| 1 | M | 28.6 | Very low | 27.8 | Very low | 232 Ų | 232 | 168.8 Ų | 168.8 | 100% | 1.143 | 86% | 0.859 | S | S | * | * | | | | 0 | 104.2 | 0 | -63.1 | -147.5 | -127.3 | 0 | 0 | 108.6 | | |
| 2 | P | 27.5 | Very low | 28.5 | Very low | 131 Ų | 131 | 168.3 Ų | 168.3 | 85% | 0.851 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -97.6 | 136.4 | 171.5 | 32.8 | -22.5 | 0 | 0 | 0 | 110.8 | | |
| 3 | F | 24.7 | Very low | 29 | Very low | 199 Ų | 199 | 164.8 Ų | 164.8 | 87% | 0.873 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 139.2 | -175.8 | -81.4 | -101.6 | 0 | 0 | 0 | 112.5 | | |
| 4 | C | 22.3 | Very low | 29.1 | Very low | 125 Ų | 125 | 157.8 Ų | 157.8 | 85% | 0.845 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -82.7 | 132.1 | 163.3 | -70.1 | 0 | 0 | 0 | 0 | 110.8 | | |
| 5 | L | 28.6 | Very low | 29.4 | Very low | 163 Ų | 163 | 161.9 Ų | 161.9 | 85% | 0.853 | 82% | 0.823 | S | S | * | * | | | trans | -139 | 95.8 | 158.5 | -84.2 | 166.7 | 0 | 0 | 0 | 107.1 | | |
| 6 | K | 27 | Very low | 29.6 | Very low | 193 Ų | 193 | 159.6 Ų | 159.6 | 84% | 0.839 | 81% | 0.814 | S | S | * | * | | | | 82.7 | 106.9 | 88.4 | -146.3 | 175.7 | -167.2 | -180 | 0 | 111.9 | | |
| 7 | E | 26.7 | Very low | 29.9 | Very low | 193 Ų | 193 | 156.3 Ų | 156.3 | 90% | 0.902 | 80% | 0.803 | S | S | * | * | | | trans | -45 | 129.9 | 171.1 | -68.8 | 169.6 | 125.3 | 0 | 0 | 112.1 | | |
| 8 | A | 27.9 | Very low | 30 | Very low | 99 Ų | 99 | 155.8 Ų | 155.8 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | | | trans | -118.7 | 102.5 | 159.8 | 0 | 0 | 0 | 0 | 0 | 108 | | |
| 9 | R | 26.4 | Very low | 30.2 | Very low | 220 Ų | 220 | 156 Ų | 156 | 83% | 0.83 | 79% | 0.793 | S | S | * | * | | | trans | -50.7 | 130.5 | 166.4 | -71.1 | 173.8 | 172.2 | 177.4 | -5.5 | 109.7 | | |
| 10 | N | 31.3 | Very low | 30.3 | Very low | 132 Ų | 132 | 157.1 Ų | 157.1 | 71% | 0.706 | 80% | 0.795 | S | S | * | * | | | trans | -131.5 | 70.6 | 167.2 | -124.3 | -11.4 | 0 | 0 | 0 | 109.9 | H12 | N10-H12 PolarHBondContact O-N 3.14Š|
| 11 | E | 35.2 | Very low | 30.5 | Very low | 170 Ų | 170 | 154.5 Ų | 154.5 | 79% | 0.794 | 78% | 0.782 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | 23.8 | 172.9 | -74.4 | -177.4 | 136.7 | 0 | 0 | 113.2 | | |
| 12 | H | 35.5 | Very low | 30.7 | Very low | 163 Ų | 163 | 152.1 Ų | 152.1 | 76% | 0.755 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122 | 4.1 | -170.5 | -89.1 | 25.4 | 0 | 0 | 0 | 116.4 | N10 | N10-H12 PolarHBondContact O-N 3.14Š|
| 13 | I | 34.8 | Very low | 30.9 | Very low | 122 Ų | 122 | 149.5 Ų | 149.5 | 63% | 0.626 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.8 | -7.9 | -176.6 | -57.6 | 174.9 | 0 | 0 | 0 | 112.3 | | |
| 14 | G | 31.3 | Very low | 31.2 | Very low | 67 Ų | 67 | 144.8 Ų | 144.8 | 69% | 0.691 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -0.7 | -172.9 | 0 | 0 | 0 | 0 | 0 | 117.7 | | |
| 15 | R | 33.4 | Very low | 31.6 | Very low | 219 Ų | 219 | 150.7 Ų | 150.7 | 83% | 0.826 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -117.6 | -20.2 | -175.3 | -75.2 | -171.4 | -166.4 | 171.8 | 5.9 | 116.2 | | |
| 16 | D | 33 | Very low | 31.7 | Very low | 125 Ų | 125 | 147.6 Ų | 147.6 | 67% | 0.668 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -89.7 | -18.4 | -177.6 | -81.4 | -28.9 | 0 | 0 | 0 | 114.3 | M18 | D16-M18 VanDerWaalsContact C-N 3.26Å; D16-M18 PolarHBondContact O-N 3.14Å |
| 17 | V | 33.9 | Very low | 31.8 | Very low | 104 Ų | 104 | 142.2 Ų | 142.2 | 63% | 0.63 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.3 | -21.4 | 175 | -174.9 | 0 | 0 | 0 | 0 | 111.8 | | |
| 18 | M | 31.7 | Very low | 32 | Very low | 147 Ų | 147 | 137.2 Ų | 137.2 | 72% | 0.724 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | -10.9 | -179 | -74.9 | -93.8 | -80.9 | 0 | 0 | 114.1 | D16 | D16-M18 VanDerWaalsContact C-N 3.26Å; D16-M18 PolarHBondContact O-N 3.14Å |
| 19 | K | 33.3 | Very low | 32.2 | Very low | 160 Ų | 160 | 139.1 Ų | 139.1 | 70% | 0.696 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -96.4 | -8.2 | -178.7 | -84.7 | -174.5 | 174.6 | -178.4 | 0 | 115.2 | | |
| 20 | Q | 33 | Very low | 32.5 | Very low | 178 Ų | 178 | 133.3 Ų | 133.3 | 83% | 0.832 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -95 | 5.3 | 175 | -76.6 | -170.4 | -16.9 | 0 | 0 | 113.9 | | |
| 21 | I | 34 | Very low | 32.3 | Very low | 103 Ų | 103 | 134.4 Ų | 134.4 | 53% | 0.528 | 70% | 0.7 | S | S | . | * | | | trans | -100.4 | 5 | -178.8 | -51.1 | 176 | 0 | 0 | 0 | 111.3 | G23 | I21-G23 PolarHBondContact O-N 3.36Š|
| 22 | E | 32.9 | Very low | 32.1 | Very low | 182 Ų | 182 | 129.6 Ų | 129.6 | 85% | 0.85 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -85.3 | 80.3 | 168.8 | -73.5 | -175.8 | 160.1 | 0 | 0 | 110.1 | | |
| 23 | G | 32.6 | Very low | 31.9 | Very low | 75 Ų | 75 | 130.9 Ų | 130.9 | 77% | 0.773 | 69% | 0.685 | S | S | * | * | S | Bend | trans | 159.1 | -16.4 | 171.3 | 0 | 0 | 0 | 0 | 0 | 116.5 | I21 | I21-G23 PolarHBondContact O-N 3.36Š|
| 24 | V | 31.2 | Very low | 31.6 | Very low | 101 Ų | 101 | 131.5 Ų | 131.5 | 61% | 0.612 | 69% | 0.694 | S | S | * | * | | | trans | -98.4 | 104 | 179.6 | -173.8 | 0 | 0 | 0 | 0 | 109 | L26 | V24-L26 HydrophobicContact CG1-CG 4.27Å; V24-L26 PolarHBondContact O-N 3.28Å |
| 25 | R | 29.8 | Very low | 31.5 | Very low | 249 Ų | 249 | 131.8 Ų | 131.8 | 94% | 0.94 | 69% | 0.69 | S | S | * | * | | | trans | -62.9 | 87.7 | 165.1 | -88 | -174.8 | 173.4 | 177.8 | -1.2 | 108.6 | | |
| 26 | L | 31.5 | Very low | 31.4 | Very low | 97 Ų | 97 | 127.1 Ų | 127.1 | 51% | 0.508 | 68% | 0.681 | S | S | . | * | | | trans | -68.1 | 135.1 | 166.8 | -78.5 | 159.3 | 0 | 0 | 0 | 108.6 | V24 A28 I30 | V24-L26 HydrophobicContact CG1-CG 4.27Å; V24-L26 PolarHBondContact O-N 3.28Å; L26-A28 PolarHBondContact O-N 3.41Å; L26-I30 HydrophobicContact CD2-CD1 4.44Å |
| 27 | P | 28.6 | Very low | 31.4 | Very low | 81 Ų | 81 | 129.7 Ų | 129.7 | 53% | 0.526 | 69% | 0.689 | S | S | . | * | | | trans | -58.6 | 132.7 | 174.4 | 22.2 | -29.6 | 0 | 0 | 0 | 109.3 | N29 I30 | P27-N29 PolarHBondContact O-N 3.31Å; P27-I30 HydrophobicContact CG-CD1 3.69Å; P27-I30 HydrophobicContact CG-CG1 4.17Å; P27-I30 PolarHBondContact O-N 3.36Å |
| 28 | A | 31.1 | Very low | 31.3 | Very low | 87 Ų | 87 | 131.6 Ų | 131.6 | 72% | 0.719 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55 | -11 | -172.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | L26 | L26-A28 PolarHBondContact O-N 3.41Š|
| 29 | N | 32.3 | Very low | 31.3 | Very low | 140 Ų | 140 | 135.3 Ų | 135.3 | 75% | 0.749 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -4.6 | 175.3 | -79.5 | -10 | 0 | 0 | 0 | 115.1 | P27 | P27-N29 PolarHBondContact O-N 3.31Š|
| 30 | I | 32 | Very low | 31.2 | Very low | 97 Ų | 97 | 135.9 Ų | 135.9 | 50% | 0.497 | 71% | 0.709 | S | S | . | * | S | Bend | trans | -96.6 | -11.8 | 178.7 | -60.5 | 179.1 | 0 | 0 | 0 | 112.1 | L26 P27 S32 | L26-I30 HydrophobicContact CD2-CD1 4.44Å; P27-I30 HydrophobicContact CG-CD1 3.69Å; P27-I30 HydrophobicContact CG-CG1 4.17Å; P27-I30 PolarHBondContact O-N 3.36Å; I30-S32 VanDerWaalsContact C-N 3.28Å; I30-S32 PolarHBondContact O-N 3.41Å |
| 31 | M | 27.9 | Very low | 31.2 | Very low | 155 Ų | 155 | 131.3 Ų | 131.3 | 76% | 0.764 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.7 | -0.9 | 179.6 | -70.2 | -131.1 | 74.4 | 0 | 0 | 114.7 | | |
| 32 | S | 30.3 | Very low | 31.1 | Very low | 69 Ų | 69 | 137.8 Ų | 137.8 | 48% | 0.483 | 72% | 0.719 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.5 | -11.7 | -176.1 | -31.6 | 0 | 0 | 0 | 0 | 114.7 | I30 | I30-S32 VanDerWaalsContact C-N 3.28Å; I30-S32 PolarHBondContact O-N 3.41Å |
| 33 | Y | 30.6 | Very low | 31.1 | Very low | 191 Ų | 191 | 138 Ų | 138 | 75% | 0.749 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -110.8 | -3.4 | -166.2 | -82 | -83.5 | 0 | 0 | 0 | 115.7 | | |
| 34 | V | 30 | Very low | 31.1 | Very low | 135 Ų | 135 | 143 Ų | 143 | 82% | 0.818 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -99.4 | -1.8 | 177.3 | -173 | 0 | 0 | 0 | 0 | 112.1 | | |
| 35 | A | 28.3 | Very low | 31.1 | Very low | 72 Ų | 72 | 145.6 Ų | 145.6 | 60% | 0.595 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -105.2 | 6.7 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 36 | L | 31.1 | Very low | 31.3 | Very low | 122 Ų | 122 | 139.1 Ų | 139.1 | 64% | 0.639 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -104.6 | -12.4 | -175.5 | -114 | 137.5 | 0 | 0 | 0 | 114.5 | | |
| 37 | E | 33.7 | Very low | 31.2 | Very low | 179 Ų | 179 | 139.8 Ų | 139.8 | 84% | 0.836 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -91.3 | -13.5 | 179.3 | -72 | -170.9 | 138.4 | 0 | 0 | 114.3 | | |
| 38 | D | 30.5 | Very low | 31.4 | Very low | 144 Ų | 144 | 143.2 Ų | 143.2 | 77% | 0.77 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -97.2 | 4.6 | -176.4 | -148.4 | 22 | 0 | 0 | 0 | 114 | | |
| 39 | R | 31.9 | Very low | 31.3 | Very low | 225 Ų | 225 | 144.6 Ų | 144.6 | 85% | 0.849 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -104.1 | -6.3 | 177.4 | -80.8 | -170.7 | 177.4 | -175.8 | 0.8 | 115.2 | | |
| 40 | M | 32 | Very low | 31.1 | Very low | 172 Ų | 172 | 143.1 Ų | 143.1 | 85% | 0.847 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -95 | 2.4 | 177.9 | -66 | -149 | 174.3 | 0 | 0 | 114.3 | | |
| 41 | A | 32.5 | Very low | 30.8 | Very low | 81 Ų | 81 | 143.9 Ų | 143.9 | 67% | 0.669 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -100.6 | 14.1 | -175.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | | |
| 42 | R | 32.4 | Very low | 30.8 | Very low | 239 Ų | 239 | 142 Ų | 142 | 90% | 0.902 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -140.3 | 29.9 | -175.8 | -73.7 | -162.8 | 173.5 | -173 | -0.3 | 116.2 | | |
| 43 | Q | 32.8 | Very low | 30.6 | Very low | 187 Ų | 187 | 144 Ų | 144 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | | | trans | -125.7 | 56.1 | 173.4 | -154.4 | 171.7 | 2.1 | 0 | 0 | 110.9 | | |
| 44 | E | 32.9 | Very low | 30.5 | Very low | 180 Ų | 180 | 138 Ų | 138 | 84% | 0.841 | 77% | 0.768 | S | S | * | * | | | trans | -80.8 | 149.6 | 154.1 | -66.9 | -174.7 | 137.9 | 0 | 0 | 107.5 | | |
| 45 | D | 30.7 | Very low | 30.4 | Very low | 155 Ų | 155 | 141.2 Ų | 141.2 | 83% | 0.829 | 77% | 0.765 | S | S | * | * | | | trans | 79 | 68.4 | -179.3 | -53.7 | -26.9 | 0 | 0 | 0 | 116.8 | | |
| 46 | S | 35 | Very low | 30.4 | Very low | 114 Ų | 114 | 142.5 Ų | 142.5 | 80% | 0.797 | 76% | 0.761 | S | S | * | * | | | trans | -163 | 103.1 | 135.7 | -82.8 | 0 | 0 | 0 | 0 | 110.6 | L48 | S46-L48 PolarHBondContact O-N 3.18Š|
| 47 | S | 29.4 | Very low | 30.3 | Very low | 110 Ų | 110 | 140.8 Ų | 140.8 | 77% | 0.769 | 76% | 0.756 | S | S | * | * | | | trans | -38.3 | 127.6 | 158.4 | 48.2 | 0 | 0 | 0 | 0 | 112.1 | | |
| 48 | L | 31.3 | Very low | 30 | Very low | 154 Ų | 154 | 135.9 Ų | 135.9 | 81% | 0.806 | 74% | 0.741 | S | S | * | * | | | trans | 165.2 | 116.2 | 138.1 | -85.4 | 155.6 | 0 | 0 | 0 | 110.5 | S46 | S46-L48 PolarHBondContact O-N 3.18Š|
| 49 | S | 29 | Very low | 29.9 | Very low | 115 Ų | 115 | 136.2 Ų | 136.2 | 80% | 0.804 | 74% | 0.738 | S | S | * | * | | | trans | 29.7 | 102.6 | 153.5 | 62.4 | 0 | 0 | 0 | 0 | 118.5 | | |
| 50 | S | 28.3 | Very low | 29.7 | Very low | 110 Ų | 110 | 132.7 Ų | 132.7 | 77% | 0.769 | 74% | 0.735 | S | S | * | * | | | trans | -144 | 140.5 | 160.3 | -65.3 | 0 | 0 | 0 | 0 | 109.4 | | |
| 51 | P | 26.5 | Very low | 29.5 | Very low | 113 Ų | 113 | 127.9 Ų | 127.9 | 73% | 0.734 | 72% | 0.716 | S | S | * | * | | | trans | -62.4 | 159.6 | 179.1 | 28.4 | -33.2 | 0 | 0 | 0 | 110.4 | S53 | P51-S53 PolarHBondContact O-N 3.05Š|
| 52 | P | 27.1 | Very low | 29.2 | Very low | 115 Ų | 115 | 129.8 Ų | 129.8 | 75% | 0.747 | 72% | 0.719 | S | S | * | * | | | trans | -56.4 | 115 | -172.7 | 23.4 | -32.9 | 0 | 0 | 0 | 109.8 | S54 | P52-S54 PolarHBondContact O-N 3.06Š|
| 53 | S | 26.6 | Very low | 29 | Very low | 110 Ų | 110 | 122.7 Ų | 122.7 | 77% | 0.769 | 70% | 0.695 | S | S | * | * | | | trans | -63.3 | 104.5 | 174.1 | -174.5 | 0 | 0 | 0 | 0 | 107.6 | P51 R55 | P51-S53 PolarHBondContact O-N 3.05Å; S53-R55 PolarHBondContact O-N 2.92Å |
| 54 | S | 28.4 | Very low | 28.6 | Very low | 66 Ų | 66 | 119.8 Ų | 119.8 | 46% | 0.462 | 69% | 0.692 | S | S | . | * | | | trans | -57.1 | 110.1 | 168.4 | 51.6 | 0 | 0 | 0 | 0 | 107.4 | P52 I56 | P52-S54 PolarHBondContact O-N 3.06Å; S54-I56 PolarHBondContact O-N 3.22Å |
| 55 | R | 27.4 | Very low | 28.4 | Very low | 202 Ų | 202 | 114.8 Ų | 114.8 | 76% | 0.762 | 68% | 0.676 | S | S | * | * | | | trans | -65.7 | 101.1 | 175.9 | -79.2 | -177.5 | 173.7 | -174.5 | -1.8 | 108.1 | S53 T57 | S53-R55 PolarHBondContact O-N 2.92Å; R55-T57 PolarHBondContact O-N 3.24Å |
| 56 | I | 28.8 | Very low | 28.2 | Very low | 99 Ų | 99 | 118 Ų | 118 | 51% | 0.508 | 68% | 0.678 | S | S | . | * | | | trans | -79 | 101.8 | 169.4 | -60.1 | 171.9 | 0 | 0 | 0 | 106.6 | S54 S58 | S54-I56 PolarHBondContact O-N 3.22Å; I56-S58 PolarHBondContact O-N 3.16Å |
| 57 | T | 28.6 | Very low | 28 | Very low | 86 Ų | 86 | 121.1 Ų | 121.1 | 53% | 0.528 | 68% | 0.677 | S | S | . | * | | | trans | -87.4 | 86.5 | 166.8 | 43.8 | 0 | 0 | 0 | 0 | 108.7 | R55 H59 | R55-T57 PolarHBondContact O-N 3.24Å; T57-H59 PolarHBondContact O-N 2.96Å |
| 58 | S | 28.6 | Very low | 27.9 | Very low | 76 Ų | 76 | 118.8 Ų | 118.8 | 53% | 0.531 | 66% | 0.66 | S | S | . | * | | | trans | -83.6 | 100.8 | 167.5 | 57.7 | 0 | 0 | 0 | 0 | 108.9 | I56 L60 | I56-S58 PolarHBondContact O-N 3.16Å; S58-L60 PolarHBondContact O-N 2.97Å |
| 59 | H | 28.7 | Very low | 27.9 | Very low | 152 Ų | 152 | 117 Ų | 117 | 70% | 0.704 | 66% | 0.66 | S | S | * | * | | | trans | -82.7 | 106.4 | 166.3 | -71.7 | -65.8 | 0 | 0 | 0 | 108.6 | T57 V61 | T57-H59 PolarHBondContact O-N 2.96Å; H59-V61 PolarHBondContact O-N 3.26Å |
| 60 | L | 26.8 | Very low | 27.8 | Very low | 150 Ų | 150 | 118.4 Ų | 118.4 | 79% | 0.785 | 66% | 0.658 | S | S | * | * | | | trans | -73.6 | 95.5 | 173.4 | -144.2 | 119.3 | 0 | 0 | 0 | 107.8 | S58 T62 | S58-L60 PolarHBondContact O-N 2.97Å; L60-T62 PolarHBondContact O-N 2.88Å |
| 61 | V | 27.2 | Very low | 27.7 | Very low | 72 Ų | 72 | 119.2 Ų | 119.2 | 44% | 0.436 | 65% | 0.645 | S | S | . | * | | | trans | -88.3 | 102.1 | 172.8 | -178 | 0 | 0 | 0 | 0 | 107.9 | H59 F63 L77 | H59-V61 PolarHBondContact O-N 3.26Å; V61-F63 HydrophobicContact CB-CE2 4.06Å; V61-F63 HydrophobicContact CG1-CD2 4.11Å; V61-F63 HydrophobicContact CG1-CE1 4.27Å; V61-F63 HydrophobicContact CG1-CE2 3.72Å; V61-F63 HydrophobicContact CG1-CZ 3.81Å; V61-F63 WeakPolarHBondContact O-CD2 3.04Å; V61-F63 PolarHBondContact O-N 2.78Å; V61-L77 HydrophobicContact CB-CD1 3.77Å; V61-L77 HydrophobicContact CG2-CD1 4.38Å; V61-L77 WeakPolarHBondContact O-CD1 3.43Å |
| 62 | T | 27.7 | Very low | 27.8 | Very low | 121 Ų | 121 | 122 Ų | 122 | 74% | 0.742 | 65% | 0.653 | S | S | * | * | | | trans | -73.4 | 98 | 173.5 | -34 | 0 | 0 | 0 | 0 | 108.5 | L60 | L60-T62 PolarHBondContact O-N 2.88Š|
| 63 | F | 27.2 | Very low | 28 | Very low | 90 Ų | 90 | 119.5 Ų | 119.5 | 40% | 0.395 | 64% | 0.638 | S | S | . | * | | | trans | -70.3 | 136.7 | 168.7 | -70.7 | -84 | 0 | 0 | 0 | 109 | V61 C65 L75 L77 H107 | V61-F63 HydrophobicContact CB-CE2 4.06Å; V61-F63 HydrophobicContact CG1-CD2 4.11Å; V61-F63 HydrophobicContact CG1-CE1 4.27Å; V61-F63 HydrophobicContact CG1-CE2 3.72Å; V61-F63 HydrophobicContact CG1-CZ 3.81Å; V61-F63 WeakPolarHBondContact O-CD2 3.04Å; V61-F63 PolarHBondContact O-N 2.78Å; F63-C65 PolarHBondContact O-N 3.43Å; F63-L75 HydrophobicContact CD2-CD2 3.89Å; F63-L77 HydrophobicContact CD2-CD2 4.06Å; F63-L77 HydrophobicContact CE2-CD2 3.67Å; F63-H107 AromaticContact CE2-NE2 4Å |
| 64 | P | 25.5 | Very low | 28.2 | Very low | 125 Ų | 125 | 120.5 Ų | 120.5 | 81% | 0.812 | 63% | 0.631 | S | S | * | * | | | trans | -69.8 | 76 | 166.5 | 29.2 | -30.8 | 0 | 0 | 0 | 108.1 | Y66 | P64-Y66 PolarHBondContact O-N 3.3Š|
| 65 | C | 28.4 | Very low | 28.4 | Very low | 75 Ų | 75 | 120.1 Ų | 120.1 | 51% | 0.507 | 62% | 0.623 | S | S | . | * | | | trans | -67 | 118.2 | 166.8 | -74.6 | 0 | 0 | 0 | 0 | 106.8 | F63 K67 | F63-C65 PolarHBondContact O-N 3.43Å; C65-K67 PolarHBondContact O-N 3.05Å |
| 66 | Y | 25.6 | Very low | 28.8 | Very low | 223 Ų | 223 | 115.2 Ų | 115.2 | 88% | 0.875 | 61% | 0.609 | S | S | * | * | | | trans | -43.8 | 109.6 | 163.7 | -148.4 | -97.4 | 0 | 0 | 0 | 107.2 | P64 P68 | P64-Y66 PolarHBondContact O-N 3.3Å; Y66-P68 VanDerWaalsContact C-CD 3.49Å; Y66-P68 WeakPolarHBondContact O-CD 2.96Å |
| 67 | K | 31.2 | Very low | 29.1 | Very low | 179 Ų | 179 | 111.9 Ų | 111.9 | 78% | 0.778 | 59% | 0.592 | S | S | * | * | | | trans | -83.6 | 98.3 | 170.4 | -90.5 | -175.4 | 174.9 | 178.5 | 0 | 106.7 | C65 S69 | C65-K67 PolarHBondContact O-N 3.05Å; K67-S69 PolarHBondContact O-N 3.04Å |
| 68 | P | 28.2 | Very low | 29.5 | Very low | 61 Ų | 61 | 109.4 Ų | 109.4 | 40% | 0.396 | 58% | 0.577 | S | S | . | * | | | trans | -55.8 | 131.1 | 146.9 | 25.9 | -28.6 | 0 | 0 | 0 | 105.6 | Y66 N70 Y71 | Y66-P68 VanDerWaalsContact C-CD 3.49Å; Y66-P68 WeakPolarHBondContact O-CD 2.96Å; P68-N70 PolarHBondContact O-N 2.91Å; P68-Y71 HydrophobicContact CB-CD2 4.4Å; P68-Y71 HydrophobicContact CG-CD2 3.94Å; P68-Y71 PolarHBondContact O-N 3.12Å |
| 69 | S | 29.7 | Very low | 30 | Very low | 116 Ų | 116 | 109.4 Ų | 109.4 | 81% | 0.811 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.5 | 2.1 | -162.9 | 16.9 | 0 | 0 | 0 | 0 | 116.8 | K67 | K67-S69 PolarHBondContact O-N 3.04Š|
| 70 | N | 27.9 | Very low | 30.4 | Very low | 145 Ų | 145 | 103.8 Ų | 103.8 | 78% | 0.775 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -134.8 | 12.2 | -168.4 | -65.2 | -34.5 | 0 | 0 | 0 | 115.4 | P68 | P68-N70 PolarHBondContact O-N 2.91Š|
| 71 | Y | 26.6 | Very low | 30.9 | Very low | 127 Ų | 127 | 97.4 Ų | 97.4 | 50% | 0.498 | 51% | 0.513 | S | S | . | . | | | trans | -120.2 | 114.5 | -179.9 | -73.3 | -88.2 | 0 | 0 | 0 | 113.1 | P68 C73 | P68-Y71 HydrophobicContact CB-CD2 4.4Å; P68-Y71 HydrophobicContact CG-CD2 3.94Å; P68-Y71 PolarHBondContact O-N 3.12Å; Y71-C73 PolarHBondContact O-N 3.18Å |
| 72 | L | 28.8 | Very low | 31.4 | Very low | 171 Ų | 171 | 98.3 Ų | 98.3 | 90% | 0.895 | 52% | 0.516 | S | S | * | . | | | trans | -89.5 | 73.1 | 173.2 | -115.6 | 142.2 | 0 | 0 | 0 | 108.6 | | |
| 73 | C | 29.4 | Very low | 32 | Very low | 63 Ų | 63 | 98.6 Ų | 98.6 | 43% | 0.426 | 50% | 0.503 | S | S | . | . | | | trans | -91.9 | 107.3 | 170.1 | -95.7 | 0 | 0 | 0 | 0 | 109.4 | Y71 L75 C96 | Y71-C73 PolarHBondContact O-N 3.18Å; C73-L75 PolarHBondContact O-N 3.18Å; C73-C96 HydrophobicContact CB-CB 4.45Å; C73-C96 WeakPolarHBondContact CB-SG 3.44Å; C73-C96 WeakPolarHBondContact SG-CB 3.33Å; C73-C96 CovalentContact SG-SG 2.04Å; C73-C96 PolarHBondContact SG-SG 2.77Å |
| 74 | E | 32 | Very low | 32.6 | Very low | 132 Ų | 132 | 104.1 Ų | 104.1 | 62% | 0.617 | 53% | 0.53 | S | S | * | . | | | trans | -77.3 | 104.1 | 163.8 | -71 | -171.8 | 171.8 | 0 | 0 | 108.7 | H76 | E74-H76 PolarHBondContact O-CD2 3.08Å; E74-H76 PolarHBondContact O-N 3.19Å; E74-H76 VanDerWaalsContact O-N 3.16Å; E74-H76 IonicContact OE2-CE1 3.33Å; E74-H76 IonicContact OE2-NE2 2.67Å; E74-H76 PolarHBondContact OE2-NE2 3.39Å |
