| 1 | M | 40.1 | Very low | 41.2 | Very low | 238 Ų | 238 | 163.8 Ų | 163.8 | 100% | 1.172 | 87% | 0.871 | S | S | * | * | | | | 0 | 139.1 | 0 | -82.9 | -171.8 | -125.8 | 0 | 0 | 108.8 | | |
| 2 | K | 45.9 | Very low | 41.1 | Very low | 199 Ų | 199 | 155.8 Ų | 155.8 | 87% | 0.865 | 86% | 0.857 | S | S | * | * | | | trans | 79 | 88.4 | 172.3 | -61.5 | -179.3 | 178 | -179.2 | 0 | 116.9 | | |
| 3 | F | 42.7 | Very low | 41.3 | Very low | 197 Ų | 197 | 164.4 Ų | 164.4 | 86% | 0.864 | 87% | 0.868 | S | S | * | * | | | trans | -43.7 | 154.2 | 141.3 | -68.5 | -96.9 | 0 | 0 | 0 | 112.7 | | |
| 4 | L | 43.2 | Very low | 40.7 | Very low | 176 Ų | 176 | 158.1 Ų | 158.1 | 92% | 0.921 | 86% | 0.863 | S | S | * | * | | | trans | 167.5 | 93.7 | 134 | -103.7 | 81.6 | 0 | 0 | 0 | 104.1 | | |
| 5 | G | 35.5 | Very low | 40.3 | Very low | 87 Ų | 87 | 152.5 Ų | 152.5 | 90% | 0.897 | 86% | 0.856 | S | S | * | * | | | | 89.2 | 119.4 | 77.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | | |
| 6 | G | 35.4 | Very low | 40.8 | Very low | 77 Ų | 77 | 152.7 Ų | 152.7 | 79% | 0.794 | 86% | 0.861 | S | S | * | * | | | cis | -156.1 | 170.6 | 6.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 7 | N | 39 | Very low | 40.5 | Very low | 158 Ų | 158 | 147.7 Ų | 147.7 | 85% | 0.845 | 85% | 0.852 | S | S | * | * | | | trans | -62.5 | 148.7 | 180 | -77.5 | 10.6 | 0 | 0 | 0 | 112.5 | D9 | N7-D9 PolarHBondContact O-N 3.47Š|
| 8 | D | 41 | Very low | 40 | Very low | 128 Ų | 128 | 147.9 Ų | 147.9 | 68% | 0.684 | 86% | 0.855 | S | S | * | * | | | trans | -35 | 116.7 | 160.3 | -68.3 | -92.6 | 0 | 0 | 0 | 114.8 | | |
| 9 | D | 42.1 | Very low | 39.8 | Very low | 156 Ų | 156 | 143.7 Ų | 143.7 | 83% | 0.834 | 85% | 0.848 | S | S | * | * | | | trans | -111.4 | 75.7 | 148.7 | -80.4 | -45.3 | 0 | 0 | 0 | 108.5 | N7 N11 | N7-D9 PolarHBondContact O-N 3.47Å; D9-N11 PolarHBondContact O-N 3.48Å |
| 10 | R | 48.2 | Very low | 39.5 | Very low | 229 Ų | 229 | 143.7 Ų | 143.7 | 86% | 0.864 | 85% | 0.849 | S | S | * | * | | | trans | -75.8 | 67.7 | 153.5 | -74.1 | -172.2 | -167.6 | 156.2 | 6 | 108.8 | | |
| 11 | N | 40.5 | Very low | 39.1 | Very low | 157 Ų | 157 | 143.7 Ų | 143.7 | 84% | 0.84 | 85% | 0.845 | S | S | * | * | S | Bend | trans | -155.7 | 107.6 | 153.4 | -147.3 | 7 | 0 | 0 | 0 | 108.6 | D9 | D9-N11 PolarHBondContact O-N 3.48Š|
| 12 | G | 40.1 | Very low | 38.6 | Very low | 68 Ų | 68 | 136.9 Ų | 136.9 | 70% | 0.701 | 83% | 0.827 | S | S | * | * | | | trans | 124.2 | 47 | 173.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | | |
| 13 | R | 43 | Very low | 38.5 | Very low | 267 Ų | 267 | 134.7 Ų | 134.7 | 100% | 1.008 | 82% | 0.823 | S | S | * | * | | | trans | -116.5 | 75.5 | 148.6 | -85.1 | -170.4 | -174.2 | 178.1 | 3.4 | 110.3 | | |
| 14 | G | 33 | Very low | 38.1 | Very low | 77 Ų | 77 | 132.1 Ų | 132.1 | 79% | 0.794 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -145.4 | 116.9 | 146.1 | 0 | 0 | 0 | 0 | 0 | 106.7 | | |
| 15 | G | 35.1 | Very low | 37.4 | Very low | 73 Ų | 73 | 127.1 Ų | 127.1 | 75% | 0.753 | 81% | 0.814 | S | S | * | * | S | Bend | trans | 110.4 | 44.9 | 161.3 | 0 | 0 | 0 | 0 | 0 | 119.3 | | |
| 16 | V | 48.3 | Very low | 37.8 | Very low | 156 Ų | 156 | 128.6 Ų | 128.6 | 95% | 0.945 | 81% | 0.811 | S | S | * | * | | | trans | 41.6 | 95.7 | 136.4 | -159.4 | 0 | 0 | 0 | 0 | 118.8 | | |
| 17 | G | 34.8 | Very low | 38 | Very low | 68 Ų | 68 | 136.9 Ų | 136.9 | 70% | 0.701 | 82% | 0.818 | S | S | * | * | | | trans | 175.9 | 144.7 | 163.5 | 0 | 0 | 0 | 0 | 0 | 106.2 | | |
| 18 | V | 32.8 | Very low | 38 | Very low | 151 Ų | 151 | 133.5 Ų | 133.5 | 92% | 0.915 | 82% | 0.821 | S | S | * | * | | | cis | -164.6 | 157.9 | 40.3 | -154.8 | 0 | 0 | 0 | 0 | 107.2 | | |
| 19 | G | 36.4 | Very low | 37.8 | Very low | 69 Ų | 69 | 129.9 Ų | 129.9 | 71% | 0.711 | 81% | 0.813 | S | S | * | * | | | trans | -68.7 | 169.1 | -171.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | | |
| 20 | T | 32.3 | Very low | 38 | Very low | 142 Ų | 142 | 129.3 Ų | 129.3 | 87% | 0.871 | 82% | 0.815 | S | S | * | * | | | trans | -147.8 | 131.1 | 146.4 | -47.5 | 0 | 0 | 0 | 0 | 108.3 | A22 | T20-A22 PolarHBondContact O-N 3.44Š|
| 21 | D | 32.2 | Very low | 37.8 | Very low | 144 Ų | 144 | 122.8 Ų | 122.8 | 77% | 0.77 | 81% | 0.805 | S | S | * | * | | | trans | -52.9 | 123 | 178.6 | -59.4 | -61.3 | 0 | 0 | 0 | 112.9 | I23 | D21-I23 HydrophobicContact CB-CG1 4.14Š|
| 22 | A | 29 | Very low | 37.7 | Very low | 96 Ų | 96 | 122.3 Ų | 122.3 | 79% | 0.793 | 80% | 0.798 | S | S | * | * | | | trans | -102.5 | 93.9 | 141.5 | 0 | 0 | 0 | 0 | 0 | 106.7 | T20 V24 | T20-A22 PolarHBondContact O-N 3.44Å; A22-V24 VanDerWaalsContact C-N 3.28Å; A22-V24 PolarHBondContact O-N 3.33Å |
| 23 | I | 43.2 | Very low | 37.7 | Very low | 153 Ų | 153 | 125.3 Ų | 125.3 | 79% | 0.785 | 80% | 0.797 | S | S | * | * | | | trans | -62.1 | 92.1 | 163.1 | -59.1 | 173 | 0 | 0 | 0 | 107.2 | D21 | D21-I23 HydrophobicContact CB-CG1 4.14Š|
| 24 | V | 34.3 | Very low | 37.6 | Very low | 143 Ų | 143 | 115.9 Ų | 115.9 | 87% | 0.867 | 78% | 0.776 | S | S | * | * | | | trans | -147 | 108.1 | 153.1 | -179.6 | 0 | 0 | 0 | 0 | 108.3 | A22 | A22-V24 VanDerWaalsContact C-N 3.28Å; A22-V24 PolarHBondContact O-N 3.33Å |
| 25 | G | 30.1 | Very low | 37.9 | Very low | 71 Ų | 71 | 115.3 Ų | 115.3 | 73% | 0.732 | 76% | 0.764 | S | S | * | * | | | trans | 110.2 | 74.5 | 157.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | R27 | G25-R27 PolarHBondContact O-N 3.29Š|
| 26 | S | 43.8 | Very low | 38.1 | Very low | 118 Ų | 118 | 118.2 Ų | 118.2 | 83% | 0.825 | 76% | 0.762 | S | S | * | * | | | trans | -44.5 | 125 | 153.7 | -51.4 | 0 | 0 | 0 | 0 | 110.9 | | |
| 27 | R | 39.7 | Very low | 37.7 | Very low | 251 Ų | 251 | 113.7 Ų | 113.7 | 95% | 0.947 | 74% | 0.742 | S | S | * | * | | | trans | 171.7 | 108.3 | 138.8 | -90.5 | 155.4 | -159.7 | -163.3 | 7.4 | 111.3 | G25 | G25-R27 PolarHBondContact O-N 3.29Š|
| 28 | G | 39 | Very low | 37.9 | Very low | 87 Ų | 87 | 113.4 Ų | 113.4 | 90% | 0.897 | 73% | 0.732 | S | S | * | * | | | trans | 98.7 | 112.6 | 146.8 | 0 | 0 | 0 | 0 | 0 | 116.8 | | |
| 29 | G | 36.9 | Very low | 38.3 | Very low | 51 Ų | 51 | 108.5 Ų | 108.5 | 53% | 0.526 | 71% | 0.713 | S | S | . | * | | | trans | 160.4 | 52.8 | 164.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | S31 | G29-S31 PolarHBondContact O-N 3.39Š|
| 30 | V | 44.8 | Very low | 38.6 | Very low | 145 Ų | 145 | 108.5 Ų | 108.5 | 88% | 0.879 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.8 | 23.4 | 171.4 | -96.1 | 0 | 0 | 0 | 0 | 113.7 | | |
| 31 | S | 43.9 | Very low | 38.9 | Very low | 91 Ų | 91 | 104.7 Ų | 104.7 | 64% | 0.636 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.9 | -10.4 | -165.2 | -54.4 | 0 | 0 | 0 | 0 | 115 | G29 | G29-S31 PolarHBondContact O-N 3.39Š|
| 32 | Q | 39.8 | Very low | 39.2 | Very low | 148 Ų | 148 | 100.9 Ų | 100.9 | 69% | 0.692 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -81.5 | -41.1 | 176.3 | -117.7 | 87.2 | 10.5 | 0 | 0 | 112 | A34 A35 | Q32-A34 VanDerWaalsContact C-N 3.31Å; Q32-A34 PolarHBondContact O-N 3.05Å; Q32-A35 PolarHBondContact O-N 3.44Å |
| 33 | D | 39.4 | Very low | 39.7 | Very low | 131 Ų | 131 | 99.9 Ų | 99.9 | 70% | 0.701 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -69.2 | -25.6 | -174.4 | -61.9 | -54.6 | 0 | 0 | 0 | 114 | A37 | D33-A37 WeakPolarHBondContact O-CB 3.45Å; D33-A37 PolarHBondContact O-N 3.36Å |
| 34 | A | 40.3 | Very low | 39.6 | Very low | 68 Ų | 68 | 96.7 Ų | 96.7 | 56% | 0.562 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -74.9 | -25.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q32 A38 | Q32-A34 VanDerWaalsContact C-N 3.31Å; Q32-A34 PolarHBondContact O-N 3.05Å; A34-A38 WeakPolarHBondContact O-CB 3.46Å; A34-A38 PolarHBondContact O-N 2.95Å |
| 35 | A | 40.4 | Very low | 39.9 | Very low | 66 Ų | 66 | 94 Ų | 94 | 55% | 0.545 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -78.8 | -39.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q32 A38 G39 | Q32-A35 PolarHBondContact O-N 3.44Å; A35-A38 PolarHBondContact O-N 3.07Å; A35-G39 PolarHBondContact O-N 3.42Å |
| 36 | D | 38.3 | Very low | 40.3 | Very low | 133 Ų | 133 | 95.3 Ų | 95.3 | 71% | 0.711 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -72.2 | -32.5 | 176.1 | -77 | -30.9 | 0 | 0 | 0 | 112.1 | A40 | D36-A40 PolarHBondContact O-N 2.77Å |
| 37 | A | 40.3 | Very low | 39.7 | Very low | 62 Ų | 62 | 93.1 Ų | 93.1 | 51% | 0.512 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -68.3 | -35.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113 | D33 A41 | D33-A37 WeakPolarHBondContact O-CB 3.45Å; D33-A37 PolarHBondContact O-N 3.36Å; A37-A41 WeakPolarHBondContact O-CB 3.42Å; A37-A41 PolarHBondContact O-N 3.04Å; A37-A41 VanDerWaalsContact O-N 3.12Å |
| 38 | A | 39.5 | Very low | 39.2 | Very low | 61 Ų | 61 | 90.6 Ų | 90.6 | 50% | 0.504 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -72.2 | -34.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | A34 A35 A41 A42 | A34-A38 WeakPolarHBondContact O-CB 3.46Å; A34-A38 PolarHBondContact O-N 2.95Å; A35-A38 PolarHBondContact O-N 3.07Å; A38-A41 PolarHBondContact O-N 2.84Å; A38-A42 WeakPolarHBondContact O-CB 3.38Å; A38-A42 PolarHBondContact O-N 3.31Å; A38-A42 VanDerWaalsContact O-N 3.08Å |
| 39 | G | 41.1 | Very low | 39 | Very low | 49 Ų | 49 | 92.4 Ų | 92.4 | 51% | 0.505 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -66.6 | -37.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | A35 A43 | A35-G39 PolarHBondContact O-N 3.42Å; G39-A43 PolarHBondContact O-N 3.23Å |
| 40 | A | 41.1 | Very low | 38.6 | Very low | 68 Ų | 68 | 98.8 Ų | 98.8 | 56% | 0.562 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -72.5 | -35.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | D36 A43 A44 | D36-A40 PolarHBondContact O-N 2.77Å; A40-A43 PolarHBondContact O-N 3.48Å; A40-A44 PolarHBondContact O-N 3.09Å |
| 41 | A | 39.3 | Very low | 37.9 | Very low | 63 Ų | 63 | 100.4 Ų | 100.4 | 52% | 0.521 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -71.3 | -32.9 | 177 | 0 | 0 | 0 | 0 | 0 | 113.1 | A37 A38 A43 A44 A45 | A37-A41 WeakPolarHBondContact O-CB 3.42Å; A37-A41 PolarHBondContact O-N 3.04Å; A37-A41 VanDerWaalsContact O-N 3.12Å; A38-A41 PolarHBondContact O-N 2.84Å; A41-A43 VanDerWaalsContact C-N 3.33Å; A41-A43 PolarHBondContact O-N 3.48Å; A41-A44 PolarHBondContact O-N 3.47Å; A41-A45 PolarHBondContact O-N 3.48Å |
| 42 | A | 38.4 | Very low | 37.3 | Very low | 64 Ų | 64 | 104.6 Ų | 104.6 | 53% | 0.529 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -70.3 | -27.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | A38 | A38-A42 WeakPolarHBondContact O-CB 3.38Å; A38-A42 PolarHBondContact O-N 3.31Å; A38-A42 VanDerWaalsContact O-N 3.08Å |
| 43 | A | 39 | Very low | 36.7 | Very low | 75 Ų | 75 | 108 Ų | 108 | 62% | 0.62 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -76.4 | -23.1 | 174 | 0 | 0 | 0 | 0 | 0 | 113.2 | G39 A40 A41 | G39-A43 PolarHBondContact O-N 3.23Å; A40-A43 PolarHBondContact O-N 3.48Å; A41-A43 VanDerWaalsContact C-N 3.33Å; A41-A43 PolarHBondContact O-N 3.48Å |
| 44 | A | 41.6 | Very low | 36.5 | Very low | 86 Ų | 86 | 107.9 Ų | 107.9 | 71% | 0.711 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -82 | -17.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | A40 A41 | A40-A44 PolarHBondContact O-N 3.09Å; A41-A44 PolarHBondContact O-N 3.47Å |
