| 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 | 39.9 | Very low | 36.9 | Very low | 236 Ų | 236 | 181.7 Ų | 181.7 | 100% | 1.163 | 89% | 0.892 | S | S | * | * | 0 | 108.5 | 0 | -75.1 | 173.3 | -178.8 | 0 | 0 | 108.4 | |||||
| 2 | R | 38.4 | Very low | 36.6 | Very low | 255 Ų | 255 | 182.4 Ų | 182.4 | 96% | 0.962 | 89% | 0.891 | S | S | * | * | trans | -96.1 | 113.9 | 174.8 | -74.6 | -175.5 | -179.7 | -133.8 | 1.2 | 107.8 | ||||
| 3 | L | 37.9 | Very low | 36.1 | Very low | 157 Ų | 157 | 182.4 Ų | 182.4 | 82% | 0.822 | 89% | 0.888 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 127.9 | 176.1 | -79.5 | 128.9 | 0 | 0 | 0 | 109.9 | ||
| 4 | P | 39.8 | Very low | 35.7 | Very low | 121 Ų | 121 | 183.3 Ų | 183.3 | 79% | 0.786 | 89% | 0.89 | S | S | * | * | P | Polyproline II helix | trans | -81.4 | 130.9 | 177.6 | 31.8 | -32.6 | 0 | 0 | 0 | 111 | ||
| 5 | W | 33.7 | Very low | 35.6 | Very low | 258 Ų | 258 | 183.8 Ų | 183.8 | 98% | 0.977 | 89% | 0.89 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 126.3 | 172.3 | -89.3 | 48.2 | 0 | 0 | 0 | 110.4 | ||
| 6 | S | 37.9 | Very low | 35.9 | Very low | 105 Ų | 105 | 179.1 Ų | 179.1 | 73% | 0.734 | 88% | 0.879 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 140.4 | -173.7 | 57.2 | 0 | 0 | 0 | 0 | 113.5 | A8 | S6-A8 PolarHBondContact O-N 3.01Š|
| 7 | Q | 37.4 | Very low | 35.4 | Very low | 205 Ų | 205 | 180.2 Ų | 180.2 | 96% | 0.958 | 88% | 0.881 | S | S | * | * | trans | -68.8 | 74.7 | 177.2 | -64.4 | 175.7 | -17 | 0 | 0 | 113.4 | ||||
| 8 | A | 36.3 | Very low | 35.2 | Very low | 87 Ų | 87 | 179.7 Ų | 179.7 | 72% | 0.719 | 88% | 0.877 | S | S | * | * | trans | -113.3 | 10.6 | -180 | 0 | 0 | 0 | 0 | 0 | 115.5 | S6 | S6-A8 PolarHBondContact O-N 3.01Š| ||
| 9 | Q | 37 | Very low | 35.1 | Very low | 189 Ų | 189 | 180.3 Ų | 180.3 | 88% | 0.883 | 88% | 0.877 | S | S | * | * | trans | -137.6 | 70.2 | 179.5 | -72.7 | -176 | -9.3 | 0 | 0 | 111.8 | ||||
| 10 | Q | 35.2 | Very low | 34.8 | Very low | 195 Ų | 195 | 183.5 Ų | 183.5 | 91% | 0.911 | 88% | 0.88 | S | S | * | * | trans | -139.1 | 10.3 | 170.5 | -102.5 | -176.2 | 20.7 | 0 | 0 | 115.3 | ||||
| 11 | Q | 32.8 | Very low | 34.6 | Very low | 191 Ų | 191 | 181.3 Ų | 181.3 | 89% | 0.893 | 88% | 0.878 | S | S | * | * | trans | -127 | 73.5 | 179.7 | -68.8 | -177.3 | 25 | 0 | 0 | 111.5 | ||||
| 12 | Q | 32.8 | Very low | 34.1 | Very low | 190 Ų | 190 | 179.4 Ų | 179.4 | 89% | 0.888 | 87% | 0.866 | S | S | * | * | trans | -158.7 | 45.1 | 163.7 | -123.8 | 177.9 | 77.3 | 0 | 0 | 112.2 | ||||
| 13 | Q | 29.9 | Very low | 33.7 | Very low | 182 Ų | 182 | 171.8 Ų | 171.8 | 85% | 0.85 | 86% | 0.858 | S | S | * | * | trans | -147.3 | 100.3 | 166.5 | -70.5 | -171.1 | 51.9 | 0 | 0 | 108.3 | ||||
| 14 | Q | 30.2 | Very low | 33.3 | Very low | 195 Ų | 195 | 172.3 Ų | 172.3 | 91% | 0.911 | 86% | 0.86 | S | S | * | * | trans | 174.3 | 117 | 153.6 | -98.2 | 163.4 | 92.9 | 0 | 0 | 109.4 | ||||
| 15 | Q | 34.4 | Very low | 32.9 | Very low | 191 Ų | 191 | 175.1 Ų | 175.1 | 89% | 0.893 | 86% | 0.863 | S | S | * | * | trans | 141.4 | 147.6 | 152.8 | -79.2 | -164 | 36.8 | 0 | 0 | 113.5 | ||||
| 16 | P | 40 | Very low | 32.7 | Very low | 109 Ų | 109 | 172.2 Ų | 172.2 | 71% | 0.708 | 86% | 0.86 | S | S | * | * | -126.8 | 156.3 | -87.1 | 22 | 1.3 | 0 | 0 | 0 | 114.3 | Q18 | P16-Q18 PolarHBondContact O-N 2.64Å; P16-Q18 VanDerWaalsContact O-N 3.16Å | |||
| 17 | Q | 28.4 | Very low | 32.4 | Very low | 198 Ų | 198 | 176.5 Ų | 176.5 | 93% | 0.925 | 87% | 0.868 | S | S | * | * | trans | -74.7 | 89.2 | 172.7 | -65.6 | 172 | -0.2 | 0 | 0 | 111.1 | ||||
| 18 | Q | 32.2 | Very low | 32 | Very low | 170 Ų | 170 | 172.4 Ų | 172.4 | 79% | 0.794 | 86% | 0.86 | S | S | * | * | trans | -149.4 | 80.7 | 164.2 | -70.8 | -170.1 | 12.1 | 0 | 0 | 109.6 | P16 | P16-Q18 PolarHBondContact O-N 2.64Å; P16-Q18 VanDerWaalsContact O-N 3.16Å | ||
| 19 | Q | 33.2 | Very low | 31.6 | Very low | 191 Ų | 191 | 177.9 Ų | 177.9 | 89% | 0.893 | 87% | 0.87 | S | S | * | * | trans | 176.5 | 75.9 | 163.8 | -101.3 | 161.9 | 65.7 | 0 | 0 | 109.5 | ||||
| 20 | R | 29.2 | Very low | 31.3 | Very low | 244 Ų | 244 | 175 Ų | 175 | 92% | 0.921 | 87% | 0.865 | S | S | * | * | trans | -172 | 55.1 | 161.4 | -109.9 | 170.4 | -165.7 | -150.3 | 5.1 | 112 | ||||
| 21 | T | 29.7 | Very low | 30.9 | Very low | 139 Ų | 139 | 174.7 Ų | 174.7 | 85% | 0.853 | 86% | 0.864 | S | S | * | * | trans | -140.5 | 46.4 | 173.5 | 29.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 22 | Q | 30.5 | Very low | 30.7 | Very low | 195 Ų | 195 | 174.3 Ų | 174.3 | 91% | 0.911 | 86% | 0.862 | S | S | * | * | trans | -150 | 65.6 | 170 | -65.1 | -168.7 | 6.5 | 0 | 0 | 110.5 | ||||
| 23 | A | 30.2 | Very low | 30.5 | Very low | 96 Ų | 96 | 173.1 Ų | 173.1 | 79% | 0.793 | 86% | 0.856 | S | S | * | * | trans | -157.9 | 42.8 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 24 | I | 28.5 | Very low | 30.4 | Very low | 168 Ų | 168 | 172 Ų | 172 | 86% | 0.862 | 86% | 0.856 | S | S | * | * | trans | -143.5 | 80.4 | 171.6 | -50.7 | 176 | 0 | 0 | 0 | 108.5 | ||||
| 25 | Q | 31.4 | Very low | 30.3 | Very low | 180 Ų | 180 | 173.3 Ų | 173.3 | 84% | 0.841 | 85% | 0.853 | S | S | * | * | trans | -171 | 105.3 | 160 | -109.5 | 165.6 | 29.2 | 0 | 0 | 107.3 | ||||
| 26 | Q | 30.1 | Very low | 30 | Very low | 197 Ų | 197 | 173.8 Ų | 173.8 | 92% | 0.921 | 85% | 0.852 | S | S | * | * | trans | 155.1 | 97.2 | 152.3 | -85.2 | 165.1 | 90.5 | 0 | 0 | 109.6 | ||||
| 27 | Q | 30 | Very low | 29.6 | Very low | 194 Ų | 194 | 173.9 Ų | 173.9 | 91% | 0.907 | 85% | 0.852 | S | S | * | * | trans | -138.3 | 141 | 151.6 | -77.2 | -167.4 | 0.5 | 0 | 0 | 109.8 | ||||
| 28 | P | 30.5 | Very low | 29.5 | Very low | 120 Ų | 120 | 169.7 Ų | 169.7 | 78% | 0.779 | 85% | 0.845 | S | S | * | * | trans | -95.5 | 147.1 | -162.8 | 0.4 | 22 | 0 | 0 | 0 | 113.8 | ||||
| 29 | Q | 27.1 | Very low | 29.4 | Very low | 202 Ų | 202 | 170.4 Ų | 170.4 | 94% | 0.944 | 85% | 0.846 | S | S | * | * | trans | -66.4 | 128.1 | 171.4 | -83.1 | 174 | -41.9 | 0 | 0 | 111.7 | ||||
| 30 | V | 30.4 | Very low | 29.2 | Very low | 127 Ų | 127 | 167.3 Ų | 167.3 | 77% | 0.77 | 84% | 0.843 | S | S | * | * | trans | -111.6 | 117.5 | 170.6 | -179.1 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 31 | Q | 27.7 | Very low | 29.2 | Very low | 190 Ų | 190 | 162.7 Ų | 162.7 | 89% | 0.888 | 84% | 0.841 | S | S | * | * | trans | -73.8 | 124 | 173.4 | -82.6 | 168.2 | -14.6 | 0 | 0 | 110.4 | ||||
| 32 | Q | 28.5 | Very low | 29.1 | Very low | 183 Ų | 183 | 160.6 Ų | 160.6 | 86% | 0.855 | 84% | 0.838 | S | S | * | * | trans | -106.3 | 122.8 | 169.2 | -82.2 | 176.6 | 7.2 | 0 | 0 | 109.6 | ||||
| 33 | Q | 29.1 | Very low | 29.2 | Very low | 164 Ų | 164 | 155.8 Ų | 155.8 | 77% | 0.766 | 83% | 0.832 | S | S | * | * | trans | -88.1 | 124.4 | 179.6 | -75.3 | 175.5 | -16.6 | 0 | 0 | 110.6 | R35 | Q33-R35 PolarHBondContact O-N 3.19Š| ||
| 34 | D | 27.9 | Very low | 29.2 | Very low | 159 Ų | 159 | 157.3 Ų | 157.3 | 85% | 0.85 | 83% | 0.834 | S | S | * | * | trans | -72.4 | 111.3 | 175.9 | -68.7 | -50.7 | 0 | 0 | 0 | 111.8 | ||||
| 35 | R | 28.4 | Very low | 29.3 | Very low | 223 Ų | 223 | 153 Ų | 153 | 84% | 0.842 | 83% | 0.831 | S | S | * | * | trans | -110.7 | 108.2 | 167 | -68.2 | -170.8 | -179.3 | -148.5 | 1.3 | 109.7 | Q33 | Q33-R35 PolarHBondContact O-N 3.19Š| ||
| 36 | K | 26.5 | Very low | 29.2 | Very low | 201 Ų | 201 | 151.5 Ų | 151.5 | 87% | 0.874 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 126.9 | 173.1 | -70.1 | 178.4 | 177.9 | 175.1 | 0 | 110.5 | ||
| 37 | P | 31.7 | Very low | 29.2 | Very low | 110 Ų | 110 | 150.9 Ų | 150.9 | 71% | 0.714 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 130.1 | 165.9 | 13 | 4 | 0 | 0 | 0 | 111.3 | F39 | P37-F39 HydrophobicContact CB-CE2 4.2Š|
| 38 | S | 26.2 | Very low | 29.2 | Very low | 111 Ų | 111 | 147.7 Ų | 147.7 | 78% | 0.776 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -89.7 | 135.4 | 172 | 45.7 | 0 | 0 | 0 | 0 | 110.8 | ||
| 39 | F | 30.5 | Very low | 29 | Very low | 185 Ų | 185 | 151.3 Ų | 151.3 | 81% | 0.811 | 83% | 0.831 | S | S | * | * | trans | -138.7 | 137.1 | 165.2 | -73.4 | -75.7 | 0 | 0 | 0 | 110.7 | P37 | P37-F39 HydrophobicContact CB-CE2 4.2Š| ||
| 40 | P | 29.6 | Very low | 29.2 | Very low | 126 Ų | 126 | 147.9 Ų | 147.9 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 150.3 | -171 | 31.8 | -34.2 | 0 | 0 | 0 | 114.3 | ||
| 41 | V | 27.8 | Very low | 29.2 | Very low | 146 Ų | 146 | 151 Ų | 151 | 89% | 0.885 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 130.2 | -177.3 | 174.9 | 0 | 0 | 0 | 0 | 110.2 | ||
| 42 | A | 29.6 | Very low | 29.1 | Very low | 95 Ų | 95 | 151 Ų | 151 | 79% | 0.785 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 136.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 43 | A | 31.1 | Very low | 29.1 | Very low | 95 Ų | 95 | 150.1 Ų | 150.1 | 79% | 0.785 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 145.8 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 44 | P | 31.6 | Very low | 29.1 | Very low | 128 Ų | 128 | 147.9 Ų | 147.9 | 83% | 0.831 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 130.9 | -179.5 | 30.3 | -30.9 | 0 | 0 | 0 | 112.3 | ||
| 45 | G | 30.2 | Very low | 29.1 | Very low | 78 Ų | 78 | 151.1 Ų | 151.1 | 80% | 0.804 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 138.9 | 179 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 46 | T | 29 | Very low | 29.1 | Very low | 147 Ų | 147 | 145.1 Ų | 145.1 | 90% | 0.902 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 130.2 | 179.2 | -24.4 | 0 | 0 | 0 | 0 | 110.8 | ||
| 47 | Q | 29.8 | Very low | 29.1 | Very low | 184 Ų | 184 | 145.9 Ų | 145.9 | 86% | 0.86 | 83% | 0.826 | S | S | * | * | trans | -115.3 | 146.6 | 167.4 | -72.6 | -158.6 | -11.4 | 0 | 0 | 111.8 | ||||
| 48 | P | 30.1 | Very low | 29 | Very low | 127 Ų | 127 | 147.9 Ų | 147.9 | 83% | 0.825 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -94.5 | 152.7 | -167.6 | 25.9 | -12.1 | 0 | 0 | 0 | 114.7 | ||
| 49 | K | 26.5 | Very low | 29.2 | Very low | 197 Ų | 197 | 151.9 Ų | 151.9 | 86% | 0.857 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 146.7 | -176.9 | -70.7 | -177.7 | 173.4 | -175 | 0 | 113.8 | ||
| 50 | P | 31.7 | Very low | 29.2 | Very low | 129 Ų | 129 | 152.2 Ų | 152.2 | 84% | 0.838 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 148.3 | 174.5 | -7.6 | 25.8 | 0 | 0 | 0 | 113.6 | ||
| 51 | Q | 29.4 | Very low | 29.1 | Very low | 192 Ų | 192 | 155.2 Ų | 155.2 | 90% | 0.897 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -87 | 138.2 | -177.3 | -69.6 | 167.6 | -30.7 | 0 | 0 | 112.6 | ||
| 52 | E | 26.2 | Very low | 29.1 | Very low | 191 Ų | 191 | 154.8 Ų | 154.8 | 89% | 0.893 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -87.8 | 138.6 | 177.5 | -66.5 | 173.3 | 163.2 | 0 | 0 | 111.5 | ||
| 53 | Q | 28.6 | Very low | 29 | Very low | 164 Ų | 164 | 158.9 Ų | 158.9 | 77% | 0.766 | 84% | 0.841 | S | S | * | * | trans | -119.3 | 127.3 | 177.4 | -77.5 | -87.2 | 1.3 | 0 | 0 | 109.7 | ||||
| 54 | P | 28.7 | Very low | 28.9 | Very low | 118 Ų | 118 | 159.6 Ų | 159.6 | 77% | 0.766 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -91.7 | 144.7 | -176.7 | 33.9 | -31.6 | 0 | 0 | 0 | 113.2 | ||
| 55 | Y | 28.4 | Very low | 28.8 | Very low | 227 Ų | 227 | 158 Ų | 158 | 89% | 0.89 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -93.6 | 138.9 | -176.6 | -24 | -79.5 | 0 | 0 | 0 | 111.6 | ||
| 56 | A | 28.8 | Very low | 28.8 | Very low | 96 Ų | 96 | 162.4 Ų | 162.4 | 79% | 0.793 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 147.8 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 57 | Y | 26.4 | Very low | 28.6 | Very low | 218 Ų | 218 | 165 Ų | 165 | 86% | 0.855 | 84% | 0.842 | S | S | * | * | trans | -112.7 | 114.6 | -174 | -139.5 | -87.4 | 0 | 0 | 0 | 109.3 | ||||
| 58 | D | 29.4 | Very low | 28.8 | Very low | 152 Ų | 152 | 160.5 Ų | 160.5 | 81% | 0.813 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -91.2 | 127 | 179.1 | -71.3 | -35.5 | 0 | 0 | 0 | 111.3 | ||
| 59 | K | 29.3 | Very low | 28.7 | Very low | 195 Ų | 195 | 163 Ų | 163 | 85% | 0.848 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -98.2 | 117.6 | 176.9 | -65.2 | 177.9 | 179.6 | 179.6 | 0 | 108.4 | ||
| 60 | Q | 30.2 | Very low | 28.8 | Very low | 192 Ų | 192 | 159 Ų | 159 | 90% | 0.897 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -100.4 | 141.6 | 172.8 | -78.1 | -178.4 | -24.5 | 0 | 0 | 111.4 | ||
| 61 | E | 29.1 | Very low | 28.5 | Very low | 188 Ų | 188 | 160.8 Ų | 160.8 | 88% | 0.879 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -84.9 | 151.6 | -158.3 | -61.8 | 170.7 | 152.2 | 0 | 0 | 113.3 | ||
| 62 | V | 26.2 | Very low | 28.8 | Very low | 137 Ų | 137 | 159.7 Ų | 159.7 | 83% | 0.83 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -93.3 | 122.6 | -177.2 | 175.6 | 0 | 0 | 0 | 0 | 109.2 | ||
| 63 | H | 27.9 | Very low | 28.8 | Very low | 182 Ų | 182 | 158.9 Ų | 158.9 | 84% | 0.843 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -92.9 | 124.2 | 167.9 | -92.9 | -84.1 | 0 | 0 | 0 | 110.7 | ||
| 64 | P | 29.8 | Very low | 29 | Very low | 110 Ų | 110 | 159.9 Ų | 159.9 | 71% | 0.714 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 169.2 | 170.9 | 37.3 | -30.5 | 0 | 0 | 0 | 112 | ||
| 65 | A | 28.5 | Very low | 29 | Very low | 94 Ų | 94 | 162.1 Ų | 162.1 | 78% | 0.777 | 83% | 0.827 | S | S | * | * | trans | 97 | 103.9 | 168.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 66 | L | 30.8 | Very low | 29.4 | Very low | 170 Ų | 170 | 158 Ų | 158 | 89% | 0.89 | 82% | 0.82 | S | S | * | * | trans | -159.5 | 107.8 | 130.2 | -103.7 | 157.5 | 0 | 0 | 0 | 108 | ||||
| 67 | Q | 25.5 | Very low | 29.4 | Very low | 202 Ų | 202 | 162.9 Ų | 162.9 | 94% | 0.944 | 83% | 0.827 | S | S | * | * | trans | -119.2 | 99.5 | -178.2 | -163.1 | 148.3 | -2.4 | 0 | 0 | 105.4 | ||||
| 68 | S | 33 | Very low | 29.8 | Very low | 89 Ų | 89 | 157.8 Ų | 157.8 | 62% | 0.622 | 82% | 0.82 | S | S | * | * | trans | -126.5 | 109.6 | 175.4 | 55.3 | 0 | 0 | 0 | 0 | 107 | ||||
| 69 | Q | 28.6 | Very low | 30.3 | Very low | 179 Ų | 179 | 156.6 Ų | 156.6 | 84% | 0.836 | 82% | 0.818 | S | S | * | * | 71.2 | 94 | 103.8 | -68.9 | -179 | -9.9 | 0 | 0 | 111.4 | |||||
| 70 | V | 27.4 | Very low | 30.6 | Very low | 114 Ų | 114 | 155 Ų | 155 | 69% | 0.691 | 81% | 0.814 | S | S | * | * | 86.1 | 119.7 | 80 | 170.8 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 71 | E | 26.7 | Very low | 31.1 | Very low | 166 Ų | 166 | 151.6 Ų | 151.6 | 78% | 0.776 | 81% | 0.806 | S | S | * | * | trans | 65.5 | 107.1 | 155.6 | -69.2 | 158.5 | -162.9 | 0 | 0 | 118.2 | ||||
| 72 | D | 34.8 | Very low | 31.5 | Very low | 169 Ų | 169 | 148.6 Ų | 148.6 | 90% | 0.904 | 79% | 0.793 | S | S | * | * | -152.5 | 120.9 | 121 | -104.8 | -31.5 | 0 | 0 | 0 | 110.8 | |||||
| 73 | Q | 27.6 | Very low | 32.1 | Very low | 175 Ų | 175 | 147.2 Ų | 147.2 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | -74 | 125.3 | 172.2 | -61.4 | 173.3 | 15.9 | 0 | 0 | 108.1 | ||||
| 74 | Q | 32.1 | Very low | 32.8 | Very low | 185 Ų | 185 | 147.3 Ų | 147.3 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | trans | -157.8 | 105.6 | 148.4 | -110.8 | 159.3 | 43.2 | 0 | 0 | 110.8 | N76 | Q74-N76 PolarHBondContact O-N 2.88Š| ||
| 75 | N | 27.9 | Very low | 33.5 | Very low | 164 Ų | 164 | 149.7 Ų | 149.7 | 88% | 0.877 | 79% | 0.789 | S | S | * | * | trans | -60.6 | 96.3 | 169.2 | -63 | -38.1 | 0 | 0 | 0 | 109.3 | ||||
| 76 | N | 36.7 | Very low | 34.3 | Very low | 141 Ų | 141 | 150.6 Ų | 150.6 | 75% | 0.754 | 79% | 0.788 | S | S | * | * | trans | -136.2 | 101.8 | 155.6 | -105.3 | -22.5 | 0 | 0 | 0 | 103.8 | Q74 P78 | Q74-N76 PolarHBondContact O-N 2.88Å; N76-P78 WeakPolarHBondContact O-CD 3.28Å; N76-P78 VanDerWaalsContact O-CG 3.28Å; N76-P78 WeakPolarHBondContact O-CG 2.82Å; N76-P78 VanDerWaalsContact O-N 3.14Å | ||
| 77 | E | 29.1 | Very low | 35.3 | Very low | 199 Ų | 199 | 151 Ų | 151 | 93% | 0.93 | 79% | 0.785 | S | S | * | * | trans | -63.6 | 103.3 | 173.6 | -65.4 | -172.9 | 151.2 | 0 | 0 | 108.6 | ||||
| 78 | P | 35.1 | Very low | 36.5 | Very low | 111 Ų | 111 | 152.1 Ų | 152.1 | 72% | 0.721 | 78% | 0.781 | S | S | * | * | trans | -93.8 | 116.5 | 169.8 | 6.6 | 19.3 | 0 | 0 | 0 | 104.5 | N76 Q80 | N76-P78 WeakPolarHBondContact O-CD 3.28Å; N76-P78 VanDerWaalsContact O-CG 3.28Å; N76-P78 WeakPolarHBondContact O-CG 2.82Å; N76-P78 VanDerWaalsContact O-N 3.14Å; P78-Q80 PolarHBondContact O-N 2.83Å | ||
| 79 | V | 40 | Very low | 37.6 | Very low | 127 Ų | 127 | 154 Ų | 154 | 77% | 0.77 | 78% | 0.779 | S | S | * | * | trans | -10.3 | 114.9 | 161.8 | 178 | 0 | 0 | 0 | 0 | 111.1 | V81 | V79-V81 PolarHBondContact O-N 2.67Š| ||
| 80 | Q | 36.5 | Very low | 38.9 | Very low | 162 Ų | 162 | 155.5 Ų | 155.5 | 76% | 0.757 | 78% | 0.778 | S | S | * | * | trans | -58.8 | 82.5 | 175 | -69.6 | -178.5 | 10.9 | 0 | 0 | 108.8 | P78 M82 | P78-Q80 PolarHBondContact O-N 2.83Å; Q80-M82 HydrophobicContact CB-CE 4.4Å; Q80-M82 PolarHBondContact O-N 2.72Å; Q80-M82 VanDerWaalsContact OE1-CE 3.31Å | ||
| 81 | V | 39.5 | Very low | 40 | Very low | 119 Ų | 119 | 158 Ų | 158 | 72% | 0.721 | 77% | 0.774 | S | S | * | * | trans | -68.5 | 89 | 155.6 | -178.6 | 0 | 0 | 0 | 0 | 102.3 | V79 P83 | V79-V81 PolarHBondContact O-N 2.67Å; V81-P83 WeakPolarHBondContact O-CD 3.45Å | ||
| 82 | M | 37.3 | Very low | 41.5 | Very low | 125 Ų | 125 | 154.4 Ų | 154.4 | 62% | 0.616 | 76% | 0.764 | S | S | * | * | trans | -37.9 | 118.9 | 165 | -76.1 | -77.8 | 141.9 | 0 | 0 | 105.5 | Q80 Q84 | Q80-M82 HydrophobicContact CB-CE 4.4Å; Q80-M82 PolarHBondContact O-N 2.72Å; Q80-M82 VanDerWaalsContact OE1-CE 3.31Å; M82-Q84 PolarHBondContact O-N 2.63Å | ||
| 83 | P | 40.1 | Very low | 43.1 | Very low | 109 Ų | 109 | 149.6 Ų | 149.6 | 71% | 0.708 | 75% | 0.754 | S | S | * | * | trans | -49.7 | 115.3 | 174 | -21.2 | 29.7 | 0 | 0 | 0 | 104.4 | V81 E85 | V81-P83 WeakPolarHBondContact O-CD 3.45Å; P83-E85 PolarHBondContact O-N 2.74Å | ||
