| 1 | M | 39.8 | Very low | 47.8 | Very low | 248 Ų | 248 | 164.1 Ų | 164.1 | 100% | 1.222 | 84% | 0.844 | S | S | * | * | | | | 0 | 121.4 | 0 | -75.2 | -171.1 | 173.1 | 0 | 0 | 110.1 | | |
| 2 | G | 42.2 | Very low | 47.6 | Very low | 78 Ų | 78 | 169.8 Ų | 169.8 | 80% | 0.804 | 85% | 0.847 | S | S | * | * | | | trans | 68.3 | 135.7 | 154.5 | 0 | 0 | 0 | 0 | 0 | 117.6 | | |
| 3 | R | 44.6 | Very low | 47.2 | Very low | 200 Ų | 200 | 170.2 Ų | 170.2 | 76% | 0.755 | 85% | 0.845 | S | S | * | * | | | cis | -164.7 | 124.3 | 2.4 | -126.3 | 174.7 | -178.5 | -169.6 | 3 | 106 | | |
| 4 | S | 45.4 | Very low | 46.7 | Very low | 112 Ų | 112 | 173.3 Ų | 173.3 | 78% | 0.783 | 84% | 0.842 | S | S | * | * | | | trans | -61.6 | 141.3 | 162.1 | 38.6 | 0 | 0 | 0 | 0 | 110.4 | | |
| 5 | R | 46.2 | Very low | 46.6 | Very low | 194 Ų | 194 | 177.3 Ų | 177.3 | 73% | 0.732 | 84% | 0.844 | S | S | * | * | | | trans | -167.3 | 98.7 | 157.6 | -98.3 | 143.3 | -164.1 | -151.7 | 4.7 | 111.6 | | |
| 6 | S | 46.9 | Very low | 46 | Very low | 111 Ų | 111 | 179.7 Ų | 179.7 | 78% | 0.776 | 84% | 0.843 | S | S | * | * | | | trans | -48.2 | 139.1 | 159 | 46.8 | 0 | 0 | 0 | 0 | 113.8 | | |
| 7 | R | 47.1 | Very low | 45.8 | Very low | 249 Ų | 249 | 175.8 Ų | 175.8 | 94% | 0.94 | 84% | 0.84 | S | S | * | * | | | trans | -141.5 | 77.5 | 160.5 | -110 | 177.4 | -179.1 | 172.7 | -0.5 | 110.5 | | |
| 8 | T | 57.3 | Low | 45.5 | Very low | 125 Ų | 125 | 179.8 Ų | 179.8 | 77% | 0.767 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 132.4 | 159.3 | 37.3 | 0 | 0 | 0 | 0 | 108.7 | | |
| 9 | P | 59.8 | Low | 45.4 | Very low | 117 Ų | 117 | 177 Ų | 177 | 76% | 0.76 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 140.6 | 175.8 | 28.5 | -30.8 | 0 | 0 | 0 | 110.8 | | |
| 10 | P | 53.6 | Low | 45.6 | Very low | 128 Ų | 128 | 173 Ų | 173 | 83% | 0.831 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 134.3 | -174.9 | 27 | -32.7 | 0 | 0 | 0 | 112.2 | R12 | P10-R12 PolarHBondContact O-N 3.48Š|
| 11 | R | 42.6 | Very low | 45.5 | Very low | 243 Ų | 243 | 169.9 Ų | 169.9 | 92% | 0.917 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 119.8 | 170.9 | -70.9 | -177.4 | 174.1 | -162.3 | -1.2 | 109.2 | E13 | R11-E13 PolarHBondContact O-N 3.44Å; R11-E13 VanDerWaalsContact O-N 3.15Å |
| 12 | R | 45.6 | Very low | 45.9 | Very low | 232 Ų | 232 | 170.1 Ų | 170.1 | 88% | 0.875 | 83% | 0.828 | S | S | * | * | | | trans | -70.8 | 105.3 | 175.7 | -161.3 | 178.2 | -171.1 | -169.8 | 5 | 109.6 | P10 R14 | P10-R12 PolarHBondContact O-N 3.48Å; R12-R14 PolarHBondContact O-N 3.06Å |
| 13 | E | 43 | Very low | 46 | Very low | 175 Ų | 175 | 174 Ų | 174 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | | | trans | -58.3 | 115.5 | 166 | -68.1 | -174.3 | 160.5 | 0 | 0 | 109.6 | R11 | R11-E13 PolarHBondContact O-N 3.44Å; R11-E13 VanDerWaalsContact O-N 3.15Å |
| 14 | R | 39.2 | Very low | 46 | Very low | 214 Ų | 214 | 171.5 Ų | 171.5 | 81% | 0.808 | 82% | 0.821 | S | S | * | * | | | trans | -122.4 | 71.5 | 169.1 | -152.7 | -179.5 | -168.6 | -160.9 | 3.5 | 109 | R12 R16 | R12-R14 PolarHBondContact O-N 3.06Å; R14-R16 PolarHBondContact O-N 3.43Å |
| 15 | R | 45.8 | Very low | 46.1 | Very low | 233 Ų | 233 | 174.7 Ų | 174.7 | 88% | 0.879 | 82% | 0.824 | S | S | * | * | | | trans | -71.9 | 106.7 | 160.6 | -69.2 | -171.9 | -180 | -162.9 | 1.4 | 108.2 | | |
| 16 | R | 36.8 | Very low | 46.2 | Very low | 216 Ų | 216 | 175.8 Ų | 175.8 | 82% | 0.815 | 83% | 0.828 | S | S | * | * | | | trans | -141.6 | 93.6 | 158.8 | -104.7 | -176.1 | -176.3 | 175.8 | 1.9 | 108.6 | R14 | R14-R16 PolarHBondContact O-N 3.43Š|
| 17 | S | 42.6 | Very low | 46.2 | Very low | 113 Ų | 113 | 180.2 Ų | 180.2 | 79% | 0.79 | 83% | 0.828 | S | S | * | * | | | trans | -57.2 | 130 | 158.1 | 27.3 | 0 | 0 | 0 | 0 | 109.7 | | |
| 18 | R | 39.9 | Very low | 46.3 | Very low | 249 Ų | 249 | 178.7 Ų | 178.7 | 94% | 0.94 | 82% | 0.822 | S | S | * | * | | | trans | -172.6 | 96.2 | 151.7 | -105.5 | 163.7 | -171.7 | 178.7 | 2.5 | 110.5 | A20 | R18-A20 PolarHBondContact O-N 3.03Š|
| 19 | S | 44 | Very low | 45.8 | Very low | 126 Ų | 126 | 183.4 Ų | 183.4 | 88% | 0.881 | 83% | 0.826 | S | S | * | * | | | trans | -60.5 | 109.1 | 160.6 | 39.3 | 0 | 0 | 0 | 0 | 111 | | |
| 20 | A | 49.6 | Very low | 45.2 | Very low | 97 Ų | 97 | 184.2 Ų | 184.2 | 80% | 0.802 | 82% | 0.823 | S | S | * | * | | | trans | -178.8 | 83.6 | 161.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | R18 | R18-A20 PolarHBondContact O-N 3.03Š|
| 21 | S | 42.7 | Very low | 44.8 | Very low | 107 Ų | 107 | 188.7 Ų | 188.7 | 75% | 0.748 | 82% | 0.824 | S | S | * | * | | | trans | -166.6 | 26.7 | 159.7 | 64.7 | 0 | 0 | 0 | 0 | 115.3 | E23 | S21-E23 PolarHBondContact O-N 3.17Š|
| 22 | R | 48.8 | Very low | 45.1 | Very low | 254 Ų | 254 | 184.6 Ų | 184.6 | 96% | 0.958 | 82% | 0.82 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.9 | 3.9 | 167.1 | -76.2 | -176.8 | 177.6 | 163.3 | -1.1 | 113 | | |
| 23 | E | 44.3 | Very low | 45.2 | Very low | 159 Ų | 159 | 184.7 Ų | 184.7 | 74% | 0.743 | 82% | 0.821 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.5 | -12.5 | -174.1 | -155.4 | -176.2 | 158.3 | 0 | 0 | 114 | S21 E25 | S21-E23 PolarHBondContact O-N 3.17Å; E23-E25 PolarHBondContact O-N 2.96Å |
| 24 | H | 45.1 | Very low | 45.2 | Very low | 148 Ų | 148 | 181.2 Ų | 181.2 | 69% | 0.685 | 82% | 0.815 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.9 | -9.7 | -173.1 | -157.5 | 68.5 | 0 | 0 | 0 | 114.7 | | |
| 25 | E | 48.3 | Very low | 45.4 | Very low | 179 Ų | 179 | 183.1 Ų | 183.1 | 84% | 0.836 | 82% | 0.822 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | -16 | -172.5 | -153.1 | 169.1 | -161.5 | 0 | 0 | 113.8 | E23 | E23-E25 PolarHBondContact O-N 2.96Š|
| 26 | R | 48.1 | Very low | 45.3 | Very low | 217 Ų | 217 | 176.6 Ų | 176.6 | 82% | 0.819 | 81% | 0.813 | S | S | * | * | G | 310 helix | trans | -85.8 | -18.4 | -176.9 | -67.9 | -171.2 | -179.1 | -167 | 0.7 | 115.1 | R28 | R26-R28 PolarHBondContact O-N 3.31Š|
| 27 | R | 47 | Very low | 45.8 | Very low | 204 Ų | 204 | 176.2 Ų | 176.2 | 77% | 0.77 | 81% | 0.811 | S | S | * | * | G | 310 helix | trans | -81.6 | -6.2 | -173.4 | -75.2 | -171.2 | -178.4 | 174.7 | 2.9 | 115.9 | | |