| 75 | L | 33.2 | Very low | 33.5 | Very low | 57 Ų | 57 | 102.1 Ų | 102.1 | 30% | 0.298 | 53% | 0.532 | S | S | . | . | | | trans | -75.3 | 99.3 | 172.3 | -169.5 | 82.9 | 0 | 0 | 0 | 108.7 | F63 C73 L77 V94 C103 | F63-L75 HydrophobicContact CD2-CD2 3.89Å; C73-L75 PolarHBondContact O-N 3.18Å; L75-L77 HydrophobicContact CD2-CD2 3.91Å; L75-L77 HydrophobicContact CG-CD2 4.46Å; L75-L77 PolarHBondContact O-N 3.4Å; L75-V94 HydrophobicContact CD1-CG1 4.31Å; L75-C103 HydrophobicContact CD1-CB 4.25Å |
| 76 | H | 34.7 | Very low | 34.1 | Very low | 100 Ų | 100 | 100.4 Ų | 100.4 | 46% | 0.463 | 53% | 0.527 | S | S | . | . | | | trans | -83.2 | 104.6 | 172.1 | -73 | -89.5 | 0 | 0 | 0 | 109.5 | E74 T92 V94 | E74-H76 PolarHBondContact O-CD2 3.08Å; E74-H76 PolarHBondContact O-N 3.19Å; E74-H76 VanDerWaalsContact O-N 3.16Å; E74-H76 IonicContact OE2-CE1 3.33Å; E74-H76 IonicContact OE2-NE2 2.67Å; E74-H76 PolarHBondContact OE2-NE2 3.39Å; H76-T92 PolarHBondContact O-OG1 3.43Å; H76-V94 HydrophobicContact CB-CG2 4.26Å; H76-V94 WeakPolarHBondContact O-CG2 3.26Å |
| 77 | L | 35.8 | Very low | 34.7 | Very low | 29 Ų | 29 | 92 Ų | 92 | 15% | 0.152 | 50% | 0.499 | C | S | . | . | P | Polyproline II helix | trans | -65.1 | 138.8 | 177.8 | -58.3 | 168.3 | 0 | 0 | 0 | 110.4 | V61 F63 L75 Q79 T92 H107 | V61-L77 HydrophobicContact CB-CD1 3.77Å; V61-L77 HydrophobicContact CG2-CD1 4.38Å; V61-L77 WeakPolarHBondContact O-CD1 3.43Å; F63-L77 HydrophobicContact CD2-CD2 4.06Å; F63-L77 HydrophobicContact CE2-CD2 3.67Å; L75-L77 HydrophobicContact CD2-CD2 3.91Å; L75-L77 HydrophobicContact CG-CD2 4.46Å; L75-L77 PolarHBondContact O-N 3.4Å; L77-Q79 PolarHBondContact O-N 3.3Å; L77-T92 PolarHBondContact O-OG1 3.16Å; L77-H107 VanDerWaalsContact CD2-NE2 3.27Å; L77-H107 WeakPolarHBondContact CD2-NE2 3.28Å |
| 78 | P | 37.5 | Very low | 35 | Very low | 34 Ų | 34 | 88.2 Ų | 88.2 | 22% | 0.221 | 48% | 0.484 | C | S | . | . | P | Polyproline II helix | trans | -59 | 132.1 | 176.6 | 24.4 | -32.6 | 0 | 0 | 0 | 110.3 | R90 H107 | P78-R90 CarbonylContact C-O 3.58Å; P78-R90 VanDerWaalsContact CA-O 3.26Å; P78-R90 WeakPolarHBondContact CA-O 2.87Å; P78-R90 WeakPolarHBondContact CB-O 3.36Å; P78-H107 HydrophobicContact CG-CB 3.41Å; P78-H107 VanDerWaalsContact CG-CB 3.41Å; P78-H107 VanDerWaalsContact CG-CG 3.44Å |
| 79 | Q | 38.3 | Very low | 35.6 | Very low | 76 Ų | 76 | 86.8 Ų | 86.8 | 36% | 0.355 | 47% | 0.474 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.3 | 123.4 | -179.2 | -65.6 | 178.8 | -5.9 | 0 | 0 | 108.8 | L77 V81 R90 | L77-Q79 PolarHBondContact O-N 3.3Å; Q79-V81 PolarHBondContact O-N 3.33Å; Q79-R90 PolarHBondContact N-O 2.92Å; Q79-R90 VanDerWaalsContact N-O 3.1Å; Q79-R90 WeakPolarHBondContact O-CB 2.98Å; Q79-R90 PolarHBondContact O-N 2.67Å |
| 80 | C | 36.5 | Very low | 35.9 | Very low | 33 Ų | 33 | 87.7 Ų | 87.7 | 22% | 0.223 | 46% | 0.46 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.3 | 120.5 | 165.6 | -47.9 | 0 | 0 | 0 | 0 | 107.3 | V87 C111 | C80-V87 HydrophobicContact CB-CG1 3.65Å; C80-C111 HydrophobicContact CB-CB 4.04Å; C80-C111 WeakPolarHBondContact CB-SG 3.27Å; C80-C111 VanDerWaalsContact SG-CA 3.53Å; C80-C111 WeakPolarHBondContact SG-CB 3.21Å; C80-C111 CovalentContact SG-SG 2.05Å; C80-C111 PolarHBondContact SG-SG 3.34Å |
| 81 | V | 38.4 | Very low | 36.5 | Very low | 16 Ų | 16 | 85.6 Ų | 85.6 | 10% | 0.097 | 45% | 0.447 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.1 | 116.3 | 175.8 | -179.3 | 0 | 0 | 0 | 0 | 108.4 | Q79 R83 E88 R90 | Q79-V81 PolarHBondContact O-N 3.33Å; V81-R83 HydrophobicContact CG1-CG 4.42Å; V81-R83 PolarHBondContact O-N 3.08Å; V81-E88 PolarHBondContact N-O 2.91Å; V81-E88 VanDerWaalsContact N-O 3.14Å; V81-E88 PolarHBondContact O-N 3.26Å; V81-R90 HydrophobicContact CG2-CB 4.34Å; V81-R90 HydrophobicContact CG2-CG 3.87Å |
| 82 | D | 36.2 | Very low | 37 | Very low | 92 Ų | 92 | 82 Ų | 82 | 49% | 0.492 | 44% | 0.438 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.3 | 118.2 | 168.3 | -103.8 | -18.6 | 0 | 0 | 0 | 109.2 | | |
| 83 | R | 40.4 | Very low | 37.3 | Very low | 126 Ų | 126 | 81 Ų | 81 | 48% | 0.475 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.2 | 156.3 | 168.1 | -74.7 | -173.9 | 165.4 | 173 | 4.2 | 109.4 | V81 G85 G86 E88 | V81-R83 HydrophobicContact CG1-CG 4.42Å; V81-R83 PolarHBondContact O-N 3.08Å; R83-G85 PolarHBondContact O-N 2.78Å; R83-G86 PolarHBondContact N-O 2.95Å; R83-G86 PolarHBondContact O-N 3.28Å; R83-E88 IonicContact CZ-OE2 2.77Å; R83-E88 IonicContact NE-OE2 3.02Å; R83-E88 IonicContact NH1-OE2 3.77Å; R83-E88 PolarHBondContact NH1-OE2 2.78Å |
| 84 | E | 41.3 | Very low | 37.4 | Very low | 207 Ų | 207 | 80.3 Ų | 80.3 | 97% | 0.967 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.8 | -3.7 | 176.5 | -81.6 | -178.3 | 149.1 | 0 | 0 | 114.9 | | |
| 85 | G | 43.6 | Very low | 37.3 | Very low | 82 Ų | 82 | 77.2 Ų | 77.2 | 85% | 0.845 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -125.9 | 15.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | R83 | R83-G85 PolarHBondContact O-N 2.78Š|
| 86 | G | 40.6 | Very low | 37.2 | Very low | 39 Ų | 39 | 75.5 Ų | 75.5 | 40% | 0.402 | 41% | 0.412 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 125.8 | 172.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | R83 E88 | R83-G86 PolarHBondContact N-O 2.95Å; R83-G86 PolarHBondContact O-N 3.28Å; G86-E88 PolarHBondContact O-N 3.42Å |
| 87 | V | 39.3 | Very low | 36.9 | Very low | 47 Ų | 47 | 75.8 Ų | 75.8 | 29% | 0.285 | 42% | 0.417 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.6 | 114.9 | 177.4 | -175 | 0 | 0 | 0 | 0 | 108.8 | C80 C111 H112 | C80-V87 HydrophobicContact CB-CG1 3.65Å; V87-C111 WeakPolarHBondContact CB-O 3.18Å; V87-C111 HydrophobicContact CG1-CB 3.91Å; V87-C111 VanDerWaalsContact CG1-O 3.28Å; V87-C111 WeakPolarHBondContact CG1-O 3.15Å; V87-H112 PolarHBondContact O-CE1 3.35Å; V87-H112 VanDerWaalsContact O-CE1 3.26Å |
| 88 | E | 37 | Very low | 36.7 | Very low | 99 Ų | 99 | 83.3 Ų | 83.3 | 46% | 0.463 | 45% | 0.449 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.8 | 125.1 | 168.5 | -89.1 | -167 | 159.7 | 0 | 0 | 109.9 | V81 R83 G86 R90 | V81-E88 PolarHBondContact N-O 2.91Å; V81-E88 VanDerWaalsContact N-O 3.14Å; V81-E88 PolarHBondContact O-N 3.26Å; R83-E88 IonicContact CZ-OE2 2.77Å; R83-E88 IonicContact NE-OE2 3.02Å; R83-E88 IonicContact NH1-OE2 3.77Å; R83-E88 PolarHBondContact NH1-OE2 2.78Å; G86-E88 PolarHBondContact O-N 3.42Å; E88-R90 PolarHBondContact O-N 3.34Å |
| 89 | P | 41.3 | Very low | 36.4 | Very low | 31 Ų | 31 | 89.5 Ų | 89.5 | 20% | 0.201 | 48% | 0.475 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.6 | 113.9 | 169.5 | 26.6 | -30.3 | 0 | 0 | 0 | 109 | M91 F108 C111 | P89-M91 PolarHBondContact O-N 2.91Å; P89-F108 HydrophobicContact CB-CZ 4.46Å; P89-F108 HydrophobicContact CG-CD1 4.49Å; P89-F108 HydrophobicContact CG-CE1 3.86Å; P89-F108 HydrophobicContact CG-CZ 3.99Å; P89-C111 HydrophobicContact CB-CB 4.33Å |
| 90 | R | 35.9 | Very low | 36 | Very low | 135 Ų | 135 | 87.8 Ų | 87.8 | 51% | 0.509 | 47% | 0.473 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.6 | 104.3 | 165.1 | -80.4 | -164.4 | 166 | 173.3 | -11.4 | 108.9 | P78 Q79 V81 E88 T92 | P78-R90 CarbonylContact C-O 3.58Å; P78-R90 VanDerWaalsContact CA-O 3.26Å; P78-R90 WeakPolarHBondContact CA-O 2.87Å; P78-R90 WeakPolarHBondContact CB-O 3.36Å; Q79-R90 PolarHBondContact N-O 2.92Å; Q79-R90 VanDerWaalsContact N-O 3.1Å; Q79-R90 WeakPolarHBondContact O-CB 2.98Å; Q79-R90 PolarHBondContact O-N 2.67Å; V81-R90 HydrophobicContact CG2-CB 4.34Å; V81-R90 HydrophobicContact CG2-CG 3.87Å; E88-R90 PolarHBondContact O-N 3.34Å; R90-T92 PolarHBondContact O-N 3.19Å |
| 91 | M | 40.6 | Very low | 35.7 | Very low | 101 Ų | 101 | 89.3 Ų | 89.3 | 50% | 0.498 | 49% | 0.489 | S | S | . | . | | | trans | -64 | 113.8 | 164.6 | -74.5 | -173.6 | 178.2 | 0 | 0 | 109.3 | P89 F108 | P89-M91 PolarHBondContact O-N 2.91Å; M91-F108 HydrophobicContact CE-CD2 4.45Å; M91-F108 HydrophobicContact CE-CE2 3.29Å; M91-F108 HydrophobicContact CE-CZ 3.62Å; M91-F108 HydrophobicContact CG-CE2 4.49Å |
| 92 | T | 35.4 | Very low | 35.3 | Very low | 51 Ų | 51 | 92.7 Ų | 92.7 | 31% | 0.313 | 51% | 0.513 | S | S | . | . | | | trans | -81.9 | 115.6 | 158.7 | 35 | 0 | 0 | 0 | 0 | 107.4 | H76 L77 R90 V94 | H76-T92 PolarHBondContact O-OG1 3.43Å; L77-T92 PolarHBondContact O-OG1 3.16Å; R90-T92 PolarHBondContact O-N 3.19Å; T92-V94 PolarHBondContact O-N 3.44Å |
| 93 | N | 35.1 | Very low | 35.1 | Very low | 150 Ų | 150 | 91.4 Ų | 91.4 | 80% | 0.802 | 51% | 0.51 | S | S | * | . | | | trans | -58.2 | 104.9 | 174.5 | -74.4 | -23.8 | 0 | 0 | 0 | 109.1 | C95 | N93-C95 PolarHBondContact O-N 3.27Š|
| 94 | V | 31.4 | Very low | 34.8 | Very low | 49 Ų | 49 | 88 Ų | 88 | 30% | 0.297 | 50% | 0.504 | S | S | . | . | | | trans | -82.6 | 111.9 | 171.8 | -177.4 | 0 | 0 | 0 | 0 | 107.3 | L75 H76 T92 | L75-V94 HydrophobicContact CD1-CG1 4.31Å; H76-V94 HydrophobicContact CB-CG2 4.26Å; H76-V94 WeakPolarHBondContact O-CG2 3.26Å; T92-V94 PolarHBondContact O-N 3.44Å |
| 95 | C | 30.4 | Very low | 34.4 | Very low | 67 Ų | 67 | 84 Ų | 84 | 45% | 0.453 | 49% | 0.485 | S | S | . | . | | | trans | -95 | 113.3 | 173.4 | -153 | 0 | 0 | 0 | 0 | 107.3 | N93 K143 | N93-C95 PolarHBondContact O-N 3.27Å; C95-K143 VanDerWaalsContact SG-CB 3.51Å |
| 96 | C | 31.3 | Very low | 33.9 | Very low | 21 Ų | 21 | 82.4 Ų | 82.4 | 14% | 0.142 | 46% | 0.461 | C | S | . | . | | | trans | -131.3 | 125.7 | 172.2 | -89.1 | 0 | 0 | 0 | 0 | 106.9 | C73 K98 A100 | C73-C96 HydrophobicContact CB-CB 4.45Å; C73-C96 WeakPolarHBondContact CB-SG 3.44Å; C73-C96 WeakPolarHBondContact SG-CB 3.33Å; C73-C96 CovalentContact SG-SG 2.04Å; C73-C96 PolarHBondContact SG-SG 2.77Å; C96-K98 PolarHBondContact O-N 3.43Å; C96-A100 HydrophobicContact CB-CB 3.23Å |