| 84 | Q | 42.2 | Very low | 45.4 | Very low | 183 Ų | 183 | 151.3 Ų | 151.3 | 86% | 0.855 | 75% | 0.753 | S | S | * | * | trans | -60.4 | 92.6 | 162.7 | -77.4 | -174.8 | -9.3 | 0 | 0 | 102.6 | M82 | M82-Q84 PolarHBondContact O-N 2.63Š| ||
| 85 | E | 43.3 | Very low | 47 | Very low | 160 Ų | 160 | 149.7 Ų | 149.7 | 75% | 0.748 | 74% | 0.74 | S | S | * | * | trans | -46.4 | 122 | 172.7 | -79.7 | -172.2 | 144 | 0 | 0 | 104.1 | P83 Q87 | P83-E85 PolarHBondContact O-N 2.74Å; E85-Q87 VanDerWaalsContact C-N 3.33Å; E85-Q87 VanDerWaalsContact O-CA 3.3Å; E85-Q87 WeakPolarHBondContact O-CA 3.3Å; E85-Q87 PolarHBondContact O-N 3.49Å | ||
| 86 | P | 46.4 | Very low | 49.3 | Very low | 114 Ų | 114 | 142.7 Ų | 142.7 | 74% | 0.74 | 70% | 0.703 | S | S | * | * | trans | -52 | 108.9 | -173.4 | 18.9 | -31 | 0 | 0 | 0 | 105.2 | R88 | P86-R88 WeakPolarHBondContact O-CA 3.34Å; P86-R88 PolarHBondContact O-N 2.75Å | ||
| 87 | Q | 50.7 | Low | 50.8 | Low | 179 Ų | 179 | 138.4 Ų | 138.4 | 84% | 0.836 | 68% | 0.682 | S | S | * | * | trans | -52.6 | 97.9 | -160.9 | -130.6 | 162.1 | -27.6 | 0 | 0 | 105.2 | E85 Q89 | E85-Q87 VanDerWaalsContact C-N 3.33Å; E85-Q87 VanDerWaalsContact O-CA 3.3Å; E85-Q87 WeakPolarHBondContact O-CA 3.3Å; E85-Q87 PolarHBondContact O-N 3.49Å; Q87-Q89 VanDerWaalsContact C-N 3.32Å; Q87-Q89 PolarHBondContact O-N 2.99Å | ||
| 88 | R | 52 | Low | 52.9 | Low | 225 Ų | 225 | 133 Ų | 133 | 85% | 0.849 | 66% | 0.659 | S | S | * | * | trans | -62.8 | 108.7 | -169.1 | -81 | -174.2 | -177 | 167.3 | 3.2 | 102.8 | P86 R90 | P86-R88 WeakPolarHBondContact O-CA 3.34Å; P86-R88 PolarHBondContact O-N 2.75Å; R88-R90 VanDerWaalsContact C-N 3.32Å; R88-R90 PolarHBondContact O-N 2.91Å | ||
| 89 | Q | 55.9 | Low | 54.6 | Low | 128 Ų | 128 | 132 Ų | 132 | 60% | 0.598 | 64% | 0.644 | S | S | * | * | trans | -53.5 | 105.8 | -172.8 | -76.7 | 150.5 | -27.6 | 0 | 0 | 105.4 | Q87 R91 T96 | Q87-Q89 VanDerWaalsContact C-N 3.32Å; Q87-Q89 PolarHBondContact O-N 2.99Å; Q89-R91 WeakPolarHBondContact O-CG 3.46Å; Q89-R91 PolarHBondContact O-N 3.35Å; Q89-T96 HydrophobicContact CB-CG2 4.14Å | ||
| 90 | R | 56.7 | Low | 56 | Low | 211 Ų | 211 | 128.8 Ų | 128.8 | 80% | 0.796 | 62% | 0.623 | S | S | * | * | trans | -61.2 | 118.1 | -172.8 | -69.7 | -171.8 | 176.5 | -171.1 | -0.7 | 104.9 | R88 V97 | R88-R90 VanDerWaalsContact C-N 3.32Å; R88-R90 PolarHBondContact O-N 2.91Å; R90-V97 HydrophobicContact CB-CG2 4.47Å; R90-V97 WeakPolarHBondContact O-CG2 3.37Å; R90-V97 PolarHBondContact O-N 3.2Å | ||
| 91 | R | 50 | Low | 57.6 | Low | 165 Ų | 165 | 129 Ų | 129 | 62% | 0.623 | 62% | 0.617 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -92.1 | 127.5 | 179 | -66.8 | -176.4 | 179 | -110.7 | 0.9 | 106.9 | Q89 W95 T96 | Q89-R91 WeakPolarHBondContact O-CG 3.46Å; Q89-R91 PolarHBondContact O-N 3.35Å; R91-W95 WeakPolarHBondContact CA-O 3.23Å; R91-T96 HydrophobicContact CG-CG2 4.37Å |
| 92 | V | 57.8 | Low | 59 | Low | 91 Ų | 91 | 130.3 Ų | 130.3 | 55% | 0.552 | 62% | 0.615 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -95.1 | 98.2 | 163.7 | -177.8 | 0 | 0 | 0 | 0 | 105.1 | R94 W95 L100 | V92-R94 PolarHBondContact O-N 3.15Å; V92-W95 PolarHBondContact N-O 3.18Å; V92-W95 PolarHBondContact O-N 3.15Å; V92-L100 HydrophobicContact CB-CD1 4Å; V92-L100 HydrophobicContact CG2-CD1 4.21Å |
| 93 | G | 68.3 | Low | 60 | Low | 69 Ų | 69 | 127.6 Ų | 127.6 | 71% | 0.711 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 59.7 | -119.2 | -170.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 94 | R | 75.7 | Confident | 61 | Low | 210 Ų | 210 | 128.6 Ų | 128.6 | 79% | 0.792 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | -14.5 | -176.5 | -159.2 | 173 | -175.4 | -113.2 | 1.9 | 113.8 | V92 | V92-R94 PolarHBondContact O-N 3.15Š|
| 95 | W | 65.4 | Low | 61.8 | Low | 152 Ų | 152 | 123.3 Ų | 123.3 | 58% | 0.576 | 60% | 0.6 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -106.8 | 142.6 | -172.2 | -59.3 | -76.8 | 0 | 0 | 0 | 112.4 | R91 V92 L100 | R91-W95 WeakPolarHBondContact CA-O 3.23Å; V92-W95 PolarHBondContact N-O 3.18Å; V92-W95 PolarHBondContact O-N 3.15Å; W95-L100 HydrophobicContact CB-CD2 4.24Å; W95-L100 HydrophobicContact CB-CG 4.21Å |
| 96 | T | 77.4 | Confident | 62.5 | Low | 17 Ų | 17 | 121.1 Ų | 121.1 | 10% | 0.104 | 59% | 0.592 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -78.2 | 150.3 | 170 | 53.5 | 0 | 0 | 0 | 0 | 110.3 | Q89 R91 D98 Q99 L100 | Q89-T96 HydrophobicContact CB-CG2 4.14Å; R91-T96 HydrophobicContact CG-CG2 4.37Å; T96-D98 PolarHBondContact O-N 3.26Å; T96-D98 VanDerWaalsContact O-N 3.15Å; T96-Q99 WeakPolarHBondContact O-CB 3.3Å; T96-Q99 PolarHBondContact O-N 3.3Å; T96-Q99 VanDerWaalsContact OG1-CD 3.28Å; T96-Q99 VanDerWaalsContact OG1-CG 3.23Å; T96-Q99 WeakPolarHBondContact OG1-CG 3.47Å; T96-Q99 PolarHBondContact OG1-OE1 3.42Å; T96-L100 PolarHBondContact O-N 2.94Å |
| 97 | V | 67.8 | Low | 62.9 | Low | 51 Ų | 51 | 119.7 Ų | 119.7 | 31% | 0.309 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -51.9 | -38.7 | 176.9 | 172 | 0 | 0 | 0 | 0 | 112.6 | R90 Q99 L100 R101 | R90-V97 HydrophobicContact CB-CG2 4.47Å; R90-V97 WeakPolarHBondContact O-CG2 3.37Å; R90-V97 PolarHBondContact O-N 3.2Å; V97-Q99 VanDerWaalsContact C-N 3.29Å; V97-Q99 PolarHBondContact O-N 3.32Å; V97-L100 PolarHBondContact O-N 3.37Å; V97-R101 HydrophobicContact CG1-CG 4.47Å; V97-R101 PolarHBondContact O-N 2.97Å |
| 98 | D | 73.1 | Confident | 62.9 | Low | 84 Ų | 84 | 114.3 Ų | 114.3 | 45% | 0.449 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -64.6 | -31.6 | 177.8 | -62.5 | -32.4 | 0 | 0 | 0 | 113.2 | T96 Q102 | T96-D98 PolarHBondContact O-N 3.26Å; T96-D98 VanDerWaalsContact O-N 3.15Å; D98-Q102 VanDerWaalsContact O-CG 3.3Å; D98-Q102 WeakPolarHBondContact O-CG 3.38Å; D98-Q102 PolarHBondContact O-N 3.22Å; D98-Q102 VanDerWaalsContact O-N 3.15Å |
| 99 | Q | 70.9 | Confident | 62.7 | Low | 90 Ų | 90 | 111.7 Ų | 111.7 | 42% | 0.421 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -72.1 | -38 | 175.3 | -74.1 | 170.9 | -10.8 | 0 | 0 | 110.7 | T96 V97 Q102 T103 | T96-Q99 WeakPolarHBondContact O-CB 3.3Å; T96-Q99 PolarHBondContact O-N 3.3Å; T96-Q99 VanDerWaalsContact OG1-CD 3.28Å; T96-Q99 VanDerWaalsContact OG1-CG 3.23Å; T96-Q99 WeakPolarHBondContact OG1-CG 3.47Å; T96-Q99 PolarHBondContact OG1-OE1 3.42Å; V97-Q99 VanDerWaalsContact C-N 3.29Å; V97-Q99 PolarHBondContact O-N 3.32Å; Q99-Q102 WeakPolarHBondContact O-CB 3.45Å; Q99-Q102 PolarHBondContact O-N 3Å; Q99-T103 PolarHBondContact O-N 3.24Å |
| 100 | L | 69.3 | Low | 62.3 | Low | 61 Ų | 61 | 114 Ų | 114 | 32% | 0.319 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -65.9 | -42.3 | 174.9 | -66.8 | 172.7 | 0 | 0 | 0 | 111.3 | V92 W95 T96 V97 Q102 T103 D104 | V92-L100 HydrophobicContact CB-CD1 4Å; V92-L100 HydrophobicContact CG2-CD1 4.21Å; W95-L100 HydrophobicContact CB-CD2 4.24Å; W95-L100 HydrophobicContact CB-CG 4.21Å; T96-L100 PolarHBondContact O-N 2.94Å; V97-L100 PolarHBondContact O-N 3.37Å; L100-Q102 VanDerWaalsContact C-N 3.26Å; L100-Q102 PolarHBondContact O-N 3.13Å; L100-T103 WeakPolarHBondContact O-CA 3.43Å; L100-T103 WeakPolarHBondContact O-CB 3.35Å; L100-T103 PolarHBondContact O-N 3.35Å; L100-T103 PolarHBondContact O-OG1 3.29Å; L100-D104 PolarHBondContact O-N 2.64Å |
| 101 | R | 69.5 | Low | 62.1 | Low | 167 Ų | 167 | 109 Ų | 109 | 63% | 0.63 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -61.7 | -32.6 | 174.5 | -71.8 | -177.1 | -169.7 | -178.1 | 3.2 | 113.1 | V97 T103 D104 | V97-R101 HydrophobicContact CG1-CG 4.47Å; V97-R101 PolarHBondContact O-N 2.97Å; R101-T103 PolarHBondContact O-N 2.87Å; R101-D104 PolarHBondContact O-N 2.78Å |
| 102 | Q | 68.8 | Low | 62.2 | Low | 146 Ų | 146 | 104 Ų | 104 | 68% | 0.682 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -65.2 | -25.1 | 172.1 | -72.2 | 169.9 | 19.6 | 0 | 0 | 112.3 | D98 Q99 L100 | D98-Q102 VanDerWaalsContact O-CG 3.3Å; D98-Q102 WeakPolarHBondContact O-CG 3.38Å; D98-Q102 PolarHBondContact O-N 3.22Å; D98-Q102 VanDerWaalsContact O-N 3.15Å; Q99-Q102 WeakPolarHBondContact O-CB 3.45Å; Q99-Q102 PolarHBondContact O-N 3Å; L100-Q102 VanDerWaalsContact C-N 3.26Å; L100-Q102 PolarHBondContact O-N 3.13Å |
| 103 | T | 58.7 | Low | 61.8 | Low | 68 Ų | 68 | 103.6 Ų | 103.6 | 42% | 0.417 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -84.7 | -13.3 | 175.1 | 68.4 | 0 | 0 | 0 | 0 | 114.4 | Q99 L100 R101 G105 I106 | Q99-T103 PolarHBondContact O-N 3.24Å; L100-T103 WeakPolarHBondContact O-CA 3.43Å; L100-T103 WeakPolarHBondContact O-CB 3.35Å; L100-T103 PolarHBondContact O-N 3.35Å; L100-T103 PolarHBondContact O-OG1 3.29Å; R101-T103 PolarHBondContact O-N 2.87Å; T103-G105 PolarHBondContact O-N 3.29Å; T103-G105 VanDerWaalsContact O-N 3.13Å; T103-I106 CarbonylContact O-C 3.37Å; T103-I106 VanDerWaalsContact O-CA 3.32Å; T103-I106 WeakPolarHBondContact O-CA 3.42Å; T103-I106 WeakPolarHBondContact O-CB 3.32Å; T103-I106 PolarHBondContact O-N 3.31Å; T103-I106 VanDerWaalsContact O-O 3.12Å |
| 104 | D | 61 | Low | 61.4 | Low | 130 Ų | 130 | 106.4 Ų | 106.4 | 70% | 0.695 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.9 | -26 | 178 | -72.9 | -22.1 | 0 | 0 | 0 | 112.5 | L100 R101 | L100-D104 PolarHBondContact O-N 2.64Å; R101-D104 PolarHBondContact O-N 2.78Å |
| 105 | G | 59.7 | Low | 60.1 | Low | 72 Ų | 72 | 104.6 Ų | 104.6 | 74% | 0.742 | 55% | 0.55 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.1 | -16.7 | 171.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | T103 V107 | T103-G105 PolarHBondContact O-N 3.29Å; T103-G105 VanDerWaalsContact O-N 3.13Å; G105-V107 PolarHBondContact O-N 3.24Å |
| 106 | I | 58.2 | Low | 59.8 | Low | 114 Ų | 114 | 106 Ų | 106 | 59% | 0.585 | 56% | 0.561 | S | S | * | * | S | Bend | trans | -93.7 | 82.2 | 176.9 | -52.1 | 176.8 | 0 | 0 | 0 | 106.8 | T103 P108 | T103-I106 CarbonylContact O-C 3.37Å; T103-I106 VanDerWaalsContact O-CA 3.32Å; T103-I106 WeakPolarHBondContact O-CA 3.42Å; T103-I106 WeakPolarHBondContact O-CB 3.32Å; T103-I106 PolarHBondContact O-N 3.31Å; T103-I106 VanDerWaalsContact O-O 3.12Å; I106-P108 WeakPolarHBondContact O-CD 3.13Å |
| 107 | V | 53.2 | Low | 58.8 | Low | 84 Ų | 84 | 107.8 Ų | 107.8 | 51% | 0.509 | 58% | 0.577 | S | S | . | * | trans | -51.8 | 113 | 163.2 | 177.3 | 0 | 0 | 0 | 0 | 106.5 | G105 L109 Y111 | G105-V107 PolarHBondContact O-N 3.24Å; V107-L109 PolarHBondContact O-N 3.32Å; V107-Y111 HydrophobicContact CG1-CG 4.27Å; V107-Y111 VanDerWaalsContact CG1-O 3.23Å; V107-Y111 WeakPolarHBondContact CG1-O 3.46Å | ||
| 108 | P | 51.1 | Low | 58.1 | Low | 65 Ų | 65 | 109 Ų | 109 | 42% | 0.422 | 59% | 0.588 | S | S | . | * | trans | -51.4 | 137.7 | -179.5 | -21.9 | 27.9 | 0 | 0 | 0 | 107.5 | I106 Q110 Y111 | I106-P108 WeakPolarHBondContact O-CD 3.13Å; P108-Q110 HydrophobicContact CB-CB 4.49Å; P108-Q110 PolarHBondContact O-N 3.28Å; P108-Y111 HydrophobicContact CB-CD2 3.85Å; P108-Y111 HydrophobicContact CB-CE2 4.28Å; P108-Y111 HydrophobicContact CG-CD2 3.65Å; P108-Y111 HydrophobicContact CG-CE2 3.79Å; P108-Y111 WeakPolarHBondContact O-CA 3.31Å; P108-Y111 WeakPolarHBondContact O-CB 3.46Å; P108-Y111 PolarHBondContact O-N 3.45Å | ||
| 109 | L | 48 | Very low | 57.5 | Low | 171 Ų | 171 | 111 Ų | 111 | 90% | 0.895 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.5 | -23.7 | -179.3 | -106.5 | 89.8 | 0 | 0 | 0 | 113.1 | V107 Y111 | V107-L109 PolarHBondContact O-N 3.32Å; L109-Y111 VanDerWaalsContact C-N 3.27Å; L109-Y111 PolarHBondContact O-N 3.37Å |
| 110 | Q | 48.7 | Very low | 56.8 | Low | 176 Ų | 176 | 117.9 Ų | 117.9 | 82% | 0.822 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.8 | -36.9 | 171.9 | -64.1 | -168.3 | -34 | 0 | 0 | 113.1 | P108 G112 | P108-Q110 HydrophobicContact CB-CB 4.49Å; P108-Q110 PolarHBondContact O-N 3.28Å; Q110-G112 PolarHBondContact O-N 3.06Å |
| 111 | Y | 52.2 | Low | 56.1 | Low | 105 Ų | 105 | 118.5 Ų | 118.5 | 41% | 0.412 | 64% | 0.638 | S | S | . | * | S | Bend | trans | -84.1 | 89.1 | 168.7 | -62.6 | -90.4 | 0 | 0 | 0 | 107.7 | V107 P108 L109 T113 | V107-Y111 HydrophobicContact CG1-CG 4.27Å; V107-Y111 VanDerWaalsContact CG1-O 3.23Å; V107-Y111 WeakPolarHBondContact CG1-O 3.46Å; P108-Y111 HydrophobicContact CB-CD2 3.85Å; P108-Y111 HydrophobicContact CB-CE2 4.28Å; P108-Y111 HydrophobicContact CG-CD2 3.65Å; P108-Y111 HydrophobicContact CG-CE2 3.79Å; P108-Y111 WeakPolarHBondContact O-CA 3.31Å; P108-Y111 WeakPolarHBondContact O-CB 3.46Å; P108-Y111 PolarHBondContact O-N 3.45Å; L109-Y111 VanDerWaalsContact C-N 3.27Å; L109-Y111 PolarHBondContact O-N 3.37Å; Y111-T113 PolarHBondContact O-N 3.31Å |
| 112 | G | 50.6 | Low | 55.7 | Low | 61 Ų | 61 | 115.4 Ų | 115.4 | 63% | 0.629 | 63% | 0.632 | S | S | * | * | trans | -47.6 | 111.3 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q110 | Q110-G112 PolarHBondContact O-N 3.06Š| ||
| 113 | T | 51.2 | Low | 55.1 | Low | 83 Ų | 83 | 111.1 Ų | 111.1 | 51% | 0.509 | 62% | 0.615 | S | S | . | * | trans | -67.8 | 135.7 | 174.1 | 179.7 | 0 | 0 | 0 | 0 | 110.6 | Y111 K115 | Y111-T113 PolarHBondContact O-N 3.31Å; T113-K115 PolarHBondContact OG1-N 3.27Å | ||
| 114 | N | 58 | Low | 54.7 | Low | 127 Ų | 127 | 109.7 Ų | 109.7 | 68% | 0.679 | 62% | 0.615 | S | S | * | * | trans | -88.3 | 1.3 | 175.6 | 55.5 | -21.8 | 0 | 0 | 0 | 113.2 | F116 A117 | N114-F116 PolarHBondContact O-N 3.13Å; N114-F116 VanDerWaalsContact O-N 3.09Å; N114-A117 HydrophobicContact CB-CB 4.22Å; N114-A117 WeakPolarHBondContact O-CB 3.48Å; N114-A117 PolarHBondContact O-N 3.5Å | ||
| 115 | K | 49.9 | Very low | 54.2 | Low | 172 Ų | 172 | 112.7 Ų | 112.7 | 75% | 0.748 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.1 | -29 | -175.7 | -164.8 | 177.8 | -71 | -172.5 | 0 | 113.3 | T113 | T113-K115 PolarHBondContact OG1-N 3.27Š|
| 116 | F | 58.4 | Low | 54 | Low | 183 Ų | 183 | 112.7 Ų | 112.7 | 80% | 0.803 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.9 | 7.8 | 176.8 | -51.7 | -70.4 | 0 | 0 | 0 | 113.2 | N114 S118 | N114-F116 PolarHBondContact O-N 3.13Å; N114-F116 VanDerWaalsContact O-N 3.09Å; F116-S118 PolarHBondContact O-N 3.01Å; F116-S118 VanDerWaalsContact O-N 3.14Å |
| 117 | A | 57.3 | Low | 53.9 | Low | 54 Ų | 54 | 110.7 Ų | 110.7 | 45% | 0.446 | 61% | 0.614 | S | S | . | * | trans | -78.5 | 100.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | N114 Q119 | N114-A117 HydrophobicContact CB-CB 4.22Å; N114-A117 WeakPolarHBondContact O-CB 3.48Å; N114-A117 PolarHBondContact O-N 3.5Å; A117-Q119 PolarHBondContact O-N 2.84Å | ||
| 118 | S | 52.9 | Low | 54 | Low | 77 Ų | 77 | 112.3 Ų | 112.3 | 54% | 0.538 | 63% | 0.627 | S | S | . | * | trans | -61.2 | 126.8 | 170.8 | 143.4 | 0 | 0 | 0 | 0 | 110.6 | F116 R120 | F116-S118 PolarHBondContact O-N 3.01Å; F116-S118 VanDerWaalsContact O-N 3.14Å; S118-R120 PolarHBondContact O-N 3.27Å; S118-R120 VanDerWaalsContact O-N 3.1Å; S118-R120 WeakPolarHBondContact OG-CB 3.23Å; S118-R120 PolarHBondContact OG-N 3.44Å | ||
| 119 | Q | 60.7 | Low | 54.1 | Low | 126 Ų | 126 | 118 Ų | 118 | 59% | 0.589 | 64% | 0.64 | S | S | * | * | trans | -61 | -14.1 | 171.1 | -167 | 70.4 | 27.5 | 0 | 0 | 112.9 | A117 G121 M122 | A117-Q119 PolarHBondContact O-N 2.84Å; Q119-G121 PolarHBondContact O-N 2.92Å; Q119-M122 WeakPolarHBondContact O-CB 3.37Å; Q119-M122 PolarHBondContact O-N 3.18Å | ||
| 120 | R | 55.2 | Low | 54.4 | Low | 234 Ų | 234 | 115 Ų | 115 | 88% | 0.883 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.7 | 113.6 | 179.1 | -157.3 | 160 | 95.1 | 107.6 | -5.6 | 109.7 | S118 | S118-R120 PolarHBondContact O-N 3.27Å; S118-R120 VanDerWaalsContact O-N 3.1Å; S118-R120 WeakPolarHBondContact OG-CB 3.23Å; S118-R120 PolarHBondContact OG-N 3.44Å |
| 121 | G | 55.2 | Low | 54.8 | Low | 73 Ų | 73 | 112.9 Ų | 112.9 | 75% | 0.753 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 89 | 2.8 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | Q119 | Q119-G121 PolarHBondContact O-N 2.92Š|
| 122 | M | 60.3 | Low | 54.9 | Low | 103 Ų | 103 | 112.7 Ų | 112.7 | 51% | 0.507 | 64% | 0.638 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80.7 | -22.7 | 177 | -70.9 | -175.4 | 71 | 0 | 0 | 113.6 | Q119 | Q119-M122 WeakPolarHBondContact O-CB 3.37Å; Q119-M122 PolarHBondContact O-N 3.18Å |
| 123 | T | 56 | Low | 54.9 | Low | 55 Ų | 55 | 113.9 Ų | 113.9 | 34% | 0.337 | 63% | 0.633 | S | S | . | * | S | Bend | trans | -90.6 | 123.3 | 166.9 | 13.8 | 0 | 0 | 0 | 0 | 108.2 | ||
| 124 | G | 51.4 | Low | 55.1 | Low | 39 Ų | 39 | 119 Ų | 119 | 40% | 0.402 | 65% | 0.649 | S | S | . | * | P | Polyproline II helix | trans | -56 | 145.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | G126 T127 | G124-G126 PolarHBondContact O-N 3.29Å; G124-G126 VanDerWaalsContact O-N 3.16Å; G124-T127 PolarHBondContact O-N 3.19Å; G124-T127 VanDerWaalsContact O-N 3.15Å; G124-T127 PolarHBondContact O-OG1 3.09Å; G124-T127 VanDerWaalsContact O-OG1 3.07Å |
| 125 | F | 50.5 | Low | 55 | Low | 193 Ų | 193 | 118.4 Ų | 118.4 | 85% | 0.846 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.6 | 124 | 170.1 | -177.6 | -96.2 | 0 | 0 | 0 | 108.9 | ||
| 126 | G | 54.5 | Low | 55.2 | Low | 71 Ų | 71 | 116 Ų | 116 | 73% | 0.732 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 93.3 | -1.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | G124 P128 | G124-G126 PolarHBondContact O-N 3.29Å; G124-G126 VanDerWaalsContact O-N 3.16Å; G126-P128 WeakPolarHBondContact O-CD 3.48Å |
| 127 | T | 56 | Low | 55.2 | Low | 72 Ų | 72 | 109.1 Ų | 109.1 | 44% | 0.442 | 62% | 0.623 | S | S | . | * | trans | -73.7 | 118.5 | 170.2 | -32.4 | 0 | 0 | 0 | 0 | 109.3 | G124 R129 | G124-T127 PolarHBondContact O-N 3.19Å; G124-T127 VanDerWaalsContact O-N 3.15Å; G124-T127 PolarHBondContact O-OG1 3.09Å; G124-T127 VanDerWaalsContact O-OG1 3.07Å; T127-R129 PolarHBondContact O-N 3.31Å; T127-R129 VanDerWaalsContact O-N 3.15Å | ||
| 128 | P | 55.8 | Low | 55.6 | Low | 118 Ų | 118 | 116 Ų | 116 | 77% | 0.766 | 65% | 0.646 | S | S | * | * | trans | -60.8 | 121.6 | 178.5 | 22.9 | -30.7 | 0 | 0 | 0 | 109.1 | G126 N130 | G126-P128 WeakPolarHBondContact O-CD 3.48Å; P128-N130 PolarHBondContact O-N 2.96Å | ||
