| 1 | M | 37.9 | Very low | 36.3 | Very low | 236 Ų | 236 | 134.5 Ų | 134.5 | 100% | 1.163 | 85% | 0.85 | S | S | * | * | | | | 0 | 123.3 | 0 | -83.3 | 139.1 | 118 | 0 | 0 | 108.4 | | |
| 2 | R | 39.4 | Very low | 35.7 | Very low | 244 Ų | 244 | 139 Ų | 139 | 92% | 0.921 | 84% | 0.838 | S | S | * | * | | | trans | 41.5 | 109.9 | 154.6 | -53.2 | 178.1 | -168.2 | -118.3 | 2.1 | 116.2 | | |
| 3 | G | 37.8 | Very low | 35.2 | Very low | 75 Ų | 75 | 137.8 Ų | 137.8 | 77% | 0.773 | 84% | 0.838 | S | S | * | * | | | cis | 83.2 | 89.6 | 39.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 4 | V | 43.5 | Very low | 34.8 | Very low | 152 Ų | 152 | 138.5 Ų | 138.5 | 92% | 0.921 | 83% | 0.827 | S | S | * | * | | | trans | -138.9 | 127.8 | 160 | -171.3 | 0 | 0 | 0 | 0 | 108.7 | | |
| 5 | S | 35.9 | Very low | 34.7 | Very low | 112 Ų | 112 | 137.1 Ų | 137.1 | 78% | 0.783 | 83% | 0.827 | S | S | * | * | | | trans | -83.8 | 133.2 | -163.4 | -159.6 | 0 | 0 | 0 | 0 | 111.5 | G7 | S5-G7 PolarHBondContact O-N 3.32Š|
| 6 | A | 42.3 | Very low | 34.9 | Very low | 104 Ų | 104 | 143.3 Ų | 143.3 | 86% | 0.86 | 83% | 0.831 | S | S | * | * | | | trans | -83.9 | 97.3 | 163.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | G8 | A6-G8 PolarHBondContact O-N 3.27Š|
| 7 | G | 35.3 | Very low | 34.7 | Very low | 73 Ų | 73 | 139 Ų | 139 | 75% | 0.753 | 83% | 0.825 | S | S | * | * | | | trans | -74 | 104 | 171 | 0 | 0 | 0 | 0 | 0 | 110.3 | S5 | S5-G7 PolarHBondContact O-N 3.32Š|
| 8 | G | 33.3 | Very low | 34.7 | Very low | 70 Ų | 70 | 145.2 Ų | 145.2 | 72% | 0.722 | 83% | 0.832 | S | S | * | * | | | trans | -78.7 | 127 | 169.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | A6 H10 | A6-G8 PolarHBondContact O-N 3.27Å; G8-H10 PolarHBondContact O-N 3.43Å |
| 9 | C | 31.9 | Very low | 34.9 | Very low | 131 Ų | 131 | 150.4 Ų | 150.4 | 89% | 0.885 | 84% | 0.836 | S | S | * | * | | | trans | -77.1 | 101.6 | 166.9 | -71.3 | 0 | 0 | 0 | 0 | 109.1 | | |
| 10 | H | 32 | Very low | 34.6 | Very low | 160 Ų | 160 | 150.5 Ų | 150.5 | 74% | 0.741 | 84% | 0.835 | S | S | * | * | | | trans | -93.5 | 93.8 | 176.4 | -139.1 | -80.8 | 0 | 0 | 0 | 108.6 | G8 R12 | G8-H10 PolarHBondContact O-N 3.43Å; H10-R12 PolarHBondContact O-N 3.39Å; H10-R12 VanDerWaalsContact O-N 3.1Å |
| 11 | C | 30.1 | Very low | 34.7 | Very low | 122 Ų | 122 | 149.6 Ų | 149.6 | 82% | 0.824 | 83% | 0.833 | S | S | * | * | | | trans | -74.5 | 98.7 | 170.1 | -67.5 | 0 | 0 | 0 | 0 | 109 | | |
| 12 | R | 28.7 | Very low | 34.4 | Very low | 189 Ų | 189 | 144.3 Ų | 144.3 | 71% | 0.713 | 81% | 0.814 | S | S | * | * | | | trans | -94.9 | 91.1 | 177.3 | -168 | -178.1 | -77.4 | -141.4 | -0.4 | 108.9 | H10 H14 | H10-R12 PolarHBondContact O-N 3.39Å; H10-R12 VanDerWaalsContact O-N 3.1Å; R12-H14 PolarHBondContact O-N 3.34Å |
| 13 | C | 29.9 | Very low | 34 | Very low | 124 Ų | 124 | 144 Ų | 144 | 84% | 0.838 | 81% | 0.813 | S | S | * | * | | | trans | -76.5 | 112.2 | 166.9 | -74.8 | 0 | 0 | 0 | 0 | 109.6 | | |
| 14 | H | 29.3 | Very low | 33.8 | Very low | 147 Ų | 147 | 147.5 Ų | 147.5 | 68% | 0.681 | 81% | 0.813 | S | S | * | * | | | trans | -92.7 | 93.4 | 175.8 | -123.7 | -79.9 | 0 | 0 | 0 | 109.1 | R12 | R12-H14 PolarHBondContact O-N 3.34Š|
| 15 | S | 33.4 | Very low | 33.6 | Very low | 118 Ų | 118 | 146.2 Ų | 146.2 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | | | trans | -102.5 | 108.1 | 165.4 | -73.3 | 0 | 0 | 0 | 0 | 109.2 | G17 | S15-G17 PolarHBondContact O-N 3.42Š|
| 16 | R | 37.1 | Very low | 33.5 | Very low | 235 Ų | 235 | 144.7 Ų | 144.7 | 89% | 0.887 | 81% | 0.81 | S | S | * | * | | | trans | -73.6 | 108.5 | 175.8 | -78.6 | -176.9 | 177.5 | -175.3 | 0.4 | 110.5 | | |
| 17 | G | 32.8 | Very low | 33.2 | Very low | 71 Ų | 71 | 150.9 Ų | 150.9 | 73% | 0.732 | 81% | 0.811 | S | S | * | * | | | trans | 38.8 | 112.8 | 137 | 0 | 0 | 0 | 0 | 0 | 120.7 | S15 | S15-G17 PolarHBondContact O-N 3.42Š|
| 18 | R | 33.8 | Very low | 33.3 | Very low | 251 Ų | 251 | 155.7 Ų | 155.7 | 95% | 0.947 | 82% | 0.82 | S | S | * | * | | | trans | -127.1 | 136.6 | 136.3 | -78.7 | -168.7 | -177.5 | -157 | 2.2 | 109.4 | | |
| 19 | R | 38.7 | Very low | 33.2 | Very low | 243 Ų | 243 | 155.7 Ų | 155.7 | 92% | 0.917 | 82% | 0.82 | S | S | * | * | | | trans | -73.7 | 135.6 | -164.7 | -65.2 | 168.7 | -132 | -170 | 1.6 | 111.4 | | |
| 20 | D | 29.9 | Very low | 33.2 | Very low | 152 Ų | 152 | 154.3 Ų | 154.3 | 81% | 0.813 | 82% | 0.818 | S | S | * | * | | | trans | -59.8 | 127 | 160.7 | -66.7 | -68.5 | 0 | 0 | 0 | 110.7 | | |
| 21 | V | 35.5 | Very low | 33.2 | Very low | 133 Ų | 133 | 151.5 Ų | 151.5 | 81% | 0.806 | 82% | 0.823 | S | S | * | * | | | trans | -116.1 | 93.1 | 157.4 | 176.2 | 0 | 0 | 0 | 0 | 106.6 | | |
| 22 | V | 32.1 | Very low | 33.4 | Very low | 125 Ų | 125 | 150.7 Ų | 150.7 | 76% | 0.758 | 83% | 0.825 | S | S | * | * | | | trans | -79.3 | 118.4 | 159.9 | 174.9 | 0 | 0 | 0 | 0 | 106.8 | | |
| 23 | R | 31.4 | Very low | 33.7 | Very low | 236 Ų | 236 | 153 Ų | 153 | 89% | 0.891 | 83% | 0.833 | S | S | * | * | | | trans | -134.9 | 120.5 | 160.7 | -159.1 | 167.4 | -177.2 | 127.5 | -1.9 | 110 | | |
| 24 | L | 34 | Very low | 33.8 | Very low | 149 Ų | 149 | 152.1 Ų | 152.1 | 78% | 0.78 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -61 | 157.9 | -177 | -67.6 | 160.6 | 0 | 0 | 0 | 113.3 | | |
| 25 | P | 38.8 | Very low | 34 | Very low | 126 Ų | 126 | 149.5 Ų | 149.5 | 82% | 0.818 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 120.8 | 172.8 | 32 | -30.5 | 0 | 0 | 0 | 110.9 | | |
| 26 | G | 33.1 | Very low | 34.1 | Very low | 80 Ų | 80 | 151.2 Ų | 151.2 | 83% | 0.825 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -95.4 | 118.1 | 169.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 27 | R | 37.1 | Very low | 34 | Very low | 233 Ų | 233 | 146.4 Ų | 146.4 | 88% | 0.879 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 141.8 | 165 | -75.1 | 155.1 | 59.7 | -171.9 | -0 | 109.8 | | |
| 28 | D | 36.1 | Very low | 34.1 | Very low | 174 Ų | 174 | 149.7 Ų | 149.7 | 93% | 0.93 | 84% | 0.835 | S | S | * | * | | | trans | 177.7 | 134.5 | 145.6 | -80.5 | -32.2 | 0 | 0 | 0 | 105.4 | | |
| 29 | G | 32 | Very low | 34 | Very low | 71 Ų | 71 | 141.5 Ų | 141.5 | 73% | 0.732 | 83% | 0.829 | S | S | * | * | | | cis | 154.5 | 139.4 | 9 | 0 | 0 | 0 | 0 | 0 | 107.4 | | |
| 30 | A | 32.4 | Very low | 33.7 | Very low | 101 Ų | 101 | 134.1 Ų | 134.1 | 84% | 0.835 | 83% | 0.828 | S | S | * | * | | | trans | 69.8 | 109.4 | 164.4 | 0 | 0 | 0 | 0 | 0 | 118.7 | | |
| 31 | A | 31.6 | Very low | 33.9 | Very low | 102 Ų | 102 | 130.4 Ų | 130.4 | 84% | 0.843 | 83% | 0.826 | S | S | * | * | | | | 85.4 | 113.2 | 67.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | | |
| 32 | A | 33.4 | Very low | 33.9 | Very low | 105 Ų | 105 | 135.8 Ų | 135.8 | 87% | 0.868 | 83% | 0.832 | S | S | * | * | | | trans | -166.8 | 121.2 | 138.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | | |
| 33 | R | 35.1 | Very low | 34.2 | Very low | 236 Ų | 236 | 140.2 Ų | 140.2 | 89% | 0.891 | 84% | 0.841 | S | S | * | * | | | trans | -65.4 | 149.4 | 165.2 | -74 | 165.7 | 125.1 | -144.8 | 2.4 | 110.1 | | |
| 34 | A | 33.3 | Very low | 34.3 | Very low | 106 Ų | 106 | 132.4 Ų | 132.4 | 88% | 0.876 | 83% | 0.834 | S | S | * | * | | | trans | -146 | 121.1 | 145.7 | 0 | 0 | 0 | 0 | 0 | 110 | | |
| 35 | S | 33.3 | Very low | 35.1 | Very low | 92 Ų | 92 | 132 Ų | 132 | 64% | 0.643 | 84% | 0.841 | S | S | * | * | | | trans | -90.1 | 147.4 | 172.6 | -67.9 | 0 | 0 | 0 | 0 | 110.5 | | |
| 36 | L | 35.1 | Very low | 35.1 | Very low | 154 Ų | 154 | 129.8 Ų | 129.8 | 81% | 0.806 | 84% | 0.84 | S | S | * | * | | | trans | 37.2 | 122.2 | 139.5 | -72.5 | 147.8 | 0 | 0 | 0 | 119.4 | | |
| 37 | T | 34.9 | Very low | 35.4 | Very low | 135 Ų | 135 | 133 Ų | 133 | 83% | 0.828 | 84% | 0.844 | S | S | * | * | | | | -166.2 | 123.5 | 119.1 | 52.8 | 0 | 0 | 0 | 0 | 108.4 | | |
| 38 | T | 34.4 | Very low | 35.4 | Very low | 139 Ų | 139 | 126.6 Ų | 126.6 | 85% | 0.853 | 84% | 0.841 | S | S | * | * | | | | 67.3 | 122.3 | 76 | -22.8 | 0 | 0 | 0 | 0 | 116.4 | | |
| 39 | G | 31.6 | Very low | 35.4 | Very low | 80 Ų | 80 | 128 Ų | 128 | 83% | 0.825 | 84% | 0.842 | S | S | * | * | | | trans | 124.8 | 118.9 | 161.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 40 | G | 33.3 | Very low | 35.5 | Very low | 87 Ų | 87 | 128.1 Ų | 128.1 | 90% | 0.897 | 84% | 0.843 | S | S | * | * | | | cis | 125.4 | 117.5 | 15.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | | |
| 41 | G | 32.7 | Very low | 35.8 | Very low | 74 Ų | 74 | 127.5 Ų | 127.5 | 76% | 0.763 | 85% | 0.846 | S | S | * | * | | | trans | 138.8 | 96.3 | 155.5 | 0 | 0 | 0 | 0 | 0 | 120.7 | | |
| 42 | R | 36.6 | Very low | 35.8 | Very low | 246 Ų | 246 | 130.3 Ų | 130.3 | 93% | 0.928 | 85% | 0.847 | S | S | * | * | | | | 68.4 | 111.8 | 128.3 | -66.1 | -178.6 | 174.7 | -132.2 | -0.8 | 123.5 | | |
| 43 | K | 37.4 | Very low | 36.1 | Very low | 218 Ų | 218 | 129.8 Ų | 129.8 | 95% | 0.948 | 84% | 0.843 | S | S | * | * | | | | 45.6 | 126 | 124.6 | -87.1 | -174 | 173.3 | -176.9 | 0 | 122.6 | | |
| 44 | G | 34.5 | Very low | 35.9 | Very low | 73 Ų | 73 | 127.3 Ų | 127.3 | 75% | 0.753 | 84% | 0.838 | S | S | * | * | | | trans | 169.3 | 136.9 | 146.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 45 | P | 50.3 | Low | 36.1 | Very low | 141 Ų | 141 | 133.6 Ų | 133.6 | 92% | 0.916 | 84% | 0.839 | S | S | * | * | | | trans | -97 | 154.2 | -162.7 | 37.8 | -32.3 | 0 | 0 | 0 | 114 | | |
| 46 | G | 37.9 | Very low | 36 | Very low | 78 Ų | 78 | 137 Ų | 137 | 80% | 0.804 | 85% | 0.845 | S | S | * | * | | | trans | -167 | 106.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | | |
| 47 | T | 39.4 | Very low | 35.9 | Very low | 147 Ų | 147 | 134.4 Ų | 134.4 | 90% | 0.902 | 85% | 0.846 | S | S | * | * | | | trans | -68.6 | 131.2 | 169.8 | 38.1 | 0 | 0 | 0 | 0 | 111.7 | | |
| 48 | A | 38.1 | Very low | 35.8 | Very low | 100 Ų | 100 | 133.9 Ų | 133.9 | 83% | 0.826 | 84% | 0.842 | S | S | * | * | | | trans | -160.6 | 133.5 | 149.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | | |
| 49 | H | 36.7 | Very low | 35.5 | Very low | 203 Ų | 203 | 131.8 Ų | 131.8 | 94% | 0.94 | 83% | 0.833 | S | S | * | * | | | trans | -56.9 | 142.9 | 173.9 | -81.7 | 18.6 | 0 | 0 | 0 | 113.2 | | |
| 50 | G | 34.4 | Very low | 35.3 | Very low | 73 Ų | 73 | 133.5 Ų | 133.5 | 75% | 0.753 | 83% | 0.831 | S | S | * | * | | | trans | -167.7 | 112.1 | 162.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | D52 | G50-D52 PolarHBondContact O-N 3.27Š|
| 51 | G | 37.2 | Very low | 35.7 | Very low | 88 Ų | 88 | 135.2 Ų | 135.2 | 91% | 0.907 | 83% | 0.825 | S | S | * | * | | | trans | -67.3 | 125.6 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | A53 | G51-A53 PolarHBondContact O-N 3.22Š|
| 52 | D | 32 | Very low | 35.9 | Very low | 162 Ų | 162 | 140 Ų | 140 | 87% | 0.866 | 83% | 0.827 | S | S | * | * | | | trans | -82.7 | 110.9 | 170.5 | -104.5 | -57.7 | 0 | 0 | 0 | 110.3 | G50 K54 | G50-D52 PolarHBondContact O-N 3.27Å; D52-K54 PolarHBondContact O-N 3.1Å; D52-K54 VanDerWaalsContact O-N 3.08Å |
| 53 | A | 39.6 | Very low | 35.7 | Very low | 93 Ų | 93 | 137.2 Ų | 137.2 | 77% | 0.769 | 82% | 0.824 | S | S | * | * | | | trans | -69 | 97.5 | 163.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | G51 R55 | G51-A53 PolarHBondContact O-N 3.22Å; A53-R55 PolarHBondContact O-N 3.46Å |