| 97 | D | 29.6 | Very low | 33.7 | Very low | 106 Ų | 106 | 82 Ų | 82 | 57% | 0.567 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -48.4 | 110.8 | 177.5 | -77.4 | -32.8 | 0 | 0 | 0 | 110.5 | Q99 | D97-Q99 PolarHBondContact O-N 3.4Š|
| 98 | K | 31.1 | Very low | 33.3 | Very low | 188 Ų | 188 | 84 Ų | 84 | 82% | 0.817 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.6 | 1.9 | 159.7 | -57.9 | -176.5 | -179.6 | 179.4 | 0 | 118.8 | C96 | C96-K98 PolarHBondContact O-N 3.43Š|
| 99 | Q | 31 | Very low | 33.1 | Very low | 163 Ų | 163 | 81.2 Ų | 81.2 | 76% | 0.762 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -134.3 | -5.4 | -179.3 | -73.9 | -169.6 | -8.1 | 0 | 0 | 116.4 | D97 | D97-Q99 PolarHBondContact O-N 3.4Š|
| 100 | A | 29.9 | Very low | 32.8 | Very low | 40 Ų | 40 | 83.9 Ų | 83.9 | 33% | 0.331 | 47% | 0.467 | S | S | . | . | | | trans | -103.4 | 89.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | C96 | C96-A100 HydrophobicContact CB-CB 3.23Š|
| 101 | A | 29.4 | Very low | 32.6 | Very low | 66 Ų | 66 | 77.9 Ų | 77.9 | 55% | 0.545 | 45% | 0.445 | S | S | . | . | | | trans | -126.4 | 1.8 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | | |
| 102 | S | 31.4 | Very low | 32.5 | Very low | 86 Ų | 86 | 78 Ų | 78 | 60% | 0.601 | 44% | 0.444 | S | S | * | . | S | Bend | trans | -113.7 | -1 | -171.2 | 72.9 | 0 | 0 | 0 | 0 | 117 | | |
| 103 | C | 30.6 | Very low | 32.2 | Very low | 65 Ų | 65 | 78.3 Ų | 78.3 | 44% | 0.439 | 46% | 0.457 | S | S | . | . | S | Bend | trans | -91.7 | 8.3 | -173.3 | -79.5 | 0 | 0 | 0 | 0 | 116.2 | L75 | L75-C103 HydrophobicContact CD1-CB 4.25Š|
| 104 | T | 34.9 | Very low | 32.1 | Very low | 56 Ų | 56 | 77.3 Ų | 77.3 | 34% | 0.344 | 45% | 0.448 | S | S | . | . | S | Bend | trans | -97.4 | -12.4 | -168.8 | 45.3 | 0 | 0 | 0 | 0 | 115 | I138 | T104-I138 WeakPolarHBondContact OG1-CD1 3.47Š|
| 105 | H | 33.1 | Very low | 32.1 | Very low | 122 Ų | 122 | 82.5 Ų | 82.5 | 57% | 0.565 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -81 | -27.2 | -175.7 | -107.9 | 47.5 | 0 | 0 | 0 | 114.8 | H107 | H105-H107 VanDerWaalsContact C-N 3.32Å; H105-H107 PolarHBondContact O-N 3.27Å |
| 106 | S | 33.4 | Very low | 32.1 | Very low | 49 Ų | 49 | 83.3 Ų | 83.3 | 34% | 0.343 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -77.5 | -14.2 | -177.8 | 54.4 | 0 | 0 | 0 | 0 | 114.3 | | |
| 107 | H | 34.8 | Very low | 32 | Very low | 29 Ų | 29 | 84.9 Ų | 84.9 | 13% | 0.134 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -92 | -25.6 | -173.9 | -87.6 | -80.8 | 0 | 0 | 0 | 115.1 | F63 L77 P78 H105 A109 S110 | F63-H107 AromaticContact CE2-NE2 4Å; L77-H107 VanDerWaalsContact CD2-NE2 3.27Å; L77-H107 WeakPolarHBondContact CD2-NE2 3.28Å; P78-H107 HydrophobicContact CG-CB 3.41Å; P78-H107 VanDerWaalsContact CG-CB 3.41Å; P78-H107 VanDerWaalsContact CG-CG 3.44Å; H105-H107 VanDerWaalsContact C-N 3.32Å; H105-H107 PolarHBondContact O-N 3.27Å; H107-A109 VanDerWaalsContact C-N 3.29Å; H107-A109 PolarHBondContact O-N 3.3Å; H107-S110 PolarHBondContact O-N 2.04Å |
| 108 | F | 31.9 | Very low | 32 | Very low | 91 Ų | 91 | 86.6 Ų | 86.6 | 40% | 0.399 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.1 | -33.5 | 178.7 | -99.5 | -97.4 | 0 | 0 | 0 | 112.7 | P89 M91 S110 | P89-F108 HydrophobicContact CB-CZ 4.46Å; P89-F108 HydrophobicContact CG-CD1 4.49Å; P89-F108 HydrophobicContact CG-CE1 3.86Å; P89-F108 HydrophobicContact CG-CZ 3.99Å; M91-F108 HydrophobicContact CE-CD2 4.45Å; M91-F108 HydrophobicContact CE-CE2 3.29Å; M91-F108 HydrophobicContact CE-CZ 3.62Å; M91-F108 HydrophobicContact CG-CE2 4.49Å; F108-S110 VanDerWaalsContact C-N 3.3Å; F108-S110 PolarHBondContact O-N 3.33Å |
| 109 | A | 31.9 | Very low | 31.9 | Very low | 39 Ų | 39 | 83.3 Ų | 83.3 | 32% | 0.322 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -70.4 | -24.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | H107 L120 | H107-A109 VanDerWaalsContact C-N 3.29Å; H107-A109 PolarHBondContact O-N 3.3Å; A109-L120 HydrophobicContact CB-CD2 3.64Å |
| 110 | S | 34.9 | Very low | 31.7 | Very low | 88 Ų | 88 | 79.9 Ų | 79.9 | 62% | 0.615 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -82.3 | -34.3 | -177.2 | -170.7 | 0 | 0 | 0 | 0 | 113.3 | H107 F108 | H107-S110 PolarHBondContact O-N 2.04Å; F108-S110 VanDerWaalsContact C-N 3.3Å; F108-S110 PolarHBondContact O-N 3.33Å |
| 111 | C | 32.6 | Very low | 31.5 | Very low | 8 Ų | 8 | 82.7 Ų | 82.7 | 5% | 0.054 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -80.3 | -21 | -178.4 | -65.1 | 0 | 0 | 0 | 0 | 114.2 | C80 V87 P89 | C80-C111 HydrophobicContact CB-CB 4.04Å; C80-C111 WeakPolarHBondContact CB-SG 3.27Å; C80-C111 VanDerWaalsContact SG-CA 3.53Å; C80-C111 WeakPolarHBondContact SG-CB 3.21Å; C80-C111 CovalentContact SG-SG 2.05Å; C80-C111 PolarHBondContact SG-SG 3.34Å; V87-C111 WeakPolarHBondContact CB-O 3.18Å; V87-C111 HydrophobicContact CG1-CB 3.91Å; V87-C111 VanDerWaalsContact CG1-O 3.28Å; V87-C111 WeakPolarHBondContact CG1-O 3.15Å; P89-C111 HydrophobicContact CB-CB 4.33Å |
| 112 | H | 38.7 | Very low | 31.4 | Very low | 103 Ų | 103 | 83.9 Ų | 83.9 | 48% | 0.477 | 49% | 0.486 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.1 | 9.8 | -174.3 | -75.9 | -66.5 | 0 | 0 | 0 | 115 | V87 H114 | V87-H112 PolarHBondContact O-CE1 3.35Å; V87-H112 VanDerWaalsContact O-CE1 3.26Å; H112-H114 PolarHBondContact O-N 3.05Å |
| 113 | G | 29.6 | Very low | 31.1 | Very low | 58 Ų | 58 | 86 Ų | 86 | 60% | 0.598 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.7 | 29.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | D115 | G113-D115 VanDerWaalsContact C-N 3.33Å; G113-D115 PolarHBondContact O-N 2.81Å |
| 114 | H | 32.7 | Very low | 30.8 | Very low | 130 Ų | 130 | 88.4 Ų | 88.4 | 60% | 0.602 | 50% | 0.501 | S | S | * | . | | | trans | -71.3 | 98 | 173.2 | -127.2 | -80.1 | 0 | 0 | 0 | 106.6 | H112 D116 | H112-H114 PolarHBondContact O-N 3.05Å; H114-D116 IonicContact CE1-OD2 3.14Å; H114-D116 PolarHBondContact CE1-OD2 3.23Å; H114-D116 VanDerWaalsContact CE1-OD2 3.27Å; H114-D116 IonicContact ND1-OD2 3.93Å; H114-D116 PolarHBondContact ND1-OD2 2.84Å; H114-D116 PolarHBondContact O-N 2.67Å |
| 115 | D | 31.5 | Very low | 30.4 | Very low | 158 Ų | 158 | 90.1 Ų | 90.1 | 85% | 0.845 | 51% | 0.512 | S | S | * | . | | | trans | -61.9 | 22.1 | 174.8 | -88.7 | -32.6 | 0 | 0 | 0 | 113.2 | G113 A117 | G113-D115 VanDerWaalsContact C-N 3.33Å; G113-D115 PolarHBondContact O-N 2.81Å; D115-A117 PolarHBondContact O-N 3.32Å |
| 116 | D | 30.2 | Very low | 30 | Very low | 84 Ų | 84 | 93.8 Ų | 93.8 | 45% | 0.449 | 53% | 0.529 | S | S | . | . | | | trans | -81.8 | 70.7 | 168.3 | -68.6 | -40.1 | 0 | 0 | 0 | 109 | H114 N118 N119 | H114-D116 IonicContact CE1-OD2 3.14Å; H114-D116 PolarHBondContact CE1-OD2 3.23Å; H114-D116 VanDerWaalsContact CE1-OD2 3.27Å; H114-D116 IonicContact ND1-OD2 3.93Å; H114-D116 PolarHBondContact ND1-OD2 2.84Å; H114-D116 PolarHBondContact O-N 2.67Å; D116-N118 PolarHBondContact O-N 3.22Å; D116-N119 PolarHBondContact O-N 3.35Å |
| 117 | A | 29.6 | Very low | 29.7 | Very low | 54 Ų | 54 | 95.7 Ų | 95.7 | 45% | 0.446 | 54% | 0.543 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -52.8 | -7.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | D115 Q225 | D115-A117 PolarHBondContact O-N 3.32Å; A117-Q225 PolarHBondContact O-NE2 2.98Å; A117-Q225 PolarHBondContact O-OE1 3.19Å |
| 118 | N | 29.9 | Very low | 29.2 | Very low | 142 Ų | 142 | 106 Ų | 106 | 76% | 0.759 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.3 | -8.2 | 178.8 | -69.9 | -18.7 | 0 | 0 | 0 | 115 | D116 | D116-N118 PolarHBondContact O-N 3.22Š|
| 119 | N | 28.5 | Very low | 28.9 | Very low | 119 Ų | 119 | 106.2 Ų | 106.2 | 64% | 0.636 | 60% | 0.595 | S | S | * | * | S | Bend | trans | -109.8 | 7.4 | -173.4 | -78.1 | -16.4 | 0 | 0 | 0 | 115.1 | D116 L121 | D116-N119 PolarHBondContact O-N 3.35Å; N119-L121 VanDerWaalsContact C-N 3.32Å; N119-L121 PolarHBondContact O-N 3.02Å |
| 120 | L | 26.9 | Very low | 28.6 | Very low | 90 Ų | 90 | 113.9 Ų | 113.9 | 47% | 0.471 | 62% | 0.624 | S | S | . | * | | | trans | -92.3 | 59.3 | 177.4 | -69.2 | 168.7 | 0 | 0 | 0 | 111.4 | A109 | A109-L120 HydrophobicContact CB-CD2 3.64Š|
| 121 | L | 24.6 | Very low | 28.2 | Very low | 99 Ų | 99 | 114 Ų | 114 | 52% | 0.518 | 63% | 0.631 | S | S | . | * | | | trans | -97.4 | 136 | 162.7 | -76.6 | 167.9 | 0 | 0 | 0 | 108.6 | N119 F123 | N119-L121 VanDerWaalsContact C-N 3.32Å; N119-L121 PolarHBondContact O-N 3.02Å; L121-F123 HydrophobicContact CB-CD2 3.89Å; L121-F123 HydrophobicContact CB-CE2 3.67Å; L121-F123 HydrophobicContact CB-CZ 4.12Å; L121-F123 HydrophobicContact CD1-CE2 4.27Å; L121-F123 HydrophobicContact CD1-CZ 3.98Å; L121-F123 WeakPolarHBondContact O-CD2 3.49Å; L121-F123 PolarHBondContact O-N 3.47Å |
| 122 | P | 28.1 | Very low | 27.8 | Very low | 91 Ų | 91 | 121.2 Ų | 121.2 | 59% | 0.591 | 67% | 0.668 | S | S | * | * | | | trans | -66.3 | 86.9 | 165.4 | 28.4 | -30.2 | 0 | 0 | 0 | 107.3 | C124 | P122-C124 VanDerWaalsContact C-N 3.25Å; P122-C124 PolarHBondContact O-N 3.26Å |
| 123 | F | 25.5 | Very low | 27.3 | Very low | 130 Ų | 130 | 123.6 Ų | 123.6 | 57% | 0.57 | 69% | 0.685 | S | S | * | * | | | trans | -73.1 | 86.8 | 172.6 | -78.7 | -77 | 0 | 0 | 0 | 108.3 | L121 T125 | L121-F123 HydrophobicContact CB-CD2 3.89Å; L121-F123 HydrophobicContact CB-CE2 3.67Å; L121-F123 HydrophobicContact CB-CZ 4.12Å; L121-F123 HydrophobicContact CD1-CE2 4.27Å; L121-F123 HydrophobicContact CD1-CZ 3.98Å; L121-F123 WeakPolarHBondContact O-CD2 3.49Å; L121-F123 PolarHBondContact O-N 3.47Å; F123-T125 HydrophobicContact CB-CG2 3.97Å; F123-T125 HydrophobicContact CD1-CG2 3.69Å; F123-T125 HydrophobicContact CG-CG2 4.26Å; F123-T125 PolarHBondContact O-N 3.27Å |