| 129 | R | 54 | Low | 56.4 | Low | 185 Ų | 185 | 119.6 Ų | 119.6 | 70% | 0.698 | 66% | 0.659 | S | S | * | * | trans | -73.7 | 113.5 | 167.3 | -70.9 | -176.6 | 177 | 173.7 | -0.6 | 106.4 | T127 T131 | T127-R129 PolarHBondContact O-N 3.31Å; T127-R129 VanDerWaalsContact O-N 3.15Å; R129-T131 VanDerWaalsContact C-N 3.31Å; R129-T131 HydrophobicContact CB-CG2 4.32Å; R129-T131 PolarHBondContact O-N 3.21Å | ||
| 130 | N | 53 | Low | 56.4 | Low | 108 Ų | 108 | 119.7 Ų | 119.7 | 58% | 0.578 | 66% | 0.663 | S | S | * | * | trans | -62.9 | 98.7 | 170.4 | -167.2 | -18.4 | 0 | 0 | 0 | 107.7 | P128 S132 T133 | P128-N130 PolarHBondContact O-N 2.96Å; N130-S132 PolarHBondContact OD1-N 2.73Å; N130-S132 PolarHBondContact OD1-OG 3.42Å; N130-T133 WeakPolarHBondContact ND2-CG2 3.45Å; N130-T133 PolarHBondContact OD1-N 2.82Å; N130-T133 VanDerWaalsContact OD1-N 3.15Å | ||
| 131 | T | 57.2 | Low | 56.9 | Low | 132 Ų | 132 | 117.7 Ų | 117.7 | 81% | 0.81 | 66% | 0.663 | S | S | * | * | trans | -100.3 | -2.6 | 175.7 | 47.1 | 0 | 0 | 0 | 0 | 111.1 | R129 | R129-T131 VanDerWaalsContact C-N 3.31Å; R129-T131 HydrophobicContact CB-CG2 4.32Å; R129-T131 PolarHBondContact O-N 3.21Å | ||
| 132 | S | 55.2 | Low | 57.3 | Low | 100 Ų | 100 | 122.2 Ų | 122.2 | 70% | 0.699 | 67% | 0.665 | S | S | * | * | trans | -107.3 | 3.3 | -171.9 | 58.3 | 0 | 0 | 0 | 0 | 113.9 | N130 K134 | N130-S132 PolarHBondContact OD1-N 2.73Å; N130-S132 PolarHBondContact OD1-OG 3.42Å; S132-K134 VanDerWaalsContact C-N 3.26Å; S132-K134 PolarHBondContact O-N 3.42Å | ||
| 133 | T | 50 | Low | 57.3 | Low | 86 Ų | 86 | 123.2 Ų | 123.2 | 53% | 0.528 | 67% | 0.672 | S | S | . | * | trans | -63.6 | 96.2 | 166.1 | 45.9 | 0 | 0 | 0 | 0 | 108.3 | N130 V135 | N130-T133 WeakPolarHBondContact ND2-CG2 3.45Å; N130-T133 PolarHBondContact OD1-N 2.82Å; N130-T133 VanDerWaalsContact OD1-N 3.15Å; T133-V135 PolarHBondContact O-N 3.37Å | ||
| 134 | K | 54.8 | Low | 58 | Low | 192 Ų | 192 | 124.3 Ų | 124.3 | 84% | 0.835 | 68% | 0.68 | S | S | * | * | trans | -55.4 | 95.4 | 159.1 | -123.8 | -176.7 | 178.9 | -169 | 0 | 105.4 | S132 V136 | S132-K134 VanDerWaalsContact C-N 3.26Å; S132-K134 PolarHBondContact O-N 3.42Å; K134-V136 VanDerWaalsContact C-N 3.3Å; K134-V136 PolarHBondContact O-N 3.27Å | ||
| 135 | V | 56.3 | Low | 58.6 | Low | 114 Ų | 114 | 128.8 Ų | 128.8 | 69% | 0.691 | 69% | 0.69 | S | S | * | * | trans | -72 | 96.7 | 174.5 | 179.1 | 0 | 0 | 0 | 0 | 105.6 | T133 S137 | T133-V135 PolarHBondContact O-N 3.37Å; V135-S137 PolarHBondContact O-N 3.13Å | ||
| 136 | V | 55.1 | Low | 59.4 | Low | 122 Ų | 122 | 126.6 Ų | 126.6 | 74% | 0.739 | 68% | 0.683 | S | S | * | * | trans | -79.9 | 107.3 | 168 | -171.1 | 0 | 0 | 0 | 0 | 105.4 | K134 | K134-V136 VanDerWaalsContact C-N 3.3Å; K134-V136 PolarHBondContact O-N 3.27Å | ||
| 137 | S | 57.9 | Low | 59.8 | Low | 37 Ų | 37 | 127.5 Ų | 127.5 | 26% | 0.259 | 67% | 0.67 | S | S | . | * | trans | -119 | 136.1 | 170.3 | 63.5 | 0 | 0 | 0 | 0 | 108.2 | V135 N139 L140 | V135-S137 PolarHBondContact O-N 3.13Å; S137-N139 PolarHBondContact O-N 2.84Å; S137-L140 PolarHBondContact O-N 2.82Å; S137-L140 WeakPolarHBondContact OG-CB 3.05Å; S137-L140 WeakPolarHBondContact OG-CD1 3.36Å | ||
| 138 | E | 65.8 | Low | 60.1 | Low | 198 Ų | 198 | 126.6 Ų | 126.6 | 93% | 0.925 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.7 | -21.2 | -179.6 | -61.9 | 178.5 | 179.6 | 0 | 0 | 113.3 | ||
| 139 | N | 69 | Low | 60.4 | Low | 154 Ų | 154 | 126.5 Ų | 126.5 | 82% | 0.824 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.2 | -0.2 | -175.9 | -49.3 | -27.4 | 0 | 0 | 0 | 114 | S137 | S137-N139 PolarHBondContact O-N 2.84Š|
| 140 | L | 62 | Low | 60.8 | Low | 127 Ų | 127 | 124.1 Ų | 124.1 | 67% | 0.665 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -108.4 | 124.8 | 175 | -94.3 | 84.6 | 0 | 0 | 0 | 109.9 | S137 E142 | S137-L140 PolarHBondContact O-N 2.82Å; S137-L140 WeakPolarHBondContact OG-CB 3.05Å; S137-L140 WeakPolarHBondContact OG-CD1 3.36Å; L140-E142 PolarHBondContact O-N 3.39Å |
| 141 | Q | 64.6 | Low | 60.9 | Low | 192 Ų | 192 | 121.8 Ų | 121.8 | 90% | 0.897 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 132.1 | 166.9 | -91.5 | 170.7 | -33.7 | 0 | 0 | 110.2 | L143 | Q141-L143 PolarHBondContact O-N 2.72Š|
| 142 | E | 63.2 | Low | 60.7 | Low | 169 Ų | 169 | 122 Ų | 122 | 79% | 0.79 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 127 | 172.3 | -63.3 | -171.8 | 162.6 | 0 | 0 | 109.4 | L140 | L140-E142 PolarHBondContact O-N 3.39Š|
| 143 | L | 60.7 | Low | 60.7 | Low | 124 Ų | 124 | 122.2 Ų | 122.2 | 65% | 0.649 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 134.2 | 173.9 | -78.6 | 168.2 | 0 | 0 | 0 | 109.3 | Q141 E145 I147 | Q141-L143 PolarHBondContact O-N 2.72Å; L143-E145 PolarHBondContact O-N 2.8Å; L143-I147 HydrophobicContact CD2-CG2 4.43Å |
| 144 | P | 70.3 | Confident | 60.9 | Low | 77 Ų | 77 | 125.5 Ų | 125.5 | 50% | 0.5 | 65% | 0.647 | S | S | . | * | P | Polyproline II helix | trans | -50 | 137.5 | 170.9 | -26.2 | 32.8 | 0 | 0 | 0 | 111.4 | E146 I147 A148 | P144-E146 PolarHBondContact O-N 2.85Å; P144-I147 HydrophobicContact CG-CD1 4.32Å; P144-I147 PolarHBondContact O-N 3.25Å; P144-A148 PolarHBondContact O-N 2.92Å |
| 145 | E | 64.8 | Low | 60.7 | Low | 134 Ų | 134 | 119.7 Ų | 119.7 | 63% | 0.626 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -56.9 | -29.9 | -172.7 | -60.1 | -173.5 | 166.6 | 0 | 0 | 113.5 | L143 I147 A148 R149 | L143-E145 PolarHBondContact O-N 2.8Å; E145-I147 PolarHBondContact O-N 2.7Å; E145-A148 PolarHBondContact O-N 3.41Å; E145-R149 WeakPolarHBondContact O-CB 3.4Å; E145-R149 VanDerWaalsContact O-CG 3.32Å; E145-R149 WeakPolarHBondContact O-CG 3.29Å; E145-R149 PolarHBondContact O-N 3.31Å; E145-R149 IonicContact OE2-CZ 3.37Å; E145-R149 IonicContact OE2-NH1 3.38Å; E145-R149 PolarHBondContact OE2-NH1 3.23Å; E145-R149 IonicContact OE2-NH2 3.85Å |
| 146 | E | 67.1 | Low | 60.3 | Low | 146 Ų | 146 | 122 Ų | 122 | 68% | 0.682 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -61.2 | -41.3 | 175.4 | -70.5 | 179.7 | -175.7 | 0 | 0 | 112.6 | P144 R149 M150 | P144-E146 PolarHBondContact O-N 2.85Å; E146-R149 PolarHBondContact O-N 3.09Å; E146-M150 PolarHBondContact O-N 3.28Å |
| 147 | I | 64.2 | Low | 59.7 | Low | 90 Ų | 90 | 123.6 Ų | 123.6 | 46% | 0.462 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -72.6 | -36.4 | 178.4 | -58.1 | 177.8 | 0 | 0 | 0 | 110.3 | L143 P144 E145 M150 | L143-I147 HydrophobicContact CD2-CG2 4.43Å; P144-I147 HydrophobicContact CG-CD1 4.32Å; P144-I147 PolarHBondContact O-N 3.25Å; E145-I147 PolarHBondContact O-N 2.7Å; I147-M150 PolarHBondContact O-N 3.11Å |
| 148 | A | 61.2 | Low | 59 | Low | 53 Ų | 53 | 130.8 Ų | 130.8 | 44% | 0.438 | 66% | 0.657 | S | S | . | * | H | α-helix | trans | -62.5 | -44.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | P144 E145 S151 | P144-A148 PolarHBondContact O-N 2.92Å; E145-A148 PolarHBondContact O-N 3.41Å; A148-S151 PolarHBondContact O-OG 2.89Å |
| 149 | R | 63.2 | Low | 58.2 | Low | 117 Ų | 117 | 124.7 Ų | 124.7 | 44% | 0.442 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -71.8 | -23.9 | 178.9 | -71.4 | -173.3 | -65.7 | -108.7 | 0.2 | 114.1 | E145 E146 S151 E152 | E145-R149 WeakPolarHBondContact O-CB 3.4Å; E145-R149 VanDerWaalsContact O-CG 3.32Å; E145-R149 WeakPolarHBondContact O-CG 3.29Å; E145-R149 PolarHBondContact O-N 3.31Å; E145-R149 IonicContact OE2-CZ 3.37Å; E145-R149 IonicContact OE2-NH1 3.38Å; E145-R149 PolarHBondContact OE2-NH1 3.23Å; E145-R149 IonicContact OE2-NH2 3.85Å; E146-R149 PolarHBondContact O-N 3.09Å; R149-S151 PolarHBondContact O-N 3.06Å; R149-S151 VanDerWaalsContact O-N 3.15Å; R149-E152 WeakPolarHBondContact O-CB 3.44Å; R149-E152 PolarHBondContact O-N 3.15Å |
| 150 | M | 61.3 | Low | 57 | Low | 135 Ų | 135 | 120 Ų | 120 | 67% | 0.665 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -52.3 | -39.1 | 174.5 | -93.6 | 176.7 | 60 | 0 | 0 | 111.9 | E146 I147 E152 S153 | E146-M150 PolarHBondContact O-N 3.28Å; I147-M150 PolarHBondContact O-N 3.11Å; M150-E152 VanDerWaalsContact C-N 3.27Å; M150-E152 PolarHBondContact O-N 3.3Å; M150-S153 PolarHBondContact O-N 3.3Å; M150-S153 PolarHBondContact O-OG 2.88Å |
| 151 | S | 54.6 | Low | 56.1 | Low | 59 Ų | 59 | 116.1 Ų | 116.1 | 41% | 0.413 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -75.6 | -8.2 | 179.9 | 74.1 | 0 | 0 | 0 | 0 | 115 | A148 R149 E154 | A148-S151 PolarHBondContact O-OG 2.89Å; R149-S151 PolarHBondContact O-N 3.06Å; R149-S151 VanDerWaalsContact O-N 3.15Å; S151-E154 CarbonylContact O-C 3.4Å |
| 152 | E | 53.6 | Low | 55.4 | Low | 137 Ų | 137 | 112.7 Ų | 112.7 | 64% | 0.64 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -76.8 | -33.2 | 173.9 | -66.6 | 179.6 | 163.5 | 0 | 0 | 111.4 | R149 M150 V155 | R149-E152 WeakPolarHBondContact O-CB 3.44Å; R149-E152 PolarHBondContact O-N 3.15Å; M150-E152 VanDerWaalsContact C-N 3.27Å; M150-E152 PolarHBondContact O-N 3.3Å; E152-V155 WeakPolarHBondContact O-CG2 3.38Å |
| 153 | S | 55.3 | Low | 54.5 | Low | 103 Ų | 103 | 113.6 Ų | 113.6 | 72% | 0.72 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -69.5 | -44.2 | 177.5 | 72 | 0 | 0 | 0 | 0 | 111.5 | M150 V155 | M150-S153 PolarHBondContact O-N 3.3Å; M150-S153 PolarHBondContact O-OG 2.88Å; S153-V155 PolarHBondContact O-N 2.88Å |
| 154 | E | 53.7 | Low | 53.8 | Low | 155 Ų | 155 | 116.7 Ų | 116.7 | 72% | 0.724 | 60% | 0.598 | S | S | * | * | S | Bend | trans | -82.2 | 71.2 | 165.9 | -79.1 | -167.5 | 147.6 | 0 | 0 | 109.1 | S151 R156 | S151-E154 CarbonylContact O-C 3.4Å; E154-R156 VanDerWaalsContact C-N 3.28Å; E154-R156 PolarHBondContact O-N 3.17Å |
| 155 | V | 50.9 | Low | 52.8 | Low | 70 Ų | 70 | 115.5 Ų | 115.5 | 42% | 0.424 | 60% | 0.595 | S | S | . | * | trans | -45.2 | 102.1 | 161.1 | 176.1 | 0 | 0 | 0 | 0 | 106.7 | E152 S153 L157 T161 | E152-V155 WeakPolarHBondContact O-CG2 3.38Å; S153-V155 PolarHBondContact O-N 2.88Å; V155-L157 PolarHBondContact O-N 3.31Å; V155-T161 HydrophobicContact CG1-CG2 4.28Å | ||
| 156 | R | 47.7 | Very low | 51.9 | Low | 162 Ų | 162 | 113.2 Ų | 113.2 | 61% | 0.611 | 59% | 0.593 | S | S | * | * | trans | -49.2 | 110.5 | -170.6 | -66.8 | 166.9 | 112.1 | 92.4 | -2.7 | 106.4 | E154 Q158 S159 | E154-R156 VanDerWaalsContact C-N 3.28Å; E154-R156 PolarHBondContact O-N 3.17Å; R156-Q158 PolarHBondContact O-N 3.15Å; R156-S159 WeakPolarHBondContact CB-OG 3.41Å; R156-S159 CarbonylContact O-C 3.4Å; R156-S159 WeakPolarHBondContact O-CA 3.45Å; R156-S159 PolarHBondContact O-N 3.36Å; R156-S159 PolarHBondContact O-OG 2.95Å | ||
| 157 | L | 43.8 | Very low | 51.2 | Low | 156 Ų | 156 | 113.2 Ų | 113.2 | 82% | 0.817 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.1 | -22.4 | 174.3 | -100.4 | 103 | 0 | 0 | 0 | 111 | V155 T161 | V155-L157 PolarHBondContact O-N 3.31Å; L157-T161 HydrophobicContact CG-CG2 4.16Å |
| 158 | Q | 43 | Very low | 50.6 | Low | 189 Ų | 189 | 119.9 Ų | 119.9 | 88% | 0.883 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | -32 | 171.1 | -78.7 | -155.1 | -36 | 0 | 0 | 114.4 | R156 G160 | R156-Q158 PolarHBondContact O-N 3.15Å; Q158-G160 VanDerWaalsContact C-N 3.29Å; Q158-G160 PolarHBondContact O-N 3.47Å |
| 159 | S | 48.9 | Very low | 50 | Low | 69 Ų | 69 | 120.7 Ų | 120.7 | 48% | 0.483 | 63% | 0.627 | S | S | . | * | S | Bend | trans | -84.4 | 84.4 | 162.7 | 56.2 | 0 | 0 | 0 | 0 | 106.5 | R156 T161 | R156-S159 WeakPolarHBondContact CB-OG 3.41Å; R156-S159 CarbonylContact O-C 3.4Å; R156-S159 WeakPolarHBondContact O-CA 3.45Å; R156-S159 PolarHBondContact O-N 3.36Å; R156-S159 PolarHBondContact O-OG 2.95Å; S159-T161 PolarHBondContact O-N 3.11Å |
| 160 | G | 43.4 | Very low | 49.7 | Very low | 55 Ų | 55 | 120.6 Ų | 120.6 | 57% | 0.567 | 63% | 0.633 | S | S | * | * | trans | -30.1 | 108.2 | -174 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q158 N162 | Q158-G160 VanDerWaalsContact C-N 3.29Å; Q158-G160 PolarHBondContact O-N 3.47Å; G160-N162 PolarHBondContact O-N 3.49Å; G160-N162 PolarHBondContact O-OD1 3.33Å; G160-N162 VanDerWaalsContact O-OD1 3.13Å | ||
| 161 | T | 43.4 | Very low | 49.2 | Very low | 46 Ų | 46 | 116.8 Ų | 116.8 | 28% | 0.282 | 62% | 0.617 | S | S | . | * | trans | -68 | 128.9 | -173.3 | 109.9 | 0 | 0 | 0 | 0 | 107.9 | V155 L157 S159 R163 | V155-T161 HydrophobicContact CG1-CG2 4.28Å; L157-T161 HydrophobicContact CG-CG2 4.16Å; S159-T161 PolarHBondContact O-N 3.11Å; T161-R163 PolarHBondContact O-N 3.15Å; T161-R163 VanDerWaalsContact O-N 3.13Å | ||
| 162 | N | 48.6 | Very low | 48.7 | Very low | 121 Ų | 121 | 116.2 Ų | 116.2 | 65% | 0.647 | 62% | 0.621 | S | S | * | * | G | 310 helix | trans | -79.1 | 9.1 | -176.2 | -57.2 | -22.7 | 0 | 0 | 0 | 113 | G160 F164 A165 | G160-N162 PolarHBondContact O-N 3.49Å; G160-N162 PolarHBondContact O-OD1 3.33Å; G160-N162 VanDerWaalsContact O-OD1 3.13Å; N162-F164 PolarHBondContact O-N 2.99Å; N162-A165 HydrophobicContact CB-CB 4.14Å; N162-A165 PolarHBondContact O-N 3.37Å |
| 163 | R | 45.7 | Very low | 48.4 | Very low | 188 Ų | 188 | 118.4 Ų | 118.4 | 71% | 0.709 | 63% | 0.628 | S | S | * | * | G | 310 helix | trans | -57 | -25.7 | -171.8 | -152.5 | -179.7 | -70.4 | 163.3 | -2.6 | 112.5 | T161 | T161-R163 PolarHBondContact O-N 3.15Å; T161-R163 VanDerWaalsContact O-N 3.13Å |
| 164 | F | 46 | Very low | 47.9 | Very low | 189 Ų | 189 | 117.4 Ų | 117.4 | 83% | 0.829 | 63% | 0.634 | S | S | * | * | G | 310 helix | trans | -125 | 6.3 | 175.7 | -50.4 | -70.6 | 0 | 0 | 0 | 113.4 | N162 S166 | N162-F164 PolarHBondContact O-N 2.99Å; F164-S166 PolarHBondContact O-N 3.08Å; F164-S166 VanDerWaalsContact O-N 3.15Å |
| 165 | A | 47.9 | Very low | 47.4 | Very low | 51 Ų | 51 | 114 Ų | 114 | 42% | 0.421 | 62% | 0.624 | S | S | . | * | trans | -78.8 | 104.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | N162 Q167 | N162-A165 HydrophobicContact CB-CB 4.14Å; N162-A165 PolarHBondContact O-N 3.37Å; A165-Q167 PolarHBondContact O-N 2.93Å | ||
| 166 | S | 47.1 | Very low | 47 | Very low | 86 Ų | 86 | 114.1 Ų | 114.1 | 60% | 0.601 | 64% | 0.64 | S | S | * | * | trans | -58.7 | 119.9 | 169.4 | -177.1 | 0 | 0 | 0 | 0 | 109.2 | F164 R168 | F164-S166 PolarHBondContact O-N 3.08Å; F164-S166 VanDerWaalsContact O-N 3.15Å; S166-R168 PolarHBondContact O-N 3.14Å; S166-R168 WeakPolarHBondContact OG-CB 3.14Å; S166-R168 PolarHBondContact OG-N 3.38Å | ||
| 167 | Q | 51.5 | Low | 46.9 | Very low | 147 Ų | 147 | 116.1 Ų | 116.1 | 69% | 0.687 | 65% | 0.647 | S | S | * | * | trans | -65.7 | 1.4 | 174.9 | -166.2 | 163.4 | 27.6 | 0 | 0 | 113.2 | A165 G169 M170 | A165-Q167 PolarHBondContact O-N 2.93Å; Q167-G169 PolarHBondContact O-N 2.92Å; Q167-M170 PolarHBondContact O-N 2.98Å | ||
| 168 | R | 51.2 | Low | 46.9 | Very low | 229 Ų | 229 | 116.2 Ų | 116.2 | 86% | 0.864 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58 | 102.8 | 174.3 | -177 | 170.8 | 161.8 | 80.5 | 1.9 | 109.8 | S166 | S166-R168 PolarHBondContact O-N 3.14Å; S166-R168 WeakPolarHBondContact OG-CB 3.14Å; S166-R168 PolarHBondContact OG-N 3.38Å |
| 169 | G | 50.1 | Low | 47 | Very low | 71 Ų | 71 | 112.2 Ų | 112.2 | 73% | 0.732 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 92.8 | 3.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 116 | Q167 | Q167-G169 PolarHBondContact O-N 2.92Š|
| 170 | M | 55.3 | Low | 46.6 | Very low | 114 Ų | 114 | 114.5 Ų | 114.5 | 56% | 0.562 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | -18.1 | -179.8 | -86.3 | -176.7 | 80.5 | 0 | 0 | 115 | Q167 | Q167-M170 PolarHBondContact O-N 2.98Š|
| 171 | T | 50.8 | Low | 46.5 | Very low | 56 Ų | 56 | 122 Ų | 122 | 34% | 0.344 | 66% | 0.658 | S | S | . | * | S | Bend | trans | -87 | 119.8 | 170.6 | 48.2 | 0 | 0 | 0 | 0 | 109.5 | ||
| 172 | G | 44.5 | Very low | 46.4 | Very low | 47 Ų | 47 | 128.8 Ų | 128.8 | 49% | 0.485 | 69% | 0.687 | S | S | . | * | P | Polyproline II helix | trans | -53.2 | 141.2 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | G174 T175 | G172-G174 PolarHBondContact O-N 2.94Å; G172-T175 PolarHBondContact O-N 3.13Å; G172-T175 PolarHBondContact O-OG1 2.99Å |
| 173 | F | 47.2 | Very low | 46.1 | Very low | 183 Ų | 183 | 126.6 Ų | 126.6 | 80% | 0.803 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -47.4 | 127.6 | 178.5 | -135 | -90.1 | 0 | 0 | 0 | 110.5 | T175 | F173-T175 PolarHBondContact O-N 2.98Š|
| 174 | G | 44.7 | Very low | 46 | Very low | 81 Ų | 81 | 125.5 Ų | 125.5 | 84% | 0.835 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 83.8 | -3.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | G172 G176 | G172-G174 PolarHBondContact O-N 2.94Å; G174-G176 PolarHBondContact O-N 3.07Å |
| 175 | T | 43.7 | Very low | 46 | Very low | 84 Ų | 84 | 122.4 Ų | 122.4 | 52% | 0.515 | 69% | 0.689 | S | S | . | * | P | Polyproline II helix | trans | -75 | 123.2 | 169.9 | 56.3 | 0 | 0 | 0 | 0 | 109.7 | G172 F173 R177 | G172-T175 PolarHBondContact O-N 3.13Å; G172-T175 PolarHBondContact O-OG1 2.99Å; F173-T175 PolarHBondContact O-N 2.98Å; T175-R177 PolarHBondContact O-N 3.39Å |
| 176 | G | 43.2 | Very low | 46 | Very low | 73 Ų | 73 | 124.7 Ų | 124.7 | 75% | 0.753 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 127.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | G174 D178 | G174-G176 PolarHBondContact O-N 3.07Å; G176-D178 PolarHBondContact O-N 3.18Å |
| 177 | R | 45.4 | Very low | 46.2 | Very low | 203 Ų | 203 | 125.3 Ų | 125.3 | 77% | 0.766 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 117.5 | 165.7 | -67.4 | 179.6 | -176.6 | 158.8 | 2 | 105.8 | T175 V179 | T175-R177 PolarHBondContact O-N 3.39Å; R177-V179 PolarHBondContact O-N 3.24Å |
| 178 | D | 42.7 | Very low | 46.2 | Very low | 158 Ų | 158 | 122.4 Ų | 122.4 | 85% | 0.845 | 70% | 0.696 | S | S | * | * | trans | -64.4 | 85.1 | 155.9 | -97.7 | -18.9 | 0 | 0 | 0 | 106.3 | G176 V180 | G176-D178 PolarHBondContact O-N 3.18Å; D178-V180 PolarHBondContact O-N 3.39Å | ||