| 28 | R | 49.2 | Very low | 46 | Very low | 217 Ų | 217 | 178.6 Ų | 178.6 | 82% | 0.819 | 82% | 0.815 | S | S | * | * | G | 310 helix | trans | -91.6 | -8.7 | -179.3 | -74.6 | -160.3 | 179.7 | -165.9 | 1.8 | 115 | R26 | R26-R28 PolarHBondContact O-N 3.31Š|
| 29 | R | 46.7 | Very low | 46.5 | Very low | 224 Ų | 224 | 177 Ų | 177 | 85% | 0.845 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -91.4 | -14.8 | -171.9 | -149.8 | 168.4 | -160.9 | 167.9 | 4.7 | 115.2 | | |
| 30 | D | 47 | Very low | 46.8 | Very low | 133 Ų | 133 | 177.4 Ų | 177.4 | 71% | 0.711 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -95.9 | 3.2 | -173.5 | -63.1 | -50.7 | 0 | 0 | 0 | 114.8 | | |
| 31 | R | 45.5 | Very low | 46.4 | Very low | 222 Ų | 222 | 184 Ų | 184 | 84% | 0.838 | 81% | 0.806 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | 6.7 | -175.8 | -148.8 | 166 | -147.9 | 170.6 | 7.7 | 115.8 | | |
| 32 | D | 48.4 | Very low | 46.7 | Very low | 157 Ų | 157 | 186.1 Ų | 186.1 | 84% | 0.84 | 81% | 0.809 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.7 | 8.2 | 178.9 | -81.3 | -56.8 | 0 | 0 | 0 | 114.3 | | |
| 33 | R | 47.3 | Very low | 46.4 | Very low | 235 Ų | 235 | 185.8 Ų | 185.8 | 89% | 0.887 | 81% | 0.807 | S | S | * | * | S | Bend | trans | -109.8 | 10.4 | -170.8 | -125.6 | 170.9 | -170.2 | 148 | 1 | 117.3 | | |
| 34 | S | 42.3 | Very low | 46.6 | Very low | 101 Ų | 101 | 189.7 Ų | 189.7 | 71% | 0.706 | 82% | 0.815 | S | S | * | * | | | trans | -138.5 | 47.4 | -175.8 | 46.9 | 0 | 0 | 0 | 0 | 114.9 | | |
| 35 | R | 43.9 | Very low | 46.3 | Very low | 254 Ų | 254 | 192.7 Ų | 192.7 | 96% | 0.958 | 82% | 0.82 | S | S | * | * | | | trans | -122.5 | 63.1 | 156.7 | -82.5 | -177.8 | 175.5 | 148.1 | -2.8 | 110.4 | | |
| 36 | S | 44.2 | Very low | 46 | Very low | 97 Ų | 97 | 190 Ų | 190 | 68% | 0.678 | 82% | 0.821 | S | S | * | * | | | trans | -81.3 | 134.3 | 163 | -80.3 | 0 | 0 | 0 | 0 | 109.3 | | |
| 37 | R | 47.8 | Very low | 45.5 | Very low | 208 Ų | 208 | 189.7 Ų | 189.7 | 79% | 0.785 | 82% | 0.82 | S | S | * | * | | | trans | 67.4 | 91.1 | 147.1 | -62.9 | 170 | 179.9 | -178.5 | -0.8 | 117.2 | | |
| 38 | D | 45.9 | Very low | 45.5 | Very low | 162 Ų | 162 | 185.6 Ų | 185.6 | 87% | 0.866 | 82% | 0.823 | S | S | * | * | | | trans | -123.5 | 101.7 | 138.3 | -82 | -61.5 | 0 | 0 | 0 | 107.9 | D40 | D38-D40 VanDerWaalsContact C-N 3.34Å; D38-D40 PolarHBondContact O-N 3.26Å |
| 39 | R | 50.7 | Low | 45 | Very low | 217 Ų | 217 | 186.8 Ų | 186.8 | 82% | 0.819 | 83% | 0.827 | S | S | * | * | | | trans | -91.5 | 53.3 | -179.4 | -80.9 | -179.6 | 165 | 168.5 | -5.5 | 109.7 | | |
| 40 | D | 49.3 | Very low | 44.7 | Very low | 134 Ų | 134 | 181 Ų | 181 | 72% | 0.717 | 82% | 0.821 | S | S | * | * | | | trans | -137 | 87.8 | -179.9 | -68.7 | -69 | 0 | 0 | 0 | 110.5 | D38 | D38-D40 VanDerWaalsContact C-N 3.34Å; D38-D40 PolarHBondContact O-N 3.26Å |
| 41 | R | 42.9 | Very low | 45.1 | Very low | 236 Ų | 236 | 180.3 Ų | 180.3 | 89% | 0.891 | 82% | 0.824 | S | S | * | * | | | trans | -136.4 | 84.4 | 161.2 | -140.7 | 168.1 | -150.4 | 166.1 | 7.6 | 110.1 | R43 | R41-R43 PolarHBondContact O-N 2.97Š|
| 42 | D | 47.5 | Very low | 45 | Very low | 151 Ų | 151 | 177.8 Ų | 177.8 | 81% | 0.807 | 82% | 0.821 | S | S | * | * | | | trans | -18 | 93.2 | 160.3 | -64.8 | -70.7 | 0 | 0 | 0 | 114.3 | R44 | D42-R44 PolarHBondContact O-N 3.49Š|
| 43 | R | 42.8 | Very low | 44.7 | Very low | 246 Ų | 246 | 181.3 Ų | 181.3 | 93% | 0.928 | 82% | 0.823 | S | S | * | * | | | trans | -92 | 38 | 167.6 | -86.7 | -174 | 179.9 | 154.4 | 0.5 | 112 | R41 | R41-R43 PolarHBondContact O-N 2.97Š|
| 44 | R | 48.8 | Very low | 44.9 | Very low | 241 Ų | 241 | 182 Ų | 182 | 91% | 0.909 | 83% | 0.825 | S | S | * | * | | | trans | -116.3 | 77.8 | 169.9 | -69.6 | -163.3 | -176.9 | -155.2 | 3.7 | 110.9 | D42 | D42-R44 PolarHBondContact O-N 3.49Š|
| 45 | R | 38.4 | Very low | 44.7 | Very low | 212 Ų | 212 | 189 Ų | 189 | 80% | 0.8 | 84% | 0.836 | S | S | * | * | | | trans | -149.2 | 81.9 | 153.7 | -150.1 | 168.7 | -168 | 175.8 | 4.1 | 111.3 | R47 | R45-R47 PolarHBondContact O-N 3.4Š|
| 46 | S | 42.4 | Very low | 44.8 | Very low | 122 Ų | 122 | 181.8 Ų | 181.8 | 85% | 0.853 | 83% | 0.825 | S | S | * | * | | | trans | -56.2 | 113.9 | 162.1 | -39 | 0 | 0 | 0 | 0 | 108.9 | | |
| 47 | R | 37.5 | Very low | 45.1 | Very low | 210 Ų | 210 | 189.2 Ų | 189.2 | 79% | 0.792 | 84% | 0.838 | S | S | * | * | | | trans | -145.5 | 105.8 | 158.7 | -123.4 | 170.1 | -174.2 | 168.3 | 0.9 | 109.4 | R45 | R45-R47 PolarHBondContact O-N 3.4Š|
| 48 | S | 46.1 | Very low | 45.4 | Very low | 118 Ų | 118 | 185.2 Ų | 185.2 | 83% | 0.825 | 84% | 0.837 | S | S | * | * | | | trans | -52 | 131.1 | 179.4 | 6.2 | 0 | 0 | 0 | 0 | 113.3 | | |
| 49 | R | 39.7 | Very low | 46.1 | Very low | 243 Ų | 243 | 183.2 Ų | 183.2 | 92% | 0.917 | 83% | 0.833 | S | S | * | * | | | trans | -170.3 | 102.4 | 147 | -113.3 | 158.6 | 177.3 | 162.8 | -1.7 | 112.9 | | |
| 50 | S | 40.4 | Very low | 46.2 | Very low | 102 Ų | 102 | 178.8 Ų | 178.8 | 71% | 0.713 | 83% | 0.832 | S | S | * | * | | | trans | 46 | 137.9 | 151.6 | -53 | 0 | 0 | 0 | 0 | 123 | | |
| 51 | P | 56.4 | Low | 46.3 | Very low | 118 Ų | 118 | 183.7 Ų | 183.7 | 77% | 0.766 | 84% | 0.841 | S | S | * | * | | | trans | -93.9 | 109 | 177.2 | 34.9 | -26.8 | 0 | 0 | 0 | 111.2 | | |
| 52 | H | 42.6 | Very low | 46.6 | Very low | 169 Ų | 169 | 183.4 Ų | 183.4 | 78% | 0.782 | 84% | 0.84 | S | S | * | * | | | trans | -137.9 | 124.9 | 167.8 | -78.9 | -53.4 | 0 | 0 | 0 | 115 | | |
| 53 | R | 42.6 | Very low | 46.5 | Very low | 232 Ų | 232 | 185.2 Ų | 185.2 | 88% | 0.875 | 84% | 0.843 | S | S | * | * | | | trans | 70.3 | 100.6 | 150.8 | -75.1 | -178.3 | 174.4 | -178.3 | -1.5 | 117.6 | R55 | R53-R55 PolarHBondContact O-N 3.13Å; R53-R55 VanDerWaalsContact O-N 3.13Å |
| 54 | R | 50.8 | Low | 46.5 | Very low | 250 Ų | 250 | 184.4 Ų | 184.4 | 94% | 0.943 | 84% | 0.84 | S | S | * | * | | | trans | -16.9 | 107.3 | 142.5 | -63.2 | -172.8 | -179.4 | -137.1 | 1.7 | 112.3 | | |
| 55 | R | 38.9 | Very low | 46.2 | Very low | 246 Ų | 246 | 178.2 Ų | 178.2 | 93% | 0.928 | 83% | 0.834 | S | S | * | * | | | trans | -103.5 | 95.1 | 163.1 | -160.3 | 170.6 | -166.1 | 168.8 | 4 | 107.5 | R53 R57 | R53-R55 PolarHBondContact O-N 3.13Å; R53-R55 VanDerWaalsContact O-N 3.13Å; R55-R57 PolarHBondContact O-N 3.05Å |
