| 1 | M | 46.5 | Very low | 51.1 | Low | 232 Ų | 232 | 142.9 Ų | 142.9 | 100% | 1.143 | 84% | 0.844 | S | S | * | * | | | | 0 | 130.8 | 0 | -68 | 164.8 | 72.3 | 0 | 0 | 107.1 | | |
| 2 | S | 55.4 | Low | 50.9 | Low | 123 Ų | 123 | 146.8 Ų | 146.8 | 86% | 0.86 | 84% | 0.843 | S | S | * | * | | | trans | 69.8 | 109.3 | 172.3 | -34.6 | 0 | 0 | 0 | 0 | 115 | | |
| 3 | G | 42.9 | Very low | 49.8 | Very low | 64 Ų | 64 | 144 Ų | 144 | 66% | 0.66 | 84% | 0.837 | S | S | * | * | | | cis | 87.2 | 121.7 | 21.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 4 | L | 58.1 | Low | 48.9 | Very low | 179 Ų | 179 | 138.8 Ų | 138.8 | 94% | 0.937 | 83% | 0.829 | S | S | * | * | | | trans | 83.9 | 144.5 | 161.7 | -45 | 172.1 | 0 | 0 | 0 | 115.8 | | |
| 5 | S | 54 | Low | 48.2 | Very low | 110 Ų | 110 | 136.3 Ų | 136.3 | 77% | 0.769 | 82% | 0.821 | S | S | * | * | | | cis | 169.5 | 137.2 | -10.4 | 171 | 0 | 0 | 0 | 0 | 105.7 | | |
| 6 | G | 53.5 | Low | 48.3 | Very low | 69 Ų | 69 | 140.1 Ų | 140.1 | 71% | 0.711 | 83% | 0.828 | S | S | * | * | | | trans | 74.9 | 148.2 | 164.9 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 7 | K | 57.6 | Low | 48.1 | Very low | 199 Ų | 199 | 138.7 Ų | 138.7 | 87% | 0.865 | 82% | 0.821 | S | S | * | * | | | cis | -160.2 | 155.7 | 37.9 | -69.2 | -171.1 | 171 | -179.7 | 0 | 111.3 | | |
| 8 | S | 54.9 | Low | 47.8 | Very low | 109 Ų | 109 | 134.8 Ų | 134.8 | 76% | 0.762 | 81% | 0.814 | S | S | * | * | | | trans | 61.3 | 99 | 154.3 | 59 | 0 | 0 | 0 | 0 | 118.8 | L10 | S8-L10 PolarHBondContact O-N 3.44Š|
| 9 | V | 50.3 | Low | 47.8 | Very low | 153 Ų | 153 | 133.8 Ų | 133.8 | 93% | 0.927 | 81% | 0.814 | S | S | * | * | | | trans | -73.5 | 104.7 | 152.8 | 171.6 | 0 | 0 | 0 | 0 | 107.5 | | |
| 10 | L | 51.8 | Low | 47.6 | Very low | 158 Ų | 158 | 139.3 Ų | 139.3 | 83% | 0.827 | 82% | 0.819 | S | S | * | * | | | trans | -60.2 | 135 | 172.5 | -175.1 | 66.9 | 0 | 0 | 0 | 110.4 | S8 | S8-L10 PolarHBondContact O-N 3.44Š|
| 11 | E | 37.4 | Very low | 48 | Very low | 176 Ų | 176 | 138.1 Ų | 138.1 | 82% | 0.822 | 82% | 0.819 | S | S | * | * | | | trans | -53.8 | 173.4 | 165.9 | -70 | -171.9 | 133.8 | 0 | 0 | 112.3 | | |
| 12 | K | 48.9 | Very low | 48.7 | Very low | 190 Ų | 190 | 135.6 Ų | 135.6 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | | | trans | 113.6 | 96.7 | 146.3 | -149.5 | 158.8 | -174.1 | 174.1 | 0 | 114.5 | | |
| 13 | S | 36.7 | Very low | 49.7 | Very low | 110 Ų | 110 | 139.5 Ų | 139.5 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | | | trans | 27.8 | 107.5 | 137.7 | 61.8 | 0 | 0 | 0 | 0 | 116.9 | | |
| 14 | G | 37.1 | Very low | 51.3 | Low | 71 Ų | 71 | 145.5 Ų | 145.5 | 73% | 0.732 | 81% | 0.806 | S | S | * | * | | | trans | 158.4 | 113.7 | 164 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 15 | S | 38.5 | Very low | 52.4 | Low | 101 Ų | 101 | 143.2 Ų | 143.2 | 71% | 0.706 | 80% | 0.799 | S | S | * | * | | | trans | 53.7 | 87 | 134.5 | -165.9 | 0 | 0 | 0 | 0 | 117.3 | T17 | S15-T17 VanDerWaalsContact C-N 3.27Å; S15-T17 PolarHBondContact O-N 3.39Å |
| 16 | Q | 48.7 | Very low | 53.7 | Low | 198 Ų | 198 | 143.1 Ų | 143.1 | 93% | 0.925 | 79% | 0.79 | S | S | * | * | | | trans | -72.4 | 89.1 | 156.1 | -96.4 | -167.6 | -9.4 | 0 | 0 | 109.8 | | |
| 17 | T | 45.3 | Very low | 55 | Low | 116 Ų | 116 | 144 Ų | 144 | 71% | 0.712 | 78% | 0.778 | S | S | * | * | | | trans | -71.5 | 131 | 153.8 | 49.4 | 0 | 0 | 0 | 0 | 109.5 | S15 | S15-T17 VanDerWaalsContact C-N 3.27Å; S15-T17 PolarHBondContact O-N 3.39Å |
| 18 | G | 43.2 | Very low | 56.4 | Low | 68 Ų | 68 | 139.9 Ų | 139.9 | 70% | 0.701 | 77% | 0.765 | S | S | * | * | S | Bend | trans | 90.8 | 118.4 | 151.7 | 0 | 0 | 0 | 0 | 0 | 118.6 | | |
| 19 | S | 47.3 | Very low | 57.8 | Low | 116 Ų | 116 | 140.2 Ų | 140.2 | 81% | 0.811 | 76% | 0.757 | S | S | * | * | S | Bend | trans | 86.7 | 107.6 | 153.8 | 82 | 0 | 0 | 0 | 0 | 119.7 | | |
| 20 | R | 44.5 | Very low | 59.1 | Low | 243 Ų | 243 | 134.6 Ų | 134.6 | 92% | 0.917 | 73% | 0.725 | S | S | * | * | | | trans | 44.2 | 69.3 | 154.5 | -55.7 | -174.3 | -154.8 | 151.1 | 5.4 | 117.9 | | |
| 21 | S | 56 | Low | 60.4 | Low | 115 Ų | 115 | 130.9 Ų | 130.9 | 80% | 0.804 | 71% | 0.709 | S | S | * | * | | | trans | -99.2 | 121 | 172.2 | -160.9 | 0 | 0 | 0 | 0 | 112.7 | | |
| 22 | K | 60.9 | Low | 62.1 | Low | 179 Ų | 179 | 132 Ų | 132 | 78% | 0.778 | 71% | 0.707 | S | S | * | * | | | trans | -71.4 | 155 | -177.9 | -58.6 | 158.9 | -174.5 | 172.6 | 0 | 109.2 | R24 | K22-R24 PolarHBondContact O-N 3.44Š|
| 23 | F | 76.6 | Confident | 63.5 | Low | 206 Ų | 206 | 126.5 Ų | 126.5 | 90% | 0.904 | 69% | 0.693 | S | S | * | * | | | trans | -6.5 | 116.7 | -179.9 | -55.7 | -78.1 | 0 | 0 | 0 | 116.6 | T25 | F23-T25 PolarHBondContact O-N 3.37Š|
| 24 | R | 76.9 | Confident | 65 | Low | 190 Ų | 190 | 124.3 Ų | 124.3 | 72% | 0.717 | 69% | 0.687 | S | S | * | * | | | trans | -69.7 | 112.2 | 171.4 | -161 | -159.2 | -160.5 | -87.8 | 5.5 | 108.9 | K22 L26 | K22-R24 PolarHBondContact O-N 3.44Å; R24-L26 PolarHBondContact O-N 3.2Å |
| 25 | T | 79.7 | Confident | 66.2 | Low | 130 Ų | 130 | 128.3 Ų | 128.3 | 80% | 0.798 | 68% | 0.684 | S | S | * | * | | | trans | -61.4 | 125.7 | 170.4 | -48.6 | 0 | 0 | 0 | 0 | 109.3 | F23 | F23-T25 PolarHBondContact O-N 3.37Š|
| 26 | L | 81.3 | Confident | 67 | Low | 108 Ų | 108 | 127.3 Ų | 127.3 | 57% | 0.565 | 68% | 0.677 | S | S | * | * | | | trans | -105.5 | 129.8 | 175.7 | -177.1 | 65.9 | 0 | 0 | 0 | 108.6 | R24 V31 | R24-L26 PolarHBondContact O-N 3.2Å; L26-V31 HydrophobicContact CD1-CG2 3.86Å; L26-V31 HydrophobicContact CD2-CG2 3.64Å; L26-V31 HydrophobicContact CG-CG2 3.76Å |
| 27 | N | 82.4 | Confident | 67.5 | Low | 87 Ų | 87 | 123.2 Ų | 123.2 | 47% | 0.465 | 66% | 0.661 | S | S | . | * | | | trans | -86.2 | 120.4 | 172.7 | -178.4 | -23.9 | 0 | 0 | 0 | 109.3 | N29 S30 V31 | N27-N29 VanDerWaalsContact C-N 3.27Å; N27-N29 PolarHBondContact O-N 3.49Å; N27-N29 VanDerWaalsContact OD1-CB 3.28Å; N27-N29 WeakPolarHBondContact OD1-CB 3.48Å; N27-N29 PolarHBondContact OD1-N 3.47Å; N27-S30 WeakPolarHBondContact CB-OG 3.49Å; N27-S30 WeakPolarHBondContact O-CB 3.36Å; N27-S30 PolarHBondContact O-N 2.66Å; N27-S30 VanDerWaalsContact O-N 3.11Å; N27-V31 PolarHBondContact O-N 3.07Å |
| 28 | I | 85.3 | Confident | 68.2 | Low | 114 Ų | 114 | 124.8 Ų | 124.8 | 59% | 0.585 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -60.3 | -37.9 | -178.2 | -59.4 | 173.1 | 0 | 0 | 0 | 111.1 | S30 V31 Y32 | I28-S30 VanDerWaalsContact C-N 3.27Å; I28-S30 PolarHBondContact O-N 2.69Å; I28-V31 PolarHBondContact O-N 2.63Å; I28-Y32 HydrophobicContact CG2-CD2 3.6Å; I28-Y32 HydrophobicContact CG2-CE2 3.43Å; I28-Y32 VanDerWaalsContact CG2-CE2 3.43Å; I28-Y32 VanDerWaalsContact O-CD2 3.31Å; I28-Y32 WeakPolarHBondContact O-CD2 3.21Å; I28-Y32 PolarHBondContact O-N 3.49Å |
| 29 | N | 85.7 | Confident | 68.5 | Low | 115 Ų | 115 | 126.9 Ų | 126.9 | 62% | 0.615 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -62.7 | -37.1 | 178.2 | -60.1 | -20 | 0 | 0 | 0 | 110.8 | N27 V31 S33 | N27-N29 VanDerWaalsContact C-N 3.27Å; N27-N29 PolarHBondContact O-N 3.49Å; N27-N29 VanDerWaalsContact OD1-CB 3.28Å; N27-N29 WeakPolarHBondContact OD1-CB 3.48Å; N27-N29 PolarHBondContact OD1-N 3.47Å; N29-V31 VanDerWaalsContact C-N 3.33Å; N29-V31 PolarHBondContact O-N 2.58Å; N29-S33 WeakPolarHBondContact O-CB 3.37Å; N29-S33 PolarHBondContact O-N 3.47Å; N29-S33 PolarHBondContact O-OG 2.91Å |
| 30 | S | 76.7 | Confident | 68.6 | Low | 35 Ų | 35 | 126.7 Ų | 126.7 | 25% | 0.245 | 67% | 0.667 | C | S | . | * | H | α-helix | trans | -67 | -33 | 178.9 | -48.6 | 0 | 0 | 0 | 0 | 112.9 | N27 I28 | N27-S30 WeakPolarHBondContact CB-OG 3.49Å; N27-S30 WeakPolarHBondContact O-CB 3.36Å; N27-S30 PolarHBondContact O-N 2.66Å; N27-S30 VanDerWaalsContact O-N 3.11Å; I28-S30 VanDerWaalsContact C-N 3.27Å; I28-S30 PolarHBondContact O-N 2.69Å |
| 31 | V | 79.7 | Confident | 68.9 | Low | 80 Ų | 80 | 126.4 Ų | 126.4 | 49% | 0.485 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -69.6 | -49.9 | 178 | -180 | 0 | 0 | 0 | 0 | 110.5 | L26 N27 I28 N29 S33 G34 | L26-V31 HydrophobicContact CD1-CG2 3.86Å; L26-V31 HydrophobicContact CD2-CG2 3.64Å; L26-V31 HydrophobicContact CG-CG2 3.76Å; N27-V31 PolarHBondContact O-N 3.07Å; I28-V31 PolarHBondContact O-N 2.63Å; N29-V31 VanDerWaalsContact C-N 3.33Å; N29-V31 PolarHBondContact O-N 2.58Å; V31-S33 VanDerWaalsContact C-N 3.33Å; V31-S33 PolarHBondContact O-N 3.36Å; V31-G34 PolarHBondContact O-N 2.92Å |