| 179 | V | 45.7 | Very low | 46.6 | Very low | 105 Ų | 105 | 120.7 Ų | 120.7 | 64% | 0.636 | 70% | 0.698 | S | S | * | * | trans | -62.6 | 103.7 | 146.9 | -176.4 | 0 | 0 | 0 | 0 | 101.4 | R177 R181 | R177-V179 PolarHBondContact O-N 3.24Å; V179-R181 HydrophobicContact CG1-CG 4.47Å; V179-R181 PolarHBondContact O-N 3.21Å | ||
| 180 | V | 40.4 | Very low | 47.1 | Very low | 117 Ų | 117 | 124.9 Ų | 124.9 | 71% | 0.709 | 70% | 0.703 | S | S | * | * | trans | -55.7 | 88.7 | 158.2 | 178.4 | 0 | 0 | 0 | 0 | 103.6 | D178 E182 | D178-V180 PolarHBondContact O-N 3.39Å; V180-E182 HydrophobicContact CG1-CG 4.43Å; V180-E182 PolarHBondContact O-N 2.9Å | ||
| 181 | R | 41.3 | Very low | 47 | Very low | 212 Ų | 212 | 125.2 Ų | 125.2 | 80% | 0.8 | 71% | 0.707 | S | S | * | * | trans | -59 | 107.7 | 151.4 | -68.7 | -179.4 | 174.9 | 133.1 | -3.5 | 99.8 | V179 A183 | V179-R181 HydrophobicContact CG1-CG 4.47Å; V179-R181 PolarHBondContact O-N 3.21Å; R181-A183 HydrophobicContact CB-CB 4.2Å; R181-A183 PolarHBondContact O-N 3.13Å | ||
| 182 | E | 42.3 | Very low | 47.4 | Very low | 189 Ų | 189 | 127.8 Ų | 127.8 | 88% | 0.883 | 73% | 0.725 | S | S | * | * | trans | -56 | 72.9 | 154.7 | -76.1 | 171.2 | 156.7 | 0 | 0 | 105.8 | V180 | V180-E182 HydrophobicContact CG1-CG 4.43Å; V180-E182 PolarHBondContact O-N 2.9Å | ||
| 183 | A | 40.7 | Very low | 47.9 | Very low | 76 Ų | 76 | 133.8 Ų | 133.8 | 63% | 0.628 | 74% | 0.744 | S | S | * | * | trans | -90.4 | 116.3 | 173 | 0 | 0 | 0 | 0 | 0 | 103 | R181 | R181-A183 HydrophobicContact CB-CB 4.2Å; R181-A183 PolarHBondContact O-N 3.13Å | ||
| 184 | L | 45.6 | Very low | 48.2 | Very low | 165 Ų | 165 | 131.7 Ų | 131.7 | 86% | 0.864 | 74% | 0.739 | S | S | * | * | S | Bend | trans | 80.6 | 28.9 | 151.7 | -139.7 | 71 | 0 | 0 | 0 | 117.2 | P186 | L184-P186 WeakPolarHBondContact O-CD 3.18Š|
| 185 | V | 45.6 | Very low | 49 | Very low | 123 Ų | 123 | 133.3 Ų | 133.3 | 75% | 0.745 | 73% | 0.728 | S | S | * | * | trans | -95.4 | 104.1 | 145.2 | -174 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 186 | P | 48.2 | Very low | 49.6 | Very low | 100 Ų | 100 | 135.5 Ų | 135.5 | 65% | 0.649 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 130.2 | 169.5 | 20.2 | -28.9 | 0 | 0 | 0 | 107.2 | L184 | L184-P186 WeakPolarHBondContact O-CD 3.18Š|
| 187 | P | 51.1 | Low | 50.2 | Low | 98 Ų | 98 | 133.7 Ų | 133.7 | 64% | 0.636 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 135.7 | -179.8 | 22.1 | -31.9 | 0 | 0 | 0 | 108 | Q189 | P187-Q189 PolarHBondContact O-N 3.21Š|
| 188 | P | 50.5 | Low | 50.7 | Low | 86 Ų | 86 | 130.9 Ų | 130.9 | 56% | 0.558 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 122.7 | 173.1 | 20.8 | -30.5 | 0 | 0 | 0 | 107.4 | D190 L191 | P188-D190 PolarHBondContact O-N 2.84Å; P188-L191 HydrophobicContact CG-CD1 4.12Å; P188-L191 HydrophobicContact CG-CG 4.26Å; P188-L191 PolarHBondContact O-N 3.03Å |
| 189 | Q | 58.8 | Low | 51.2 | Low | 194 Ų | 194 | 128.2 Ų | 128.2 | 91% | 0.907 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | -5.4 | -168.5 | -72.1 | 177.6 | -5 | 0 | 0 | 113.8 | P187 | P187-Q189 PolarHBondContact O-N 3.21Š|
| 190 | D | 60.7 | Low | 51.7 | Low | 158 Ų | 158 | 131 Ų | 131 | 85% | 0.845 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.6 | 20.8 | 180 | -83.7 | -17 | 0 | 0 | 0 | 114.4 | P188 P192 | P188-D190 PolarHBondContact O-N 2.84Å; D190-P192 WeakPolarHBondContact O-CD 3.43Å |
| 191 | L | 53.8 | Low | 52.3 | Low | 122 Ų | 122 | 132.4 Ų | 132.4 | 64% | 0.639 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -83.1 | 121.8 | 168.6 | -71.4 | 173.8 | 0 | 0 | 0 | 110.3 | P188 L193 | P188-L191 HydrophobicContact CG-CD1 4.12Å; P188-L191 HydrophobicContact CG-CG 4.26Å; P188-L191 PolarHBondContact O-N 3.03Å; L191-L193 PolarHBondContact O-N 2.96Å |
| 192 | P | 58.6 | Low | 52.7 | Low | 110 Ų | 110 | 125.8 Ų | 125.8 | 71% | 0.714 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -57 | 130.9 | 175.7 | -19.4 | 29.7 | 0 | 0 | 0 | 110.2 | D190 M194 | D190-P192 WeakPolarHBondContact O-CD 3.43Å; P192-M194 PolarHBondContact O-N 3.28Å; P192-M194 VanDerWaalsContact O-N 3.09Å |
| 193 | L | 56.4 | Low | 52.9 | Low | 172 Ų | 172 | 124.5 Ų | 124.5 | 90% | 0.901 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 117.5 | 171.5 | -173.7 | 66.9 | 0 | 0 | 0 | 108.6 | L191 | L191-L193 PolarHBondContact O-N 2.96Š|
| 194 | M | 53.7 | Low | 53.1 | Low | 139 Ų | 139 | 123.9 Ų | 123.9 | 69% | 0.685 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 139.9 | 178.9 | -69.9 | -160.8 | 165.8 | 0 | 0 | 109.6 | P192 E196 | P192-M194 PolarHBondContact O-N 3.28Å; P192-M194 VanDerWaalsContact O-N 3.09Å; M194-E196 PolarHBondContact O-N 3.05Å |
| 195 | D | 60.1 | Low | 53.2 | Low | 115 Ų | 115 | 121.7 Ų | 121.7 | 62% | 0.615 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 128.6 | 179.4 | -166.1 | 0.8 | 0 | 0 | 0 | 110.3 | G197 K198 | D195-G197 PolarHBondContact O-N 3.46Å; D195-K198 WeakPolarHBondContact O-CB 3.34Å; D195-K198 PolarHBondContact O-N 2.74Å |
| 196 | E | 56.9 | Low | 53.2 | Low | 131 Ų | 131 | 119 Ų | 119 | 61% | 0.612 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -54.2 | -24.9 | -175.5 | -66.4 | -176.7 | 171.2 | 0 | 0 | 112.8 | M194 K198 E199 R200 | M194-E196 PolarHBondContact O-N 3.05Å; E196-K198 VanDerWaalsContact C-N 3.34Å; E196-E199 PolarHBondContact O-N 2.97Å; E196-R200 PolarHBondContact O-N 3.14Å; E196-R200 VanDerWaalsContact O-N 3.13Å |
| 197 | G | 55.1 | Low | 53.2 | Low | 35 Ų | 35 | 123.1 Ų | 123.1 | 36% | 0.361 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -64.4 | -34.6 | 174 | 0 | 0 | 0 | 0 | 0 | 113.6 | D195 M201 | D195-G197 PolarHBondContact O-N 3.46Å; G197-M201 WeakPolarHBondContact O-CG 3.4Å; G197-M201 PolarHBondContact O-N 3.1Å |
| 198 | K | 56.5 | Low | 53 | Low | 143 Ų | 143 | 126.9 Ų | 126.9 | 62% | 0.622 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -76.3 | -34 | 177 | -66.9 | 177.8 | -178.2 | 172.5 | 0 | 111.5 | D195 E196 M201 T202 | D195-K198 WeakPolarHBondContact O-CB 3.34Å; D195-K198 PolarHBondContact O-N 2.74Å; E196-K198 VanDerWaalsContact C-N 3.34Å; K198-M201 PolarHBondContact O-N 2.94Å; K198-T202 PolarHBondContact O-N 3.06Å |
| 199 | E | 53.2 | Low | 52.7 | Low | 102 Ų | 102 | 131.6 Ų | 131.6 | 48% | 0.477 | 67% | 0.67 | S | S | . | * | H | α-helix | trans | -63.8 | -44.5 | 175.2 | -60.4 | -170.9 | 161.1 | 0 | 0 | 111 | E196 M201 T202 E203 | E196-E199 PolarHBondContact O-N 2.97Å; E199-M201 VanDerWaalsContact C-N 3.29Å; E199-M201 PolarHBondContact O-N 3.03Å; E199-T202 CarbonylContact O-C 3.38Å; E199-T202 WeakPolarHBondContact O-CA 3.28Å; E199-T202 PolarHBondContact O-N 3.36Å; E199-T202 PolarHBondContact O-OG1 3.48Å; E199-E203 PolarHBondContact O-N 2.91Å |
| 200 | R | 57.1 | Low | 52.1 | Low | 163 Ų | 163 | 125.7 Ų | 125.7 | 62% | 0.615 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -59.5 | -35.2 | 173.2 | -96.1 | -177 | -77.8 | -161.9 | -9 | 113.8 | E196 T202 E203 | E196-R200 PolarHBondContact O-N 3.14Å; E196-R200 VanDerWaalsContact O-N 3.13Å; R200-T202 PolarHBondContact O-N 2.74Å; R200-E203 PolarHBondContact O-N 2.97Å |
| 201 | M | 51 | Low | 51.2 | Low | 147 Ų | 147 | 121.4 Ų | 121.4 | 72% | 0.724 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -68.2 | -25.1 | 174.5 | -69.3 | -84.8 | -80.9 | 0 | 0 | 112 | G197 K198 E199 I205 | G197-M201 WeakPolarHBondContact O-CG 3.4Å; G197-M201 PolarHBondContact O-N 3.1Å; K198-M201 PolarHBondContact O-N 2.94Å; E199-M201 VanDerWaalsContact C-N 3.29Å; E199-M201 PolarHBondContact O-N 3.03Å; M201-I205 WeakPolarHBondContact O-CD1 3.45Å; M201-I205 WeakPolarHBondContact O-CG1 3.45Å |
| 202 | T | 50.1 | Low | 50.6 | Low | 74 Ų | 74 | 119.2 Ų | 119.2 | 45% | 0.454 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -89.2 | -17.9 | 173.5 | 58 | 0 | 0 | 0 | 0 | 113.9 | K198 E199 R200 G204 I205 | K198-T202 PolarHBondContact O-N 3.06Å; E199-T202 CarbonylContact O-C 3.38Å; E199-T202 WeakPolarHBondContact O-CA 3.28Å; E199-T202 PolarHBondContact O-N 3.36Å; E199-T202 PolarHBondContact O-OG1 3.48Å; R200-T202 PolarHBondContact O-N 2.74Å; T202-G204 PolarHBondContact O-N 3.37Å; T202-I205 CarbonylContact O-C 3.38Å; T202-I205 PolarHBondContact O-N 3.45Å |
| 203 | E | 46.4 | Very low | 50.2 | Low | 162 Ų | 162 | 118.8 Ų | 118.8 | 76% | 0.757 | 63% | 0.627 | S | S | * | * | S | Bend | trans | -68 | 79.6 | 167.3 | -76.7 | -167.9 | 139.3 | 0 | 0 | 110.7 | E199 R200 | E199-E203 PolarHBondContact O-N 2.91Å; R200-E203 PolarHBondContact O-N 2.97Å |
| 204 | G | 46.2 | Very low | 49.6 | Very low | 63 Ų | 63 | 119 Ų | 119 | 65% | 0.649 | 62% | 0.616 | S | S | * | * | S | Bend | trans | 143 | -33.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | T202 V206 | T202-G204 PolarHBondContact O-N 3.37Å; G204-V206 PolarHBondContact O-N 2.94Å |
| 205 | I | 46.4 | Very low | 49.1 | Very low | 118 Ų | 118 | 121.3 Ų | 121.3 | 61% | 0.605 | 62% | 0.622 | S | S | * | * | trans | -80.2 | 69.5 | 161.5 | -49.2 | 175.8 | 0 | 0 | 0 | 106.9 | M201 T202 R207 | M201-I205 WeakPolarHBondContact O-CD1 3.45Å; M201-I205 WeakPolarHBondContact O-CG1 3.45Å; T202-I205 CarbonylContact O-C 3.38Å; T202-I205 PolarHBondContact O-N 3.45Å; I205-R207 PolarHBondContact O-N 3Å | ||
| 206 | V | 46.8 | Very low | 48.4 | Very low | 66 Ų | 66 | 119.3 Ų | 119.3 | 40% | 0.4 | 62% | 0.622 | S | S | . | * | trans | -50.9 | 109.7 | 160.6 | 176.7 | 0 | 0 | 0 | 0 | 105.1 | G204 L208 S210 | G204-V206 PolarHBondContact O-N 2.94Å; V206-L208 PolarHBondContact O-N 3.19Å; V206-S210 VanDerWaalsContact CG1-O 3.29Å; V206-S210 WeakPolarHBondContact CG1-O 3.03Å; V206-S210 WeakPolarHBondContact CG1-OG 3.4Å | ||
| 207 | R | 48.6 | Very low | 47.6 | Very low | 187 Ų | 187 | 117.4 Ų | 117.4 | 71% | 0.706 | 62% | 0.623 | S | S | * | * | trans | -43.6 | 120.3 | 175.2 | -74.3 | -179.8 | 171.5 | 91.4 | -2.8 | 105.5 | I205 Q209 S210 | I205-R207 PolarHBondContact O-N 3Å; R207-Q209 HydrophobicContact CB-CB 4.31Å; R207-Q209 CarbonylContact O-C 3.48Å; R207-Q209 PolarHBondContact O-N 3.31Å; R207-S210 PolarHBondContact O-N 2.76Å; R207-S210 PolarHBondContact O-OG 2.89Å | ||
| 208 | L | 46.1 | Very low | 47.4 | Very low | 177 Ų | 177 | 121.9 Ų | 121.9 | 93% | 0.927 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49.8 | -17.8 | 179.1 | -105.2 | 144 | 0 | 0 | 0 | 112.8 | V206 | V206-L208 PolarHBondContact O-N 3.19Š|
| 209 | Q | 43.2 | Very low | 47 | Very low | 185 Ų | 185 | 124.1 Ų | 124.1 | 86% | 0.864 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.6 | -39.1 | 169.4 | -66.8 | -75.9 | -83.6 | 0 | 0 | 114.3 | R207 G211 | R207-Q209 HydrophobicContact CB-CB 4.31Å; R207-Q209 CarbonylContact O-C 3.48Å; R207-Q209 PolarHBondContact O-N 3.31Å; Q209-G211 PolarHBondContact O-N 2.79Å |
| 210 | S | 47.4 | Very low | 46.7 | Very low | 71 Ų | 71 | 122.6 Ų | 122.6 | 50% | 0.497 | 66% | 0.656 | S | S | . | * | S | Bend | trans | -92 | 80 | 174.1 | 61.6 | 0 | 0 | 0 | 0 | 109 | V206 R207 T212 | V206-S210 VanDerWaalsContact CG1-O 3.29Å; V206-S210 WeakPolarHBondContact CG1-O 3.03Å; V206-S210 WeakPolarHBondContact CG1-OG 3.4Å; R207-S210 PolarHBondContact O-N 2.76Å; R207-S210 PolarHBondContact O-OG 2.89Å; S210-T212 PolarHBondContact O-N 2.95Å; S210-T212 VanDerWaalsContact O-N 3.12Å |
| 211 | G | 41.5 | Very low | 46.4 | Very low | 67 Ų | 67 | 120.3 Ų | 120.3 | 69% | 0.691 | 65% | 0.654 | S | S | * | * | trans | -45 | 120.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q209 | Q209-G211 PolarHBondContact O-N 2.79Š| ||
| 212 | T | 42 | Very low | 46.2 | Very low | 77 Ų | 77 | 117.8 Ų | 117.8 | 47% | 0.472 | 65% | 0.647 | S | S | . | * | trans | -72.1 | 132.1 | 175.7 | 175.9 | 0 | 0 | 0 | 0 | 110.3 | S210 R214 | S210-T212 PolarHBondContact O-N 2.95Å; S210-T212 VanDerWaalsContact O-N 3.12Å; T212-R214 PolarHBondContact OG1-N 3.17Å; T212-R214 PolarHBondContact OG1-NE 3.45Å | ||
| 213 | N | 49.9 | Very low | 45.9 | Very low | 100 Ų | 100 | 115.7 Ų | 115.7 | 54% | 0.535 | 64% | 0.64 | S | S | . | * | trans | -93.2 | 10.4 | 178.4 | 53.8 | -17.3 | 0 | 0 | 0 | 113.1 | F215 A216 | N213-F215 PolarHBondContact O-N 3.38Å; N213-A216 HydrophobicContact CB-CB 4.05Å; N213-A216 PolarHBondContact O-N 3.46Å | ||
| 214 | R | 43.8 | Very low | 45.5 | Very low | 178 Ų | 178 | 116.4 Ų | 116.4 | 67% | 0.672 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.5 | -25 | -178 | -99.9 | -178.9 | -77.2 | 174.7 | -9 | 114.5 | T212 | T212-R214 PolarHBondContact OG1-N 3.17Å; T212-R214 PolarHBondContact OG1-NE 3.45Å |
| 215 | F | 43.6 | Very low | 45.2 | Very low | 186 Ų | 186 | 116.7 Ų | 116.7 | 82% | 0.816 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.3 | 9.4 | 178.7 | -51.5 | -70.1 | 0 | 0 | 0 | 113 | N213 S217 | N213-F215 PolarHBondContact O-N 3.38Å; F215-S217 PolarHBondContact O-N 3.38Å |
| 216 | A | 44.5 | Very low | 45 | Very low | 73 Ų | 73 | 115.1 Ų | 115.1 | 60% | 0.603 | 64% | 0.64 | S | S | * | * | trans | -77 | 94.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | N213 Q218 | N213-A216 HydrophobicContact CB-CB 4.05Å; N213-A216 PolarHBondContact O-N 3.46Å; A216-Q218 PolarHBondContact O-N 3.02Å | ||
| 217 | S | 40.6 | Very low | 44.7 | Very low | 92 Ų | 92 | 117.7 Ų | 117.7 | 64% | 0.643 | 66% | 0.661 | S | S | * | * | trans | -60.1 | 119.2 | 170 | -176.7 | 0 | 0 | 0 | 0 | 109.6 | F215 K219 | F215-S217 PolarHBondContact O-N 3.38Å; S217-K219 PolarHBondContact O-N 3.36Å; S217-K219 VanDerWaalsContact O-N 3.12Å; S217-K219 WeakPolarHBondContact OG-CB 3.37Å; S217-K219 PolarHBondContact OG-N 3.32Å | ||
| 218 | Q | 51.3 | Low | 44.4 | Very low | 128 Ų | 128 | 117.3 Ų | 117.3 | 60% | 0.598 | 66% | 0.659 | S | S | * | * | trans | -71.2 | 4.5 | 173 | -172.2 | 155.4 | 23 | 0 | 0 | 112.7 | A216 G220 M221 | A216-Q218 PolarHBondContact O-N 3.02Å; Q218-G220 PolarHBondContact O-N 3.25Å; Q218-M221 HydrophobicContact CB-SD 4.29Å; Q218-M221 HydrophobicContact CG-CB 3.8Å; Q218-M221 HydrophobicContact CG-CE 4.39Å; Q218-M221 HydrophobicContact CG-CG 4.12Å; Q218-M221 HydrophobicContact CG-SD 3.72Å; Q218-M221 PolarHBondContact O-N 2.98Å; Q218-M221 VanDerWaalsContact O-N 3.09Å | ||
| 219 | K | 47.7 | Very low | 44.2 | Very low | 191 Ų | 191 | 119.6 Ų | 119.6 | 83% | 0.83 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.9 | 113.2 | 176.9 | -166.5 | 176.5 | -173.9 | -179.7 | 0 | 109.4 | S217 | S217-K219 PolarHBondContact O-N 3.36Å; S217-K219 VanDerWaalsContact O-N 3.12Å; S217-K219 WeakPolarHBondContact OG-CB 3.37Å; S217-K219 PolarHBondContact OG-N 3.32Å |
| 220 | G | 45.6 | Very low | 44.2 | Very low | 69 Ų | 69 | 118.2 Ų | 118.2 | 71% | 0.711 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 90.9 | 10.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | Q218 T222 | Q218-G220 PolarHBondContact O-N 3.25Å; G220-T222 VanDerWaalsContact C-N 3.33Å |
| 221 | M | 50.8 | Low | 43.9 | Very low | 116 Ų | 116 | 121.4 Ų | 121.4 | 57% | 0.571 | 67% | 0.665 | S | S | * | * | trans | -77.1 | -13.3 | 177 | -86.7 | -177.9 | 54.8 | 0 | 0 | 114.9 | Q218 | Q218-M221 HydrophobicContact CB-SD 4.29Å; Q218-M221 HydrophobicContact CG-CB 3.8Å; Q218-M221 HydrophobicContact CG-CE 4.39Å; Q218-M221 HydrophobicContact CG-CG 4.12Å; Q218-M221 HydrophobicContact CG-SD 3.72Å; Q218-M221 PolarHBondContact O-N 2.98Å; Q218-M221 VanDerWaalsContact O-N 3.09Å | ||
| 222 | T | 47.9 | Very low | 43.8 | Very low | 94 Ų | 94 | 122.6 Ų | 122.6 | 58% | 0.577 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -94.1 | 113 | 174.2 | -46.7 | 0 | 0 | 0 | 0 | 108.2 | G220 T226 | G220-T222 VanDerWaalsContact C-N 3.33Å; T222-T226 WeakPolarHBondContact CG2-OG1 3.5Å |
| 223 | G | 43.5 | Very low | 43.6 | Very low | 30 Ų | 30 | 128.6 Ų | 128.6 | 31% | 0.309 | 68% | 0.679 | S | S | . | * | trans | -59.3 | 143 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | G225 T226 | G223-G225 PolarHBondContact O-N 3.27Å; G223-T226 PolarHBondContact O-N 3.21Å; G223-T226 VanDerWaalsContact O-N 3.1Å; G223-T226 PolarHBondContact O-OG1 2.78Å | ||
| 224 | F | 38 | Very low | 43.3 | Very low | 176 Ų | 176 | 130.8 Ų | 130.8 | 77% | 0.772 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -47.9 | 128.9 | 170.9 | -178 | -99.1 | 0 | 0 | 0 | 110.2 | F270 | F224-F270 HydrophobicContact CE2-CD1 4.49Š|
| 225 | G | 39 | Very low | 43.3 | Very low | 70 Ų | 70 | 129.1 Ų | 129.1 | 72% | 0.722 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 82.7 | 1.2 | 179 | 0 | 0 | 0 | 0 | 0 | 116.5 | G223 | G223-G225 PolarHBondContact O-N 3.27Š|
| 226 | T | 42.4 | Very low | 43.5 | Very low | 84 Ų | 84 | 123.3 Ų | 123.3 | 52% | 0.515 | 67% | 0.669 | S | S | . | * | trans | -87.5 | 122.7 | 174.7 | 58.2 | 0 | 0 | 0 | 0 | 111.8 | T222 G223 | T222-T226 WeakPolarHBondContact CG2-OG1 3.5Å; G223-T226 PolarHBondContact O-N 3.21Å; G223-T226 VanDerWaalsContact O-N 3.1Å; G223-T226 PolarHBondContact O-OG1 2.78Å | ||
| 227 | S | 40.2 | Very low | 44 | Very low | 120 Ų | 120 | 125.4 Ų | 125.4 | 84% | 0.839 | 68% | 0.679 | S | S | * | * | trans | -73.3 | 126.3 | 176.2 | -52.1 | 0 | 0 | 0 | 0 | 110.5 | R229 | S227-R229 PolarHBondContact O-N 3.04Š| ||
| 228 | R | 44.2 | Very low | 44.7 | Very low | 180 Ų | 180 | 129.5 Ų | 129.5 | 68% | 0.679 | 69% | 0.686 | S | S | * | * | trans | -73.5 | 114.5 | 172.1 | -167.7 | 172.6 | -167.5 | -97.4 | 0.9 | 108.3 | E230 | R228-E230 PolarHBondContact O-N 3.23Š| ||
| 229 | R | 40.7 | Very low | 44.6 | Very low | 225 Ų | 225 | 128.3 Ų | 128.3 | 85% | 0.849 | 68% | 0.68 | S | S | * | * | trans | -67.3 | 101.4 | 171.1 | -135.9 | -177.5 | -153.3 | -151.2 | 5 | 107.2 | S227 V231 | S227-R229 PolarHBondContact O-N 3.04Å; R229-V231 PolarHBondContact O-N 3.35Å | ||
| 230 | E | 42.6 | Very low | 45 | Very low | 155 Ų | 155 | 124.3 Ų | 124.3 | 72% | 0.724 | 67% | 0.674 | S | S | * | * | trans | -61.6 | 133.4 | 161.5 | -65.2 | -175.9 | 175.2 | 0 | 0 | 106.4 | R228 T232 | R228-E230 PolarHBondContact O-N 3.23Å; E230-T232 VanDerWaalsContact C-N 3.32Å; E230-T232 PolarHBondContact O-N 3.44Å | ||
| 231 | V | 42 | Very low | 45.5 | Very low | 139 Ų | 139 | 129.9 Ų | 129.9 | 84% | 0.842 | 68% | 0.681 | S | S | * | * | trans | -55.7 | 102.4 | 179.5 | -176.4 | 0 | 0 | 0 | 0 | 106.4 | R229 K233 | R229-V231 PolarHBondContact O-N 3.35Å; V231-K233 PolarHBondContact O-N 3.46Å | ||