| 56 | S | 45.5 | Very low | 46.7 | Very low | 104 Ų | 104 | 174 Ų | 174 | 73% | 0.727 | 84% | 0.836 | S | S | * | * | | | trans | -52.2 | 129.3 | 172.8 | -51.6 | 0 | 0 | 0 | 0 | 110 | T58 | S56-T58 PolarHBondContact O-N 3.34Å; S56-T58 VanDerWaalsContact O-N 3.12Å |
| 57 | R | 49.7 | Very low | 46.9 | Very low | 252 Ų | 252 | 173 Ų | 173 | 95% | 0.951 | 83% | 0.83 | S | S | * | * | | | trans | -58.1 | 106.7 | 169.4 | -93.4 | 167 | 161.3 | 152.6 | -7 | 110 | R55 | R55-R57 PolarHBondContact O-N 3.05Š|
| 58 | T | 54.2 | Low | 47.7 | Very low | 124 Ų | 124 | 171.3 Ų | 171.3 | 76% | 0.761 | 84% | 0.835 | S | S | * | * | | | trans | -133.1 | 124.4 | 149.2 | 40.1 | 0 | 0 | 0 | 0 | 107.5 | S56 | S56-T58 PolarHBondContact O-N 3.34Å; S56-T58 VanDerWaalsContact O-N 3.12Å |
| 59 | P | 61.8 | Low | 47.6 | Very low | 120 Ų | 120 | 170.4 Ų | 170.4 | 78% | 0.779 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 135.1 | 178.3 | 20.9 | -17.6 | 0 | 0 | 0 | 110.7 | R61 | P59-R61 PolarHBondContact O-N 2.99Š|
| 60 | P | 52.9 | Low | 48 | Very low | 125 Ų | 125 | 164.8 Ų | 164.8 | 81% | 0.812 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -69 | 128.9 | 178.8 | 26.4 | -31.9 | 0 | 0 | 0 | 111 | R62 | P60-R62 PolarHBondContact O-N 3.2Š|
| 61 | R | 51.5 | Low | 48.3 | Very low | 236 Ų | 236 | 166.6 Ų | 166.6 | 89% | 0.891 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 117.7 | 168.9 | -78.6 | -177.4 | 169.9 | 170.5 | -2.6 | 108.8 | P59 H63 | P59-R61 PolarHBondContact O-N 2.99Å; R61-H63 PolarHBondContact O-N 3.29Å |
| 62 | R | 47.5 | Very low | 47.8 | Very low | 231 Ų | 231 | 172 Ų | 172 | 87% | 0.872 | 84% | 0.836 | S | S | * | * | | | trans | -65.1 | 109.3 | 180 | -147.6 | 175.7 | -169.4 | -168.1 | 2.1 | 109.5 | P60 R64 | P60-R62 PolarHBondContact O-N 3.2Å; R62-R64 PolarHBondContact O-N 3.18Å |
| 63 | H | 45.5 | Very low | 48.4 | Very low | 188 Ų | 188 | 171.5 Ų | 171.5 | 87% | 0.87 | 83% | 0.834 | S | S | * | * | | | trans | -67.9 | 113.9 | 166 | -72.7 | -82.6 | 0 | 0 | 0 | 108.6 | R61 | R61-H63 PolarHBondContact O-N 3.29Š|
| 64 | R | 42.9 | Very low | 48.7 | Very low | 229 Ų | 229 | 168.4 Ų | 168.4 | 86% | 0.864 | 83% | 0.826 | S | S | * | * | | | trans | -81.7 | 132.5 | 165.4 | -91.8 | 179.3 | 173 | 156.6 | -3.2 | 108.3 | R62 | R62-R64 PolarHBondContact O-N 3.18Š|
| 65 | S | 44 | Very low | 48.7 | Very low | 112 Ų | 112 | 163.4 Ų | 163.4 | 78% | 0.783 | 82% | 0.818 | S | S | * | * | | | trans | -52.1 | 138.5 | -173.2 | 40.8 | 0 | 0 | 0 | 0 | 115 | S67 | S65-S67 PolarHBondContact O-N 2.9Š|
| 66 | S | 48.2 | Very low | 49.3 | Very low | 122 Ų | 122 | 161 Ų | 161 | 85% | 0.853 | 81% | 0.809 | S | S | * | * | | | trans | -50.6 | 114.7 | 161.2 | 173.8 | 0 | 0 | 0 | 0 | 110.9 | | |
| 67 | S | 46.9 | Very low | 49.7 | Very low | 102 Ų | 102 | 166.2 Ų | 166.2 | 71% | 0.713 | 81% | 0.813 | S | S | * | * | | | trans | -103.2 | 120.7 | 159.8 | 54 | 0 | 0 | 0 | 0 | 108 | S65 S69 | S65-S67 PolarHBondContact O-N 2.9Å; S67-S69 PolarHBondContact O-N 3.41Å |
| 68 | L | 54.1 | Low | 49.9 | Very low | 174 Ų | 174 | 159.8 Ų | 159.8 | 91% | 0.911 | 80% | 0.797 | S | S | * | * | | | trans | -39.2 | 123 | 178.3 | -68.3 | 128.1 | 0 | 0 | 0 | 112.4 | | |
| 69 | S | 42.6 | Very low | 49.9 | Very low | 99 Ų | 99 | 159.9 Ų | 159.9 | 69% | 0.692 | 79% | 0.793 | S | S | * | * | | | trans | -141.3 | 143.3 | 164.5 | -67.2 | 0 | 0 | 0 | 0 | 108.8 | S67 V71 | S67-S69 PolarHBondContact O-N 3.41Å; S69-V71 PolarHBondContact O-N 2.91Å |
| 70 | P | 49.3 | Very low | 49.6 | Very low | 126 Ų | 126 | 161.8 Ų | 161.8 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | | | trans | -59.8 | 129.4 | -160.3 | -24.9 | 35 | 0 | 0 | 0 | 112.9 | R72 | P70-R72 PolarHBondContact O-N 3.5Š|
| 71 | V | 45.9 | Very low | 49.8 | Very low | 139 Ų | 139 | 165.8 Ų | 165.8 | 84% | 0.842 | 79% | 0.791 | S | S | * | * | | | trans | -58.9 | 100.6 | 176.4 | -170.3 | 0 | 0 | 0 | 0 | 107.9 | S69 Q73 | S69-V71 PolarHBondContact O-N 2.91Å; V71-Q73 PolarHBondContact O-N 3.31Å; V71-Q73 VanDerWaalsContact O-N 3.09Å |
| 72 | R | 47 | Very low | 49.9 | Very low | 233 Ų | 233 | 162.6 Ų | 162.6 | 88% | 0.879 | 78% | 0.783 | S | S | * | * | | | trans | -60.3 | 114.2 | 167.6 | -92.3 | 179.4 | 168 | 170.4 | -3.6 | 107 | P70 K74 | P70-R72 PolarHBondContact O-N 3.5Å; R72-K74 PolarHBondContact O-N 3.15Å |
| 73 | Q | 53.7 | Low | 50.1 | Low | 158 Ų | 158 | 160.1 Ų | 160.1 | 74% | 0.738 | 78% | 0.782 | S | S | * | * | | | trans | -33.6 | 100 | 168.2 | -69.7 | -177.8 | -37.2 | 0 | 0 | 111.1 | V71 | V71-Q73 PolarHBondContact O-N 3.31Å; V71-Q73 VanDerWaalsContact O-N 3.09Å |
| 74 | K | 49.3 | Very low | 50.5 | Low | 167 Ų | 167 | 155 Ų | 155 | 73% | 0.726 | 77% | 0.772 | S | S | * | * | | | trans | -124.2 | 34.5 | 175.6 | -157.8 | -152.5 | 172.3 | -149.7 | 0 | 110.2 | R72 | R72-K74 PolarHBondContact O-N 3.15Š|
| 75 | D | 51.2 | Low | 51.1 | Low | 144 Ų | 144 | 152.6 Ų | 152.6 | 77% | 0.77 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -122.1 | 11.1 | 178.6 | -72.5 | -39.6 | 0 | 0 | 0 | 113.2 | | |
| 76 | R | 51.9 | Low | 51.4 | Low | 195 Ų | 195 | 154.5 Ų | 154.5 | 74% | 0.736 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -116.3 | 2.2 | 179 | -70.5 | -171.5 | -178.3 | 174.3 | -1 | 115.6 | | |
| 77 | R | 52.8 | Low | 51.8 | Low | 214 Ų | 214 | 157.7 Ų | 157.7 | 81% | 0.808 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -106.6 | -11.3 | -178.4 | -64.5 | -168.8 | -152.7 | -158.5 | 2.7 | 114.9 | | |
| 78 | D | 53.8 | Low | 51.9 | Low | 117 Ų | 117 | 158.7 Ų | 158.7 | 63% | 0.626 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -88.4 | -20.5 | 179.2 | -84.5 | -32.8 | 0 | 0 | 0 | 112.9 | | |
| 79 | D | 55.2 | Low | 51.7 | Low | 127 Ų | 127 | 153.9 Ų | 153.9 | 68% | 0.679 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -76.5 | -40.1 | 176.3 | -83.6 | -33 | 0 | 0 | 0 | 113.1 | R81 K82 | D79-R81 PolarHBondContact O-N 3.03Å; D79-R81 VanDerWaalsContact O-N 3.15Å; D79-K82 PolarHBondContact O-N 3.24Å |
| 80 | E | 55.5 | Low | 52.2 | Low | 159 Ų | 159 | 158.9 Ų | 158.9 | 74% | 0.743 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.1 | -16.3 | 178.9 | -70 | -178.6 | 168.8 | 0 | 0 | 113.5 | | |
| 81 | R | 57.4 | Low | 52.3 | Low | 209 Ų | 209 | 157.3 Ų | 157.3 | 79% | 0.789 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.6 | -9.3 | -177.8 | -149.6 | 172.4 | -172.7 | -105 | -1 | 113.3 | D79 | D79-R81 PolarHBondContact O-N 3.03Å; D79-R81 VanDerWaalsContact O-N 3.15Å |