| 45 | A | 41.2 | Very low | 35.9 | Very low | 85 Ų | 85 | 109.7 Ų | 109.7 | 70% | 0.702 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -89.5 | -9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | A41 | A41-A45 PolarHBondContact O-N 3.48Š|
| 46 | V | 37.6 | Very low | 35.8 | Very low | 99 Ų | 99 | 112.8 Ų | 112.8 | 60% | 0.6 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -109 | 85.4 | 170.6 | -173.4 | 0 | 0 | 0 | 0 | 107.9 | Y48 | V46-Y48 HydrophobicContact CG1-CD2 4.17Å; V46-Y48 PolarHBondContact O-N 3.5Å |
| 47 | G | 31.9 | Very low | 35.5 | Very low | 72 Ų | 72 | 110.3 Ų | 110.3 | 74% | 0.742 | 70% | 0.696 | S | S | * | * | | | trans | -64.3 | 81.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112 | | |
| 48 | Y | 28.9 | Very low | 35.2 | Very low | 198 Ų | 198 | 111.3 Ų | 111.3 | 78% | 0.776 | 71% | 0.712 | S | S | * | * | | | trans | -94.2 | 99.6 | 142 | -83.9 | -82.5 | 0 | 0 | 0 | 106.9 | V46 F50 | V46-Y48 HydrophobicContact CG1-CD2 4.17Å; V46-Y48 PolarHBondContact O-N 3.5Å; Y48-F50 PolarHBondContact O-N 3.12Å |
| 49 | V | 34.8 | Very low | 35.1 | Very low | 126 Ų | 126 | 115.8 Ų | 115.8 | 76% | 0.764 | 73% | 0.733 | S | S | * | * | | | trans | -60.2 | 91.2 | 163.7 | 174.8 | 0 | 0 | 0 | 0 | 107.1 | Q51 | V49-Q51 VanDerWaalsContact C-N 3.28Å; V49-Q51 HydrophobicContact CG1-CG 3.94Å; V49-Q51 PolarHBondContact O-N 3.45Å; V49-Q51 VanDerWaalsContact O-N 3.07Å |
| 50 | F | 29.4 | Very low | 34.5 | Very low | 184 Ų | 184 | 116.7 Ų | 116.7 | 81% | 0.807 | 74% | 0.743 | S | S | * | * | | | trans | -67.1 | 102.4 | 150.2 | -86.8 | -84.5 | 0 | 0 | 0 | 105.3 | Y48 Q52 | Y48-F50 PolarHBondContact O-N 3.12Å; F50-Q52 PolarHBondContact O-N 3.42Å |
| 51 | Q | 29.8 | Very low | 34.1 | Very low | 179 Ų | 179 | 120.2 Ų | 120.2 | 84% | 0.836 | 76% | 0.757 | S | S | * | * | | | trans | -57.6 | 89.8 | 159 | -75.3 | -159.7 | 92.7 | 0 | 0 | 107.3 | V49 R53 | V49-Q51 VanDerWaalsContact C-N 3.28Å; V49-Q51 HydrophobicContact CG1-CG 3.94Å; V49-Q51 PolarHBondContact O-N 3.45Å; V49-Q51 VanDerWaalsContact O-N 3.07Å; Q51-R53 VanDerWaalsContact C-N 3.29Å; Q51-R53 PolarHBondContact O-N 3.32Å |
| 52 | Q | 30.9 | Very low | 33.7 | Very low | 180 Ų | 180 | 120.5 Ų | 120.5 | 84% | 0.841 | 77% | 0.765 | S | S | * | * | | | trans | -65.3 | 99.6 | 161.3 | -81.3 | -176.8 | -0.7 | 0 | 0 | 106.2 | F50 | F50-Q52 PolarHBondContact O-N 3.42Š|
| 53 | R | 28.5 | Very low | 33.4 | Very low | 220 Ų | 220 | 124.7 Ų | 124.7 | 83% | 0.83 | 78% | 0.784 | S | S | * | * | | | trans | -43.7 | 127.9 | 161.4 | -98.1 | -178.7 | 167.9 | -134.6 | 0.5 | 108.7 | Q51 S55 | Q51-R53 VanDerWaalsContact C-N 3.29Å; Q51-R53 PolarHBondContact O-N 3.32Å; R53-S55 PolarHBondContact O-N 3.45Å |
| 54 | P | 34.3 | Very low | 32.9 | Very low | 127 Ų | 127 | 124.9 Ų | 124.9 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | | | trans | -64.8 | 107.7 | 158.5 | -11.2 | 26.1 | 0 | 0 | 0 | 106.9 | | |
| 55 | S | 28 | Very low | 32.4 | Very low | 107 Ų | 107 | 124.4 Ų | 124.4 | 75% | 0.748 | 80% | 0.797 | S | S | * | * | | | trans | -88.1 | 123.6 | 164.6 | -113.7 | 0 | 0 | 0 | 0 | 108 | R53 | R53-S55 PolarHBondContact O-N 3.45Š|
| 56 | P | 39.1 | Very low | 32.1 | Very low | 130 Ų | 130 | 127.6 Ų | 127.6 | 84% | 0.844 | 81% | 0.808 | S | S | * | * | | | trans | -80.9 | 124.9 | 179.9 | 22.8 | -16.3 | 0 | 0 | 0 | 110.5 | | |
| 57 | G | 32 | Very low | 31.8 | Very low | 82 Ų | 82 | 126.9 Ų | 126.9 | 85% | 0.845 | 82% | 0.82 | S | S | * | * | | | trans | 169.6 | 106.9 | 168.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | | |
| 58 | G | 32.8 | Very low | 31.9 | Very low | 82 Ų | 82 | 127.5 Ų | 127.5 | 85% | 0.845 | 83% | 0.827 | S | S | * | * | | | trans | 157.2 | 60.3 | 170.5 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 59 | V | 36.8 | Very low | 31.9 | Very low | 156 Ų | 156 | 121.6 Ų | 121.6 | 95% | 0.945 | 83% | 0.826 | S | S | * | * | | | trans | -79.1 | 124.4 | 166.8 | -163.5 | 0 | 0 | 0 | 0 | 107.3 | | |
| 60 | G | 30.1 | Very low | 31.9 | Very low | 68 Ų | 68 | 122.2 Ų | 122.2 | 70% | 0.701 | 83% | 0.83 | S | S | * | * | | | trans | -168.9 | 68.7 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | | |
| 61 | V | 31.3 | Very low | 32.4 | Very low | 142 Ų | 142 | 119.2 Ų | 119.2 | 86% | 0.861 | 83% | 0.828 | S | S | * | * | | | trans | 22.8 | 113.3 | 142.7 | -170 | 0 | 0 | 0 | 0 | 117.4 | | |
| 62 | G | 31.2 | Very low | 32.8 | Very low | 68 Ų | 68 | 114.3 Ų | 114.3 | 70% | 0.701 | 83% | 0.826 | S | S | * | * | | | trans | -82.2 | 164.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | | |
| 63 | V | 33 | Very low | 32.9 | Very low | 152 Ų | 152 | 112 Ų | 112 | 92% | 0.921 | 82% | 0.824 | S | S | * | * | | | trans | -161.7 | 104.9 | 149.2 | -176.4 | 0 | 0 | 0 | 0 | 103.9 | | |
| 64 | G | 29 | Very low | 33.4 | Very low | 80 Ų | 80 | 105.4 Ų | 105.4 | 83% | 0.825 | 83% | 0.825 | S | S | * | * | | | | 91 | 109 | 84.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | | |
| 65 | G | 29.5 | Very low | 33.4 | Very low | 75 Ų | 75 | 102.9 Ų | 102.9 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | | | trans | 151.2 | 68.4 | 162.3 | 0 | 0 | 0 | 0 | 0 | 120.3 | | |
| 66 | V | 36 | Very low | 34.2 | Very low | 153 Ų | 153 | 105.1 Ų | 105.1 | 93% | 0.927 | 82% | 0.823 | S | S | * | * | | | trans | 65.2 | 100.9 | 141.4 | -163.1 | 0 | 0 | 0 | 0 | 120.9 | | |
| 67 | G | 30 | Very low | 34.3 | Very low | 84 Ų | 84 | 102.6 Ų | 102.6 | 87% | 0.866 | 82% | 0.82 | S | S | * | * | | | trans | 108.5 | 114.3 | 138.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | | |
| 68 | G | 34.9 | Very low | 34.4 | Very low | 85 Ų | 85 | 104 Ų | 104 | 88% | 0.876 | 82% | 0.817 | S | S | * | * | S | Bend | cis | -164.1 | 146.1 | -2.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | | |
| 69 | G | 29.6 | Very low | 35.1 | Very low | 74 Ų | 74 | 106.1 Ų | 106.1 | 76% | 0.763 | 81% | 0.814 | S | S | * | * | | | trans | 141.3 | 92 | -175.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | | |
| 70 | V | 33.8 | Very low | 35.3 | Very low | 139 Ų | 139 | 106.5 Ų | 106.5 | 84% | 0.842 | 81% | 0.81 | S | S | * | * | | | trans | -67.2 | 130.9 | -173.4 | -178.8 | 0 | 0 | 0 | 0 | 110.8 | | |
| 71 | P | 41 | Very low | 35.8 | Very low | 120 Ų | 120 | 111.8 Ų | 111.8 | 78% | 0.779 | 82% | 0.816 | S | S | * | * | | | trans | -91.5 | 136.2 | 170 | 33.6 | -27.5 | 0 | 0 | 0 | 111.4 | | |
| 72 | G | 37.5 | Very low | 36.2 | Very low | 77 Ų | 77 | 113.2 Ų | 113.2 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | | | trans | 76.3 | 89.8 | 156.7 | 0 | 0 | 0 | 0 | 0 | 117.7 | | |
| 73 | V | 32.9 | Very low | 36.4 | Very low | 132 Ų | 132 | 112.5 Ų | 112.5 | 80% | 0.8 | 80% | 0.801 | S | S | * | * | | | trans | -123.1 | 115.1 | 147 | 175 | 0 | 0 | 0 | 0 | 106.5 | A75 | V73-A75 PolarHBondContact O-N 3.46Š|
| 74 | G | 39.8 | Very low | 36.7 | Very low | 81 Ų | 81 | 108.4 Ų | 108.4 | 84% | 0.835 | 78% | 0.783 | S | S | * | * | | | trans | -63.5 | 127.5 | 162.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | | |
| 75 | A | 32.5 | Very low | 37 | Very low | 74 Ų | 74 | 108.2 Ų | 108.2 | 61% | 0.612 | 77% | 0.774 | S | S | * | * | | | trans | -159.9 | 102.3 | 161.9 | 0 | 0 | 0 | 0 | 0 | 105.1 | V73 | V73-A75 PolarHBondContact O-N 3.46Š|
| 76 | V | 45.1 | Very low | 37.6 | Very low | 154 Ų | 154 | 109.7 Ų | 109.7 | 93% | 0.933 | 77% | 0.768 | S | S | * | * | | | | 26.4 | 97.2 | 93.3 | -172.8 | 0 | 0 | 0 | 0 | 111.1 | | |
| 77 | G | 40.7 | Very low | 37.8 | Very low | 76 Ų | 76 | 109 Ų | 109 | 78% | 0.784 | 76% | 0.755 | S | S | * | * | | | trans | 102.7 | 78.4 | 160.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | | |
| 78 | S | 36.1 | Very low | 38.1 | Very low | 112 Ų | 112 | 113.2 Ų | 113.2 | 78% | 0.783 | 75% | 0.745 | S | S | * | * | | | trans | -175.4 | 70.4 | 148.7 | 51.4 | 0 | 0 | 0 | 0 | 112 | | |
| 79 | T | 45.5 | Very low | 38.4 | Very low | 127 Ų | 127 | 112.4 Ų | 112.4 | 78% | 0.779 | 73% | 0.731 | S | S | * | * | | | trans | -126.3 | 40.2 | 167.3 | 59 | 0 | 0 | 0 | 0 | 111.3 | | |
| 80 | L | 42 | Very low | 39 | Very low | 163 Ų | 163 | 112 Ų | 112 | 85% | 0.853 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -115.9 | -0.7 | 177.4 | -74.7 | 165.9 | 0 | 0 | 0 | 113.6 | | |
| 81 | H | 41.4 | Very low | 39.2 | Very low | 179 Ų | 179 | 110.9 Ų | 110.9 | 83% | 0.829 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -107.1 | -17.2 | -179.1 | -139.2 | 83 | 0 | 0 | 0 | 115.1 | | |
| 82 | E | 38.9 | Very low | 39.4 | Very low | 172 Ų | 172 | 111.1 Ų | 111.1 | 80% | 0.804 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -98.9 | -11.4 | 175 | -85.7 | 165.6 | 148.8 | 0 | 0 | 114 | | |
| 83 | A | 35.2 | Very low | 39.7 | Very low | 54 Ų | 54 | 110.2 Ų | 110.2 | 45% | 0.446 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -74.2 | -24.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | | |
| 84 | A | 38.4 | Very low | 40.3 | Very low | 66 Ų | 66 | 109 Ų | 109 | 55% | 0.545 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -79.8 | -23.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 85 | A | 37.2 | Very low | 40.3 | Very low | 76 Ų | 76 | 111.5 Ų | 111.5 | 63% | 0.628 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -78.2 | -27.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 86 | T | 40.1 | Very low | 41 | Very low | 105 Ų | 105 | 114.7 Ų | 114.7 | 64% | 0.644 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -77.7 | -28.2 | 178.7 | -47.2 | 0 | 0 | 0 | 0 | 112.5 | Y88 | T86-Y88 PolarHBondContact O-N 3.39Å |
| 87 | E | 41.8 | Very low | 41 | Very low | 139 Ų | 139 | 114.1 Ų | 114.1 | 65% | 0.65 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -71.5 | -27.8 | 178.6 | -69.9 | 178.4 | 165.7 | 0 | 0 | 113 | H91 | E87-H91 PolarHBondContact O-N 3.5Å |
| 88 | Y | 36.6 | Very low | 41.2 | Very low | 172 Ų | 172 | 116.6 Ų | 116.6 | 68% | 0.675 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -75.5 | -32.9 | 179.7 | -161 | -98.9 | 0 | 0 | 0 | 113.3 | T86 F92 | T86-Y88 PolarHBondContact O-N 3.39Å; Y88-F92 HydrophobicContact CE1-CD2 4.34Å; Y88-F92 PolarHBondContact O-N 2.79Å |
| 89 | A | 41 | Very low | 41.6 | Very low | 69 Ų | 69 | 115.2 Ų | 115.2 | 57% | 0.57 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -72.6 | -34.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | A93 | A89-A93 PolarHBondContact O-N 3.3Å |
| 90 | A | 41.8 | Very low | 41.3 | Very low | 65 Ų | 65 | 119.2 Ų | 119.2 | 54% | 0.537 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -68.2 | -36.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | F92 A93 Q94 | A90-F92 VanDerWaalsContact C-N 3.35Å; A90-F92 PolarHBondContact O-N 3.48Å; A90-A93 PolarHBondContact O-N 3.37Å; A90-Q94 PolarHBondContact O-N 3.02Å; A90-Q94 VanDerWaalsContact O-N 3.13Å |
| 91 | H | 38.2 | Very low | 41.2 | Very low | 116 Ų | 116 | 121.3 Ų | 121.3 | 54% | 0.537 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -69.6 | -29.8 | -179.1 | -123.6 | -82.9 | 0 | 0 | 0 | 113.4 | E87 K95 | E87-H91 PolarHBondContact O-N 3.5Å; H91-K95 PolarHBondContact O-N 3.34Å |
| 92 | F | 44.6 | Very low | 41.1 | Very low | 124 Ų | 124 | 116.5 Ų | 116.5 | 54% | 0.544 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -73.9 | -37.5 | 175.9 | -125.7 | -87.1 | 0 | 0 | 0 | 112.3 | Y88 A90 K95 Q96 | Y88-F92 HydrophobicContact CE1-CD2 4.34Å; Y88-F92 PolarHBondContact O-N 2.79Å; A90-F92 VanDerWaalsContact C-N 3.35Å; A90-F92 PolarHBondContact O-N 3.48Å; F92-K95 PolarHBondContact O-N 3.24Å; F92-Q96 WeakPolarHBondContact O-CG 3.46Å; F92-Q96 PolarHBondContact O-N 2.98Å |