| 54 | K | 31.7 | Very low | 35.5 | Very low | 185 Ų | 185 | 134.3 Ų | 134.3 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | | | trans | -66.6 | 90.6 | 175.5 | -163.3 | 163.5 | -172.9 | 172.2 | 0 | 110.2 | D52 Q56 | D52-K54 PolarHBondContact O-N 3.1Å; D52-K54 VanDerWaalsContact O-N 3.08Å; K54-Q56 PolarHBondContact O-N 3.25Å; K54-Q56 VanDerWaalsContact O-N 3.16Å |
| 55 | R | 37.9 | Very low | 35.4 | Very low | 237 Ų | 237 | 135.4 Ų | 135.4 | 89% | 0.894 | 81% | 0.814 | S | S | * | * | | | trans | -63.7 | 108.4 | 158.6 | -84.7 | -176 | -179.4 | -90.7 | 0.3 | 107.5 | A53 A57 | A53-R55 PolarHBondContact O-N 3.46Å; R55-A57 PolarHBondContact O-N 2.95Å |
| 56 | Q | 30.9 | Very low | 34.5 | Very low | 165 Ų | 165 | 134.2 Ų | 134.2 | 77% | 0.771 | 81% | 0.809 | S | S | * | * | | | trans | -71.5 | 108.9 | 163.3 | -71.8 | 178.4 | 19.4 | 0 | 0 | 107.7 | K54 V58 | K54-Q56 PolarHBondContact O-N 3.25Å; K54-Q56 VanDerWaalsContact O-N 3.16Å; Q56-V58 PolarHBondContact O-N 3.42Å |
| 57 | A | 32.2 | Very low | 34.2 | Very low | 99 Ų | 99 | 143 Ų | 143 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | | | trans | -75.5 | 104.3 | 159.3 | 0 | 0 | 0 | 0 | 0 | 107 | R55 S59 | R55-A57 PolarHBondContact O-N 2.95Å; A57-S59 PolarHBondContact O-N 3.44Å |
| 58 | V | 32 | Very low | 33.9 | Very low | 124 Ų | 124 | 138.7 Ų | 138.7 | 75% | 0.752 | 80% | 0.803 | S | S | * | * | | | trans | -76.8 | 107.7 | 167.7 | -174.2 | 0 | 0 | 0 | 0 | 106.5 | Q56 C60 | Q56-V58 PolarHBondContact O-N 3.42Å; V58-C60 PolarHBondContact O-N 3.22Å; V58-C60 VanDerWaalsContact O-N 3.14Å |
| 59 | S | 29.6 | Very low | 33.9 | Very low | 95 Ų | 95 | 139.7 Ų | 139.7 | 66% | 0.664 | 80% | 0.801 | S | S | * | * | | | trans | -67.5 | 103.9 | 170.6 | -176.6 | 0 | 0 | 0 | 0 | 108.7 | A57 T61 | A57-S59 PolarHBondContact O-N 3.44Å; S59-T61 VanDerWaalsContact C-N 3.26Å; S59-T61 PolarHBondContact O-N 3.2Å; S59-T61 VanDerWaalsContact O-N 3.12Å; S59-T61 PolarHBondContact OG-OG1 3.31Å |
| 60 | C | 27.7 | Very low | 33.8 | Very low | 115 Ų | 115 | 136.3 Ų | 136.3 | 78% | 0.777 | 80% | 0.799 | S | S | * | * | | | trans | -82.3 | 77.3 | 167.7 | -129.2 | 0 | 0 | 0 | 0 | 108.4 | V58 Q62 | V58-C60 PolarHBondContact O-N 3.22Å; V58-C60 VanDerWaalsContact O-N 3.14Å; C60-Q62 PolarHBondContact O-N 3.37Å |
| 61 | T | 41.5 | Very low | 33.9 | Very low | 124 Ų | 124 | 138.9 Ų | 138.9 | 76% | 0.761 | 80% | 0.8 | S | S | * | * | | | trans | -87.7 | 92.2 | 165.1 | 7 | 0 | 0 | 0 | 0 | 107.2 | S59 | S59-T61 VanDerWaalsContact C-N 3.26Å; S59-T61 PolarHBondContact O-N 3.2Å; S59-T61 VanDerWaalsContact O-N 3.12Å; S59-T61 PolarHBondContact OG-OG1 3.31Å |
| 62 | Q | 36.6 | Very low | 34.6 | Very low | 175 Ų | 175 | 140.4 Ų | 140.4 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | | | trans | -121.9 | 134.1 | 161.3 | -71 | -171.7 | 42 | 0 | 0 | 109.4 | C60 | C60-Q62 PolarHBondContact O-N 3.37Š|
| 63 | H | 32.4 | Very low | 34.7 | Very low | 187 Ų | 187 | 145 Ų | 145 | 87% | 0.866 | 80% | 0.799 | S | S | * | * | | | trans | -78.7 | 118 | -156.4 | -158.8 | -101.7 | 0 | 0 | 0 | 110 | | |
| 64 | L | 33.5 | Very low | 34.3 | Very low | 156 Ų | 156 | 144 Ų | 144 | 82% | 0.817 | 80% | 0.798 | S | S | * | * | | | trans | -79.4 | 130 | 168.2 | -135.5 | 78.7 | 0 | 0 | 0 | 109 | | |
| 65 | S | 31.9 | Very low | 34.7 | Very low | 96 Ų | 96 | 146.6 Ų | 146.6 | 67% | 0.671 | 80% | 0.803 | S | S | * | * | | | trans | 75.8 | 108 | 144.4 | -45.3 | 0 | 0 | 0 | 0 | 119.5 | | |
| 66 | S | 30.3 | Very low | 34.5 | Very low | 116 Ų | 116 | 143.1 Ų | 143.1 | 81% | 0.811 | 80% | 0.801 | S | S | * | * | | | trans | -145.3 | 88.9 | 135.7 | -168 | 0 | 0 | 0 | 0 | 109.2 | | |
| 67 | W | 33.6 | Very low | 34.7 | Very low | 262 Ų | 262 | 145.8 Ų | 145.8 | 99% | 0.992 | 80% | 0.804 | S | S | * | * | | | trans | -79.1 | 110.2 | 156.6 | -87.1 | 6.7 | 0 | 0 | 0 | 107 | | |
| 68 | G | 32.7 | Very low | 34.7 | Very low | 57 Ų | 57 | 148.9 Ų | 148.9 | 59% | 0.588 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -74 | 147.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | | |
| 69 | P | 38.1 | Very low | 34.7 | Very low | 121 Ų | 121 | 146.8 Ų | 146.8 | 79% | 0.786 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 132.4 | 179.4 | 29.6 | -32 | 0 | 0 | 0 | 111.6 | | |
| 70 | C | 33.2 | Very low | 35.1 | Very low | 132 Ų | 132 | 147.1 Ų | 147.1 | 89% | 0.892 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 127.4 | 164.9 | -72.7 | 0 | 0 | 0 | 0 | 109.9 | | |
| 71 | T | 36.6 | Very low | 35.3 | Very low | 127 Ų | 127 | 153.5 Ų | 153.5 | 78% | 0.779 | 83% | 0.826 | S | S | * | * | | | trans | -130.3 | 145.4 | 164.1 | 48.7 | 0 | 0 | 0 | 0 | 110.8 | | |
| 72 | P | 52.8 | Low | 35.5 | Very low | 120 Ų | 120 | 153.4 Ų | 153.4 | 78% | 0.779 | 83% | 0.827 | S | S | * | * | | | trans | -103.4 | 150.2 | -174.8 | 38.1 | -30.7 | 0 | 0 | 0 | 113.1 | | |
| 73 | R | 34.3 | Very low | 35.1 | Very low | 258 Ų | 258 | 153.9 Ų | 153.9 | 97% | 0.974 | 83% | 0.832 | S | S | * | * | | | trans | 136.2 | 139.7 | 166.5 | -87.4 | 173 | 167.9 | -148.9 | -2.4 | 107.3 | | |
| 74 | G | 31.1 | Very low | 35.5 | Very low | 72 Ų | 72 | 150.6 Ų | 150.6 | 74% | 0.742 | 83% | 0.83 | S | S | * | * | | | cis | 163.6 | 141.7 | 12 | 0 | 0 | 0 | 0 | 0 | 105.6 | | |
| 75 | R | 39.8 | Very low | 35.4 | Very low | 240 Ų | 240 | 149.3 Ų | 149.3 | 91% | 0.906 | 83% | 0.833 | S | S | * | * | | | trans | -15.3 | 138.7 | 175.3 | -69.7 | 174.2 | -105.9 | -93.3 | 1.4 | 118.3 | | |
| 76 | L | 33.4 | Very low | 35.7 | Very low | 164 Ų | 164 | 150 Ų | 150 | 86% | 0.859 | 84% | 0.844 | S | S | * | * | | | | -170.9 | 133 | 103.3 | -149.8 | 66.3 | 0 | 0 | 0 | 113.7 | | |
| 77 | W | 34.8 | Very low | 35.8 | Very low | 222 Ų | 222 | 148.1 Ų | 148.1 | 84% | 0.841 | 84% | 0.843 | S | S | * | * | | | trans | -9.6 | 140.1 | 162.4 | -85.4 | 46.8 | 0 | 0 | 0 | 122.7 | | |
| 78 | L | 33.3 | Very low | 35.9 | Very low | 164 Ų | 164 | 145.3 Ų | 145.3 | 86% | 0.859 | 84% | 0.841 | S | S | * | * | | | | 174.2 | 122.1 | 102.9 | -93.9 | 158.4 | 0 | 0 | 0 | 109.7 | | |
| 79 | G | 32 | Very low | 35.8 | Very low | 80 Ų | 80 | 147.2 Ų | 147.2 | 83% | 0.825 | 85% | 0.851 | S | S | * | * | | | trans | -179.3 | 91.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | | |
| 80 | A | 37.4 | Very low | 35.5 | Very low | 101 Ų | 101 | 149.6 Ų | 149.6 | 84% | 0.835 | 86% | 0.856 | S | S | * | * | | | trans | -74.6 | 142.2 | -169.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 81 | W | 31.1 | Very low | 35.6 | Very low | 249 Ų | 249 | 147.3 Ų | 147.3 | 94% | 0.943 | 85% | 0.847 | S | S | * | * | | | trans | -140.9 | 137 | 147.4 | -113.9 | -14.7 | 0 | 0 | 0 | 110 | | |
| 82 | P | 45.7 | Very low | 35.8 | Very low | 122 Ų | 122 | 147.4 Ų | 147.4 | 79% | 0.792 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -87.5 | 131.4 | -174.5 | 32.8 | -30 | 0 | 0 | 0 | 111.6 | | |
| 83 | M | 29.9 | Very low | 34.9 | Very low | 185 Ų | 185 | 145 Ų | 145 | 91% | 0.911 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -95.9 | 126.3 | 160.6 | -80.4 | 177.4 | 74.7 | 0 | 0 | 109.2 | | |
| 84 | S | 40.8 | Very low | 35.3 | Very low | 119 Ų | 119 | 139.5 Ų | 139.5 | 83% | 0.832 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 129.3 | 159.9 | -102.3 | 0 | 0 | 0 | 0 | 110.2 | | |
| 85 | C | 31.2 | Very low | 35.3 | Very low | 129 Ų | 129 | 140.1 Ų | 140.1 | 87% | 0.872 | 84% | 0.843 | S | S | * | * | | | trans | -155.2 | 139.1 | 148.4 | -102 | 0 | 0 | 0 | 0 | 110 | | |
| 86 | A | 37.3 | Very low | 34.8 | Very low | 110 Ų | 110 | 136.6 Ų | 136.6 | 91% | 0.909 | 84% | 0.837 | S | S | * | * | | | trans | -60.3 | 147.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 87 | G | 32.4 | Very low | 34.7 | Very low | 76 Ų | 76 | 135.9 Ų | 135.9 | 78% | 0.784 | 83% | 0.829 | S | S | * | * | | | trans | -159.3 | 103.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 88 | E | 35.7 | Very low | 34.5 | Very low | 203 Ų | 203 | 132.9 Ų | 132.9 | 95% | 0.949 | 82% | 0.824 | S | S | * | * | | | trans | -59.5 | 136.1 | 175.9 | -160.2 | 158.3 | 86.5 | 0 | 0 | 111.8 | | |
| 89 | A | 31.2 | Very low | 34.5 | Very low | 98 Ų | 98 | 131 Ų | 131 | 81% | 0.81 | 82% | 0.823 | S | S | * | * | | | trans | -154.3 | 123.3 | 164.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 90 | L | 32 | Very low | 35 | Very low | 170 Ų | 170 | 132.8 Ų | 132.8 | 89% | 0.89 | 82% | 0.821 | S | S | * | * | | | trans | -63.9 | 135.8 | 174.9 | -95.8 | 128.1 | 0 | 0 | 0 | 113.5 | | |
| 91 | A | 35.4 | Very low | 34.7 | Very low | 85 Ų | 85 | 134.2 Ų | 134.2 | 70% | 0.702 | 82% | 0.818 | S | S | * | * | | | trans | 43 | 143.3 | 138 | 0 | 0 | 0 | 0 | 0 | 121.1 | | |
| 92 | P | 40.7 | Very low | 34.9 | Very low | 129 Ų | 129 | 130.7 Ų | 130.7 | 84% | 0.838 | 81% | 0.812 | S | S | * | * | | | | -136.6 | 155.5 | 75 | 28.9 | -9.4 | 0 | 0 | 0 | 114.9 | | |
| 93 | G | 33.9 | Very low | 34.4 | Very low | 70 Ų | 70 | 129.6 Ų | 129.6 | 72% | 0.722 | 81% | 0.814 | S | S | * | * | | | trans | -72.9 | -179.5 | -176 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 94 | P | 41.5 | Very low | 34.5 | Very low | 142 Ų | 142 | 124.9 Ų | 124.9 | 92% | 0.922 | 81% | 0.812 | S | S | * | * | | | | -138.7 | 174.4 | 115.7 | 34.8 | -19.6 | 0 | 0 | 0 | 114.1 | | |
| 95 | A | 32.6 | Very low | 34 | Very low | 85 Ų | 85 | 123 Ų | 123 | 70% | 0.702 | 81% | 0.811 | S | S | * | * | | | trans | -84 | 162.6 | -162.6 | 0 | 0 | 0 | 0 | 0 | 116 | | |
| 96 | E | 29.4 | Very low | 34.1 | Very low | 165 Ų | 165 | 120.8 Ų | 120.8 | 77% | 0.771 | 81% | 0.811 | S | S | * | * | | | trans | 59.5 | 125.3 | 149.7 | -69.2 | -169.8 | 99.7 | 0 | 0 | 120.8 | | |
| 97 | Q | 30.3 | Very low | 34 | Very low | 150 Ų | 150 | 126.2 Ų | 126.2 | 70% | 0.701 | 81% | 0.808 | S | S | * | * | | | | 178.8 | 115.2 | 108.1 | -154.3 | 78.9 | 37 | 0 | 0 | 111.8 | | |
| 98 | Q | 31.7 | Very low | 34 | Very low | 159 Ų | 159 | 130 Ų | 130 | 74% | 0.743 | 81% | 0.809 | S | S | * | * | | | trans | 9.1 | 140.6 | 151 | -64.4 | 158.5 | -9.9 | 0 | 0 | 123.1 | | |
| 99 | C | 33.1 | Very low | 33.7 | Very low | 123 Ų | 123 | 123.8 Ų | 123.8 | 83% | 0.831 | 80% | 0.8 | S | S | * | * | | | trans | -65.9 | 165.5 | 157.7 | -54.2 | 0 | 0 | 0 | 0 | 112.6 | | |
| 100 | P | 41.8 | Very low | 33.7 | Very low | 119 Ų | 119 | 125 Ų | 125 | 77% | 0.773 | 80% | 0.803 | S | S | * | * | | | | -158.2 | 174.7 | 89.1 | 39 | -18 | 0 | 0 | 0 | 119 | | |
| 101 | V | 30.4 | Very low | 34.8 | Very low | 130 Ų | 130 | 123 Ų | 123 | 79% | 0.788 | 80% | 0.8 | S | S | * | * | | | trans | 83.7 | 100.7 | 148 | 101 | 0 | 0 | 0 | 0 | 118.6 | | |
| 102 | E | 35.5 | Very low | 34.6 | Very low | 175 Ų | 175 | 123.4 Ų | 123.4 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | | | | 82.4 | 122.3 | 78.4 | -80 | -71.8 | 127.5 | 0 | 0 | 116.2 | | |
| 103 | A | 35.4 | Very low | 34.2 | Very low | 100 Ų | 100 | 125.7 Ų | 125.7 | 83% | 0.826 | 80% | 0.802 | S | S | * | * | | | | 169.5 | 124 | 115.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 104 | G | 32.6 | Very low | 34 | Very low | 85 Ų | 85 | 130.9 Ų | 130.9 | 88% | 0.876 | 81% | 0.808 | S | S | * | * | | | trans | 100.3 | 124.2 | 145.3 | 0 | 0 | 0 | 0 | 0 | 117.4 | | |