| 32 | Y | 73.9 | Confident | 68.7 | Low | 200 Ų | 200 | 126 Ų | 126 | 78% | 0.784 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -74.3 | -22 | -179.4 | -69 | -67.2 | 0 | 0 | 0 | 113.4 | I28 G34 | I28-Y32 HydrophobicContact CG2-CD2 3.6Å; I28-Y32 HydrophobicContact CG2-CE2 3.43Å; I28-Y32 VanDerWaalsContact CG2-CE2 3.43Å; I28-Y32 VanDerWaalsContact O-CD2 3.31Å; I28-Y32 WeakPolarHBondContact O-CD2 3.21Å; I28-Y32 PolarHBondContact O-N 3.49Å; Y32-G34 PolarHBondContact O-N 3.13Å |
| 33 | S | 77.4 | Confident | 68.3 | Low | 75 Ų | 75 | 125.5 Ų | 125.5 | 52% | 0.524 | 67% | 0.669 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.8 | -1.4 | 173.9 | -57.9 | 0 | 0 | 0 | 0 | 114 | N29 V31 K35 | N29-S33 WeakPolarHBondContact O-CB 3.37Å; N29-S33 PolarHBondContact O-N 3.47Å; N29-S33 PolarHBondContact O-OG 2.91Å; V31-S33 VanDerWaalsContact C-N 3.33Å; V31-S33 PolarHBondContact O-N 3.36Å; S33-K35 PolarHBondContact O-N 3.47Å; S33-K35 VanDerWaalsContact O-N 3.07Å |
| 34 | G | 67.5 | Low | 67.2 | Low | 63 Ų | 63 | 121.3 Ų | 121.3 | 65% | 0.649 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 68.2 | 6.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | V31 Y32 S36 | V31-G34 PolarHBondContact O-N 2.92Å; Y32-G34 PolarHBondContact O-N 3.13Å; G34-S36 PolarHBondContact O-N 2.9Å |
| 35 | K | 63.7 | Low | 65.9 | Low | 155 Ų | 155 | 118 Ų | 118 | 67% | 0.674 | 67% | 0.666 | S | S | * | * | | | trans | -79 | 70.5 | 174.1 | -63.1 | 176.1 | -169.3 | -77 | 0 | 108 | S33 L37 | S33-K35 PolarHBondContact O-N 3.47Å; S33-K35 VanDerWaalsContact O-N 3.07Å; K35-L37 PolarHBondContact O-N 2.99Å; K35-L37 VanDerWaalsContact O-N 3.08Å |
| 36 | S | 54.1 | Low | 64.6 | Low | 80 Ų | 80 | 115.3 Ų | 115.3 | 56% | 0.559 | 65% | 0.652 | S | S | * | * | | | trans | -54 | 113.4 | 178 | -179.2 | 0 | 0 | 0 | 0 | 110.1 | G34 L38 | G34-S36 PolarHBondContact O-N 2.9Å; S36-L38 PolarHBondContact O-N 2.94Å; S36-L38 WeakPolarHBondContact OG-CB 3.35Å; S36-L38 WeakPolarHBondContact OG-CD1 3.28Å; S36-L38 PolarHBondContact OG-N 3.07Å |
| 37 | L | 59 | Low | 63.3 | Low | 113 Ų | 113 | 120.3 Ų | 120.3 | 59% | 0.592 | 67% | 0.67 | S | S | * | * | | | trans | -80.7 | 12.3 | 169.8 | -68 | 174.2 | 0 | 0 | 0 | 112.1 | K35 S39 | K35-L37 PolarHBondContact O-N 2.99Å; K35-L37 VanDerWaalsContact O-N 3.08Å; L37-S39 PolarHBondContact O-N 3.13Å; L37-S39 VanDerWaalsContact O-N 3.13Å |
| 38 | L | 59.9 | Low | 61.8 | Low | 148 Ų | 148 | 125.8 Ų | 125.8 | 78% | 0.775 | 69% | 0.692 | S | S | * | * | | | trans | -78.9 | 95.5 | 173.5 | -65.3 | 152 | 0 | 0 | 0 | 107.5 | S36 S40 | S36-L38 PolarHBondContact O-N 2.94Å; S36-L38 WeakPolarHBondContact OG-CB 3.35Å; S36-L38 WeakPolarHBondContact OG-CD1 3.28Å; S36-L38 PolarHBondContact OG-N 3.07Å; L38-S40 PolarHBondContact O-N 3.46Å |
| 39 | S | 50.8 | Low | 60.6 | Low | 112 Ų | 112 | 122.2 Ų | 122.2 | 78% | 0.783 | 68% | 0.684 | S | S | * | * | | | trans | -50 | 108.4 | 165.1 | -81.5 | 0 | 0 | 0 | 0 | 109.3 | L37 R41 | L37-S39 PolarHBondContact O-N 3.13Å; L37-S39 VanDerWaalsContact O-N 3.13Å; S39-R41 PolarHBondContact O-N 2.65Å |
| 40 | S | 49.2 | Very low | 59.8 | Low | 112 Ų | 112 | 125.3 Ų | 125.3 | 78% | 0.783 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -48.3 | 99.1 | 158.9 | 157.4 | 0 | 0 | 0 | 0 | 108.8 | L38 | L38-S40 PolarHBondContact O-N 3.46Š|
| 41 | R | 50.5 | Low | 59.5 | Low | 237 Ų | 237 | 131.3 Ų | 131.3 | 89% | 0.894 | 72% | 0.723 | S | S | * | * | | | trans | 176.8 | 92.6 | 162.2 | -101.9 | 178.5 | -82.7 | -171.1 | -2.1 | 110.3 | S39 | S39-R41 PolarHBondContact O-N 2.65Š|
| 42 | S | 51.9 | Low | 58.9 | Low | 107 Ų | 107 | 132.6 Ų | 132.6 | 75% | 0.748 | 74% | 0.736 | S | S | * | * | | | trans | -149.6 | 68.1 | 160.2 | 69.9 | 0 | 0 | 0 | 0 | 111.8 | | |
| 43 | N | 51.3 | Low | 58.2 | Low | 169 Ų | 169 | 130.2 Ų | 130.2 | 90% | 0.904 | 74% | 0.736 | S | S | * | * | | | trans | -85.4 | 90.9 | 149.9 | -89.1 | -0.9 | 0 | 0 | 0 | 106.5 | | |
| 44 | V | 53.9 | Low | 57.1 | Low | 118 Ų | 118 | 129.6 Ų | 129.6 | 72% | 0.715 | 74% | 0.741 | S | S | * | * | | | trans | -163.5 | 124.9 | 165.9 | -95.5 | 0 | 0 | 0 | 0 | 110.1 | S46 | V44-S46 PolarHBondContact O-N 2.85Š|
| 45 | S | 49.3 | Very low | 56.7 | Low | 120 Ų | 120 | 136.6 Ų | 136.6 | 84% | 0.839 | 75% | 0.754 | S | S | * | * | | | trans | -47.7 | 130.5 | 169.7 | 57.2 | 0 | 0 | 0 | 0 | 112 | | |
| 46 | S | 53.7 | Low | 56.4 | Low | 73 Ų | 73 | 132.6 Ų | 132.6 | 51% | 0.51 | 75% | 0.75 | S | S | . | * | | | trans | -144.5 | 104.4 | 166.5 | -64.7 | 0 | 0 | 0 | 0 | 105.4 | V44 H48 G49 | V44-S46 PolarHBondContact O-N 2.85Å; S46-H48 PolarHBondContact O-N 3.36Å; S46-H48 VanDerWaalsContact O-N 3.13Å; S46-G49 PolarHBondContact O-N 3.42Å; S46-G49 VanDerWaalsContact O-N 3.07Å |
| 47 | K | 54.3 | Low | 56.3 | Low | 214 Ų | 214 | 135.8 Ų | 135.8 | 93% | 0.93 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | | 23.5 | 70.9 | 85.7 | -84.6 | -175.2 | 172.1 | -178.3 | 0 | 109.6 | G49 | K47-G49 PolarHBondContact O-N 3.44Š|
| 48 | H | 50.7 | Low | 56 | Low | 201 Ų | 201 | 133.6 Ų | 133.6 | 93% | 0.931 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 58.3 | 39.9 | -179.4 | -65.3 | -75.7 | 0 | 0 | 0 | 117.1 | S46 | S46-H48 PolarHBondContact O-N 3.36Å; S46-H48 VanDerWaalsContact O-N 3.13Å |
| 49 | G | 58.5 | Low | 55.6 | Low | 40 Ų | 40 | 134.2 Ų | 134.2 | 41% | 0.412 | 77% | 0.767 | S | S | . | * | | | trans | -80.5 | 138.8 | 164.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | S46 K47 Q51 | S46-G49 PolarHBondContact O-N 3.42Å; S46-G49 VanDerWaalsContact O-N 3.07Å; K47-G49 PolarHBondContact O-N 3.44Å; G49-Q51 PolarHBondContact O-N 3.07Å |
| 50 | L | 69.9 | Low | 55.9 | Low | 179 Ų | 179 | 132 Ų | 132 | 94% | 0.937 | 76% | 0.756 | S | S | * | * | | | trans | -42.5 | 112.3 | 174.6 | -71.7 | 166.1 | 0 | 0 | 0 | 110 | S52 | L50-S52 PolarHBondContact O-N 2.86Š|
| 51 | Q | 70.8 | Confident | 56.5 | Low | 161 Ų | 161 | 137.5 Ų | 137.5 | 75% | 0.752 | 76% | 0.759 | S | S | * | * | | | trans | -61.3 | 104.6 | 178.5 | -178.5 | 179.5 | -36.2 | 0 | 0 | 107.4 | G49 L53 | G49-Q51 PolarHBondContact O-N 3.07Å; Q51-L53 PolarHBondContact O-N 3.08Å |
| 52 | S | 67.4 | Low | 57.7 | Low | 108 Ų | 108 | 137.1 Ų | 137.1 | 76% | 0.755 | 76% | 0.758 | S | S | * | * | | | trans | -55.9 | 110.9 | 164.5 | 38.3 | 0 | 0 | 0 | 0 | 106.2 | L50 G54 | L50-S52 PolarHBondContact O-N 2.86Å; S52-G54 PolarHBondContact O-N 3.35Å |
| 53 | L | 57.5 | Low | 59 | Low | 149 Ų | 149 | 140 Ų | 140 | 78% | 0.78 | 76% | 0.761 | S | S | * | * | | | trans | -65.7 | 68.2 | 172.2 | -65 | 172.6 | 0 | 0 | 0 | 108 | Q51 K55 | Q51-L53 PolarHBondContact O-N 3.08Å; L53-K55 PolarHBondContact O-N 3.34Å; L53-K55 VanDerWaalsContact O-N 3.13Å |
| 54 | G | 54.7 | Low | 60.5 | Low | 62 Ų | 62 | 136.6 Ų | 136.6 | 64% | 0.639 | 75% | 0.748 | S | S | * | * | | | trans | -70 | 108 | 174.8 | 0 | 0 | 0 | 0 | 0 | 107.1 | S52 A56 | S52-G54 PolarHBondContact O-N 3.35Å; G54-A56 PolarHBondContact O-N 3.02Å |
| 55 | K | 60.8 | Low | 62 | Low | 210 Ų | 210 | 136.4 Ų | 136.4 | 91% | 0.913 | 75% | 0.75 | S | S | * | * | S | Bend | trans | 24.2 | 48.6 | 168.7 | -68.8 | 178.1 | 176.6 | 178.1 | 0 | 114 | L53 T57 | L53-K55 PolarHBondContact O-N 3.34Å; L53-K55 VanDerWaalsContact O-N 3.13Å; K55-T57 PolarHBondContact O-N 3.13Å |
| 56 | A | 56.4 | Low | 63.7 | Low | 72 Ų | 72 | 136.8 Ų | 136.8 | 60% | 0.595 | 75% | 0.749 | S | S | * | * | | | trans | -61.7 | 137.2 | 160.4 | 0 | 0 | 0 | 0 | 0 | 103.1 | G54 A58 | G54-A56 PolarHBondContact O-N 3.02Å; A56-A58 PolarHBondContact O-N 3.26Å |
| 57 | T | 52.3 | Low | 65.2 | Low | 146 Ų | 146 | 137 Ų | 137 | 90% | 0.896 | 76% | 0.755 | S | S | * | * | | | trans | -57.1 | 76 | 159 | -53 | 0 | 0 | 0 | 0 | 105.8 | K55 I59 | K55-T57 PolarHBondContact O-N 3.13Å; T57-I59 PolarHBondContact O-N 3.39Å; T57-I59 VanDerWaalsContact O-N 3.07Å |
| 58 | A | 53.5 | Low | 66.7 | Low | 67 Ų | 67 | 134.7 Ų | 134.7 | 55% | 0.554 | 75% | 0.753 | S | S | * | * | | | trans | -55 | 126.3 | 167.3 | 0 | 0 | 0 | 0 | 0 | 100.8 | A56 A60 | A56-A58 PolarHBondContact O-N 3.26Å; A58-A60 HydrophobicContact CB-CB 4.09Å; A58-A60 PolarHBondContact O-N 3.35Å |
| 59 | I | 50.7 | Low | 68.3 | Low | 161 Ų | 161 | 131.1 Ų | 131.1 | 83% | 0.826 | 74% | 0.74 | S | S | * | * | | | trans | -56.2 | 74.4 | 136.8 | -62.5 | 163 | 0 | 0 | 0 | 104 | T57 R61 | T57-I59 PolarHBondContact O-N 3.39Å; T57-I59 VanDerWaalsContact O-N 3.07Å; I59-R61 PolarHBondContact O-N 3.39Å |