| 93 | A | 44.8 | Very low | 41 | Very low | 58 Ų | 58 | 113.3 Ų | 113.3 | 48% | 0.479 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -68.3 | -35.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A89 A90 Q97 | A89-A93 PolarHBondContact O-N 3.3Å; A90-A93 PolarHBondContact O-N 3.37Å; A93-Q97 PolarHBondContact O-N 3.5Å |
| 94 | Q | 43.8 | Very low | 41.3 | Very low | 108 Ų | 108 | 114.1 Ų | 114.1 | 51% | 0.505 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -70.5 | -36.5 | 177.1 | -152.2 | 177.7 | 19.8 | 0 | 0 | 112.4 | A90 Q97 Q98 | A90-Q94 PolarHBondContact O-N 3.02Å; A90-Q94 VanDerWaalsContact O-N 3.13Å; Q94-Q97 PolarHBondContact O-N 3.49Å; Q94-Q98 PolarHBondContact O-N 3.05Å; Q94-Q98 VanDerWaalsContact O-N 3.11Å |
| 95 | K | 41.5 | Very low | 41.4 | Very low | 132 Ų | 132 | 117 Ų | 117 | 57% | 0.574 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -65.4 | -38.5 | 175.2 | -79.3 | -167.1 | -177.6 | -170.4 | 0 | 112.9 | H91 F92 Q97 Q98 T99 | H91-K95 PolarHBondContact O-N 3.34Å; F92-K95 PolarHBondContact O-N 3.24Å; K95-Q97 VanDerWaalsContact C-N 3.27Å; K95-Q97 PolarHBondContact O-N 2.92Å; K95-Q98 PolarHBondContact O-N 3.38Å; K95-T99 PolarHBondContact O-N 3.3Å; K95-T99 PolarHBondContact O-OG1 3.18Å |
| 96 | Q | 45.4 | Very low | 41.6 | Very low | 141 Ų | 141 | 121.5 Ų | 121.5 | 66% | 0.659 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -61.6 | -36.3 | 175.1 | -72.3 | -102 | -15.9 | 0 | 0 | 112.2 | F92 R100 | F92-Q96 WeakPolarHBondContact O-CG 3.46Å; F92-Q96 PolarHBondContact O-N 2.98Å; Q96-R100 PolarHBondContact O-N 3.29Å |
| 97 | Q | 46.2 | Very low | 42 | Very low | 143 Ų | 143 | 119 Ų | 119 | 67% | 0.668 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -74.7 | -26.9 | 176.2 | -67.1 | -170.3 | 9.4 | 0 | 0 | 113.3 | A93 Q94 K95 | A93-Q97 PolarHBondContact O-N 3.5Å; Q94-Q97 PolarHBondContact O-N 3.49Å; K95-Q97 VanDerWaalsContact C-N 3.27Å; K95-Q97 PolarHBondContact O-N 2.92Å |
| 98 | Q | 44.3 | Very low | 41.8 | Very low | 127 Ų | 127 | 120.7 Ų | 120.7 | 59% | 0.593 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -80.9 | -37.1 | 173.7 | -71.3 | 179.1 | -1.8 | 0 | 0 | 112.3 | Q94 K95 W101 A102 | Q94-Q98 PolarHBondContact O-N 3.05Å; Q94-Q98 VanDerWaalsContact O-N 3.11Å; K95-Q98 PolarHBondContact O-N 3.38Å; Q98-W101 PolarHBondContact O-N 3.24Å; Q98-A102 PolarHBondContact O-N 3.49Å |
| 99 | T | 44.1 | Very low | 42.2 | Very low | 84 Ų | 84 | 116.3 Ų | 116.3 | 52% | 0.515 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -71.7 | -30.4 | 179.7 | -52 | 0 | 0 | 0 | 0 | 112.9 | K95 W101 A102 | K95-T99 PolarHBondContact O-N 3.3Å; K95-T99 PolarHBondContact O-OG1 3.18Å; T99-W101 PolarHBondContact O-N 3.08Å; T99-A102 PolarHBondContact O-N 3.27Å |
| 100 | R | 39.8 | Very low | 42.5 | Very low | 210 Ų | 210 | 119.4 Ų | 119.4 | 79% | 0.792 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -66.7 | -15.7 | 173.8 | -173.7 | 163 | 171 | -94.6 | -0.5 | 113.6 | Q96 | Q96-R100 PolarHBondContact O-N 3.29Å |
| 101 | W | 39.8 | Very low | 42.5 | Very low | 208 Ų | 208 | 124.1 Ų | 124.1 | 79% | 0.788 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -103.1 | -11.5 | 176 | -68.6 | 66.7 | 0 | 0 | 0 | 113 | Q98 T99 | Q98-W101 PolarHBondContact O-N 3.24Å; T99-W101 PolarHBondContact O-N 3.08Å |
| 102 | A | 39.4 | Very low | 42.5 | Very low | 77 Ų | 77 | 121.8 Ų | 121.8 | 64% | 0.636 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -96.8 | -3.9 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q98 T99 | Q98-A102 PolarHBondContact O-N 3.49Å; T99-A102 PolarHBondContact O-N 3.27Å |
| 103 | C | 37.8 | Very low | 42.6 | Very low | 106 Ų | 106 | 120.2 Ų | 120.2 | 72% | 0.716 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -120.5 | 77 | 177.8 | -56.6 | 0 | 0 | 0 | 0 | 109.5 | | |
| 104 | G | 40.9 | Very low | 42.7 | Very low | 71 Ų | 71 | 123.4 Ų | 123.4 | 73% | 0.732 | 67% | 0.673 | S | S | * | * | S | Bend | trans | 169.4 | 6.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 116.9 | | |
| 105 | D | 40.6 | Very low | 42.8 | Very low | 127 Ų | 127 | 126 Ų | 126 | 68% | 0.679 | 68% | 0.683 | S | S | * | * | | | trans | -123.2 | 54.3 | 178.3 | -163.3 | 41.4 | 0 | 0 | 0 | 110.7 | G107 | D105-G107 VanDerWaalsContact C-N 3.34Å; D105-G107 PolarHBondContact O-N 3.41Å; D105-G107 VanDerWaalsContact O-N 3.15Å |
| 106 | D | 42.2 | Very low | 42.9 | Very low | 169 Ų | 169 | 129.5 Ų | 129.5 | 90% | 0.904 | 69% | 0.692 | S | S | * | * | | | trans | -79.4 | 90.1 | 164.8 | -67.6 | -44.6 | 0 | 0 | 0 | 108.3 | | |
| 107 | G | 46.5 | Very low | 42.9 | Very low | 53 Ų | 53 | 131.2 Ų | 131.2 | 55% | 0.546 | 70% | 0.697 | S | S | . | * | S | Bend | trans | 73.7 | 99.7 | 155.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | D105 | D105-G107 VanDerWaalsContact C-N 3.34Å; D105-G107 PolarHBondContact O-N 3.41Å; D105-G107 VanDerWaalsContact O-N 3.15Å |
| 108 | H | 38.2 | Very low | 42.6 | Very low | 174 Ų | 174 | 134.6 Ų | 134.6 | 81% | 0.806 | 71% | 0.706 | S | S | * | * | | | | 162.9 | 119.8 | 120.1 | -78.4 | -57.7 | 0 | 0 | 0 | 107.4 | I110 | H108-I110 PolarHBondContact O-N 3.47Š|
| 109 | G | 44.8 | Very low | 42.5 | Very low | 81 Ų | 81 | 134.6 Ų | 134.6 | 84% | 0.835 | 71% | 0.71 | S | S | * | * | | | trans | -46.1 | 124.5 | -170.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | D111 | G109-D111 VanDerWaalsContact C-N 3.25Å; G109-D111 PolarHBondContact O-N 3.44Å |
| 110 | I | 47.3 | Very low | 42.3 | Very low | 133 Ų | 133 | 135.2 Ų | 135.2 | 68% | 0.682 | 72% | 0.715 | S | S | * | * | | | trans | -90.2 | 68.7 | 170.8 | -52.3 | -174 | 0 | 0 | 0 | 108.4 | H108 N112 | H108-I110 PolarHBondContact O-N 3.47Å; I110-N112 VanDerWaalsContact C-N 3.28Å; I110-N112 PolarHBondContact O-N 3.4Å |
| 111 | D | 42.5 | Very low | 42.5 | Very low | 165 Ų | 165 | 131.3 Ų | 131.3 | 88% | 0.882 | 72% | 0.717 | S | S | * | * | | | trans | -77.3 | 85.7 | 144.3 | -91.8 | -47.5 | 0 | 0 | 0 | 106.6 | G109 | G109-D111 VanDerWaalsContact C-N 3.25Å; G109-D111 PolarHBondContact O-N 3.44Å |
| 112 | N | 38.9 | Very low | 42.5 | Very low | 67 Ų | 67 | 129.5 Ų | 129.5 | 36% | 0.358 | 72% | 0.719 | S | S | . | * | | | trans | -176.8 | 104.4 | 148.4 | -154.7 | 58.3 | 0 | 0 | 0 | 112.1 | I110 D114 K115 | I110-N112 VanDerWaalsContact C-N 3.28Å; I110-N112 PolarHBondContact O-N 3.4Å; N112-D114 PolarHBondContact O-N 3.44Å; N112-K115 HydrophobicContact CB-CG 4.41Å |
| 113 | P | 46.9 | Very low | 42.4 | Very low | 90 Ų | 90 | 131.8 Ų | 131.8 | 58% | 0.584 | 72% | 0.721 | S | S | * | * | G | 310 helix | trans | -71.7 | -9.1 | 178.7 | 28.2 | -32.9 | 0 | 0 | 0 | 114.3 | K115 | P113-K115 PolarHBondContact O-N 3.13Š|
| 114 | D | 46.5 | Very low | 42.6 | Very low | 125 Ų | 125 | 132.5 Ų | 132.5 | 67% | 0.668 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -86.8 | -0.6 | -174.2 | -67.4 | -38.5 | 0 | 0 | 0 | 115.3 | N112 | N112-D114 PolarHBondContact O-N 3.44Š|
| 115 | K | 45.8 | Very low | 42.7 | Very low | 164 Ų | 164 | 132.8 Ų | 132.8 | 71% | 0.713 | 72% | 0.719 | S | S | * | * | G | 310 helix | trans | -80.9 | -13.3 | 179.8 | -64.8 | -76.3 | -173.5 | 177.4 | 0 | 113.4 | N112 P113 K117 | N112-K115 HydrophobicContact CB-CG 4.41Å; P113-K115 PolarHBondContact O-N 3.13Å; K115-K117 PolarHBondContact O-N 2.97Å |
| 116 | W | 43 | Very low | 42.8 | Very low | 204 Ų | 204 | 134.1 Ų | 134.1 | 77% | 0.773 | 73% | 0.727 | S | S | * | * | G | 310 helix | trans | -78.4 | -6.7 | -177 | -48.9 | -25.1 | 0 | 0 | 0 | 113.8 | Y118 | W116-Y118 PolarHBondContact O-N 3.43Š|
| 117 | K | 45.6 | Very low | 42.7 | Very low | 177 Ų | 177 | 130.7 Ų | 130.7 | 77% | 0.77 | 72% | 0.721 | S | S | * | * | G | 310 helix | trans | -81.5 | 1.1 | -176.4 | -143.4 | 162.1 | 74.1 | -173.5 | 0 | 114.5 | K115 | K115-K117 PolarHBondContact O-N 2.97Š|
| 118 | Y | 40.7 | Very low | 42.1 | Very low | 215 Ų | 215 | 132.1 Ų | 132.1 | 84% | 0.843 | 73% | 0.728 | S | S | * | * | | | trans | -136.3 | 75.7 | 172.1 | -71.2 | -78.2 | 0 | 0 | 0 | 110.8 | W116 | W116-Y118 PolarHBondContact O-N 3.43Š|
| 119 | N | 40.9 | Very low | 42 | Very low | 127 Ų | 127 | 130 Ų | 130 | 68% | 0.679 | 73% | 0.73 | S | S | * | * | | | trans | -118.7 | 115.5 | 155.4 | -161.4 | 57.9 | 0 | 0 | 0 | 107.1 | | |
| 120 | P | 39.8 | Very low | 41.7 | Very low | 96 Ų | 96 | 130 Ų | 130 | 62% | 0.623 | 73% | 0.73 | S | S | * | * | | | trans | -63.7 | 152.1 | 171.3 | 29.3 | -30.9 | 0 | 0 | 0 | 108.4 | M122 | P120-M122 PolarHBondContact O-N 3.33Š|
| 121 | P | 44.9 | Very low | 41.2 | Very low | 128 Ų | 128 | 127 Ų | 127 | 83% | 0.831 | 73% | 0.731 | S | S | * | * | | | trans | -61 | 112.7 | -179.9 | 24.2 | -31.4 | 0 | 0 | 0 | 108.8 | N123 | P121-N123 PolarHBondContact O-N 2.96Š|
| 122 | M | 38.8 | Very low | 41 | Very low | 171 Ų | 171 | 125 Ų | 125 | 84% | 0.842 | 73% | 0.728 | S | S | * | * | | | trans | -61.2 | 109.6 | 167.4 | -82.6 | -133.1 | -69.7 | 0 | 0 | 107.8 | P120 | P120-M122 PolarHBondContact O-N 3.33Š|
| 123 | N | 38.4 | Very low | 41.1 | Very low | 124 Ų | 124 | 128.5 Ų | 128.5 | 66% | 0.663 | 75% | 0.754 | S | S | * | * | | | trans | -62.8 | 125.7 | 170.3 | -171.8 | 5.1 | 0 | 0 | 0 | 108.5 | P121 A125 | P121-N123 PolarHBondContact O-N 2.96Å; N123-A125 PolarHBondContact O-N 3.4Å |
| 124 | P | 41.7 | Very low | 40.5 | Very low | 121 Ų | 121 | 127.8 Ų | 127.8 | 79% | 0.786 | 76% | 0.763 | S | S | * | * | G | 310 helix | trans | -62.7 | -2.2 | -178.4 | -22.6 | 32.8 | 0 | 0 | 0 | 115.6 | N126 | P124-N126 VanDerWaalsContact C-N 3.31Å; P124-N126 PolarHBondContact O-N 3.49Å |
| 125 | A | 42 | Very low | 40 | Very low | 77 Ų | 77 | 129.7 Ų | 129.7 | 64% | 0.636 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -74.9 | -8.2 | -173.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | N123 | N123-A125 PolarHBondContact O-N 3.4Š|
| 126 | N | 43.3 | Very low | 39.7 | Very low | 156 Ų | 156 | 124.8 Ų | 124.8 | 83% | 0.834 | 77% | 0.77 | S | S | * | * | G | 310 helix | trans | -122.1 | 19 | -170.5 | -149.1 | 67.5 | 0 | 0 | 0 | 116.2 | P124 | P124-N126 VanDerWaalsContact C-N 3.31Å; P124-N126 PolarHBondContact O-N 3.49Å |
| 127 | A | 39.7 | Very low | 39.6 | Very low | 96 Ų | 96 | 120.9 Ų | 120.9 | 79% | 0.793 | 77% | 0.773 | S | S | * | * | | | trans | -107.8 | 34.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 128 | A | 34.7 | Very low | 39.5 | Very low | 83 Ų | 83 | 120.9 Ų | 120.9 | 69% | 0.686 | 78% | 0.782 | S | S | * | * | | | trans | -85.5 | 135.6 | 170.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | G130 | A128-G130 PolarHBondContact O-N 2.96Š|
| 129 | P | 35.7 | Very low | 39.1 | Very low | 130 Ų | 130 | 114.2 Ų | 114.2 | 84% | 0.844 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -63.3 | 124.6 | 178.3 | -17.4 | 29.7 | 0 | 0 | 0 | 111.9 | | |
| 130 | G | 38.7 | Very low | 38.6 | Very low | 81 Ų | 81 | 111.7 Ų | 111.7 | 84% | 0.835 | 78% | 0.782 | S | S | * | * | | | trans | 48.6 | 89.6 | 154.9 | 0 | 0 | 0 | 0 | 0 | 118.4 | A128 | A128-G130 PolarHBondContact O-N 2.96Š|
| 131 | G | 37.3 | Very low | 38.8 | Very low | 69 Ų | 69 | 113.3 Ų | 113.3 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | | | trans | -95.7 | 148.9 | 155.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 132 | P | 37.6 | Very low | 38.3 | Very low | 125 Ų | 125 | 110.2 Ų | 110.2 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | | | trans | -65.1 | 153.2 | -173.8 | 27.9 | -33.5 | 0 | 0 | 0 | 112.1 | G134 | P132-G134 PolarHBondContact O-N 3.29Š|