| 105 | G | 31.1 | Very low | 33.7 | Very low | 79 Ų | 79 | 127.7 Ų | 127.7 | 81% | 0.814 | 79% | 0.794 | S | S | * | * | | | cis | 172.7 | 144.8 | -1.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | | |
| 106 | G | 32.2 | Very low | 33.6 | Very low | 84 Ų | 84 | 129.6 Ų | 129.6 | 87% | 0.866 | 80% | 0.801 | S | S | * | * | | | trans | 80.9 | 148.5 | 157.6 | 0 | 0 | 0 | 0 | 0 | 118.6 | | |
| 107 | R | 34.5 | Very low | 34 | Very low | 223 Ų | 223 | 128.3 Ų | 128.3 | 84% | 0.842 | 80% | 0.799 | S | S | * | * | | | cis | -166 | 137.9 | -20 | -166.7 | -179.9 | -165.7 | -78.2 | 2.8 | 107.5 | | |
| 108 | L | 33.3 | Very low | 34.5 | Very low | 155 Ų | 155 | 128.7 Ų | 128.7 | 81% | 0.812 | 80% | 0.801 | S | S | * | * | | | trans | 4.4 | 145.3 | 160.4 | -80.1 | 83 | 0 | 0 | 0 | 122.4 | | |
| 109 | G | 29.3 | Very low | 34.8 | Very low | 73 Ų | 73 | 127 Ų | 127 | 75% | 0.753 | 80% | 0.797 | S | S | * | * | | | | 139.7 | 122.2 | 126.3 | 0 | 0 | 0 | 0 | 0 | 117.2 | | |
| 110 | S | 30.9 | Very low | 35 | Very low | 125 Ų | 125 | 127.1 Ų | 127.1 | 87% | 0.874 | 79% | 0.789 | S | S | * | * | | | trans | -93 | -156.3 | -167.5 | -44 | 0 | 0 | 0 | 0 | 114.8 | | |
| 111 | P | 55.9 | Low | 34.7 | Very low | 126 Ų | 126 | 128.5 Ų | 128.5 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | | | | -120.6 | 173.7 | -124.9 | 32.3 | -8.2 | 0 | 0 | 0 | 115.6 | | |
| 112 | A | 30.5 | Very low | 35 | Very low | 95 Ų | 95 | 130.3 Ų | 130.3 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | | | trans | 178.8 | 124.2 | 159.6 | 0 | 0 | 0 | 0 | 0 | 109 | | |
| 113 | H | 31.8 | Very low | 35.1 | Very low | 176 Ų | 176 | 130.5 Ų | 130.5 | 82% | 0.815 | 79% | 0.793 | S | S | * | * | | | | 81.7 | 115.2 | 78.3 | -170.8 | -86.7 | 0 | 0 | 0 | 114.9 | | |
| 114 | E | 30.7 | Very low | 35.1 | Very low | 180 Ų | 180 | 131.9 Ų | 131.9 | 84% | 0.841 | 79% | 0.787 | S | S | * | * | | | trans | 150.8 | 142 | 150.6 | -92.1 | -164.9 | 104.8 | 0 | 0 | 109.1 | | |
| 115 | A | 34.6 | Very low | 35.2 | Very low | 75 Ų | 75 | 136.5 Ų | 136.5 | 62% | 0.62 | 78% | 0.783 | S | S | * | * | | | cis | -176.1 | 161.1 | -10 | 0 | 0 | 0 | 0 | 0 | 108.2 | | |
| 116 | C | 31.3 | Very low | 35.5 | Very low | 125 Ų | 125 | 144.4 Ų | 144.4 | 85% | 0.845 | 79% | 0.788 | S | S | * | * | | | trans | 71.6 | 114 | 168.1 | -71.1 | 0 | 0 | 0 | 0 | 118.3 | | |
| 117 | N | 37.8 | Very low | 36.4 | Very low | 137 Ų | 137 | 146 Ų | 146 | 73% | 0.733 | 78% | 0.784 | S | S | * | * | | | cis | 59.7 | 134.9 | 45 | -132 | 27.3 | 0 | 0 | 0 | 113.2 | | |
| 118 | E | 41.2 | Very low | 36.2 | Very low | 159 Ų | 159 | 139.7 Ų | 139.7 | 74% | 0.743 | 78% | 0.778 | S | S | * | * | | | cis | -176.8 | 129.2 | 48.9 | -156.2 | 154.3 | 111 | 0 | 0 | 106.4 | | |
| 119 | D | 36.8 | Very low | 36 | Very low | 123 Ų | 123 | 138.8 Ų | 138.8 | 66% | 0.658 | 78% | 0.78 | S | S | * | * | | | | 89.5 | 126.3 | 87.1 | -154.7 | -107.7 | 0 | 0 | 0 | 117.9 | | |
| 120 | N | 38.1 | Very low | 36.1 | Very low | 125 Ų | 125 | 141.1 Ų | 141.1 | 67% | 0.668 | 78% | 0.784 | S | S | * | * | | | trans | 31 | 142.3 | 150.3 | -58.1 | -34 | 0 | 0 | 0 | 124.7 | | |
| 121 | T | 33.9 | Very low | 36.3 | Very low | 148 Ų | 148 | 138.6 Ų | 138.6 | 91% | 0.908 | 78% | 0.778 | S | S | * | * | | | | -151.7 | 133.3 | 121.9 | -31.6 | 0 | 0 | 0 | 0 | 113.8 | | |
| 122 | E | 38.5 | Very low | 35.3 | Very low | 169 Ų | 169 | 139.9 Ų | 139.9 | 79% | 0.79 | 77% | 0.773 | S | S | * | * | | | trans | -58.3 | 155.5 | 171.6 | 176.3 | -176.8 | 112.6 | 0 | 0 | 115.6 | | |
| 123 | K | 36.1 | Very low | 35.3 | Very low | 178 Ų | 178 | 142.4 Ų | 142.4 | 77% | 0.774 | 78% | 0.779 | S | S | * | * | | | | 150.3 | 115.6 | 120.7 | -160.5 | 166.5 | -172.2 | 175.2 | 0 | 117.6 | | |
| 124 | D | 37 | Very low | 35.3 | Very low | 130 Ų | 130 | 143.8 Ų | 143.8 | 70% | 0.695 | 78% | 0.777 | S | S | * | * | | | trans | 53.3 | 149 | 132.6 | -154.9 | -133.9 | 0 | 0 | 0 | 124.8 | | |
| 125 | K | 34.7 | Very low | 35.4 | Very low | 182 Ų | 182 | 141.7 Ų | 141.7 | 79% | 0.791 | 78% | 0.78 | S | S | * | * | | | trans | 88.4 | 98.9 | 158.6 | -92.9 | 165.7 | -170.5 | -165.7 | 0 | 122.7 | | |
| 126 | R | 37.1 | Very low | 35.2 | Very low | 245 Ų | 245 | 141.2 Ų | 141.2 | 93% | 0.925 | 78% | 0.783 | S | S | * | * | | | trans | 21.8 | 157.5 | 131.8 | -75.9 | -167.4 | -171.9 | -132.8 | 2.2 | 122.9 | | |
| 127 | P | 50.2 | Low | 35.6 | Very low | 118 Ų | 118 | 143.5 Ų | 143.5 | 77% | 0.766 | 79% | 0.786 | S | S | * | * | | | trans | -103.9 | 154 | -138.4 | 39.4 | -33.5 | 0 | 0 | 0 | 115.4 | | |
| 128 | A | 30.4 | Very low | 35.7 | Very low | 89 Ų | 89 | 145.3 Ų | 145.3 | 74% | 0.736 | 79% | 0.792 | S | S | * | * | | | trans | -175.3 | 123.4 | 153.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 129 | T | 30 | Very low | 35.4 | Very low | 136 Ų | 136 | 148.3 Ų | 148.3 | 83% | 0.834 | 80% | 0.796 | S | S | * | * | | | | 84.1 | 123.7 | 128.5 | -44.1 | 0 | 0 | 0 | 0 | 121.6 | | |
| 130 | S | 31.7 | Very low | 35.1 | Very low | 122 Ų | 122 | 149 Ų | 149 | 85% | 0.853 | 80% | 0.8 | S | S | * | * | | | trans | 83.6 | 124.1 | 155 | -156 | 0 | 0 | 0 | 0 | 117.1 | | |
| 131 | G | 33.3 | Very low | 35.1 | Very low | 72 Ų | 72 | 151.3 Ų | 151.3 | 74% | 0.742 | 81% | 0.807 | S | S | * | * | | | cis | -147.5 | 161.2 | 27 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 132 | H | 36.1 | Very low | 35.1 | Very low | 153 Ų | 153 | 148.5 Ų | 148.5 | 71% | 0.708 | 79% | 0.794 | S | S | * | * | | | trans | -66.9 | 142.3 | 178.4 | -98.3 | 157.1 | 0 | 0 | 0 | 113.8 | | |
| 133 | T | 30.6 | Very low | 35.1 | Very low | 148 Ų | 148 | 147.8 Ų | 147.8 | 91% | 0.908 | 79% | 0.793 | S | S | * | * | | | | -144.9 | 110.3 | 125.5 | -9.5 | 0 | 0 | 0 | 0 | 109.4 | | |
| 134 | R | 32.4 | Very low | 35.2 | Very low | 205 Ų | 205 | 149 Ų | 149 | 77% | 0.774 | 79% | 0.793 | S | S | * | * | | | trans | -112 | 110.7 | 175.7 | 172.5 | -173.5 | -73.1 | 167 | -1.7 | 107.3 | | |
| 135 | C | 31.6 | Very low | 35.4 | Very low | 136 Ų | 136 | 147.9 Ų | 147.9 | 92% | 0.919 | 79% | 0.793 | S | S | * | * | | | trans | -108 | 126.5 | 151.3 | -74.6 | 0 | 0 | 0 | 0 | 104.7 | | |
| 136 | G | 31.4 | Very low | 35.8 | Very low | 65 Ų | 65 | 145.7 Ų | 145.7 | 67% | 0.67 | 79% | 0.79 | S | S | * | * | | | cis | 144.3 | 58.3 | 20.4 | 0 | 0 | 0 | 0 | 0 | 106 | M138 | G136-M138 PolarHBondContact O-N 3.26Š|
| 137 | L | 38.4 | Very low | 35.8 | Very low | 174 Ų | 174 | 139 Ų | 139 | 91% | 0.911 | 78% | 0.778 | S | S | * | * | | | trans | -75 | 98.7 | 174 | -118 | 154.5 | 0 | 0 | 0 | 107 | R139 | L137-R139 PolarHBondContact O-N 2.89Š|
| 138 | M | 40.3 | Very low | 35.2 | Very low | 174 Ų | 174 | 138.6 Ų | 138.6 | 86% | 0.857 | 78% | 0.778 | S | S | * | * | | | trans | -70.9 | 110.8 | 168.8 | -75.5 | -91.3 | 93.8 | 0 | 0 | 108.2 | G136 D140 | G136-M138 PolarHBondContact O-N 3.26Å; M138-D140 PolarHBondContact O-N 3.08Å |
| 139 | R | 35.8 | Very low | 35.8 | Very low | 222 Ų | 222 | 139.5 Ų | 139.5 | 84% | 0.838 | 79% | 0.785 | S | S | * | * | | | trans | -60.5 | 116.3 | 148.1 | -87.1 | 177.2 | 158.9 | 97.1 | -2.9 | 106.9 | L137 | L137-R139 PolarHBondContact O-N 2.89Š|
| 140 | D | 29.3 | Very low | 36.7 | Very low | 137 Ų | 137 | 136.7 Ų | 136.7 | 73% | 0.733 | 78% | 0.783 | S | S | * | * | | | trans | -90.8 | 108.1 | 152.2 | -156.9 | -87.1 | 0 | 0 | 0 | 107.3 | M138 S142 | M138-D140 PolarHBondContact O-N 3.08Å; D140-S142 PolarHBondContact OD1-N 3.5Å; D140-S142 PolarHBondContact OD1-OG 3Å |
| 141 | Q | 37.5 | Very low | 37.1 | Very low | 175 Ų | 175 | 139.5 Ų | 139.5 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | | | trans | -110.2 | 107.5 | 155.7 | -84.2 | -148.2 | 101.5 | 0 | 0 | 106.6 | | |
| 142 | S | 35.8 | Very low | 37.6 | Very low | 89 Ų | 89 | 144.3 Ų | 144.3 | 62% | 0.622 | 79% | 0.791 | S | S | * | * | | | trans | -137.6 | 90.3 | 153.2 | 57.7 | 0 | 0 | 0 | 0 | 110.1 | D140 | D140-S142 PolarHBondContact OD1-N 3.5Å; D140-S142 PolarHBondContact OD1-OG 3Å |
| 143 | I | 38.4 | Very low | 37.7 | Very low | 153 Ų | 153 | 142.9 Ų | 142.9 | 79% | 0.785 | 79% | 0.793 | S | S | * | * | | | trans | 46.2 | 99.1 | 138.7 | -65.5 | 140.2 | 0 | 0 | 0 | 116.3 | P145 | I143-P145 WeakPolarHBondContact O-CD 3.43Š|
| 144 | W | 38.1 | Very low | 38.5 | Very low | 205 Ų | 205 | 145.2 Ų | 145.2 | 78% | 0.777 | 79% | 0.785 | S | S | * | * | | | trans | -69.8 | 120.5 | 157.3 | -129.5 | 88.4 | 0 | 0 | 0 | 109 | P147 | W144-P147 HydrophobicContact CZ3-CG 4.48Š|
| 145 | P | 39.9 | Very low | 38.5 | Very low | 105 Ų | 105 | 141.5 Ų | 141.5 | 68% | 0.682 | 79% | 0.785 | S | S | * | * | | | trans | -78.8 | 115.4 | 155.7 | -0.8 | 19.7 | 0 | 0 | 0 | 107.2 | I143 P147 | I143-P145 WeakPolarHBondContact O-CD 3.43Å; P145-P147 VanDerWaalsContact O-CD 3.27Å; P145-P147 WeakPolarHBondContact O-CD 3.46Å |
| 146 | N | 43 | Very low | 38.8 | Very low | 136 Ų | 136 | 141.1 Ų | 141.1 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | | | trans | -58.4 | 122.1 | 162.5 | -96.8 | -31.3 | 0 | 0 | 0 | 108.8 | S148 | N146-S148 PolarHBondContact O-N 2.84Š|
| 147 | P | 37.3 | Very low | 39 | Very low | 105 Ų | 105 | 143.6 Ų | 143.6 | 68% | 0.682 | 77% | 0.774 | S | S | * | * | | | trans | -81.7 | 103.7 | 156.6 | 27.3 | -15.9 | 0 | 0 | 0 | 107.2 | W144 P145 | W144-P147 HydrophobicContact CZ3-CG 4.48Å; P145-P147 VanDerWaalsContact O-CD 3.27Å; P145-P147 WeakPolarHBondContact O-CD 3.46Å |
| 148 | S | 38.5 | Very low | 38.7 | Very low | 110 Ų | 110 | 144.6 Ų | 144.6 | 77% | 0.769 | 77% | 0.774 | S | S | * | * | | | trans | -47.7 | 144.9 | 162.8 | -50.7 | 0 | 0 | 0 | 0 | 110.6 | N146 | N146-S148 PolarHBondContact O-N 2.84Š|
| 149 | A | 43.5 | Very low | 38.5 | Very low | 107 Ų | 107 | 147.7 Ų | 147.7 | 88% | 0.884 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -36.5 | 134.6 | 180 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 150 | G | 48.5 | Very low | 38.4 | Very low | 77 Ų | 77 | 144.7 Ų | 144.7 | 79% | 0.794 | 78% | 0.776 | S | S | * | * | | | trans | 100.8 | 76.3 | 149.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | | |
| 151 | E | 39.2 | Very low | 38.7 | Very low | 181 Ų | 181 | 144 Ų | 144 | 85% | 0.846 | 78% | 0.779 | S | S | * | * | | | trans | -142.7 | 109.5 | 146.4 | -139.3 | 179 | 150.2 | 0 | 0 | 109.8 | V153 | E151-V153 PolarHBondContact O-N 3.39Š|
| 152 | L | 44.4 | Very low | 38.4 | Very low | 174 Ų | 174 | 144.3 Ų | 144.3 | 91% | 0.911 | 78% | 0.78 | S | S | * | * | | | trans | -63.1 | 97.7 | 168.8 | -77.7 | 145.9 | 0 | 0 | 0 | 107.7 | R154 | L152-R154 PolarHBondContact O-N 3.17Š|
| 153 | V | 38 | Very low | 38 | Very low | 122 Ų | 122 | 148 Ų | 148 | 74% | 0.739 | 79% | 0.792 | S | S | * | * | | | trans | -71.8 | 88.6 | 169.1 | -171.4 | 0 | 0 | 0 | 0 | 107.8 | E151 T155 | E151-V153 PolarHBondContact O-N 3.39Å; V153-T155 HydrophobicContact CG1-CG2 4.13Å; V153-T155 PolarHBondContact O-N 3.2Å; V153-T155 VanDerWaalsContact O-N 3.17Å |
| 154 | R | 46.7 | Very low | 37.7 | Very low | 197 Ų | 197 | 149.6 Ų | 149.6 | 74% | 0.743 | 80% | 0.796 | S | S | * | * | | | trans | -73.8 | 90.1 | 168.5 | -172.9 | -167.5 | -170.3 | 171.4 | 4.8 | 107.6 | L152 Q156 | L152-R154 PolarHBondContact O-N 3.17Å; R154-Q156 HydrophobicContact CG-CB 4.3Å; R154-Q156 PolarHBondContact O-N 3.13Å |
