 Ų | 128.6 | 46% | 0.462 | 68% | 0.68 | S | S | . | * | trans | -91.3 | 149.9 | 157.7 | 82.4 | 0 | 0 | 0 | 0 | 107.9 | F286 Y290 S291 | F286-S288 PolarHBondContact O-N 2.8Å; S288-Y290 PolarHBondContact O-N 3.11Å; S288-Y290 PolarHBondContact OG-N 3.11Å; S288-S291 PolarHBondContact O-N 2.92Å; S288-S291 VanDerWaalsContact O-N 3.1Å; S288-S291 PolarHBondContact O-OG 2.77Å | ||
| 289 | S | 45.5 | Very low | 39.1 | Very low | 118 Ų | 118 | 134.4 Ų | 134.4 | 83% | 0.825 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.8 | -3.9 | 177.4 | -45.2 | 0 | 0 | 0 | 0 | 114 | ||
| 290 | Y | 42.1 | Very low | 38.9 | Very low | 211 Ų | 211 | 144 Ų | 144 | 83% | 0.827 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.2 | -2.6 | -179 | -61.4 | -79.3 | 0 | 0 | 0 | 113.8 | S288 R292 | S288-Y290 PolarHBondContact O-N 3.11Å; S288-Y290 PolarHBondContact OG-N 3.11Å; Y290-R292 PolarHBondContact O-N 2.96Å |
| 291 | S | 43.2 | Very low | 38.7 | Very low | 79 Ų | 79 | 145.2 Ų | 145.2 | 55% | 0.552 | 73% | 0.734 | S | S | * | * | trans | -77.9 | 48.2 | 177 | 72.1 | 0 | 0 | 0 | 0 | 113.1 | S288 V293 | S288-S291 PolarHBondContact O-N 2.92Å; S288-S291 VanDerWaalsContact O-N 3.1Å; S288-S291 PolarHBondContact O-OG 2.77Å; S291-V293 PolarHBondContact O-N 2.87Å | ||
| 292 | R | 40.7 | Very low | 38.6 | Very low | 210 Ų | 210 | 149.1 Ų | 149.1 | 79% | 0.792 | 75% | 0.753 | S | S | * | * | trans | -83.9 | 99.9 | 165.8 | -73.9 | -171.4 | 177.9 | -173.2 | -0.6 | 108.7 | Y290 N294 | Y290-R292 PolarHBondContact O-N 2.96Å; R292-N294 PolarHBondContact O-N 3.05Å | ||
| 293 | V | 36.3 | Very low | 38.6 | Very low | 116 Ų | 116 | 150.6 Ų | 150.6 | 70% | 0.703 | 75% | 0.753 | S | S | * | * | trans | -76.3 | 103.4 | 171.8 | 179.1 | 0 | 0 | 0 | 0 | 108 | S291 Y295 | S291-V293 PolarHBondContact O-N 2.87Å; V293-Y295 HydrophobicContact CG1-CD2 3.63Å; V293-Y295 HydrophobicContact CG1-CG 4.4Å; V293-Y295 PolarHBondContact O-N 3.08Å | ||
| 294 | N | 36.3 | Very low | 38.6 | Very low | 143 Ų | 143 | 150.4 Ų | 150.4 | 77% | 0.765 | 76% | 0.758 | S | S | * | * | trans | -71.9 | 21.7 | -173.1 | -74.2 | -19.2 | 0 | 0 | 0 | 115.4 | R292 | R292-N294 PolarHBondContact O-N 3.05Š| ||
| 295 | Y | 35.1 | Very low | 38.6 | Very low | 209 Ų | 209 | 147.9 Ų | 147.9 | 82% | 0.82 | 76% | 0.76 | S | S | * | * | trans | -91.7 | 6.7 | -173 | -73.8 | -60.8 | 0 | 0 | 0 | 115.5 | V293 | V293-Y295 HydrophobicContact CG1-CD2 3.63Å; V293-Y295 HydrophobicContact CG1-CG 4.4Å; V293-Y295 PolarHBondContact O-N 3.08Å | ||
| 296 | L | 37.9 | Very low | 38.7 | Very low | 160 Ų | 160 | 152.5 Ų | 152.5 | 84% | 0.838 | 77% | 0.773 | S | S | * | * | trans | -137.8 | 73.8 | 178.5 | -69 | 173.8 | 0 | 0 | 0 | 112.1 | P298 | L296-P298 WeakPolarHBondContact O-CD 3.07Š| ||
| 297 | T | 35.6 | Very low | 38.6 | Very low | 126 Ų | 126 | 152.2 Ų | 152.2 | 77% | 0.773 | 78% | 0.78 | S | S | * | * | trans | -77.8 | 112 | 139.6 | 45.7 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 298 | P | 36 | Very low | 38.7 | Very low | 109 Ų | 109 | 159 Ų | 159 | 71% | 0.708 | 79% | 0.789 | S | S | * | * | trans | -62.5 | 141.5 | 172 | 27.5 | -33 | 0 | 0 | 0 | 109.2 | L296 | L296-P298 WeakPolarHBondContact O-CD 3.07Š| ||
| 299 | W | 37.9 | Very low | 38.5 | Very low | 255 Ų | 255 | 166.8 Ų | 166.8 | 97% | 0.966 | 82% | 0.816 | S | S | * | * | trans | -62 | 138.9 | 174.7 | -60.7 | 83.9 | 0 | 0 | 0 | 109.6 | ||||
| 300 | H | 34.9 | Very low | 37.8 | Very low | 265 Ų | 265 | 171.2 Ų | 171.2 | 100% | 1.227 | 82% | 0.816 | S | S | * | * | trans | -70.5 | 0 | 177.7 | -95.5 | -73.1 | 0 | 0 | 0 | 112.5 |
Retrieved 300 of 300 residues in 90.6 ms
(Link to these results)