| 133 | P | 40.1 | Very low | 38.7 | Very low | 139 Ų | 139 | 107.4 Ų | 107.4 | 90% | 0.903 | 79% | 0.788 | S | S | * | * | | | trans | -67.6 | 105.6 | -168.2 | 26.4 | -32.3 | 0 | 0 | 0 | 111.2 | | |
| 134 | G | 35.2 | Very low | 38.9 | Very low | 75 Ų | 75 | 108.6 Ų | 108.6 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | | | trans | -87.4 | 119.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | P132 | P132-G134 PolarHBondContact O-N 3.29Š|
| 135 | N | 37.1 | Very low | 38.7 | Very low | 165 Ų | 165 | 105.5 Ų | 105.5 | 88% | 0.882 | 78% | 0.783 | S | S | * | * | | | trans | -42 | 133.1 | -179.6 | -149 | 51.5 | 0 | 0 | 0 | 114.5 | | |
| 136 | G | 38.8 | Very low | 38.8 | Very low | 62 Ų | 62 | 108.9 Ų | 108.9 | 64% | 0.639 | 80% | 0.796 | S | S | * | * | | | trans | -64.3 | 145.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 137 | S | 39.8 | Very low | 38.7 | Very low | 122 Ų | 122 | 108 Ų | 108 | 85% | 0.853 | 79% | 0.79 | S | S | * | * | | | trans | -167.7 | 124.5 | 148.4 | -86.4 | 0 | 0 | 0 | 0 | 109.7 | | |
| 138 | N | 43.8 | Very low | 38.5 | Very low | 177 Ų | 177 | 107.1 Ų | 107.1 | 95% | 0.947 | 79% | 0.79 | S | S | * | * | | | trans | -48.2 | 145.9 | 166.6 | -86.3 | -30.4 | 0 | 0 | 0 | 112.4 | | |
| 139 | G | 32.7 | Very low | 39 | Very low | 74 Ų | 74 | 111.8 Ų | 111.8 | 76% | 0.763 | 80% | 0.8 | S | S | * | * | | | trans | 123.6 | 110.1 | 153.3 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 140 | G | 31 | Very low | 39.2 | Very low | 75 Ų | 75 | 109.2 Ų | 109.2 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | | | trans | -63.2 | 169.8 | 143.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 141 | P | 43.3 | Very low | 39.1 | Very low | 129 Ų | 129 | 111.7 Ų | 111.7 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | | | cis | -139.8 | 171.4 | 33.4 | 37.7 | -18.3 | 0 | 0 | 0 | 115.7 | | |
| 142 | G | 34.6 | Very low | 39.1 | Very low | 64 Ų | 64 | 111.7 Ų | 111.7 | 66% | 0.66 | 80% | 0.802 | S | S | * | * | | | trans | 89.3 | 121.5 | 147.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | I144 | G142-I144 PolarHBondContact O-N 3.46Š|
| 143 | A | 48.3 | Very low | 39.1 | Very low | 111 Ų | 111 | 114.4 Ų | 114.4 | 92% | 0.917 | 81% | 0.808 | S | S | * | * | | | trans | -60.2 | 100.4 | 160.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | G145 | A143-G145 PolarHBondContact O-N 3.39Š|
| 144 | I | 42.5 | Very low | 38.8 | Very low | 149 Ų | 149 | 111.7 Ų | 111.7 | 76% | 0.764 | 81% | 0.805 | S | S | * | * | | | trans | -77.6 | 112.1 | 165.5 | -62 | -177 | 0 | 0 | 0 | 106 | G142 | G142-I144 PolarHBondContact O-N 3.46Š|
| 145 | G | 36.9 | Very low | 38.9 | Very low | 56 Ų | 56 | 112 Ų | 112 | 58% | 0.577 | 81% | 0.809 | S | S | * | * | | | trans | -52.2 | 150.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | A143 I147 | A143-G145 PolarHBondContact O-N 3.39Å; G145-I147 PolarHBondContact O-N 3.32Å |
| 146 | T | 43.5 | Very low | 38.7 | Very low | 148 Ų | 148 | 108.4 Ų | 108.4 | 91% | 0.908 | 81% | 0.81 | S | S | * | * | | | trans | -52.3 | 104.9 | 168 | 43.5 | 0 | 0 | 0 | 0 | 109 | G148 | T146-G148 PolarHBondContact O-N 3.09Š|
| 147 | I | 41.3 | Very low | 38.5 | Very low | 137 Ų | 137 | 109.2 Ų | 109.2 | 70% | 0.703 | 82% | 0.819 | S | S | * | * | | | trans | -60.9 | 104.2 | 168.3 | -65.9 | 167.7 | 0 | 0 | 0 | 106 | G145 M149 | G145-I147 PolarHBondContact O-N 3.32Å; I147-M149 PolarHBondContact O-N 3.21Å; I147-M149 VanDerWaalsContact O-N 3.11Å |
| 148 | G | 36.7 | Very low | 38.4 | Very low | 78 Ų | 78 | 107.5 Ų | 107.5 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | | | trans | -67.3 | 102.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | T146 | T146-G148 PolarHBondContact O-N 3.09Š|
| 149 | M | 43.7 | Very low | 38 | Very low | 182 Ų | 182 | 103 Ų | 103 | 90% | 0.897 | 82% | 0.816 | S | S | * | * | | | trans | -91 | 117.3 | 157.5 | -76.2 | -175.6 | -179.4 | 0 | 0 | 107.7 | I147 | I147-M149 PolarHBondContact O-N 3.21Å; I147-M149 VanDerWaalsContact O-N 3.11Å |
| 150 | G | 39.6 | Very low | 38.2 | Very low | 76 Ų | 76 | 103.4 Ų | 103.4 | 78% | 0.784 | 82% | 0.82 | S | S | * | * | | | trans | 161.2 | 89.5 | 171.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | | |
| 151 | S | 38 | Very low | 38.6 | Very low | 133 Ų | 133 | 105.2 Ų | 105.2 | 93% | 0.93 | 83% | 0.828 | S | S | * | * | | | trans | -41.1 | 147.4 | 161.4 | -68 | 0 | 0 | 0 | 0 | 114.3 | | |
| 152 | G | 36.5 | Very low | 38.2 | Very low | 69 Ų | 69 | 102.7 Ų | 102.7 | 71% | 0.711 | 83% | 0.825 | S | S | * | * | | | trans | 142.8 | 96.8 | 145.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | | |
| 153 | L | 37.6 | Very low | 38.6 | Very low | 182 Ų | 182 | 103.9 Ų | 103.9 | 95% | 0.953 | 84% | 0.837 | S | S | * | * | | | trans | 6.2 | 130.7 | 146.4 | -76.3 | 68.5 | 0 | 0 | 0 | 118.5 | | |
| 154 | G | 34.3 | Very low | 38 | Very low | 81 Ų | 81 | 102.1 Ų | 102.1 | 84% | 0.835 | 83% | 0.83 | S | S | * | * | | | trans | 128.6 | 107.4 | 130.2 | 0 | 0 | 0 | 0 | 0 | 117 | | |
| 155 | G | 36.5 | Very low | 38.2 | Very low | 82 Ų | 82 | 102.7 Ų | 102.7 | 85% | 0.845 | 84% | 0.835 | S | S | * | * | | | | 91 | 101.7 | 129.6 | 0 | 0 | 0 | 0 | 0 | 118.1 | | |
| 156 | G | 33.8 | Very low | 38.4 | Very low | 89 Ų | 89 | 107.9 Ų | 107.9 | 92% | 0.918 | 85% | 0.85 | S | S | * | * | | | | 48.7 | 119.5 | 127.3 | 0 | 0 | 0 | 0 | 0 | 119.7 | | |
| 157 | G | 35.3 | Very low | 37.9 | Very low | 80 Ų | 80 | 104.9 Ų | 104.9 | 83% | 0.825 | 85% | 0.848 | S | S | * | * | | | trans | 171.3 | 59.9 | 164.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 158 | G | 37 | Very low | 37.6 | Very low | 85 Ų | 85 | 101.9 Ų | 101.9 | 88% | 0.876 | 85% | 0.85 | S | S | * | * | | | trans | -76.5 | 133.2 | 160.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 159 | G | 36 | Very low | 37.9 | Very low | 84 Ų | 84 | 103.7 Ų | 103.7 | 87% | 0.866 | 85% | 0.851 | S | S | * | * | | | trans | 112 | 129.6 | 163.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | | |
| 160 | G | 35.2 | Very low | 37.6 | Very low | 81 Ų | 81 | 98.5 Ų | 98.5 | 84% | 0.835 | 84% | 0.844 | S | S | * | * | | | trans | 156 | 86.5 | 164.9 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 161 | A | 39.8 | Very low | 38.1 | Very low | 113 Ų | 113 | 100.6 Ų | 100.6 | 93% | 0.934 | 84% | 0.842 | S | S | * | * | | | trans | -53.2 | 159.5 | 162.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 162 | G | 35.8 | Very low | 38.5 | Very low | 76 Ų | 76 | 102 Ų | 102 | 78% | 0.784 | 84% | 0.839 | S | S | * | * | | | trans | 147.6 | 102.7 | 153.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | | |
| 163 | G | 43.3 | Very low | 38.7 | Very low | 89 Ų | 89 | 101.9 Ų | 101.9 | 92% | 0.918 | 84% | 0.837 | S | S | * | * | | | trans | -64.8 | 154.6 | 158 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 164 | G | 35.8 | Very low | 39.2 | Very low | 75 Ų | 75 | 96.3 Ų | 96.3 | 77% | 0.773 | 82% | 0.824 | S | S | * | * | | | trans | 173.1 | 97.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | N166 | G164-N166 PolarHBondContact O-N 3.29Š|
| 165 | N | 45.4 | Very low | 39.9 | Very low | 161 Ų | 161 | 100.5 Ų | 100.5 | 86% | 0.861 | 83% | 0.826 | S | S | * | * | | | trans | -59.1 | 126.1 | 164.2 | -64.7 | 11.5 | 0 | 0 | 0 | 109.8 | | |
| 166 | N | 41.3 | Very low | 40.4 | Very low | 165 Ų | 165 | 103.6 Ų | 103.6 | 88% | 0.882 | 82% | 0.818 | S | S | * | * | | | | 168 | 134.7 | 122.4 | -101.2 | 5.6 | 0 | 0 | 0 | 112.3 | G164 | G164-N166 PolarHBondContact O-N 3.29Š|
| 167 | G | 33.8 | Very low | 40.8 | Very low | 85 Ų | 85 | 107.2 Ų | 107.2 | 88% | 0.876 | 81% | 0.811 | S | S | * | * | | | trans | 100.1 | 107.4 | 130.9 | 0 | 0 | 0 | 0 | 0 | 117.9 | | |
| 168 | G | 34.3 | Very low | 41.3 | Very low | 73 Ų | 73 | 112.1 Ų | 112.1 | 75% | 0.753 | 81% | 0.813 | S | S | * | * | | | trans | 138.9 | 78.1 | 160.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | | |
| 169 | S | 42.5 | Very low | 41.5 | Very low | 117 Ų | 117 | 112 Ų | 112 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | | | | 46 | 77.3 | 93.5 | -171.7 | 0 | 0 | 0 | 0 | 113.5 | | |
| 170 | G | 37.3 | Very low | 41.8 | Very low | 73 Ų | 73 | 115 Ų | 115 | 75% | 0.753 | 79% | 0.792 | S | S | * | * | | | trans | -119.8 | 71.4 | 157 | 0 | 0 | 0 | 0 | 0 | 108.9 | N172 | G170-N172 PolarHBondContact O-N 2.87Š|
| 171 | T | 51.5 | Low | 42.1 | Very low | 119 Ų | 119 | 114.4 Ų | 114.4 | 73% | 0.73 | 78% | 0.779 | S | S | * | * | | | trans | -57.6 | 99.2 | 167.9 | -48.5 | 0 | 0 | 0 | 0 | 108.3 | | |
| 172 | N | 45.8 | Very low | 42.2 | Very low | 164 Ų | 164 | 112.2 Ų | 112.2 | 88% | 0.877 | 76% | 0.761 | S | S | * | * | | | trans | 175 | 82.2 | 152.4 | -85.3 | -18.6 | 0 | 0 | 0 | 109.7 | G170 | G170-N172 PolarHBondContact O-N 2.87Š|
| 173 | G | 39.6 | Very low | 42.6 | Very low | 65 Ų | 65 | 110.9 Ų | 110.9 | 67% | 0.67 | 74% | 0.743 | S | S | * | * | | | trans | -161.8 | 20.4 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | | |
| 174 | G | 48.4 | Very low | 42.5 | Very low | 66 Ų | 66 | 109.6 Ų | 109.6 | 68% | 0.68 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.1 | 146.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | | |
| 175 | L | 49.6 | Very low | 42.8 | Very low | 168 Ų | 168 | 109.1 Ų | 109.1 | 88% | 0.88 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 108.5 | -0.2 | 170.2 | -53.9 | 173.7 | 0 | 0 | 0 | 118.3 | | |
| 176 | H | 46.3 | Very low | 42.8 | Very low | 147 Ų | 147 | 106.6 Ų | 106.6 | 68% | 0.681 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -118.8 | 12.3 | -179.9 | -73 | -85.8 | 0 | 0 | 0 | 117 | | |
| 177 | H | 43.9 | Very low | 42.7 | Very low | 166 Ų | 166 | 104.7 Ų | 104.7 | 77% | 0.769 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -122.7 | 1.9 | 179.5 | -79.5 | -87.4 | 0 | 0 | 0 | 116.1 | | |
| 178 | Q | 44.7 | Very low | 43 | Very low | 182 Ų | 182 | 103.1 Ų | 103.1 | 85% | 0.85 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -88.1 | -23.1 | 172.8 | -83.3 | -174.3 | -6.3 | 0 | 0 | 113.9 | | |
| 179 | S | 40.6 | Very low | 43.3 | Very low | 83 Ų | 83 | 102.2 Ų | 102.2 | 58% | 0.58 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -80 | -29.6 | -175.9 | 61.4 | 0 | 0 | 0 | 0 | 114.5 | A183 | S179-A183 WeakPolarHBondContact O-CB 3.43Å; S179-A183 PolarHBondContact O-N 3.26Å |
| 180 | M | 42.3 | Very low | 43.2 | Very low | 146 Ų | 146 | 103 Ų | 103 | 72% | 0.719 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -76.6 | -33.9 | 178.3 | -75.9 | -165.8 | -154.6 | 0 | 0 | 113.3 | A183 A184 | M180-A183 PolarHBondContact O-N 3.3Å; M180-A184 PolarHBondContact O-N 3.37Å; M180-A184 VanDerWaalsContact O-N 3.13Å |
| 181 | A | 42.7 | Very low | 43.8 | Very low | 70 Ų | 70 | 106.7 Ų | 106.7 | 58% | 0.579 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -68.2 | -37.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | A185 | A181-A185 PolarHBondContact O-N 3.31Å |
| 182 | A | 41.7 | Very low | 43.6 | Very low | 66 Ų | 66 | 107.6 Ų | 107.6 | 55% | 0.545 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -71.1 | -34.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | N186 | A182-N186 WeakPolarHBondContact O-CB 3.44Å; A182-N186 PolarHBondContact O-N 3.49Å; A182-N186 VanDerWaalsContact O-N 3.14Å |
| 183 | A | 43 | Very low | 43.5 | Very low | 49 Ų | 49 | 102.7 Ų | 102.7 | 41% | 0.405 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -70.1 | -35.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113 | S179 M180 N186 M187 | S179-A183 WeakPolarHBondContact O-CB 3.43Å; S179-A183 PolarHBondContact O-N 3.26Å; M180-A183 PolarHBondContact O-N 3.3Å; A183-N186 PolarHBondContact O-N 3.1Å; A183-M187 PolarHBondContact O-N 3.4Å |