| 82 | K | 53.7 | Low | 52.6 | Low | 170 Ų | 170 | 155.2 Ų | 155.2 | 74% | 0.739 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | -24.9 | 177.4 | -92.5 | -170 | 175 | -178.6 | 0 | 113.9 | D79 | D79-K82 PolarHBondContact O-N 3.24Š|
| 83 | E | 51.2 | Low | 53.1 | Low | 178 Ų | 178 | 152 Ų | 152 | 83% | 0.832 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -87 | -12.3 | -173.9 | -63.8 | -165.7 | 170.7 | 0 | 0 | 114.8 | K85 | E83-K85 PolarHBondContact O-N 2.75Š|
| 84 | A | 54.8 | Low | 53.1 | Low | 81 Ų | 81 | 146.4 Ų | 146.4 | 67% | 0.669 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -89.7 | 5.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | | |
| 85 | K | 55.4 | Low | 53.5 | Low | 179 Ų | 179 | 140.9 Ų | 140.9 | 78% | 0.778 | 70% | 0.701 | S | S | * | * | G | 310 helix | trans | -93.4 | -3.1 | -169.1 | -121.9 | -174.3 | -179.9 | -169.7 | 0 | 115.7 | E83 | E83-K85 PolarHBondContact O-N 2.75Š|
| 86 | D | 49.1 | Very low | 53.8 | Low | 152 Ų | 152 | 138.2 Ų | 138.2 | 81% | 0.813 | 70% | 0.699 | S | S | * | * | | | trans | -112.3 | 63.2 | 179.6 | -64.7 | -36.8 | 0 | 0 | 0 | 111 | | |
| 87 | K | 56.6 | Low | 54.2 | Low | 188 Ų | 188 | 136.1 Ų | 136.1 | 82% | 0.817 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -95.1 | 118.6 | 156.8 | -72.3 | -174.8 | -178.7 | 179.7 | 0 | 107.1 | G89 | K87-G89 PolarHBondContact O-N 2.9Š|
| 88 | P | 48.6 | Very low | 54.3 | Low | 124 Ų | 124 | 129 Ų | 129 | 81% | 0.805 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 125.8 | 176.8 | 24.5 | -32.2 | 0 | 0 | 0 | 108.3 | K90 | P88-K90 PolarHBondContact O-N 2.83Š|
| 89 | G | 50.5 | Low | 54.4 | Low | 73 Ų | 73 | 128.4 Ų | 128.4 | 75% | 0.753 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -51 | 129.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | K87 S91 | K87-G89 PolarHBondContact O-N 2.9Å; G89-S91 PolarHBondContact O-N 3.3Å |
| 90 | K | 53.8 | Low | 54.2 | Low | 203 Ų | 203 | 130.6 Ų | 130.6 | 88% | 0.883 | 68% | 0.676 | S | S | * | * | | | trans | -55.3 | 113.3 | 175.6 | -69.1 | 175.5 | 179.5 | 179.8 | 0 | 107.3 | P88 I92 | P88-K90 PolarHBondContact O-N 2.83Å; K90-I92 PolarHBondContact O-N 3.45Å; K90-I92 VanDerWaalsContact O-N 3.13Å |
| 91 | S | 50.7 | Low | 54.5 | Low | 93 Ų | 93 | 127 Ų | 127 | 65% | 0.65 | 68% | 0.681 | S | S | * | * | | | trans | -54.4 | 118.6 | 170.4 | 51.9 | 0 | 0 | 0 | 0 | 107.6 | G89 Q93 | G89-S91 PolarHBondContact O-N 3.3Å; S91-Q93 PolarHBondContact O-N 3.47Å |
| 92 | I | 52.8 | Low | 54.6 | Low | 96 Ų | 96 | 121.4 Ų | 121.4 | 49% | 0.492 | 66% | 0.663 | S | S | . | * | | | trans | -60.1 | 107.6 | 175.4 | -61.6 | 174.2 | 0 | 0 | 0 | 106.5 | K90 I94 | K90-I92 PolarHBondContact O-N 3.45Å; K90-I92 VanDerWaalsContact O-N 3.13Å; I92-I94 PolarHBondContact O-N 2.93Å |
| 93 | Q | 56.7 | Low | 55.4 | Low | 164 Ų | 164 | 117.1 Ų | 117.1 | 77% | 0.766 | 65% | 0.651 | S | S | * | * | | | trans | -78.8 | 107 | 174.1 | -65 | -176.3 | 2.2 | 0 | 0 | 106.5 | S91 S95 | S91-Q93 PolarHBondContact O-N 3.47Å; Q93-S95 PolarHBondContact O-N 2.79Å |
| 94 | I | 54.4 | Low | 56.3 | Low | 41 Ų | 41 | 116.5 Ų | 116.5 | 21% | 0.21 | 65% | 0.648 | C | S | . | * | | | trans | -71.9 | 121 | 170.6 | -61.3 | 168.6 | 0 | 0 | 0 | 106.1 | I92 D98 M99 K111 | I92-I94 PolarHBondContact O-N 2.93Å; I94-D98 HydrophobicContact CG2-CB 4.15Å; I94-M99 HydrophobicContact CG2-CG 4.36Å; I94-K111 HydrophobicContact CD1-CB 3.86Å; I94-K111 HydrophobicContact CD1-CD 3.81Å; I94-K111 HydrophobicContact CD1-CG 3.8Å |
| 95 | S | 57.3 | Low | 56.9 | Low | 51 Ų | 51 | 119.3 Ų | 119.3 | 36% | 0.357 | 65% | 0.648 | S | S | . | * | | | trans | -64 | 144.1 | 175.3 | 176.6 | 0 | 0 | 0 | 0 | 109.8 | Q93 E97 D98 | Q93-S95 PolarHBondContact O-N 2.79Å; S95-E97 PolarHBondContact O-N 2.86Å; S95-E97 PolarHBondContact OG-N 3.49Å; S95-E97 PolarHBondContact OG-OE2 3.15Å; S95-D98 PolarHBondContact O-N 3.24Å |
| 96 | A | 57.3 | Low | 57.5 | Low | 88 Ų | 88 | 115.1 Ų | 115.1 | 73% | 0.727 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.4 | -19 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 97 | E | 60.5 | Low | 58.5 | Low | 152 Ų | 152 | 109.2 Ų | 109.2 | 71% | 0.71 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | -28.4 | 176.7 | -67 | 162.5 | 162.6 | 0 | 0 | 112.6 | S95 M99 Q100 | S95-E97 PolarHBondContact O-N 2.86Å; S95-E97 PolarHBondContact OG-N 3.49Å; S95-E97 PolarHBondContact OG-OE2 3.15Å; E97-M99 VanDerWaalsContact C-N 3.33Å; E97-M99 PolarHBondContact O-N 3.15Å; E97-Q100 PolarHBondContact O-N 3.33Å |
| 98 | D | 55 | Low | 59.2 | Low | 63 Ų | 63 | 106.6 Ų | 106.6 | 34% | 0.337 | 59% | 0.59 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80.5 | -14 | -179.3 | -71.9 | -48.9 | 0 | 0 | 0 | 113.5 | I94 S95 | I94-D98 HydrophobicContact CG2-CB 4.15Å; S95-D98 PolarHBondContact O-N 3.24Å |
| 99 | M | 56.3 | Low | 60.2 | Low | 106 Ų | 106 | 106 Ų | 106 | 52% | 0.522 | 58% | 0.577 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.4 | -8.7 | 172.9 | -76.1 | -158.1 | -179.6 | 0 | 0 | 113.3 | I94 E97 G101 I107 | I94-M99 HydrophobicContact CG2-CG 4.36Å; E97-M99 VanDerWaalsContact C-N 3.33Å; E97-M99 PolarHBondContact O-N 3.15Å; M99-G101 PolarHBondContact O-N 3.24Å; M99-G101 VanDerWaalsContact O-N 3.17Å; M99-I107 HydrophobicContact CB-CD1 4.23Å; M99-I107 HydrophobicContact CE-CG2 4.09Å; M99-I107 HydrophobicContact CG-CD1 4.08Å; M99-I107 HydrophobicContact CG-CG2 4.32Å |
| 100 | Q | 50.8 | Low | 61 | Low | 172 Ų | 172 | 104.9 Ų | 104.9 | 80% | 0.804 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.1 | 97.5 | -172.3 | -143 | 168.8 | 18.3 | 0 | 0 | 110.7 | E97 | E97-Q100 PolarHBondContact O-N 3.33Š|
| 101 | G | 61.3 | Low | 61.8 | Low | 83 Ų | 83 | 102 Ų | 102 | 86% | 0.856 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 105.5 | 11 | 169.9 | 0 | 0 | 0 | 0 | 0 | 117 | M99 | M99-G101 PolarHBondContact O-N 3.24Å; M99-G101 VanDerWaalsContact O-N 3.17Å |
| 102 | K | 59.5 | Low | 62.5 | Low | 92 Ų | 92 | 105.6 Ų | 105.6 | 40% | 0.4 | 55% | 0.549 | S | S | . | . | S | Bend | trans | -112.8 | 150.5 | 175.2 | -69.1 | 174.1 | -175.1 | 165.9 | 0 | 110.9 | E106 I107 | K102-E106 HydrophobicContact CB-CB 4.18Å; K102-E106 WeakPolarHBondContact CB-OE2 3.43Å; K102-I107 HydrophobicContact CB-CG1 4.17Å |