| 155 | T | 33.9 | Very low | 37.3 | Very low | 128 Ų | 128 | 146.3 Ų | 146.3 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | | | trans | -75.8 | 78.7 | 164.8 | 44 | 0 | 0 | 0 | 0 | 109.2 | V153 | V153-T155 HydrophobicContact CG1-CG2 4.13Å; V153-T155 PolarHBondContact O-N 3.2Å; V153-T155 VanDerWaalsContact O-N 3.17Å |
| 156 | Q | 36.9 | Very low | 36.9 | Very low | 128 Ų | 128 | 146.6 Ų | 146.6 | 60% | 0.598 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 125.9 | 163 | -171.9 | -178.7 | 94.4 | 0 | 0 | 107.3 | R154 E158 | R154-Q156 HydrophobicContact CG-CB 4.3Å; R154-Q156 PolarHBondContact O-N 3.13Å; Q156-E158 PolarHBondContact O-N 3.47Å |
| 157 | P | 36.4 | Very low | 36.5 | Very low | 116 Ų | 116 | 144.7 Ų | 144.7 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 121.9 | 174.8 | 24.7 | -29.8 | 0 | 0 | 0 | 109.5 | R159 | P157-R159 PolarHBondContact O-N 3.36Š|
| 158 | E | 32.2 | Very low | 36.1 | Very low | 195 Ų | 195 | 148.8 Ų | 148.8 | 91% | 0.911 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 123.7 | -179.4 | -162.9 | 164.6 | 93.4 | 0 | 0 | 109.9 | Q156 | Q156-E158 PolarHBondContact O-N 3.47Š|
| 159 | R | 36.4 | Very low | 35.8 | Very low | 239 Ų | 239 | 151.5 Ų | 151.5 | 90% | 0.902 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -68 | 136 | 176.5 | -88.7 | -172.8 | 173.2 | 125.5 | -2.2 | 110.4 | P157 | P157-R159 PolarHBondContact O-N 3.36Š|
| 160 | L | 32.6 | Very low | 35.7 | Very low | 160 Ų | 160 | 151.5 Ų | 151.5 | 84% | 0.838 | 81% | 0.808 | S | S | * | * | | | trans | -42 | 143.7 | 167.2 | -107.5 | 96.5 | 0 | 0 | 0 | 113.4 | Q162 | L160-Q162 PolarHBondContact O-N 2.96Š|
| 161 | P | 34.6 | Very low | 34.7 | Very low | 121 Ų | 121 | 151 Ų | 151 | 79% | 0.786 | 80% | 0.803 | S | S | * | * | | | trans | -65.7 | 121.3 | 162.5 | -18.2 | 31.5 | 0 | 0 | 0 | 111.3 | L163 | P161-L163 PolarHBondContact O-N 3.4Š|
| 162 | Q | 32.7 | Very low | 34.5 | Very low | 182 Ų | 182 | 151.8 Ų | 151.8 | 85% | 0.85 | 80% | 0.804 | S | S | * | * | | | trans | -65.1 | 121.7 | 168.3 | -82.6 | -163.4 | -68.4 | 0 | 0 | 110.7 | L160 Q164 | L160-Q162 PolarHBondContact O-N 2.96Å; Q162-Q164 PolarHBondContact O-N 3.45Å |
| 163 | L | 27 | Very low | 33.9 | Very low | 167 Ų | 167 | 152.3 Ų | 152.3 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | | | trans | -71.5 | 112 | 159.6 | -116.2 | 112.2 | 0 | 0 | 0 | 108.7 | P161 T165 | P161-L163 PolarHBondContact O-N 3.4Å; L163-T165 PolarHBondContact O-N 3.46Å |
| 164 | Q | 31.3 | Very low | 33.6 | Very low | 187 Ų | 187 | 154.6 Ų | 154.6 | 87% | 0.874 | 80% | 0.804 | S | S | * | * | | | trans | -74 | 119.1 | 174.5 | -69.5 | -177.8 | -55.6 | 0 | 0 | 110.2 | Q162 | Q162-Q164 PolarHBondContact O-N 3.45Š|
| 165 | T | 30.3 | Very low | 32.9 | Very low | 136 Ų | 136 | 151.4 Ų | 151.4 | 83% | 0.834 | 81% | 0.807 | S | S | * | * | | | trans | -113.2 | 112.1 | 160.6 | -56.6 | 0 | 0 | 0 | 0 | 107.8 | L163 | L163-T165 PolarHBondContact O-N 3.46Š|
| 166 | S | 32.3 | Very low | 32.9 | Very low | 110 Ų | 110 | 148.7 Ų | 148.7 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | | | trans | -162.6 | 99.6 | 163 | -162.2 | 0 | 0 | 0 | 0 | 107 | | |
| 167 | A | 33.4 | Very low | 32.9 | Very low | 97 Ų | 97 | 151.7 Ų | 151.7 | 80% | 0.802 | 82% | 0.815 | S | S | * | * | | | | 57.4 | 85.3 | 84.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 168 | Q | 29.4 | Very low | 33.3 | Very low | 191 Ų | 191 | 152.9 Ų | 152.9 | 89% | 0.893 | 81% | 0.813 | S | S | * | * | | | trans | -102.1 | 124.5 | 172.5 | -175.4 | 176 | -6.2 | 0 | 0 | 109.1 | | |
| 169 | E | 32.2 | Very low | 33.9 | Very low | 167 Ų | 167 | 152.8 Ų | 152.8 | 78% | 0.78 | 81% | 0.81 | S | S | * | * | | | trans | -141.7 | 166.1 | 167.9 | -109.1 | -58.5 | 99.6 | 0 | 0 | 106.8 | | |
| 170 | P | 40.4 | Very low | 33.8 | Very low | 107 Ų | 107 | 149.5 Ų | 149.5 | 70% | 0.695 | 81% | 0.81 | S | S | * | * | | | | -108 | 164.4 | -104.1 | 39.6 | -30.2 | 0 | 0 | 0 | 113 | | |
| 171 | G | 29 | Very low | 34 | Very low | 65 Ų | 65 | 145.9 Ų | 145.9 | 67% | 0.67 | 81% | 0.812 | S | S | * | * | | | trans | -146.7 | 96.8 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 172 | K | 34.2 | Very low | 34.1 | Very low | 199 Ų | 199 | 143 Ų | 143 | 87% | 0.865 | 80% | 0.803 | S | S | * | * | | | trans | 38.5 | 118 | 138.7 | 62.1 | -161.3 | 172.6 | -169.1 | 0 | 120.8 | | |
| 173 | E | 32.1 | Very low | 34.3 | Very low | 184 Ų | 184 | 143.1 Ų | 143.1 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | | | | 63.8 | 113.5 | 128.6 | -158.8 | 171.7 | 138.5 | 0 | 0 | 118.7 | | |
| 174 | E | 31 | Very low | 34.9 | Very low | 171 Ų | 171 | 140.1 Ų | 140.1 | 80% | 0.799 | 79% | 0.792 | S | S | * | * | | | | 176.8 | 128.3 | 106.5 | -168.9 | 177.5 | 133.8 | 0 | 0 | 111.9 | | |
| 175 | T | 33.5 | Very low | 35.2 | Very low | 130 Ų | 130 | 141.9 Ų | 141.9 | 80% | 0.798 | 79% | 0.791 | S | S | * | * | | | trans | 40.6 | 118.5 | 147.4 | -49.1 | 0 | 0 | 0 | 0 | 121.7 | | |
| 176 | G | 32.4 | Very low | 36.2 | Very low | 70 Ų | 70 | 143.9 Ų | 143.9 | 72% | 0.722 | 79% | 0.793 | S | S | * | * | | | | 141.2 | 125.9 | 125.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | | |
| 177 | K | 36.6 | Very low | 36.8 | Very low | 192 Ų | 192 | 144.6 Ų | 144.6 | 84% | 0.835 | 80% | 0.798 | S | S | * | * | | | trans | 103.2 | 84.7 | 145 | -140 | 166.6 | -173 | 179 | 0 | 117.7 | | |
| 178 | I | 45.3 | Very low | 37.2 | Very low | 141 Ų | 141 | 148 Ų | 148 | 72% | 0.723 | 80% | 0.803 | S | S | * | * | | | trans | 29.7 | 121 | 132.4 | 61.1 | 178.1 | 0 | 0 | 0 | 118.9 | | |
| 179 | K | 44.9 | Very low | 37.6 | Very low | 192 Ų | 192 | 142.7 Ų | 142.7 | 84% | 0.835 | 80% | 0.799 | S | S | * | * | | | | 170.6 | 112.9 | 102.2 | 54.5 | -155.9 | 155.4 | 171.3 | 0 | 113.8 | | |
| 180 | N | 34.8 | Very low | 38.2 | Very low | 171 Ų | 171 | 143.2 Ų | 143.2 | 91% | 0.914 | 81% | 0.807 | S | S | * | * | | | trans | 40.2 | 128.8 | 134 | -58.6 | -22.5 | 0 | 0 | 0 | 122.7 | | |
| 181 | G | 37.3 | Very low | 38.1 | Very low | 84 Ų | 84 | 141.8 Ų | 141.8 | 87% | 0.866 | 81% | 0.812 | S | S | * | * | | | trans | 121.9 | 110.9 | 151.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | | |
| 182 | G | 35 | Very low | 38.8 | Very low | 59 Ų | 59 | 146.1 Ų | 146.1 | 61% | 0.608 | 82% | 0.818 | S | S | * | * | | | cis | 148.7 | 113.6 | 7.9 | 0 | 0 | 0 | 0 | 0 | 106.9 | | |
| 183 | H | 38.7 | Very low | 39.5 | Very low | 185 Ų | 185 | 141.9 Ų | 141.9 | 86% | 0.856 | 81% | 0.811 | S | S | * | * | | | trans | 51.8 | 142 | 147.4 | -57.9 | -66.8 | 0 | 0 | 0 | 120.4 | | |
| 184 | T | 38.9 | Very low | 39.8 | Very low | 105 Ų | 105 | 142.1 Ų | 142.1 | 64% | 0.644 | 81% | 0.811 | S | S | * | * | | | cis | -176.6 | 143.4 | -2.9 | -73.5 | 0 | 0 | 0 | 0 | 107.2 | | |
| 185 | R | 37.1 | Very low | 39.9 | Very low | 223 Ų | 223 | 137.6 Ų | 137.6 | 84% | 0.842 | 81% | 0.811 | S | S | * | * | | | trans | 57.3 | 120.4 | 151.7 | -81.8 | 172.9 | 152.4 | -130.6 | -1.4 | 124.1 | | |
| 186 | M | 51.9 | Low | 40 | Very low | 179 Ų | 179 | 136.4 Ų | 136.4 | 88% | 0.882 | 81% | 0.814 | S | S | * | * | | | | 32.6 | 125 | 104.4 | -53.8 | -94.8 | 127.4 | 0 | 0 | 119.6 | | |
| 187 | S | 44 | Very low | 40.3 | Very low | 124 Ų | 124 | 143 Ų | 143 | 87% | 0.867 | 82% | 0.823 | S | S | * | * | | | trans | -159.9 | 124.6 | 136.5 | -170.8 | 0 | 0 | 0 | 0 | 112.6 | | |
| 188 | N | 41.8 | Very low | 40.3 | Very low | 170 Ų | 170 | 142.9 Ų | 142.9 | 91% | 0.909 | 83% | 0.825 | S | S | * | * | | | trans | -68.5 | 152.4 | 162.7 | -109.7 | 12.5 | 0 | 0 | 0 | 110.5 | | |
| 189 | G | 38.9 | Very low | 39.7 | Very low | 78 Ų | 78 | 141.8 Ų | 141.8 | 80% | 0.804 | 83% | 0.825 | S | S | * | * | | | trans | -165.5 | 102.2 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 190 | N | 45.5 | Very low | 39 | Very low | 178 Ų | 178 | 137.6 Ų | 137.6 | 95% | 0.952 | 82% | 0.82 | S | S | * | * | | | trans | -81.5 | 144.5 | 173.1 | -136.3 | 47.7 | 0 | 0 | 0 | 109.5 | | |
| 191 | G | 37.9 | Very low | 38.9 | Very low | 77 Ų | 77 | 135 Ų | 135 | 79% | 0.794 | 81% | 0.81 | S | S | * | * | | | trans | -177.4 | 106.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 192 | I | 43.9 | Very low | 38.7 | Very low | 156 Ų | 156 | 138.5 Ų | 138.5 | 80% | 0.8 | 80% | 0.804 | S | S | * | * | | | trans | -101.2 | 147.5 | 160.5 | -45.3 | 170.6 | 0 | 0 | 0 | 106.1 | | |
| 193 | P | 48.8 | Very low | 38.6 | Very low | 110 Ų | 110 | 140.6 Ų | 140.6 | 71% | 0.714 | 80% | 0.801 | S | S | * | * | | | | -146.1 | 152.5 | 97.5 | 20.4 | 2.8 | 0 | 0 | 0 | 116.4 | | |
| 194 | H | 38.6 | Very low | 38.5 | Very low | 189 Ų | 189 | 138.1 Ų | 138.1 | 88% | 0.875 | 79% | 0.789 | S | S | * | * | | | trans | 41.2 | 135.5 | 146.2 | -60.5 | -74.4 | 0 | 0 | 0 | 120 | | |
| 195 | G | 32.2 | Very low | 38.2 | Very low | 76 Ų | 76 | 141.2 Ų | 141.2 | 78% | 0.784 | 79% | 0.794 | S | S | * | * | | | cis | 132.9 | 108.7 | 22.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | | |
| 196 | A | 35.1 | Very low | 38.3 | Very low | 106 Ų | 106 | 138.7 Ų | 138.7 | 88% | 0.876 | 80% | 0.796 | S | S | * | * | | | trans | -160.2 | 137.2 | 166.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | | |
| 197 | K | 40.1 | Very low | 37.3 | Very low | 209 Ų | 209 | 135.8 Ų | 135.8 | 91% | 0.909 | 79% | 0.793 | S | S | * | * | | | trans | -78.9 | 141.7 | -174.1 | -56.2 | 168.4 | 178.6 | 179.8 | 0 | 110.7 | | |
| 198 | H | 36.6 | Very low | 37 | Very low | 188 Ų | 188 | 134.1 Ų | 134.1 | 87% | 0.87 | 79% | 0.787 | S | S | * | * | | | trans | -154.3 | 154.4 | 145.7 | -146.9 | -102.3 | 0 | 0 | 0 | 113.5 | | |
| 199 | V | 31.1 | Very low | 37.1 | Very low | 118 Ų | 118 | 132.2 Ų | 132.2 | 72% | 0.715 | 78% | 0.783 | S | S | * | * | | | trans | -95.3 | 143.8 | -161.5 | 166.9 | 0 | 0 | 0 | 0 | 111.9 | | |
| 200 | S | 31.7 | Very low | 37 | Very low | 105 Ų | 105 | 134.3 Ų | 134.3 | 73% | 0.734 | 78% | 0.78 | S | S | * | * | | | trans | 14.1 | 151 | 140.4 | -153.3 | 0 | 0 | 0 | 0 | 123.1 | | |
| 201 | V | 32.5 | Very low | 36.8 | Very low | 117 Ų | 117 | 132 Ų | 132 | 71% | 0.709 | 78% | 0.778 | S | S | * | * | | | trans | 102.7 | 101.3 | 152.8 | -174.3 | 0 | 0 | 0 | 0 | 118.7 | | |
| 202 | E | 31.6 | Very low | 37 | Very low | 156 Ų | 156 | 136.4 Ų | 136.4 | 73% | 0.729 | 78% | 0.778 | S | S | * | * | | | | 70.5 | 131.7 | 125 | -135 | 177.6 | 140.1 | 0 | 0 | 123.7 | | |
| 203 | N | 33.5 | Very low | 37 | Very low | 103 Ų | 103 | 137.4 Ų | 137.4 | 55% | 0.551 | 78% | 0.776 | S | S | * | * | | | | 126.4 | 131 | 121.8 | -107.6 | -39.8 | 0 | 0 | 0 | 120.5 | | |
| 204 | H | 35.9 | Very low | 36.7 | Very low | 133 Ų | 133 | 139.5 Ų | 139.5 | 62% | 0.616 | 78% | 0.779 | S | S | * | * | | | trans | 92.9 | 106.8 | 143 | -65.6 | -34.9 | 0 | 0 | 0 | 124.4 | | |
| 205 | K | 34.5 | Very low | 37.2 | Very low | 170 Ų | 170 | 138.6 Ų | 138.6 | 74% | 0.739 | 78% | 0.775 | S | S | * | * | | | | 70.4 | 130.3 | 127 | -59.7 | 163.3 | -171.5 | -93.2 | 0 | 116.9 | | |
| 206 | I | 38.9 | Very low | 37.8 | Very low | 171 Ų | 171 | 145.6 Ų | 145.6 | 88% | 0.877 | 78% | 0.777 | S | S | * | * | | | | -161.2 | 146 | 77 | -70.1 | 132 | 0 | 0 | 0 | 111.1 | | |
| 207 | S | 30.8 | Very low | 37.9 | Very low | 118 Ų | 118 | 149.5 Ų | 149.5 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | | | trans | -75.9 | 167.7 | -175.6 | -65.2 | 0 | 0 | 0 | 0 | 117.2 | | |
| 208 | A | 36.6 | Very low | 38.2 | Very low | 89 Ų | 89 | 147.6 Ų | 147.6 | 74% | 0.736 | 77% | 0.773 | S | S | * | * | | | trans | -56.5 | 176 | 178.1 | 0 | 0 | 0 | 0 | 0 | 118.2 | | |