| 184 | A | 41.6 | Very low | 43.5 | Very low | 61 Ų | 61 | 102.6 Ų | 102.6 | 50% | 0.504 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -69.9 | -38.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | M180 N186 M187 A188 | M180-A184 PolarHBondContact O-N 3.37Å; M180-A184 VanDerWaalsContact O-N 3.13Å; A184-N186 VanDerWaalsContact C-N 3.33Å; A184-N186 PolarHBondContact O-N 3.38Å; A184-M187 PolarHBondContact O-N 3.45Å; A184-A188 PolarHBondContact O-N 3.4Å |
| 185 | A | 42.8 | Very low | 43.1 | Very low | 66 Ų | 66 | 102.4 Ų | 102.4 | 55% | 0.545 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -65.3 | -35.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | A181 A188 A189 | A181-A185 PolarHBondContact O-N 3.31Å; A185-A188 PolarHBondContact O-N 3.11Å; A185-A189 PolarHBondContact O-N 3.29Å |
| 186 | N | 44.3 | Very low | 42.9 | Very low | 108 Ų | 108 | 99.4 Ų | 99.4 | 58% | 0.578 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -71.8 | -29.6 | 179.7 | -153.2 | 16.5 | 0 | 0 | 0 | 113 | A182 A183 A184 M190 | A182-N186 WeakPolarHBondContact O-CB 3.44Å; A182-N186 PolarHBondContact O-N 3.49Å; A182-N186 VanDerWaalsContact O-N 3.14Å; A183-N186 PolarHBondContact O-N 3.1Å; A184-N186 VanDerWaalsContact C-N 3.33Å; A184-N186 PolarHBondContact O-N 3.38Å; N186-M190 PolarHBondContact O-N 3.01Å |
| 187 | M | 39.4 | Very low | 43 | Very low | 124 Ų | 124 | 95.2 Ų | 95.2 | 61% | 0.611 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -73.4 | -35.4 | 173.3 | -91.9 | -179.4 | -83.7 | 0 | 0 | 113.1 | A183 A184 M190 Q191 | A183-M187 PolarHBondContact O-N 3.4Å; A184-M187 PolarHBondContact O-N 3.45Å; M187-M190 PolarHBondContact O-N 3.32Å; M187-Q191 PolarHBondContact O-N 2.99Å |
| 188 | A | 39.8 | Very low | 42.8 | Very low | 53 Ų | 53 | 94.8 Ų | 94.8 | 44% | 0.438 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66.5 | -38.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A184 A185 Q191 Q192 | A184-A188 PolarHBondContact O-N 3.4Å; A185-A188 PolarHBondContact O-N 3.11Å; A188-Q191 PolarHBondContact O-N 3.5Å; A188-Q192 PolarHBondContact O-N 2.91Å |
| 189 | A | 42.3 | Very low | 42.6 | Very low | 53 Ų | 53 | 91.2 Ų | 91.2 | 44% | 0.438 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -66.8 | -35.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A185 Q192 A193 | A185-A189 PolarHBondContact O-N 3.29Å; A189-Q192 PolarHBondContact O-N 3.48Å; A189-A193 PolarHBondContact O-N 3.07Å; A189-A193 VanDerWaalsContact O-N 3.1Å |
| 190 | M | 40 | Very low | 42.8 | Very low | 133 Ų | 133 | 91.9 Ų | 91.9 | 66% | 0.655 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -68.3 | -35.4 | 175.4 | -87.4 | -171.8 | 174.6 | 0 | 0 | 113.4 | N186 M187 A193 A194 | N186-M190 PolarHBondContact O-N 3.01Å; M187-M190 PolarHBondContact O-N 3.32Å; M190-A193 PolarHBondContact O-N 3.5Å; M190-A194 PolarHBondContact O-N 3.02Å |
| 191 | Q | 49.4 | Very low | 42.8 | Very low | 151 Ų | 151 | 90.9 Ų | 90.9 | 71% | 0.706 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -69.1 | -33.6 | 176.2 | -80.4 | 176.2 | -4.2 | 0 | 0 | 112.5 | M187 A188 A194 A195 | M187-Q191 PolarHBondContact O-N 2.99Å; A188-Q191 PolarHBondContact O-N 3.5Å; Q191-A194 PolarHBondContact O-N 2.9Å; Q191-A195 WeakPolarHBondContact O-CB 3.49Å; Q191-A195 PolarHBondContact O-N 3.18Å |
| 192 | Q | 47.8 | Very low | 42.7 | Very low | 139 Ų | 139 | 93.6 Ų | 93.6 | 65% | 0.65 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -70.1 | -37.2 | 173 | -73 | 177.3 | -27.4 | 0 | 0 | 112.2 | A188 A189 A195 L196 | A188-Q192 PolarHBondContact O-N 2.91Å; A189-Q192 PolarHBondContact O-N 3.48Å; Q192-A195 PolarHBondContact O-N 3.06Å; Q192-L196 WeakPolarHBondContact O-CB 3.48Å; Q192-L196 PolarHBondContact O-N 3.38Å |
| 193 | A | 42.8 | Very low | 42.9 | Very low | 61 Ų | 61 | 94.7 Ų | 94.7 | 50% | 0.504 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -66.3 | -37.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | A189 M190 L196 A197 | A189-A193 PolarHBondContact O-N 3.07Å; A189-A193 VanDerWaalsContact O-N 3.1Å; M190-A193 PolarHBondContact O-N 3.5Å; A193-L196 PolarHBondContact O-N 3.05Å; A193-A197 WeakPolarHBondContact O-CB 3.49Å; A193-A197 PolarHBondContact O-N 3.47Å |
| 194 | A | 39.5 | Very low | 43 | Very low | 62 Ų | 62 | 95.8 Ų | 95.8 | 51% | 0.512 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -70 | -34.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | M190 Q191 A197 K198 | M190-A194 PolarHBondContact O-N 3.02Å; Q191-A194 PolarHBondContact O-N 2.9Å; A194-A197 PolarHBondContact O-N 3.24Å; A194-K198 PolarHBondContact O-N 3.49Å; A194-K198 VanDerWaalsContact O-N 3.07Å |
| 195 | A | 40.9 | Very low | 43.3 | Very low | 63 Ų | 63 | 99.2 Ų | 99.2 | 52% | 0.521 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -68.6 | -39.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q191 Q192 K198 H199 | Q191-A195 WeakPolarHBondContact O-CB 3.49Å; Q191-A195 PolarHBondContact O-N 3.18Å; Q192-A195 PolarHBondContact O-N 3.06Å; A195-K198 PolarHBondContact O-N 3.49Å; A195-H199 PolarHBondContact O-N 3.37Å |
| 196 | L | 46 | Very low | 43.6 | Very low | 105 Ų | 105 | 99 Ų | 99 | 55% | 0.55 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -69.3 | -34 | 173.7 | -80.4 | 158.2 | 0 | 0 | 0 | 112.8 | Q192 A193 H199 N200 | Q192-L196 WeakPolarHBondContact O-CB 3.48Å; Q192-L196 PolarHBondContact O-N 3.38Å; A193-L196 PolarHBondContact O-N 3.05Å; L196-H199 PolarHBondContact O-N 3.22Å; L196-N200 PolarHBondContact O-N 3.29Å; L196-N200 PolarHBondContact O-ND2 3.25Å |
| 197 | A | 46.7 | Very low | 43.7 | Very low | 58 Ų | 58 | 97 Ų | 97 | 48% | 0.479 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -65.1 | -40.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | A193 A194 H199 N200 H201 | A193-A197 WeakPolarHBondContact O-CB 3.49Å; A193-A197 PolarHBondContact O-N 3.47Å; A194-A197 PolarHBondContact O-N 3.24Å; A197-H199 VanDerWaalsContact C-N 3.32Å; A197-H199 PolarHBondContact O-N 3.24Å; A197-N200 PolarHBondContact O-N 3.44Å; A197-H201 WeakPolarHBondContact O-CB 3.38Å; A197-H201 PolarHBondContact O-N 3.13Å |
| 198 | K | 41.4 | Very low | 44.1 | Very low | 158 Ų | 158 | 94 Ų | 94 | 69% | 0.687 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -67.9 | -30.8 | 175.2 | -152.5 | 178.6 | -176 | -175.3 | 0 | 112.5 | A194 A195 M202 | A194-K198 PolarHBondContact O-N 3.49Å; A194-K198 VanDerWaalsContact O-N 3.07Å; A195-K198 PolarHBondContact O-N 3.49Å; K198-M202 PolarHBondContact O-N 3.24Å |
| 199 | H | 39.2 | Very low | 44.4 | Very low | 107 Ų | 107 | 94.2 Ų | 94.2 | 50% | 0.495 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -71.1 | -43.5 | 174 | -170.8 | -129.4 | 0 | 0 | 0 | 112.3 | A195 L196 A197 H201 M202 I203 | A195-H199 PolarHBondContact O-N 3.37Å; L196-H199 PolarHBondContact O-N 3.22Å; A197-H199 VanDerWaalsContact C-N 3.32Å; A197-H199 PolarHBondContact O-N 3.24Å; H199-H201 PolarHBondContact O-N 3.44Å; H199-M202 PolarHBondContact O-N 3.42Å; H199-I203 PolarHBondContact O-N 3.19Å |
| 200 | N | 44.6 | Very low | 44.8 | Very low | 96 Ų | 96 | 96.7 Ų | 96.7 | 51% | 0.513 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.7 | -36.4 | 174.1 | -86.9 | -49.6 | 0 | 0 | 0 | 112.6 | L196 A197 M202 I203 S204 | L196-N200 PolarHBondContact O-N 3.29Å; L196-N200 PolarHBondContact O-ND2 3.25Å; A197-N200 PolarHBondContact O-N 3.44Å; N200-M202 VanDerWaalsContact C-N 3.32Å; N200-M202 PolarHBondContact O-N 3.21Å; N200-I203 PolarHBondContact O-N 3.39Å; N200-S204 PolarHBondContact O-N 3.29Å; N200-S204 PolarHBondContact O-OG 3.36Å |
| 201 | H | 43.9 | Very low | 45.2 | Very low | 126 Ų | 126 | 93.4 Ų | 93.4 | 58% | 0.583 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -67 | -32.8 | -179.7 | -142.7 | -25.3 | 0 | 0 | 0 | 113.1 | A197 H199 Q205 | A197-H201 WeakPolarHBondContact O-CB 3.38Å; A197-H201 PolarHBondContact O-N 3.13Å; H199-H201 PolarHBondContact O-N 3.44Å; H201-Q205 PolarHBondContact O-N 3.28Å |
| 202 | M | 40.2 | Very low | 45.1 | Very low | 126 Ų | 126 | 89.6 Ų | 89.6 | 62% | 0.621 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -71.8 | -40.4 | 172.9 | -104.8 | -172.8 | -65.6 | 0 | 0 | 112.5 | K198 H199 N200 S204 Q205 A206 | K198-M202 PolarHBondContact O-N 3.24Å; H199-M202 PolarHBondContact O-N 3.42Å; N200-M202 VanDerWaalsContact C-N 3.32Å; N200-M202 PolarHBondContact O-N 3.21Å; M202-S204 VanDerWaalsContact C-N 3.33Å; M202-S204 PolarHBondContact O-N 3.32Å; M202-Q205 PolarHBondContact O-N 3.14Å; M202-A206 PolarHBondContact O-N 3.2Å; M202-A206 VanDerWaalsContact O-N 3.09Å |
| 203 | I | 46.3 | Very low | 45.1 | Very low | 90 Ų | 90 | 90.9 Ų | 90.9 | 46% | 0.462 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -65.3 | -37.3 | 177 | -74.3 | 169.7 | 0 | 0 | 0 | 111.1 | H199 N200 A206 A207 | H199-I203 PolarHBondContact O-N 3.19Å; N200-I203 PolarHBondContact O-N 3.39Å; I203-A206 PolarHBondContact O-N 3.44Å; I203-A207 PolarHBondContact O-N 3.3Å |
| 204 | S | 45.2 | Very low | 45.4 | Very low | 71 Ų | 71 | 95.9 Ų | 95.9 | 50% | 0.497 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -73.1 | -28.2 | 175.9 | -64.5 | 0 | 0 | 0 | 0 | 113.9 | N200 M202 A207 A208 | N200-S204 PolarHBondContact O-N 3.29Å; N200-S204 PolarHBondContact O-OG 3.36Å; M202-S204 VanDerWaalsContact C-N 3.33Å; M202-S204 PolarHBondContact O-N 3.32Å; S204-A207 PolarHBondContact O-N 3.43Å; S204-A208 WeakPolarHBondContact O-CB 3.49Å; S204-A208 PolarHBondContact O-N 3.3Å |
| 205 | Q | 48 | Very low | 45.7 | Very low | 133 Ų | 133 | 101 Ų | 101 | 62% | 0.621 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -71.1 | -35.1 | 170.3 | -78.3 | -176 | 20.4 | 0 | 0 | 112 | H201 M202 A208 A209 | H201-Q205 PolarHBondContact O-N 3.28Å; M202-Q205 PolarHBondContact O-N 3.14Å; Q205-A208 PolarHBondContact O-N 3.2Å; Q205-A209 WeakPolarHBondContact O-CB 3.45Å; Q205-A209 PolarHBondContact O-N 3.46Å |
| 206 | A | 47.8 | Very low | 45.6 | Very low | 63 Ų | 63 | 105.9 Ų | 105.9 | 52% | 0.521 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -67.1 | -35.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | M202 I203 V210 | M202-A206 PolarHBondContact O-N 3.2Å; M202-A206 VanDerWaalsContact O-N 3.09Å; I203-A206 PolarHBondContact O-N 3.44Å; A206-V210 WeakPolarHBondContact O-CG2 3.49Å; A206-V210 PolarHBondContact O-N 3.23Å |
| 207 | A | 46.9 | Very low | 45.2 | Very low | 64 Ų | 64 | 109.3 Ų | 109.3 | 53% | 0.529 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -72.9 | -35.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | I203 S204 A211 | I203-A207 PolarHBondContact O-N 3.3Å; S204-A207 PolarHBondContact O-N 3.43Å; A207-A211 PolarHBondContact O-N 3.15Å |
| 208 | A | 47.4 | Very low | 44.9 | Very low | 61 Ų | 61 | 111.9 Ų | 111.9 | 50% | 0.504 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -73.1 | -30.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | S204 Q205 V210 A211 A212 | S204-A208 WeakPolarHBondContact O-CB 3.49Å; S204-A208 PolarHBondContact O-N 3.3Å; Q205-A208 PolarHBondContact O-N 3.2Å; A208-V210 VanDerWaalsContact C-N 3.35Å; A208-A211 PolarHBondContact O-N 2.96Å; A208-A212 WeakPolarHBondContact O-CB 3.46Å; A208-A212 PolarHBondContact O-N 3.43Å; A208-A212 VanDerWaalsContact O-N 3.09Å |
| 209 | A | 47.3 | Very low | 44.8 | Very low | 58 Ų | 58 | 112.6 Ų | 112.6 | 48% | 0.479 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -68.5 | -31.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q205 | Q205-A209 WeakPolarHBondContact O-CB 3.45Å; Q205-A209 PolarHBondContact O-N 3.46Å |