| 232 | T | 38.8 | Very low | 45.3 | Very low | 91 Ų | 91 | 130.6 Ų | 130.6 | 56% | 0.558 | 68% | 0.683 | S | S | * | * | trans | -62.8 | 112.6 | 175.8 | 27 | 0 | 0 | 0 | 0 | 106 | E230 M234 | E230-T232 VanDerWaalsContact C-N 3.32Å; E230-T232 PolarHBondContact O-N 3.44Å; T232-M234 WeakPolarHBondContact O-CG 3.25Å; T232-M234 PolarHBondContact O-N 2.93Å | ||
| 233 | K | 39.4 | Very low | 45.2 | Very low | 204 Ų | 204 | 129.4 Ų | 129.4 | 89% | 0.887 | 67% | 0.673 | S | S | * | * | trans | -62.6 | 85.3 | 172.3 | -58.7 | 179.9 | -178.7 | -174.1 | 0 | 107.7 | V231 | V231-K233 PolarHBondContact O-N 3.46Š| ||
| 234 | M | 42.2 | Very low | 45.5 | Very low | 146 Ų | 146 | 132 Ų | 132 | 72% | 0.719 | 69% | 0.685 | S | S | * | * | trans | -106.4 | 121.8 | 174.6 | 47.3 | -155.7 | -76.1 | 0 | 0 | 107.3 | T232 D236 | T232-M234 WeakPolarHBondContact O-CG 3.25Å; T232-M234 PolarHBondContact O-N 2.93Å; M234-D236 PolarHBondContact O-N 3.49Å; M234-D236 VanDerWaalsContact O-N 3.12Å | ||
| 235 | N | 44 | Very low | 46 | Very low | 142 Ų | 142 | 131.5 Ų | 131.5 | 76% | 0.759 | 69% | 0.685 | S | S | * | * | trans | -69.1 | 101.4 | 173.5 | -170.9 | -3.5 | 0 | 0 | 0 | 107.2 | S237 | N235-S237 PolarHBondContact O-N 3.43Š| ||
| 236 | D | 47.4 | Very low | 46.2 | Very low | 65 Ų | 65 | 134.3 Ų | 134.3 | 35% | 0.348 | 68% | 0.679 | S | S | . | * | trans | -80.9 | 100 | -178.9 | -171.6 | -6.7 | 0 | 0 | 0 | 109.8 | M234 K238 H239 | M234-D236 PolarHBondContact O-N 3.49Å; M234-D236 VanDerWaalsContact O-N 3.12Å; D236-K238 PolarHBondContact O-N 2.95Å; D236-K238 WeakPolarHBondContact OD1-CB 3.11Å; D236-K238 PolarHBondContact OD1-N 3.01Å; D236-H239 CarbonylContact O-C 3.5Å; D236-H239 PolarHBondContact O-N 3.06Å; D236-H239 IonicContact OD2-CD2 3.58Å; D236-H239 PolarHBondContact OD2-CD2 3.26Å | ||
| 237 | S | 55 | Low | 46.4 | Very low | 116 Ų | 116 | 134.6 Ų | 134.6 | 81% | 0.811 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.8 | -20.5 | 174.9 | -84.3 | 0 | 0 | 0 | 0 | 114.3 | N235 | N235-S237 PolarHBondContact O-N 3.43Š|
| 238 | K | 55.6 | Low | 46.5 | Very low | 178 Ų | 178 | 135.7 Ų | 135.7 | 77% | 0.774 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.6 | -15.8 | 179.5 | -62.8 | -171.2 | -179.1 | -176.1 | 0 | 113.1 | D236 | D236-K238 PolarHBondContact O-N 2.95Å; D236-K238 WeakPolarHBondContact OD1-CB 3.11Å; D236-K238 PolarHBondContact OD1-N 3.01Å |
| 239 | H | 49.1 | Very low | 46.2 | Very low | 104 Ų | 104 | 133.9 Ų | 133.9 | 48% | 0.481 | 68% | 0.678 | S | S | . | * | trans | -134.6 | 69 | -179.8 | -66 | -60.2 | 0 | 0 | 0 | 110.5 | D236 E241 Q242 | D236-H239 CarbonylContact O-C 3.5Å; D236-H239 PolarHBondContact O-N 3.06Å; D236-H239 IonicContact OD2-CD2 3.58Å; D236-H239 PolarHBondContact OD2-CD2 3.26Å; H239-E241 PolarHBondContact O-N 3.34Å; H239-E241 VanDerWaalsContact O-N 3.14Å; H239-Q242 HydrophobicContact CB-CG 4.24Å; H239-Q242 PolarHBondContact O-N 2.87Å | ||
| 240 | P | 55.8 | Low | 46.3 | Very low | 107 Ų | 107 | 127.1 Ų | 127.1 | 70% | 0.695 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.9 | -17.9 | -179.9 | 27.1 | -35.2 | 0 | 0 | 0 | 113.5 | Q242 | P240-Q242 PolarHBondContact O-N 3.36Š|
| 241 | E | 56.3 | Low | 46.4 | Very low | 186 Ų | 186 | 124.1 Ų | 124.1 | 87% | 0.869 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | -16.4 | 174.9 | -61 | -171.9 | -171 | 0 | 0 | 113 | H239 D243 | H239-E241 PolarHBondContact O-N 3.34Å; H239-E241 VanDerWaalsContact O-N 3.14Å; E241-D243 VanDerWaalsContact C-N 3.28Å; E241-D243 PolarHBondContact O-N 2.96Å |
| 242 | Q | 48.1 | Very low | 46.4 | Very low | 131 Ų | 131 | 121.1 Ų | 121.1 | 61% | 0.612 | 64% | 0.639 | S | S | * | * | trans | -82.1 | 79.6 | 171.9 | -67.7 | 179.8 | 9.4 | 0 | 0 | 108.7 | H239 P240 P244 | H239-Q242 HydrophobicContact CB-CG 4.24Å; H239-Q242 PolarHBondContact O-N 2.87Å; P240-Q242 PolarHBondContact O-N 3.36Å; Q242-P244 WeakPolarHBondContact O-CD 3.31Å; Q242-P244 VanDerWaalsContact O-N 3.15Å | ||
| 243 | D | 45.5 | Very low | 46.3 | Very low | 68 Ų | 68 | 120.7 Ų | 120.7 | 36% | 0.364 | 64% | 0.638 | S | S | . | * | trans | -62.5 | 110.3 | 171 | -175.6 | -6 | 0 | 0 | 0 | 109.3 | E241 E245 H246 | E241-D243 VanDerWaalsContact C-N 3.28Å; E241-D243 PolarHBondContact O-N 2.96Å; D243-E245 PolarHBondContact O-N 2.94Å; D243-E245 PolarHBondContact OD1-N 3.43Å; D243-H246 HydrophobicContact CB-CB 4.4Å; D243-H246 CarbonylContact O-C 3.58Å; D243-H246 PolarHBondContact O-N 3.15Å; D243-H246 IonicContact OD2-CD2 3.2Å; D243-H246 PolarHBondContact OD2-CD2 2.92Å; D243-H246 IonicContact OD2-CG 3.67Å | ||
| 244 | P | 49.2 | Very low | 46.3 | Very low | 86 Ų | 86 | 118.3 Ų | 118.3 | 56% | 0.558 | 64% | 0.635 | S | S | * | * | S | Bend | trans | -66.3 | -19.3 | -179.2 | -15.8 | 31.1 | 0 | 0 | 0 | 112.7 | Q242 | Q242-P244 WeakPolarHBondContact O-CD 3.31Å; Q242-P244 VanDerWaalsContact O-N 3.15Å |
| 245 | E | 47.5 | Very low | 46.4 | Very low | 165 Ų | 165 | 119.5 Ų | 119.5 | 77% | 0.771 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -89.3 | -24.2 | -178.4 | -59.5 | -160.8 | 160.5 | 0 | 0 | 112.6 | D243 P247 | D243-E245 PolarHBondContact O-N 2.94Å; D243-E245 PolarHBondContact OD1-N 3.43Å; E245-P247 VanDerWaalsContact C-CD 3.49Å; E245-P247 WeakPolarHBondContact O-CD 3.08Å |
| 246 | H | 44.7 | Very low | 46.5 | Very low | 128 Ų | 128 | 115.8 Ų | 115.8 | 59% | 0.593 | 62% | 0.623 | S | S | * | * | trans | -125.6 | 71.3 | 178.6 | -65 | -45.8 | 0 | 0 | 0 | 111.9 | D243 D248 | D243-H246 HydrophobicContact CB-CB 4.4Å; D243-H246 CarbonylContact O-C 3.58Å; D243-H246 PolarHBondContact O-N 3.15Å; D243-H246 IonicContact OD2-CD2 3.2Å; D243-H246 PolarHBondContact OD2-CD2 2.92Å; D243-H246 IonicContact OD2-CG 3.67Å; H246-D248 VanDerWaalsContact C-N 3.27Å; H246-D248 PolarHBondContact O-N 2.97Å | ||
| 247 | P | 46.6 | Very low | 46.2 | Very low | 90 Ų | 90 | 115.2 Ų | 115.2 | 58% | 0.584 | 63% | 0.633 | S | S | * | * | trans | -64 | 96.5 | 164 | 29.1 | -33.2 | 0 | 0 | 0 | 107.8 | E245 Q249 S250 | E245-P247 VanDerWaalsContact C-CD 3.49Å; E245-P247 WeakPolarHBondContact O-CD 3.08Å; P247-Q249 PolarHBondContact O-N 3.15Å; P247-S250 PolarHBondContact O-N 3.22Å | ||
| 248 | D | 41.3 | Very low | 45.6 | Very low | 144 Ų | 144 | 112.3 Ų | 112.3 | 77% | 0.77 | 61% | 0.611 | S | S | * | * | S | Bend | trans | -60 | 3.1 | 170.7 | 37.6 | -27.9 | 0 | 0 | 0 | 112.8 | H246 S250 | H246-D248 VanDerWaalsContact C-N 3.27Å; H246-D248 PolarHBondContact O-N 2.97Å; D248-S250 VanDerWaalsContact C-N 3.31Å; D248-S250 PolarHBondContact O-N 2.78Å |
| 249 | Q | 38.9 | Very low | 45.3 | Very low | 141 Ų | 141 | 108.6 Ų | 108.6 | 66% | 0.659 | 60% | 0.599 | S | S | * | * | trans | -88.1 | 36.9 | 166.4 | -61.8 | -174.2 | 8 | 0 | 0 | 114.2 | P247 S251 I252 | P247-Q249 PolarHBondContact O-N 3.15Å; Q249-S251 PolarHBondContact O-N 2.71Å; Q249-I252 HydrophobicContact CB-CG1 4.21Å; Q249-I252 WeakPolarHBondContact O-CG1 3.32Å; Q249-I252 PolarHBondContact O-N 2.85Å; Q249-I252 VanDerWaalsContact O-N 3.15Å | ||
| 250 | S | 42.8 | Very low | 45.1 | Very low | 83 Ų | 83 | 111.6 Ų | 111.6 | 58% | 0.58 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.9 | -9.5 | 163.5 | 75.9 | 0 | 0 | 0 | 0 | 112.5 | P247 D248 R260 | P247-S250 PolarHBondContact O-N 3.22Å; D248-S250 VanDerWaalsContact C-N 3.31Å; D248-S250 PolarHBondContact O-N 2.78Å; S250-R260 PolarHBondContact O-NH1 2.85Å; S250-R260 PolarHBondContact O-NH2 3.28Å |
| 251 | S | 43 | Very low | 44.6 | Very low | 92 Ų | 92 | 115.5 Ų | 115.5 | 64% | 0.643 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.6 | 50.3 | 169.1 | 58 | 0 | 0 | 0 | 0 | 112.2 | Q249 P253 | Q249-S251 PolarHBondContact O-N 2.71Å; S251-P253 WeakPolarHBondContact O-CD 3.5Å |
| 252 | I | 42.3 | Very low | 44.3 | Very low | 76 Ų | 76 | 109.6 Ų | 109.6 | 39% | 0.39 | 60% | 0.596 | S | S | . | * | trans | -54.1 | 111.2 | 158.3 | -69.8 | 175 | 0 | 0 | 0 | 106.3 | Q249 L254 S256 | Q249-I252 HydrophobicContact CB-CG1 4.21Å; Q249-I252 WeakPolarHBondContact O-CG1 3.32Å; Q249-I252 PolarHBondContact O-N 2.85Å; Q249-I252 VanDerWaalsContact O-N 3.15Å; I252-L254 PolarHBondContact O-N 2.84Å; I252-S256 WeakPolarHBondContact CG2-O 3.41Å; I252-S256 WeakPolarHBondContact CG2-OG 3.39Å | ||
| 253 | P | 37.9 | Very low | 44 | Very low | 82 Ų | 82 | 107.7 Ų | 107.7 | 53% | 0.532 | 60% | 0.597 | S | S | . | * | trans | -57.4 | 140 | -175.7 | 22.3 | -31.2 | 0 | 0 | 0 | 107.3 | S251 Q255 S256 | S251-P253 WeakPolarHBondContact O-CD 3.5Å; P253-Q255 PolarHBondContact O-N 2.82Å; P253-S256 PolarHBondContact O-N 3Å | ||
| 254 | L | 39 | Very low | 44.3 | Very low | 155 Ų | 155 | 111.9 Ų | 111.9 | 81% | 0.812 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -46.1 | -14.3 | -179.6 | -85.2 | 146.4 | 0 | 0 | 0 | 115.1 | I252 S256 T258 | I252-L254 PolarHBondContact O-N 2.84Å; L254-S256 VanDerWaalsContact C-N 3.3Å; L254-T258 HydrophobicContact CD2-CG2 4.18Å |
| 255 | Q | 43.8 | Very low | 44.1 | Very low | 170 Ų | 170 | 117.1 Ų | 117.1 | 79% | 0.794 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.7 | -31 | 169.1 | -67 | -170.8 | -56.8 | 0 | 0 | 114 | P253 | P253-Q255 PolarHBondContact O-N 2.82Š|
| 256 | S | 47.1 | Very low | 44.1 | Very low | 64 Ų | 64 | 112.9 Ų | 112.9 | 45% | 0.448 | 63% | 0.629 | S | S | . | * | S | Bend | trans | -100 | 97 | 174.3 | 154.1 | 0 | 0 | 0 | 0 | 107.2 | I252 P253 L254 T258 | I252-S256 WeakPolarHBondContact CG2-O 3.41Å; I252-S256 WeakPolarHBondContact CG2-OG 3.39Å; P253-S256 PolarHBondContact O-N 3Å; L254-S256 VanDerWaalsContact C-N 3.3Å; S256-T258 PolarHBondContact O-N 3.18Å |
| 257 | G | 40.6 | Very low | 44.3 | Very low | 54 Ų | 54 | 112.3 Ų | 112.3 | 56% | 0.557 | 63% | 0.628 | S | S | * | * | trans | -33.9 | 106.1 | -172.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | N259 | G257-N259 PolarHBondContact O-OD1 3.15Š| ||
| 258 | T | 42.2 | Very low | 44.5 | Very low | 55 Ų | 55 | 113.2 Ų | 113.2 | 34% | 0.337 | 63% | 0.632 | S | S | . | * | trans | -82.6 | 134.2 | 178.4 | 176.9 | 0 | 0 | 0 | 0 | 110.2 | L254 S256 | L254-T258 HydrophobicContact CD2-CG2 4.18Å; S256-T258 PolarHBondContact O-N 3.18Å | ||
| 259 | N | 48.6 | Very low | 44.6 | Very low | 100 Ų | 100 | 108.5 Ų | 108.5 | 54% | 0.535 | 62% | 0.618 | S | S | . | * | trans | -93.2 | 6.3 | -173.6 | -51.3 | -30.6 | 0 | 0 | 0 | 112.8 | G257 F261 A262 | G257-N259 PolarHBondContact O-OD1 3.15Å; N259-F261 PolarHBondContact O-N 2.94Å; N259-A262 HydrophobicContact CB-CB 4.4Å; N259-A262 PolarHBondContact O-N 3.07Å | ||
| 260 | R | 44.9 | Very low | 44.8 | Very low | 166 Ų | 166 | 110.6 Ų | 110.6 | 63% | 0.626 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.4 | -26.7 | -173.3 | -84.2 | -174.6 | -171.1 | 138.1 | 8.4 | 114.4 | S250 | S250-R260 PolarHBondContact O-NH1 2.85Å; S250-R260 PolarHBondContact O-NH2 3.28Å |
| 261 | F | 46.3 | Very low | 44.8 | Very low | 189 Ų | 189 | 110.3 Ų | 110.3 | 83% | 0.829 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.5 | 8.9 | -177.3 | -50.8 | -70.7 | 0 | 0 | 0 | 113 | N259 S263 | N259-F261 PolarHBondContact O-N 2.94Å; F261-S263 PolarHBondContact O-N 3.49Å |
| 262 | A | 49.4 | Very low | 44.8 | Very low | 62 Ų | 62 | 109.5 Ų | 109.5 | 51% | 0.512 | 63% | 0.626 | S | S | . | * | trans | -75.6 | 106.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | N259 Q264 | N259-A262 HydrophobicContact CB-CB 4.4Å; N259-A262 PolarHBondContact O-N 3.07Å; A262-Q264 PolarHBondContact O-N 3.16Å | ||
| 263 | S | 42.1 | Very low | 44.8 | Very low | 92 Ų | 92 | 110.5 Ų | 110.5 | 64% | 0.643 | 65% | 0.645 | S | S | * | * | trans | -63.1 | 120.9 | 173.2 | -175.7 | 0 | 0 | 0 | 0 | 110.3 | F261 K265 | F261-S263 PolarHBondContact O-N 3.49Å; S263-K265 PolarHBondContact O-N 3.28Å; S263-K265 VanDerWaalsContact O-N 3.1Å | ||
| 264 | Q | 51.8 | Low | 45.2 | Very low | 156 Ų | 156 | 115.5 Ų | 115.5 | 73% | 0.729 | 65% | 0.654 | S | S | * | * | trans | -71.2 | -0.6 | 179.9 | -166.3 | 160.6 | 23.2 | 0 | 0 | 113.9 | A262 G266 M267 | A262-Q264 PolarHBondContact O-N 3.16Å; Q264-G266 PolarHBondContact O-N 3.4Å; Q264-M267 HydrophobicContact CG-CB 4.34Å; Q264-M267 PolarHBondContact O-N 3.19Å | ||
| 265 | K | 46.2 | Very low | 45.3 | Very low | 196 Ų | 196 | 119.5 Ų | 119.5 | 85% | 0.852 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.5 | 110.3 | -177.7 | -154.8 | 176.1 | -173.5 | 178.8 | 0 | 109.8 | S263 | S263-K265 PolarHBondContact O-N 3.28Å; S263-K265 VanDerWaalsContact O-N 3.1Å |
| 266 | G | 46.8 | Very low | 45.4 | Very low | 76 Ų | 76 | 117.8 Ų | 117.8 | 78% | 0.784 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 86.4 | 17.8 | 178 | 0 | 0 | 0 | 0 | 0 | 115.9 | Q264 | Q264-G266 PolarHBondContact O-N 3.4Š|
| 267 | M | 48.9 | Very low | 45.2 | Very low | 115 Ų | 115 | 122.7 Ų | 122.7 | 57% | 0.567 | 67% | 0.67 | S | S | * | * | trans | -87.8 | -11.1 | -177 | -79.7 | -173.7 | 58.6 | 0 | 0 | 116 | Q264 | Q264-M267 HydrophobicContact CG-CB 4.34Å; Q264-M267 PolarHBondContact O-N 3.19Å | ||
| 268 | T | 50.2 | Low | 45.1 | Very low | 110 Ų | 110 | 125 Ų | 125 | 68% | 0.675 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -87.7 | 119.4 | 171.7 | 1.6 | 0 | 0 | 0 | 0 | 109 | T272 | T268-T272 WeakPolarHBondContact CG2-OG1 3.43Š|
| 269 | G | 44.5 | Very low | 45.1 | Very low | 45 Ų | 45 | 129.6 Ų | 129.6 | 46% | 0.464 | 69% | 0.691 | S | S | . | * | P | Polyproline II helix | trans | -59.6 | 145.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | G271 T272 | G269-G271 PolarHBondContact O-N 3.42Å; G269-T272 PolarHBondContact O-N 3.26Å; G269-T272 PolarHBondContact O-OG1 3.16Å; G269-T272 VanDerWaalsContact O-OG1 3.06Å |
| 270 | F | 41.6 | Very low | 44.9 | Very low | 185 Ų | 185 | 132.6 Ų | 132.6 | 81% | 0.811 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -47.1 | 127.8 | 170.1 | 179.6 | -99.8 | 0 | 0 | 0 | 110.8 | F224 | F224-F270 HydrophobicContact CE2-CD1 4.49Š|
| 271 | G | 43.1 | Very low | 45.1 | Very low | 76 Ų | 76 | 128.9 Ų | 128.9 | 78% | 0.784 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 85.6 | -0.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 116.6 | G269 A273 | G269-G271 PolarHBondContact O-N 3.42Å; G271-A273 PolarHBondContact O-N 2.81Å |
| 272 | T | 44.5 | Very low | 45.2 | Very low | 76 Ų | 76 | 123.4 Ų | 123.4 | 47% | 0.466 | 68% | 0.679 | S | S | . | * | trans | -72.7 | 120.5 | 173 | 58.5 | 0 | 0 | 0 | 0 | 110.3 | T268 G269 R274 | T268-T272 WeakPolarHBondContact CG2-OG1 3.43Å; G269-T272 PolarHBondContact O-N 3.26Å; G269-T272 PolarHBondContact O-OG1 3.16Å; G269-T272 VanDerWaalsContact O-OG1 3.06Å; T272-R274 PolarHBondContact O-N 3.49Å; T272-R274 VanDerWaalsContact O-N 3.13Å | ||
| 273 | A | 42 | Very low | 45.9 | Very low | 96 Ų | 96 | 125.9 Ų | 125.9 | 79% | 0.793 | 69% | 0.692 | S | S | * | * | trans | -60.9 | 115.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | G271 R275 | G271-A273 PolarHBondContact O-N 2.81Å; A273-R275 PolarHBondContact O-N 3.03Å; A273-R275 VanDerWaalsContact O-N 3.13Å | ||
| 274 | R | 45.7 | Very low | 47 | Very low | 187 Ų | 187 | 130 Ų | 130 | 71% | 0.706 | 70% | 0.699 | S | S | * | * | trans | -70.3 | 107 | 166.4 | -147 | -179.3 | -166.1 | -154 | 4.9 | 105.1 | T272 E276 | T272-R274 PolarHBondContact O-N 3.49Å; T272-R274 VanDerWaalsContact O-N 3.13Å; R274-E276 IonicContact NH1-OE1 3.99Å; R274-E276 PolarHBondContact O-N 3.22Å | ||
| 275 | R | 41.6 | Very low | 46.9 | Very low | 239 Ų | 239 | 127.1 Ų | 127.1 | 90% | 0.902 | 69% | 0.685 | S | S | * | * | trans | -66.3 | 84.8 | 166.7 | -92.2 | -175.8 | 171.6 | 174.9 | -3.3 | 106.6 | A273 L277 | A273-R275 PolarHBondContact O-N 3.03Å; A273-R275 VanDerWaalsContact O-N 3.13Å; R275-L277 PolarHBondContact O-N 3.13Å | ||
| 276 | E | 46.5 | Very low | 47.5 | Very low | 134 Ų | 134 | 121.5 Ų | 121.5 | 63% | 0.626 | 67% | 0.668 | S | S | * | * | trans | -54.3 | 116.1 | 149.2 | -59.2 | -80.7 | 146.5 | 0 | 0 | 103.5 | R274 T278 | R274-E276 IonicContact NH1-OE1 3.99Å; R274-E276 PolarHBondContact O-N 3.22Å; E276-T278 VanDerWaalsContact C-N 3.29Å; E276-T278 PolarHBondContact O-N 3.34Å | ||
| 277 | L | 42.9 | Very low | 48 | Very low | 167 Ų | 167 | 126 Ų | 126 | 87% | 0.874 | 67% | 0.669 | S | S | * | * | trans | -59.3 | 98.7 | -178 | -162 | 149.9 | 0 | 0 | 0 | 106.4 | R275 H279 | R275-L277 PolarHBondContact O-N 3.13Å; L277-H279 PolarHBondContact O-N 3.15Å | ||
| 278 | T | 38.6 | Very low | 48.2 | Very low | 103 Ų | 103 | 128.9 Ų | 128.9 | 63% | 0.632 | 68% | 0.675 | S | S | * | * | trans | -63.8 | 113.7 | -177.3 | 40.6 | 0 | 0 | 0 | 0 | 106.9 | E276 M280 | E276-T278 VanDerWaalsContact C-N 3.29Å; E276-T278 PolarHBondContact O-N 3.34Å; T278-M280 VanDerWaalsContact C-N 3.32Å; T278-M280 PolarHBondContact O-N 3.13Å | ||
| 279 | H | 41.7 | Very low | 48 | Very low | 151 Ų | 151 | 128.1 Ų | 128.1 | 70% | 0.699 | 67% | 0.666 | S | S | * | * | trans | -60.4 | 93.2 | 174.9 | -175.4 | -105.1 | 0 | 0 | 0 | 108.9 | L277 V281 | L277-H279 PolarHBondContact O-N 3.15Å; H279-V281 WeakPolarHBondContact CE1-CG2 3.37Å; H279-V281 WeakPolarHBondContact ND1-CG2 3.36Å; H279-V281 PolarHBondContact O-N 3.13Å | ||
| 280 | M | 44.2 | Very low | 48.2 | Very low | 164 Ų | 164 | 130.8 Ų | 130.8 | 81% | 0.808 | 67% | 0.674 | S | S | * | * | trans | -87.4 | 103.5 | 172.1 | -68.1 | -176.7 | 174.7 | 0 | 0 | 106.9 | T278 D282 | T278-M280 VanDerWaalsContact C-N 3.32Å; T278-M280 PolarHBondContact O-N 3.13Å; M280-D282 PolarHBondContact O-N 3.22Å | ||
| 281 | V | 48.9 | Very low | 48.2 | Very low | 88 Ų | 88 | 128.5 Ų | 128.5 | 53% | 0.533 | 67% | 0.67 | S | S | . | * | trans | -78.1 | 101.6 | 168 | -177 | 0 | 0 | 0 | 0 | 106.8 | H279 S283 | H279-V281 WeakPolarHBondContact CE1-CG2 3.37Å; H279-V281 WeakPolarHBondContact ND1-CG2 3.36Å; H279-V281 PolarHBondContact O-N 3.13Å; V281-S283 PolarHBondContact O-N 3.13Å | ||
| 282 | D | 47.5 | Very low | 48.1 | Very low | 74 Ų | 74 | 131.2 Ų | 131.2 | 40% | 0.396 | 66% | 0.662 | S | S | . | * | trans | -76.4 | 108.9 | 171.8 | -171.6 | -10.6 | 0 | 0 | 0 | 109.3 | M280 K284 H285 | M280-D282 PolarHBondContact O-N 3.22Å; D282-K284 PolarHBondContact O-N 3.42Å; D282-K284 PolarHBondContact OD1-N 3.25Å; D282-H285 HydrophobicContact CB-CB 4.46Å; D282-H285 CarbonylContact O-C 3.39Å; D282-H285 PolarHBondContact O-N 2.65Å; D282-H285 IonicContact OD2-CD2 3.69Å; D282-H285 PolarHBondContact OD2-CD2 2.84Å; D282-H285 IonicContact OD2-CG 3.76Å | ||