| 124 | C | 23.9 | Very low | 27.1 | Very low | 116 Ų | 116 | 124.7 Ų | 124.7 | 78% | 0.784 | 69% | 0.688 | S | S | * | * | | | trans | -65.4 | 77.5 | 149.5 | -69.6 | 0 | 0 | 0 | 0 | 107.4 | P122 | P122-C124 VanDerWaalsContact C-N 3.25Å; P122-C124 PolarHBondContact O-N 3.26Å |
| 125 | T | 26.4 | Very low | 26.8 | Very low | 92 Ų | 92 | 125 Ų | 125 | 56% | 0.564 | 69% | 0.692 | S | S | * | * | | | trans | -100.8 | 85.9 | 175.4 | 39.4 | 0 | 0 | 0 | 0 | 109.1 | F123 S127 | F123-T125 HydrophobicContact CB-CG2 3.97Å; F123-T125 HydrophobicContact CD1-CG2 3.69Å; F123-T125 HydrophobicContact CG-CG2 4.26Å; F123-T125 PolarHBondContact O-N 3.27Å; T125-S127 PolarHBondContact O-N 3.19Å |
| 126 | E | 24.1 | Very low | 26.6 | Very low | 199 Ų | 199 | 121.5 Ų | 121.5 | 93% | 0.93 | 68% | 0.677 | S | S | * | * | | | trans | -67.7 | 77 | 149 | -75.3 | -172.5 | 155.6 | 0 | 0 | 107.6 | | |
| 127 | S | 27 | Very low | 26.4 | Very low | 90 Ų | 90 | 122.5 Ų | 122.5 | 63% | 0.629 | 69% | 0.691 | S | S | * | * | | | trans | -157.5 | 75.4 | 174.1 | -54.4 | 0 | 0 | 0 | 0 | 109.4 | T125 S129 | T125-S127 PolarHBondContact O-N 3.19Å; S127-S129 PolarHBondContact O-N 2.88Å |
| 128 | Y | 24.1 | Very low | 26.2 | Very low | 246 Ų | 246 | 123.5 Ų | 123.5 | 97% | 0.965 | 69% | 0.688 | S | S | * | * | | | trans | -57.5 | 107.6 | 154.7 | -101.4 | -98.5 | 0 | 0 | 0 | 107.4 | | |
| 129 | S | 25.7 | Very low | 25.9 | Very low | 95 Ų | 95 | 122 Ų | 122 | 66% | 0.664 | 68% | 0.684 | S | S | * | * | | | trans | -152.6 | 89.4 | 171.5 | 165.7 | 0 | 0 | 0 | 0 | 107.6 | S127 A131 | S127-S129 PolarHBondContact O-N 2.88Å; S129-A131 PolarHBondContact O-N 3.14Å |
| 130 | E | 25.3 | Very low | 25.8 | Very low | 199 Ų | 199 | 120.2 Ų | 120.2 | 93% | 0.93 | 68% | 0.68 | S | S | * | * | | | trans | 21.8 | 83.1 | 150 | -63.7 | 180 | 161.5 | 0 | 0 | 116 | | |
| 131 | A | 26.6 | Very low | 25.6 | Very low | 92 Ų | 92 | 119.2 Ų | 119.2 | 76% | 0.76 | 67% | 0.674 | S | S | * | * | | | trans | -149.1 | 111.8 | 155.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | S129 D133 | S129-A131 PolarHBondContact O-N 3.14Å; A131-D133 PolarHBondContact O-N 3.39Å |
| 132 | N | 25.9 | Very low | 25.6 | Very low | 158 Ų | 158 | 118.8 Ų | 118.8 | 85% | 0.845 | 67% | 0.672 | S | S | * | * | | | trans | -43.9 | 118.9 | 169.4 | -60.1 | -55.2 | 0 | 0 | 0 | 110.3 | | |
| 133 | D | 26.9 | Very low | 25.5 | Very low | 153 Ų | 153 | 121.4 Ų | 121.4 | 82% | 0.818 | 67% | 0.674 | S | S | * | * | S | Bend | trans | 178.1 | 110.6 | 136.9 | -88.2 | -30.4 | 0 | 0 | 0 | 110.7 | A131 M135 | A131-D133 PolarHBondContact O-N 3.39Å; D133-M135 PolarHBondContact O-N 3.1Å; D133-M135 VanDerWaalsContact O-N 3.16Å |
| 134 | A | 25.4 | Very low | 25.5 | Very low | 82 Ų | 82 | 121.4 Ų | 121.4 | 68% | 0.678 | 68% | 0.676 | S | S | * | * | | | trans | 21.9 | 75.5 | 158.6 | 0 | 0 | 0 | 0 | 0 | 118.1 | | |
| 135 | M | 26.6 | Very low | 25.7 | Very low | 137 Ų | 137 | 124.9 Ų | 124.9 | 68% | 0.675 | 68% | 0.681 | S | S | * | * | | | trans | -92.2 | 130.2 | 170.1 | -160.1 | 163.1 | 74.4 | 0 | 0 | 110.5 | D133 S137 | D133-M135 PolarHBondContact O-N 3.1Å; D133-M135 VanDerWaalsContact O-N 3.16Å; M135-S137 PolarHBondContact O-N 3.36Å |
| 136 | P | 27.6 | Very low | 25.6 | Very low | 83 Ų | 83 | 128.6 Ų | 128.6 | 54% | 0.539 | 70% | 0.697 | S | S | . | * | | | trans | -65.1 | 119.1 | 171.9 | 24.8 | -30.4 | 0 | 0 | 0 | 109.2 | I138 | P136-I138 PolarHBondContact O-N 2.97Å; P136-I138 VanDerWaalsContact O-N 3.08Å |
| 137 | S | 24.8 | Very low | 25.6 | Very low | 106 Ų | 106 | 123.6 Ų | 123.6 | 74% | 0.741 | 68% | 0.68 | S | S | * | * | | | trans | -66.3 | 108.5 | -179.6 | 66.2 | 0 | 0 | 0 | 0 | 110.3 | M135 V139 | M135-S137 PolarHBondContact O-N 3.36Å; S137-V139 PolarHBondContact O-N 2.05Å |
| 138 | I | 26.6 | Very low | 25.4 | Very low | 75 Ų | 75 | 127.6 Ų | 127.6 | 39% | 0.385 | 69% | 0.694 | S | S | . | * | | | trans | -81.1 | 109.3 | 168.5 | -65.2 | 136.6 | 0 | 0 | 0 | 107.1 | T104 P136 | T104-I138 WeakPolarHBondContact OG1-CD1 3.47Å; P136-I138 PolarHBondContact O-N 2.97Å; P136-I138 VanDerWaalsContact O-N 3.08Å |
| 139 | V | 24 | Very low | 25.5 | Very low | 109 Ų | 109 | 120.4 Ų | 120.4 | 66% | 0.661 | 67% | 0.672 | S | S | * | * | | | trans | -95.4 | 110.9 | 175.5 | -179.7 | 0 | 0 | 0 | 0 | 108.1 | S137 I141 | S137-V139 PolarHBondContact O-N 2.05Å; V139-I141 HydrophobicContact CG1-CG1 4.39Å; V139-I141 PolarHBondContact O-N 3.34Å |
| 140 | C | 25.6 | Very low | 25.4 | Very low | 82 Ų | 82 | 120.1 Ų | 120.1 | 55% | 0.554 | 67% | 0.668 | S | S | * | * | | | trans | -69.9 | 119.7 | 169.4 | -61.8 | 0 | 0 | 0 | 0 | 108.9 | | |
| 141 | I | 23.8 | Very low | 25.3 | Very low | 69 Ų | 69 | 115.9 Ų | 115.9 | 35% | 0.354 | 66% | 0.66 | S | S | . | * | | | trans | -100.7 | 117.4 | 176.6 | -58.2 | 176.2 | 0 | 0 | 0 | 108 | V139 K143 L149 | V139-I141 HydrophobicContact CG1-CG1 4.39Å; V139-I141 PolarHBondContact O-N 3.34Å; I141-K143 PolarHBondContact O-N 3.4Å; I141-L149 HydrophobicContact CG2-CD2 3.61Å |
| 142 | D | 24.2 | Very low | 25.1 | Very low | 90 Ų | 90 | 117.7 Ų | 117.7 | 48% | 0.481 | 66% | 0.657 | S | S | . | * | | | trans | -67.9 | 112.7 | 173 | -162.9 | -3.9 | 0 | 0 | 0 | 108.6 | Q144 | D142-Q144 PolarHBondContact O-N 3.02Š|
| 143 | K | 26.2 | Very low | 25 | Very low | 146 Ų | 146 | 114.9 Ų | 114.9 | 64% | 0.635 | 65% | 0.648 | S | S | * | * | | | trans | -96.2 | 77.3 | -177.3 | -154.7 | -178.9 | -172.2 | -173.2 | 0 | 108.7 | C95 I141 E145 | C95-K143 VanDerWaalsContact SG-CB 3.51Å; I141-K143 PolarHBondContact O-N 3.4Å; K143-E145 PolarHBondContact O-N 2.94Å |
| 144 | Q | 25.2 | Very low | 24.7 | Very low | 131 Ų | 131 | 113.9 Ų | 113.9 | 61% | 0.612 | 64% | 0.642 | S | S | * | * | | | trans | -63.9 | 120.7 | 163.3 | -78.3 | -170.2 | 2.3 | 0 | 0 | 109 | D142 N146 T147 | D142-Q144 PolarHBondContact O-N 3.02Å; Q144-N146 PolarHBondContact O-N 3.06Å; Q144-T147 PolarHBondContact O-N 3.04Å; Q144-T147 PolarHBondContact O-OG1 2.93Å |
| 145 | E | 27.2 | Very low | 24.6 | Very low | 189 Ų | 189 | 115.6 Ų | 115.6 | 88% | 0.883 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -47.4 | 124 | 168.3 | -66.8 | -174.9 | 148.2 | 0 | 0 | 109 | K143 | K143-E145 PolarHBondContact O-N 2.94Š|
| 146 | N | 25.9 | Very low | 24.4 | Very low | 169 Ų | 169 | 115.3 Ų | 115.3 | 90% | 0.904 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 87.1 | 13 | 179.4 | -60.7 | -14.7 | 0 | 0 | 0 | 120.1 | Q144 | Q144-N146 PolarHBondContact O-N 3.06Š|
| 147 | T | 23.9 | Very low | 24.2 | Very low | 94 Ų | 94 | 117.5 Ų | 117.5 | 58% | 0.577 | 66% | 0.663 | S | S | * | * | | | trans | -104 | 116 | 165.5 | 32.8 | 0 | 0 | 0 | 0 | 111.9 | Q144 L149 | Q144-T147 PolarHBondContact O-N 3.04Å; Q144-T147 PolarHBondContact O-OG1 2.93Å; T147-L149 PolarHBondContact O-N 2.75Å |
| 148 | L | 22.7 | Very low | 24.1 | Very low | 174 Ų | 174 | 118.6 Ų | 118.6 | 91% | 0.911 | 67% | 0.665 | S | S | * | * | | | trans | -52.3 | 110.4 | 171.2 | -75.2 | 155.3 | 0 | 0 | 0 | 108.7 | | |
| 149 | L | 25.7 | Very low | 24 | Very low | 95 Ų | 95 | 120.9 Ų | 120.9 | 50% | 0.497 | 68% | 0.678 | S | S | . | * | | | trans | -62.2 | 128 | 173.4 | -76.9 | 166.6 | 0 | 0 | 0 | 108.6 | I141 T147 S151 | I141-L149 HydrophobicContact CG2-CD2 3.61Å; T147-L149 PolarHBondContact O-N 2.75Å; L149-S151 PolarHBondContact O-N 2.93Å |
| 150 | P | 23.1 | Very low | 24.1 | Very low | 90 Ų | 90 | 123.9 Ų | 123.9 | 58% | 0.584 | 68% | 0.682 | S | S | * | * | | | trans | -58.5 | 137.8 | 173.2 | 23 | -29 | 0 | 0 | 0 | 108.7 | D152 | P150-D152 PolarHBondContact O-N 2.98Š|
| 151 | S | 23.1 | Very low | 24 | Very low | 110 Ų | 110 | 129.7 Ų | 129.7 | 77% | 0.769 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | 21.4 | -171.9 | -41.5 | 0 | 0 | 0 | 0 | 114.5 | L149 | L149-S151 PolarHBondContact O-N 2.93Š|
| 152 | D | 23.6 | Very low | 24.1 | Very low | 130 Ų | 130 | 131.9 Ų | 131.9 | 70% | 0.695 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.6 | 13.2 | -165.4 | -61.8 | -34.8 | 0 | 0 | 0 | 113.4 | P150 L154 | P150-D152 PolarHBondContact O-N 2.98Å; D152-L154 PolarHBondContact O-N 3.31Å |
| 153 | C | 21.9 | Very low | 24.2 | Very low | 98 Ų | 98 | 137.1 Ų | 137.1 | 66% | 0.662 | 73% | 0.728 | S | S | * | * | | | trans | -78.6 | 57.5 | 165 | -65.2 | 0 | 0 | 0 | 0 | 110.1 | | |
| 154 | L | 21.7 | Very low | 24.4 | Very low | 132 Ų | 132 | 138.1 Ų | 138.1 | 69% | 0.691 | 74% | 0.74 | S | S | * | * | | | trans | -88.2 | 116.8 | 169.8 | -90.5 | 157.6 | 0 | 0 | 0 | 108.4 | D152 T156 | D152-L154 PolarHBondContact O-N 3.31Å; L154-T156 PolarHBondContact O-N 3.48Å |
| 155 | T | 23 | Very low | 24.5 | Very low | 119 Ų | 119 | 134.9 Ų | 134.9 | 73% | 0.73 | 74% | 0.743 | S | S | * | * | | | trans | -18.8 | 108 | 154.6 | 43.1 | 0 | 0 | 0 | 0 | 113.7 | | |
| 156 | T | 21.7 | Very low | 24.6 | Very low | 131 Ų | 131 | 133.5 Ų | 133.5 | 80% | 0.804 | 74% | 0.741 | S | S | * | * | | | trans | -95.4 | 84.6 | 155.8 | 21.1 | 0 | 0 | 0 | 0 | 107.6 | L154 T158 | L154-T156 PolarHBondContact O-N 3.48Å; T156-T158 VanDerWaalsContact C-N 3.33Å; T156-T158 PolarHBondContact O-N 3.07Å; T156-T158 VanDerWaalsContact O-N 3.12Å |
| 157 | T | 23.8 | Very low | 24.7 | Very low | 128 Ų | 128 | 130.8 Ų | 130.8 | 79% | 0.785 | 74% | 0.735 | S | S | * | * | | | trans | -65.6 | 97.6 | 153.9 | 39.2 | 0 | 0 | 0 | 0 | 106.9 | D159 | T157-D159 VanDerWaalsContact C-N 3.33Å; T157-D159 PolarHBondContact O-N 3.47Å |