| 210 | V | 50.7 | Low | 45.1 | Very low | 105 Ų | 105 | 116 Ų | 116 | 64% | 0.636 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -78.3 | -34.2 | 175.7 | 178.7 | 0 | 0 | 0 | 0 | 111.5 | A206 A208 Q213 | A206-V210 WeakPolarHBondContact O-CG2 3.49Å; A206-V210 PolarHBondContact O-N 3.23Å; A208-V210 VanDerWaalsContact C-N 3.35Å; V210-Q213 PolarHBondContact O-N 3.45Å |
| 211 | A | 47.8 | Very low | 44.7 | Very low | 64 Ų | 64 | 119.5 Ų | 119.5 | 53% | 0.529 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -70.4 | -29.5 | 175 | 0 | 0 | 0 | 0 | 0 | 113.3 | A207 A208 | A207-A211 PolarHBondContact O-N 3.15Å; A208-A211 PolarHBondContact O-N 2.96Å |
| 212 | A | 47.8 | Very low | 44.5 | Very low | 71 Ų | 71 | 122.3 Ų | 122.3 | 59% | 0.587 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -75.6 | -19 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | A208 | A208-A212 WeakPolarHBondContact O-CB 3.46Å; A208-A212 PolarHBondContact O-N 3.43Å; A208-A212 VanDerWaalsContact O-N 3.09Å |
| 213 | Q | 47.3 | Very low | 44.7 | Very low | 166 Ų | 166 | 121.9 Ų | 121.9 | 78% | 0.776 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | -11.5 | 178.2 | -84.6 | -174.9 | -11.6 | 0 | 0 | 114.6 | V210 | V210-Q213 PolarHBondContact O-N 3.45Š|
| 214 | Q | 48.8 | Very low | 44.5 | Very low | 167 Ų | 167 | 126 Ų | 126 | 78% | 0.78 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.3 | -5.8 | -179.7 | -90.4 | -167.8 | -12.2 | 0 | 0 | 115.7 | | |
| 215 | H | 46.2 | Very low | 44.4 | Very low | 168 Ų | 168 | 131.9 Ų | 131.9 | 78% | 0.778 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -103 | 13.9 | -173.6 | -85 | 84.4 | 0 | 0 | 0 | 116 | | |
| 216 | Q | 39.2 | Very low | 44.1 | Very low | 167 Ų | 167 | 135.1 Ų | 135.1 | 78% | 0.78 | 72% | 0.722 | S | S | * | * | | | trans | -120.6 | 65.1 | -178.8 | -72.5 | -88.3 | -17.4 | 0 | 0 | 111.6 | | |
| 217 | H | 36.5 | Very low | 43.9 | Very low | 177 Ų | 177 | 141.1 Ų | 141.1 | 82% | 0.819 | 74% | 0.739 | S | S | * | * | | | trans | -114.1 | 105.9 | 158.2 | -79.7 | -72.7 | 0 | 0 | 0 | 109.1 | H219 | H217-H219 PolarHBondContact O-N 3.33Š|
| 218 | P | 41.5 | Very low | 43.8 | Very low | 111 Ų | 111 | 147.2 Ų | 147.2 | 72% | 0.721 | 76% | 0.756 | S | S | * | * | | | trans | -77 | 110.9 | 174.7 | 29.7 | -29 | 0 | 0 | 0 | 108.9 | Q220 | P218-Q220 PolarHBondContact O-N 2.96Š|
| 219 | H | 39.3 | Very low | 43.6 | Very low | 173 Ų | 173 | 153.8 Ų | 153.8 | 80% | 0.801 | 78% | 0.777 | S | S | * | * | | | trans | -91.8 | 87.1 | 164.3 | -123.6 | 62.8 | 0 | 0 | 0 | 108.5 | H217 | H217-H219 PolarHBondContact O-N 3.33Š|
| 220 | Q | 45.6 | Very low | 43.4 | Very low | 180 Ų | 180 | 160 Ų | 160 | 84% | 0.841 | 80% | 0.796 | S | S | * | * | | | trans | -68.9 | 120.9 | 155.2 | -81.3 | -178.2 | 10.2 | 0 | 0 | 107.9 | P218 | P218-Q220 PolarHBondContact O-N 2.96Š|
| 221 | Q | 35.3 | Very low | 43.1 | Very low | 168 Ų | 168 | 164.4 Ų | 164.4 | 79% | 0.785 | 81% | 0.81 | S | S | * | * | | | trans | -166.8 | 100.4 | 151.1 | -107 | 166.4 | 53.2 | 0 | 0 | 111.1 | | |
| 222 | H | 40.6 | Very low | 42.7 | Very low | 186 Ų | 186 | 165.9 Ų | 165.9 | 86% | 0.861 | 82% | 0.821 | S | S | * | * | | | trans | -112.7 | 138.3 | 143.8 | -85.6 | -85.3 | 0 | 0 | 0 | 105.6 | | |
| 223 | P | 44 | Very low | 42.4 | Very low | 116 Ų | 116 | 171.4 Ų | 171.4 | 75% | 0.753 | 84% | 0.835 | S | S | * | * | | | | -141 | 140.7 | 81.7 | 29.2 | -8.9 | 0 | 0 | 0 | 112.7 | | |
| 224 | Q | 42.2 | Very low | 41.9 | Very low | 176 Ų | 176 | 170.3 Ų | 170.3 | 82% | 0.822 | 84% | 0.835 | S | S | * | * | | | | 54.6 | 85.9 | 80.1 | -156.3 | 161.8 | 15.8 | 0 | 0 | 114.2 | | |
| 225 | Q | 42 | Very low | 41.6 | Very low | 195 Ų | 195 | 171 Ų | 171 | 91% | 0.911 | 84% | 0.838 | S | S | * | * | | | trans | 171.1 | 99.1 | 139.7 | -97.4 | 177.8 | 25.6 | 0 | 0 | 110.1 | | |
| 226 | Q | 41.8 | Very low | 41 | Very low | 202 Ų | 202 | 166.3 Ų | 166.3 | 94% | 0.944 | 84% | 0.835 | S | S | * | * | | | trans | -148.6 | 46.4 | 161.4 | -139.3 | 176.1 | 34.5 | 0 | 0 | 111.6 | | |
| 227 | Q | 44.1 | Very low | 41 | Very low | 189 Ų | 189 | 166.7 Ų | 166.7 | 88% | 0.883 | 84% | 0.837 | S | S | * | * | | | trans | -131.9 | 64 | 175.3 | -149.9 | 176.3 | 44.5 | 0 | 0 | 109.7 | | |
| 228 | Q | 44.8 | Very low | 41.8 | Very low | 191 Ų | 191 | 163.4 Ų | 163.4 | 89% | 0.893 | 83% | 0.831 | S | S | * | * | | | trans | -167.7 | 83.5 | 159.8 | -116 | 173.7 | 29.9 | 0 | 0 | 110.5 | | |
| 229 | Q | 41.9 | Very low | 42.1 | Very low | 200 Ų | 200 | 166 Ų | 166 | 94% | 0.935 | 83% | 0.833 | S | S | * | * | | | trans | -159.2 | 62.9 | 151.4 | -118.4 | 171.9 | 28.8 | 0 | 0 | 110 | | |
| 230 | Q | 44.7 | Very low | 42.3 | Very low | 188 Ų | 188 | 166 Ų | 166 | 88% | 0.879 | 83% | 0.833 | S | S | * | * | | | trans | -133.3 | 87.7 | 160.5 | -97.9 | 173.1 | 14.3 | 0 | 0 | 107 | | |
| 231 | Q | 44.5 | Very low | 42.1 | Very low | 198 Ų | 198 | 165 Ų | 165 | 93% | 0.925 | 83% | 0.833 | S | S | * | * | | | trans | 167.3 | 90.2 | 150.3 | -98.3 | 173.5 | -11.2 | 0 | 0 | 109.4 | | |
| 232 | A | 38.8 | Very low | 42.6 | Very low | 94 Ų | 94 | 165.8 Ų | 165.8 | 78% | 0.777 | 84% | 0.839 | S | S | * | * | | | trans | -171.8 | 129.1 | 143.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | | |
| 233 | Q | 41 | Very low | 42.5 | Very low | 188 Ų | 188 | 160.5 Ų | 160.5 | 88% | 0.879 | 83% | 0.834 | S | S | * | * | | | trans | 74 | 87.1 | 167.7 | -60.6 | 178.4 | -29.7 | 0 | 0 | 114.7 | | |
| 234 | N | 37.3 | Very low | 42.4 | Very low | 143 Ų | 143 | 159.1 Ų | 159.1 | 77% | 0.765 | 84% | 0.841 | S | S | * | * | | | | 50.3 | 82.9 | 61.4 | -154.6 | 33.8 | 0 | 0 | 0 | 113.3 | | |
| 235 | Q | 42.3 | Very low | 42.4 | Very low | 180 Ų | 180 | 154.5 Ų | 154.5 | 84% | 0.841 | 84% | 0.841 | S | S | * | * | | | | 156.4 | 121.7 | 120.9 | -84 | -174.1 | 42.6 | 0 | 0 | 110.7 | | |
| 236 | G | 32.7 | Very low | 42.5 | Very low | 70 Ų | 70 | 153.3 Ų | 153.3 | 72% | 0.722 | 84% | 0.841 | S | S | * | * | | | trans | 120.6 | 87.9 | 163 | 0 | 0 | 0 | 0 | 0 | 115.3 | | |
| 237 | H | 40 | Very low | 42.5 | Very low | 176 Ų | 176 | 147.3 Ų | 147.3 | 82% | 0.815 | 83% | 0.833 | S | S | * | * | | | trans | -107.4 | 146.4 | 144.4 | -69.5 | 12.5 | 0 | 0 | 0 | 105.3 | | |
| 238 | P | 52.9 | Low | 42.7 | Very low | 107 Ų | 107 | 146.9 Ų | 146.9 | 70% | 0.695 | 84% | 0.836 | S | S | * | * | | | | -145.7 | 167.5 | 81 | 34.3 | -14 | 0 | 0 | 0 | 116.2 | | |
| 239 | H | 48.3 | Very low | 42.6 | Very low | 165 Ų | 165 | 141.3 Ų | 141.3 | 76% | 0.764 | 83% | 0.829 | S | S | * | * | | | trans | -57.4 | 143 | 172.3 | -58.6 | -99.2 | 0 | 0 | 0 | 114.1 | | |
| 240 | H | 44.1 | Very low | 42.9 | Very low | 173 Ų | 173 | 139.6 Ų | 139.6 | 80% | 0.801 | 83% | 0.827 | S | S | * | * | | | trans | -133.5 | 100.3 | 152.2 | -46.3 | -65.1 | 0 | 0 | 0 | 105.6 | | |
| 241 | L | 40 | Very low | 42.8 | Very low | 161 Ų | 161 | 133.8 Ų | 133.8 | 84% | 0.843 | 82% | 0.817 | S | S | * | * | | | | 54.2 | 109.1 | 74.5 | -162 | 64.3 | 0 | 0 | 0 | 113.8 | | |
| 242 | M | 47.1 | Very low | 43 | Very low | 184 Ų | 184 | 132.3 Ų | 132.3 | 91% | 0.906 | 82% | 0.816 | S | S | * | * | | | trans | -14.9 | 130.5 | 152.1 | -172.7 | 178.4 | -71.2 | 0 | 0 | 116.5 | | |
| 243 | G | 38.7 | Very low | 43 | Very low | 74 Ų | 74 | 131.3 Ų | 131.3 | 76% | 0.763 | 82% | 0.815 | S | S | * | * | | | trans | 166.4 | 116.1 | 166.5 | 0 | 0 | 0 | 0 | 0 | 107.8 | | |
| 244 | G | 41.2 | Very low | 43.2 | Very low | 88 Ų | 88 | 131.2 Ų | 131.2 | 91% | 0.907 | 82% | 0.819 | S | S | * | * | | | | 104.9 | 105 | 60.7 | 0 | 0 | 0 | 0 | 0 | 107.1 | | |
| 245 | G | 42.9 | Very low | 43.2 | Very low | 79 Ų | 79 | 127.4 Ų | 127.4 | 81% | 0.814 | 81% | 0.814 | S | S | * | * | | | trans | -168.4 | 77.8 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112 | G247 | G245-G247 PolarHBondContact O-N 3.34Š|
| 246 | N | 43.8 | Very low | 43.2 | Very low | 170 Ų | 170 | 126 Ų | 126 | 91% | 0.909 | 81% | 0.81 | S | S | * | * | | | trans | -56.9 | 117.9 | 166.3 | -78 | -31.1 | 0 | 0 | 0 | 110.2 | | |
| 247 | G | 41.4 | Very low | 43.4 | Very low | 76 Ų | 76 | 132 Ų | 132 | 78% | 0.784 | 82% | 0.82 | S | S | * | * | | | trans | -110.7 | 94.8 | 160.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | G245 G249 | G245-G247 PolarHBondContact O-N 3.34Å; G247-G249 PolarHBondContact O-N 3.32Å |
| 248 | L | 48.9 | Very low | 43.2 | Very low | 180 Ų | 180 | 131.8 Ų | 131.8 | 94% | 0.942 | 82% | 0.819 | S | S | * | * | | | trans | -61.7 | 119.7 | 170.8 | -72 | 155.6 | 0 | 0 | 0 | 109.2 | | |
| 249 | G | 42.8 | Very low | 43 | Very low | 73 Ų | 73 | 132.5 Ų | 132.5 | 75% | 0.753 | 82% | 0.823 | S | S | * | * | | | trans | -162.4 | 74.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | G247 G251 | G247-G249 PolarHBondContact O-N 3.32Å; G249-G251 PolarHBondContact O-N 3.34Å |
| 250 | N | 47.6 | Very low | 42.5 | Very low | 164 Ų | 164 | 127.9 Ų | 127.9 | 88% | 0.877 | 82% | 0.82 | S | S | * | * | | | trans | -65.4 | 121.9 | 169.9 | -166.9 | -15.6 | 0 | 0 | 0 | 108.7 | | |
| 251 | G | 43.4 | Very low | 42.4 | Very low | 66 Ų | 66 | 128.6 Ų | 128.6 | 68% | 0.68 | 82% | 0.824 | S | S | * | * | | | trans | -172.6 | 91.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | G249 G253 | G249-G251 PolarHBondContact O-N 3.34Å; G251-G253 PolarHBondContact O-N 3.48Å |
| 252 | N | 48.1 | Very low | 42.4 | Very low | 167 Ų | 167 | 130.6 Ų | 130.6 | 89% | 0.893 | 83% | 0.829 | S | S | * | * | | | trans | -49.9 | 133.1 | 165.7 | -70.2 | -57 | 0 | 0 | 0 | 110.6 | | |
| 253 | G | 39.5 | Very low | 42.4 | Very low | 74 Ų | 74 | 131 Ų | 131 | 76% | 0.763 | 83% | 0.829 | S | S | * | * | | | trans | 174.2 | 75.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | G251 G255 | G251-G253 PolarHBondContact O-N 3.48Å; G253-G255 PolarHBondContact O-N 2.91Å |
| 254 | L | 44 | Very low | 42.7 | Very low | 185 Ų | 185 | 136.5 Ų | 136.5 | 97% | 0.969 | 84% | 0.835 | S | S | * | * | | | trans | -54.3 | 131.1 | 162.7 | -69.1 | 158.9 | 0 | 0 | 0 | 110 | | |
| 255 | G | 38.2 | Very low | 42.9 | Very low | 63 Ų | 63 | 141.3 Ų | 141.3 | 65% | 0.649 | 83% | 0.834 | S | S | * | * | | | trans | 100.5 | 118.8 | 135.9 | 0 | 0 | 0 | 0 | 0 | 119 | G253 | G253-G255 PolarHBondContact O-N 2.91Š|
| 256 | I | 41.6 | Very low | 42.7 | Very low | 150 Ų | 150 | 146.4 Ų | 146.4 | 77% | 0.769 | 84% | 0.836 | S | S | * | * | | | trans | 83.9 | 90.8 | 140.4 | -43.6 | 166.9 | 0 | 0 | 0 | 116.3 | | |
| 257 | Q | 35.8 | Very low | 42.7 | Very low | 198 Ų | 198 | 147.8 Ų | 147.8 | 93% | 0.925 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 128.7 | 154.2 | -78.7 | 162.7 | -9.4 | 0 | 0 | 109.6 | | |
| 258 | H | 37.5 | Very low | 42.8 | Very low | 170 Ų | 170 | 153.2 Ų | 153.2 | 79% | 0.787 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 168.6 | 175.7 | -98.1 | -105.5 | 0 | 0 | 0 | 111.7 | | |
| 259 | P | 47.9 | Very low | 42.4 | Very low | 122 Ų | 122 | 153.6 Ų | 153.6 | 79% | 0.792 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -100 | 166.2 | -132 | 39.1 | -37.5 | 0 | 0 | 0 | 114.6 | | |
| 260 | G | 37.3 | Very low | 42.1 | Very low | 68 Ų | 68 | 159.4 Ų | 159.4 | 70% | 0.701 | 85% | 0.847 | S | S | * | * | | | trans | 126.6 | 139 | 162.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 261 | Q | 42.1 | Very low | 41.7 | Very low | 188 Ų | 188 | 160.7 Ų | 160.7 | 88% | 0.879 | 85% | 0.847 | S | S | * | * | | | trans | 81.5 | 75.3 | 173.9 | -49.3 | -80.8 | 8.8 | 0 | 0 | 115.5 | | |