| 209 | P | 44.4 | Very low | 38.1 | Very low | 130 Ų | 130 | 147.1 Ų | 147.1 | 84% | 0.844 | 77% | 0.77 | S | S | * | * | | | | -133.8 | 155.5 | 116.8 | 37.7 | -26.8 | 0 | 0 | 0 | 116 | | |
| 210 | V | 36.4 | Very low | 38.3 | Very low | 122 Ų | 122 | 146.1 Ų | 146.1 | 74% | 0.739 | 77% | 0.769 | S | S | * | * | | | trans | -55.1 | 138.8 | 176.7 | 162.7 | 0 | 0 | 0 | 0 | 114.7 | | |
| 211 | S | 40.8 | Very low | 38.5 | Very low | 129 Ų | 129 | 146.3 Ų | 146.3 | 90% | 0.902 | 77% | 0.77 | S | S | * | * | | | trans | -149.8 | 132.6 | 134.6 | -104.3 | 0 | 0 | 0 | 0 | 112.9 | | |
| 212 | Q | 43.3 | Very low | 38.7 | Very low | 170 Ų | 170 | 148.3 Ų | 148.3 | 79% | 0.794 | 78% | 0.776 | S | S | * | * | | | trans | -99.5 | 149.8 | -170 | -178.7 | -177.5 | -37.4 | 0 | 0 | 108.2 | | |
| 213 | K | 43.8 | Very low | 38.8 | Very low | 176 Ų | 176 | 146.1 Ų | 146.1 | 77% | 0.765 | 78% | 0.778 | S | S | * | * | | | trans | 115.1 | 116.3 | 143.5 | -149.9 | 175.8 | 176.9 | 178.7 | 0 | 118.1 | | |
| 214 | M | 42.5 | Very low | 38.5 | Very low | 155 Ų | 155 | 148 Ų | 148 | 76% | 0.764 | 79% | 0.793 | S | S | * | * | | | trans | 65.4 | 108.7 | 145.1 | 72.5 | -172.4 | -91.2 | 0 | 0 | 122.1 | | |
| 215 | H | 48.3 | Very low | 38.3 | Very low | 170 Ų | 170 | 147.8 Ų | 147.8 | 79% | 0.787 | 80% | 0.796 | S | S | * | * | | | | -173.8 | 149.5 | 95.5 | -154.8 | -130.1 | 0 | 0 | 0 | 111.5 | | |
| 216 | R | 45.3 | Very low | 38.6 | Very low | 223 Ų | 223 | 145.9 Ų | 145.9 | 84% | 0.842 | 79% | 0.794 | S | S | * | * | | | trans | -72.8 | 138.4 | -163 | -61.8 | 161.6 | 171.2 | -178.6 | -5.2 | 112.3 | | |
| 217 | K | 37 | Very low | 38.4 | Very low | 187 Ų | 187 | 143.6 Ų | 143.6 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | | | | 80.6 | 104.1 | 60.2 | -158.2 | 174 | -171.7 | -168.7 | 0 | 114.8 | | |
| 218 | I | 46.5 | Very low | 39.4 | Very low | 170 Ų | 170 | 145.1 Ų | 145.1 | 87% | 0.872 | 78% | 0.781 | S | S | * | * | | | trans | -144.9 | 92.7 | 134.4 | -35.6 | 173.8 | 0 | 0 | 0 | 108.3 | | |
| 219 | Q | 35.8 | Very low | 39.6 | Very low | 177 Ų | 177 | 146.3 Ų | 146.3 | 83% | 0.827 | 78% | 0.784 | S | S | * | * | | | trans | -130.5 | 109.4 | 151.7 | -96.6 | -144.1 | -48.4 | 0 | 0 | 106.1 | S221 | Q219-S221 PolarHBondContact O-N 3.47Š|
| 220 | S | 33.7 | Very low | 39.8 | Very low | 98 Ų | 98 | 149.4 Ų | 149.4 | 69% | 0.685 | 78% | 0.784 | S | S | * | * | | | trans | -77.5 | 107.5 | 171.8 | -172 | 0 | 0 | 0 | 0 | 107.7 | | |
| 221 | S | 36.3 | Very low | 40.5 | Very low | 109 Ų | 109 | 153.5 Ų | 153.5 | 76% | 0.762 | 79% | 0.792 | S | S | * | * | | | trans | -120.5 | 86.7 | 162.7 | 60.5 | 0 | 0 | 0 | 0 | 106.6 | Q219 S223 | Q219-S221 PolarHBondContact O-N 3.47Å; S221-S223 PolarHBondContact O-N 2.92Å; S221-S223 VanDerWaalsContact O-N 3.08Å |
| 222 | L | 36.5 | Very low | 40.5 | Very low | 159 Ų | 159 | 153 Ų | 153 | 83% | 0.832 | 79% | 0.789 | S | S | * | * | | | trans | -73.8 | 93.1 | 172.3 | -59 | 178.5 | 0 | 0 | 0 | 108.2 | | |
| 223 | S | 33.9 | Very low | 40.7 | Very low | 109 Ų | 109 | 154.1 Ų | 154.1 | 76% | 0.762 | 79% | 0.791 | S | S | * | * | | | trans | -101.6 | 104.6 | 159.1 | 167.6 | 0 | 0 | 0 | 0 | 106.6 | S221 N225 | S221-S223 PolarHBondContact O-N 2.92Å; S221-S223 VanDerWaalsContact O-N 3.08Å; S223-N225 PolarHBondContact O-N 3.13Å |
| 224 | V | 26.7 | Very low | 40.2 | Very low | 143 Ų | 143 | 151.7 Ų | 151.7 | 87% | 0.867 | 79% | 0.79 | S | S | * | * | | | trans | -81.4 | 105.2 | 172.6 | -89.9 | 0 | 0 | 0 | 0 | 108.8 | | |
| 225 | N | 33 | Very low | 40.2 | Very low | 128 Ų | 128 | 151.2 Ų | 151.2 | 68% | 0.684 | 79% | 0.791 | S | S | * | * | | | trans | -104.4 | 116.9 | 157.6 | -177 | 27.9 | 0 | 0 | 0 | 107.3 | S223 D227 | S223-N225 PolarHBondContact O-N 3.13Å; N225-D227 PolarHBondContact ND2-OD2 3.25Å |
| 226 | N | 40.5 | Very low | 39.6 | Very low | 131 Ų | 131 | 147.3 Ų | 147.3 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | | | trans | -113.3 | 86.8 | 178.9 | -169.4 | 0 | 0 | 0 | 0 | 109.6 | I228 | N226-I228 PolarHBondContact O-N 2.91Š|
| 227 | D | 34.4 | Very low | 39.3 | Very low | 123 Ų | 123 | 143.5 Ų | 143.5 | 66% | 0.658 | 79% | 0.789 | S | S | * | * | | | trans | -74.8 | 98.9 | 166 | -77.1 | -78.2 | 0 | 0 | 0 | 109.2 | N225 S229 | N225-D227 PolarHBondContact ND2-OD2 3.25Å; D227-S229 PolarHBondContact O-N 3.16Å |
| 228 | I | 51.7 | Low | 39.2 | Very low | 150 Ų | 150 | 143.7 Ų | 143.7 | 77% | 0.769 | 79% | 0.791 | S | S | * | * | | | trans | -59.2 | 96.8 | 170.5 | -71.4 | 153.7 | 0 | 0 | 0 | 109 | N226 | N226-I228 PolarHBondContact O-N 2.91Š|
| 229 | S | 42 | Very low | 38.6 | Very low | 113 Ų | 113 | 140.9 Ų | 140.9 | 79% | 0.79 | 79% | 0.786 | S | S | * | * | | | trans | -99.1 | 111.9 | 170.2 | 58.9 | 0 | 0 | 0 | 0 | 110.5 | D227 K231 | D227-S229 PolarHBondContact O-N 3.16Å; S229-K231 PolarHBondContact O-N 3.19Å |
| 230 | K | 48.1 | Very low | 38.8 | Very low | 196 Ų | 196 | 138 Ų | 138 | 85% | 0.852 | 78% | 0.783 | S | S | * | * | | | trans | -49.2 | 117.3 | 176.6 | -65.4 | 161.2 | 174.1 | 165.6 | 0 | 112.1 | | |
| 231 | K | 50.4 | Low | 39 | Very low | 208 Ų | 208 | 142.8 Ų | 142.8 | 90% | 0.904 | 79% | 0.791 | S | S | * | * | | | | 158.8 | 106 | 129.6 | 61.5 | -157.6 | 169.2 | -176 | 0 | 111 | S229 | S229-K231 PolarHBondContact O-N 3.19Š|
| 232 | S | 41.4 | Very low | 39 | Very low | 119 Ų | 119 | 141.3 Ų | 141.3 | 83% | 0.832 | 79% | 0.786 | S | S | * | * | | | trans | -152.5 | 103.7 | 147.4 | -172 | 0 | 0 | 0 | 0 | 107.7 | | |
| 233 | K | 46 | Very low | 39.2 | Very low | 192 Ų | 192 | 138.9 Ų | 138.9 | 84% | 0.835 | 79% | 0.788 | S | S | * | * | | | trans | -96.3 | 97.5 | 170.7 | -179.4 | 176.8 | 178.1 | 112.3 | 0 | 106 | | |
| 234 | V | 33.7 | Very low | 39.6 | Very low | 125 Ų | 125 | 136.5 Ų | 136.5 | 76% | 0.758 | 77% | 0.772 | S | S | * | * | | | trans | -138.5 | 125.7 | 157 | 129.2 | 0 | 0 | 0 | 0 | 106.6 | A236 | V234-A236 PolarHBondContact O-N 3.42Š|
| 235 | N | 42.4 | Very low | 40.7 | Very low | 146 Ų | 146 | 131.8 Ų | 131.8 | 78% | 0.781 | 75% | 0.745 | S | S | * | * | | | trans | -72.3 | 119.6 | -178.4 | -53.4 | -61.9 | 0 | 0 | 0 | 108.5 | | |
| 236 | A | 35.7 | Very low | 41.5 | Very low | 88 Ų | 88 | 130.7 Ų | 130.7 | 73% | 0.727 | 75% | 0.745 | S | S | * | * | | | trans | -132.3 | 103 | 159 | 0 | 0 | 0 | 0 | 0 | 107.1 | V234 F238 | V234-A236 PolarHBondContact O-N 3.42Å; A236-F238 VanDerWaalsContact C-N 3.25Å; A236-F238 PolarHBondContact O-N 3.24Å |
| 237 | V | 39.7 | Very low | 42 | Very low | 143 Ų | 143 | 130.9 Ų | 130.9 | 87% | 0.867 | 74% | 0.741 | S | S | * | * | | | trans | -71 | 89.3 | 164.9 | 169.4 | 0 | 0 | 0 | 0 | 106.2 | | |
| 238 | F | 34.3 | Very low | 42.7 | Very low | 191 Ų | 191 | 128.5 Ų | 128.5 | 84% | 0.838 | 73% | 0.729 | S | S | * | * | | | trans | -158.2 | 99.7 | 148.6 | -113.8 | -85.9 | 0 | 0 | 0 | 105 | A236 P240 | A236-F238 VanDerWaalsContact C-N 3.25Å; A236-F238 PolarHBondContact O-N 3.24Å; F238-P240 WeakPolarHBondContact O-CD 3.47Å |
| 239 | S | 35.1 | Very low | 42.9 | Very low | 110 Ų | 110 | 124.2 Ų | 124.2 | 77% | 0.769 | 71% | 0.712 | S | S | * | * | | | trans | -91.7 | 108 | 171.6 | -87.1 | 0 | 0 | 0 | 0 | 108.9 | K241 | S239-K241 VanDerWaalsContact C-N 3.3Š|
| 240 | P | 39.8 | Very low | 43.5 | Very low | 118 Ų | 118 | 120.7 Ų | 120.7 | 77% | 0.766 | 69% | 0.687 | S | S | * | * | | | trans | -86.2 | 82.9 | 134.7 | 16.4 | 0.1 | 0 | 0 | 0 | 106.3 | F238 A242 | F238-P240 WeakPolarHBondContact O-CD 3.47Å; P240-A242 PolarHBondContact O-N 3.12Å |
| 241 | K | 37.1 | Very low | 44.4 | Very low | 198 Ų | 198 | 115 Ų | 115 | 86% | 0.861 | 67% | 0.668 | S | S | * | * | | | trans | -82.8 | 72.9 | 167.3 | -165.5 | -175.6 | 177.3 | 76 | 0 | 107.9 | S239 | S239-K241 VanDerWaalsContact C-N 3.3Š|
| 242 | A | 37.2 | Very low | 44.9 | Very low | 78 Ų | 78 | 110.9 Ų | 110.9 | 65% | 0.645 | 65% | 0.652 | S | S | * | * | | | trans | -131 | 88.5 | 152.2 | 0 | 0 | 0 | 0 | 0 | 105.1 | P240 S244 | P240-A242 PolarHBondContact O-N 3.12Å; A242-S244 PolarHBondContact O-N 3.14Å |
| 243 | A | 39.6 | Very low | 45.8 | Very low | 107 Ų | 107 | 105.7 Ų | 105.7 | 88% | 0.884 | 62% | 0.615 | S | S | * | * | | | trans | -70 | 76.1 | 153 | 0 | 0 | 0 | 0 | 0 | 105.2 | S245 | A243-S245 PolarHBondContact O-N 3.29Š|
| 244 | S | 43.2 | Very low | 47 | Very low | 60 Ų | 60 | 98.5 Ų | 98.5 | 42% | 0.42 | 59% | 0.585 | S | S | . | * | | | trans | -60.3 | 129.8 | 161.2 | 67.3 | 0 | 0 | 0 | 0 | 104.7 | A242 | A242-S244 PolarHBondContact O-N 3.14Š|
| 245 | S | 49.2 | Very low | 48.9 | Very low | 43 Ų | 43 | 97.5 Ų | 97.5 | 30% | 0.301 | 58% | 0.576 | S | S | . | * | | | trans | -58.8 | 160.6 | 175.2 | 85.6 | 0 | 0 | 0 | 0 | 108.5 | A243 E247 D248 | A243-S245 PolarHBondContact O-N 3.29Å; S245-E247 VanDerWaalsContact CB-OE2 3.23Å; S245-E247 WeakPolarHBondContact CB-OE2 3.38Å; S245-E247 PolarHBondContact O-N 3.35Å; S245-E247 PolarHBondContact OG-N 3.16Å; S245-E247 PolarHBondContact OG-OE2 2.96Å; S245-D248 PolarHBondContact N-OD2 3.5Å; S245-D248 WeakPolarHBondContact O-CB 3.48Å; S245-D248 PolarHBondContact O-N 3.45Å |
| 246 | P | 50.5 | Low | 50.3 | Low | 106 Ų | 106 | 92 Ų | 92 | 69% | 0.688 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -57.6 | -12.2 | 174.1 | 24.1 | -33.8 | 0 | 0 | 0 | 113.2 | C249 | P246-C249 PolarHBondContact O-SG 3.42Å |
| 247 | E | 49.9 | Very low | 51.6 | Low | 134 Ų | 134 | 90.4 Ų | 90.4 | 63% | 0.626 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -80 | -30 | 171.1 | -61.7 | 107.4 | 152.4 | 0 | 0 | 113.3 | S245 | S245-E247 VanDerWaalsContact CB-OE2 3.23Å; S245-E247 WeakPolarHBondContact CB-OE2 3.38Å; S245-E247 PolarHBondContact O-N 3.35Å; S245-E247 PolarHBondContact OG-N 3.16Å; S245-E247 PolarHBondContact OG-OE2 2.96Å |
| 248 | D | 49.8 | Very low | 53.1 | Low | 73 Ų | 73 | 87.4 Ų | 87.4 | 39% | 0.39 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -76.5 | -31.1 | -178.6 | -71.6 | -50.8 | 0 | 0 | 0 | 112.2 | S245 C250 V251 H252 | S245-D248 PolarHBondContact N-OD2 3.5Å; S245-D248 WeakPolarHBondContact O-CB 3.48Å; S245-D248 PolarHBondContact O-N 3.45Å; D248-C250 VanDerWaalsContact C-N 3.3Å; D248-C250 PolarHBondContact O-N 3.21Å; D248-V251 PolarHBondContact O-N 3.03Å; D248-H252 PolarHBondContact O-N 3.08Å; D248-H252 VanDerWaalsContact O-N 3.11Å; D248-H252 PolarHBondContact O-ND1 3.29Å |
| 249 | C | 55.8 | Low | 54.5 | Low | 61 Ų | 61 | 84.1 Ų | 84.1 | 41% | 0.412 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.4 | -35.1 | 176.2 | 60.4 | 0 | 0 | 0 | 0 | 111.8 | P246 H252 C253 | P246-C249 PolarHBondContact O-SG 3.42Å; C249-H252 PolarHBondContact O-N 3.02Å; C249-C253 VanDerWaalsContact O-CB 3.29Å; C249-C253 WeakPolarHBondContact O-CB 3.49Å; C249-C253 PolarHBondContact O-N 2.91Å |
| 250 | C | 53.8 | Low | 55.6 | Low | 39 Ų | 39 | 82.5 Ų | 82.5 | 26% | 0.264 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.9 | -42.8 | 176.5 | -62.8 | 0 | 0 | 0 | 0 | 111.9 | D248 C253 I254 | D248-C250 VanDerWaalsContact C-N 3.3Å; D248-C250 PolarHBondContact O-N 3.21Å; C250-C253 PolarHBondContact O-N 2.98Å; C250-I254 WeakPolarHBondContact O-CB 3.19Å; C250-I254 WeakPolarHBondContact O-CD1 3.36Å; C250-I254 VanDerWaalsContact O-CG1 3.22Å; C250-I254 WeakPolarHBondContact O-CG1 3.33Å; C250-I254 PolarHBondContact O-N 2.97Å |