| 158 | T | 24.2 | Very low | 25 | Very low | 130 Ų | 130 | 132.3 Ų | 132.3 | 80% | 0.798 | 74% | 0.744 | S | S | * | * | | | trans | -73.2 | 94.9 | 166.7 | 14.1 | 0 | 0 | 0 | 0 | 108.3 | T156 K160 | T156-T158 VanDerWaalsContact C-N 3.33Å; T156-T158 PolarHBondContact O-N 3.07Å; T156-T158 VanDerWaalsContact O-N 3.12Å; T158-K160 PolarHBondContact O-N 2.8Å; T158-K160 VanDerWaalsContact O-N 3.08Å |
| 159 | D | 23.5 | Very low | 25.3 | Very low | 123 Ų | 123 | 131.1 Ų | 131.1 | 66% | 0.658 | 74% | 0.739 | S | S | * | * | | | trans | -52.3 | 103.5 | 164.4 | -161 | -3.3 | 0 | 0 | 0 | 108.5 | T157 R161 | T157-D159 VanDerWaalsContact C-N 3.33Å; T157-D159 PolarHBondContact O-N 3.47Å; D159-R161 PolarHBondContact O-N 3.09Å; D159-R161 IonicContact OD2-NE 3.58Å |
| 160 | K | 26.1 | Very low | 25.6 | Very low | 171 Ų | 171 | 132.1 Ų | 132.1 | 74% | 0.743 | 75% | 0.754 | S | S | * | * | | | trans | -73.9 | 77 | 169.2 | -89.3 | -172.7 | 176 | 179.7 | 0 | 108.4 | T158 | T158-K160 PolarHBondContact O-N 2.8Å; T158-K160 VanDerWaalsContact O-N 3.08Å |
| 161 | R | 23.3 | Very low | 25.9 | Very low | 205 Ų | 205 | 132 Ų | 132 | 77% | 0.774 | 76% | 0.76 | S | S | * | * | | | trans | -102.1 | 84.1 | 150.6 | -67.2 | -170 | -160.4 | -169.2 | 2.4 | 108.1 | D159 | D159-R161 PolarHBondContact O-N 3.09Å; D159-R161 IonicContact OD2-NE 3.58Å |
| 162 | T | 27 | Very low | 26.2 | Very low | 115 Ų | 115 | 135.8 Ų | 135.8 | 71% | 0.706 | 76% | 0.763 | S | S | * | * | | | trans | -136.1 | 99.1 | 162.7 | 39.9 | 0 | 0 | 0 | 0 | 105.7 | | |
| 163 | F | 26.1 | Very low | 26.6 | Very low | 199 Ų | 199 | 141 Ų | 141 | 87% | 0.873 | 77% | 0.773 | S | S | * | * | | | | 78.8 | 83.4 | 93.9 | -107.1 | -91.6 | 0 | 0 | 0 | 109.2 | | |
| 164 | D | 30.2 | Very low | 26.9 | Very low | 167 Ų | 167 | 143 Ų | 143 | 89% | 0.893 | 78% | 0.777 | S | S | * | * | | | trans | -148.1 | 123.7 | 147.8 | -93.9 | -35.5 | 0 | 0 | 0 | 108.3 | | |
| 165 | G | 27.4 | Very low | 27.5 | Very low | 64 Ų | 64 | 145.6 Ų | 145.6 | 66% | 0.66 | 79% | 0.785 | S | S | * | * | | | trans | 64.5 | 113.6 | 146.7 | 0 | 0 | 0 | 0 | 0 | 118.7 | | |
| 166 | D | 28.6 | Very low | 27.6 | Very low | 159 Ų | 159 | 144 Ų | 144 | 85% | 0.85 | 79% | 0.793 | S | S | * | * | | | trans | 82.5 | 116.1 | 146.9 | -56.4 | -26.5 | 0 | 0 | 0 | 118.9 | | |
| 167 | S | 27.3 | Very low | 27.7 | Very low | 112 Ų | 112 | 141.8 Ų | 141.8 | 78% | 0.783 | 80% | 0.795 | S | S | * | * | | | trans | 59.3 | 121.2 | 133 | -138.3 | 0 | 0 | 0 | 0 | 116 | | |
| 168 | V | 32 | Very low | 27.7 | Very low | 126 Ų | 126 | 141.1 Ų | 141.1 | 76% | 0.764 | 80% | 0.796 | S | S | * | * | | | | -170.1 | 145 | 57.1 | -170.1 | 0 | 0 | 0 | 0 | 106.7 | | |
| 169 | D | 27.9 | Very low | 27.7 | Very low | 150 Ų | 150 | 142 Ų | 142 | 80% | 0.802 | 80% | 0.801 | S | S | * | * | | | trans | -29.7 | 133.1 | 159.2 | -83.7 | -54.9 | 0 | 0 | 0 | 115.1 | | |
| 170 | S | 32.7 | Very low | 27.7 | Very low | 116 Ų | 116 | 141 Ų | 141 | 81% | 0.811 | 80% | 0.804 | S | S | * | * | | | | 171.8 | 100 | 123.4 | -77.3 | 0 | 0 | 0 | 0 | 112.6 | | |
| 171 | A | 28 | Very low | 27.7 | Very low | 87 Ų | 87 | 139.9 Ų | 139.9 | 72% | 0.719 | 81% | 0.811 | S | S | * | * | | | trans | 24.7 | 125.4 | 131 | 0 | 0 | 0 | 0 | 0 | 121 | | |
| 172 | K | 31.2 | Very low | 27.7 | Very low | 190 Ų | 190 | 141.6 Ų | 141.6 | 83% | 0.826 | 82% | 0.818 | S | S | * | * | | | trans | 65.2 | 117.2 | 132.7 | -64.7 | 177.4 | 175.2 | 176 | 0 | 118 | | |
| 173 | R | 31.9 | Very low | 27.6 | Very low | 240 Ų | 240 | 147.9 Ų | 147.9 | 91% | 0.906 | 83% | 0.828 | S | S | * | * | | | | 178.6 | 131.4 | 95.2 | -93.8 | 177.8 | -166.3 | 168.9 | 4.9 | 111.4 | | |
| 174 | D | 28.3 | Very low | 27.5 | Very low | 139 Ų | 139 | 146.5 Ų | 146.5 | 74% | 0.743 | 83% | 0.83 | S | S | * | * | | | trans | -64.1 | 177.6 | 168.7 | -76 | -55.9 | 0 | 0 | 0 | 114 | | |
| 175 | H | 32.4 | Very low | 27.3 | Very low | 187 Ų | 187 | 144.3 Ų | 144.3 | 87% | 0.866 | 82% | 0.824 | S | S | * | * | | | trans | 99.3 | 110.1 | 167.9 | -43.8 | -49.4 | 0 | 0 | 0 | 112.1 | | |
| 176 | G | 26 | Very low | 27.2 | Very low | 86 Ų | 86 | 145.7 Ų | 145.7 | 89% | 0.887 | 83% | 0.83 | S | S | * | * | | | cis | 127.4 | 104.8 | 29.1 | 0 | 0 | 0 | 0 | 0 | 107 | | |
| 177 | G | 24.3 | Very low | 27.1 | Very low | 83 Ų | 83 | 148.2 Ų | 148.2 | 86% | 0.856 | 83% | 0.833 | S | S | * | * | | | trans | -146.8 | 98.2 | -179.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | | |
| 178 | S | 23.3 | Very low | 27 | Very low | 114 Ų | 114 | 146.6 Ų | 146.6 | 80% | 0.797 | 83% | 0.834 | S | S | * | * | | | trans | -90.6 | 135.2 | -174.4 | -175.5 | 0 | 0 | 0 | 0 | 111.4 | | |
| 179 | T | 25 | Very low | 26.9 | Very low | 148 Ų | 148 | 145.3 Ų | 145.3 | 91% | 0.908 | 84% | 0.837 | S | S | * | * | | | trans | -132.2 | 113.1 | 153.7 | 42.2 | 0 | 0 | 0 | 0 | 109.6 | | |
| 180 | S | 23.2 | Very low | 27.1 | Very low | 103 Ų | 103 | 142.1 Ų | 142.1 | 72% | 0.72 | 82% | 0.824 | S | S | * | * | | | trans | -82.4 | 137.6 | 179.6 | 78.6 | 0 | 0 | 0 | 0 | 111.7 | | |
| 181 | V | 25.7 | Very low | 27 | Very low | 148 Ų | 148 | 143.2 Ų | 143.2 | 90% | 0.897 | 82% | 0.821 | S | S | * | * | | | trans | -132.3 | 133.4 | 151.4 | -174.7 | 0 | 0 | 0 | 0 | 108.5 | | |
| 182 | R | 24.2 | Very low | 27.5 | Very low | 240 Ų | 240 | 146.6 Ų | 146.6 | 91% | 0.906 | 82% | 0.815 | S | S | * | * | | | trans | -67.6 | 141.9 | -161.5 | -66.9 | 170.7 | 175.1 | 161.5 | -2.8 | 114.2 | | |
| 183 | R | 24.1 | Very low | 27.6 | Very low | 247 Ų | 247 | 145.4 Ų | 145.4 | 93% | 0.932 | 81% | 0.81 | S | S | * | * | | | trans | -72.8 | 140 | 168.1 | -77.6 | 177.3 | 168.7 | 151.6 | -3.3 | 112 | | |
| 184 | L | 25 | Very low | 27.8 | Very low | 171 Ų | 171 | 141.4 Ų | 141.4 | 90% | 0.895 | 81% | 0.807 | S | S | * | * | | | trans | -113.9 | 138.9 | 155.5 | -71.6 | 170.4 | 0 | 0 | 0 | 108.2 | | |
| 185 | P | 25 | Very low | 27.6 | Very low | 121 Ų | 121 | 138 Ų | 138 | 79% | 0.786 | 80% | 0.804 | S | S | * | * | | | trans | -102.3 | 165 | -170.2 | 37.9 | -32.8 | 0 | 0 | 0 | 115.4 | | |
| 186 | A | 24.7 | Very low | 27.3 | Very low | 93 Ų | 93 | 136.2 Ų | 136.2 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | | | trans | 85.3 | 122.7 | 153 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 187 | K | 27.2 | Very low | 27.5 | Very low | 211 Ų | 211 | 139.3 Ų | 139.3 | 92% | 0.917 | 78% | 0.781 | S | S | * | * | | | | -170.8 | 142 | 56.2 | -109.1 | 176 | 175.8 | 176 | 0 | 109.3 | | |
| 188 | G | 25.8 | Very low | 27.5 | Very low | 79 Ų | 79 | 145.4 Ų | 145.4 | 81% | 0.814 | 78% | 0.779 | S | S | * | * | | | trans | 93.4 | 59.8 | 158.2 | 0 | 0 | 0 | 0 | 0 | 116.9 | | |
| 189 | A | 29.1 | Very low | 27.6 | Very low | 99 Ų | 99 | 147.3 Ų | 147.3 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | | | trans | -88.6 | 121.2 | 157.5 | 0 | 0 | 0 | 0 | 0 | 108.4 | D191 | A189-D191 PolarHBondContact O-N 3.19Š|
| 190 | P | 32.5 | Very low | 27.6 | Very low | 82 Ų | 82 | 145.4 Ų | 145.4 | 53% | 0.532 | 78% | 0.776 | S | S | . | * | | | trans | -70.1 | 123.2 | 166.8 | -9.1 | 25 | 0 | 0 | 0 | 108.8 | W192 | P190-W192 VanDerWaalsContact O-CD1 3.27Å; P190-W192 PolarHBondContact O-N 3.26Å |
| 191 | D | 30.8 | Very low | 27.7 | Very low | 140 Ų | 140 | 149.3 Ų | 149.3 | 75% | 0.749 | 79% | 0.785 | S | S | * | * | | | trans | -63.7 | 113.4 | 172.4 | -158.3 | 4.9 | 0 | 0 | 0 | 108.9 | A189 | A189-D191 PolarHBondContact O-N 3.19Š|
| 192 | W | 37.6 | Very low | 27.7 | Very low | 158 Ų | 158 | 149.6 Ų | 149.6 | 60% | 0.598 | 78% | 0.781 | S | S | * | * | | | trans | -96.9 | 88 | 174.6 | -76.3 | 89.8 | 0 | 0 | 0 | 108.8 | P190 R197 | P190-W192 VanDerWaalsContact O-CD1 3.27Å; P190-W192 PolarHBondContact O-N 3.26Å; W192-R197 HydrophobicContact CH2-CB 3.57Å; W192-R197 HydrophobicContact CH2-CG 3.42Å; W192-R197 VanDerWaalsContact CH2-CG 3.42Å; W192-R197 HydrophobicContact CZ2-CG 4.36Å; W192-R197 HydrophobicContact CZ3-CB 3.93Å; W192-R197 HydrophobicContact CZ3-CG 3.54Å |
| 193 | K | 33.1 | Very low | 27.6 | Very low | 164 Ų | 164 | 149.7 Ų | 149.7 | 71% | 0.713 | 78% | 0.782 | S | S | * | * | | | trans | -95.9 | 129.2 | 156.6 | -71.8 | -163.4 | 175.3 | -172.8 | 0 | 108.5 | | |
| 194 | D | 35.6 | Very low | 27.5 | Very low | 156 Ų | 156 | 142 Ų | 142 | 83% | 0.834 | 77% | 0.766 | S | S | * | * | S | Bend | trans | 57.7 | 97.4 | 162.7 | -53.3 | -34.8 | 0 | 0 | 0 | 117.5 | | |
| 195 | G | 26.2 | Very low | 27.4 | Very low | 67 Ų | 67 | 145.4 Ų | 145.4 | 69% | 0.691 | 77% | 0.767 | S | S | * | * | S | Bend | trans | 78.2 | 134.2 | 143.7 | 0 | 0 | 0 | 0 | 0 | 118.5 | | |
| 196 | E | 26.1 | Very low | 27.1 | Very low | 151 Ų | 151 | 146.1 Ų | 146.1 | 71% | 0.706 | 77% | 0.769 | S | S | * | * | | | trans | 37.2 | 104.8 | 160.7 | -85.7 | -173 | 118.8 | 0 | 0 | 118.2 | R198 | E196-R198 IonicContact OE1-CZ 3.83Å; E196-R198 IonicContact OE1-NE 3.14Å; E196-R198 PolarHBondContact OE1-NE 3.05Å; E196-R198 VanDerWaalsContact OE1-NE 3.14Å; E196-R198 IonicContact OE1-NH2 3.27Å; E196-R198 PolarHBondContact OE1-NH2 3.39Å; E196-R198 VanDerWaalsContact OE1-NH2 3.14Å |
| 197 | R | 28.4 | Very low | 27 | Very low | 150 Ų | 150 | 147.4 Ų | 147.4 | 57% | 0.566 | 77% | 0.767 | S | S | * | * | | | trans | -106.3 | 104.5 | 143.6 | -71.5 | -172.8 | 178.4 | 175.3 | -4.7 | 110.7 | W192 | W192-R197 HydrophobicContact CH2-CB 3.57Å; W192-R197 HydrophobicContact CH2-CG 3.42Å; W192-R197 VanDerWaalsContact CH2-CG 3.42Å; W192-R197 HydrophobicContact CZ2-CG 4.36Å; W192-R197 HydrophobicContact CZ3-CB 3.93Å; W192-R197 HydrophobicContact CZ3-CG 3.54Å |