| 262 | Q | 40.9 | Very low | 41.5 | Very low | 203 Ų | 203 | 165.2 Ų | 165.2 | 95% | 0.949 | 85% | 0.851 | S | S | * | * | | | trans | -172.6 | 67.9 | 145.9 | -103.9 | 166.2 | 40.7 | 0 | 0 | 109.9 | | |
| 263 | Q | 47.2 | Very low | 41 | Very low | 194 Ų | 194 | 165.1 Ų | 165.1 | 91% | 0.907 | 85% | 0.845 | S | S | * | * | | | trans | -130.7 | 61.8 | 171.6 | -154.1 | 177.8 | 37.8 | 0 | 0 | 109 | | |
| 264 | Q | 45.3 | Very low | 40.9 | Very low | 188 Ų | 188 | 170.8 Ų | 170.8 | 88% | 0.879 | 85% | 0.851 | S | S | * | * | S | Bend | trans | -179.2 | 90.5 | 163.4 | -106.7 | 168.2 | 19 | 0 | 0 | 108.8 | | |
| 265 | Q | 43.7 | Very low | 40.8 | Very low | 189 Ų | 189 | 168.2 Ų | 168.2 | 88% | 0.883 | 85% | 0.846 | S | S | * | * | | | trans | 151.8 | 82.9 | 153.5 | -88.5 | 172.7 | 20.4 | 0 | 0 | 109.3 | | |
| 266 | Q | 40.3 | Very low | 41.1 | Very low | 187 Ų | 187 | 168.7 Ų | 168.7 | 87% | 0.874 | 85% | 0.85 | S | S | * | * | | | trans | 178.2 | 94.8 | 144.2 | -103.5 | 169.4 | 44.9 | 0 | 0 | 108.5 | | |
| 267 | Q | 42.2 | Very low | 41.1 | Very low | 199 Ų | 199 | 170.1 Ų | 170.1 | 93% | 0.93 | 85% | 0.854 | S | S | * | * | | | trans | 172.5 | 61.2 | 139 | -93.4 | 170.5 | 55.7 | 0 | 0 | 109.2 | | |
| 268 | Q | 43.8 | Very low | 41.2 | Very low | 190 Ų | 190 | 172 Ų | 172 | 89% | 0.888 | 85% | 0.854 | S | S | * | * | | | trans | -105.2 | 134.5 | 143.2 | -86.5 | -176.9 | 15.8 | 0 | 0 | 106.2 | | |
| 269 | Q | 40.3 | Very low | 41.8 | Very low | 187 Ų | 187 | 171.8 Ų | 171.8 | 87% | 0.874 | 86% | 0.859 | S | S | * | * | | | trans | 89.5 | 82.9 | -177.9 | -56.5 | -176.4 | 27.3 | 0 | 0 | 116.6 | | |
| 270 | Q | 37.4 | Very low | 41.5 | Very low | 196 Ų | 196 | 170 Ų | 170 | 92% | 0.916 | 86% | 0.855 | S | S | * | * | | | | -155.6 | 95.1 | 112 | -107.2 | 175 | 66.2 | 0 | 0 | 109.8 | Q272 | Q270-Q272 PolarHBondContact O-N 3.01Š|
| 271 | Q | 38.5 | Very low | 41.6 | Very low | 190 Ų | 190 | 173.8 Ų | 173.8 | 89% | 0.888 | 86% | 0.858 | S | S | * | * | | | trans | -69.9 | 107.1 | 152.7 | -83.1 | 177.3 | 11.5 | 0 | 0 | 107.1 | | |
| 272 | Q | 39.3 | Very low | 42 | Very low | 162 Ų | 162 | 172.8 Ų | 172.8 | 76% | 0.757 | 86% | 0.858 | S | S | * | * | | | trans | -164.4 | 110 | 146.6 | -109.9 | 161.1 | 68.1 | 0 | 0 | 110.4 | Q270 | Q270-Q272 PolarHBondContact O-N 3.01Š|
| 273 | Q | 38.5 | Very low | 42.4 | Very low | 164 Ų | 164 | 171.4 Ų | 171.4 | 77% | 0.766 | 86% | 0.856 | S | S | * | * | | | trans | 62.8 | 90.1 | 144.2 | -56.8 | -179.8 | 14.6 | 0 | 0 | 119.5 | | |
| 274 | H | 36.8 | Very low | 41.9 | Very low | 193 Ų | 193 | 168.3 Ų | 168.3 | 89% | 0.894 | 85% | 0.846 | S | S | * | * | | | trans | -144.1 | 114.2 | 139.9 | -67.8 | -65.8 | 0 | 0 | 0 | 109.9 | | |
| 275 | P | 42.4 | Very low | 41.4 | Very low | 132 Ų | 132 | 168.1 Ų | 168.1 | 86% | 0.857 | 85% | 0.845 | S | S | * | * | | | trans | -87.3 | 126.7 | 171.4 | 33 | -26.6 | 0 | 0 | 0 | 108.9 | | |
| 276 | G | 43.6 | Very low | 41.1 | Very low | 72 Ų | 72 | 163.6 Ų | 163.6 | 74% | 0.742 | 84% | 0.84 | S | S | * | * | | | trans | 158.9 | 33.1 | 169.3 | 0 | 0 | 0 | 0 | 0 | 118.8 | | |
| 277 | Q | 43 | Very low | 41.2 | Very low | 181 Ų | 181 | 159.6 Ų | 159.6 | 85% | 0.846 | 84% | 0.839 | S | S | * | * | | | trans | -150.3 | 94.3 | 159.8 | -75.8 | -156.1 | 6.4 | 0 | 0 | 111.3 | | |
| 278 | Y | 37.8 | Very low | 41.3 | Very low | 238 Ų | 238 | 154.6 Ų | 154.6 | 93% | 0.933 | 83% | 0.831 | S | S | * | * | | | trans | -139.1 | 91.1 | 156.2 | -67.1 | -71.3 | 0 | 0 | 0 | 108.4 | | |
| 279 | N | 48.5 | Very low | 41.2 | Very low | 165 Ų | 165 | 154.2 Ų | 154.2 | 88% | 0.882 | 83% | 0.834 | S | S | * | * | | | trans | -134.5 | 85.3 | 165.4 | -165.7 | 30.2 | 0 | 0 | 0 | 109.1 | | |
| 280 | A | 43.2 | Very low | 41.1 | Very low | 85 Ų | 85 | 148.3 Ų | 148.3 | 70% | 0.702 | 82% | 0.824 | S | S | * | * | S | Bend | trans | 177 | 71.5 | 158.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | | |
| 281 | N | 39.8 | Very low | 41.2 | Very low | 146 Ų | 146 | 148.3 Ų | 148.3 | 78% | 0.781 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -165 | 10.3 | 159.8 | -97.7 | -35.7 | 0 | 0 | 0 | 115.2 | | |
| 282 | L | 48.5 | Very low | 41.2 | Very low | 168 Ų | 168 | 148.3 Ų | 148.3 | 88% | 0.88 | 83% | 0.826 | S | S | * | * | G | 310 helix | trans | -86.5 | -4.6 | 172.5 | -97.4 | 71.5 | 0 | 0 | 0 | 114 | | |
| 283 | L | 49.5 | Very low | 41 | Very low | 173 Ų | 173 | 146.7 Ų | 146.7 | 91% | 0.906 | 83% | 0.832 | S | S | * | * | G | 310 helix | trans | -86.9 | 1.3 | -178.6 | -158.4 | 60.4 | 0 | 0 | 0 | 114.1 | | |
| 284 | N | 36.9 | Very low | 40.6 | Very low | 129 Ų | 129 | 142.3 Ų | 142.3 | 69% | 0.69 | 82% | 0.82 | S | S | * | * | G | 310 helix | trans | -113.7 | 18 | -176.2 | -150.3 | -19.6 | 0 | 0 | 0 | 114.6 | | |
| 285 | H | 36 | Very low | 40.6 | Very low | 185 Ų | 185 | 143.2 Ų | 143.2 | 86% | 0.856 | 82% | 0.817 | S | S | * | * | S | Bend | trans | -126.5 | 11 | 174.4 | -93.3 | 45.5 | 0 | 0 | 0 | 114.1 | | |
| 286 | A | 37.6 | Very low | 40.2 | Very low | 93 Ų | 93 | 141.3 Ų | 141.3 | 77% | 0.769 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -94.4 | 3.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 287 | A | 42.1 | Very low | 40 | Very low | 104 Ų | 104 | 147.3 Ų | 147.3 | 86% | 0.86 | 82% | 0.821 | S | S | * | * | S | Bend | trans | -112.1 | 16 | -169.9 | 0 | 0 | 0 | 0 | 0 | 116 | | |
| 288 | A | 43.6 | Very low | 39.6 | Very low | 93 Ų | 93 | 144.3 Ų | 144.3 | 77% | 0.769 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -140.4 | 30.7 | -174.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | | |
| 289 | L | 41.2 | Very low | 39.5 | Very low | 182 Ų | 182 | 136.8 Ų | 136.8 | 95% | 0.953 | 82% | 0.815 | S | S | * | * | | | trans | -131 | 55.9 | 168.9 | -89.4 | 156.3 | 0 | 0 | 0 | 110.7 | | |
| 290 | G | 38.1 | Very low | 38.8 | Very low | 64 Ų | 64 | 133 Ų | 133 | 66% | 0.66 | 82% | 0.815 | S | S | * | * | | | trans | -102.5 | 92.8 | 159.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | | |
| 291 | H | 40.5 | Very low | 38.4 | Very low | 195 Ų | 195 | 134 Ų | 134 | 90% | 0.903 | 82% | 0.817 | S | S | * | * | | | trans | -148.3 | 113.1 | 152.6 | -88.2 | -67.6 | 0 | 0 | 0 | 109.7 | | |
| 292 | M | 38 | Very low | 38.4 | Very low | 190 Ų | 190 | 134.3 Ų | 134.3 | 94% | 0.936 | 82% | 0.815 | S | S | * | * | | | trans | -55.2 | 144.7 | 170.2 | -56.3 | 166.6 | -149.6 | 0 | 0 | 110.4 | | |
| 293 | S | 34.5 | Very low | 37.7 | Very low | 128 Ų | 128 | 136 Ų | 136 | 90% | 0.895 | 81% | 0.812 | S | S | * | * | | | trans | -144.5 | 138.8 | 143 | -147.9 | 0 | 0 | 0 | 0 | 111.6 | | |
| 294 | S | 30.9 | Very low | 37.2 | Very low | 73 Ų | 73 | 133 Ų | 133 | 51% | 0.51 | 80% | 0.797 | S | S | . | * | | | trans | -69.9 | 150.2 | -160.2 | -177.7 | 0 | 0 | 0 | 0 | 113.2 | A296 | S294-A296 PolarHBondContact O-N 3.42Š|
| 295 | Y | 36.8 | Very low | 37.4 | Very low | 211 Ų | 211 | 136.1 Ų | 136.1 | 83% | 0.827 | 81% | 0.807 | S | S | * | * | | | trans | -41 | 126.3 | 150.5 | 48.1 | -86.5 | 0 | 0 | 0 | 110 | | |
| 296 | A | 34.1 | Very low | 37.6 | Very low | 93 Ų | 93 | 136 Ų | 136 | 77% | 0.769 | 81% | 0.806 | S | S | * | * | | | trans | -131.3 | 104.7 | 165.5 | 0 | 0 | 0 | 0 | 0 | 108.1 | S294 | S294-A296 PolarHBondContact O-N 3.42Š|
| 297 | Q | 39.5 | Very low | 37.5 | Very low | 198 Ų | 198 | 135.6 Ų | 135.6 | 93% | 0.925 | 81% | 0.81 | S | S | * | * | | | trans | -55.2 | 132.9 | 156.1 | -75.8 | 168.2 | -80.5 | 0 | 0 | 108.7 | | |
| 298 | S | 33.5 | Very low | 37 | Very low | 117 Ų | 117 | 134.3 Ų | 134.3 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | | | trans | -145.7 | 106.4 | 158.2 | -176.4 | 0 | 0 | 0 | 0 | 108.6 | | |
| 299 | G | 36.7 | Very low | 36.7 | Very low | 81 Ų | 81 | 135 Ų | 135 | 84% | 0.835 | 81% | 0.814 | S | S | * | * | | | trans | -81.7 | 143.4 | 160.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | | |
| 300 | G | 33.4 | Very low | 36.7 | Very low | 85 Ų | 85 | 135.5 Ų | 135.5 | 88% | 0.876 | 81% | 0.813 | S | S | * | * | | | trans | 176 | 133.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | | |
| 301 | S | 34.5 | Very low | 37 | Very low | 105 Ų | 105 | 141.2 Ų | 141.2 | 73% | 0.734 | 82% | 0.822 | S | S | * | * | | | trans | -119.1 | 160.8 | -162.5 | -163.2 | 0 | 0 | 0 | 0 | 110.3 | | |
| 302 | M | 39.9 | Very low | 37.2 | Very low | 153 Ų | 153 | 138.1 Ų | 138.1 | 75% | 0.754 | 82% | 0.819 | S | S | * | * | | | trans | 80.3 | 150.6 | 154.9 | -45.7 | -158.7 | -68.7 | 0 | 0 | 119.9 | | |
| 303 | Y | 35 | Very low | 37 | Very low | 204 Ų | 204 | 132.3 Ų | 132.3 | 80% | 0.8 | 81% | 0.808 | S | S | * | * | | | trans | 93.4 | 95.6 | 173.6 | -67.7 | -90.4 | 0 | 0 | 0 | 115.3 | | |
| 304 | D | 37.8 | Very low | 37.2 | Very low | 110 Ų | 110 | 135 Ų | 135 | 59% | 0.588 | 81% | 0.809 | S | S | * | * | | | | 94.2 | 102.5 | 76.3 | -177.1 | 44.9 | 0 | 0 | 0 | 110.7 | | |
| 305 | H | 40.7 | Very low | 37.6 | Very low | 195 Ų | 195 | 140 Ų | 140 | 90% | 0.903 | 83% | 0.83 | S | S | * | * | | | trans | -146.3 | 66.5 | 156.1 | -79.5 | -59.1 | 0 | 0 | 0 | 108.7 | | |
| 306 | H | 41.3 | Very low | 37.5 | Very low | 183 Ų | 183 | 133.6 Ų | 133.6 | 85% | 0.847 | 83% | 0.828 | S | S | * | * | | | trans | -88.4 | 119.5 | 151.9 | -80.7 | -70.1 | 0 | 0 | 0 | 108.7 | | |
| 307 | G | 34.4 | Very low | 37.6 | Very low | 83 Ų | 83 | 132.6 Ų | 132.6 | 86% | 0.856 | 83% | 0.827 | S | S | * | * | | | trans | 179.3 | 79.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 308 | G | 33.6 | Very low | 37.7 | Very low | 77 Ų | 77 | 132.1 Ų | 132.1 | 79% | 0.794 | 83% | 0.827 | S | S | * | * | S | Bend | trans | 163.1 | 112.2 | 159.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | | |
| 309 | A | 36 | Very low | 38.5 | Very low | 109 Ų | 109 | 132.3 Ų | 132.3 | 90% | 0.901 | 83% | 0.826 | S | S | * | * | | | trans | 88.2 | 101.9 | 160.1 | 0 | 0 | 0 | 0 | 0 | 118.1 | | |
| 310 | M | 41.5 | Very low | 38.6 | Very low | 192 Ų | 192 | 137.9 Ų | 137.9 | 95% | 0.946 | 83% | 0.827 | S | S | * | * | | | trans | -71.6 | 135.6 | 173.2 | -55 | -159.2 | -103.6 | 0 | 0 | 112 | | |
| 311 | H | 43.7 | Very low | 38.9 | Very low | 184 Ų | 184 | 143 Ų | 143 | 85% | 0.852 | 83% | 0.828 | S | S | * | * | | | trans | -56.5 | 156.6 | 154.7 | -100.3 | -168.5 | 0 | 0 | 0 | 109.9 | | |
| 312 | P | 45.2 | Very low | 39.4 | Very low | 129 Ų | 129 | 146.2 Ų | 146.2 | 84% | 0.838 | 83% | 0.831 | S | S | * | * | | | cis | -155.7 | 157 | 47.9 | 31.9 | -7.2 | 0 | 0 | 0 | 117.9 | | |
| 313 | G | 33.1 | Very low | 39.9 | Very low | 68 Ų | 68 | 145 Ų | 145 | 70% | 0.701 | 84% | 0.835 | S | S | * | * | | | trans | 161.6 | 113.6 | 159.4 | 0 | 0 | 0 | 0 | 0 | 118.9 | | |
| 314 | M | 39.5 | Very low | 40.4 | Very low | 185 Ų | 185 | 143.5 Ų | 143.5 | 91% | 0.911 | 84% | 0.84 | S | S | * | * | | | trans | 77.5 | 106.9 | 137.9 | -61 | 162.7 | 81.6 | 0 | 0 | 120.2 | | |
| 315 | N | 39.6 | Very low | 40.5 | Very low | 177 Ų | 177 | 141.5 Ų | 141.5 | 95% | 0.947 | 85% | 0.845 | S | S | * | * | | | | 35.5 | 125 | 129.1 | -92.4 | -47.1 | 0 | 0 | 0 | 119.5 | | |
| 316 | G | 34.3 | Very low | 40.8 | Very low | 77 Ų | 77 | 138.3 Ų | 138.3 | 79% | 0.794 | 84% | 0.842 | S | S | * | * | | | trans | 162.1 | 83.1 | 152.1 | 0 | 0 | 0 | 0 | 0 | 116.7 | | |
| 317 | G | 35.5 | Very low | 41 | Very low | 72 Ų | 72 | 135.7 Ų | 135.7 | 74% | 0.742 | 84% | 0.841 | S | S | * | * | | | trans | 41.7 | 117.1 | 139.6 | 0 | 0 | 0 | 0 | 0 | 120.8 | | |