| 251 | V | 67.3 | Low | 56.5 | Low | 76 Ų | 76 | 80.7 Ų | 80.7 | 46% | 0.461 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -64.8 | -42.2 | 177.5 | 178.5 | 0 | 0 | 0 | 0 | 110.9 | D248 C253 I254 L255 | D248-V251 PolarHBondContact O-N 3.03Å; V251-C253 VanDerWaalsContact C-N 3.35Å; V251-I254 PolarHBondContact O-N 3.3Å; V251-L255 HydrophobicContact CG1-CD1 3.97Å; V251-L255 HydrophobicContact CG1-CG 4.42Å; V251-L255 WeakPolarHBondContact O-CB 3.44Å; V251-L255 VanDerWaalsContact O-CG 3.23Å; V251-L255 WeakPolarHBondContact O-CG 3.37Å; V251-L255 PolarHBondContact O-N 3.47Å |
| 252 | H | 60.7 | Low | 57.4 | Low | 121 Ų | 121 | 77 Ų | 77 | 56% | 0.56 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -67.2 | -36.5 | 176.3 | -70.5 | 78.4 | 0 | 0 | 0 | 111.8 | D248 C249 A256 | D248-H252 PolarHBondContact O-N 3.08Å; D248-H252 VanDerWaalsContact O-N 3.11Å; D248-H252 PolarHBondContact O-ND1 3.29Å; C249-H252 PolarHBondContact O-N 3.02Å; H252-A256 VanDerWaalsContact O-CB 3.22Å; H252-A256 WeakPolarHBondContact O-CB 3.34Å; H252-A256 PolarHBondContact O-N 3.44Å |
| 253 | C | 61.4 | Low | 58.6 | Low | 10 Ų | 10 | 76.8 Ų | 76.8 | 7% | 0.068 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -67.5 | -43.9 | 175.6 | -162.5 | 0 | 0 | 0 | 0 | 111.5 | C249 C250 V251 L255 A256 C257 C309 | C249-C253 VanDerWaalsContact O-CB 3.29Å; C249-C253 WeakPolarHBondContact O-CB 3.49Å; C249-C253 PolarHBondContact O-N 2.91Å; C250-C253 PolarHBondContact O-N 2.98Å; V251-C253 VanDerWaalsContact C-N 3.35Å; C253-L255 PolarHBondContact O-N 3.29Å; C253-A256 PolarHBondContact O-N 3.42Å; C253-C257 WeakPolarHBondContact O-CB 3.29Å; C253-C257 PolarHBondContact O-N 3.39Å; C253-C257 PolarHBondContact O-SG 2.54Å; C253-C309 WeakPolarHBondContact CB-SG 3.36Å; C253-C309 WeakPolarHBondContact SG-CB 3.32Å; C253-C309 CovalentContact SG-SG 2.06Å; C253-C309 PolarHBondContact SG-SG 3.49Å |
| 254 | I | 71.8 | Confident | 59.5 | Low | 41 Ų | 41 | 75.5 Ų | 75.5 | 21% | 0.21 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -62.1 | -45.6 | 175.6 | -67.6 | 162.9 | 0 | 0 | 0 | 111 | C250 V251 A256 C257 L258 I318 | C250-I254 WeakPolarHBondContact O-CB 3.19Å; C250-I254 WeakPolarHBondContact O-CD1 3.36Å; C250-I254 VanDerWaalsContact O-CG1 3.22Å; C250-I254 WeakPolarHBondContact O-CG1 3.33Å; C250-I254 PolarHBondContact O-N 2.97Å; V251-I254 PolarHBondContact O-N 3.3Å; I254-A256 VanDerWaalsContact C-N 3.33Å; I254-A256 PolarHBondContact O-N 3.48Å; I254-C257 PolarHBondContact O-N 2.85Å; I254-L258 HydrophobicContact CG2-CD1 3.97Å; I254-L258 HydrophobicContact CG2-CG 4.4Å; I254-L258 WeakPolarHBondContact O-CB 3.48Å; I254-L258 VanDerWaalsContact O-CG 3.29Å; I254-L258 WeakPolarHBondContact O-CG 3.22Å; I254-L258 PolarHBondContact O-N 2.96Å; I254-I318 HydrophobicContact CD1-CG2 3.9Å |
| 255 | L | 73.8 | Confident | 60.1 | Low | 105 Ų | 105 | 76.9 Ų | 76.9 | 55% | 0.55 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -64.8 | -37.8 | 177.7 | -70 | 174.6 | 0 | 0 | 0 | 111.8 | V251 C253 F259 | V251-L255 HydrophobicContact CG1-CD1 3.97Å; V251-L255 HydrophobicContact CG1-CG 4.42Å; V251-L255 WeakPolarHBondContact O-CB 3.44Å; V251-L255 VanDerWaalsContact O-CG 3.23Å; V251-L255 WeakPolarHBondContact O-CG 3.37Å; V251-L255 PolarHBondContact O-N 3.47Å; C253-L255 PolarHBondContact O-N 3.29Å; L255-F259 VanDerWaalsContact O-CB 3.29Å; L255-F259 WeakPolarHBondContact O-CB 3.48Å; L255-F259 PolarHBondContact O-N 3.21Å |
| 256 | A | 69.9 | Low | 60 | Low | 30 Ų | 30 | 76.4 Ų | 76.4 | 25% | 0.248 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -65.6 | -43.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | H252 C253 I254 F259 C260 | H252-A256 VanDerWaalsContact O-CB 3.22Å; H252-A256 WeakPolarHBondContact O-CB 3.34Å; H252-A256 PolarHBondContact O-N 3.44Å; C253-A256 PolarHBondContact O-N 3.42Å; I254-A256 VanDerWaalsContact C-N 3.33Å; I254-A256 PolarHBondContact O-N 3.48Å; A256-F259 PolarHBondContact O-N 2.83Å; A256-C260 WeakPolarHBondContact O-CB 3.23Å; A256-C260 PolarHBondContact O-N 3.05Å; A256-C260 PolarHBondContact O-SG 3.11Å |
| 257 | C | 64.3 | Low | 59.8 | Low | 54 Ų | 54 | 75.8 Ų | 75.8 | 37% | 0.365 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -62.1 | -45.5 | 176.5 | -70.3 | 0 | 0 | 0 | 0 | 112.2 | C253 I254 F259 C260 E261 | C253-C257 WeakPolarHBondContact O-CB 3.29Å; C253-C257 PolarHBondContact O-N 3.39Å; C253-C257 PolarHBondContact O-SG 2.54Å; I254-C257 PolarHBondContact O-N 2.85Å; C257-F259 VanDerWaalsContact C-N 3.31Å; C257-F259 PolarHBondContact O-N 2.72Å; C257-C260 PolarHBondContact O-N 2.9Å; C257-E261 PolarHBondContact O-N 3.31Å |
| 258 | L | 70 | Confident | 60.2 | Low | 80 Ų | 80 | 74 Ų | 74 | 42% | 0.419 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -63.6 | -37.2 | 175.9 | -69.8 | 172 | 0 | 0 | 0 | 112 | I254 F262 | I254-L258 HydrophobicContact CG2-CD1 3.97Å; I254-L258 HydrophobicContact CG2-CG 4.4Å; I254-L258 WeakPolarHBondContact O-CB 3.48Å; I254-L258 VanDerWaalsContact O-CG 3.29Å; I254-L258 WeakPolarHBondContact O-CG 3.22Å; I254-L258 PolarHBondContact O-N 2.96Å; L258-F262 WeakPolarHBondContact O-CB 3.39Å; L258-F262 PolarHBondContact O-N 2.82Å |
| 259 | F | 64.9 | Low | 60.2 | Low | 123 Ų | 123 | 75.4 Ų | 75.4 | 54% | 0.539 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -70.5 | -37.4 | 175.7 | -171.1 | -108.1 | 0 | 0 | 0 | 111.9 | L255 A256 C257 F262 L263 | L255-F259 VanDerWaalsContact O-CB 3.29Å; L255-F259 WeakPolarHBondContact O-CB 3.48Å; L255-F259 PolarHBondContact O-N 3.21Å; A256-F259 PolarHBondContact O-N 2.83Å; C257-F259 VanDerWaalsContact C-N 3.31Å; C257-F259 PolarHBondContact O-N 2.72Å; F259-F262 PolarHBondContact O-N 3.45Å; F259-L263 HydrophobicContact CD1-CD1 3.65Å; F259-L263 HydrophobicContact CD1-CG 4.15Å; F259-L263 HydrophobicContact CE1-CD1 3.24Å; F259-L263 HydrophobicContact CE1-CD2 4.43Å; F259-L263 HydrophobicContact CE1-CG 3.86Å; F259-L263 HydrophobicContact CE2-CG 4.41Å; F259-L263 HydrophobicContact CZ-CD1 3.78Å; F259-L263 HydrophobicContact CZ-CD2 4.14Å; F259-L263 HydrophobicContact CZ-CG 3.99Å; F259-L263 WeakPolarHBondContact O-CB 3.49Å; F259-L263 WeakPolarHBondContact O-CG 3.12Å; F259-L263 PolarHBondContact O-N 3.38Å |
| 260 | C | 56.9 | Low | 59.8 | Low | 75 Ų | 75 | 77.8 Ų | 77.8 | 51% | 0.507 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -65.1 | -42.2 | 174 | -74.2 | 0 | 0 | 0 | 0 | 112.2 | A256 C257 T264 | A256-C260 WeakPolarHBondContact O-CB 3.23Å; A256-C260 PolarHBondContact O-N 3.05Å; A256-C260 PolarHBondContact O-SG 3.11Å; C257-C260 PolarHBondContact O-N 2.9Å; C260-T264 VanDerWaalsContact O-CB 3.25Å; C260-T264 WeakPolarHBondContact O-CB 3.37Å; C260-T264 PolarHBondContact O-N 3.38Å; C260-T264 PolarHBondContact O-OG1 3.33Å |
| 261 | E | 60.2 | Low | 59.3 | Low | 81 Ų | 81 | 77 Ų | 77 | 38% | 0.379 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -65.3 | -41.1 | 173 | -74.7 | -174.1 | 168.5 | 0 | 0 | 111.4 | C257 T264 L265 | C257-E261 PolarHBondContact O-N 3.31Å; E261-T264 PolarHBondContact O-N 2.81Å; E261-L265 WeakPolarHBondContact O-CB 3.26Å; E261-L265 WeakPolarHBondContact O-CG 3.49Å; E261-L265 PolarHBondContact O-N 2.82Å |
| 262 | F | 55 | Low | 58 | Low | 121 Ų | 121 | 79.6 Ų | 79.6 | 53% | 0.531 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -65.1 | -43.4 | 176.7 | 178.7 | -102.1 | 0 | 0 | 0 | 112.5 | L258 F259 T264 L265 C266 | L258-F262 WeakPolarHBondContact O-CB 3.39Å; L258-F262 PolarHBondContact O-N 2.82Å; F259-F262 PolarHBondContact O-N 3.45Å; F262-T264 VanDerWaalsContact C-N 3.33Å; F262-L265 PolarHBondContact O-N 3.19Å; F262-C266 WeakPolarHBondContact CE1-SG 3.06Å; F262-C266 WeakPolarHBondContact CZ-SG 3.23Å; F262-C266 VanDerWaalsContact O-CB 3.23Å; F262-C266 WeakPolarHBondContact O-CB 3.44Å; F262-C266 PolarHBondContact O-N 2.75Å; F262-C266 PolarHBondContact O-SG 2.75Å |
| 263 | L | 61.8 | Low | 57 | Low | 72 Ų | 72 | 78.1 Ų | 78.1 | 38% | 0.377 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -65.9 | -36.8 | 174.4 | -75.6 | -179.6 | 0 | 0 | 0 | 111.4 | F259 C266 N267 | F259-L263 HydrophobicContact CD1-CD1 3.65Å; F259-L263 HydrophobicContact CD1-CG 4.15Å; F259-L263 HydrophobicContact CE1-CD1 3.24Å; F259-L263 HydrophobicContact CE1-CD2 4.43Å; F259-L263 HydrophobicContact CE1-CG 3.86Å; F259-L263 HydrophobicContact CE2-CG 4.41Å; F259-L263 HydrophobicContact CZ-CD1 3.78Å; F259-L263 HydrophobicContact CZ-CD2 4.14Å; F259-L263 HydrophobicContact CZ-CG 3.99Å; F259-L263 WeakPolarHBondContact O-CB 3.49Å; F259-L263 WeakPolarHBondContact O-CG 3.12Å; F259-L263 PolarHBondContact O-N 3.38Å; L263-C266 CarbonylContact O-C 3.57Å; L263-C266 PolarHBondContact O-N 3.49Å; L263-N267 VanDerWaalsContact O-CB 3.24Å; L263-N267 WeakPolarHBondContact O-CB 3.27Å; L263-N267 PolarHBondContact O-N 2.79Å; L263-N267 PolarHBondContact O-ND2 2.72Å; L263-N267 VanDerWaalsContact O-ND2 3.08Å |
| 264 | T | 59.5 | Low | 56.2 | Low | 80 Ų | 80 | 82.9 Ų | 82.9 | 49% | 0.491 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.6 | -46.3 | 174 | -59 | 0 | 0 | 0 | 0 | 111.3 | C260 E261 F262 C266 N267 I268 | C260-T264 VanDerWaalsContact O-CB 3.25Å; C260-T264 WeakPolarHBondContact O-CB 3.37Å; C260-T264 PolarHBondContact O-N 3.38Å; C260-T264 PolarHBondContact O-OG1 3.33Å; E261-T264 PolarHBondContact O-N 2.81Å; F262-T264 VanDerWaalsContact C-N 3.33Å; T264-C266 VanDerWaalsContact C-N 3.35Å; T264-C266 PolarHBondContact O-N 3.41Å; T264-N267 CarbonylContact O-C 3.6Å; T264-N267 PolarHBondContact O-N 3.43Å; T264-I268 HydrophobicContact CG2-CD1 4.08Å; T264-I268 VanDerWaalsContact O-CG1 3.26Å; T264-I268 WeakPolarHBondContact O-CG1 3.25Å; T264-I268 PolarHBondContact O-N 3.31Å |
| 265 | L | 56.6 | Low | 54.7 | Low | 90 Ų | 90 | 83.9 Ų | 83.9 | 47% | 0.471 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.1 | -39.3 | 174 | -74.7 | 167.8 | 0 | 0 | 0 | 111.6 | E261 F262 N267 I268 V269 | E261-L265 WeakPolarHBondContact O-CB 3.26Å; E261-L265 WeakPolarHBondContact O-CG 3.49Å; E261-L265 PolarHBondContact O-N 2.82Å; F262-L265 PolarHBondContact O-N 3.19Å; L265-N267 VanDerWaalsContact C-N 3.34Å; L265-I268 PolarHBondContact O-N 2.87Å; L265-V269 WeakPolarHBondContact O-CB 3.24Å; L265-V269 WeakPolarHBondContact O-CG2 3.39Å; L265-V269 PolarHBondContact O-N 3.34Å |
| 266 | C | 45.2 | Very low | 52.9 | Low | 32 Ų | 32 | 81.9 Ų | 81.9 | 22% | 0.216 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -64.1 | -40 | 172.7 | -74.5 | 0 | 0 | 0 | 0 | 111.1 | F262 L263 T264 I268 V269 L270 | F262-C266 WeakPolarHBondContact CE1-SG 3.06Å; F262-C266 WeakPolarHBondContact CZ-SG 3.23Å; F262-C266 VanDerWaalsContact O-CB 3.23Å; F262-C266 WeakPolarHBondContact O-CB 3.44Å; F262-C266 PolarHBondContact O-N 2.75Å; F262-C266 PolarHBondContact O-SG 2.75Å; L263-C266 CarbonylContact O-C 3.57Å; L263-C266 PolarHBondContact O-N 3.49Å; T264-C266 VanDerWaalsContact C-N 3.35Å; T264-C266 PolarHBondContact O-N 3.41Å; C266-I268 VanDerWaalsContact C-N 3.35Å; C266-V269 PolarHBondContact O-N 2.97Å; C266-L270 HydrophobicContact CB-CD1 4.34Å; C266-L270 WeakPolarHBondContact O-CA 3.41Å; C266-L270 WeakPolarHBondContact O-CB 3.33Å; C266-L270 WeakPolarHBondContact O-CG 3.11Å; C266-L270 PolarHBondContact O-N 2.91Å |