| 60 | A | 55.9 | Low | 69.1 | Low | 67 Ų | 67 | 133.7 Ų | 133.7 | 55% | 0.554 | 75% | 0.75 | S | S | * | * | | | trans | -64.3 | 95.9 | 162.7 | 0 | 0 | 0 | 0 | 0 | 98.7 | A58 R62 | A58-A60 HydrophobicContact CB-CB 4.09Å; A58-A60 PolarHBondContact O-N 3.35Å; A60-R62 PolarHBondContact O-N 3.18Å |
| 61 | R | 62.8 | Low | 69.3 | Low | 226 Ų | 226 | 129 Ų | 129 | 85% | 0.853 | 73% | 0.732 | S | S | * | * | | | trans | -49.6 | 94.4 | 159.5 | -74.1 | -179.3 | 149.9 | 138.2 | -4 | 103.2 | I59 M63 | I59-R61 PolarHBondContact O-N 3.39Å; R61-M63 PolarHBondContact O-N 3.49Å |
| 62 | R | 74.5 | Confident | 69 | Low | 230 Ų | 230 | 128 Ų | 128 | 87% | 0.868 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 122.6 | 178 | -75.8 | -178.4 | 160.4 | -148.9 | -3.7 | 102.4 | A60 P64 | A60-R62 PolarHBondContact O-N 3.18Å; R62-P64 VanDerWaalsContact O-N 3.15Å |
| 63 | M | 80.7 | Confident | 68.7 | Low | 166 Ų | 166 | 131.5 Ų | 131.5 | 82% | 0.818 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -47.1 | 131 | 174.2 | -74.4 | -67 | -66.9 | 0 | 0 | 106.4 | R61 | R61-M63 PolarHBondContact O-N 3.49Š|
| 64 | P | 82.3 | Confident | 69 | Low | 98 Ų | 98 | 128 Ų | 128 | 64% | 0.636 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 144.9 | 174.8 | 23.1 | -32.2 | 0 | 0 | 0 | 108 | R62 | R62-P64 VanDerWaalsContact O-N 3.15Š|
| 65 | P | 85.5 | Confident | 69.6 | Low | 115 Ų | 115 | 131.1 Ų | 131.1 | 75% | 0.747 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -51.3 | 137.8 | 177.3 | 22.1 | -32.3 | 0 | 0 | 0 | 109.3 | A67 | P65-A67 PolarHBondContact O-N 3.1Š|
| 66 | P | 84.7 | Confident | 69.6 | Low | 127 Ų | 127 | 124.7 Ų | 124.7 | 83% | 0.825 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 130.7 | 174.9 | -25.4 | 33.7 | 0 | 0 | 0 | 110.1 | N68 | P66-N68 PolarHBondContact O-N 2.97Š|
| 67 | A | 86.3 | Confident | 69.8 | Low | 77 Ų | 77 | 125.5 Ų | 125.5 | 64% | 0.636 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 137.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | P65 L69 | P65-A67 PolarHBondContact O-N 3.1Å; A67-L69 HydrophobicContact CB-CD2 4.12Å; A67-L69 HydrophobicContact CB-CG 4.24Å; A67-L69 PolarHBondContact O-N 3.48Å; A67-L69 VanDerWaalsContact O-N 3.12Å |
| 68 | N | 85.4 | Confident | 70.3 | Confident | 167 Ų | 167 | 121.8 Ų | 121.8 | 89% | 0.893 | 70% | 0.698 | S | S | * | * | | | trans | -80.4 | 90.1 | 170.3 | -166.3 | -3.4 | 0 | 0 | 0 | 108.1 | P66 | P66-N68 PolarHBondContact O-N 2.97Š|
| 69 | L | 83.1 | Confident | 71 | Confident | 126 Ų | 126 | 123.2 Ų | 123.2 | 66% | 0.66 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -85 | 142.1 | 177 | -60.8 | 178.6 | 0 | 0 | 0 | 109.4 | A67 S71 | A67-L69 HydrophobicContact CB-CD2 4.12Å; A67-L69 HydrophobicContact CB-CG 4.24Å; A67-L69 PolarHBondContact O-N 3.48Å; A67-L69 VanDerWaalsContact O-N 3.12Å; L69-S71 PolarHBondContact O-N 3.28Å |
| 70 | P | 76.7 | Confident | 72 | Confident | 94 Ų | 94 | 119.6 Ų | 119.6 | 61% | 0.61 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 128.2 | 168.9 | 24.7 | -32.7 | 0 | 0 | 0 | 108 | | |
| 71 | S | 72.5 | Confident | 72.7 | Confident | 81 Ų | 81 | 122.9 Ų | 122.9 | 57% | 0.566 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -63 | 145.2 | 179 | -70.4 | 0 | 0 | 0 | 0 | 109 | L69 K73 S74 E75 | L69-S71 PolarHBondContact O-N 3.28Å; S71-K73 PolarHBondContact O-N 2.94Å; S71-S74 PolarHBondContact N-OG 3.24Å; S71-S74 PolarHBondContact O-N 3.47Å; S71-S74 PolarHBondContact O-OG 3.21Å; S71-E75 PolarHBondContact O-N 3.34Å |
| 72 | L | 65 | Low | 73 | Confident | 140 Ų | 140 | 116 Ų | 116 | 73% | 0.733 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -52.4 | -24 | 177.2 | -157.2 | 81.2 | 0 | 0 | 0 | 113.1 | S76 | L72-S76 WeakPolarHBondContact O-CB 3.43Å; L72-S76 PolarHBondContact O-N 2.59Å; L72-S76 PolarHBondContact O-OG 3.19Å |
| 73 | K | 61.5 | Low | 72.7 | Confident | 181 Ų | 181 | 109.2 Ų | 109.2 | 79% | 0.787 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -71.5 | -26.6 | 174.9 | -63.9 | 179.3 | 177.8 | 177.8 | 0 | 114.1 | S71 | S71-K73 PolarHBondContact O-N 2.94Å |
| 74 | S | 64.4 | Low | 72 | Confident | 76 Ų | 76 | 105.5 Ų | 105.5 | 53% | 0.531 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -84 | -24.2 | 173.2 | 51.5 | 0 | 0 | 0 | 0 | 113.1 | S71 | S71-S74 PolarHBondContact N-OG 3.24Å; S71-S74 PolarHBondContact O-N 3.47Å; S71-S74 PolarHBondContact O-OG 3.21Å |
| 75 | E | 66.1 | Low | 71.5 | Confident | 127 Ų | 127 | 106.6 Ų | 106.6 | 59% | 0.593 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -81.5 | -27.5 | 176.9 | -171 | 178.2 | 167.3 | 0 | 0 | 112.5 | S71 | S71-E75 PolarHBondContact O-N 3.34Å |
| 76 | S | 60.8 | Low | 70.7 | Confident | 75 Ų | 75 | 104.4 Ų | 104.4 | 52% | 0.524 | 64% | 0.64 | S | S | . | * | S | Bend | trans | -92.4 | -8.3 | -178.8 | 49.5 | 0 | 0 | 0 | 0 | 114.6 | L72 G78 | L72-S76 WeakPolarHBondContact O-CB 3.43Å; L72-S76 PolarHBondContact O-N 2.59Å; L72-S76 PolarHBondContact O-OG 3.19Å; S76-G78 PolarHBondContact O-N 3.41Å; S76-G78 VanDerWaalsContact O-N 3.11Å |
| 77 | A | 61.2 | Low | 70 | Confident | 89 Ų | 89 | 102.6 Ų | 102.6 | 74% | 0.736 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75 | 4.1 | -175.2 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 78 | G | 62.9 | Low | 68.9 | Low | 68 Ų | 68 | 105 Ų | 105 | 70% | 0.701 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -151.2 | 14 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | S76 D80 | S76-G78 PolarHBondContact O-N 3.41Å; S76-G78 VanDerWaalsContact O-N 3.11Å; G78-D80 VanDerWaalsContact C-N 3.33Å; G78-D80 PolarHBondContact O-N 3.03Å |
| 79 | Q | 67.9 | Low | 67.8 | Low | 97 Ų | 97 | 100.8 Ų | 100.8 | 45% | 0.453 | 64% | 0.637 | S | S | . | * | | | trans | -80.4 | 89 | 172 | -73.1 | -62.6 | 0.7 | 0 | 0 | 109 | P81 I85 | Q79-P81 WeakPolarHBondContact O-CD 3.35Å; Q79-I85 HydrophobicContact CG-CD1 4.41Å |
| 80 | D | 72.1 | Confident | 66.4 | Low | 85 Ų | 85 | 99.2 Ų | 99.2 | 46% | 0.455 | 63% | 0.632 | S | S | . | * | | | trans | -60.7 | 118.8 | 170.9 | -176.9 | -6.4 | 0 | 0 | 0 | 108.6 | G78 A82 V83 | G78-D80 VanDerWaalsContact C-N 3.33Å; G78-D80 PolarHBondContact O-N 3.03Å; D80-A82 PolarHBondContact O-N 3.48Å; D80-A82 VanDerWaalsContact OD1-CB 3.23Å; D80-A82 WeakPolarHBondContact OD1-CB 3.31Å; D80-A82 PolarHBondContact OD1-N 3.05Å; D80-V83 HydrophobicContact CB-CB 4.29Å; D80-V83 HydrophobicContact CB-CG2 3.87Å; D80-V83 PolarHBondContact O-N 3.26Å |
| 81 | P | 69.6 | Low | 65.3 | Low | 135 Ų | 135 | 100.6 Ų | 100.6 | 88% | 0.877 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.2 | -13.9 | 175.9 | 25.1 | -34 | 0 | 0 | 0 | 113.3 | Q79 | Q79-P81 WeakPolarHBondContact O-CD 3.35Š|
| 82 | A | 70.6 | Confident | 64.3 | Low | 83 Ų | 83 | 98.7 Ų | 98.7 | 69% | 0.686 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.9 | -14.6 | 171.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | D80 | D80-A82 PolarHBondContact O-N 3.48Å; D80-A82 VanDerWaalsContact OD1-CB 3.23Å; D80-A82 WeakPolarHBondContact OD1-CB 3.31Å; D80-A82 PolarHBondContact OD1-N 3.05Å |
| 83 | V | 67.8 | Low | 63.9 | Low | 87 Ų | 87 | 105 Ų | 105 | 53% | 0.527 | 65% | 0.652 | S | S | . | * | S | Bend | trans | -97.7 | 100.7 | 177.9 | 179.7 | 0 | 0 | 0 | 0 | 108.8 | D80 I85 | D80-V83 HydrophobicContact CB-CB 4.29Å; D80-V83 HydrophobicContact CB-CG2 3.87Å; D80-V83 PolarHBondContact O-N 3.26Å; V83-I85 PolarHBondContact O-N 3.26Å |
| 84 | S | 65.9 | Low | 63.6 | Low | 87 Ų | 87 | 99.9 Ų | 99.9 | 61% | 0.608 | 65% | 0.65 | S | S | * | * | | | trans | -69 | 102 | 170.6 | -168.9 | 0 | 0 | 0 | 0 | 109.4 | V86 | S84-V86 PolarHBondContact O-N 3.14Å; S84-V86 PolarHBondContact OG-O 3.44Å |
| 85 | I | 72.4 | Confident | 62.6 | Low | 121 Ų | 121 | 101.3 Ų | 101.3 | 62% | 0.621 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -66.3 | -27.2 | 171.2 | -40.3 | 167.3 | 0 | 0 | 0 | 110.3 | Q79 V83 | Q79-I85 HydrophobicContact CG-CD1 4.41Å; V83-I85 PolarHBondContact O-N 3.26Å |
| 86 | V | 67.9 | Low | 61.7 | Low | 70 Ų | 70 | 103.7 Ų | 103.7 | 42% | 0.424 | 67% | 0.671 | S | S | . | * | S | Bend | trans | -79.3 | 126.4 | 174 | -175.8 | 0 | 0 | 0 | 0 | 107.4 | S84 S88 V90 | S84-V86 PolarHBondContact O-N 3.14Å; S84-V86 PolarHBondContact OG-O 3.44Å; V86-S88 PolarHBondContact O-N 3.33Å; V86-V90 WeakPolarHBondContact CG1-O 3.41Å |