| 283 | S | 64.4 | Low | 47.9 | Very low | 114 Ų | 114 | 133 Ų | 133 | 80% | 0.797 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | -21.8 | 178.8 | -48.3 | 0 | 0 | 0 | 0 | 113.3 | V281 | V281-S283 PolarHBondContact O-N 3.13Š|
| 284 | K | 66.6 | Low | 47.8 | Very low | 179 Ų | 179 | 133.7 Ų | 133.7 | 78% | 0.778 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.8 | -19.5 | -179.9 | -66.8 | -176.1 | 178.2 | -179.6 | 0 | 112.8 | D282 | D282-K284 PolarHBondContact O-N 3.42Å; D282-K284 PolarHBondContact OD1-N 3.25Å |
| 285 | H | 49.6 | Very low | 47.7 | Very low | 94 Ų | 94 | 132.3 Ų | 132.3 | 44% | 0.435 | 67% | 0.667 | S | S | . | * | trans | -138.2 | 68 | -177.3 | -61.7 | -65.6 | 0 | 0 | 0 | 111.2 | D282 E287 Y288 | D282-H285 HydrophobicContact CB-CB 4.46Å; D282-H285 CarbonylContact O-C 3.39Å; D282-H285 PolarHBondContact O-N 2.65Å; D282-H285 IonicContact OD2-CD2 3.69Å; D282-H285 PolarHBondContact OD2-CD2 2.84Å; D282-H285 IonicContact OD2-CG 3.76Å; H285-E287 PolarHBondContact O-N 2.85Å; H285-E287 VanDerWaalsContact O-N 3.12Å; H285-Y288 HydrophobicContact CB-CD2 3.32Å; H285-Y288 HydrophobicContact CB-CE2 3.58Å; H285-Y288 HydrophobicContact CB-CG 4.45Å; H285-Y288 AromaticContact CG-CE2 3.8Å; H285-Y288 PolarHBondContact O-N 3.19Å; H285-Y288 VanDerWaalsContact O-N 3.11Å | ||
| 286 | P | 57.6 | Low | 47.8 | Very low | 78 Ų | 78 | 125.8 Ų | 125.8 | 51% | 0.506 | 66% | 0.664 | S | S | . | * | G | 310 helix | trans | -61 | -19.3 | 175.9 | 25.8 | -33.7 | 0 | 0 | 0 | 112.9 | Y288 L289 | P286-Y288 PolarHBondContact O-N 3.15Å; P286-L289 WeakPolarHBondContact O-CB 3.47Å; P286-L289 VanDerWaalsContact O-CD1 3.3Å; P286-L289 WeakPolarHBondContact O-CD1 3.32Å; P286-L289 PolarHBondContact O-N 3.36Å |
| 287 | E | 56.8 | Low | 47.6 | Very low | 171 Ų | 171 | 124.9 Ų | 124.9 | 80% | 0.799 | 67% | 0.667 | S | S | * | * | G | 310 helix | trans | -57.1 | -27.2 | 173.3 | -32 | -86.2 | 172.8 | 0 | 0 | 112.8 | H285 L289 | H285-E287 PolarHBondContact O-N 2.85Å; H285-E287 VanDerWaalsContact O-N 3.12Å; E287-L289 PolarHBondContact O-N 2.96Å |
| 288 | Y | 53.7 | Low | 47.5 | Very low | 175 Ų | 175 | 123.3 Ų | 123.3 | 69% | 0.686 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -81.3 | 6.4 | 178.5 | -67.1 | -58.2 | 0 | 0 | 0 | 113.3 | H285 P286 T290 | H285-Y288 HydrophobicContact CB-CD2 3.32Å; H285-Y288 HydrophobicContact CB-CE2 3.58Å; H285-Y288 HydrophobicContact CB-CG 4.45Å; H285-Y288 AromaticContact CG-CE2 3.8Å; H285-Y288 PolarHBondContact O-N 3.19Å; H285-Y288 VanDerWaalsContact O-N 3.11Å; P286-Y288 PolarHBondContact O-N 3.15Å; Y288-T290 PolarHBondContact O-N 2.99Å |
| 289 | L | 46 | Very low | 47.5 | Very low | 94 Ų | 94 | 122.2 Ų | 122.2 | 49% | 0.492 | 65% | 0.654 | S | S | . | * | trans | -59.6 | 95.4 | 159.6 | -97.2 | 98.8 | 0 | 0 | 0 | 107.4 | P286 E287 D291 | P286-L289 WeakPolarHBondContact O-CB 3.47Å; P286-L289 VanDerWaalsContact O-CD1 3.3Å; P286-L289 WeakPolarHBondContact O-CD1 3.32Å; P286-L289 PolarHBondContact O-N 3.36Å; E287-L289 PolarHBondContact O-N 2.96Å; L289-D291 PolarHBondContact O-N 3.19Å | ||
| 290 | T | 48.7 | Very low | 47.6 | Very low | 102 Ų | 102 | 123 Ų | 123 | 63% | 0.626 | 66% | 0.662 | S | S | * | * | trans | -67.4 | 96.8 | 166.4 | -54 | 0 | 0 | 0 | 0 | 105.4 | Y288 H292 | Y288-T290 PolarHBondContact O-N 2.99Å; T290-H292 WeakPolarHBondContact CG2-CD2 3.25Å; T290-H292 WeakPolarHBondContact CG2-NE2 3.2Å; T290-H292 PolarHBondContact O-N 3Å | ||
| 291 | D | 42.5 | Very low | 47.4 | Very low | 137 Ų | 137 | 124.2 Ų | 124.2 | 73% | 0.733 | 67% | 0.666 | S | S | * | * | trans | -55.3 | 85.6 | 165.3 | -72.3 | -32.7 | 0 | 0 | 0 | 107.8 | L289 P293 | L289-D291 PolarHBondContact O-N 3.19Å; D291-P293 WeakPolarHBondContact O-CD 3.14Å | ||
| 292 | H | 39.7 | Very low | 47.2 | Very low | 132 Ų | 132 | 126.1 Ų | 126.1 | 61% | 0.611 | 67% | 0.67 | S | S | * | * | trans | -99.6 | 87.6 | 161.1 | -82.4 | -49.2 | 0 | 0 | 0 | 106.8 | T290 D294 | T290-H292 WeakPolarHBondContact CG2-CD2 3.25Å; T290-H292 WeakPolarHBondContact CG2-NE2 3.2Å; T290-H292 PolarHBondContact O-N 3Å; H292-D294 PolarHBondContact O-N 3.15Å | ||
| 293 | P | 41.7 | Very low | 46.9 | Very low | 115 Ų | 115 | 126.1 Ų | 126.1 | 75% | 0.747 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | 10.9 | -177.3 | 28.1 | -35.9 | 0 | 0 | 0 | 115.2 | D291 | D291-P293 WeakPolarHBondContact O-CD 3.14Š|
| 294 | D | 38.7 | Very low | 45.8 | Very low | 110 Ų | 110 | 124 Ų | 124 | 59% | 0.588 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.4 | -11.8 | -166.2 | -45.3 | 46.9 | 0 | 0 | 0 | 113 | H292 A296 V297 | H292-D294 PolarHBondContact O-N 3.15Å; D294-A296 PolarHBondContact O-N 2.94Å; D294-V297 PolarHBondContact O-N 3.19Å; D294-V297 VanDerWaalsContact O-N 3.08Å |
| 295 | Q | 44.2 | Very low | 45.2 | Very low | 158 Ų | 158 | 121.8 Ų | 121.8 | 74% | 0.738 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.6 | -16.1 | -174.8 | -72.3 | -167.5 | 13.3 | 0 | 0 | 114.4 | V297 | Q295-V297 PolarHBondContact O-N 3.24Š|
| 296 | A | 43.4 | Very low | 45.1 | Very low | 101 Ų | 101 | 125.2 Ų | 125.2 | 84% | 0.835 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | -25.2 | 173 | 0 | 0 | 0 | 0 | 0 | 112 | D294 | D294-A296 PolarHBondContact O-N 2.94Š|
| 297 | V | 43.3 | Very low | 44.9 | Very low | 115 Ų | 115 | 130.5 Ų | 130.5 | 70% | 0.697 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -111.4 | 77.4 | 177.8 | -171.7 | 0 | 0 | 0 | 0 | 108.1 | D294 Q295 P299 | D294-V297 PolarHBondContact O-N 3.19Å; D294-V297 VanDerWaalsContact O-N 3.08Å; Q295-V297 PolarHBondContact O-N 3.24Å; V297-P299 WeakPolarHBondContact O-CD 3.18Å |
| 298 | L | 39.7 | Very low | 44.5 | Very low | 135 Ų | 135 | 125.9 Ų | 125.9 | 71% | 0.707 | 69% | 0.687 | S | S | * | * | trans | -60.6 | 109 | 167.4 | -69.3 | 173.9 | 0 | 0 | 0 | 107.9 | L300 | L298-L300 PolarHBondContact O-N 2.73Š| ||
| 299 | P | 38.6 | Very low | 44 | Very low | 80 Ų | 80 | 121.4 Ų | 121.4 | 52% | 0.519 | 68% | 0.681 | S | S | . | * | trans | -61 | 131.1 | -179.5 | 24.7 | -31.4 | 0 | 0 | 0 | 108 | V297 Q301 M302 | V297-P299 WeakPolarHBondContact O-CD 3.18Å; P299-Q301 PolarHBondContact O-N 3.28Å; P299-M302 PolarHBondContact O-N 3.47Å | ||
| 300 | L | 43.3 | Very low | 44.3 | Very low | 168 Ų | 168 | 124.9 Ų | 124.9 | 88% | 0.88 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49.9 | -12.7 | 179.5 | -82.6 | 153.1 | 0 | 0 | 0 | 114.5 | L298 M302 | L298-L300 PolarHBondContact O-N 2.73Å; L300-M302 VanDerWaalsContact C-N 3.29Å |
| 301 | Q | 41.6 | Very low | 44 | Very low | 189 Ų | 189 | 128.6 Ų | 128.6 | 88% | 0.883 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.4 | -25.2 | 173.2 | -162.9 | 174.3 | -56.6 | 0 | 0 | 113.2 | P299 G303 | P299-Q301 PolarHBondContact O-N 3.28Å; Q301-G303 PolarHBondContact O-N 3.06Å |
| 302 | M | 44.8 | Very low | 44.1 | Very low | 127 Ų | 127 | 125.9 Ų | 125.9 | 63% | 0.626 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -83.1 | 93.9 | 170.1 | -65.7 | -71.2 | -83.8 | 0 | 0 | 107.7 | P299 L300 T304 | P299-M302 PolarHBondContact O-N 3.47Å; L300-M302 VanDerWaalsContact C-N 3.29Å; M302-T304 PolarHBondContact O-N 3.46Å |
| 303 | G | 40.5 | Very low | 44.6 | Very low | 75 Ų | 75 | 126.7 Ų | 126.7 | 77% | 0.773 | 72% | 0.716 | S | S | * | * | trans | -39.4 | 111.4 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q301 | Q301-G303 PolarHBondContact O-N 3.06Š| ||
| 304 | T | 41.6 | Very low | 44.9 | Very low | 69 Ų | 69 | 125.6 Ų | 125.6 | 42% | 0.423 | 71% | 0.707 | S | S | . | * | trans | -70.1 | 132.8 | -180 | -179.7 | 0 | 0 | 0 | 0 | 110.1 | M302 K306 | M302-T304 PolarHBondContact O-N 3.46Å; T304-K306 VanDerWaalsContact C-N 3.28Å; T304-K306 WeakPolarHBondContact OG1-CE 3.36Å; T304-K306 PolarHBondContact OG1-N 2.91Å | ||
| 305 | N | 53.4 | Low | 45.3 | Very low | 132 Ų | 132 | 122.4 Ų | 122.4 | 71% | 0.706 | 70% | 0.7 | S | S | * | * | G | 310 helix | trans | -83.3 | 1.5 | 175.8 | 58.8 | -15.4 | 0 | 0 | 0 | 113.3 | F307 A308 | N305-F307 PolarHBondContact O-N 3.3Å; N305-A308 HydrophobicContact CB-CB 4.42Å; N305-A308 PolarHBondContact O-N 3.21Å |
| 306 | K | 46.7 | Very low | 45.1 | Very low | 167 Ų | 167 | 125.6 Ų | 125.6 | 73% | 0.726 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -57.3 | -19.5 | -177.9 | -76.7 | -171.6 | -70.6 | -130.2 | 0 | 114 | T304 | T304-K306 VanDerWaalsContact C-N 3.28Å; T304-K306 WeakPolarHBondContact OG1-CE 3.36Å; T304-K306 PolarHBondContact OG1-N 2.91Å |
| 307 | F | 53.6 | Low | 44.9 | Very low | 189 Ų | 189 | 123.8 Ų | 123.8 | 83% | 0.829 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -124.1 | 12.1 | 177.7 | -51.4 | -70.7 | 0 | 0 | 0 | 113.8 | N305 S309 | N305-F307 PolarHBondContact O-N 3.3Å; F307-S309 PolarHBondContact O-N 3.36Å; F307-S309 VanDerWaalsContact O-N 3.08Å |
| 308 | A | 48.5 | Very low | 44.9 | Very low | 74 Ų | 74 | 121.1 Ų | 121.1 | 61% | 0.612 | 69% | 0.693 | S | S | * | * | trans | -74.2 | 102.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | N305 Q310 | N305-A308 HydrophobicContact CB-CB 4.42Å; N305-A308 PolarHBondContact O-N 3.21Å; A308-Q310 PolarHBondContact O-N 3.07Å | ||
| 309 | S | 43.5 | Very low | 45.2 | Very low | 80 Ų | 80 | 124.2 Ų | 124.2 | 56% | 0.559 | 70% | 0.701 | S | S | * | * | trans | -65.3 | 126.5 | 173.7 | 97.8 | 0 | 0 | 0 | 0 | 109.1 | F307 Q311 | F307-S309 PolarHBondContact O-N 3.36Å; F307-S309 VanDerWaalsContact O-N 3.08Å; S309-Q311 PolarHBondContact O-N 3.04Å; S309-Q311 VanDerWaalsContact O-N 3.1Å | ||
| 310 | Q | 51.9 | Low | 45.4 | Very low | 168 Ų | 168 | 129.1 Ų | 129.1 | 79% | 0.785 | 71% | 0.709 | S | S | * | * | trans | -69 | -2.4 | 175.2 | -162.8 | 178.6 | 38.7 | 0 | 0 | 112.8 | A308 G312 M313 | A308-Q310 PolarHBondContact O-N 3.07Å; Q310-G312 PolarHBondContact O-N 2.76Å; Q310-G312 VanDerWaalsContact O-N 3.07Å; Q310-M313 PolarHBondContact O-N 3.3Å | ||
| 311 | Q | 42.8 | Very low | 45.3 | Very low | 180 Ų | 180 | 128.5 Ų | 128.5 | 84% | 0.841 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.2 | 111.8 | -174.9 | -149.8 | 154.1 | -3.8 | 0 | 0 | 109.8 | S309 | S309-Q311 PolarHBondContact O-N 3.04Å; S309-Q311 VanDerWaalsContact O-N 3.1Å |
| 312 | G | 45.1 | Very low | 45.5 | Very low | 79 Ų | 79 | 126.2 Ų | 126.2 | 81% | 0.814 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 95.5 | 7.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | Q310 T314 | Q310-G312 PolarHBondContact O-N 2.76Å; Q310-G312 VanDerWaalsContact O-N 3.07Å; G312-T314 VanDerWaalsContact C-N 3.3Å; G312-T314 PolarHBondContact O-N 3.25Å |
| 313 | M | 50 | Low | 45.4 | Very low | 150 Ų | 150 | 123 Ų | 123 | 74% | 0.739 | 68% | 0.683 | S | S | * | * | trans | -80.7 | 4.9 | -179.8 | -80.5 | -169.6 | 69.9 | 0 | 0 | 115.9 | Q310 G315 | Q310-M313 PolarHBondContact O-N 3.3Å; M313-G315 PolarHBondContact O-N 3.44Å | ||
| 314 | T | 47.1 | Very low | 45.4 | Very low | 92 Ų | 92 | 123.5 Ų | 123.5 | 56% | 0.564 | 69% | 0.688 | S | S | * | * | trans | -81.5 | 107.4 | 177.5 | -40.3 | 0 | 0 | 0 | 0 | 110 | G312 A318 | G312-T314 VanDerWaalsContact C-N 3.3Å; G312-T314 PolarHBondContact O-N 3.25Å; T314-A318 HydrophobicContact CG2-CB 3.88Å | ||
| 315 | G | 46.6 | Very low | 45.3 | Very low | 43 Ų | 43 | 123.8 Ų | 123.8 | 44% | 0.443 | 69% | 0.687 | S | S | . | * | trans | -60.3 | 144.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | M313 G317 A318 | M313-G315 PolarHBondContact O-N 3.44Å; G315-G317 PolarHBondContact O-N 3.26Å; G315-A318 PolarHBondContact O-N 2.78Å; G315-A318 VanDerWaalsContact O-N 3.13Å | ||
| 316 | F | 40.5 | Very low | 44.8 | Very low | 225 Ų | 225 | 122.5 Ų | 122.5 | 99% | 0.987 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.3 | 122 | 171.9 | -175.9 | -98.9 | 0 | 0 | 0 | 110.1 | ||
| 317 | G | 40.6 | Very low | 44.8 | Very low | 63 Ų | 63 | 121.2 Ų | 121.2 | 65% | 0.649 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 98 | -4.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 116 | G315 F319 | G315-G317 PolarHBondContact O-N 3.26Å; G317-F319 PolarHBondContact O-N 2.78Å |
| 318 | A | 43.2 | Very low | 44.3 | Very low | 59 Ų | 59 | 120.5 Ų | 120.5 | 49% | 0.488 | 68% | 0.679 | S | S | . | * | trans | -75.7 | 121.2 | 169.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | T314 G315 R320 | T314-A318 HydrophobicContact CG2-CB 3.88Å; G315-A318 PolarHBondContact O-N 2.78Å; G315-A318 VanDerWaalsContact O-N 3.13Å; A318-R320 PolarHBondContact O-N 3.43Å | ||
| 319 | F | 45.1 | Very low | 44.1 | Very low | 200 Ų | 200 | 121.2 Ų | 121.2 | 88% | 0.877 | 68% | 0.679 | S | S | * | * | trans | -62.2 | 121 | 175.1 | -56.3 | -81.3 | 0 | 0 | 0 | 109.6 | G317 L321 | G317-F319 PolarHBondContact O-N 2.78Å; F319-L321 PolarHBondContact O-N 3.02Å; F319-L321 VanDerWaalsContact O-N 3.13Å | ||
| 320 | R | 42.7 | Very low | 43.8 | Very low | 182 Ų | 182 | 128.6 Ų | 128.6 | 69% | 0.687 | 69% | 0.694 | S | S | * | * | trans | -76.7 | 98.6 | 173.9 | -155.3 | 179.6 | 177.3 | 100.8 | -4.7 | 107.1 | A318 E322 | A318-R320 PolarHBondContact O-N 3.43Å; R320-E322 HydrophobicContact CB-CG 4.2Å; R320-E322 VanDerWaalsContact CD-OE1 3.25Å; R320-E322 WeakPolarHBondContact CD-OE1 3.2Å; R320-E322 HydrophobicContact CG-CG 3.57Å; R320-E322 IonicContact CZ-OE1 2.81Å; R320-E322 IonicContact NE-OE1 3.76Å; R320-E322 PolarHBondContact NE-OE1 3.09Å; R320-E322 IonicContact NH2-OE1 2.65Å; R320-E322 PolarHBondContact O-N 3.12Å | ||
| 321 | L | 41.1 | Very low | 43.2 | Very low | 156 Ų | 156 | 128 Ų | 128 | 82% | 0.817 | 69% | 0.692 | S | S | * | * | trans | -73.5 | 75.3 | 171.7 | -145.9 | 92.9 | 0 | 0 | 0 | 107.6 | F319 T323 | F319-L321 PolarHBondContact O-N 3.02Å; F319-L321 VanDerWaalsContact O-N 3.13Å; L321-T323 PolarHBondContact O-N 3.02Å | ||
| 322 | E | 46.5 | Very low | 43.2 | Very low | 140 Ų | 140 | 122.5 Ų | 122.5 | 65% | 0.654 | 68% | 0.677 | S | S | * | * | trans | -70.7 | -4.9 | 180 | -71 | -151.2 | 147.5 | 0 | 0 | 113 | R320 G324 | R320-E322 HydrophobicContact CB-CG 4.2Å; R320-E322 VanDerWaalsContact CD-OE1 3.25Å; R320-E322 WeakPolarHBondContact CD-OE1 3.2Å; R320-E322 HydrophobicContact CG-CG 3.57Å; R320-E322 IonicContact CZ-OE1 2.81Å; R320-E322 IonicContact NE-OE1 3.76Å; R320-E322 PolarHBondContact NE-OE1 3.09Å; R320-E322 IonicContact NH2-OE1 2.65Å; R320-E322 PolarHBondContact O-N 3.12Å; E322-G324 PolarHBondContact O-N 3.06Å; E322-G324 VanDerWaalsContact O-N 3.15Å | ||
| 323 | T | 41.8 | Very low | 43.1 | Very low | 61 Ų | 61 | 126 Ų | 126 | 37% | 0.374 | 68% | 0.676 | S | S | . | * | trans | -90.7 | 84.6 | 179.8 | -39.4 | 0 | 0 | 0 | 0 | 109.7 | L321 N325 | L321-T323 PolarHBondContact O-N 3.02Å; T323-N325 PolarHBondContact O-N 3.1Å | ||
| 324 | G | 40.8 | Very low | 42.8 | Very low | 85 Ų | 85 | 128.2 Ų | 128.2 | 88% | 0.876 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -63.1 | 19 | 174.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | E322 | E322-G324 PolarHBondContact O-N 3.06Å; E322-G324 VanDerWaalsContact O-N 3.15Å |
| 325 | N | 39.2 | Very low | 42.4 | Very low | 74 Ų | 74 | 126.9 Ų | 126.9 | 40% | 0.396 | 68% | 0.676 | S | S | . | * | S | Bend | trans | -157.3 | 117.4 | 168.8 | -160 | -37.6 | 0 | 0 | 0 | 110.7 | T323 L327 Y328 | T323-N325 PolarHBondContact O-N 3.1Å; N325-L327 PolarHBondContact O-N 3.29Å; N325-L327 PolarHBondContact OD1-N 3.31Å; N325-Y328 HydrophobicContact CB-CD2 4.22Å; N325-Y328 PolarHBondContact O-N 3.13Å; N325-Y328 VanDerWaalsContact O-N 3.16Å |
| 326 | P | 43.2 | Very low | 42 | Very low | 105 Ų | 105 | 132.5 Ų | 132.5 | 68% | 0.682 | 69% | 0.691 | S | S | * | * | G | 310 helix | trans | -62.3 | -9.7 | -177.2 | 24 | -33.6 | 0 | 0 | 0 | 114.6 | Y328 C329 | P326-Y328 VanDerWaalsContact C-N 3.32Å; P326-Y328 PolarHBondContact O-N 3.23Å; P326-C329 WeakPolarHBondContact O-CB 3.29Å; P326-C329 PolarHBondContact O-N 3.1Å |
| 327 | L | 47.6 | Very low | 42.2 | Very low | 141 Ų | 141 | 125.1 Ų | 125.1 | 74% | 0.738 | 68% | 0.678 | S | S | * | * | G | 310 helix | trans | -69.4 | -28.1 | 174.5 | -65.3 | -179.4 | 0 | 0 | 0 | 113.2 | N325 C329 | N325-L327 PolarHBondContact O-N 3.29Å; N325-L327 PolarHBondContact OD1-N 3.31Å; L327-C329 PolarHBondContact O-N 3.36Å |
| 328 | Y | 42.6 | Very low | 42.3 | Very low | 174 Ų | 174 | 128.4 Ų | 128.4 | 68% | 0.682 | 68% | 0.679 | S | S | * | * | G | 310 helix | trans | -78.9 | -6.5 | 174.7 | -68.8 | -70.9 | 0 | 0 | 0 | 113.3 | N325 P326 R330 Q331 | N325-Y328 HydrophobicContact CB-CD2 4.22Å; N325-Y328 PolarHBondContact O-N 3.13Å; N325-Y328 VanDerWaalsContact O-N 3.16Å; P326-Y328 VanDerWaalsContact C-N 3.32Å; P326-Y328 PolarHBondContact O-N 3.23Å; Y328-R330 PolarHBondContact O-N 3.03Å; Y328-Q331 PolarHBondContact O-N 2.63Å |
| 329 | C | 43.4 | Very low | 42.3 | Very low | 89 Ų | 89 | 130.4 Ų | 130.4 | 60% | 0.601 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -70 | -10.4 | 175.6 | -65.5 | 0 | 0 | 0 | 0 | 113.3 | P326 L327 Q331 | P326-C329 WeakPolarHBondContact O-CB 3.29Å; P326-C329 PolarHBondContact O-N 3.1Å; L327-C329 PolarHBondContact O-N 3.36Å; C329-Q331 PolarHBondContact O-N 2.97Å |
| 330 | R | 38.9 | Very low | 42.2 | Very low | 235 Ų | 235 | 124.8 Ų | 124.8 | 89% | 0.887 | 67% | 0.665 | S | S | * | * | trans | -79.1 | 39.1 | 166.3 | -68.9 | -160.1 | 178 | -154.5 | 1 | 112.3 | Y328 A332 | Y328-R330 PolarHBondContact O-N 3.03Å; R330-A332 PolarHBondContact O-N 2.86Å | ||
| 331 | Q | 39 | Very low | 42.3 | Very low | 156 Ų | 156 | 122 Ų | 122 | 73% | 0.729 | 67% | 0.673 | S | S | * | * | trans | -53.2 | 126.5 | 164.7 | -82.5 | -178.4 | 1.8 | 0 | 0 | 107.9 | Y328 C329 L333 | Y328-Q331 PolarHBondContact O-N 2.63Å; C329-Q331 PolarHBondContact O-N 2.97Å; Q331-L333 PolarHBondContact O-N 3.15Å | ||
| 332 | A | 41.7 | Very low | 42.4 | Very low | 64 Ų | 64 | 123.9 Ų | 123.9 | 53% | 0.529 | 68% | 0.677 | S | S | . | * | trans | -46 | 133.1 | -158.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | R330 K334 S335 | R330-A332 PolarHBondContact O-N 2.86Å; A332-K334 PolarHBondContact O-N 3.36Å; A332-S335 PolarHBondContact O-N 3.44Å; A332-S335 PolarHBondContact O-OG 2.95Å | ||