| 267 | N | 47.5 | Very low | 51.5 | Low | 94 Ų | 94 | 87.7 Ų | 87.7 | 50% | 0.503 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -70.8 | -30 | 176.5 | -74.9 | -30.7 | 0 | 0 | 0 | 112.2 | L263 T264 L265 G271 | L263-N267 VanDerWaalsContact O-CB 3.24Å; L263-N267 WeakPolarHBondContact O-CB 3.27Å; L263-N267 PolarHBondContact O-N 2.79Å; L263-N267 PolarHBondContact O-ND2 2.72Å; L263-N267 VanDerWaalsContact O-ND2 3.08Å; T264-N267 CarbonylContact O-C 3.6Å; T264-N267 PolarHBondContact O-N 3.43Å; L265-N267 VanDerWaalsContact C-N 3.34Å; N267-G271 WeakPolarHBondContact O-CA 3.49Å; N267-G271 PolarHBondContact O-N 3.25Å |
| 268 | I | 57.4 | Low | 50.2 | Low | 95 Ų | 95 | 88 Ų | 88 | 49% | 0.487 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -71.3 | -47.8 | 170.2 | -66.6 | 162.6 | 0 | 0 | 0 | 109.6 | T264 L265 C266 G271 Q272 | T264-I268 HydrophobicContact CG2-CD1 4.08Å; T264-I268 VanDerWaalsContact O-CG1 3.26Å; T264-I268 WeakPolarHBondContact O-CG1 3.25Å; T264-I268 PolarHBondContact O-N 3.31Å; L265-I268 PolarHBondContact O-N 2.87Å; C266-I268 VanDerWaalsContact C-N 3.35Å; I268-G271 PolarHBondContact O-N 3.08Å; I268-Q272 WeakPolarHBondContact O-CB 3.23Å; I268-Q272 WeakPolarHBondContact O-CG 3.36Å; I268-Q272 PolarHBondContact O-N 2.69Å |
| 269 | V | 49.3 | Very low | 48.6 | Very low | 103 Ų | 103 | 89.1 Ų | 89.1 | 62% | 0.624 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -69.8 | -40.6 | -177.4 | 173.2 | 0 | 0 | 0 | 0 | 112.2 | L265 C266 | L265-V269 WeakPolarHBondContact O-CB 3.24Å; L265-V269 WeakPolarHBondContact O-CG2 3.39Å; L265-V269 PolarHBondContact O-N 3.34Å; C266-V269 PolarHBondContact O-N 2.97Å |
| 270 | L | 48.9 | Very low | 47.7 | Very low | 111 Ų | 111 | 88.9 Ų | 88.9 | 58% | 0.581 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -78.5 | -31.6 | 175 | -62.8 | 171 | 0 | 0 | 0 | 111.5 | C266 A273 S274 | C266-L270 HydrophobicContact CB-CD1 4.34Å; C266-L270 WeakPolarHBondContact O-CA 3.41Å; C266-L270 WeakPolarHBondContact O-CB 3.33Å; C266-L270 WeakPolarHBondContact O-CG 3.11Å; C266-L270 PolarHBondContact O-N 2.91Å; L270-A273 CarbonylContact O-C 3.56Å; L270-A273 WeakPolarHBondContact O-CB 3.38Å; L270-A273 PolarHBondContact O-N 3.13Å; L270-A273 VanDerWaalsContact O-N 3.13Å; L270-S274 VanDerWaalsContact O-CB 3.3Å; L270-S274 WeakPolarHBondContact O-CB 3.29Å; L270-S274 PolarHBondContact O-N 2.81Å |
| 271 | G | 43.8 | Very low | 47.1 | Very low | 22 Ų | 22 | 93.2 Ų | 93.2 | 23% | 0.227 | 55% | 0.548 | C | S | . | . | H | α-helix | trans | -68.2 | -34.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | N267 I268 A273 S274 C275 | N267-G271 WeakPolarHBondContact O-CA 3.49Å; N267-G271 PolarHBondContact O-N 3.25Å; I268-G271 PolarHBondContact O-N 3.08Å; G271-A273 PolarHBondContact O-N 3.43Å; G271-S274 PolarHBondContact O-N 3.19Å; G271-C275 CarbonylContact O-C 3.48Å; G271-C275 WeakPolarHBondContact O-CA 3.12Å; G271-C275 WeakPolarHBondContact O-CB 3.45Å; G271-C275 PolarHBondContact O-N 2.81Å; G271-C275 VanDerWaalsContact O-O 3.14Å |
| 272 | Q | 38.7 | Very low | 46.4 | Very low | 132 Ų | 132 | 93.5 Ų | 93.5 | 62% | 0.617 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -67.6 | -19.9 | 169.9 | -71 | -66.5 | -63.2 | 0 | 0 | 112.7 | I268 | I268-Q272 WeakPolarHBondContact O-CB 3.23Å; I268-Q272 WeakPolarHBondContact O-CG 3.36Å; I268-Q272 PolarHBondContact O-N 2.69Å |
| 273 | A | 38.9 | Very low | 45.7 | Very low | 90 Ų | 90 | 92.7 Ų | 92.7 | 74% | 0.744 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -91.7 | -15.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | L270 G271 | L270-A273 CarbonylContact O-C 3.56Å; L270-A273 WeakPolarHBondContact O-CB 3.38Å; L270-A273 PolarHBondContact O-N 3.13Å; L270-A273 VanDerWaalsContact O-N 3.13Å; G271-A273 PolarHBondContact O-N 3.43Å |
| 274 | S | 45.9 | Very low | 44.8 | Very low | 109 Ų | 109 | 93.7 Ų | 93.7 | 76% | 0.762 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -117.1 | -38.3 | -172.2 | 178.3 | 0 | 0 | 0 | 0 | 113.8 | L270 G271 | L270-S274 VanDerWaalsContact O-CB 3.3Å; L270-S274 WeakPolarHBondContact O-CB 3.29Å; L270-S274 PolarHBondContact O-N 2.81Å; G271-S274 PolarHBondContact O-N 3.19Å |
| 275 | C | 39.8 | Very low | 44 | Very low | 63 Ų | 63 | 94.1 Ų | 94.1 | 43% | 0.426 | 59% | 0.59 | S | S | . | * | S | Bend | trans | -109.2 | 88.2 | 174.4 | -158.7 | 0 | 0 | 0 | 0 | 107.5 | G271 I277 C278 | G271-C275 CarbonylContact O-C 3.48Å; G271-C275 WeakPolarHBondContact O-CA 3.12Å; G271-C275 WeakPolarHBondContact O-CB 3.45Å; G271-C275 PolarHBondContact O-N 2.81Å; G271-C275 VanDerWaalsContact O-O 3.14Å; C275-I277 PolarHBondContact O-N 3.26Å; C275-C278 HydrophobicContact CB-CB 4.45Å; C275-C278 WeakPolarHBondContact CB-SG 3.1Å; C275-C278 WeakPolarHBondContact SG-CB 3.22Å; C275-C278 CovalentContact SG-SG 2.08Å; C275-C278 PolarHBondContact SG-SG 3.01Å |
| 276 | G | 36.9 | Very low | 43.3 | Very low | 63 Ų | 63 | 95.5 Ų | 95.5 | 65% | 0.649 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.5 | 115.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | | |
| 277 | I | 40.1 | Very low | 43.2 | Very low | 151 Ų | 151 | 98.5 Ų | 98.5 | 77% | 0.774 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 58.9 | 67.1 | 164.3 | -41.2 | 162.7 | 0 | 0 | 0 | 113.1 | C275 T279 | C275-I277 PolarHBondContact O-N 3.26Å; I277-T279 HydrophobicContact CG2-CG2 4.38Å; I277-T279 PolarHBondContact O-N 2.8Å |
| 278 | C | 35.8 | Very low | 42.8 | Very low | 62 Ų | 62 | 97 Ų | 97 | 42% | 0.419 | 63% | 0.632 | S | S | . | * | | | trans | -95.4 | 96.8 | 173.5 | -55.9 | 0 | 0 | 0 | 0 | 106.8 | C275 S280 | C275-C278 HydrophobicContact CB-CB 4.45Å; C275-C278 WeakPolarHBondContact CB-SG 3.1Å; C275-C278 WeakPolarHBondContact SG-CB 3.22Å; C275-C278 CovalentContact SG-SG 2.08Å; C275-C278 PolarHBondContact SG-SG 3.01Å; C278-S280 PolarHBondContact O-N 3.23Å |
| 279 | T | 38.2 | Very low | 42.1 | Very low | 103 Ų | 103 | 100.7 Ų | 100.7 | 63% | 0.632 | 65% | 0.653 | S | S | * | * | | | trans | -68.4 | 108.6 | -176.8 | 49.6 | 0 | 0 | 0 | 0 | 110.3 | I277 E281 | I277-T279 HydrophobicContact CG2-CG2 4.38Å; I277-T279 PolarHBondContact O-N 2.8Å; T279-E281 PolarHBondContact O-N 2.89Å |
| 280 | S | 44.7 | Very low | 42.1 | Very low | 117 Ų | 117 | 103 Ų | 103 | 82% | 0.818 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 29.6 | -9.4 | 155.9 | -156.8 | 0 | 0 | 0 | 0 | 124.3 | C278 | C278-S280 PolarHBondContact O-N 3.23Š|
| 281 | E | 45.2 | Very low | 42 | Very low | 166 Ų | 166 | 105.3 Ų | 105.3 | 78% | 0.776 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.6 | -0.3 | -175.8 | 37.4 | -110.5 | 99.7 | 0 | 0 | 115 | T279 | T279-E281 PolarHBondContact O-N 2.89Š|
| 282 | A | 45.2 | Very low | 42.1 | Very low | 87 Ų | 87 | 107.3 Ų | 107.3 | 72% | 0.719 | 69% | 0.688 | S | S | * | * | | | trans | -145 | 41.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | C284 | A282-C284 VanDerWaalsContact C-N 3.26Å; A282-C284 PolarHBondContact O-N 3.27Å |
| 283 | C | 40.8 | Very low | 42.6 | Very low | 104 Ų | 104 | 109.5 Ų | 109.5 | 70% | 0.703 | 70% | 0.703 | S | S | * | * | | | trans | -78.8 | 85.7 | 164.4 | -165.6 | 0 | 0 | 0 | 0 | 108.6 | C285 | C283-C285 VanDerWaalsContact C-N 3.26Å; C283-C285 PolarHBondContact O-N 2.06Å |
| 284 | C | 42.7 | Very low | 43 | Very low | 94 Ų | 94 | 111.2 Ų | 111.2 | 64% | 0.635 | 70% | 0.7 | S | S | * | * | | | trans | -71.3 | 79.1 | 173.5 | -171.8 | 0 | 0 | 0 | 0 | 109.4 | A282 C287 | A282-C284 VanDerWaalsContact C-N 3.26Å; A282-C284 PolarHBondContact O-N 3.27Å; C284-C287 PolarHBondContact SG-N 2.85Å |
| 285 | C | 42.7 | Very low | 42.9 | Very low | 89 Ų | 89 | 110.3 Ų | 110.3 | 60% | 0.601 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -86.9 | -12.9 | 161.4 | -73.7 | 0 | 0 | 0 | 0 | 112.3 | C283 | C283-C285 VanDerWaalsContact C-N 3.26Å; C283-C285 PolarHBondContact O-N 2.06Å |
| 286 | C | 42.2 | Very low | 43.2 | Very low | 118 Ų | 118 | 112.3 Ų | 112.3 | 80% | 0.797 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -150.9 | 85.7 | 173.5 | -50.3 | 0 | 0 | 0 | 0 | 110.6 | | |
| 287 | C | 43.1 | Very low | 43.6 | Very low | 96 Ų | 96 | 112.3 Ų | 112.3 | 65% | 0.649 | 70% | 0.697 | S | S | * | * | | | trans | 44 | 104.1 | 158.3 | -53.9 | 0 | 0 | 0 | 0 | 118.4 | C284 | C284-C287 PolarHBondContact SG-N 2.85Š|
| 288 | G | 39.2 | Very low | 43.8 | Very low | 62 Ų | 62 | 111.6 Ų | 111.6 | 64% | 0.639 | 70% | 0.702 | S | S | * | * | | | trans | -69.9 | 137.7 | 152 | 0 | 0 | 0 | 0 | 0 | 110.3 | E290 | G288-E290 PolarHBondContact O-N 3.23Š|
| 289 | D | 42.1 | Very low | 44.1 | Very low | 172 Ų | 172 | 113 Ų | 113 | 92% | 0.92 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -65.3 | 26.6 | -168.4 | -162.2 | -121.9 | 0 | 0 | 0 | 116.7 | | |
| 290 | E | 48.6 | Very low | 44.3 | Very low | 153 Ų | 153 | 114.8 Ų | 114.8 | 72% | 0.715 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -134.3 | 103.7 | 177.8 | -110.5 | -139.7 | 128.6 | 0 | 0 | 111.9 | G288 | G288-E290 PolarHBondContact O-N 3.23Š|
| 291 | M | 48.6 | Very low | 44.4 | Very low | 158 Ų | 158 | 117.1 Ų | 117.1 | 78% | 0.778 | 72% | 0.717 | S | S | * | * | S | Bend | trans | 73 | 109.4 | 158.4 | -66.8 | 71.5 | -165.6 | 0 | 0 | 117.1 | | |
| 292 | G | 44.9 | Very low | 44.4 | Very low | 65 Ų | 65 | 113.6 Ų | 113.6 | 67% | 0.67 | 70% | 0.704 | S | S | * | * | | | trans | 143.2 | 88.9 | 150.1 | 0 | 0 | 0 | 0 | 0 | 114 | D294 | G292-D294 PolarHBondContact O-N 3.43Š|
| 293 | D | 48.3 | Very low | 44.4 | Very low | 177 Ų | 177 | 114.8 Ų | 114.8 | 95% | 0.947 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -66.8 | 51.3 | 172.6 | -176.7 | 56.7 | 0 | 0 | 0 | 113.6 | | |
| 294 | D | 47.5 | Very low | 44.6 | Very low | 126 Ų | 126 | 112.4 Ų | 112.4 | 67% | 0.674 | 70% | 0.698 | S | S | * | * | | | trans | -158.9 | 51 | 167.8 | -164.3 | 17.3 | 0 | 0 | 0 | 112.7 | G292 S296 | G292-D294 PolarHBondContact O-N 3.43Å; D294-S296 PolarHBondContact O-N 3.04Å; D294-S296 PolarHBondContact OD1-OG 3.5Å |
| 295 | C | 45 | Very low | 45 | Very low | 90 Ų | 90 | 110.5 Ų | 110.5 | 61% | 0.608 | 68% | 0.682 | S | S | * | * | | | trans | -81.8 | 84.1 | 157.4 | -73.2 | 0 | 0 | 0 | 0 | 107.7 | C297 | C295-C297 PolarHBondContact O-N 2.87Å; C295-C297 PolarHBondContact O-SG 3.2Å; C295-C297 VanDerWaalsContact O-SG 3.35Å |
| 296 | S | 45.8 | Very low | 45.4 | Very low | 105 Ų | 105 | 113.2 Ų | 113.2 | 73% | 0.734 | 69% | 0.687 | S | S | * | * | | | trans | -68.2 | 47.5 | 159.5 | -68.4 | 0 | 0 | 0 | 0 | 110.4 | D294 | D294-S296 PolarHBondContact O-N 3.04Å; D294-S296 PolarHBondContact OD1-OG 3.5Å |
| 297 | C | 45.2 | Very low | 45.6 | Very low | 64 Ų | 64 | 114.1 Ų | 114.1 | 43% | 0.432 | 68% | 0.684 | S | S | . | * | | | trans | -74.8 | 130.6 | 170.4 | 52.4 | 0 | 0 | 0 | 0 | 107 | C295 C299 | C295-C297 PolarHBondContact O-N 2.87Å; C295-C297 PolarHBondContact O-SG 3.2Å; C295-C297 VanDerWaalsContact O-SG 3.35Å; C297-C299 HydrophobicContact CB-CB 4.34Å; C297-C299 WeakPolarHBondContact CB-SG 3.29Å; C297-C299 PolarHBondContact O-N 3.48Å |
| 298 | P | 45.1 | Very low | 45.8 | Very low | 136 Ų | 136 | 112.9 Ų | 112.9 | 88% | 0.883 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -73.3 | 42.7 | 175.6 | 32.8 | -35.2 | 0 | 0 | 0 | 110.9 | D300 | P298-D300 PolarHBondContact O-N 3.21Š|
| 299 | C | 41.5 | Very low | 46 | Very low | 92 Ų | 92 | 110.9 Ų | 110.9 | 62% | 0.622 | 66% | 0.657 | S | S | * | * | | | trans | -90.8 | 22.9 | 174.5 | -53.8 | 0 | 0 | 0 | 0 | 110.6 | C297 | C297-C299 HydrophobicContact CB-CB 4.34Å; C297-C299 WeakPolarHBondContact CB-SG 3.29Å; C297-C299 PolarHBondContact O-N 3.48Å |