| 87 | P | 69.5 | Low | 60.7 | Low | 89 Ų | 89 | 109 Ų | 109 | 58% | 0.578 | 69% | 0.687 | S | S | * | * | | | trans | -58 | 131.3 | 173.4 | -12.3 | 22.7 | 0 | 0 | 0 | 108.8 | G89 V90 | P87-G89 VanDerWaalsContact C-N 3.28Å; P87-G89 PolarHBondContact O-N 3.15Å; P87-V90 HydrophobicContact CB-CG2 3.86Å; P87-V90 HydrophobicContact CG-CG2 3.92Å; P87-V90 PolarHBondContact O-N 3.42Å; P87-V90 VanDerWaalsContact O-N 3.1Å |
| 88 | S | 63.4 | Low | 60.1 | Low | 127 Ų | 127 | 109.2 Ų | 109.2 | 89% | 0.888 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | 88 | 179.4 | 53.8 | 0 | 0 | 0 | 0 | 109.7 | V86 | V86-S88 PolarHBondContact O-N 3.33Š|
| 89 | G | 62.4 | Low | 59.3 | Low | 79 Ų | 79 | 112.9 Ų | 112.9 | 81% | 0.814 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 146.2 | -9.9 | -174.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | P87 | P87-G89 VanDerWaalsContact C-N 3.28Å; P87-G89 PolarHBondContact O-N 3.15Å |
| 90 | V | 53.7 | Low | 58.1 | Low | 92 Ų | 92 | 114.4 Ų | 114.4 | 56% | 0.558 | 71% | 0.711 | S | S | * | * | | | trans | -109 | 112 | 179.9 | -149.9 | 0 | 0 | 0 | 0 | 110.6 | V86 P87 G92 | V86-V90 WeakPolarHBondContact CG1-O 3.41Å; P87-V90 HydrophobicContact CB-CG2 3.86Å; P87-V90 HydrophobicContact CG-CG2 3.92Å; P87-V90 PolarHBondContact O-N 3.42Å; P87-V90 VanDerWaalsContact O-N 3.1Å; V90-G92 PolarHBondContact O-N 3.28Å |
| 91 | S | 54.6 | Low | 56.5 | Low | 124 Ų | 124 | 115.8 Ų | 115.8 | 87% | 0.867 | 72% | 0.723 | S | S | * | * | | | trans | -77.5 | 112.1 | 172.7 | -174.9 | 0 | 0 | 0 | 0 | 109.7 | | |
| 92 | G | 49.9 | Very low | 55.2 | Low | 41 Ų | 41 | 118.1 Ų | 118.1 | 42% | 0.423 | 72% | 0.719 | S | S | . | * | | | trans | 156.6 | 111.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | V90 | V90-G92 PolarHBondContact O-N 3.28Š|
| 93 | W | 57.6 | Low | 53.7 | Low | 273 Ų | 273 | 121.6 Ų | 121.6 | 100% | 1.034 | 73% | 0.726 | S | S | * | * | S | Bend | | -145.6 | 22.2 | 71.9 | -75.7 | 89.2 | 0 | 0 | 0 | 113.8 | | |
| 94 | G | 54.8 | Low | 52.2 | Low | 72 Ų | 72 | 121.8 Ų | 121.8 | 74% | 0.742 | 74% | 0.737 | S | S | * | * | | | trans | -171.7 | 89.2 | -176.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q96 | G94-Q96 PolarHBondContact O-N 3.19Š|
| 95 | S | 44.2 | Very low | 51.1 | Low | 106 Ų | 106 | 122.6 Ų | 122.6 | 74% | 0.741 | 74% | 0.74 | S | S | * | * | | | trans | -65.2 | 126.9 | 175.3 | -5.5 | 0 | 0 | 0 | 0 | 110.4 | | |
| 96 | Q | 47.1 | Very low | 49.5 | Very low | 177 Ų | 177 | 124.4 Ų | 124.4 | 83% | 0.827 | 75% | 0.75 | S | S | * | * | | | trans | -131.5 | 121.4 | 140 | -74.4 | -67.5 | 10.9 | 0 | 0 | 107.7 | G94 A98 | G94-Q96 PolarHBondContact O-N 3.19Å; Q96-A98 PolarHBondContact O-N 3.5Å |
| 97 | Q | 39.2 | Very low | 48.1 | Very low | 187 Ų | 187 | 127.7 Ų | 127.7 | 87% | 0.874 | 77% | 0.771 | S | S | * | * | | | trans | -56.2 | 123.4 | 174.5 | -68.8 | 156 | -24.4 | 0 | 0 | 108.6 | | |
| 98 | A | 47.7 | Very low | 46.7 | Very low | 94 Ų | 94 | 130.5 Ų | 130.5 | 78% | 0.777 | 79% | 0.786 | S | S | * | * | | | trans | -115.7 | 120.3 | 165.1 | 0 | 0 | 0 | 0 | 0 | 107.4 | Q96 | Q96-A98 PolarHBondContact O-N 3.5Š|
| 99 | D | 46.3 | Very low | 45.5 | Very low | 144 Ų | 144 | 127.2 Ų | 127.2 | 77% | 0.77 | 77% | 0.772 | S | S | * | * | | | trans | -50.3 | 136.4 | -172 | -61 | -72.1 | 0 | 0 | 0 | 114 | T101 | D99-T101 PolarHBondContact O-N 3.24Å; D99-T101 VanDerWaalsContact O-N 3.11Å |
| 100 | P | 42.8 | Very low | 44.3 | Very low | 129 Ų | 129 | 132.5 Ų | 132.5 | 84% | 0.838 | 78% | 0.776 | S | S | * | * | | | trans | -86.3 | 84.2 | 176.5 | 34.7 | -30 | 0 | 0 | 0 | 109 | | |
| 101 | T | 38.8 | Very low | 43.5 | Very low | 115 Ų | 115 | 139.7 Ų | 139.7 | 71% | 0.706 | 79% | 0.793 | S | S | * | * | | | trans | -137.8 | 126.9 | 160.5 | 62.8 | 0 | 0 | 0 | 0 | 111.5 | D99 | D99-T101 PolarHBondContact O-N 3.24Å; D99-T101 VanDerWaalsContact O-N 3.11Å |
| 102 | K | 42.7 | Very low | 42.8 | Very low | 183 Ų | 183 | 137.9 Ų | 137.9 | 80% | 0.796 | 79% | 0.785 | S | S | * | * | S | Bend | trans | 97.1 | 86.7 | 164.9 | -54.8 | 179.3 | -176.2 | 175.8 | 0 | 117.1 | | |
| 103 | N | 38.8 | Very low | 42.5 | Very low | 157 Ų | 157 | 141.4 Ų | 141.4 | 84% | 0.84 | 80% | 0.8 | S | S | * | * | | | | 70.9 | 102.9 | 126.4 | -54.1 | 0.9 | 0 | 0 | 0 | 118.5 | | |
| 104 | A | 35.9 | Very low | 41.8 | Very low | 91 Ų | 91 | 138.2 Ų | 138.2 | 75% | 0.752 | 80% | 0.797 | S | S | * | * | | | trans | -72.6 | 179.2 | 153.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | | |
| 105 | P | 42.4 | Very low | 41.2 | Very low | 104 Ų | 104 | 140.1 Ų | 140.1 | 68% | 0.675 | 80% | 0.799 | S | S | * | * | | | cis | -142.9 | 178.2 | 1.1 | 46.8 | -29.3 | 0 | 0 | 0 | 114.6 | | |
| 106 | L | 39.1 | Very low | 41.4 | Very low | 159 Ų | 159 | 140.5 Ų | 140.5 | 83% | 0.832 | 80% | 0.799 | S | S | * | * | | | trans | 59.5 | 129 | 157.5 | -45.3 | 174.7 | 0 | 0 | 0 | 118.9 | | |
| 107 | T | 40.3 | Very low | 41.4 | Very low | 139 Ų | 139 | 137.4 Ų | 137.4 | 85% | 0.853 | 79% | 0.794 | S | S | * | * | | | | 165.7 | 117.5 | 123 | -70.5 | 0 | 0 | 0 | 0 | 111.5 | | |
| 108 | V | 38.8 | Very low | 41.8 | Very low | 147 Ų | 147 | 138.3 Ų | 138.3 | 89% | 0.891 | 80% | 0.796 | S | S | * | * | | | trans | -61.2 | 130 | 159.3 | 167.4 | 0 | 0 | 0 | 0 | 109 | | |
| 109 | G | 39.1 | Very low | 42.1 | Very low | 59 Ų | 59 | 139.5 Ų | 139.5 | 61% | 0.608 | 80% | 0.796 | S | S | * | * | | | trans | 154.8 | 96.6 | 165.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | | |
| 110 | Q | 35.7 | Very low | 42.4 | Very low | 190 Ų | 190 | 137.4 Ų | 137.4 | 89% | 0.888 | 79% | 0.79 | S | S | * | * | | | | 42.7 | 121.7 | 126.9 | -70 | 177.2 | -42.3 | 0 | 0 | 120.2 | | |
| 111 | R | 38.5 | Very low | 42.6 | Very low | 243 Ų | 243 | 137.1 Ų | 137.1 | 92% | 0.917 | 79% | 0.786 | S | S | * | * | | | | 123.4 | 107.9 | 121.9 | -157.2 | 176.2 | -102.6 | -162.4 | -4.1 | 114.1 | | |
| 112 | A | 38.5 | Very low | 43 | Very low | 85 Ų | 85 | 142.4 Ų | 142.4 | 70% | 0.702 | 79% | 0.794 | S | S | * | * | | | trans | -74.7 | -167.5 | 165.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 113 | P | 43.9 | Very low | 43.1 | Very low | 115 Ų | 115 | 138.9 Ų | 138.9 | 75% | 0.747 | 79% | 0.788 | S | S | * | * | | | cis | -138.1 | 136.6 | -18.3 | 32.6 | -14 | 0 | 0 | 0 | 113.4 | | |
| 114 | Q | 43.7 | Very low | 43.2 | Very low | 206 Ų | 206 | 140.5 Ų | 140.5 | 96% | 0.963 | 79% | 0.793 | S | S | * | * | | | trans | -149.3 | 103.7 | 164.6 | -61.5 | -171.8 | 60.8 | 0 | 0 | 112.2 | | |
| 115 | S | 41.4 | Very low | 43.4 | Very low | 112 Ų | 112 | 147.1 Ų | 147.1 | 78% | 0.783 | 80% | 0.799 | S | S | * | * | | | trans | -78.4 | 175.2 | 157 | 56.9 | 0 | 0 | 0 | 0 | 110.1 | | |
| 116 | P | 49.4 | Very low | 43.3 | Very low | 115 Ų | 115 | 149.2 Ų | 149.2 | 75% | 0.747 | 80% | 0.804 | S | S | * | * | | | cis | -141.4 | -151.3 | 13.7 | 40.2 | -15.6 | 0 | 0 | 0 | 111.1 | | |
| 117 | P | 47.4 | Very low | 43.7 | Very low | 111 Ų | 111 | 146.3 Ų | 146.3 | 72% | 0.721 | 80% | 0.803 | S | S | * | * | | | cis | -127.1 | 164.1 | -8.3 | 38.1 | -18.8 | 0 | 0 | 0 | 115.5 | | |
| 118 | F | 46.3 | Very low | 44.2 | Very low | 207 Ų | 207 | 147 Ų | 147 | 91% | 0.908 | 80% | 0.797 | S | S | * | * | | | trans | -58.1 | 153.1 | 177.3 | -61.4 | -87.1 | 0 | 0 | 0 | 113.9 | | |
| 119 | P | 55.6 | Low | 45.1 | Very low | 119 Ų | 119 | 145.2 Ų | 145.2 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | | | | -140.7 | 175.4 | 129.5 | 42.5 | -29.8 | 0 | 0 | 0 | 112.9 | | |
| 120 | P | 51.6 | Low | 45.6 | Very low | 99 Ų | 99 | 146.9 Ų | 146.9 | 64% | 0.643 | 79% | 0.788 | S | S | * | * | | | | -87 | 162 | -102.8 | 26.5 | -6.5 | 0 | 0 | 0 | 114.9 | Y122 | P120-Y122 PolarHBondContact O-N 3.45Š|
| 121 | T | 48 | Very low | 45.9 | Very low | 124 Ų | 124 | 146.6 Ų | 146.6 | 76% | 0.761 | 78% | 0.784 | S | S | * | * | | | trans | -37.8 | 120.8 | 163.3 | 46 | 0 | 0 | 0 | 0 | 114.2 | T123 | T121-T123 PolarHBondContact O-N 3.11Å; T121-T123 VanDerWaalsContact O-N 3.15Å |
| 122 | Y | 46.3 | Very low | 46.2 | Very low | 225 Ų | 225 | 142.8 Ų | 142.8 | 88% | 0.882 | 78% | 0.782 | S | S | * | * | | | trans | -77.9 | 92.9 | 156.4 | -60.2 | -79.7 | 0 | 0 | 0 | 107.9 | P120 M124 | P120-Y122 PolarHBondContact O-N 3.45Å; Y122-M124 PolarHBondContact O-N 3.34Å |
| 123 | T | 45.6 | Very low | 46.4 | Very low | 109 Ų | 109 | 142.9 Ų | 142.9 | 67% | 0.669 | 78% | 0.783 | S | S | * | * | | | trans | -60.1 | 121.1 | 165.9 | 50.7 | 0 | 0 | 0 | 0 | 108.6 | T121 R125 | T121-T123 PolarHBondContact O-N 3.11Å; T121-T123 VanDerWaalsContact O-N 3.15Å; T123-R125 VanDerWaalsContact C-N 3.27Å; T123-R125 PolarHBondContact O-N 2.86Å |