| 103 | T | 72 | Confident | 63.1 | Low | 81 Ų | 81 | 108 Ų | 108 | 50% | 0.497 | 56% | 0.56 | S | S | . | * | | | trans | -68.9 | 155.1 | 178.6 | 60.7 | 0 | 0 | 0 | 0 | 110.7 | E105 E106 I107 | T103-E105 PolarHBondContact O-N 3.26Å; T103-E106 PolarHBondContact N-OE2 3.36Å; T103-E106 WeakPolarHBondContact O-CB 3.5Å; T103-E106 PolarHBondContact O-N 3.09Å; T103-E106 WeakPolarHBondContact OG1-CG 3.47Å; T103-I107 WeakPolarHBondContact O-CG1 3.32Å; T103-I107 PolarHBondContact O-N 3.48Å |
| 104 | E | 69.1 | Low | 63.6 | Low | 165 Ų | 165 | 101.6 Ų | 101.6 | 77% | 0.771 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -56.9 | -34.6 | -179.7 | -66.4 | 177.4 | 171.7 | 0 | 0 | 112 | I107 E108 | E104-I107 PolarHBondContact O-N 2.88Å; E104-E108 WeakPolarHBondContact O-CG 3.4Å; E104-E108 PolarHBondContact O-N 2.99Å |
| 105 | E | 67.6 | Low | 64.1 | Low | 139 Ų | 139 | 105.5 Ų | 105.5 | 65% | 0.65 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -66.4 | -37 | 175 | -61.1 | -175.2 | 165 | 0 | 0 | 112.8 | T103 M109 | T103-E105 PolarHBondContact O-N 3.26Å; E105-M109 HydrophobicContact CB-CE 4.06Å; E105-M109 VanDerWaalsContact O-CB 3.31Å; E105-M109 WeakPolarHBondContact O-CB 3.35Å; E105-M109 WeakPolarHBondContact O-CE 3.3Å; E105-M109 VanDerWaalsContact O-CG 3.25Å; E105-M109 WeakPolarHBondContact O-CG 3Å; E105-M109 PolarHBondContact O-N 3.35Å |
| 106 | E | 67.4 | Low | 64.5 | Low | 92 Ų | 92 | 103.2 Ų | 103.2 | 43% | 0.43 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -70.8 | -35.5 | 175.4 | -74.5 | 174.9 | 161.6 | 0 | 0 | 111.7 | K102 T103 M109 M110 | K102-E106 HydrophobicContact CB-CB 4.18Å; K102-E106 WeakPolarHBondContact CB-OE2 3.43Å; T103-E106 PolarHBondContact N-OE2 3.36Å; T103-E106 WeakPolarHBondContact O-CB 3.5Å; T103-E106 PolarHBondContact O-N 3.09Å; T103-E106 WeakPolarHBondContact OG1-CG 3.47Å; E106-M109 PolarHBondContact O-N 2.88Å; E106-M110 VanDerWaalsContact O-CB 3.3Å; E106-M110 WeakPolarHBondContact O-CB 3.34Å; E106-M110 WeakPolarHBondContact O-CG 3.24Å; E106-M110 PolarHBondContact O-N 3.22Å |
| 107 | I | 70.2 | Confident | 65 | Low | 27 Ų | 27 | 102.8 Ų | 102.8 | 14% | 0.138 | 53% | 0.53 | C | S | . | . | H | α-helix | trans | -69.1 | -40.5 | 175.6 | -64.4 | 165.7 | 0 | 0 | 0 | 110.3 | M99 K102 T103 E104 M110 K111 | M99-I107 HydrophobicContact CB-CD1 4.23Å; M99-I107 HydrophobicContact CE-CG2 4.09Å; M99-I107 HydrophobicContact CG-CD1 4.08Å; M99-I107 HydrophobicContact CG-CG2 4.32Å; K102-I107 HydrophobicContact CB-CG1 4.17Å; T103-I107 WeakPolarHBondContact O-CG1 3.32Å; T103-I107 PolarHBondContact O-N 3.48Å; E104-I107 PolarHBondContact O-N 2.88Å; I107-M110 PolarHBondContact O-N 3.37Å; I107-K111 VanDerWaalsContact O-CB 3.32Å; I107-K111 WeakPolarHBondContact O-CB 3.33Å; I107-K111 PolarHBondContact O-N 3.23Å |
| 108 | E | 72.2 | Confident | 65.7 | Low | 133 Ų | 133 | 105.3 Ų | 105.3 | 62% | 0.621 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.2 | -41.8 | 172.8 | -76.3 | -170.6 | 166.8 | 0 | 0 | 112 | E104 M110 K111 M112 | E104-E108 WeakPolarHBondContact O-CG 3.4Å; E104-E108 PolarHBondContact O-N 2.99Å; E108-M110 PolarHBondContact O-N 3.35Å; E108-K111 PolarHBondContact O-N 3.27Å; E108-M112 VanDerWaalsContact O-CB 3.24Å; E108-M112 WeakPolarHBondContact O-CB 3.31Å; E108-M112 WeakPolarHBondContact O-CG 3.44Å; E108-M112 PolarHBondContact O-N 3.42Å |
| 109 | M | 68.4 | Low | 66.7 | Low | 111 Ų | 111 | 108.2 Ų | 108.2 | 55% | 0.547 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.4 | -39.5 | 173.6 | -78.2 | -172.4 | -96.4 | 0 | 0 | 112.1 | E105 E106 K111 M112 M113 | E105-M109 HydrophobicContact CB-CE 4.06Å; E105-M109 VanDerWaalsContact O-CB 3.31Å; E105-M109 WeakPolarHBondContact O-CB 3.35Å; E105-M109 WeakPolarHBondContact O-CE 3.3Å; E105-M109 VanDerWaalsContact O-CG 3.25Å; E105-M109 WeakPolarHBondContact O-CG 3Å; E105-M109 PolarHBondContact O-N 3.35Å; E106-M109 PolarHBondContact O-N 2.88Å; M109-K111 VanDerWaalsContact C-N 3.35Å; M109-M112 PolarHBondContact O-N 3.22Å; M109-M113 VanDerWaalsContact O-CB 3.31Å; M109-M113 WeakPolarHBondContact O-CB 3.18Å; M109-M113 WeakPolarHBondContact O-CG 3.44Å; M109-M113 PolarHBondContact O-N 3.25Å |
| 110 | M | 68.6 | Low | 67.8 | Low | 50 Ų | 50 | 106.7 Ų | 106.7 | 25% | 0.246 | 55% | 0.554 | C | S | . | * | H | α-helix | trans | -64.9 | -38.8 | 174 | -71.1 | -95.2 | -74.4 | 0 | 0 | 111.4 | E106 I107 E108 G114 F115 | E106-M110 VanDerWaalsContact O-CB 3.3Å; E106-M110 WeakPolarHBondContact O-CB 3.34Å; E106-M110 WeakPolarHBondContact O-CG 3.24Å; E106-M110 PolarHBondContact O-N 3.22Å; I107-M110 PolarHBondContact O-N 3.37Å; E108-M110 PolarHBondContact O-N 3.35Å; M110-G114 CarbonylContact O-C 3.43Å; M110-G114 WeakPolarHBondContact O-CA 3.06Å; M110-G114 PolarHBondContact O-N 3.27Å; M110-F115 HydrophobicContact CB-CB 4.34Å; M110-F115 HydrophobicContact CE-CB 4.19Å; M110-F115 WeakPolarHBondContact CE-O 3.37Å; M110-F115 PolarHBondContact O-N 3.47Å; M110-F115 HydrophobicContact SD-CB 3.55Å; M110-F115 VanDerWaalsContact SD-CB 3.55Å; M110-F115 HydrophobicContact SD-CG 4.4Å |
| 111 | K | 69.3 | Low | 69.3 | Low | 143 Ų | 143 | 103.2 Ų | 103.2 | 62% | 0.622 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -71.2 | -40.7 | 176.9 | -168.8 | 172.8 | -175.2 | -179 | 0 | 112.5 | I94 I107 E108 M109 G114 | I94-K111 HydrophobicContact CD1-CB 3.86Å; I94-K111 HydrophobicContact CD1-CD 3.81Å; I94-K111 HydrophobicContact CD1-CG 3.8Å; I107-K111 VanDerWaalsContact O-CB 3.32Å; I107-K111 WeakPolarHBondContact O-CB 3.33Å; I107-K111 PolarHBondContact O-N 3.23Å; E108-K111 PolarHBondContact O-N 3.27Å; M109-K111 VanDerWaalsContact C-N 3.35Å; K111-G114 PolarHBondContact O-N 3.44Å |
| 112 | M | 65.1 | Low | 70.2 | Confident | 169 Ų | 169 | 108.2 Ų | 108.2 | 83% | 0.833 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -65.4 | -40.4 | 177.2 | -74.3 | -94.3 | -79.1 | 0 | 0 | 111.9 | E108 M109 | E108-M112 VanDerWaalsContact O-CB 3.24Å; E108-M112 WeakPolarHBondContact O-CB 3.31Å; E108-M112 WeakPolarHBondContact O-CG 3.44Å; E108-M112 PolarHBondContact O-N 3.42Å; M109-M112 PolarHBondContact O-N 3.22Å |