| 198 | R | 24.3 | Very low | 26.7 | Very low | 212 Ų | 212 | 144.5 Ų | 144.5 | 80% | 0.8 | 76% | 0.761 | S | S | * | * | | | trans | -70.3 | 123.8 | 148.1 | -60.4 | 177.4 | -174.8 | -167 | -1.5 | 107.1 | E196 | E196-R198 IonicContact OE1-CZ 3.83Å; E196-R198 IonicContact OE1-NE 3.14Å; E196-R198 PolarHBondContact OE1-NE 3.05Å; E196-R198 VanDerWaalsContact OE1-NE 3.14Å; E196-R198 IonicContact OE1-NH2 3.27Å; E196-R198 PolarHBondContact OE1-NH2 3.39Å; E196-R198 VanDerWaalsContact OE1-NH2 3.14Å |
| 199 | M | 25.8 | Very low | 26.6 | Very low | 153 Ų | 153 | 146.9 Ų | 146.9 | 75% | 0.754 | 76% | 0.761 | S | S | * | * | | | trans | -106.6 | 129.7 | 164 | -71 | -154.3 | -168.2 | 0 | 0 | 109.1 | M201 | M199-M201 PolarHBondContact O-N 3.47Š|
| 200 | A | 25.6 | Very low | 26.3 | Very low | 108 Ų | 108 | 147.5 Ų | 147.5 | 89% | 0.893 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 120.2 | -175.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 201 | M | 25.9 | Very low | 25.8 | Very low | 186 Ų | 186 | 153.2 Ų | 153.2 | 92% | 0.916 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -89.6 | 119.4 | 165.6 | -99.6 | -159.1 | 159.9 | 0 | 0 | 109.6 | M199 | M199-M201 PolarHBondContact O-N 3.47Š|
| 202 | D | 25.1 | Very low | 25.4 | Very low | 153 Ų | 153 | 155.1 Ų | 155.1 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 129.4 | 178.5 | -139.9 | -13.5 | 0 | 0 | 0 | 110.6 | S204 | D202-S204 PolarHBondContact O-N 3.41Š|
| 203 | R | 22.8 | Very low | 24.7 | Very low | 243 Ų | 243 | 156.2 Ų | 156.2 | 92% | 0.917 | 79% | 0.792 | S | S | * | * | | | trans | -86.4 | 88.6 | -175.3 | -77.3 | 175.6 | 163.2 | 165.5 | -5.3 | 109.7 | | |
| 204 | S | 21.1 | Very low | 24.2 | Very low | 86 Ų | 86 | 151.6 Ų | 151.6 | 60% | 0.601 | 79% | 0.791 | S | S | * | * | | | trans | -159.2 | 54.6 | 169.4 | 68.8 | 0 | 0 | 0 | 0 | 114.5 | D202 | D202-S204 PolarHBondContact O-N 3.41Š|
| 205 | W | 21.9 | Very low | 23.6 | Very low | 241 Ų | 241 | 153 Ų | 153 | 91% | 0.913 | 79% | 0.792 | S | S | * | * | | | trans | -141.8 | 80 | 160.4 | -70.5 | 87.7 | 0 | 0 | 0 | 109 | | |
| 206 | V | 20.2 | Very low | 23.4 | Very low | 137 Ų | 137 | 154.7 Ų | 154.7 | 83% | 0.83 | 80% | 0.799 | S | S | * | * | | | trans | -107 | 102.9 | 161.1 | 178.8 | 0 | 0 | 0 | 0 | 105.2 | | |
| 207 | V | 23.1 | Very low | 23.3 | Very low | 119 Ų | 119 | 156.2 Ų | 156.2 | 72% | 0.721 | 80% | 0.804 | S | S | * | * | | | trans | -132.8 | 115.7 | 166.1 | 178 | 0 | 0 | 0 | 0 | 107.1 | T209 | V207-T209 PolarHBondContact O-N 2.97Š|
| 208 | D | 20.2 | Very low | 23 | Very low | 150 Ų | 150 | 154.3 Ų | 154.3 | 80% | 0.802 | 81% | 0.814 | S | S | * | * | | | trans | -47.6 | 120.4 | 177.4 | -70.7 | -53.1 | 0 | 0 | 0 | 112.3 | | |
| 209 | T | 24 | Very low | 23 | Very low | 130 Ų | 130 | 152.4 Ų | 152.4 | 80% | 0.798 | 82% | 0.818 | S | S | * | * | | | trans | -136.6 | 107.3 | 150.5 | 45.1 | 0 | 0 | 0 | 0 | 108.1 | V207 F211 | V207-T209 PolarHBondContact O-N 2.97Å; T209-F211 PolarHBondContact O-N 3.32Å |
| 210 | S | 22.2 | Very low | 22.8 | Very low | 111 Ų | 111 | 150.4 Ų | 150.4 | 78% | 0.776 | 82% | 0.819 | S | S | * | * | | | trans | -56.8 | 125.8 | 177.2 | 36.3 | 0 | 0 | 0 | 0 | 110.9 | Q212 | S210-Q212 PolarHBondContact O-N 3.18Š|
| 211 | F | 22.3 | Very low | 22.6 | Very low | 202 Ų | 202 | 149.1 Ų | 149.1 | 89% | 0.886 | 80% | 0.803 | S | S | * | * | | | trans | -66.4 | 99 | 167.7 | -130.2 | -97.8 | 0 | 0 | 0 | 108.1 | T209 | T209-F211 PolarHBondContact O-N 3.32Š|
| 212 | Q | 22.9 | Very low | 22.4 | Very low | 180 Ų | 180 | 145.1 Ų | 145.1 | 84% | 0.841 | 80% | 0.799 | S | S | * | * | | | trans | -93 | 104.5 | 158.6 | -82 | -167.1 | -18.3 | 0 | 0 | 107.7 | S210 G214 | S210-Q212 PolarHBondContact O-N 3.18Å; Q212-G214 PolarHBondContact O-N 3.04Å |
| 213 | Q | 22.7 | Very low | 22.4 | Very low | 182 Ų | 182 | 142.7 Ų | 142.7 | 85% | 0.85 | 79% | 0.785 | S | S | * | * | | | trans | -53.8 | 98.6 | 163 | -96.9 | 176.8 | -20.2 | 0 | 0 | 108.7 | | |
| 214 | G | 22.2 | Very low | 22.4 | Very low | 67 Ų | 67 | 140 Ų | 140 | 69% | 0.691 | 78% | 0.783 | S | S | * | * | | | trans | -93.1 | 120.4 | 165.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | Q212 A216 | Q212-G214 PolarHBondContact O-N 3.04Å; G214-A216 PolarHBondContact O-N 3Å |
| 215 | E | 22.2 | Very low | 22.6 | Very low | 185 Ų | 185 | 141.5 Ų | 141.5 | 86% | 0.864 | 78% | 0.781 | S | S | * | * | | | trans | -56.8 | 100.8 | 174.3 | -68.9 | 179.9 | 148.6 | 0 | 0 | 110.8 | K217 | E215-K217 PolarHBondContact O-N 2.96Š|
| 216 | A | 23.6 | Very low | 22.6 | Very low | 102 Ų | 102 | 136.6 Ų | 136.6 | 84% | 0.843 | 77% | 0.771 | S | S | * | * | | | trans | -79.2 | 102.5 | 168.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | G214 S218 | G214-A216 PolarHBondContact O-N 3Å; A216-S218 PolarHBondContact O-N 3.25Å |
| 217 | K | 22.2 | Very low | 22.7 | Very low | 184 Ų | 184 | 136.9 Ų | 136.9 | 80% | 0.8 | 77% | 0.772 | S | S | * | * | | | trans | -66.3 | 116.7 | 172.6 | -73 | -179 | 177.7 | 179.1 | 0 | 109.9 | E215 L219 | E215-K217 PolarHBondContact O-N 2.96Å; K217-L219 PolarHBondContact O-N 3.03Å |
| 218 | S | 23.1 | Very low | 22.7 | Very low | 110 Ų | 110 | 134.2 Ų | 134.2 | 77% | 0.769 | 77% | 0.769 | S | S | * | * | | | trans | -57.4 | 119.2 | 169.9 | 158.1 | 0 | 0 | 0 | 0 | 111.2 | A216 | A216-S218 PolarHBondContact O-N 3.25Š|
| 219 | L | 23.2 | Very low | 22.8 | Very low | 172 Ų | 172 | 132.5 Ų | 132.5 | 90% | 0.901 | 77% | 0.769 | S | S | * | * | | | trans | -111.8 | 98.8 | 168.4 | -71.8 | 167.9 | 0 | 0 | 0 | 108.1 | K217 | K217-L219 PolarHBondContact O-N 3.03Š|
| 220 | S | 22.5 | Very low | 22.8 | Very low | 111 Ų | 111 | 137.8 Ų | 137.8 | 78% | 0.776 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -91 | 118.7 | 174.4 | 59.1 | 0 | 0 | 0 | 0 | 110.4 | | |
| 221 | C | 21.9 | Very low | 22.8 | Very low | 81 Ų | 81 | 140.5 Ų | 140.5 | 55% | 0.547 | 78% | 0.775 | S | S | . | * | P | Polyproline II helix | trans | -89 | 122.6 | 167.7 | -98.5 | 0 | 0 | 0 | 0 | 110.1 | H242 | C221-H242 PolarHBondContact SG-NE2 3.34Å; C221-H242 VanDerWaalsContact SG-NE2 3.35Å |
| 222 | A | 22.1 | Very low | 22.8 | Very low | 102 Ų | 102 | 141 Ų | 141 | 84% | 0.843 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 123.1 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 223 | I | 24.4 | Very low | 22.8 | Very low | 101 Ų | 101 | 138 Ų | 138 | 52% | 0.518 | 78% | 0.776 | S | S | . | * | | | trans | -95.5 | 115.2 | 171.5 | -61.2 | 174.8 | 0 | 0 | 0 | 107.3 | Q225 | I223-Q225 PolarHBondContact O-N 3.39Š|
| 224 | Q | 23.3 | Very low | 22.8 | Very low | 187 Ų | 187 | 135.7 Ų | 135.7 | 87% | 0.874 | 77% | 0.765 | S | S | * | * | | | trans | -75.8 | 117.4 | 170.5 | -78 | 179 | -15.2 | 0 | 0 | 109.6 | | |
| 225 | Q | 24.1 | Very low | 22.9 | Very low | 117 Ų | 117 | 138.2 Ų | 138.2 | 55% | 0.547 | 77% | 0.772 | S | S | . | * | | | trans | -78.3 | 117.5 | 170.9 | -88 | 177 | -25 | 0 | 0 | 110.3 | A117 I223 V227 | A117-Q225 PolarHBondContact O-NE2 2.98Å; A117-Q225 PolarHBondContact O-OE1 3.19Å; I223-Q225 PolarHBondContact O-N 3.39Å; Q225-V227 PolarHBondContact O-N 3.34Å |
| 226 | I | 22.4 | Very low | 23 | Very low | 139 Ų | 139 | 135.8 Ų | 135.8 | 71% | 0.713 | 77% | 0.765 | S | S | * | * | | | trans | -81.2 | 108.6 | 163.4 | -60.6 | 176 | 0 | 0 | 0 | 107.1 | G228 L236 | I226-G228 VanDerWaalsContact C-N 3.35Å; I226-G228 PolarHBondContact O-N 2.81Å; I226-L236 HydrophobicContact CD1-CD1 4.15Å |
| 227 | V | 22.6 | Very low | 23 | Very low | 142 Ų | 142 | 136 Ų | 136 | 86% | 0.861 | 76% | 0.757 | S | S | * | * | | | trans | -70.5 | 90.7 | 172.5 | -176.9 | 0 | 0 | 0 | 0 | 108.3 | Q225 | Q225-V227 PolarHBondContact O-N 3.34Š|
| 228 | G | 22.8 | Very low | 23.1 | Very low | 63 Ų | 63 | 133.3 Ų | 133.3 | 65% | 0.649 | 75% | 0.752 | S | S | * | * | | | trans | -100.3 | 121.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | I226 | I226-G228 VanDerWaalsContact C-N 3.35Å; I226-G228 PolarHBondContact O-N 2.81Å |
| 229 | S | 22 | Very low | 23.1 | Very low | 115 Ų | 115 | 135.1 Ų | 135.1 | 80% | 0.804 | 75% | 0.752 | S | S | * | * | | | trans | -60.2 | 162.5 | -178.3 | 47.2 | 0 | 0 | 0 | 0 | 114.8 | H231 | S229-H231 PolarHBondContact O-N 3.27Š|
| 230 | R | 23.1 | Very low | 23.2 | Very low | 241 Ų | 241 | 131 Ų | 131 | 91% | 0.909 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -34.2 | 2.9 | -168.4 | -93.9 | -178.1 | 179.4 | -179.9 | -0.5 | 122.8 | | |
| 231 | H | 23.2 | Very low | 23.3 | Very low | 168 Ų | 168 | 134.3 Ų | 134.3 | 78% | 0.778 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -146.1 | 111.2 | -179.8 | -66.3 | -71.4 | 0 | 0 | 0 | 111.1 | S229 | S229-H231 PolarHBondContact O-N 3.27Š|
| 232 | R | 22.5 | Very low | 23.5 | Very low | 213 Ų | 213 | 136.6 Ų | 136.6 | 80% | 0.804 | 74% | 0.742 | S | S | * | * | | | trans | 105.7 | 88.2 | 174.8 | -66.8 | 178.2 | 164 | -178.1 | -1.8 | 114.9 | Q234 | R232-Q234 HydrophobicContact CB-CG 4.28Å; R232-Q234 PolarHBondContact O-N 3.41Å |
| 233 | A | 22.4 | Very low | 23.6 | Very low | 115 Ų | 115 | 140.3 Ų | 140.3 | 95% | 0.95 | 74% | 0.741 | S | S | * | * | | | trans | -67.2 | 87.7 | 151.5 | 0 | 0 | 0 | 0 | 0 | 108.4 | | |
| 234 | Q | 23.8 | Very low | 23.7 | Very low | 135 Ų | 135 | 140.8 Ų | 140.8 | 63% | 0.631 | 75% | 0.749 | S | S | * | * | | | trans | -89 | 115.2 | 165.4 | -79.5 | 177.9 | -6.5 | 0 | 0 | 107.5 | R232 L236 | R232-Q234 HydrophobicContact CB-CG 4.28Å; R232-Q234 PolarHBondContact O-N 3.41Å; Q234-L236 PolarHBondContact O-N 2.97Å |
| 235 | S | 22.7 | Very low | 23.6 | Very low | 119 Ų | 119 | 136.6 Ų | 136.6 | 83% | 0.832 | 74% | 0.74 | S | S | * | * | | | trans | -47.1 | 118.6 | 174.5 | 51.5 | 0 | 0 | 0 | 0 | 111.6 | | |