| 124 | M | 41.1 | Very low | 46.2 | Very low | 191 Ų | 191 | 143 Ų | 143 | 94% | 0.941 | 79% | 0.787 | S | S | * | * | | | trans | -57.5 | 91.6 | 164.3 | -76.8 | -76.8 | 168.7 | 0 | 0 | 108.4 | Y122 N126 | Y122-M124 PolarHBondContact O-N 3.34Å; M124-N126 PolarHBondContact O-N 3.3Å |
| 125 | R | 39.3 | Very low | 46.2 | Very low | 230 Ų | 230 | 139.2 Ų | 139.2 | 87% | 0.868 | 78% | 0.78 | S | S | * | * | | | trans | -86 | 103.4 | 176.6 | -149.8 | 178.8 | -144.7 | -173.3 | 6.1 | 107.4 | T123 A127 | T123-R125 VanDerWaalsContact C-N 3.27Å; T123-R125 PolarHBondContact O-N 2.86Å; R125-A127 PolarHBondContact O-N 3.37Å |
| 126 | N | 39.7 | Very low | 46.1 | Very low | 148 Ų | 148 | 136.1 Ų | 136.1 | 79% | 0.791 | 77% | 0.766 | S | S | * | * | | | trans | -37.2 | 101.6 | 158.6 | -99.4 | 19.8 | 0 | 0 | 0 | 110 | M124 Q128 | M124-N126 PolarHBondContact O-N 3.3Å; N126-Q128 PolarHBondContact O-N 3.5Å |
| 127 | A | 47.6 | Very low | 46 | Very low | 98 Ų | 98 | 141 Ų | 141 | 81% | 0.81 | 77% | 0.771 | S | S | * | * | | | trans | -95.5 | 78.2 | 166.2 | 0 | 0 | 0 | 0 | 0 | 107.5 | R125 | R125-A127 PolarHBondContact O-N 3.37Š|
| 128 | Q | 50.6 | Low | 45.8 | Very low | 154 Ų | 154 | 144.6 Ų | 144.6 | 72% | 0.72 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 125.3 | 168 | -163.7 | 170.4 | -18.8 | 0 | 0 | 108.1 | N126 | N126-Q128 PolarHBondContact O-N 3.5Š|
| 129 | P | 58.9 | Low | 45.5 | Very low | 110 Ų | 110 | 143.6 Ų | 143.6 | 71% | 0.714 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 140.4 | 169.3 | 26.5 | -29.9 | 0 | 0 | 0 | 109.4 | F131 | P129-F131 PolarHBondContact O-N 3.17Š|
| 130 | P | 49.8 | Very low | 44.7 | Very low | 93 Ų | 93 | 144.3 Ų | 144.3 | 60% | 0.604 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 124 | -177 | 26.3 | -32.6 | 0 | 0 | 0 | 110.7 | N132 | P130-N132 PolarHBondContact O-N 3.12Š|
| 131 | F | 41.1 | Very low | 44.3 | Very low | 185 Ų | 185 | 144.3 Ų | 144.3 | 81% | 0.811 | 78% | 0.781 | S | S | * | * | | | trans | 1 | 105.7 | 142.7 | 25.9 | -91.6 | 0 | 0 | 0 | 114.6 | P129 | P129-F131 PolarHBondContact O-N 3.17Š|
| 132 | N | 44.7 | Very low | 44.2 | Very low | 163 Ų | 163 | 145.4 Ų | 145.4 | 87% | 0.872 | 78% | 0.782 | S | S | * | * | | | trans | -122.1 | 129 | 148.4 | -160.8 | 11.3 | 0 | 0 | 0 | 108.8 | P130 | P130-N132 PolarHBondContact O-N 3.12Š|
| 133 | A | 43 | Very low | 44.2 | Very low | 86 Ų | 86 | 144.6 Ų | 144.6 | 71% | 0.711 | 78% | 0.778 | S | S | * | * | | | trans | -78.7 | 133.3 | -163.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 134 | S | 39.7 | Very low | 44.9 | Very low | 119 Ų | 119 | 145 Ų | 145 | 83% | 0.832 | 78% | 0.783 | S | S | * | * | | | | 172 | 154 | 127.6 | -94.5 | 0 | 0 | 0 | 0 | 113.1 | | |
| 135 | P | 43.3 | Very low | 45.3 | Very low | 125 Ų | 125 | 140.1 Ų | 140.1 | 81% | 0.812 | 77% | 0.773 | S | S | * | * | | | trans | -103.9 | 152.9 | -137.5 | 37.9 | -32.1 | 0 | 0 | 0 | 113.4 | | |
| 136 | G | 40.2 | Very low | 45.8 | Very low | 48 Ų | 48 | 137 Ų | 137 | 50% | 0.495 | 77% | 0.773 | S | S | . | * | | | trans | 176.4 | 76.2 | 169.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | | |
| 137 | Y | 45.8 | Very low | 46.5 | Very low | 218 Ų | 218 | 136.1 Ų | 136.1 | 86% | 0.855 | 77% | 0.773 | S | S | * | * | | | trans | 48.3 | 99.6 | 148 | -48.5 | -79.7 | 0 | 0 | 0 | 119.4 | | |
| 138 | H | 44.7 | Very low | 47.2 | Very low | 185 Ų | 185 | 138.7 Ų | 138.7 | 86% | 0.856 | 77% | 0.772 | S | S | * | * | | | trans | -129.8 | 103.7 | 146 | -43.1 | -63.6 | 0 | 0 | 0 | 108.9 | | |
| 139 | Q | 39.1 | Very low | 47.8 | Very low | 187 Ų | 187 | 136.5 Ų | 136.5 | 87% | 0.874 | 77% | 0.771 | S | S | * | * | | | trans | -67.7 | 137.4 | 172.1 | -76.5 | -178.7 | 20.2 | 0 | 0 | 110.5 | | |
| 140 | T | 38 | Very low | 47.8 | Very low | 134 Ų | 134 | 137.1 Ų | 137.1 | 82% | 0.822 | 78% | 0.775 | S | S | * | * | | | trans | -70 | 133.2 | 171.8 | 55.1 | 0 | 0 | 0 | 0 | 110.8 | | |
| 141 | S | 44.8 | Very low | 48 | Very low | 99 Ų | 99 | 137.6 Ų | 137.6 | 69% | 0.692 | 79% | 0.787 | S | S | * | * | | | trans | -134.4 | 108.9 | 156.4 | -172.5 | 0 | 0 | 0 | 0 | 109.8 | | |
| 142 | N | 44.6 | Very low | 48.7 | Very low | 146 Ų | 146 | 137.8 Ų | 137.8 | 78% | 0.781 | 79% | 0.79 | S | S | * | * | | | trans | -54.4 | 139 | 170.4 | -79.2 | -30.4 | 0 | 0 | 0 | 112.5 | | |
| 143 | Y | 46.9 | Very low | 48.5 | Very low | 208 Ų | 208 | 141.4 Ų | 141.4 | 82% | 0.816 | 79% | 0.793 | S | S | * | * | | | trans | -137.1 | 131.1 | 142.8 | -70.4 | -77.1 | 0 | 0 | 0 | 108.6 | | |
| 144 | P | 59.6 | Low | 48.8 | Very low | 117 Ų | 117 | 144.1 Ų | 144.1 | 76% | 0.76 | 80% | 0.801 | S | S | * | * | | | trans | -75.3 | 134.5 | -176.3 | 30.2 | -33 | 0 | 0 | 0 | 111 | L146 | P144-L146 PolarHBondContact O-N 3.16Š|
| 145 | A | 49.7 | Very low | 49.2 | Very low | 89 Ų | 89 | 141.4 Ų | 141.4 | 74% | 0.736 | 79% | 0.792 | S | S | * | * | | | trans | -66.3 | 125.8 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | T147 | A145-T147 PolarHBondContact O-N 3.1Å; A145-T147 VanDerWaalsContact O-N 3.1Å |
| 146 | L | 50.8 | Low | 49.3 | Very low | 166 Ų | 166 | 145 Ų | 145 | 87% | 0.869 | 80% | 0.798 | S | S | * | * | | | trans | -73.8 | 94.2 | 168.5 | -68.8 | 172.4 | 0 | 0 | 0 | 108.7 | P144 L148 | P144-L146 PolarHBondContact O-N 3.16Å; L146-L148 PolarHBondContact O-N 3.26Å |
| 147 | T | 54 | Low | 49.5 | Very low | 128 Ų | 128 | 146.1 Ų | 146.1 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | | | trans | -79 | 110.1 | 167.5 | -57.3 | 0 | 0 | 0 | 0 | 108.7 | A145 | A145-T147 PolarHBondContact O-N 3.1Å; A145-T147 VanDerWaalsContact O-N 3.1Å |
| 148 | L | 63 | Low | 49.9 | Very low | 152 Ų | 152 | 144.5 Ų | 144.5 | 80% | 0.796 | 81% | 0.812 | S | S | * | * | | | trans | -75.6 | 141.7 | 166.1 | -84 | 91.9 | 0 | 0 | 0 | 110.1 | L146 | L146-L148 PolarHBondContact O-N 3.26Š|
| 149 | P | 62.6 | Low | 50.2 | Low | 109 Ų | 109 | 138.8 Ų | 138.8 | 71% | 0.708 | 79% | 0.791 | S | S | * | * | | | trans | -77 | 150.1 | 179.2 | 31.7 | -33.9 | 0 | 0 | 0 | 111.8 | A151 | P149-A151 PolarHBondContact O-N 3.41Š|
| 150 | P | 58.1 | Low | 50.4 | Low | 122 Ų | 122 | 140.4 Ų | 140.4 | 79% | 0.792 | 79% | 0.791 | S | S | * | * | | | trans | -70.6 | 113.7 | 169.1 | 28.7 | -31.1 | 0 | 0 | 0 | 109.5 | | |
| 151 | A | 54.5 | Low | 51.1 | Low | 103 Ų | 103 | 141.4 Ų | 141.4 | 85% | 0.851 | 79% | 0.79 | S | S | * | * | | | trans | -69 | 130.8 | 169.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | P149 | P149-A151 PolarHBondContact O-N 3.41Š|
| 152 | Q | 55.9 | Low | 51 | Low | 189 Ų | 189 | 145.3 Ų | 145.3 | 88% | 0.883 | 80% | 0.797 | S | S | * | * | | | trans | -73.8 | 143.8 | -169.3 | -62.3 | 170.5 | -81.4 | 0 | 0 | 112.3 | | |
| 153 | Y | 41.1 | Very low | 51.4 | Low | 239 Ų | 239 | 149.8 Ų | 149.8 | 94% | 0.937 | 80% | 0.804 | S | S | * | * | | | trans | -86.2 | 101.6 | 178.5 | -142.4 | -88 | 0 | 0 | 0 | 109.4 | | |
| 154 | V | 49.6 | Very low | 51.8 | Low | 144 Ų | 144 | 145.4 Ų | 145.4 | 87% | 0.873 | 80% | 0.799 | S | S | * | * | | | trans | -156.2 | 132.7 | 163.8 | -171.3 | 0 | 0 | 0 | 0 | 110.6 | | |
| 155 | G | 46.5 | Very low | 52 | Low | 62 Ų | 62 | 148.5 Ų | 148.5 | 64% | 0.639 | 81% | 0.805 | S | S | * | * | | | trans | 119.1 | 81.4 | 161.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | | |
| 156 | Q | 46 | Very low | 52.8 | Low | 200 Ų | 200 | 149.4 Ų | 149.4 | 94% | 0.935 | 80% | 0.803 | S | S | * | * | | | | 56.9 | 111.1 | 98.1 | -71.5 | -154.7 | 16.8 | 0 | 0 | 115.6 | | |
| 157 | G | 45 | Very low | 53.3 | Low | 71 Ų | 71 | 147.4 Ų | 147.4 | 73% | 0.732 | 80% | 0.801 | S | S | * | * | | | trans | 75.9 | 121.1 | 144.5 | 0 | 0 | 0 | 0 | 0 | 117.1 | | |
| 158 | M | 53.4 | Low | 53.8 | Low | 184 Ų | 184 | 152.1 Ų | 152.1 | 91% | 0.906 | 80% | 0.804 | S | S | * | * | | | | 166 | 153.6 | 118.4 | -82.9 | -51.3 | -107.6 | 0 | 0 | 110.9 | | |
| 159 | P | 50.4 | Low | 53.4 | Low | 66 Ų | 66 | 151.5 Ų | 151.5 | 43% | 0.429 | 80% | 0.801 | S | S | . | * | | | trans | -89.8 | 165 | -144.2 | 35.1 | -35 | 0 | 0 | 0 | 113.8 | L161 | P159-L161 PolarHBondContact O-N 3.48Š|
| 160 | Y | 44.3 | Very low | 52.6 | Low | 221 Ų | 221 | 154 Ų | 154 | 87% | 0.867 | 81% | 0.808 | S | S | * | * | | | trans | -26.5 | 103.6 | 161.5 | 36 | -89.1 | 0 | 0 | 0 | 113 | | |