| 113 | M | 67.1 | Low | 71.3 | Confident | 147 Ų | 147 | 108 Ų | 108 | 72% | 0.724 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -86.2 | -7.7 | 176.5 | -64.7 | -69.6 | -177 | 0 | 0 | 113.2 | M109 F115 | M109-M113 VanDerWaalsContact O-CB 3.31Å; M109-M113 WeakPolarHBondContact O-CB 3.18Å; M109-M113 WeakPolarHBondContact O-CG 3.44Å; M109-M113 PolarHBondContact O-N 3.25Å; M113-F115 HydrophobicContact CB-CD2 3.42Å; M113-F115 VanDerWaalsContact CB-CD2 3.42Å; M113-F115 HydrophobicContact CB-CE2 3.41Å; M113-F115 VanDerWaalsContact CB-CE2 3.41Å; M113-F115 HydrophobicContact CB-CG 4.5Å; M113-F115 HydrophobicContact CB-CZ 4.48Å; M113-F115 HydrophobicContact CG-CD2 4.44Å; M113-F115 HydrophobicContact CG-CE2 4.18Å |
| 114 | G | 67.4 | Low | 72 | Confident | 29 Ų | 29 | 110.1 Ų | 110.1 | 30% | 0.299 | 57% | 0.57 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 80.5 | 15.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | M110 K111 G116 | M110-G114 CarbonylContact O-C 3.43Å; M110-G114 WeakPolarHBondContact O-CA 3.06Å; M110-G114 PolarHBondContact O-N 3.27Å; K111-G114 PolarHBondContact O-N 3.44Å; G114-G116 PolarHBondContact O-N 2.76Å |
| 115 | F | 64.5 | Low | 72.6 | Confident | 122 Ų | 122 | 111.1 Ų | 111.1 | 54% | 0.535 | 57% | 0.571 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78.9 | 38.8 | 179.5 | -64.4 | -62.6 | 0 | 0 | 0 | 114.1 | M110 M113 | M110-F115 HydrophobicContact CB-CB 4.34Å; M110-F115 HydrophobicContact CE-CB 4.19Å; M110-F115 WeakPolarHBondContact CE-O 3.37Å; M110-F115 PolarHBondContact O-N 3.47Å; M110-F115 HydrophobicContact SD-CB 3.55Å; M110-F115 VanDerWaalsContact SD-CB 3.55Å; M110-F115 HydrophobicContact SD-CG 4.4Å; M113-F115 HydrophobicContact CB-CD2 3.42Å; M113-F115 VanDerWaalsContact CB-CD2 3.42Å; M113-F115 HydrophobicContact CB-CE2 3.41Å; M113-F115 VanDerWaalsContact CB-CE2 3.41Å; M113-F115 HydrophobicContact CB-CG 4.5Å; M113-F115 HydrophobicContact CB-CZ 4.48Å; M113-F115 HydrophobicContact CG-CD2 4.44Å; M113-F115 HydrophobicContact CG-CE2 4.18Å |
| 116 | G | 65 | Low | 73.4 | Confident | 4 Ų | 4 | 106.6 Ų | 106.6 | 4% | 0.041 | 55% | 0.554 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -92.2 | -12.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | G114 | G114-G116 PolarHBondContact O-N 2.76Š|
| 117 | S | 68.6 | Low | 74.1 | Confident | 78 Ų | 78 | 109.6 Ų | 109.6 | 55% | 0.545 | 57% | 0.573 | S | S | . | * | S | Bend | trans | -162.6 | 133.7 | 175.8 | -163.1 | 0 | 0 | 0 | 0 | 110.5 | D119 | S117-D119 PolarHBondContact O-N 3.34Š|
| 118 | F | 75.4 | Confident | 74.7 | Confident | 205 Ų | 205 | 111.9 Ų | 111.9 | 90% | 0.899 | 60% | 0.603 | S | S | * | * | | | trans | -87.1 | 90.2 | -179.2 | -131.2 | -85.3 | 0 | 0 | 0 | 110.6 | | |
| 119 | D | 74.5 | Confident | 75 | Confident | 125 Ų | 125 | 110.3 Ų | 110.3 | 67% | 0.668 | 61% | 0.607 | S | S | * | * | | | trans | -79.7 | 127.1 | 175.7 | -90.8 | -47 | 0 | 0 | 0 | 112 | S117 K124 | S117-D119 PolarHBondContact O-N 3.34Å; D119-K124 IonicContact OD1-NZ 3.94Å |
| 120 | S | 80 | Confident | 75.7 | Confident | 74 Ų | 74 | 109.9 Ų | 109.9 | 52% | 0.517 | 61% | 0.61 | S | S | . | * | | | trans | -82.4 | 132.4 | 169.1 | -170 | 0 | 0 | 0 | 0 | 111.3 | K122 K124 | S120-K122 PolarHBondContact OG-N 3.49Å; S120-K124 WeakPolarHBondContact O-CD 3.25Å; S120-K124 WeakPolarHBondContact O-CE 3.31Å; S120-K124 PolarHBondContact O-NZ 2.97Å; S120-K124 VanDerWaalsContact O-NZ 3.15Å |
| 121 | T | 81.9 | Confident | 76.2 | Confident | 98 Ų | 98 | 112.3 Ų | 112.3 | 60% | 0.601 | 62% | 0.624 | S | S | * | * | | | trans | -91.2 | -4.9 | 172.5 | 57.2 | 0 | 0 | 0 | 0 | 112.9 | G123 K124 T126 | T121-G123 PolarHBondContact O-N 3.34Å; T121-K124 PolarHBondContact O-N 2.73Å; T121-K124 VanDerWaalsContact O-N 3.15Å; T121-T126 HydrophobicContact CG2-CG2 4.12Å |
| 122 | K | 81.3 | Confident | 77 | Confident | 188 Ų | 188 | 109.3 Ų | 109.3 | 82% | 0.817 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.1 | 120.6 | -179.9 | -171.9 | 178 | -179.4 | -179.2 | 0 | 110.1 | S120 K124 | S120-K122 PolarHBondContact OG-N 3.49Å; K122-K124 PolarHBondContact O-N 2.88Å |
| 123 | G | 82.1 | Confident | 78.1 | Confident | 89 Ų | 89 | 111 Ų | 111 | 92% | 0.918 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 76.5 | 0.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | T121 | T121-G123 PolarHBondContact O-N 3.34Š|
| 124 | K | 85.5 | Confident | 79.2 | Confident | 125 Ų | 125 | 108.9 Ų | 108.9 | 54% | 0.543 | 63% | 0.63 | S | S | . | * | S | Bend | trans | -100 | 137.6 | 174.2 | -62.8 | -177.5 | -170.8 | 161.3 | 0 | 109.7 | D119 S120 T121 K122 T126 | D119-K124 IonicContact OD1-NZ 3.94Å; S120-K124 WeakPolarHBondContact O-CD 3.25Å; S120-K124 WeakPolarHBondContact O-CE 3.31Å; S120-K124 PolarHBondContact O-NZ 2.97Å; S120-K124 VanDerWaalsContact O-NZ 3.15Å; T121-K124 PolarHBondContact O-N 2.73Å; T121-K124 VanDerWaalsContact O-N 3.15Å; K122-K124 PolarHBondContact O-N 2.88Å; K124-T126 PolarHBondContact O-N 3.12Å |
| 125 | K | 81.7 | Confident | 80.4 | Confident | 185 Ų | 185 | 112.8 Ų | 112.8 | 80% | 0.804 | 65% | 0.648 | S | S | * | * | | | trans | -71.5 | 115.3 | 172.1 | -175.4 | -179.9 | 177.6 | -176.3 | 0 | 108.4 | | |
| 126 | T | 85.1 | Confident | 81.7 | Confident | 45 Ų | 45 | 114 Ų | 114 | 28% | 0.276 | 66% | 0.66 | S | S | . | * | | | trans | -81.6 | 139 | 175.6 | 47 | 0 | 0 | 0 | 0 | 110.6 | T121 K124 V130 | T121-T126 HydrophobicContact CG2-CG2 4.12Å; K124-T126 PolarHBondContact O-N 3.12Å; T126-V130 WeakPolarHBondContact OG1-CB 3.44Å; T126-V130 WeakPolarHBondContact OG1-CG1 3.18Å |
| 127 | D | 82.4 | Confident | 83 | Confident | 155 Ų | 155 | 118.8 Ų | 118.8 | 83% | 0.829 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -73.1 | 153.4 | 176.4 | -67.4 | -44.2 | 0 | 0 | 0 | 111 | | |
| 128 | G | 82.9 | Confident | 84.1 | Confident | 75 Ų | 75 | 120.8 Ų | 120.8 | 77% | 0.773 | 70% | 0.697 | S | S | * | * | S | Bend | trans | 99.4 | -157.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | V130 | G128-V130 VanDerWaalsContact C-N 3.3Å; G128-V130 PolarHBondContact O-N 3.13Å |
| 129 | S | 77.9 | Confident | 84.9 | Confident | 100 Ų | 100 | 119.1 Ų | 119.1 | 70% | 0.699 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -90.5 | 15.2 | -176.8 | 60.8 | 0 | 0 | 0 | 0 | 113.8 | N131 A132 | S129-N131 PolarHBondContact O-N 3.45Å; S129-A132 WeakPolarHBondContact O-CB 3.45Å; S129-A132 PolarHBondContact O-N 3.39Å |