| 236 | L | 24.9 | Very low | 23.7 | Very low | 135 Ų | 135 | 136.3 Ų | 136.3 | 71% | 0.707 | 75% | 0.746 | S | S | * | * | | | trans | -96.5 | 129.3 | 169.3 | -74.4 | 171.2 | 0 | 0 | 0 | 110.1 | I226 Q234 N238 | I226-L236 HydrophobicContact CD1-CD1 4.15Å; Q234-L236 PolarHBondContact O-N 2.97Å; L236-N238 PolarHBondContact O-N 3.34Å |
| 237 | P | 24.2 | Very low | 23.8 | Very low | 105 Ų | 105 | 137.1 Ų | 137.1 | 68% | 0.682 | 75% | 0.752 | S | S | * | * | | | trans | -78.1 | 113.1 | 171.5 | 29.7 | -28.4 | 0 | 0 | 0 | 109.5 | L239 | P237-L239 PolarHBondContact O-N 2.82Š|
| 238 | N | 24.9 | Very low | 23.9 | Very low | 129 Ų | 129 | 139.8 Ų | 139.8 | 69% | 0.69 | 75% | 0.752 | S | S | * | * | | | trans | -80.2 | 95.1 | 167.8 | -106.2 | -22.3 | 0 | 0 | 0 | 109.3 | L236 C240 | L236-N238 PolarHBondContact O-N 3.34Å; N238-C240 PolarHBondContact O-N 2.71Å |
| 239 | L | 22.2 | Very low | 24 | Very low | 148 Ų | 148 | 143.3 Ų | 143.3 | 78% | 0.775 | 76% | 0.761 | S | S | * | * | | | trans | -77.6 | 95.1 | 164.7 | -89.1 | 136.1 | 0 | 0 | 0 | 108.8 | P237 Q241 | P237-L239 PolarHBondContact O-N 2.82Å; L239-Q241 VanDerWaalsContact C-N 3.3Å; L239-Q241 PolarHBondContact O-N 2.96Å |
| 240 | C | 25.6 | Very low | 24 | Very low | 84 Ų | 84 | 142.6 Ų | 142.6 | 57% | 0.568 | 76% | 0.762 | S | S | * | * | | | trans | -74.8 | 88.2 | 161.6 | -65.8 | 0 | 0 | 0 | 0 | 108.7 | N238 H242 | N238-C240 PolarHBondContact O-N 2.71Å; C240-H242 VanDerWaalsContact C-N 3.31Å; C240-H242 PolarHBondContact O-N 3.2Å |
| 241 | Q | 24.1 | Very low | 24 | Very low | 181 Ų | 181 | 134.5 Ų | 134.5 | 85% | 0.846 | 75% | 0.753 | S | S | * | * | | | trans | -78.5 | 79.7 | 173 | -158.6 | 174.1 | 21.8 | 0 | 0 | 108.8 | L239 H243 | L239-Q241 VanDerWaalsContact C-N 3.3Å; L239-Q241 PolarHBondContact O-N 2.96Å; Q241-H243 PolarHBondContact O-N 3.44Å |
| 242 | H | 27.1 | Very low | 24.1 | Very low | 130 Ų | 130 | 134.9 Ų | 134.9 | 60% | 0.602 | 76% | 0.76 | S | S | * | * | | | trans | -92.2 | 104.5 | 177.4 | -76.2 | -67.3 | 0 | 0 | 0 | 112.1 | C221 C240 V244 | C221-H242 PolarHBondContact SG-NE2 3.34Å; C221-H242 VanDerWaalsContact SG-NE2 3.35Å; C240-H242 VanDerWaalsContact C-N 3.31Å; C240-H242 PolarHBondContact O-N 3.2Å; H242-V244 PolarHBondContact O-N 3.42Å; H242-V244 VanDerWaalsContact O-N 3.09Å |
| 243 | H | 23.3 | Very low | 24.1 | Very low | 179 Ų | 179 | 134.7 Ų | 134.7 | 83% | 0.829 | 77% | 0.765 | S | S | * | * | | | trans | -66.1 | 92.3 | 166.6 | -162.8 | -88 | 0 | 0 | 0 | 109.6 | Q241 | Q241-H243 PolarHBondContact O-N 3.44Š|
| 244 | V | 26.7 | Very low | 24.3 | Very low | 112 Ų | 112 | 133.8 Ų | 133.8 | 68% | 0.679 | 75% | 0.752 | S | S | * | * | | | trans | -95 | 94.2 | 170.6 | -176.2 | 0 | 0 | 0 | 0 | 108.4 | H242 T246 | H242-V244 PolarHBondContact O-N 3.42Å; H242-V244 VanDerWaalsContact O-N 3.09Å; V244-T246 PolarHBondContact O-N 3.17Å |
| 245 | S | 21.9 | Very low | 24.3 | Very low | 99 Ų | 99 | 136.1 Ų | 136.1 | 69% | 0.692 | 76% | 0.763 | S | S | * | * | | | trans | -78.2 | 91.9 | 168.9 | 58.6 | 0 | 0 | 0 | 0 | 109.6 | | |
| 246 | T | 26.1 | Very low | 24.4 | Very low | 110 Ų | 110 | 135.1 Ų | 135.1 | 68% | 0.675 | 76% | 0.762 | S | S | * | * | | | trans | -138.9 | 98.1 | 161.2 | 49.1 | 0 | 0 | 0 | 0 | 110 | V244 | V244-T246 PolarHBondContact O-N 3.17Š|
| 247 | N | 24.1 | Very low | 24.4 | Very low | 157 Ų | 157 | 135.3 Ų | 135.3 | 84% | 0.84 | 77% | 0.768 | S | S | * | * | | | trans | 19.6 | 101.5 | 149.1 | -65.7 | -34.8 | 0 | 0 | 0 | 117 | | |
| 248 | K | 23.8 | Very low | 24.5 | Very low | 198 Ų | 198 | 136.3 Ų | 136.3 | 86% | 0.861 | 78% | 0.775 | S | S | * | * | | | | 159 | 139.2 | 121.9 | -84.4 | 166.3 | -179.3 | -179 | 0 | 110.4 | | |
| 249 | V | 25.2 | Very low | 24.5 | Very low | 137 Ų | 137 | 133.3 Ų | 133.3 | 83% | 0.83 | 78% | 0.775 | S | S | * | * | | | trans | 88.5 | 90.6 | 159.9 | -156.1 | 0 | 0 | 0 | 0 | 117.6 | | |
| 250 | A | 22.9 | Very low | 24.6 | Very low | 100 Ų | 100 | 137.8 Ų | 137.8 | 83% | 0.826 | 78% | 0.782 | S | S | * | * | | | trans | 60.4 | 118.3 | 130.9 | 0 | 0 | 0 | 0 | 0 | 120.8 | | |
| 251 | G | 22.4 | Very low | 24.6 | Very low | 70 Ų | 70 | 145.3 Ų | 145.3 | 72% | 0.722 | 80% | 0.8 | S | S | * | * | | | trans | 115.8 | 114.4 | 130.8 | 0 | 0 | 0 | 0 | 0 | 116 | | |
| 252 | L | 25.9 | Very low | 24.6 | Very low | 176 Ų | 176 | 144.5 Ų | 144.5 | 92% | 0.921 | 80% | 0.8 | S | S | * | * | | | trans | 83.9 | 86.9 | 152.3 | -52.7 | 173.1 | 0 | 0 | 0 | 117 | | |
| 253 | F | 23 | Very low | 24.5 | Very low | 209 Ų | 209 | 142.8 Ų | 142.8 | 92% | 0.917 | 80% | 0.803 | S | S | * | * | | | trans | -56.9 | 141 | 147.8 | -74.7 | -101.2 | 0 | 0 | 0 | 110.9 | | |
| 254 | S | 25.3 | Very low | 24.5 | Very low | 97 Ų | 97 | 140.9 Ų | 140.9 | 68% | 0.678 | 80% | 0.799 | S | S | * | * | | | | -179.3 | 110.7 | 118.5 | -173.5 | 0 | 0 | 0 | 0 | 110.9 | | |
| 255 | E | 24.2 | Very low | 24.5 | Very low | 184 Ų | 184 | 144.2 Ų | 144.2 | 86% | 0.86 | 81% | 0.812 | S | S | * | * | | | trans | 45.3 | 117.7 | 133.5 | -59.5 | 175.6 | 143.9 | 0 | 0 | 121.1 | | |
| 256 | A | 24.5 | Very low | 24.7 | Very low | 98 Ų | 98 | 148.4 Ų | 148.4 | 81% | 0.81 | 82% | 0.82 | S | S | * | * | | | | -171.3 | 93.2 | 124.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | | |
| 257 | V | 25.2 | Very low | 24.6 | Very low | 138 Ų | 138 | 149.4 Ų | 149.4 | 84% | 0.836 | 83% | 0.831 | S | S | * | * | | | trans | 44.5 | 126.7 | 132 | -172.4 | 0 | 0 | 0 | 0 | 121.2 | | |
| 258 | P | 26.2 | Very low | 24.8 | Very low | 126 Ų | 126 | 149.7 Ų | 149.7 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | | | trans | -90.7 | 150.4 | -176.3 | 37.1 | -33.7 | 0 | 0 | 0 | 113.7 | | |
| 259 | G | 25.4 | Very low | 24.8 | Very low | 67 Ų | 67 | 144 Ų | 144 | 69% | 0.691 | 83% | 0.829 | S | S | * | * | | | trans | -139.7 | 85.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 260 | R | 24.8 | Very low | 25.1 | Very low | 242 Ų | 242 | 145.4 Ų | 145.4 | 91% | 0.913 | 83% | 0.826 | S | S | * | * | | | trans | 58.8 | 96.7 | 148.7 | -55.3 | -175.1 | -176.3 | -142.1 | 0.2 | 118.9 | | |
| 261 | Y | 25.1 | Very low | 25.5 | Very low | 242 Ų | 242 | 147.5 Ų | 147.5 | 95% | 0.949 | 82% | 0.824 | S | S | * | * | | | trans | -118.6 | 120.6 | 140.5 | -80.4 | -89.3 | 0 | 0 | 0 | 108.1 | | |
| 262 | L | 23.2 | Very low | 25.7 | Very low | 164 Ų | 164 | 148.4 Ų | 148.4 | 86% | 0.859 | 82% | 0.824 | S | S | * | * | | | trans | -111.9 | 149.9 | 170.1 | -111.1 | 160 | 0 | 0 | 0 | 107 | | |
| 263 | S | 24.8 | Very low | 25.9 | Very low | 93 Ų | 93 | 152 Ų | 152 | 65% | 0.65 | 83% | 0.826 | S | S | * | * | | | trans | 100.8 | 88.8 | 163.4 | -54.7 | 0 | 0 | 0 | 0 | 116.6 | | |
| 264 | D | 24.3 | Very low | 26.2 | Very low | 139 Ų | 139 | 145.3 Ų | 145.3 | 74% | 0.743 | 82% | 0.815 | S | S | * | * | | | | 74.1 | 96.6 | 122.1 | -48.9 | -30 | 0 | 0 | 0 | 118.3 | | |
| 265 | L | 26.8 | Very low | 26.6 | Very low | 183 Ų | 183 | 151.8 Ų | 151.8 | 96% | 0.958 | 83% | 0.825 | S | S | * | * | | | trans | -161.3 | 103.2 | 130.2 | -107 | 137.7 | 0 | 0 | 0 | 110.3 | | |
| 266 | E | 25.1 | Very low | 26.9 | Very low | 186 Ų | 186 | 149.2 Ų | 149.2 | 87% | 0.869 | 82% | 0.815 | S | S | * | * | | | trans | -60.5 | 125.7 | 171.1 | -64 | 173.9 | 135.8 | 0 | 0 | 110.9 | | |
| 267 | C | 25 | Very low | 27.3 | Very low | 132 Ų | 132 | 153.1 Ų | 153.1 | 89% | 0.892 | 82% | 0.816 | S | S | * | * | | | trans | -166.8 | 73.4 | 151 | -103 | 0 | 0 | 0 | 0 | 109.2 | | |
| 268 | L | 27.9 | Very low | 27.8 | Very low | 163 Ų | 163 | 154.9 Ų | 154.9 | 85% | 0.853 | 85% | 0.845 | S | S | * | * | | | trans | -100.5 | 89.9 | 162.9 | -77 | 171.4 | 0 | 0 | 0 | 108.4 | | |
| 269 | G | 24.4 | Very low | 27.9 | Very low | 79 Ų | 79 | 156.4 Ų | 156.4 | 81% | 0.814 | 85% | 0.847 | S | S | * | * | | | trans | -94.7 | 75 | 161.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | | |
| 270 | E | 31.3 | Very low | 28.1 | Very low | 165 Ų | 165 | 161.1 Ų | 161.1 | 77% | 0.771 | 86% | 0.855 | S | S | * | * | | | trans | -95.7 | 105.6 | 167.4 | -83.4 | -168 | 135.9 | 0 | 0 | 110.5 | | |
| 271 | N | 29.9 | Very low | 28.2 | Very low | 144 Ų | 144 | 156.6 Ų | 156.6 | 77% | 0.77 | 85% | 0.852 | S | S | * | * | | | | 34 | 107 | 127.1 | -69.3 | -37.4 | 0 | 0 | 0 | 118.4 | | |
| 272 | A | 27.6 | Very low | 28.4 | Very low | 89 Ų | 89 | 151.5 Ų | 151.5 | 74% | 0.736 | 85% | 0.846 | S | S | * | * | | | | 31.4 | 102.2 | 118.3 | 0 | 0 | 0 | 0 | 0 | 117.4 | | |
| 273 | R | 30.2 | Very low | 28.8 | Very low | 252 Ų | 252 | 150.8 Ų | 150.8 | 95% | 0.951 | 85% | 0.845 | S | S | * | * | | | | 165 | 112.2 | 119.6 | -94.1 | 170.3 | 169.8 | 174.8 | -1.3 | 111.4 | | |
| 274 | G | 29.9 | Very low | 29 | Very low | 68 Ų | 68 | 154.6 Ų | 154.6 | 70% | 0.701 | 86% | 0.858 | S | S | * | * | | | | 92.3 | 131.1 | 120.5 | 0 | 0 | 0 | 0 | 0 | 118.3 | | |
| 275 | R | 32.8 | Very low | 29.4 | Very low | 233 Ų | 233 | 155.7 Ų | 155.7 | 88% | 0.879 | 87% | 0.866 | S | S | * | * | | | trans | 71.4 | 141 | 151.3 | -65 | -179.3 | 178.8 | 169.4 | 0 | 115 | | |
| 276 | M | 30.3 | Very low | 29.6 | Very low | 131 Ų | 131 | 153.6 Ų | 153.6 | 65% | 0.645 | 86% | 0.859 | S | S | * | * | | | cis | 179.8 | 133.5 | -9.6 | -128.5 | -168.3 | -89.1 | 0 | 0 | 101.2 | | |
| 277 | Q | 33.1 | Very low | 29.9 | Very low | 180 Ų | 180 | 150.9 Ų | 150.9 | 84% | 0.841 | 86% | 0.858 | S | S | * | * | | | trans | 61.5 | 135.6 | 152.8 | -60.4 | 168.7 | -11.4 | 0 | 0 | 116.5 | | |
| 278 | A | 36.7 | Very low | 30.4 | Very low | 175 Ų | 175 | 152.6 Ų | 152.6 | 100% | 1.446 | 86% | 0.855 | S | S | * | * | | | cis | -151.6 | 0 | 14 | 0 | 0 | 0 | 0 | 0 | 107.8 | | |