| 161 | L | 52.6 | Low | 52.2 | Low | 155 Ų | 155 | 155.5 Ų | 155.5 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | | | trans | -98.7 | 107.5 | 163.7 | -72.7 | -179.7 | 0 | 0 | 0 | 108.8 | P159 R163 | P159-L161 PolarHBondContact O-N 3.48Å; L161-R163 PolarHBondContact O-N 3.45Å |
| 162 | Q | 43.6 | Very low | 51.6 | Low | 180 Ų | 180 | 161 Ų | 161 | 84% | 0.841 | 80% | 0.801 | S | S | * | * | | | trans | -44.5 | 107.8 | 154.6 | -85.4 | 170.6 | -6.2 | 0 | 0 | 108.8 | T164 | Q162-T164 PolarHBondContact O-N 3.31Š|
| 163 | R | 51.8 | Low | 51 | Low | 241 Ų | 241 | 156.1 Ų | 156.1 | 91% | 0.909 | 79% | 0.788 | S | S | * | * | | | trans | -84.7 | 92.1 | 161.5 | -82.3 | -175.1 | -163.8 | -99.9 | -1.2 | 108 | L161 | L161-R163 PolarHBondContact O-N 3.45Š|
| 164 | T | 54.6 | Low | 51.5 | Low | 116 Ų | 116 | 153.4 Ų | 153.4 | 71% | 0.712 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -57 | 128.3 | 158.4 | 55.6 | 0 | 0 | 0 | 0 | 108.8 | Q162 | Q162-T164 PolarHBondContact O-N 3.31Š|
| 165 | M | 65.5 | Low | 51.5 | Low | 181 Ų | 181 | 152.8 Ų | 152.8 | 89% | 0.892 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 142.8 | 174.4 | -73 | -164.3 | 156.3 | 0 | 0 | 110.9 | | |
| 166 | P | 64.9 | Low | 51.6 | Low | 108 Ų | 108 | 155 Ų | 155 | 70% | 0.701 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -72 | 150.7 | 179.8 | 29.8 | -33.4 | 0 | 0 | 0 | 111.7 | W168 | P166-W168 PolarHBondContact O-N 3.23Š|
| 167 | P | 62 | Low | 51.6 | Low | 125 Ų | 125 | 151.3 Ų | 151.3 | 81% | 0.812 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 117.1 | 177.4 | 31.7 | -29.6 | 0 | 0 | 0 | 108.6 | D169 | P167-D169 PolarHBondContact O-N 3.46Š|
| 168 | W | 65.3 | Low | 51.7 | Low | 226 Ų | 226 | 152.3 Ų | 152.3 | 86% | 0.856 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 120.5 | 168 | 42.9 | -87.4 | 0 | 0 | 0 | 108.9 | P166 L170 | P166-W168 PolarHBondContact O-N 3.23Å; W168-L170 PolarHBondContact O-N 3.18Å |
| 169 | D | 54 | Low | 51.5 | Low | 139 Ų | 139 | 148.6 Ų | 148.6 | 74% | 0.743 | 76% | 0.764 | S | S | * | * | | | trans | -38.7 | 118.5 | -174 | -108.9 | -53.4 | 0 | 0 | 0 | 115.9 | P167 K171 | P167-D169 PolarHBondContact O-N 3.46Å; D169-K171 PolarHBondContact O-N 2.87Å |
| 170 | L | 45.1 | Very low | 51.2 | Low | 163 Ų | 163 | 152 Ų | 152 | 85% | 0.853 | 78% | 0.777 | S | S | * | * | | | trans | -91.3 | 86.5 | 163.4 | -133.2 | 77.7 | 0 | 0 | 0 | 108.2 | W168 | W168-L170 PolarHBondContact O-N 3.18Š|
| 171 | K | 50.7 | Low | 51.3 | Low | 152 Ų | 152 | 149.4 Ų | 149.4 | 66% | 0.661 | 78% | 0.778 | S | S | * | * | | | trans | -142.1 | 114.7 | 166.8 | -82.5 | -167.4 | -177.8 | 174.6 | 0 | 112.3 | D169 | D169-K171 PolarHBondContact O-N 2.87Š|
| 172 | R | 41.1 | Very low | 51.3 | Low | 218 Ų | 218 | 151.4 Ų | 151.4 | 82% | 0.823 | 78% | 0.78 | S | S | * | * | | | trans | 67.1 | 139.2 | 142.2 | -62.4 | 175.6 | -160.3 | -108.2 | -1.8 | 115.5 | | |
| 173 | S | 44.3 | Very low | 51.4 | Low | 88 Ų | 88 | 149 Ų | 149 | 62% | 0.615 | 78% | 0.779 | S | S | * | * | | | cis | -178.1 | 146.9 | 2.5 | 37.4 | 0 | 0 | 0 | 0 | 105.7 | | |
| 174 | E | 49.9 | Very low | 51.7 | Low | 181 Ų | 181 | 148.6 Ų | 148.6 | 85% | 0.846 | 78% | 0.778 | S | S | * | * | | | trans | 78.3 | 93 | 147.4 | -65.1 | 160.1 | -143.2 | 0 | 0 | 119.8 | | |
| 175 | T | 49.8 | Very low | 51.3 | Low | 131 Ų | 131 | 149.1 Ų | 149.1 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | | | trans | -50.7 | 169.6 | 138.2 | 49.9 | 0 | 0 | 0 | 0 | 112.1 | | |
| 176 | P | 49.1 | Very low | 50.5 | Low | 108 Ų | 108 | 148.7 Ų | 148.7 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | | | cis | -153.4 | 168.5 | 29.2 | 37.4 | -12.9 | 0 | 0 | 0 | 119.6 | | |
| 177 | T | 45.5 | Very low | 49.5 | Very low | 124 Ų | 124 | 147.8 Ų | 147.8 | 76% | 0.761 | 77% | 0.773 | S | S | * | * | | | trans | 57.7 | 120 | 136.9 | -58.3 | 0 | 0 | 0 | 0 | 121.8 | | |
| 178 | A | 48 | Very low | 48.9 | Very low | 92 Ų | 92 | 149.4 Ų | 149.4 | 76% | 0.76 | 77% | 0.774 | S | S | * | * | | | | -177.9 | 93.6 | 120.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 179 | T | 48.8 | Very low | 48.2 | Very low | 105 Ų | 105 | 142.3 Ų | 142.3 | 64% | 0.644 | 76% | 0.764 | S | S | * | * | | | | 44.4 | 106.2 | 106.8 | -46.4 | 0 | 0 | 0 | 0 | 120 | | |
| 180 | I | 45.5 | Very low | 47.9 | Very low | 138 Ų | 138 | 142.6 Ų | 142.6 | 71% | 0.708 | 77% | 0.765 | S | S | * | * | | | trans | 70.9 | 120.6 | 132.2 | -46.7 | 171.5 | 0 | 0 | 0 | 119.9 | | |
| 181 | L | 46 | Very low | 48.5 | Very low | 167 Ų | 167 | 143 Ų | 143 | 87% | 0.874 | 77% | 0.768 | S | S | * | * | | | | 158.4 | 140.8 | 112.1 | -99.3 | 123.1 | 0 | 0 | 0 | 113.9 | | |
| 182 | K | 51.4 | Low | 48.3 | Very low | 197 Ų | 197 | 147.7 Ų | 147.7 | 86% | 0.857 | 78% | 0.782 | S | S | * | * | | | trans | -74.3 | 167.6 | -178.3 | -93.4 | 172.5 | 178.7 | 173 | 0 | 114.2 | | |
| 183 | P | 47.2 | Very low | 48.7 | Very low | 128 Ų | 128 | 142.7 Ų | 142.7 | 83% | 0.831 | 78% | 0.78 | S | S | * | * | | | trans | -89.7 | 156.2 | -162.2 | 36.2 | -34.3 | 0 | 0 | 0 | 114.7 | | |
| 184 | R | 57.9 | Low | 49.1 | Very low | 234 Ų | 234 | 143.6 Ų | 143.6 | 88% | 0.883 | 79% | 0.786 | S | S | * | * | | | trans | -148.4 | 114.5 | 175 | -171.7 | 171.9 | -178.7 | 119 | -1.8 | 113.9 | | |
| 185 | N | 45.1 | Very low | 49.1 | Very low | 127 Ų | 127 | 144.7 Ų | 144.7 | 68% | 0.679 | 79% | 0.788 | S | S | * | * | | | trans | 35.6 | 134.9 | 140.2 | -79.1 | -36.1 | 0 | 0 | 0 | 124.6 | | |
| 186 | Q | 48.8 | Very low | 49 | Very low | 172 Ų | 172 | 144.4 Ų | 144.4 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | | | | 89.3 | 115.7 | 127.8 | -79.3 | 169.1 | 10.7 | 0 | 0 | 122.1 | | |
| 187 | A | 43.5 | Very low | 48.9 | Very low | 88 Ų | 88 | 147.3 Ų | 147.3 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | | | | 98.2 | 152.1 | 117.3 | 0 | 0 | 0 | 0 | 0 | 121 | | |
| 188 | I | 50.2 | Low | 48.9 | Very low | 159 Ų | 159 | 147.2 Ų | 147.2 | 82% | 0.815 | 81% | 0.805 | S | S | * | * | | | trans | 99.4 | 91.7 | 154.2 | -46.4 | 177.3 | 0 | 0 | 0 | 117.2 | | |
| 189 | A | 50.4 | Low | 48.8 | Very low | 78 Ų | 78 | 149 Ų | 149 | 65% | 0.645 | 81% | 0.807 | S | S | * | * | | | | 39.6 | 147 | 118.9 | 0 | 0 | 0 | 0 | 0 | 123.4 | | |
| 190 | D | 48.6 | Very low | 48.7 | Very low | 144 Ų | 144 | 149 Ų | 149 | 77% | 0.77 | 82% | 0.817 | S | S | * | * | | | trans | 93.9 | 110.1 | 149.7 | -57.4 | -28.5 | 0 | 0 | 0 | 120 | | |
| 191 | N | 56.1 | Low | 48.7 | Very low | 173 Ų | 173 | 151.4 Ų | 151.4 | 93% | 0.925 | 83% | 0.825 | S | S | * | * | | | trans | -155.4 | 103.4 | 135.3 | -102.5 | -53 | 0 | 0 | 0 | 111.3 | | |
| 192 | R | 48.2 | Very low | 48.7 | Very low | 250 Ų | 250 | 152.8 Ų | 152.8 | 94% | 0.943 | 83% | 0.827 | S | S | * | * | | | trans | -97.8 | 122.8 | 162.6 | -86 | -178.3 | -178.6 | 175.5 | 2.1 | 108.6 | | |
| 193 | S | 48.1 | Very low | 48.4 | Very low | 113 Ų | 113 | 149 Ų | 149 | 79% | 0.79 | 83% | 0.825 | S | S | * | * | | | trans | -177.7 | 137.6 | 154.7 | -155.2 | 0 | 0 | 0 | 0 | 105.6 | | |
| 194 | S | 53.1 | Low | 48.4 | Very low | 107 Ų | 107 | 146.4 Ų | 146.4 | 75% | 0.748 | 82% | 0.821 | S | S | * | * | | | cis | -161.7 | 154.3 | 14.4 | -20.4 | 0 | 0 | 0 | 0 | 107.3 | | |
| 195 | K | 50.3 | Low | 47.8 | Very low | 203 Ų | 203 | 147 Ų | 147 | 88% | 0.883 | 82% | 0.824 | S | S | * | * | | | trans | -73.3 | 142.9 | 174.1 | -64 | 167.1 | 176.4 | 175.7 | 0 | 111.1 | | |
| 196 | S | 47.5 | Very low | 47.9 | Very low | 125 Ų | 125 | 148.2 Ų | 148.2 | 87% | 0.874 | 83% | 0.83 | S | S | * | * | | | trans | -148.6 | 123.3 | 142.8 | 58.3 | 0 | 0 | 0 | 0 | 110.2 | | |
| 197 | L | 47.8 | Very low | 47.7 | Very low | 169 Ų | 169 | 149.6 Ų | 149.6 | 89% | 0.885 | 83% | 0.833 | S | S | * | * | | | trans | -101.7 | 135.5 | 170.4 | -93.2 | 136.1 | 0 | 0 | 0 | 106.8 | | |
| 198 | S | 44.2 | Very low | 47.8 | Very low | 122 Ų | 122 | 150.4 Ų | 150.4 | 85% | 0.853 | 83% | 0.834 | S | S | * | * | | | trans | -143.1 | 100.9 | 167 | 169 | 0 | 0 | 0 | 0 | 108.8 | | |
| 199 | T | 46.9 | Very low | 48 | Very low | 131 Ų | 131 | 152.2 Ų | 152.2 | 80% | 0.804 | 84% | 0.836 | S | S | * | * | | | trans | -71 | 138.9 | 167.7 | -3.4 | 0 | 0 | 0 | 0 | 110.4 | | |
| 200 | A | 45.4 | Very low | 47.6 | Very low | 103 Ų | 103 | 153.3 Ų | 153.3 | 85% | 0.851 | 85% | 0.845 | S | S | * | * | | | trans | -174.4 | 108.4 | 143.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | | |
| 201 | E | 46.2 | Very low | 47.4 | Very low | 190 Ų | 190 | 149.8 Ų | 149.8 | 89% | 0.888 | 84% | 0.842 | S | S | * | * | | | trans | -75.2 | 139.5 | 166.5 | -59.4 | 180 | 130.5 | 0 | 0 | 109.4 | | |
| 202 | H | 46.7 | Very low | 46.9 | Very low | 195 Ų | 195 | 151 Ų | 151 | 90% | 0.903 | 84% | 0.842 | S | S | * | * | | | trans | -138.4 | 111 | 158.6 | -130.9 | -22.8 | 0 | 0 | 0 | 110.3 | | |
| 203 | S | 44.2 | Very low | 46.6 | Very low | 118 Ų | 118 | 143.2 Ų | 143.2 | 83% | 0.825 | 83% | 0.831 | S | S | * | * | | | trans | -74.2 | 138.7 | 171.5 | 44.5 | 0 | 0 | 0 | 0 | 111.1 | | |
| 204 | G | 46.3 | Very low | 46.7 | Very low | 73 Ų | 73 | 146.1 Ų | 146.1 | 75% | 0.753 | 84% | 0.835 | S | S | * | * | | | trans | -173.7 | 89.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | | |
| 205 | R | 46.3 | Very low | 46.5 | Very low | 246 Ų | 246 | 146 Ų | 146 | 93% | 0.928 | 83% | 0.833 | S | S | * | * | | | trans | 60.6 | 107.1 | 145 | -67 | -176.2 | -179.1 | -140.6 | -0.1 | 121.4 | | |
| 206 | L | 46.2 | Very low | 46.4 | Very low | 154 Ų | 154 | 145.7 Ų | 145.7 | 81% | 0.806 | 84% | 0.838 | S | S | * | * | | | | -1.4 | 127.2 | 127.3 | -57.1 | 166.3 | 0 | 0 | 0 | 117.4 | | |
| 207 | F | 45.9 | Very low | 46.3 | Very low | 200 Ų | 200 | 150.2 Ų | 150.2 | 88% | 0.877 | 84% | 0.836 | S | S | * | * | | | | 179.2 | 152.7 | 98.4 | -113.7 | -90.7 | 0 | 0 | 0 | 111.6 | | |
| 208 | S | 45.2 | Very low | 46.1 | Very low | 106 Ų | 106 | 148.2 Ų | 148.2 | 74% | 0.741 | 83% | 0.826 | S | S | * | * | | | trans | -80.9 | 163.6 | -162.2 | -50.1 | 0 | 0 | 0 | 0 | 116.2 | | |
| 209 | K | 54.2 | Low | 45.8 | Very low | 197 Ų | 197 | 147.3 Ų | 147.3 | 86% | 0.857 | 82% | 0.819 | S | S | * | * | | | | 101.9 | 111.2 | 128.8 | -150.9 | 164.4 | -176 | 178.8 | 0 | 118.1 | | |
| 210 | A | 42.7 | Very low | 45.6 | Very low | 101 Ų | 101 | 146.6 Ų | 146.6 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | | | trans | 46.2 | 127.3 | 133.7 | 0 | 0 | 0 | 0 | 0 | 120.5 | | |
| 211 | G | 44.8 | Very low | 45.6 | Very low | 69 Ų | 69 | 153.7 Ų | 153.7 | 71% | 0.711 | 83% | 0.825 | S | S | * | * | | | trans | 158 | 91.3 | 163 | 0 | 0 | 0 | 0 | 0 | 108.1 | | |
| 212 | E | 44.4 | Very low | 45.7 | Very low | 198 Ų | 198 | 155.3 Ų | 155.3 | 93% | 0.925 | 82% | 0.823 | S | S | * | * | | | | 102 | 107.5 | 93.7 | -158.8 | 171 | -173 | 0 | 0 | 108.8 | | |
| 213 | A | 41.9 | Very low | 45.6 | Very low | 87 Ų | 87 | 150.5 Ų | 150.5 | 72% | 0.719 | 81% | 0.811 | S | S | * | * | | | trans | -76.2 | 137.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | | |
| 214 | M | 50.1 | Low | 45.3 | Very low | 175 Ų | 175 | 154.5 Ų | 154.5 | 86% | 0.862 | 82% | 0.816 | S | S | * | * | | | trans | -177.2 | 136.5 | 133.4 | -103.8 | 151.9 | 78.1 | 0 | 0 | 113.1 | | |
| 215 | S | 49 | Very low | 45.3 | Very low | 103 Ų | 103 | 156.2 Ų | 156.2 | 72% | 0.72 | 82% | 0.817 | S | S | * | * | | | trans | 54.8 | 101.4 | 143.2 | -67.7 | 0 | 0 | 0 | 0 | 119.3 | | |
| 216 | M | 49.2 | Very low | 44.9 | Very low | 198 Ų | 198 | 150.2 Ų | 150.2 | 98% | 0.975 | 81% | 0.813 | S | S | * | * | | | trans | -130.9 | 107.4 | 132.1 | -74.6 | -168.8 | 73.8 | 0 | 0 | 110.3 | | |
| 217 | W | 45.1 | Very low | 45.4 | Very low | 219 Ų | 219 | 148.3 Ų | 148.3 | 83% | 0.83 | 81% | 0.81 | S | S | * | * | | | trans | -75.9 | 141.2 | 172.5 | -173.4 | -5.4 | 0 | 0 | 0 | 108.9 | | |
| 218 | N | 43.5 | Very low | 45.4 | Very low | 128 Ų | 128 | 144.1 Ų | 144.1 | 68% | 0.684 | 81% | 0.805 | S | S | * | * | | | trans | 87.7 | 140.8 | 142.4 | -107 | -5.5 | 0 | 0 | 0 | 120.3 | | |
| 219 | S | 38 | Very low | 45.1 | Very low | 102 Ų | 102 | 142.9 Ų | 142.9 | 71% | 0.713 | 81% | 0.809 | S | S | * | * | | | trans | 92 | 88.2 | 152.9 | -51 | 0 | 0 | 0 | 0 | 116.9 | | |
| 220 | S | 42.7 | Very low | 44.9 | Very low | 116 Ų | 116 | 139.7 Ų | 139.7 | 81% | 0.811 | 81% | 0.806 | S | S | * | * | | | trans | -151 | 91.5 | 133.4 | -89.2 | 0 | 0 | 0 | 0 | 110.7 | R222 | S220-R222 PolarHBondContact O-N 2.75Š|
| 221 | R | 45.8 | Very low | 44.5 | Very low | 253 Ų | 253 | 140.6 Ų | 140.6 | 96% | 0.955 | 81% | 0.807 | S | S | * | * | | | trans | -66.3 | 111.1 | 148.6 | -72.5 | -170.5 | -163 | -136.6 | 6.6 | 107.5 | | |
| 222 | R | 47 | Very low | 44.5 | Very low | 223 Ų | 223 | 142.8 Ų | 142.8 | 84% | 0.842 | 81% | 0.81 | S | S | * | * | | | trans | -159 | 144.3 | 156.6 | -84.7 | -171.5 | -166.7 | -108.1 | -1.3 | 105.6 | S220 | S220-R222 PolarHBondContact O-N 2.75Š|
| 223 | S | 45.7 | Very low | 44.4 | Very low | 94 Ų | 94 | 138.4 Ų | 138.4 | 66% | 0.657 | 80% | 0.801 | S | S | * | * | | | cis | -162.7 | 135.4 | -11.6 | -86 | 0 | 0 | 0 | 0 | 103.3 | S225 | S223-S225 PolarHBondContact O-N 3.36Š|
| 224 | E | 36.9 | Very low | 44.5 | Very low | 202 Ų | 202 | 145.8 Ų | 145.8 | 94% | 0.944 | 81% | 0.81 | S | S | * | * | | | trans | -62.9 | 128.1 | 172.7 | -64 | 171.1 | 139.4 | 0 | 0 | 109.1 | | |
| 225 | S | 45.8 | Very low | 44.3 | Very low | 110 Ų | 110 | 144.8 Ų | 144.8 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | | | trans | -156.1 | 109.6 | 157 | 49.5 | 0 | 0 | 0 | 0 | 108.9 | S223 | S223-S225 PolarHBondContact O-N 3.36Š|
| 226 | S | 39.2 | Very low | 44.5 | Very low | 120 Ų | 120 | 144.8 Ų | 144.8 | 84% | 0.839 | 80% | 0.799 | S | S | * | * | | | trans | -78.9 | 139.2 | 169.5 | -55.6 | 0 | 0 | 0 | 0 | 109.9 | | |
| 227 | P | 55.8 | Low | 44.5 | Very low | 114 Ų | 114 | 139.7 Ų | 139.7 | 74% | 0.74 | 79% | 0.789 | S | S | * | * | | | trans | -104.7 | 112.7 | 154.7 | 18.3 | -1.6 | 0 | 0 | 0 | 110.3 | | |
| 228 | S | 46.7 | Very low | 44.9 | Very low | 112 Ų | 112 | 138 Ų | 138 | 78% | 0.783 | 79% | 0.787 | S | S | * | * | | | trans | 23 | 126.8 | 131.1 | 57.4 | 0 | 0 | 0 | 0 | 118.9 | | |
| 229 | G | 39.1 | Very low | 45.3 | Very low | 79 Ų | 79 | 137.1 Ų | 137.1 | 81% | 0.814 | 78% | 0.782 | S | S | * | * | | | trans | -68.2 | 156.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 230 | T | 49.2 | Very low | 45.8 | Very low | 130 Ų | 130 | 141.2 Ų | 141.2 | 80% | 0.798 | 78% | 0.784 | S | S | * | * | | | trans | -130.8 | 116.3 | 157.5 | 35.4 | 0 | 0 | 0 | 0 | 106.9 | | |
| 231 | S | 34.7 | Very low | 46.2 | Very low | 121 Ų | 121 | 142.1 Ų | 142.1 | 85% | 0.846 | 78% | 0.778 | S | S | * | * | | | trans | -66.9 | 122 | 171.6 | 59.8 | 0 | 0 | 0 | 0 | 109.9 | | |
| 232 | C | 43.9 | Very low | 46.6 | Very low | 115 Ų | 115 | 138.7 Ų | 138.7 | 78% | 0.777 | 77% | 0.767 | S | S | * | * | | | trans | -115.4 | 127.3 | 165.1 | -54.2 | 0 | 0 | 0 | 0 | 107.6 | | |
| 233 | S | 43.4 | Very low | 46.9 | Very low | 105 Ų | 105 | 135.2 Ų | 135.2 | 73% | 0.734 | 76% | 0.76 | S | S | * | * | | | trans | -58.5 | 146.9 | -162 | -52.2 | 0 | 0 | 0 | 0 | 115.9 | E235 | S233-E235 PolarHBondContact O-N 2.78Š|
| 234 | R | 43.5 | Very low | 47.2 | Very low | 242 Ų | 242 | 133.7 Ų | 133.7 | 91% | 0.913 | 75% | 0.753 | S | S | * | * | | | trans | -96.1 | 64.9 | 179.5 | -172.9 | -171.8 | -177.9 | 177.5 | 0.4 | 109.5 | | |
| 235 | E | 45.6 | Very low | 48 | Very low | 154 Ų | 154 | 129.6 Ų | 129.6 | 72% | 0.72 | 74% | 0.738 | S | S | * | * | | | trans | -148 | 114 | 171.7 | -82 | 110.9 | -179.1 | 0 | 0 | 108 | S233 | S233-E235 PolarHBondContact O-N 2.78Š|
| 236 | T | 52.8 | Low | 48.4 | Very low | 103 Ų | 103 | 129.1 Ų | 129.1 | 63% | 0.632 | 73% | 0.726 | S | S | * | * | | | trans | 162.7 | -7.6 | 159.6 | 32.6 | 0 | 0 | 0 | 0 | 113.4 | K238 | T236-K238 PolarHBondContact O-N 3.46Š|
| 237 | A | 50.1 | Low | 49 | Very low | 92 Ų | 92 | 132.6 Ų | 132.6 | 76% | 0.76 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77 | 1.2 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | | |
| 238 | K | 53.5 | Low | 49.2 | Very low | 183 Ų | 183 | 132 Ų | 132 | 80% | 0.796 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.5 | -17.3 | 179.8 | -69.6 | -176.1 | 179.2 | 178 | 0 | 113.9 | T236 | T236-K238 PolarHBondContact O-N 3.46Š|
| 239 | D | 51.2 | Low | 49.6 | Very low | 110 Ų | 110 | 132.7 Ų | 132.7 | 59% | 0.588 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | -24.4 | -173.6 | -57.6 | -35.5 | 0 | 0 | 0 | 112.8 | L241 | D239-L241 PolarHBondContact O-N 3.3Š|
| 240 | Y | 49.3 | Very low | 50.6 | Low | 188 Ų | 188 | 134.6 Ų | 134.6 | 74% | 0.737 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.3 | -15.8 | 179.8 | -72.4 | -77.7 | 0 | 0 | 0 | 114.3 | | |