| 318 | M | 42.9 | Very low | 41 | Very low | 188 Ų | 188 | 135.7 Ų | 135.7 | 93% | 0.926 | 84% | 0.841 | S | S | * | * | | | trans | -52.5 | 139.2 | 153.5 | -56.5 | 172.9 | -144.7 | 0 | 0 | 111.2 | | |
| 319 | P | 50 | Low | 41.3 | Very low | 122 Ų | 122 | 137.3 Ų | 137.3 | 79% | 0.792 | 85% | 0.847 | S | S | * | * | | | trans | -98.7 | 112 | 150.2 | 29 | -22.6 | 0 | 0 | 0 | 110.3 | Q321 | P319-Q321 PolarHBondContact O-N 3.48Š|
| 320 | K | 38.7 | Very low | 41.2 | Very low | 198 Ų | 198 | 136.1 Ų | 136.1 | 86% | 0.861 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 124.5 | 158.6 | -93.9 | 176.2 | 171.2 | 170.7 | 0 | 108.6 | | |
| 321 | Q | 40.4 | Very low | 40.8 | Very low | 192 Ų | 192 | 130.7 Ų | 130.7 | 90% | 0.897 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 127.8 | 160.9 | -74.5 | 178.7 | -2.2 | 0 | 0 | 108.8 | P319 | P319-Q321 PolarHBondContact O-N 3.48Š|
| 322 | Q | 43.4 | Very low | 40.9 | Very low | 172 Ų | 172 | 126.9 Ų | 126.9 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 142.8 | 177 | -66.1 | 171.2 | -29.4 | 0 | 0 | 110.3 | | |
| 323 | P | 50.3 | Low | 40.9 | Very low | 129 Ų | 129 | 130.1 Ų | 130.1 | 84% | 0.838 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -79 | 125 | 168.3 | -4.8 | 22.5 | 0 | 0 | 0 | 110.5 | | |
| 324 | L | 47.1 | Very low | 41.2 | Very low | 171 Ų | 171 | 132.3 Ų | 132.3 | 90% | 0.895 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 128.7 | 165.4 | -93.9 | 76 | 0 | 0 | 0 | 109.4 | | |
| 325 | G | 38.5 | Very low | 41.1 | Very low | 68 Ų | 68 | 133.4 Ų | 133.4 | 70% | 0.701 | 83% | 0.825 | S | S | * | * | | | trans | -85.8 | -178.5 | -173.1 | 0 | 0 | 0 | 0 | 0 | 116.7 | | |
| 326 | P | 48.6 | Very low | 41.2 | Very low | 128 Ų | 128 | 131.6 Ų | 131.6 | 83% | 0.831 | 82% | 0.82 | S | S | * | * | | | trans | -96.8 | -171.9 | 173.9 | 41 | -32.3 | 0 | 0 | 0 | 110.7 | | |
| 327 | P | 44 | Very low | 41.1 | Very low | 128 Ų | 128 | 137.6 Ų | 137.6 | 83% | 0.831 | 82% | 0.82 | S | S | * | * | | | cis | -128.6 | 159 | -10 | 36.8 | -19.4 | 0 | 0 | 0 | 113.7 | | |
| 328 | G | 35.3 | Very low | 41.2 | Very low | 83 Ų | 83 | 143.4 Ų | 143.4 | 86% | 0.856 | 83% | 0.83 | S | S | * | * | | | trans | -130.1 | 107.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112 | | |
| 329 | A | 40.6 | Very low | 40.7 | Very low | 111 Ų | 111 | 137.3 Ų | 137.3 | 92% | 0.917 | 82% | 0.815 | S | S | * | * | | | trans | -82.2 | 147.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | | |
| 330 | G | 32.8 | Very low | 40 | Very low | 85 Ų | 85 | 135.2 Ų | 135.2 | 88% | 0.876 | 82% | 0.816 | S | S | * | * | | | trans | 143.3 | 114.6 | 155.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | | |
| 331 | G | 32.8 | Very low | 39.7 | Very low | 77 Ų | 77 | 134.6 Ų | 134.6 | 79% | 0.794 | 82% | 0.816 | S | S | * | * | | | trans | 146.8 | 103.4 | 151.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | | |
| 332 | P | 46.1 | Very low | 39.3 | Very low | 104 Ų | 104 | 131.8 Ų | 131.8 | 68% | 0.675 | 81% | 0.812 | S | S | * | * | | | trans | -93.9 | 149.9 | 174.9 | 36.2 | -28.7 | 0 | 0 | 0 | 111.7 | | |
| 333 | Q | 46.4 | Very low | 38.9 | Very low | 197 Ų | 197 | 129.9 Ų | 129.9 | 92% | 0.921 | 81% | 0.812 | S | S | * | * | | | trans | -142.5 | 112.9 | 155.7 | -68.1 | -58.3 | -16.9 | 0 | 0 | 110 | | |
| 334 | D | 37.5 | Very low | 38.4 | Very low | 115 Ų | 115 | 129.7 Ų | 129.7 | 62% | 0.615 | 81% | 0.809 | S | S | * | * | | | trans | -87.7 | 170.3 | 178.1 | -80 | -53.3 | 0 | 0 | 0 | 112.9 | | |
| 335 | Y | 39.1 | Very low | 38.1 | Very low | 208 Ų | 208 | 126.6 Ų | 126.6 | 82% | 0.816 | 80% | 0.799 | S | S | * | * | | | trans | 85.5 | 125.3 | 159.7 | -51.4 | -71.6 | 0 | 0 | 0 | 116.3 | | |
| 336 | V | 41.8 | Very low | 37.8 | Very low | 138 Ų | 138 | 132.2 Ų | 132.2 | 84% | 0.836 | 81% | 0.809 | S | S | * | * | | | | -148.4 | 137.1 | 55.8 | 171.8 | 0 | 0 | 0 | 0 | 113.6 | | |
| 337 | Y | 31.2 | Very low | 37.5 | Very low | 204 Ų | 204 | 130 Ų | 130 | 80% | 0.8 | 81% | 0.81 | S | S | * | * | | | trans | -72.2 | 129.9 | 168.3 | 169.7 | -93.7 | 0 | 0 | 0 | 112.5 | | |
| 338 | M | 37.8 | Very low | 37.1 | Very low | 194 Ų | 194 | 128.7 Ų | 128.7 | 96% | 0.956 | 81% | 0.81 | S | S | * | * | | | trans | -137.2 | 111.2 | 147.2 | -111.5 | 176.7 | -179.8 | 0 | 0 | 108.2 | | |
| 339 | G | 32.8 | Very low | 37.1 | Very low | 59 Ų | 59 | 129.5 Ų | 129.5 | 61% | 0.608 | 81% | 0.808 | S | S | * | * | | | trans | -71.8 | 154.3 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 340 | G | 34.7 | Very low | 36.9 | Very low | 78 Ų | 78 | 133.2 Ų | 133.2 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | | | trans | -179.8 | 83 | 168.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | T342 | G340-T342 PolarHBondContact O-N 2.99Š|
| 341 | Q | 32.8 | Very low | 37.2 | Very low | 185 Ų | 185 | 137.8 Ų | 137.8 | 86% | 0.864 | 81% | 0.81 | S | S | * | * | | | trans | -59.2 | 130.5 | 174.3 | -89.9 | 174.9 | -44.6 | 0 | 0 | 111.2 | | |
| 342 | T | 32.9 | Very low | 37.8 | Very low | 134 Ų | 134 | 138.8 Ų | 138.8 | 82% | 0.822 | 80% | 0.802 | S | S | * | * | | | trans | -150.8 | 109.3 | 137.9 | -15.2 | 0 | 0 | 0 | 0 | 108.7 | G340 V344 | G340-T342 PolarHBondContact O-N 2.99Å; T342-V344 PolarHBondContact O-N 3.01Å |
| 343 | T | 33.8 | Very low | 38.1 | Very low | 131 Ų | 131 | 140.2 Ų | 140.2 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | | | trans | -74.1 | 117.1 | 174 | -56.2 | 0 | 0 | 0 | 0 | 109.4 | | |
| 344 | V | 39.1 | Very low | 37.9 | Very low | 126 Ų | 126 | 138.5 Ų | 138.5 | 76% | 0.764 | 80% | 0.803 | S | S | * | * | | | trans | -142.2 | 130 | 158.4 | -155 | 0 | 0 | 0 | 0 | 107.9 | T342 | T342-V344 PolarHBondContact O-N 3.01Š|
| 345 | P | 41.2 | Very low | 38 | Very low | 105 Ų | 105 | 139.2 Ų | 139.2 | 68% | 0.682 | 81% | 0.807 | S | S | * | * | | | trans | -88.5 | 168.3 | -171.6 | 35.7 | -33.8 | 0 | 0 | 0 | 112.9 | | |
| 346 | M | 32.5 | Very low | 38.4 | Very low | 186 Ų | 186 | 138.9 Ų | 138.9 | 92% | 0.916 | 81% | 0.813 | S | S | * | * | | | trans | 79.4 | 94.1 | 162.2 | -106.3 | 85.6 | -175.8 | 0 | 0 | 118.7 | | |
| 347 | G | 41.9 | Very low | 38.4 | Very low | 82 Ų | 82 | 142.8 Ų | 142.8 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | | | | 52.2 | 87.6 | 117.5 | 0 | 0 | 0 | 0 | 0 | 119.7 | | |
| 348 | A | 35.6 | Very low | 39.1 | Very low | 101 Ų | 101 | 141.3 Ų | 141.3 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | | | trans | -168.9 | 98.9 | 138.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | M350 | A348-M350 PolarHBondContact O-N 2.85Š|
| 349 | A | 36.8 | Very low | 39.2 | Very low | 99 Ų | 99 | 137.7 Ų | 137.7 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | | | trans | -63.3 | 132 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | M351 | A349-M351 PolarHBondContact O-N 3.37Š|
| 350 | M | 35.8 | Very low | 39.6 | Very low | 189 Ų | 189 | 140 Ų | 140 | 93% | 0.931 | 81% | 0.808 | S | S | * | * | | | trans | -35.2 | 122.3 | 169.7 | -65.2 | 159.9 | 166.2 | 0 | 0 | 113 | A348 | A348-M350 PolarHBondContact O-N 2.85Š|
| 351 | M | 39.6 | Very low | 40.1 | Very low | 182 Ų | 182 | 141.2 Ų | 141.2 | 90% | 0.897 | 80% | 0.804 | S | S | * | * | | | trans | -99.8 | 128.4 | 161.6 | -76.2 | -164.2 | 162.7 | 0 | 0 | 109.7 | A349 | A349-M351 PolarHBondContact O-N 3.37Š|
| 352 | P | 45.4 | Very low | 40.7 | Very low | 97 Ų | 97 | 135.8 Ų | 135.8 | 63% | 0.63 | 79% | 0.791 | S | S | * | * | | | trans | -71.6 | 153.1 | 174.5 | 29 | -32.8 | 0 | 0 | 0 | 111.7 | Q354 | P352-Q354 PolarHBondContact O-N 2.96Š|
| 353 | P | 51.9 | Low | 41.3 | Very low | 135 Ų | 135 | 134.7 Ų | 134.7 | 88% | 0.877 | 78% | 0.784 | S | S | * | * | | | trans | -78 | 111.1 | -179 | 31.1 | -30.5 | 0 | 0 | 0 | 109.8 | | |
| 354 | Q | 42.5 | Very low | 41.6 | Very low | 160 Ų | 160 | 132.2 Ų | 132.2 | 75% | 0.748 | 78% | 0.777 | S | S | * | * | | | trans | -111.4 | 116.7 | 173.3 | -99.1 | 157.2 | -36.5 | 0 | 0 | 111.2 | P352 | P352-Q354 PolarHBondContact O-N 2.96Š|
| 355 | N | 38.9 | Very low | 41.7 | Very low | 131 Ų | 131 | 130.5 Ų | 130.5 | 70% | 0.701 | 78% | 0.776 | S | S | * | * | | | trans | 74 | 75.7 | 152.5 | -59.1 | -32.8 | 0 | 0 | 0 | 119.4 | Y357 | N355-Y357 PolarHBondContact O-N 3.11Š|
| 356 | Q | 46.5 | Very low | 41.6 | Very low | 200 Ų | 200 | 129.8 Ų | 129.8 | 94% | 0.935 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -81 | 22.5 | 158 | -71.9 | -162.8 | 5.7 | 0 | 0 | 114.2 | | |
| 357 | Y | 43.2 | Very low | 42.1 | Very low | 221 Ų | 221 | 127.6 Ų | 127.6 | 87% | 0.867 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -112.8 | 16.2 | -176.1 | -128.2 | -90 | 0 | 0 | 0 | 115.5 | N355 | N355-Y357 PolarHBondContact O-N 3.11Š|
| 358 | M | 44.7 | Very low | 41.9 | Very low | 173 Ų | 173 | 135.1 Ų | 135.1 | 85% | 0.852 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -129.3 | 31.5 | 179.8 | -87.7 | 163.9 | 172.9 | 0 | 0 | 113.6 | | |
| 359 | N | 40.7 | Very low | 42.2 | Very low | 117 Ų | 117 | 138.4 Ų | 138.4 | 63% | 0.626 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -138.9 | 48.4 | 173.4 | -156.4 | -15.3 | 0 | 0 | 0 | 113.2 | | |
| 360 | S | 40.9 | Very low | 42.4 | Very low | 108 Ų | 108 | 137.9 Ų | 137.9 | 76% | 0.755 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -121.4 | -7.8 | 169 | -54.8 | 0 | 0 | 0 | 0 | 113.3 | | |
| 361 | S | 45.3 | Very low | 42.6 | Very low | 103 Ų | 103 | 137.5 Ų | 137.5 | 72% | 0.72 | 80% | 0.8 | S | S | * | * | S | Bend | trans | -97.6 | -13.6 | 177.5 | 46.2 | 0 | 0 | 0 | 0 | 113.9 | | |
| 362 | A | 44.9 | Very low | 42.7 | Very low | 71 Ų | 71 | 135.3 Ų | 135.3 | 59% | 0.587 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -84.9 | -16.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | | |
| 363 | V | 46.3 | Very low | 42.6 | Very low | 111 Ų | 111 | 137.3 Ų | 137.3 | 67% | 0.673 | 80% | 0.804 | S | S | * | * | S | Bend | trans | -96 | -8.5 | -178.3 | -177.5 | 0 | 0 | 0 | 0 | 113 | | |
| 364 | A | 40.6 | Very low | 42.1 | Very low | 79 Ų | 79 | 137.4 Ų | 137.4 | 65% | 0.653 | 80% | 0.8 | S | S | * | * | S | Bend | trans | -90.2 | -9.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 365 | A | 39.5 | Very low | 42 | Very low | 90 Ų | 90 | 136.1 Ų | 136.1 | 74% | 0.744 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -98.2 | -3.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | | |
| 366 | A | 40.8 | Very low | 42.2 | Very low | 91 Ų | 91 | 136.4 Ų | 136.4 | 75% | 0.752 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -94.8 | -0.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | | |
| 367 | N | 42.4 | Very low | 41.9 | Very low | 140 Ų | 140 | 132.2 Ų | 132.2 | 75% | 0.749 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -130.9 | 54.2 | -173.9 | -152.1 | 1.5 | 0 | 0 | 0 | 113.1 | | |
| 368 | R | 38.5 | Very low | 41.8 | Very low | 239 Ų | 239 | 125.9 Ų | 125.9 | 90% | 0.902 | 80% | 0.797 | S | S | * | * | S | Bend | trans | -137 | 31.9 | 171.8 | -138.6 | -166.4 | -79.6 | 174 | -5.2 | 113.1 | | |
| 369 | N | 41.3 | Very low | 41.6 | Very low | 170 Ų | 170 | 122.2 Ų | 122.2 | 91% | 0.909 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -134.5 | 43.7 | 175.6 | -146 | 8.6 | 0 | 0 | 0 | 112.2 | | |
| 370 | A | 41.4 | Very low | 41.7 | Very low | 89 Ų | 89 | 122.7 Ų | 122.7 | 74% | 0.736 | 81% | 0.806 | S | S | * | * | | | trans | -149.4 | 80 | 169 | 0 | 0 | 0 | 0 | 0 | 109.4 | | |
| 371 | A | 38.5 | Very low | 41.8 | Very low | 181 Ų | 181 | 124 Ų | 124 | 100% | 1.496 | 81% | 0.811 | S | S | * | * | | | trans | -164.9 | 0 | 155.5 | 0 | 0 | 0 | 0 | 0 | 108 | | |