| 333 | L | 43.9 | Very low | 42.4 | Very low | 152 Ų | 152 | 122.7 Ų | 122.7 | 80% | 0.796 | 67% | 0.673 | S | S | * | * | G | 310 helix | trans | -48.4 | -20.7 | 174.3 | -71.5 | 165.4 | 0 | 0 | 0 | 113.5 | Q331 S335 Q336 | Q331-L333 PolarHBondContact O-N 3.15Å; L333-S335 PolarHBondContact O-N 3.12Å; L333-Q336 HydrophobicContact CD2-CG 4.38Å; L333-Q336 WeakPolarHBondContact O-CB 3.42Å; L333-Q336 PolarHBondContact O-N 2.77Å; L333-Q336 VanDerWaalsContact O-N 3.13Å |
| 334 | K | 42.8 | Very low | 42.3 | Very low | 196 Ų | 196 | 122.4 Ų | 122.4 | 85% | 0.852 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -62.5 | -18.2 | 173.4 | -73.7 | -174.9 | 175.6 | 179.6 | 0 | 114.6 | A332 | A332-K334 PolarHBondContact O-N 3.36Š|
| 335 | S | 38.8 | Very low | 42.6 | Very low | 65 Ų | 65 | 121.5 Ų | 121.5 | 46% | 0.455 | 66% | 0.662 | S | S | . | * | G | 310 helix | trans | -92.7 | -7.3 | 175.9 | 63.5 | 0 | 0 | 0 | 0 | 113.8 | A332 L333 G337 I338 | A332-S335 PolarHBondContact O-N 3.44Å; A332-S335 PolarHBondContact O-OG 2.95Å; L333-S335 PolarHBondContact O-N 3.12Å; S335-G337 PolarHBondContact O-N 2.96Å; S335-I338 PolarHBondContact O-N 3.29Å |
| 336 | Q | 39.9 | Very low | 43.1 | Very low | 160 Ų | 160 | 123.9 Ų | 123.9 | 75% | 0.748 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.8 | 97 | 169.7 | -70.8 | -73.4 | -9 | 0 | 0 | 108.3 | L333 | L333-Q336 HydrophobicContact CD2-CG 4.38Å; L333-Q336 WeakPolarHBondContact O-CB 3.42Å; L333-Q336 PolarHBondContact O-N 2.77Å; L333-Q336 VanDerWaalsContact O-N 3.13Å |
| 337 | G | 42.9 | Very low | 43.1 | Very low | 70 Ų | 70 | 126.5 Ų | 126.5 | 72% | 0.722 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 125.5 | -17 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | S335 I339 | S335-G337 PolarHBondContact O-N 2.96Å; G337-I339 PolarHBondContact O-N 3.22Å |
| 338 | I | 42.4 | Very low | 43 | Very low | 132 Ų | 132 | 128.7 Ų | 128.7 | 68% | 0.677 | 68% | 0.682 | S | S | * | * | trans | -99.3 | 80.6 | 172 | -53.4 | 175 | 0 | 0 | 0 | 107.5 | S335 P340 | S335-I338 PolarHBondContact O-N 3.29Å; I338-P340 VanDerWaalsContact O-CD 3.25Å; I338-P340 WeakPolarHBondContact O-CD 3.34Å | ||
| 339 | I | 44.2 | Very low | 43.2 | Very low | 101 Ų | 101 | 122.8 Ų | 122.8 | 52% | 0.518 | 67% | 0.67 | S | S | . | * | trans | -64.1 | 113.6 | 165.3 | -70.9 | 174.8 | 0 | 0 | 0 | 106.4 | G337 S341 M343 | G337-I339 PolarHBondContact O-N 3.22Å; I339-S341 PolarHBondContact O-N 3.21Å; I339-M343 HydrophobicContact CB-SD 4.1Å; I339-M343 HydrophobicContact CD1-SD 4.13Å; I339-M343 HydrophobicContact CG1-SD 3.8Å; I339-M343 HydrophobicContact CG2-CB 3.67Å; I339-M343 HydrophobicContact CG2-CG 3.33Å; I339-M343 WeakPolarHBondContact CG2-O 3.45Å; I339-M343 HydrophobicContact CG2-SD 3.4Å; I339-M343 WeakPolarHBondContact CG2-SD 3.38Å | ||
| 340 | P | 42.6 | Very low | 43.3 | Very low | 83 Ų | 83 | 122.3 Ų | 122.3 | 54% | 0.539 | 67% | 0.667 | S | S | . | * | trans | -56.9 | 131.6 | 172.8 | -4.7 | 14 | 0 | 0 | 0 | 106.9 | I338 Q342 M343 | I338-P340 VanDerWaalsContact O-CD 3.25Å; I338-P340 WeakPolarHBondContact O-CD 3.34Å; P340-Q342 PolarHBondContact O-N 3.13Å; P340-M343 WeakPolarHBondContact O-CB 3.43Å; P340-M343 PolarHBondContact O-N 3.02Å | ||
| 341 | S | 46 | Very low | 43.9 | Very low | 122 Ų | 122 | 117.7 Ų | 117.7 | 85% | 0.853 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.3 | -10.3 | -174.7 | -166 | 0 | 0 | 0 | 0 | 114.8 | I339 | I339-S341 PolarHBondContact O-N 3.21Š|
| 342 | Q | 42.7 | Very low | 44.3 | Very low | 196 Ų | 196 | 118.9 Ų | 118.9 | 92% | 0.916 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.1 | -27.3 | 171.4 | -69.3 | -175.7 | -41.1 | 0 | 0 | 113.6 | P340 G344 | P340-Q342 PolarHBondContact O-N 3.13Å; Q342-G344 PolarHBondContact O-N 2.78Å |
| 343 | M | 45.5 | Very low | 44.6 | Very low | 116 Ų | 116 | 119.4 Ų | 119.4 | 57% | 0.571 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -77.6 | 104.7 | 161.8 | 157.1 | -178.1 | -84.8 | 0 | 0 | 105.7 | I339 P340 S345 | I339-M343 HydrophobicContact CB-SD 4.1Å; I339-M343 HydrophobicContact CD1-SD 4.13Å; I339-M343 HydrophobicContact CG1-SD 3.8Å; I339-M343 HydrophobicContact CG2-CB 3.67Å; I339-M343 HydrophobicContact CG2-CG 3.33Å; I339-M343 WeakPolarHBondContact CG2-O 3.45Å; I339-M343 HydrophobicContact CG2-SD 3.4Å; I339-M343 WeakPolarHBondContact CG2-SD 3.38Å; P340-M343 WeakPolarHBondContact O-CB 3.43Å; P340-M343 PolarHBondContact O-N 3.02Å; M343-S345 PolarHBondContact O-N 3.08Å |
| 344 | G | 40.6 | Very low | 44.9 | Very low | 54 Ų | 54 | 118.9 Ų | 118.9 | 56% | 0.557 | 67% | 0.668 | S | S | * | * | trans | -46.6 | 125.1 | -176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q342 N346 | Q342-G344 PolarHBondContact O-N 2.78Å; G344-N346 PolarHBondContact O-N 3.04Å; G344-N346 PolarHBondContact O-OD1 2.95Å | ||
| 345 | S | 46.1 | Very low | 45.2 | Very low | 66 Ų | 66 | 113 Ų | 113 | 46% | 0.462 | 65% | 0.648 | S | S | . | * | trans | -66.3 | 128.5 | 170.9 | 167.4 | 0 | 0 | 0 | 0 | 109.3 | M343 Q347 | M343-S345 PolarHBondContact O-N 3.08Å; S345-Q347 PolarHBondContact O-N 3.18Å; S345-Q347 WeakPolarHBondContact OG-CB 3.4Å; S345-Q347 VanDerWaalsContact OG-CD 3.26Å; S345-Q347 WeakPolarHBondContact OG-CG 3.34Å; S345-Q347 PolarHBondContact OG-N 2.83Å; S345-Q347 PolarHBondContact OG-OE1 3.38Å | ||
| 346 | N | 49.4 | Very low | 45.4 | Very low | 125 Ų | 125 | 112.4 Ų | 112.4 | 67% | 0.668 | 65% | 0.653 | S | S | * | * | G | 310 helix | trans | -77.5 | 6.2 | 179.8 | -54.9 | -23.2 | 0 | 0 | 0 | 112.9 | G344 F348 A349 | G344-N346 PolarHBondContact O-N 3.04Å; G344-N346 PolarHBondContact O-OD1 2.95Å; N346-F348 PolarHBondContact O-N 3Å; N346-A349 HydrophobicContact CB-CB 4.2Å; N346-A349 PolarHBondContact O-N 2.62Å |
| 347 | Q | 45 | Very low | 45.4 | Very low | 160 Ų | 160 | 114.5 Ų | 114.5 | 75% | 0.748 | 66% | 0.66 | S | S | * | * | G | 310 helix | trans | -55.5 | -23.4 | -176.8 | -77.3 | 171.5 | -16.6 | 0 | 0 | 113.4 | S345 | S345-Q347 PolarHBondContact O-N 3.18Å; S345-Q347 WeakPolarHBondContact OG-CB 3.4Å; S345-Q347 VanDerWaalsContact OG-CD 3.26Å; S345-Q347 WeakPolarHBondContact OG-CG 3.34Å; S345-Q347 PolarHBondContact OG-N 2.83Å; S345-Q347 PolarHBondContact OG-OE1 3.38Å |
| 348 | F | 45.7 | Very low | 45.2 | Very low | 187 Ų | 187 | 114.6 Ų | 114.6 | 82% | 0.82 | 66% | 0.661 | S | S | * | * | G | 310 helix | trans | -118.1 | 5.3 | 178.1 | -49.9 | -70.2 | 0 | 0 | 0 | 113.5 | N346 S350 | N346-F348 PolarHBondContact O-N 3Å; F348-S350 PolarHBondContact O-N 3.48Å; F348-S350 VanDerWaalsContact O-N 3.13Å |
| 349 | A | 46.5 | Very low | 45.1 | Very low | 50 Ų | 50 | 112.3 Ų | 112.3 | 41% | 0.413 | 65% | 0.653 | S | S | . | * | trans | -74.9 | 106.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | N346 Q351 | N346-A349 HydrophobicContact CB-CB 4.2Å; N346-A349 PolarHBondContact O-N 2.62Å; A349-Q351 PolarHBondContact O-N 3.1Å; A349-Q351 VanDerWaalsContact O-N 3.14Å | ||
| 350 | S | 45.5 | Very low | 45 | Very low | 79 Ų | 79 | 113.7 Ų | 113.7 | 55% | 0.552 | 67% | 0.668 | S | S | * | * | trans | -52.4 | 117.8 | 166.1 | 159.9 | 0 | 0 | 0 | 0 | 109 | F348 Q352 | F348-S350 PolarHBondContact O-N 3.48Å; F348-S350 VanDerWaalsContact O-N 3.13Å; S350-Q352 PolarHBondContact O-N 2.78Å; S350-Q352 WeakPolarHBondContact OG-CB 2.93Å; S350-Q352 PolarHBondContact OG-N 3.17Å | ||
| 351 | Q | 51.5 | Low | 45 | Very low | 138 Ų | 138 | 117.7 Ų | 117.7 | 65% | 0.645 | 67% | 0.673 | S | S | * | * | trans | -63.3 | 0.3 | 177.1 | -64.6 | -177.7 | 33.2 | 0 | 0 | 113.4 | A349 G353 M354 | A349-Q351 PolarHBondContact O-N 3.1Å; A349-Q351 VanDerWaalsContact O-N 3.14Å; Q351-G353 PolarHBondContact O-N 3.3Å; Q351-M354 PolarHBondContact O-N 3.18Å | ||
| 352 | Q | 47.2 | Very low | 44.7 | Very low | 181 Ų | 181 | 118.7 Ų | 118.7 | 85% | 0.846 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.9 | 102.3 | 179 | -156 | 167.5 | 25.6 | 0 | 0 | 109.5 | S350 | S350-Q352 PolarHBondContact O-N 2.78Å; S350-Q352 WeakPolarHBondContact OG-CB 2.93Å; S350-Q352 PolarHBondContact OG-N 3.17Å |
| 353 | G | 46.8 | Very low | 44.9 | Very low | 74 Ų | 74 | 115 Ų | 115 | 76% | 0.763 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 106.8 | -1.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | Q351 | Q351-G353 PolarHBondContact O-N 3.3Š|
| 354 | M | 51.7 | Low | 44.4 | Very low | 141 Ų | 141 | 115.7 Ų | 115.7 | 70% | 0.695 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -81.2 | -14.5 | -178.1 | -75.1 | -174 | 70.5 | 0 | 0 | 114.8 | Q351 | Q351-M354 PolarHBondContact O-N 3.18Š|
| 355 | T | 49 | Very low | 44.5 | Very low | 73 Ų | 73 | 121.5 Ų | 121.5 | 45% | 0.448 | 67% | 0.671 | S | S | . | * | S | Bend | trans | -127.9 | 123.6 | 168.7 | 42.9 | 0 | 0 | 0 | 0 | 108.5 | ||
| 356 | G | 43.1 | Very low | 44.3 | Very low | 53 Ų | 53 | 122.3 Ų | 122.3 | 55% | 0.546 | 68% | 0.682 | S | S | . | * | trans | -60.2 | 145.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | G358 T359 | G356-G358 PolarHBondContact O-N 2.76Å; G356-T359 PolarHBondContact O-N 2.86Å; G356-T359 PolarHBondContact O-OG1 2.96Å | ||
| 357 | F | 40 | Very low | 44.2 | Very low | 204 Ų | 204 | 122 Ų | 122 | 90% | 0.895 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.3 | 123.3 | 173.9 | -166.4 | -93.8 | 0 | 0 | 0 | 109.7 | ||
| 358 | G | 38.2 | Very low | 44.2 | Very low | 72 Ų | 72 | 123.1 Ų | 123.1 | 74% | 0.742 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 101 | 0.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 117.2 | G356 | G356-G358 PolarHBondContact O-N 2.76Š|
| 359 | T | 39.1 | Very low | 44.1 | Very low | 84 Ų | 84 | 117.8 Ų | 117.8 | 52% | 0.515 | 69% | 0.688 | S | S | . | * | P | Polyproline II helix | trans | -88.8 | 122.3 | 173.6 | 58.4 | 0 | 0 | 0 | 0 | 111.6 | G356 | G356-T359 PolarHBondContact O-N 2.86Å; G356-T359 PolarHBondContact O-OG1 2.96Å |
| 360 | P | 42.6 | Very low | 44.2 | Very low | 129 Ų | 129 | 122.5 Ų | 122.5 | 84% | 0.838 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 138 | 170.9 | -19.2 | 30.7 | 0 | 0 | 0 | 110.8 | ||
| 361 | R | 42.5 | Very low | 44.5 | Very low | 168 Ų | 168 | 128.2 Ų | 128.2 | 63% | 0.634 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 123.3 | 174.4 | -62.4 | -177 | -172.4 | -131.4 | -0.7 | 108.4 | V363 | R361-V363 PolarHBondContact O-N 3.39Š|
| 362 | D | 39.2 | Very low | 44.6 | Very low | 142 Ų | 142 | 126.8 Ų | 126.8 | 76% | 0.759 | 72% | 0.72 | S | S | * | * | trans | -79.1 | 101.7 | 168.3 | -149.6 | -9.9 | 0 | 0 | 0 | 107.8 | N364 | D362-N364 VanDerWaalsContact C-N 3.32Š| ||
| 363 | V | 47 | Very low | 45.4 | Very low | 119 Ų | 119 | 122.3 Ų | 122.3 | 72% | 0.721 | 71% | 0.706 | S | S | * | * | trans | -91.5 | -1.4 | 177.1 | -112.7 | 0 | 0 | 0 | 0 | 111.8 | R361 Y365 | R361-V363 PolarHBondContact O-N 3.39Å; V363-Y365 VanDerWaalsContact C-N 3.33Å; V363-Y365 PolarHBondContact O-N 2.87Å | ||
| 364 | N | 35.9 | Very low | 46 | Very low | 130 Ų | 130 | 124.6 Ų | 124.6 | 70% | 0.695 | 70% | 0.701 | S | S | * | * | trans | -79.7 | 88.7 | 177.2 | -65 | -27.6 | 0 | 0 | 0 | 108.3 | D362 A366 | D362-N364 VanDerWaalsContact C-N 3.32Å; N364-A366 PolarHBondContact O-N 3.05Å | ||
| 365 | Y | 43.5 | Very low | 46.6 | Very low | 176 Ų | 176 | 125.6 Ų | 125.6 | 69% | 0.69 | 70% | 0.704 | S | S | * | * | trans | -62.9 | 76.2 | 146.7 | -71 | -83 | 0 | 0 | 0 | 106.9 | V363 T367 | V363-Y365 VanDerWaalsContact C-N 3.33Å; V363-Y365 PolarHBondContact O-N 2.87Å; Y365-T367 PolarHBondContact O-N 3.32Å | ||
| 366 | A | 41.4 | Very low | 47.1 | Very low | 84 Ų | 84 | 125.5 Ų | 125.5 | 69% | 0.694 | 70% | 0.703 | S | S | * | * | trans | -67 | 73.2 | 160.9 | 0 | 0 | 0 | 0 | 0 | 106.2 | N364 E368 | N364-A366 PolarHBondContact O-N 3.05Å; A366-E368 VanDerWaalsContact C-N 3.29Å; A366-E368 PolarHBondContact O-N 3.26Å | ||
| 367 | T | 46.1 | Very low | 47.8 | Very low | 117 Ų | 117 | 125.3 Ų | 125.3 | 72% | 0.718 | 69% | 0.691 | S | S | * | * | trans | -64.7 | 103.6 | 163.4 | -48.7 | 0 | 0 | 0 | 0 | 103.6 | Y365 G369 | Y365-T367 PolarHBondContact O-N 3.32Å; T367-G369 PolarHBondContact O-N 3.09Å | ||
| 368 | E | 45.6 | Very low | 48.6 | Very low | 184 Ų | 184 | 121.7 Ų | 121.7 | 86% | 0.86 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -46.8 | 107.9 | -179.1 | -62.5 | 177.7 | 161.9 | 0 | 0 | 110.1 | A366 L370 | A366-E368 VanDerWaalsContact C-N 3.29Å; A366-E368 PolarHBondContact O-N 3.26Å; E368-L370 PolarHBondContact O-N 3.13Å |
| 369 | G | 43 | Very low | 49.5 | Very low | 76 Ų | 76 | 123.4 Ų | 123.4 | 78% | 0.784 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 80.2 | 18.7 | 144 | 0 | 0 | 0 | 0 | 0 | 120.3 | T367 | T367-G369 PolarHBondContact O-N 3.09Š|
| 370 | L | 49.6 | Very low | 49.8 | Very low | 149 Ų | 149 | 122.8 Ų | 122.8 | 78% | 0.78 | 67% | 0.666 | S | S | * | * | trans | -124.7 | 100.3 | 166.5 | -88.6 | 88.5 | 0 | 0 | 0 | 111 | E368 L372 | E368-L370 PolarHBondContact O-N 3.13Å; L370-L372 PolarHBondContact O-N 3.44Å; L370-L372 VanDerWaalsContact O-N 3.07Å | ||
| 371 | E | 51.6 | Low | 50.1 | Low | 199 Ų | 199 | 123.6 Ų | 123.6 | 93% | 0.93 | 66% | 0.659 | S | S | * | * | trans | -61.9 | 107.2 | 161.8 | -72.7 | 179.1 | 165.6 | 0 | 0 | 107.9 | ||||
| 372 | L | 52.7 | Low | 50.5 | Low | 107 Ų | 107 | 121 Ų | 121 | 56% | 0.56 | 66% | 0.662 | S | S | * | * | trans | -70.4 | 137.6 | 171.5 | -80.7 | 156.3 | 0 | 0 | 0 | 108.5 | L370 V376 T377 | L370-L372 PolarHBondContact O-N 3.44Å; L370-L372 VanDerWaalsContact O-N 3.07Å; L372-V376 HydrophobicContact CD2-CG1 4.29Å; L372-T377 HydrophobicContact CB-CG2 4Å | ||
| 373 | P | 65 | Low | 50.8 | Low | 87 Ų | 87 | 119.9 Ų | 119.9 | 57% | 0.565 | 66% | 0.655 | S | S | * | * | trans | -53.5 | 142.6 | 175.5 | -24.5 | 32.5 | 0 | 0 | 0 | 112 | E375 V376 T377 | P373-E375 PolarHBondContact O-N 3.26Å; P373-V376 PolarHBondContact O-N 3.34Å; P373-T377 PolarHBondContact O-N 2.91Å | ||
| 374 | D | 59.2 | Low | 50.6 | Low | 122 Ų | 122 | 120.2 Ų | 120.2 | 65% | 0.652 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -52.7 | -29.3 | -176.1 | -77.2 | -11.9 | 0 | 0 | 0 | 114.5 | V376 T377 K378 | D374-V376 VanDerWaalsContact C-N 3.32Å; D374-V376 PolarHBondContact O-N 2.71Å; D374-T377 VanDerWaalsContact CA-OG1 3.29Å; D374-T377 WeakPolarHBondContact CA-OG1 3.44Å; D374-T377 PolarHBondContact O-OG1 3.24Å; D374-K378 VanDerWaalsContact O-CG 3.31Å; D374-K378 WeakPolarHBondContact O-CG 3.15Å; D374-K378 PolarHBondContact O-N 2.93Å; D374-K378 VanDerWaalsContact O-N 3.13Å |
| 375 | E | 63.3 | Low | 51 | Low | 162 Ų | 162 | 117.2 Ų | 117.2 | 76% | 0.757 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -68.3 | -32.4 | 176.9 | -64.1 | -168.7 | 176.9 | 0 | 0 | 112.2 | P373 L379 | P373-E375 PolarHBondContact O-N 3.26Å; E375-L379 WeakPolarHBondContact O-CG 3.39Å |
| 376 | V | 61.1 | Low | 50.9 | Low | 71 Ų | 71 | 114.9 Ų | 114.9 | 43% | 0.43 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -81.8 | -33.4 | 179.3 | -171.9 | 0 | 0 | 0 | 0 | 111.1 | L372 P373 D374 L379 | L372-V376 HydrophobicContact CD2-CG1 4.29Å; P373-V376 PolarHBondContact O-N 3.34Å; D374-V376 VanDerWaalsContact C-N 3.32Å; D374-V376 PolarHBondContact O-N 2.71Å; V376-L379 WeakPolarHBondContact O-CB 3.35Å; V376-L379 PolarHBondContact O-N 3.39Å |
| 377 | T | 57 | Low | 51 | Low | 49 Ų | 49 | 117.8 Ų | 117.8 | 30% | 0.301 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -67.2 | -39.2 | 174.6 | 57.3 | 0 | 0 | 0 | 0 | 111.2 | L372 P373 D374 L379 S380 E381 | L372-T377 HydrophobicContact CB-CG2 4Å; P373-T377 PolarHBondContact O-N 2.91Å; D374-T377 VanDerWaalsContact CA-OG1 3.29Å; D374-T377 WeakPolarHBondContact CA-OG1 3.44Å; D374-T377 PolarHBondContact O-OG1 3.24Å; T377-L379 PolarHBondContact O-N 3.29Å; T377-S380 PolarHBondContact O-N 2.7Å; T377-S380 PolarHBondContact O-OG 2.79Å; T377-E381 PolarHBondContact O-N 2.83Å |
| 378 | K | 57.7 | Low | 50.9 | Low | 128 Ų | 128 | 114.3 Ų | 114.3 | 56% | 0.557 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -61.9 | -29.6 | 173.7 | -74.6 | 174.9 | -177.8 | 175.6 | 0 | 113.8 | D374 S380 E381 | D374-K378 VanDerWaalsContact O-CG 3.31Å; D374-K378 WeakPolarHBondContact O-CG 3.15Å; D374-K378 PolarHBondContact O-N 2.93Å; D374-K378 VanDerWaalsContact O-N 3.13Å; K378-S380 VanDerWaalsContact C-N 3.29Å; K378-S380 PolarHBondContact O-N 3.32Å; K378-E381 PolarHBondContact O-N 2.95Å |
| 379 | L | 55.7 | Low | 50.7 | Low | 108 Ų | 108 | 107.3 Ų | 107.3 | 57% | 0.565 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -65.7 | -33.5 | 174.9 | -68.8 | 170.4 | 0 | 0 | 0 | 111.7 | E375 V376 T377 T382 I383 | E375-L379 WeakPolarHBondContact O-CG 3.39Å; V376-L379 WeakPolarHBondContact O-CB 3.35Å; V376-L379 PolarHBondContact O-N 3.39Å; T377-L379 PolarHBondContact O-N 3.29Å; L379-T382 PolarHBondContact O-OG1 3.04Å; L379-I383 WeakPolarHBondContact O-CG1 3.46Å; L379-I383 PolarHBondContact O-N 2.98Å |
| 380 | S | 46.7 | Very low | 50.4 | Low | 71 Ų | 71 | 112.7 Ų | 112.7 | 50% | 0.497 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -78.6 | -19.3 | 176.1 | 71.3 | 0 | 0 | 0 | 0 | 113.2 | T377 K378 I383 | T377-S380 PolarHBondContact O-N 2.7Å; T377-S380 PolarHBondContact O-OG 2.79Å; K378-S380 VanDerWaalsContact C-N 3.29Å; K378-S380 PolarHBondContact O-N 3.32Å; S380-I383 CarbonylContact O-C 3.3Å; S380-I383 VanDerWaalsContact O-C 3.3Å; S380-I383 PolarHBondContact O-N 3.37Å |
| 381 | E | 48.4 | Very low | 50.4 | Low | 146 Ų | 146 | 112 Ų | 112 | 68% | 0.682 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -68.2 | -35.5 | 172.9 | -66.2 | -178.6 | 174.3 | 0 | 0 | 112.2 | T377 K378 | T377-E381 PolarHBondContact O-N 2.83Å; K378-E381 PolarHBondContact O-N 2.95Å |
| 382 | T | 51.5 | Low | 50 | Low | 114 Ų | 114 | 111.6 Ų | 111.6 | 70% | 0.699 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -76.4 | -30.8 | 174.6 | 53.2 | 0 | 0 | 0 | 0 | 112.5 | L379 I384 | L379-T382 PolarHBondContact O-OG1 3.04Å; T382-I384 PolarHBondContact O-N 3.02Å |