| 241 | L | 51.7 | Low | 51.1 | Low | 134 Ų | 134 | 134 Ų | 134 | 70% | 0.702 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | -20 | 175.3 | -110.6 | 77.2 | 0 | 0 | 0 | 112.8 | D239 | D239-L241 PolarHBondContact O-N 3.3Š|
| 242 | Y | 52.8 | Low | 52.2 | Low | 182 Ų | 182 | 135.5 Ų | 135.5 | 71% | 0.714 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | -6.7 | -178.5 | -112.1 | -88.8 | 0 | 0 | 0 | 114.4 | N246 | Y242-N246 PolarHBondContact O-ND2 3.2Š|
| 243 | H | 53.9 | Low | 53 | Low | 150 Ų | 150 | 132.1 Ų | 132.1 | 69% | 0.694 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98 | -17.5 | 179.9 | -87.7 | -0.3 | 0 | 0 | 0 | 114.6 | | |
| 244 | A | 52.2 | Low | 53.9 | Low | 62 Ų | 62 | 134 Ų | 134 | 51% | 0.512 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -75.2 | -38 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | N246 W247 | A244-N246 VanDerWaalsContact C-N 3.34Å; A244-N246 PolarHBondContact O-N 2.67Å; A244-W247 PolarHBondContact O-N 3.28Å |
| 245 | D | 52.6 | Low | 54.8 | Low | 116 Ų | 116 | 127.9 Ų | 127.9 | 62% | 0.62 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -76.3 | -21.9 | -173.4 | -63.1 | -18.6 | 0 | 0 | 0 | 113.1 | | |
| 246 | N | 55.3 | Low | 55.5 | Low | 100 Ų | 100 | 125 Ų | 125 | 54% | 0.535 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -77.1 | -22.9 | 175.4 | -82.2 | -43.3 | 0 | 0 | 0 | 113.3 | Y242 A244 N250 | Y242-N246 PolarHBondContact O-ND2 3.2Å; A244-N246 VanDerWaalsContact C-N 3.34Å; A244-N246 PolarHBondContact O-N 2.67Å; N246-N250 WeakPolarHBondContact O-CB 3.45Å; N246-N250 PolarHBondContact O-N 3.11Å |
| 247 | W | 52.4 | Low | 55.9 | Low | 192 Ų | 192 | 129 Ų | 129 | 73% | 0.727 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -74.8 | -37.4 | -178.3 | -157.7 | 73 | 0 | 0 | 0 | 111.9 | A244 E251 | A244-W247 PolarHBondContact O-N 3.28Å; W247-E251 PolarHBondContact O-N 2.91Å |
| 248 | V | 58.7 | Low | 56.6 | Low | 102 Ų | 102 | 128.3 Ų | 128.3 | 62% | 0.618 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -72.1 | -37.1 | 179.9 | 179.4 | 0 | 0 | 0 | 0 | 112.2 | N250 Y252 | V248-N250 VanDerWaalsContact C-N 3.35Å; V248-Y252 PolarHBondContact O-N 2.83Å |
| 249 | L | 56.7 | Low | 57 | Low | 126 Ų | 126 | 124 Ų | 124 | 66% | 0.66 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -71.7 | -29.5 | 178.5 | -71.8 | 170.9 | 0 | 0 | 0 | 112.9 | A253 | L249-A253 PolarHBondContact O-N 3.41Å |
| 250 | N | 58.9 | Low | 57.5 | Low | 120 Ų | 120 | 121.9 Ų | 121.9 | 64% | 0.642 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -77.9 | -32.7 | -179.1 | -154.1 | 34.2 | 0 | 0 | 0 | 112.6 | N246 V248 A253 H254 | N246-N250 WeakPolarHBondContact O-CB 3.45Å; N246-N250 PolarHBondContact O-N 3.11Å; V248-N250 VanDerWaalsContact C-N 3.35Å; N250-A253 PolarHBondContact O-N 3.07Å; N250-H254 PolarHBondContact O-N 3.34Å |
| 251 | E | 60.4 | Low | 58.1 | Low | 116 Ų | 116 | 120.4 Ų | 120.4 | 54% | 0.542 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -63.2 | -45.9 | 171.5 | -93.4 | -79.7 | 147 | 0 | 0 | 111.5 | W247 A253 H254 E255 | W247-E251 PolarHBondContact O-N 2.91Å; E251-A253 VanDerWaalsContact C-N 3.31Å; E251-A253 PolarHBondContact O-N 2.87Å; E251-H254 PolarHBondContact O-N 3.03Å; E251-H254 VanDerWaalsContact O-N 3.15Å; E251-E255 PolarHBondContact O-N 3.15Å; E251-E255 VanDerWaalsContact O-N 3.14Å |
| 252 | Y | 57.5 | Low | 58.6 | Low | 153 Ų | 153 | 118.4 Ų | 118.4 | 60% | 0.6 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -64.8 | -34.1 | 178.8 | -162.2 | -101.7 | 0 | 0 | 0 | 112.8 | V248 Q256 | V248-Y252 PolarHBondContact O-N 2.83Å; Y252-Q256 HydrophobicContact CD1-CG 4.33Å; Y252-Q256 HydrophobicContact CE1-CG 4.13Å; Y252-Q256 WeakPolarHBondContact O-CG 3.37Å; Y252-Q256 PolarHBondContact O-N 3.28Å |
| 253 | A | 60.7 | Low | 58.9 | Low | 44 Ų | 44 | 114.6 Ų | 114.6 | 36% | 0.364 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -71.5 | -29.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L249 N250 E251 R257 | L249-A253 PolarHBondContact O-N 3.41Å; N250-A253 PolarHBondContact O-N 3.07Å; E251-A253 VanDerWaalsContact C-N 3.31Å; E251-A253 PolarHBondContact O-N 2.87Å; A253-R257 PolarHBondContact O-N 2.86Å |
| 254 | H | 61.3 | Low | 59.1 | Low | 144 Ų | 144 | 114.7 Ų | 114.7 | 67% | 0.667 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -75 | -36.5 | 177.7 | -160.9 | -84.8 | 0 | 0 | 0 | 111.6 | N250 E251 R257 S258 | N250-H254 PolarHBondContact O-N 3.34Å; E251-H254 PolarHBondContact O-N 3.03Å; E251-H254 VanDerWaalsContact O-N 3.15Å; H254-R257 PolarHBondContact O-N 3.41Å; H254-S258 PolarHBondContact O-N 3.02Å |
| 255 | E | 62.7 | Low | 59.1 | Low | 114 Ų | 114 | 126.1 Ų | 126.1 | 53% | 0.533 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -67.8 | -41.6 | 177.2 | -162.5 | 168.1 | -170.6 | 0 | 0 | 112.1 | E251 R257 S258 I259 | E251-E255 PolarHBondContact O-N 3.15Å; E251-E255 VanDerWaalsContact O-N 3.14Å; E255-R257 PolarHBondContact O-N 3.38Å; E255-S258 PolarHBondContact O-N 3.5Å; E255-I259 HydrophobicContact CG-CD1 4.23Å; E255-I259 WeakPolarHBondContact O-CG1 3.23Å; E255-I259 PolarHBondContact O-N 2.64Å; E255-I259 VanDerWaalsContact O-N 3.1Å |
| 256 | Q | 60.7 | Low | 59.4 | Low | 93 Ų | 93 | 126.7 Ų | 126.7 | 44% | 0.435 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -65.9 | -34.2 | 177.5 | -66.9 | -64.8 | -26.5 | 0 | 0 | 113.3 | Y252 A260 | Y252-Q256 HydrophobicContact CD1-CG 4.33Å; Y252-Q256 HydrophobicContact CE1-CG 4.13Å; Y252-Q256 WeakPolarHBondContact O-CG 3.37Å; Y252-Q256 PolarHBondContact O-N 3.28Å; Q256-A260 PolarHBondContact O-N 3.46Å; Q256-A260 VanDerWaalsContact O-N 3.16Å |
| 257 | R | 61.6 | Low | 59.7 | Low | 188 Ų | 188 | 128.1 Ų | 128.1 | 71% | 0.709 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -72 | -33.6 | 175.2 | -72.8 | -175.9 | -166.7 | -130.8 | 2.8 | 112.7 | A253 H254 E255 Q261 | A253-R257 PolarHBondContact O-N 2.86Å; H254-R257 PolarHBondContact O-N 3.41Å; E255-R257 PolarHBondContact O-N 3.38Å; R257-Q261 WeakPolarHBondContact O-CG 3.4Å; R257-Q261 PolarHBondContact O-N 3.26Å |
| 258 | S | 65.1 | Low | 60.1 | Low | 78 Ų | 78 | 124.5 Ų | 124.5 | 55% | 0.545 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -68.9 | -36.8 | 175.8 | -169.1 | 0 | 0 | 0 | 0 | 112 | H254 E255 S262 | H254-S258 PolarHBondContact O-N 3.02Å; E255-S258 PolarHBondContact O-N 3.5Å; S258-S262 PolarHBondContact O-N 2.75Å |
| 259 | I | 60.8 | Low | 60.1 | Low | 91 Ų | 91 | 125.8 Ų | 125.8 | 47% | 0.467 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -70.5 | -40.7 | 177.9 | -64.4 | 165.2 | 0 | 0 | 0 | 110.6 | E255 Q261 S262 | E255-I259 HydrophobicContact CG-CD1 4.23Å; E255-I259 WeakPolarHBondContact O-CG1 3.23Å; E255-I259 PolarHBondContact O-N 2.64Å; E255-I259 VanDerWaalsContact O-N 3.1Å; I259-Q261 PolarHBondContact O-N 3.1Å; I259-S262 PolarHBondContact O-N 3.36Å |
| 260 | A | 62.2 | Low | 60.3 | Low | 67 Ų | 67 | 125.8 Ų | 125.8 | 55% | 0.554 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -67 | -34.1 | 179 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q256 S262 | Q256-A260 PolarHBondContact O-N 3.46Å; Q256-A260 VanDerWaalsContact O-N 3.16Å; A260-S262 VanDerWaalsContact C-N 3.3Å; A260-S262 PolarHBondContact O-N 3.11Å |
| 261 | Q | 62.2 | Low | 60.4 | Low | 157 Ų | 157 | 126.2 Ų | 126.2 | 73% | 0.734 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -77.5 | -15 | 178.1 | -70.9 | -178.6 | -4.9 | 0 | 0 | 113.8 | R257 I259 | R257-Q261 WeakPolarHBondContact O-CG 3.4Å; R257-Q261 PolarHBondContact O-N 3.26Å; I259-Q261 PolarHBondContact O-N 3.1Å |
| 262 | S | 61.4 | Low | 60.4 | Low | 92 Ų | 92 | 126.9 Ų | 126.9 | 64% | 0.643 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.7 | -13.6 | 177.9 | 177.3 | 0 | 0 | 0 | 0 | 113.4 | S258 I259 A260 | S258-S262 PolarHBondContact O-N 2.75Å; I259-S262 PolarHBondContact O-N 3.36Å; A260-S262 VanDerWaalsContact C-N 3.3Å; A260-S262 PolarHBondContact O-N 3.11Å |
| 263 | C | 60.8 | Low | 60.7 | Low | 101 Ų | 101 | 124.9 Ų | 124.9 | 68% | 0.682 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -101.5 | 2.7 | -174.9 | -65.3 | 0 | 0 | 0 | 0 | 114.1 | | |
| 264 | D | 57.6 | Low | 60.7 | Low | 153 Ų | 153 | 131.7 Ų | 131.7 | 82% | 0.818 | 66% | 0.661 | S | S | * | * | | | trans | -117.7 | 27.4 | -174.2 | -122.1 | -16 | 0 | 0 | 0 | 113.1 | | |
| 265 | R | 51.8 | Low | 60.6 | Low | 302 Ų | 302 | 130.5 Ų | 130.5 | 100% | 1.14 | 66% | 0.66 | S | S | * | * | | | trans | -125.8 | 0 | 168 | -82.5 | -169.6 | -175.4 | 179.2 | 2.8 | 110.2 | | |