| 130 | V | 82.6 | Confident | 85.7 | Confident | 101 Ų | 101 | 122.6 Ų | 122.6 | 61% | 0.612 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.2 | -34.4 | -175.7 | -176 | 0 | 0 | 0 | 0 | 111.6 | T126 G128 | T126-V130 WeakPolarHBondContact OG1-CB 3.44Å; T126-V130 WeakPolarHBondContact OG1-CG1 3.18Å; G128-V130 VanDerWaalsContact C-N 3.3Å; G128-V130 PolarHBondContact O-N 3.13Å |
| 131 | N | 80.5 | Confident | 86.2 | Confident | 102 Ų | 102 | 128.9 Ų | 128.9 | 55% | 0.545 | 72% | 0.716 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -101 | 25.5 | 177.3 | -62.4 | -53.2 | 0 | 0 | 0 | 112.9 | S129 Y133 | S129-N131 PolarHBondContact O-N 3.45Å; N131-Y133 WeakPolarHBondContact O-CD1 3.42Å; N131-Y133 PolarHBondContact O-N 3.37Å |
| 132 | A | 86.3 | Confident | 86.6 | Confident | 80 Ų | 80 | 132.1 Ų | 132.1 | 66% | 0.661 | 72% | 0.722 | S | S | * | * | | | trans | -74.4 | 110.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | S129 | S129-A132 WeakPolarHBondContact O-CB 3.45Å; S129-A132 PolarHBondContact O-N 3.39Å |
| 133 | Y | 87.7 | Confident | 87 | Confident | 205 Ų | 205 | 130 Ų | 130 | 80% | 0.804 | 71% | 0.709 | S | S | * | * | | | trans | -125.2 | 145.7 | 171.7 | 68.4 | -86 | 0 | 0 | 0 | 110.3 | N131 V135 | N131-Y133 WeakPolarHBondContact O-CD1 3.42Å; N131-Y133 PolarHBondContact O-N 3.37Å; Y133-V135 HydrophobicContact CD2-CG2 4.21Å |
| 134 | A | 90.4 | Very high | 87.4 | Confident | 102 Ų | 102 | 130.9 Ų | 130.9 | 84% | 0.843 | 69% | 0.685 | S | S | * | * | | | trans | -133.8 | 130.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | | |
| 135 | V | 92.4 | Very high | 87.6 | Confident | 111 Ų | 111 | 128.7 Ų | 128.7 | 67% | 0.673 | 68% | 0.677 | S | S | * | * | | | trans | -114.4 | 121.3 | 178.9 | -171 | 0 | 0 | 0 | 0 | 108.8 | Y133 V137 | Y133-V135 HydrophobicContact CD2-CG2 4.21Å; V135-V137 HydrophobicContact CG1-CG2 3.52Å |
| 136 | N | 91.8 | Very high | 87.9 | Confident | 146 Ų | 146 | 127.6 Ų | 127.6 | 78% | 0.781 | 67% | 0.669 | S | S | * | * | | | trans | -101.7 | 95.2 | 171.5 | -175.1 | -1.3 | 0 | 0 | 0 | 109.5 | | |
| 137 | V | 92.8 | Very high | 88.1 | Confident | 105 Ų | 105 | 132.6 Ų | 132.6 | 64% | 0.636 | 69% | 0.691 | S | S | * | * | | | trans | -92.3 | 114.7 | 177.3 | -173.4 | 0 | 0 | 0 | 0 | 109.7 | V135 M139 | V135-V137 HydrophobicContact CG1-CG2 3.52Å; V137-M139 HydrophobicContact CG1-CG 4.31Å |
| 138 | T | 91.1 | Very high | 88.3 | Confident | 121 Ų | 121 | 132.8 Ų | 132.8 | 74% | 0.742 | 69% | 0.692 | S | S | * | * | | | trans | -107.2 | 108.1 | 170.9 | 51.4 | 0 | 0 | 0 | 0 | 109.7 | | |
| 139 | M | 92.8 | Very high | 88.7 | Confident | 169 Ų | 169 | 131.3 Ų | 131.3 | 83% | 0.833 | 66% | 0.663 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 134 | 174.7 | -67.9 | -174.2 | 167.5 | 0 | 0 | 110.2 | V137 R141 | V137-M139 HydrophobicContact CG1-CG 4.31Å; M139-R141 PolarHBondContact O-N 3.38Å |
| 140 | K | 90.7 | Very high | 88.8 | Confident | 198 Ų | 198 | 136 Ų | 136 | 86% | 0.861 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 134 | 172.7 | -70.8 | -175.7 | 179.4 | 180 | 0 | 109.5 | K142 | K140-K142 PolarHBondContact O-N 3.22Š|
| 141 | R | 90.6 | Very high | 88.9 | Confident | 206 Ų | 206 | 133.6 Ų | 133.6 | 78% | 0.777 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 123.9 | 173.2 | -71 | -176.6 | 175.6 | 159.1 | -0.4 | 108.9 | M139 Y143 | M139-R141 PolarHBondContact O-N 3.38Å; R141-Y143 HydrophobicContact CB-CE2 4.25Å |
| 142 | K | 90.3 | Very high | 89.1 | Confident | 167 Ų | 167 | 131.1 Ų | 131.1 | 73% | 0.726 | 67% | 0.665 | S | S | * | * | | | trans | -90 | 109.9 | 172 | -64.2 | -175.2 | -178.8 | -178.2 | 0 | 108.3 | K140 F159 | K140-K142 PolarHBondContact O-N 3.22Å; K142-F159 HydrophobicContact CB-CD1 3.79Å; K142-F159 HydrophobicContact CB-CE1 3.88Å; K142-F159 HydrophobicContact CD-CD1 4.29Å; K142-F159 HydrophobicContact CD-CE1 4.03Å |
| 143 | Y | 90.5 | Very high | 88.8 | Confident | 143 Ų | 143 | 136.5 Ų | 136.5 | 56% | 0.561 | 67% | 0.674 | S | S | * | * | | | trans | -81.6 | 156 | 177.1 | -64.4 | -74.5 | 0 | 0 | 0 | 110.9 | R141 F159 I160 | R141-Y143 HydrophobicContact CB-CE2 4.25Å; Y143-F159 WeakPolarHBondContact O-CA 3.49Å; Y143-I160 PolarHBondContact O-N 3Å |
| 144 | R | 90.4 | Very high | 88.7 | Confident | 107 Ų | 107 | 134.1 Ų | 134.1 | 40% | 0.404 | 68% | 0.675 | S | S | . | * | B | Isolated β-bridge | trans | -122.6 | 135.3 | -176.9 | -65.7 | 178.6 | 86.5 | -148.7 | -0.7 | 109.1 | Y146 L157 D158 I160 | R144-Y146 HydrophobicContact CB-CE2 4.18Å; R144-Y146 VanDerWaalsContact O-CD2 3.27Å; R144-Y146 WeakPolarHBondContact O-CD2 3.29Å; R144-L157 HydrophobicContact CB-CB 3.67Å; R144-L157 HydrophobicContact CB-CD1 3.53Å; R144-L157 HydrophobicContact CB-CG 4.23Å; R144-L157 HydrophobicContact CG-CB 4.2Å; R144-L157 HydrophobicContact CG-CD1 4.24Å; R144-L157 VanDerWaalsContact CZ-CG 3.47Å; R144-L157 VanDerWaalsContact NH1-CD1 3.26Å; R144-D158 CarbonylContact C-O 3.55Å; R144-D158 VanDerWaalsContact CA-O 3.29Å; R144-D158 WeakPolarHBondContact CA-O 3.45Å; R144-I160 WeakPolarHBondContact O-CD1 2.89Å |
| 145 | Q | 89 | Confident | 88.6 | Confident | 80 Ų | 80 | 136.9 Ų | 136.9 | 37% | 0.374 | 66% | 0.664 | S | S | . | * | | | trans | -80 | 125.4 | 177.6 | -171.9 | 173.1 | -10.4 | 0 | 0 | 109.3 | M147 R149 L157 D158 I160 | Q145-M147 WeakPolarHBondContact CG-O 3.25Å; Q145-M147 PolarHBondContact NE2-O 3.22Å; Q145-R149 HydrophobicContact CG-CG 4.23Å; Q145-R149 WeakPolarHBondContact O-CD 3.36Å; Q145-R149 WeakPolarHBondContact O-CG 3.37Å; Q145-R149 PolarHBondContact O-NE 3.38Å; Q145-L157 VanDerWaalsContact O-CD2 3.29Å; Q145-L157 WeakPolarHBondContact O-CD2 3.48Å; Q145-D158 PolarHBondContact N-O 3.4Å; Q145-I160 HydrophobicContact CB-CD1 4.22Å; Q145-I160 HydrophobicContact CB-CG1 3.79Å |
| 146 | Y | 88.1 | Confident | 88.4 | Confident | 162 Ų | 162 | 136.4 Ų | 136.4 | 64% | 0.635 | 66% | 0.663 | S | S | * | * | | | trans | -103.5 | -36.1 | 177.7 | -74.6 | -92.3 | 0 | 0 | 0 | 112.7 | R144 R149 L157 | R144-Y146 HydrophobicContact CB-CE2 4.18Å; R144-Y146 VanDerWaalsContact O-CD2 3.27Å; R144-Y146 WeakPolarHBondContact O-CD2 3.29Å; Y146-R149 VanDerWaalsContact O-CD 3.26Å; Y146-R149 WeakPolarHBondContact O-CD 3.29Å; Y146-L157 HydrophobicContact CD1-CD1 3.79Å; Y146-L157 HydrophobicContact CD1-CD2 3.79Å; Y146-L157 HydrophobicContact CD2-CD1 4.16Å; Y146-L157 HydrophobicContact CE1-CD1 3.23Å; Y146-L157 HydrophobicContact CE1-CD2 4Å; Y146-L157 HydrophobicContact CE1-CG 4.3Å; Y146-L157 HydrophobicContact CE2-CD1 3.65Å; Y146-L157 HydrophobicContact CG-CD1 4.23Å; Y146-L157 HydrophobicContact CG-CD2 4.24Å; Y146-L157 WeakPolarHBondContact OH-CD1 3.04Å |