| 300 | D | 41.7 | Very low | 46.1 | Very low | 139 Ų | 139 | 106.7 Ų | 106.7 | 74% | 0.743 | 64% | 0.64 | S | S | * | * | | | trans | -105 | 58.3 | -180 | -161.3 | 18.4 | 0 | 0 | 0 | 110 | P298 | P298-D300 PolarHBondContact O-N 3.21Š|
| 301 | M | 47.1 | Very low | 45.8 | Very low | 166 Ų | 166 | 108.1 Ų | 108.1 | 82% | 0.818 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -139.3 | 98.8 | 156 | -72.2 | -62.4 | 157.8 | 0 | 0 | 106.9 | | |
| 302 | D | 44.9 | Very low | 45.6 | Very low | 93 Ų | 93 | 103.1 Ų | 103.1 | 50% | 0.497 | 63% | 0.627 | S | S | . | * | | | trans | 83.5 | 48 | 152.4 | -66.6 | -60.8 | 0 | 0 | 0 | 120.1 | G304 I305 | D302-G304 PolarHBondContact O-N 3.05Å; D302-I305 HydrophobicContact CB-CB 4.07Å; D302-I305 HydrophobicContact CB-CD1 3.45Å; D302-I305 VanDerWaalsContact CB-CD1 3.45Å; D302-I305 HydrophobicContact CB-CG1 3.67Å; D302-I305 PolarHBondContact O-N 2.72Å |
| 303 | C | 46 | Very low | 45.9 | Very low | 112 Ų | 112 | 104.2 Ų | 104.2 | 76% | 0.757 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -60.7 | -16.2 | 149.1 | -94.2 | 0 | 0 | 0 | 0 | 112.6 | | |
| 304 | G | 45.3 | Very low | 45.9 | Very low | 53 Ų | 53 | 100.8 Ų | 100.8 | 55% | 0.546 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -76 | -20.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | D302 M306 | D302-G304 PolarHBondContact O-N 3.05Å; G304-M306 VanDerWaalsContact C-N 3.35Å |
| 305 | I | 50.5 | Low | 46.1 | Very low | 55 Ų | 55 | 95.9 Ų | 95.9 | 28% | 0.282 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -73.4 | -32.1 | 174.7 | -71.9 | 174.2 | 0 | 0 | 0 | 110.5 | D302 D307 C309 | D302-I305 HydrophobicContact CB-CB 4.07Å; D302-I305 HydrophobicContact CB-CD1 3.45Å; D302-I305 VanDerWaalsContact CB-CD1 3.45Å; D302-I305 HydrophobicContact CB-CG1 3.67Å; D302-I305 PolarHBondContact O-N 2.72Å; I305-D307 VanDerWaalsContact C-N 3.32Å; I305-D307 PolarHBondContact O-N 3.2Å; I305-C309 WeakPolarHBondContact O-CB 3.45Å; I305-C309 PolarHBondContact O-N 3.32Å; I305-C309 VanDerWaalsContact O-N 3.09Å; I305-C309 PolarHBondContact O-SG 3.03Å |
| 306 | M | 50.2 | Low | 46.6 | Very low | 146 Ų | 146 | 95.4 Ų | 95.4 | 72% | 0.719 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -63.9 | -34.2 | 175.5 | -93.4 | 178.3 | 54.1 | 0 | 0 | 113.1 | G304 C310 | G304-M306 VanDerWaalsContact C-N 3.35Å; M306-C310 WeakPolarHBondContact O-CB 3.37Å; M306-C310 PolarHBondContact O-N 3.13Å |
| 307 | D | 48 | Very low | 47.3 | Very low | 136 Ų | 136 | 96.3 Ų | 96.3 | 73% | 0.727 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -73 | -39.2 | -178 | -154.7 | 64.2 | 0 | 0 | 0 | 111.5 | I305 | I305-D307 VanDerWaalsContact C-N 3.32Å; I305-D307 PolarHBondContact O-N 3.2Å |
| 308 | A | 45.3 | Very low | 48 | Very low | 71 Ų | 71 | 96.9 Ų | 96.9 | 59% | 0.587 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -75.9 | -32.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | C310 | A308-C310 VanDerWaalsContact C-N 3.28Å; A308-C310 PolarHBondContact O-N 2.77Å |
| 309 | C | 43.5 | Very low | 48.6 | Very low | 19 Ų | 19 | 91.3 Ų | 91.3 | 13% | 0.128 | 53% | 0.527 | C | S | . | . | H | α-helix | trans | -75.4 | -17.1 | 177.1 | -63.5 | 0 | 0 | 0 | 0 | 112.9 | C253 I305 | C253-C309 WeakPolarHBondContact CB-SG 3.36Å; C253-C309 WeakPolarHBondContact SG-CB 3.32Å; C253-C309 CovalentContact SG-SG 2.06Å; C253-C309 PolarHBondContact SG-SG 3.49Å; I305-C309 WeakPolarHBondContact O-CB 3.45Å; I305-C309 PolarHBondContact O-N 3.32Å; I305-C309 VanDerWaalsContact O-N 3.09Å; I305-C309 PolarHBondContact O-SG 3.03Å |
| 310 | C | 44 | Very low | 49.4 | Very low | 84 Ų | 84 | 93.4 Ų | 93.4 | 57% | 0.568 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -88.4 | -21.3 | -178.2 | -149.6 | 0 | 0 | 0 | 0 | 113.4 | M306 A308 S312 | M306-C310 WeakPolarHBondContact O-CB 3.37Å; M306-C310 PolarHBondContact O-N 3.13Å; A308-C310 VanDerWaalsContact C-N 3.28Å; A308-C310 PolarHBondContact O-N 2.77Å; C310-S312 PolarHBondContact O-N 3.48Å |
| 311 | E | 43.3 | Very low | 50.1 | Low | 183 Ų | 183 | 92.9 Ų | 92.9 | 86% | 0.855 | 52% | 0.523 | S | S | * | . | S | Bend | trans | -74 | -15.4 | 177.3 | -171.6 | 153.7 | 79.6 | 0 | 0 | 112.9 | | |
| 312 | S | 43.3 | Very low | 50.2 | Low | 53 Ų | 53 | 87.1 Ų | 87.1 | 37% | 0.371 | 50% | 0.498 | S | S | . | . | | | trans | -112.5 | 99.5 | 176.2 | -51.1 | 0 | 0 | 0 | 0 | 109.6 | C310 D314 C315 | C310-S312 PolarHBondContact O-N 3.48Å; S312-D314 PolarHBondContact O-N 3.09Å; S312-C315 PolarHBondContact O-N 3.43Å |
| 313 | S | 52.2 | Low | 50.4 | Low | 88 Ų | 88 | 84.9 Ų | 84.9 | 62% | 0.615 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -51.6 | -27.5 | 176.1 | 45.7 | 0 | 0 | 0 | 0 | 113.6 | C315 E317 | S313-C315 PolarHBondContact O-N 3.37Å; S313-E317 PolarHBondContact O-N 3.24Å |
| 314 | D | 48.5 | Very low | 50.5 | Low | 105 Ų | 105 | 82 Ų | 82 | 56% | 0.561 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -69.9 | -27.7 | 179.9 | -51.4 | -88.3 | 0 | 0 | 0 | 113.5 | S312 I318 | S312-D314 PolarHBondContact O-N 3.09Å; D314-I318 WeakPolarHBondContact O-CD1 3.36Å; D314-I318 PolarHBondContact O-N 2.08Å |
| 315 | C | 50.8 | Low | 50.9 | Low | 24 Ų | 24 | 85.4 Ų | 85.4 | 16% | 0.162 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -75.6 | -40 | 179.6 | -65.3 | 0 | 0 | 0 | 0 | 111.7 | S312 S313 E317 C319 | S312-C315 PolarHBondContact O-N 3.43Å; S313-C315 PolarHBondContact O-N 3.37Å; C315-E317 VanDerWaalsContact C-N 3.33Å; C315-C319 WeakPolarHBondContact O-CB 3.3Å; C315-C319 PolarHBondContact O-N 3.03Å; C315-C319 PolarHBondContact O-SG 3.49Å |
| 316 | L | 55.4 | Low | 50.4 | Low | 79 Ų | 79 | 86.6 Ų | 86.6 | 41% | 0.414 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -69.1 | -32.9 | 176.1 | -68.1 | 174.6 | 0 | 0 | 0 | 111.8 | C319 M320 | L316-C319 PolarHBondContact O-N 3.3Å; L316-M320 WeakPolarHBondContact O-CB 3.08Å; L316-M320 WeakPolarHBondContact O-CG 3.26Å; L316-M320 PolarHBondContact O-N 2.74Å |
| 317 | E | 60.4 | Low | 49.6 | Very low | 124 Ų | 124 | 86.7 Ų | 86.7 | 58% | 0.579 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -66.3 | -46.4 | 174.7 | -170.3 | 168.5 | -170.1 | 0 | 0 | 111.6 | S313 C315 C319 M320 E321 | S313-E317 PolarHBondContact O-N 3.24Å; C315-E317 VanDerWaalsContact C-N 3.33Å; E317-C319 VanDerWaalsContact C-N 3.35Å; E317-C319 PolarHBondContact O-N 2.9Å; E317-M320 PolarHBondContact O-N 2.7Å; E317-E321 WeakPolarHBondContact O-CB 3.38Å; E317-E321 PolarHBondContact O-N 3.31Å |
| 318 | I | 61.6 | Low | 49.1 | Very low | 76 Ų | 76 | 85.4 Ų | 85.4 | 39% | 0.39 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.7 | -41.5 | 173.3 | -97.5 | 77.7 | 0 | 0 | 0 | 111.6 | I254 D314 E321 C322 | I254-I318 HydrophobicContact CD1-CG2 3.9Å; D314-I318 WeakPolarHBondContact O-CD1 3.36Å; D314-I318 PolarHBondContact O-N 2.08Å; I318-E321 PolarHBondContact O-N 3.21Å; I318-C322 WeakPolarHBondContact O-CB 3.47Å; I318-C322 PolarHBondContact O-N 3.47Å; I318-C322 PolarHBondContact O-SG 3.35Å |
| 319 | C | 57.1 | Low | 48.7 | Very low | 20 Ų | 20 | 91.1 Ų | 91.1 | 14% | 0.135 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -64.9 | -44.4 | 179.4 | -73.2 | 0 | 0 | 0 | 0 | 111.5 | C315 L316 E317 E321 C322 C323 | C315-C319 WeakPolarHBondContact O-CB 3.3Å; C315-C319 PolarHBondContact O-N 3.03Å; C315-C319 PolarHBondContact O-SG 3.49Å; L316-C319 PolarHBondContact O-N 3.3Å; E317-C319 VanDerWaalsContact C-N 3.35Å; E317-C319 PolarHBondContact O-N 2.9Å; C319-E321 VanDerWaalsContact C-N 3.34Å; C319-E321 PolarHBondContact O-N 3.49Å; C319-C322 PolarHBondContact O-N 2.8Å; C319-C323 PolarHBondContact O-N 3.04Å; C319-C323 PolarHBondContact O-SG 2.96Å |
| 320 | M | 58.7 | Low | 49 | Very low | 135 Ų | 135 | 94.7 Ų | 94.7 | 67% | 0.665 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -65.8 | -34.6 | 176 | -73.2 | -172 | -64.5 | 0 | 0 | 112.7 | L316 E317 C323 G324 | L316-M320 WeakPolarHBondContact O-CB 3.08Å; L316-M320 WeakPolarHBondContact O-CG 3.26Å; L316-M320 PolarHBondContact O-N 2.74Å; E317-M320 PolarHBondContact O-N 2.7Å; M320-C323 PolarHBondContact O-N 3.06Å; M320-G324 PolarHBondContact O-N 3.41Å; M320-G324 VanDerWaalsContact O-N 3.13Å |
| 321 | E | 55.9 | Low | 49.3 | Very low | 128 Ų | 128 | 95.3 Ų | 95.3 | 60% | 0.598 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -66.1 | -41.5 | 172.9 | -169.8 | 177.5 | -172.6 | 0 | 0 | 111.5 | E317 I318 C319 G324 I325 | E317-E321 WeakPolarHBondContact O-CB 3.38Å; E317-E321 PolarHBondContact O-N 3.31Å; I318-E321 PolarHBondContact O-N 3.21Å; C319-E321 VanDerWaalsContact C-N 3.34Å; C319-E321 PolarHBondContact O-N 3.49Å; E321-G324 PolarHBondContact O-N 3.45Å; E321-I325 WeakPolarHBondContact O-CG1 3.17Å; E321-I325 PolarHBondContact O-N 2.88Å |
| 322 | C | 49.7 | Very low | 49.6 | Very low | 46 Ų | 46 | 90.4 Ų | 90.4 | 31% | 0.311 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.8 | -38.9 | 174.8 | -66.1 | 0 | 0 | 0 | 0 | 112.3 | I318 C319 G324 I325 C326 | I318-C322 WeakPolarHBondContact O-CB 3.47Å; I318-C322 PolarHBondContact O-N 3.47Å; I318-C322 PolarHBondContact O-SG 3.35Å; C319-C322 PolarHBondContact O-N 2.8Å; C322-G324 VanDerWaalsContact C-N 3.26Å; C322-G324 PolarHBondContact O-N 2.84Å; C322-I325 PolarHBondContact O-N 2.94Å; C322-C326 PolarHBondContact O-N 3.17Å; C322-C326 PolarHBondContact O-SG 3.22Å |
| 323 | C | 49.4 | Very low | 50 | Low | 46 Ų | 46 | 92.6 Ų | 92.6 | 31% | 0.311 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.1 | -33.8 | 174.3 | -67.1 | 0 | 0 | 0 | 0 | 111.9 | C319 M320 I325 F327 | C319-C323 PolarHBondContact O-N 3.04Å; C319-C323 PolarHBondContact O-SG 2.96Å; M320-C323 PolarHBondContact O-N 3.06Å; C323-I325 VanDerWaalsContact C-N 3.35Å; C323-F327 PolarHBondContact O-N 3.2Å |
| 324 | G | 47.8 | Very low | 49.8 | Very low | 50 Ų | 50 | 92.9 Ų | 92.9 | 52% | 0.515 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -71.6 | -22.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115 | M320 E321 C322 | M320-G324 PolarHBondContact O-N 3.41Å; M320-G324 VanDerWaalsContact O-N 3.13Å; E321-G324 PolarHBondContact O-N 3.45Å; C322-G324 VanDerWaalsContact C-N 3.26Å; C322-G324 PolarHBondContact O-N 2.84Å |
| 325 | I | 53 | Low | 49.9 | Very low | 125 Ų | 125 | 92.1 Ų | 92.1 | 64% | 0.641 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -86.5 | -32.3 | 178.5 | -61.3 | 164.9 | 0 | 0 | 0 | 111.1 | E321 C322 C323 | E321-I325 WeakPolarHBondContact O-CG1 3.17Å; E321-I325 PolarHBondContact O-N 2.88Å; C322-I325 PolarHBondContact O-N 2.94Å; C323-I325 VanDerWaalsContact C-N 3.35Å |
| 326 | C | 40.6 | Very low | 49.8 | Very low | 81 Ų | 81 | 96.9 Ų | 96.9 | 55% | 0.547 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -79.5 | -16.5 | -179.3 | -66.9 | 0 | 0 | 0 | 0 | 113.9 | C322 | C322-C326 PolarHBondContact O-N 3.17Å; C322-C326 PolarHBondContact O-SG 3.22Å |
| 327 | F | 34.1 | Very low | 49.4 | Very low | 147 Ų | 147 | 98.3 Ų | 98.3 | 65% | 0.645 | 57% | 0.568 | S | S | * | * | | | trans | -127 | 80.8 | 170.4 | -70 | -81.1 | 0 | 0 | 0 | 111.4 | C323 | C323-F327 PolarHBondContact O-N 3.2Š|
| 328 | P | 36 | Very low | 48.5 | Very low | 109 Ų | 109 | 96.2 Ų | 96.2 | 71% | 0.708 | 57% | 0.567 | S | S | * | * | | | trans | -70.3 | 129.9 | 162.1 | 30.4 | -29.3 | 0 | 0 | 0 | 108.2 | | |
| 329 | S | 38.2 | Very low | 47.3 | Very low | 191 Ų | 191 | 98 Ų | 98 | 100% | 1.336 | 58% | 0.583 | S | S | * | * | | | trans | -50.8 | 0 | -178.8 | 77.7 | 0 | 0 | 0 | 0 | 114.3 | | |