| 383 | I | 45.2 | Very low | 49.7 | Very low | 119 Ų | 119 | 108.8 Ų | 108.8 | 61% | 0.61 | 59% | 0.594 | S | S | * | * | S | Bend | trans | -90.3 | 82.5 | 174.5 | -56.3 | 169.4 | 0 | 0 | 0 | 107.3 | L379 S380 P385 | L379-I383 WeakPolarHBondContact O-CG1 3.46Å; L379-I383 PolarHBondContact O-N 2.98Å; S380-I383 CarbonylContact O-C 3.3Å; S380-I383 VanDerWaalsContact O-C 3.3Å; S380-I383 PolarHBondContact O-N 3.37Å; I383-P385 WeakPolarHBondContact O-CD 3.09Å |
| 384 | I | 43.1 | Very low | 48.6 | Very low | 126 Ų | 126 | 108 Ų | 108 | 65% | 0.646 | 59% | 0.594 | S | S | * | * | trans | -47.2 | 106.8 | 169.7 | -59.9 | -178.7 | 0 | 0 | 0 | 106.7 | T382 S386 A388 | T382-I384 PolarHBondContact O-N 3.02Å; I384-S386 PolarHBondContact O-N 3.05Å; I384-A388 HydrophobicContact CG2-CB 3.83Å | ||
| 385 | P | 42.7 | Very low | 48.1 | Very low | 67 Ų | 67 | 106.2 Ų | 106.2 | 44% | 0.435 | 59% | 0.592 | S | S | . | * | trans | -59.6 | 135.4 | -176.7 | 20.6 | -28.5 | 0 | 0 | 0 | 105.2 | I383 Q387 A388 | I383-P385 WeakPolarHBondContact O-CD 3.09Å; P385-Q387 CarbonylContact O-C 3.6Å; P385-Q387 PolarHBondContact O-N 2.92Å; P385-A388 HydrophobicContact CG-CB 3.95Å; P385-A388 WeakPolarHBondContact O-CA 3.42Å; P385-A388 WeakPolarHBondContact O-CB 3.46Å; P385-A388 PolarHBondContact O-N 3.25Å | ||
| 386 | S | 43.4 | Very low | 47.6 | Very low | 126 Ų | 126 | 104.7 Ų | 104.7 | 88% | 0.881 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.2 | -9.5 | 177.9 | 42.9 | 0 | 0 | 0 | 0 | 113.2 | I384 | I384-S386 PolarHBondContact O-N 3.05Š|
| 387 | Q | 42.9 | Very low | 47.2 | Very low | 145 Ų | 145 | 109.6 Ų | 109.6 | 68% | 0.678 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.1 | -29.9 | 168 | -66.5 | -172.6 | -44.9 | 0 | 0 | 114.5 | P385 G389 | P385-Q387 CarbonylContact O-C 3.6Å; P385-Q387 PolarHBondContact O-N 2.92Å; Q387-G389 VanDerWaalsContact C-N 3.26Å; Q387-G389 PolarHBondContact O-N 3.48Å |
| 388 | A | 44.6 | Very low | 47 | Very low | 45 Ų | 45 | 110.4 Ų | 110.4 | 37% | 0.372 | 62% | 0.618 | S | S | . | * | S | Bend | trans | -69 | 94.5 | 161.3 | 0 | 0 | 0 | 0 | 0 | 106.1 | I384 P385 W390 | I384-A388 HydrophobicContact CG2-CB 3.83Å; P385-A388 HydrophobicContact CG-CB 3.95Å; P385-A388 WeakPolarHBondContact O-CA 3.42Å; P385-A388 WeakPolarHBondContact O-CB 3.46Å; P385-A388 PolarHBondContact O-N 3.25Å; A388-W390 PolarHBondContact O-N 3.3Å |
| 389 | G | 40.9 | Very low | 47 | Very low | 36 Ų | 36 | 111.1 Ų | 111.1 | 37% | 0.371 | 63% | 0.625 | S | S | . | * | trans | -42 | 136.8 | -171.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q387 N391 | Q387-G389 VanDerWaalsContact C-N 3.26Å; Q387-G389 PolarHBondContact O-N 3.48Å; G389-N391 PolarHBondContact O-N 3.21Å; G389-N391 PolarHBondContact O-OD1 3.16Å | ||
| 390 | W | 36.8 | Very low | 46.9 | Very low | 189 Ų | 189 | 108.6 Ų | 108.6 | 72% | 0.716 | 61% | 0.614 | S | S | * | * | trans | -60.4 | 98.4 | 175.9 | 178.5 | 74.2 | 0 | 0 | 0 | 109.9 | A388 K392 G393 | A388-W390 PolarHBondContact O-N 3.3Å; W390-K392 HydrophobicContact CD2-CB 4.14Å; W390-K392 HydrophobicContact CH2-CB 4.14Å; W390-K392 HydrophobicContact CZ2-CB 3.62Å; W390-K392 PolarHBondContact O-N 3.48Å; W390-K392 VanDerWaalsContact O-N 3.13Å; W390-G393 VanDerWaalsContact CE3-N 3.3Å; W390-G393 VanDerWaalsContact CZ3-N 3.32Å; W390-G393 PolarHBondContact O-N 2.96Å | ||
| 391 | N | 48 | Very low | 46.8 | Very low | 136 Ų | 136 | 106.8 Ų | 106.8 | 73% | 0.727 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | -15 | -171.4 | -61.7 | -31.3 | 0 | 0 | 0 | 113.7 | G389 G393 A394 | G389-N391 PolarHBondContact O-N 3.21Å; G389-N391 PolarHBondContact O-OD1 3.16Å; N391-G393 PolarHBondContact O-N 2.99Å; N391-A394 PolarHBondContact O-N 2.89Å |
| 392 | K | 43.3 | Very low | 46.8 | Very low | 189 Ų | 189 | 109.2 Ų | 109.2 | 82% | 0.822 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70 | -21.3 | 178.1 | -73.7 | -175.9 | 178.9 | 179.8 | 0 | 113 | W390 | W390-K392 HydrophobicContact CD2-CB 4.14Å; W390-K392 HydrophobicContact CH2-CB 4.14Å; W390-K392 HydrophobicContact CZ2-CB 3.62Å; W390-K392 PolarHBondContact O-N 3.48Å; W390-K392 VanDerWaalsContact O-N 3.13Å |
| 393 | G | 47 | Very low | 46.6 | Very low | 49 Ų | 49 | 107.2 Ų | 107.2 | 51% | 0.505 | 62% | 0.618 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -105.2 | -10.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | W390 N391 S395 | W390-G393 VanDerWaalsContact CE3-N 3.3Å; W390-G393 VanDerWaalsContact CZ3-N 3.32Å; W390-G393 PolarHBondContact O-N 2.96Å; N391-G393 PolarHBondContact O-N 2.99Å; G393-S395 PolarHBondContact O-N 2.82Å |
| 394 | A | 43 | Very low | 46.8 | Very low | 70 Ų | 70 | 104.2 Ų | 104.2 | 58% | 0.579 | 61% | 0.611 | S | S | * | * | trans | -76.2 | 91.9 | -176.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | N391 | N391-A394 PolarHBondContact O-N 2.89Š| ||
| 395 | S | 47 | Very low | 47.2 | Very low | 85 Ų | 85 | 105 Ų | 105 | 59% | 0.594 | 62% | 0.621 | S | S | * | * | trans | -76.5 | 122.4 | 169.6 | -172 | 0 | 0 | 0 | 0 | 109.2 | G393 K397 | G393-S395 PolarHBondContact O-N 2.82Å; S395-K397 PolarHBondContact O-N 3.37Å; S395-K397 WeakPolarHBondContact OG-CB 3.28Å; S395-K397 PolarHBondContact OG-N 3.12Å | ||
| 396 | Q | 52.7 | Low | 47.7 | Very low | 130 Ų | 130 | 108.9 Ų | 108.9 | 61% | 0.607 | 63% | 0.627 | S | S | * | * | trans | -64.4 | 4.3 | 169.6 | -161.1 | -177 | 17.7 | 0 | 0 | 112.9 | G398 M399 | Q396-G398 PolarHBondContact O-N 3.15Å; Q396-M399 HydrophobicContact CB-SD 4.46Å; Q396-M399 HydrophobicContact CG-CB 3.93Å; Q396-M399 HydrophobicContact CG-CG 4.33Å; Q396-M399 HydrophobicContact CG-SD 4.02Å; Q396-M399 PolarHBondContact O-N 3.26Å | ||
| 397 | K | 53 | Low | 48.2 | Very low | 174 Ų | 174 | 106.2 Ų | 106.2 | 76% | 0.757 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.5 | 108.4 | 177.8 | -175.9 | 177.7 | -176.4 | -179.1 | 0 | 110.3 | S395 | S395-K397 PolarHBondContact O-N 3.37Å; S395-K397 WeakPolarHBondContact OG-CB 3.28Å; S395-K397 PolarHBondContact OG-N 3.12Å |
| 398 | G | 53.5 | Low | 48.7 | Very low | 65 Ų | 65 | 105.1 Ų | 105.1 | 67% | 0.67 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 95.8 | 2.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | Q396 | Q396-G398 PolarHBondContact O-N 3.15Š|
| 399 | M | 56.7 | Low | 49 | Very low | 144 Ų | 144 | 111.4 Ų | 111.4 | 71% | 0.709 | 63% | 0.625 | S | S | * | * | trans | -82.7 | -20.1 | 179.8 | -66.7 | -178 | 69.1 | 0 | 0 | 114.1 | Q396 | Q396-M399 HydrophobicContact CB-SD 4.46Å; Q396-M399 HydrophobicContact CG-CB 3.93Å; Q396-M399 HydrophobicContact CG-CG 4.33Å; Q396-M399 HydrophobicContact CG-SD 4.02Å; Q396-M399 PolarHBondContact O-N 3.26Å | ||
| 400 | T | 54 | Low | 49.3 | Very low | 54 Ų | 54 | 110.5 Ų | 110.5 | 33% | 0.331 | 62% | 0.615 | S | S | . | * | S | Bend | trans | -84.5 | 131.1 | 171.4 | 53.2 | 0 | 0 | 0 | 0 | 109.9 | ||
| 401 | G | 45.7 | Very low | 49.9 | Very low | 34 Ų | 34 | 108.3 Ų | 108.3 | 35% | 0.351 | 61% | 0.611 | S | S | . | * | P | Polyproline II helix | trans | -52.5 | 147.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | G403 A404 | G401-G403 PolarHBondContact O-N 2.66Å; G401-A404 VanDerWaalsContact O-CB 3.31Å; G401-A404 WeakPolarHBondContact O-CB 3.05Å; G401-A404 PolarHBondContact O-N 3.46Å |
| 402 | F | 47.9 | Very low | 50 | Low | 196 Ų | 196 | 106.9 Ų | 106.9 | 86% | 0.86 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.4 | 125.5 | 176.9 | -177.1 | -95.6 | 0 | 0 | 0 | 110.5 | A404 | F402-A404 VanDerWaalsContact C-N 3.34Å; F402-A404 PolarHBondContact O-N 3.03Å |
| 403 | G | 46.1 | Very low | 50.3 | Low | 73 Ų | 73 | 101.8 Ų | 101.8 | 75% | 0.753 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 84.3 | -5.3 | -179.1 | 0 | 0 | 0 | 0 | 0 | 116 | G401 V405 | G401-G403 PolarHBondContact O-N 2.66Å; G403-V405 PolarHBondContact O-N 3.38Å |
| 404 | A | 50.2 | Low | 50.4 | Low | 56 Ų | 56 | 105.7 Ų | 105.7 | 46% | 0.463 | 58% | 0.584 | S | S | . | * | P | Polyproline II helix | trans | -67.2 | 124.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | G401 F402 R406 | G401-A404 VanDerWaalsContact O-CB 3.31Å; G401-A404 WeakPolarHBondContact O-CB 3.05Å; G401-A404 PolarHBondContact O-N 3.46Å; F402-A404 VanDerWaalsContact C-N 3.34Å; F402-A404 PolarHBondContact O-N 3.03Å; A404-R406 PolarHBondContact O-N 3.34Å |
| 405 | V | 52.6 | Low | 50.7 | Low | 143 Ų | 143 | 109.9 Ų | 109.9 | 87% | 0.867 | 59% | 0.585 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 121.6 | 178.3 | -150.5 | 0 | 0 | 0 | 0 | 108.2 | G403 D407 | G403-V405 PolarHBondContact O-N 3.38Å; V405-D407 PolarHBondContact O-N 3.07Å |
| 406 | R | 52.6 | Low | 50.8 | Low | 148 Ų | 148 | 109.2 Ų | 109.2 | 56% | 0.558 | 57% | 0.574 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 125.5 | 170.3 | -65.7 | -177.5 | -171 | 176.3 | 5 | 107.7 | A404 V408 | A404-R406 PolarHBondContact O-N 3.34Å; R406-V408 HydrophobicContact CB-CG2 4.19Å; R406-V408 PolarHBondContact O-N 2.76Å |
| 407 | D | 52.7 | Low | 50.5 | Low | 70 Ų | 70 | 110.2 Ų | 110.2 | 37% | 0.374 | 57% | 0.573 | S | S | . | * | trans | -74 | 84.8 | 171.4 | -172.4 | 14.4 | 0 | 0 | 0 | 109.7 | V405 K409 G410 K411 H412 | V405-D407 PolarHBondContact O-N 3.07Å; D407-K409 VanDerWaalsContact C-N 3.27Å; D407-K409 PolarHBondContact OD1-N 3.12Å; D407-G410 PolarHBondContact OD1-N 3.22Å; D407-G410 VanDerWaalsContact OD1-N 3.09Å; D407-G410 VanDerWaalsContact OD2-C 3.3Å; D407-K411 PolarHBondContact OD1-N 3.25Å; D407-K411 VanDerWaalsContact OD1-N 3.15Å; D407-K411 PolarHBondContact OD2-N 3.34Å; D407-H412 VanDerWaalsContact OD2-CB 3.28Å; D407-H412 WeakPolarHBondContact OD2-CB 3.09Å; D407-H412 PolarHBondContact OD2-N 3.04Å | ||
| 408 | V | 53.7 | Low | 50.5 | Low | 122 Ų | 122 | 107.1 Ų | 107.1 | 74% | 0.739 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -22.9 | 175.8 | -174.3 | 0 | 0 | 0 | 0 | 110.7 | R406 | R406-V408 HydrophobicContact CB-CG2 4.19Å; R406-V408 PolarHBondContact O-N 2.76Å |
| 409 | K | 51.2 | Low | 50.5 | Low | 176 Ų | 176 | 111.3 Ų | 111.3 | 77% | 0.765 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.2 | 3.7 | -175.1 | -68.2 | -167.7 | 179.1 | -171.4 | 0 | 113.5 | D407 K411 | D407-K409 VanDerWaalsContact C-N 3.27Å; D407-K409 PolarHBondContact OD1-N 3.12Å; K409-K411 HydrophobicContact CB-CG 4.23Å; K409-K411 PolarHBondContact O-N 3.11Å; K409-K411 VanDerWaalsContact O-N 3.11Å |
| 410 | G | 47.9 | Very low | 50.4 | Low | 17 Ų | 17 | 109.9 Ų | 109.9 | 18% | 0.175 | 56% | 0.558 | C | S | . | * | trans | 58.4 | 23.6 | 180 | 0 | 0 | 0 | 0 | 0 | 113.9 | D407 H412 L413 K414 | D407-G410 PolarHBondContact OD1-N 3.22Å; D407-G410 VanDerWaalsContact OD1-N 3.09Å; D407-G410 VanDerWaalsContact OD2-C 3.3Å; G410-H412 PolarHBondContact O-N 3.2Å; G410-L413 WeakPolarHBondContact O-CB 3.46Å; G410-L413 PolarHBondContact O-N 3.05Å; G410-K414 PolarHBondContact O-N 2.77Å | ||
| 411 | K | 49.5 | Very low | 50.2 | Low | 144 Ų | 144 | 113.8 Ų | 113.8 | 63% | 0.626 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -61.6 | -33.3 | -179.4 | -74.2 | -170.3 | 174.6 | -169.3 | 0 | 111.9 | D407 K409 R415 | D407-K411 PolarHBondContact OD1-N 3.25Å; D407-K411 VanDerWaalsContact OD1-N 3.15Å; D407-K411 PolarHBondContact OD2-N 3.34Å; K409-K411 HydrophobicContact CB-CG 4.23Å; K409-K411 PolarHBondContact O-N 3.11Å; K409-K411 VanDerWaalsContact O-N 3.11Å; K411-R415 PolarHBondContact O-N 2.88Å; K411-R415 VanDerWaalsContact O-N 3.11Å |
| 412 | H | 50.4 | Low | 50.4 | Low | 106 Ų | 106 | 115.9 Ų | 115.9 | 49% | 0.491 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -67.7 | -40.4 | 174.2 | 177.9 | 41 | 0 | 0 | 0 | 111.5 | D407 G410 R415 L416 | D407-H412 VanDerWaalsContact OD2-CB 3.28Å; D407-H412 WeakPolarHBondContact OD2-CB 3.09Å; D407-H412 PolarHBondContact OD2-N 3.04Å; G410-H412 PolarHBondContact O-N 3.2Å; H412-R415 PolarHBondContact O-N 3.34Å; H412-L416 PolarHBondContact O-N 3.34Å; H412-L416 VanDerWaalsContact O-N 3.15Å |
| 413 | L | 49.4 | Very low | 50.7 | Low | 81 Ų | 81 | 115.6 Ų | 115.6 | 42% | 0.424 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -64.6 | -43.7 | 173.9 | -116.7 | 76.4 | 0 | 0 | 0 | 111.1 | G410 R415 L416 W417 | G410-L413 WeakPolarHBondContact O-CB 3.46Å; G410-L413 PolarHBondContact O-N 3.05Å; L413-R415 VanDerWaalsContact C-N 3.25Å; L413-R415 PolarHBondContact O-N 2.8Å; L413-L416 PolarHBondContact O-N 3.21Å; L413-L416 VanDerWaalsContact O-N 3.17Å; L413-W417 PolarHBondContact O-N 2.93Å |
| 414 | K | 47.7 | Very low | 50.9 | Low | 131 Ų | 131 | 117.6 Ų | 117.6 | 57% | 0.57 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -58.4 | -39.9 | 177.2 | -157.8 | -173.7 | -171.8 | -111.7 | 0 | 111.7 | G410 W417 E418 | G410-K414 PolarHBondContact O-N 2.77Å; K414-W417 PolarHBondContact O-N 3.05Å; K414-E418 WeakPolarHBondContact CE-OE1 3.45Å; K414-E418 IonicContact NZ-OE1 2.7Å; K414-E418 PolarHBondContact NZ-OE1 3.14Å; K414-E418 WeakPolarHBondContact O-CG 3.36Å; K414-E418 PolarHBondContact O-N 3.41Å |
| 415 | R | 49.2 | Very low | 50.6 | Low | 158 Ų | 158 | 122.5 Ų | 122.5 | 60% | 0.596 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65.6 | -40.6 | 177.6 | -160.3 | -175.7 | -61.7 | 141.8 | -0.1 | 112.6 | K411 H412 L413 W417 E418 E419 | K411-R415 PolarHBondContact O-N 2.88Å; K411-R415 VanDerWaalsContact O-N 3.11Å; H412-R415 PolarHBondContact O-N 3.34Å; L413-R415 VanDerWaalsContact C-N 3.25Å; L413-R415 PolarHBondContact O-N 2.8Å; R415-W417 VanDerWaalsContact C-N 3.34Å; R415-E418 PolarHBondContact O-N 3.21Å; R415-E419 WeakPolarHBondContact O-CB 3.3Å; R415-E419 PolarHBondContact O-N 2.94Å; R415-E419 VanDerWaalsContact O-N 3.15Å |
| 416 | L | 49.5 | Very low | 50 | Low | 71 Ų | 71 | 123.5 Ų | 123.5 | 37% | 0.372 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -64.3 | -40.5 | 174 | -76.8 | 161.4 | 0 | 0 | 0 | 111.5 | H412 L413 E419 D420 | H412-L416 PolarHBondContact O-N 3.34Å; H412-L416 VanDerWaalsContact O-N 3.15Å; L413-L416 PolarHBondContact O-N 3.21Å; L413-L416 VanDerWaalsContact O-N 3.17Å; L416-E419 PolarHBondContact O-N 2.75Å; L416-D420 PolarHBondContact O-N 3.41Å; L416-D420 VanDerWaalsContact O-N 3.08Å |
| 417 | W | 46.4 | Very low | 49.6 | Very low | 151 Ų | 151 | 125.2 Ų | 125.2 | 57% | 0.572 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -66.2 | -40 | 177.4 | -84.8 | 64 | 0 | 0 | 0 | 112.9 | L413 K414 R415 E419 Y421 | L413-W417 PolarHBondContact O-N 2.93Å; K414-W417 PolarHBondContact O-N 3.05Å; R415-W417 VanDerWaalsContact C-N 3.34Å; W417-E419 VanDerWaalsContact C-N 3.29Å; W417-E419 PolarHBondContact O-N 3.08Å; W417-Y421 PolarHBondContact O-N 2.88Å |
| 418 | E | 52.9 | Low | 48.8 | Very low | 110 Ų | 110 | 133.7 Ų | 133.7 | 51% | 0.514 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -67.7 | -28.9 | 176 | -74.6 | 169.9 | -177.5 | 0 | 0 | 112.3 | K414 R415 | K414-E418 WeakPolarHBondContact CE-OE1 3.45Å; K414-E418 IonicContact NZ-OE1 2.7Å; K414-E418 PolarHBondContact NZ-OE1 3.14Å; K414-E418 WeakPolarHBondContact O-CG 3.36Å; K414-E418 PolarHBondContact O-N 3.41Å; R415-E418 PolarHBondContact O-N 3.21Å |
| 419 | E | 54 | Low | 48.5 | Very low | 152 Ų | 152 | 134.3 Ų | 134.3 | 71% | 0.71 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -80.7 | -36 | -179.6 | -153.4 | 164.2 | -147.5 | 0 | 0 | 111.9 | R415 L416 W417 | R415-E419 WeakPolarHBondContact O-CB 3.3Å; R415-E419 PolarHBondContact O-N 2.94Å; R415-E419 VanDerWaalsContact O-N 3.15Å; L416-E419 PolarHBondContact O-N 2.75Å; W417-E419 VanDerWaalsContact C-N 3.29Å; W417-E419 PolarHBondContact O-N 3.08Å |
| 420 | D | 55.3 | Low | 48.4 | Very low | 114 Ų | 114 | 132.1 Ų | 132.1 | 61% | 0.61 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -87.7 | -22.6 | 179.9 | -70.9 | -25.2 | 0 | 0 | 0 | 113.7 | L416 | L416-D420 PolarHBondContact O-N 3.41Å; L416-D420 VanDerWaalsContact O-N 3.08Å |
| 421 | Y | 49 | Very low | 48.4 | Very low | 137 Ų | 137 | 138.5 Ų | 138.5 | 54% | 0.537 | 64% | 0.642 | S | S | . | * | trans | -135.2 | 69.9 | -176.7 | -57.5 | -85.5 | 0 | 0 | 0 | 112.6 | W417 E423 E424 | W417-Y421 PolarHBondContact O-N 2.88Å; Y421-E423 PolarHBondContact O-N 3.18Å; Y421-E424 PolarHBondContact O-N 2.99Å | ||
| 422 | P | 50.8 | Low | 48.3 | Very low | 78 Ų | 78 | 138.2 Ų | 138.2 | 51% | 0.506 | 64% | 0.643 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -65.5 | -18.6 | 178.9 | 26.4 | -34.5 | 0 | 0 | 0 | 113.5 | E424 E425 | P422-E424 VanDerWaalsContact C-N 3.29Å; P422-E424 PolarHBondContact O-N 3.03Å; P422-E425 WeakPolarHBondContact O-CG 3.06Å |
| 423 | E | 53.1 | Low | 48.2 | Very low | 189 Ų | 189 | 140.2 Ų | 140.2 | 88% | 0.883 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | -8.4 | -179.8 | -59.4 | -161.5 | -169.7 | 0 | 0 | 113.8 | Y421 E425 | Y421-E423 PolarHBondContact O-N 3.18Å; E423-E425 PolarHBondContact O-N 3.2Å |
| 424 | E | 50.8 | Low | 48.1 | Very low | 116 Ų | 116 | 144.1 Ų | 144.1 | 54% | 0.542 | 67% | 0.668 | S | S | . | * | trans | -90.1 | 40.5 | 172 | -63.4 | -161.7 | 173.9 | 0 | 0 | 112 | Y421 P422 H426 | Y421-E424 PolarHBondContact O-N 2.99Å; P422-E424 VanDerWaalsContact C-N 3.29Å; P422-E424 PolarHBondContact O-N 3.03Å; E424-H426 PolarHBondContact O-N 2.92Å | ||
| 425 | E | 43 | Very low | 48.1 | Very low | 159 Ų | 159 | 145.1 Ų | 145.1 | 74% | 0.743 | 68% | 0.675 | S | S | * | * | trans | -73.6 | 3.4 | -179.6 | -97.4 | -174.7 | -178 | 0 | 0 | 114.9 | P422 E423 | P422-E425 WeakPolarHBondContact O-CG 3.06Å; E423-E425 PolarHBondContact O-N 3.2Å | ||
| 426 | H | 41.5 | Very low | 48.1 | Very low | 163 Ų | 163 | 144.1 Ų | 144.1 | 76% | 0.755 | 68% | 0.681 | S | S | * | * | trans | -125.9 | 75.3 | -172.6 | -68.4 | -52.5 | 0 | 0 | 0 | 114.1 | E424 | E424-H426 PolarHBondContact O-N 2.92Š| ||
| 427 | F | 43.9 | Very low | 47.9 | Very low | 185 Ų | 185 | 150.2 Ų | 150.2 | 81% | 0.811 | 71% | 0.707 | S | S | * | * | trans | -136.9 | 82.9 | 157.9 | -70.6 | -75.2 | 0 | 0 | 0 | 111.6 | ||||
| 428 | L | 34.6 | Very low | 48.1 | Very low | 248 Ų | 248 | 150.1 Ų | 150.1 | 100% | 1.298 | 72% | 0.719 | S | S | * | * | trans | -111.9 | 0 | 152 | -106.4 | 164.1 | 0 | 0 | 0 | 108.4 |
Retrieved 428 of 428 residues in 233.4 ms
(Link to these results)