| 147 | M | 89.4 | Confident | 88.1 | Confident | 149 Ų | 149 | 130.4 Ų | 130.4 | 73% | 0.734 | 63% | 0.63 | S | S | * | * | S | Bend | trans | -96 | 147 | -173.7 | -62.6 | -58.9 | -176.1 | 0 | 0 | 111.8 | Q145 R149 | Q145-M147 WeakPolarHBondContact CG-O 3.25Å; Q145-M147 PolarHBondContact NE2-O 3.22Å; M147-R149 PolarHBondContact O-N 3.43Å |
| 148 | N | 86.9 | Confident | 87.7 | Confident | 159 Ų | 159 | 129.2 Ų | 129.2 | 85% | 0.85 | 62% | 0.621 | S | S | * | * | S | Bend | trans | 51.5 | 40.9 | 175.8 | -57.1 | -21.7 | 0 | 0 | 0 | 113.4 | | |
| 149 | R | 90 | Very high | 87.1 | Confident | 44 Ų | 44 | 130.1 Ų | 130.1 | 17% | 0.166 | 61% | 0.614 | C | S | . | * | | | trans | -82.1 | 136.9 | 179.8 | -58.2 | 167.9 | 64.9 | -148.5 | -10.2 | 110.7 | Q145 Y146 M147 G151 R155 P156 L157 | Q145-R149 HydrophobicContact CG-CG 4.23Å; Q145-R149 WeakPolarHBondContact O-CD 3.36Å; Q145-R149 WeakPolarHBondContact O-CG 3.37Å; Q145-R149 PolarHBondContact O-NE 3.38Å; Y146-R149 VanDerWaalsContact O-CD 3.26Å; Y146-R149 WeakPolarHBondContact O-CD 3.29Å; M147-R149 PolarHBondContact O-N 3.43Å; R149-G151 PolarHBondContact O-N 3.15Å; R149-R155 PolarHBondContact NH1-O 3.31Å; R149-R155 PolarHBondContact NH2-O 3.42Å; R149-P156 PolarHBondContact NH2-O 2.96Å; R149-L157 VanDerWaalsContact NH2-CA 3.29Å |
| 150 | K | 81.4 | Confident | 86.3 | Confident | 199 Ų | 199 | 126.4 Ų | 126.4 | 87% | 0.865 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | 120.6 | 170.8 | -76.8 | -169.9 | 173.8 | -177.4 | 0 | 109.6 | | |
| 151 | G | 84.4 | Confident | 85.3 | Confident | 51 Ų | 51 | 125 Ų | 125 | 53% | 0.526 | 62% | 0.622 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 116.8 | 19 | 169.2 | 0 | 0 | 0 | 0 | 0 | 117.4 | R149 R155 | R149-G151 PolarHBondContact O-N 3.15Å; G151-R155 WeakPolarHBondContact O-CD 3.26Å; G151-R155 VanDerWaalsContact O-CG 3.25Å; G151-R155 WeakPolarHBondContact O-CG 3.27Å |
| 152 | G | 83.1 | Confident | 85 | Confident | 50 Ų | 50 | 121 Ų | 121 | 52% | 0.515 | 62% | 0.615 | S | S | . | * | | | trans | 75.9 | 175.4 | 169.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | N154 | G152-N154 PolarHBondContact O-N 3.21Š|
| 153 | F | 81.9 | Confident | 84.7 | Confident | 193 Ų | 193 | 118.5 Ų | 118.5 | 85% | 0.846 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.2 | -32.2 | -165.2 | -170.2 | -107.2 | 0 | 0 | 0 | 114.1 | R155 | F153-R155 VanDerWaalsContact C-N 3.33Å; F153-R155 PolarHBondContact O-N 3.43Å |
| 154 | N | 84.5 | Confident | 84.4 | Confident | 155 Ų | 155 | 117.2 Ų | 117.2 | 83% | 0.829 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | 15.8 | -173.5 | -69 | 10.8 | 0 | 0 | 0 | 114.6 | G152 | G152-N154 PolarHBondContact O-N 3.21Š|
| 155 | R | 88 | Confident | 84 | Confident | 160 Ų | 160 | 117.8 Ų | 117.8 | 60% | 0.604 | 62% | 0.624 | S | S | * | * | S | Bend | trans | -95.9 | 153 | 174.2 | -76.6 | -177.7 | 84.5 | 92.1 | -4.9 | 112.3 | R149 G151 F153 L157 | R149-R155 PolarHBondContact NH1-O 3.31Å; R149-R155 PolarHBondContact NH2-O 3.42Å; G151-R155 WeakPolarHBondContact O-CD 3.26Å; G151-R155 VanDerWaalsContact O-CG 3.25Å; G151-R155 WeakPolarHBondContact O-CG 3.27Å; F153-R155 VanDerWaalsContact C-N 3.33Å; F153-R155 PolarHBondContact O-N 3.43Å; R155-L157 PolarHBondContact O-N 3.42Å |
| 156 | P | 88.1 | Confident | 83.7 | Confident | 100 Ų | 100 | 120.1 Ų | 120.1 | 65% | 0.649 | 64% | 0.639 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 134.7 | 174.2 | 25.9 | -34.2 | 0 | 0 | 0 | 111.5 | R149 | R149-P156 PolarHBondContact NH2-O 2.96Š|
| 157 | L | 86.4 | Confident | 83.4 | Confident | 20 Ų | 20 | 117.3 Ų | 117.3 | 11% | 0.105 | 64% | 0.64 | C | S | . | * | P | Polyproline II helix | trans | -65.2 | 135.4 | 179.3 | -48 | 167.6 | 0 | 0 | 0 | 111 | R144 Q145 Y146 R149 R155 | R144-L157 HydrophobicContact CB-CB 3.67Å; R144-L157 HydrophobicContact CB-CD1 3.53Å; R144-L157 HydrophobicContact CB-CG 4.23Å; R144-L157 HydrophobicContact CG-CB 4.2Å; R144-L157 HydrophobicContact CG-CD1 4.24Å; R144-L157 VanDerWaalsContact CZ-CG 3.47Å; R144-L157 VanDerWaalsContact NH1-CD1 3.26Å; Q145-L157 VanDerWaalsContact O-CD2 3.29Å; Q145-L157 WeakPolarHBondContact O-CD2 3.48Å; Y146-L157 HydrophobicContact CD1-CD1 3.79Å; Y146-L157 HydrophobicContact CD1-CD2 3.79Å; Y146-L157 HydrophobicContact CD2-CD1 4.16Å; Y146-L157 HydrophobicContact CE1-CD1 3.23Å; Y146-L157 HydrophobicContact CE1-CD2 4Å; Y146-L157 HydrophobicContact CE1-CG 4.3Å; Y146-L157 HydrophobicContact CE2-CD1 3.65Å; Y146-L157 HydrophobicContact CG-CD1 4.23Å; Y146-L157 HydrophobicContact CG-CD2 4.24Å; Y146-L157 WeakPolarHBondContact OH-CD1 3.04Å; R149-L157 VanDerWaalsContact NH2-CA 3.29Å; R155-L157 PolarHBondContact O-N 3.42Å |
| 158 | D | 84.3 | Confident | 83 | Confident | 81 Ų | 81 | 115.1 Ų | 115.1 | 43% | 0.433 | 63% | 0.633 | S | S | . | * | P | Polyproline II helix | trans | -70.1 | 142.3 | 176.9 | -56.3 | -41.3 | 0 | 0 | 0 | 110 | R144 Q145 | R144-D158 CarbonylContact C-O 3.55Å; R144-D158 VanDerWaalsContact CA-O 3.29Å; R144-D158 WeakPolarHBondContact CA-O 3.45Å; Q145-D158 PolarHBondContact N-O 3.4Å |
| 159 | F | 79.4 | Confident | 82.7 | Confident | 139 Ų | 139 | 111.7 Ų | 111.7 | 61% | 0.61 | 62% | 0.616 | S | S | * | * | B | Isolated β-bridge | trans | -70.9 | 130.8 | 171.7 | -65.9 | -71.3 | 0 | 0 | 0 | 109.1 | K142 Y143 A161 | K142-F159 HydrophobicContact CB-CD1 3.79Å; K142-F159 HydrophobicContact CB-CE1 3.88Å; K142-F159 HydrophobicContact CD-CD1 4.29Å; K142-F159 HydrophobicContact CD-CE1 4.03Å; Y143-F159 WeakPolarHBondContact O-CA 3.49Å; F159-A161 PolarHBondContact O-N 3.45Å |
| 160 | I | 75.2 | Confident | 82.1 | Confident | 92 Ų | 92 | 117.3 Ų | 117.3 | 47% | 0.472 | 65% | 0.654 | S | S | . | * | P | Polyproline II helix | trans | -76.5 | 118.3 | 172.8 | -60.3 | 167.9 | 0 | 0 | 0 | 106.5 | Y143 R144 Q145 | Y143-I160 PolarHBondContact O-N 3Å; R144-I160 WeakPolarHBondContact O-CD1 2.89Å; Q145-I160 HydrophobicContact CB-CD1 4.22Å; Q145-I160 HydrophobicContact CB-CG1 3.79Å |
| 161 | A | 68.7 | Low | 82.2 | Confident | 168 Ų | 168 | 109.9 Ų | 109.9 | 100% | 1.388 | 63% | 0.634 | S | S | * | * | | | trans | -72 | 0 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | F159 | F159-A161 PolarHBondContact O-N 3.45Š|