| 1 | M | 35.1 | Very low | 36.9 | Very low | 231 Ų | 231 | 158.1 Ų | 158.1 | 100% | 1.138 | 78% | 0.782 | S | S | * | * | | | | 0 | 148.1 | 0 | -73.2 | -176.3 | 175.9 | 0 | 0 | 108.9 | | |
| 2 | R | 35.3 | Very low | 36.3 | Very low | 215 Ų | 215 | 161.3 Ų | 161.3 | 81% | 0.811 | 79% | 0.794 | S | S | * | * | | | trans | 42.1 | 133.3 | 151.7 | -62.4 | -178.7 | -179.1 | -164.9 | -0.6 | 118.6 | | |
| 3 | R | 35.7 | Very low | 35.9 | Very low | 215 Ų | 215 | 160.5 Ų | 160.5 | 81% | 0.811 | 80% | 0.803 | S | S | * | * | | | cis | -160.1 | 146.3 | 16.3 | -127.8 | 171.3 | -174.4 | 173.8 | -2.1 | 111.7 | | |
| 4 | E | 40.1 | Very low | 35.4 | Very low | 159 Ų | 159 | 153.5 Ų | 153.5 | 74% | 0.743 | 79% | 0.792 | S | S | * | * | | | trans | -14.5 | 145.5 | 143.5 | -78.4 | -64 | 136.8 | 0 | 0 | 116.9 | G6 | E4-G6 PolarHBondContact OE2-N 3.3Š|
| 5 | P | 50.8 | Low | 36.8 | Very low | 127 Ų | 127 | 150.7 Ų | 150.7 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | | | | -140.8 | 142.5 | 66.7 | 39 | -22.9 | 0 | 0 | 0 | 118.8 | | |
| 6 | G | 34.8 | Very low | 36.6 | Very low | 54 Ų | 54 | 149.9 Ų | 149.9 | 56% | 0.557 | 79% | 0.785 | S | S | * | * | | | trans | -76.1 | -155.9 | 152.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | E4 | E4-G6 PolarHBondContact OE2-N 3.3Š|
| 7 | P | 50.1 | Low | 36.6 | Very low | 128 Ų | 128 | 149.3 Ų | 149.3 | 83% | 0.831 | 78% | 0.78 | S | S | * | * | | | cis | -127.8 | -168.9 | 20.7 | 43.8 | -28.8 | 0 | 0 | 0 | 115.9 | | |
| 8 | R | 30.8 | Very low | 36.1 | Very low | 197 Ų | 197 | 149.9 Ų | 149.9 | 74% | 0.743 | 78% | 0.778 | S | S | * | * | | | trans | -81.8 | -171.5 | 179.7 | -49.4 | 167.2 | 173.2 | 171.8 | -5.4 | 113.7 | | |
| 9 | Y | 32.5 | Very low | 35.9 | Very low | 175 Ų | 175 | 147.8 Ų | 147.8 | 69% | 0.686 | 77% | 0.773 | S | S | * | * | | | trans | 102.4 | 146.9 | 150.9 | -60.8 | -76.2 | 0 | 0 | 0 | 116.2 | | |
| 10 | Q | 29.2 | Very low | 35.5 | Very low | 176 Ų | 176 | 147.8 Ų | 147.8 | 82% | 0.822 | 77% | 0.774 | S | S | * | * | | | cis | -171.8 | 162.9 | -25.1 | -174.4 | 165.4 | 34 | 0 | 0 | 109.2 | | |
| 11 | G | 31.3 | Very low | 35.4 | Very low | 62 Ų | 62 | 146 Ų | 146 | 64% | 0.639 | 77% | 0.773 | S | S | * | * | | | trans | 98 | 134.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 12 | Q | 30.4 | Very low | 35.2 | Very low | 196 Ų | 196 | 143.5 Ų | 143.5 | 92% | 0.916 | 76% | 0.759 | S | S | * | * | | | cis | 52.9 | 93.8 | 22.4 | -75.4 | -164.2 | 17.8 | 0 | 0 | 114.8 | | |
| 13 | V | 30.4 | Very low | 35 | Very low | 151 Ų | 151 | 144.8 Ų | 144.8 | 92% | 0.915 | 76% | 0.764 | S | S | * | * | | | trans | -129.8 | 146.2 | 136 | -177.6 | 0 | 0 | 0 | 0 | 106.9 | | |
| 14 | G | 28.6 | Very low | 34.7 | Very low | 63 Ų | 63 | 139.5 Ų | 139.5 | 65% | 0.649 | 76% | 0.756 | S | S | * | * | | | trans | -83.6 | -148.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | | |
| 15 | P | 56.8 | Low | 34.1 | Very low | 111 Ų | 111 | 139.8 Ų | 139.8 | 72% | 0.721 | 76% | 0.761 | S | S | * | * | | | trans | -126.1 | -169.6 | -135.5 | 34.7 | -14.8 | 0 | 0 | 0 | 115.4 | | |
| 16 | D | 34.4 | Very low | 33 | Very low | 139 Ų | 139 | 138.5 Ų | 138.5 | 74% | 0.743 | 76% | 0.755 | S | S | * | * | | | trans | 99.2 | 139.3 | 144.5 | -71.4 | -25.2 | 0 | 0 | 0 | 122.3 | | |
| 17 | I | 35.3 | Very low | 32.5 | Very low | 139 Ų | 139 | 141 Ų | 141 | 71% | 0.713 | 76% | 0.764 | S | S | * | * | | | trans | 71.2 | 110.2 | 156.7 | -61.6 | 149.2 | 0 | 0 | 0 | 118.4 | | |
| 18 | H | 28.4 | Very low | 31.3 | Very low | 161 Ų | 161 | 140.6 Ų | 140.6 | 75% | 0.745 | 76% | 0.763 | S | S | * | * | | | | -158 | 112.8 | 106.5 | -122.5 | -76.4 | 0 | 0 | 0 | 115.6 | | |
| 19 | T | 31.8 | Very low | 31.3 | Very low | 109 Ų | 109 | 138 Ų | 138 | 67% | 0.669 | 76% | 0.759 | S | S | * | * | | | trans | 42.3 | 128 | 145.1 | 55.2 | 0 | 0 | 0 | 0 | 123.6 | | |
| 20 | D | 28.7 | Very low | 31.2 | Very low | 148 Ų | 148 | 135.8 Ų | 135.8 | 79% | 0.791 | 77% | 0.766 | S | S | * | * | | | trans | -40.9 | 154.2 | 155.8 | -51.9 | -80.7 | 0 | 0 | 0 | 117 | | |
| 21 | S | 32.2 | Very low | 31.5 | Very low | 110 Ų | 110 | 136.4 Ų | 136.4 | 77% | 0.769 | 76% | 0.761 | S | S | * | * | | | | 172.9 | 124.3 | 106.3 | -72.8 | 0 | 0 | 0 | 0 | 114.7 | | |
| 22 | E | 31.3 | Very low | 31.6 | Very low | 179 Ų | 179 | 138.8 Ų | 138.8 | 84% | 0.836 | 77% | 0.765 | S | S | * | * | | | trans | 26.2 | 129.6 | 148.3 | -52.8 | -165.1 | 110.8 | 0 | 0 | 123.3 | | |
| 23 | R | 31.3 | Very low | 31.5 | Very low | 242 Ų | 242 | 136.5 Ų | 136.5 | 91% | 0.913 | 76% | 0.759 | S | S | * | * | | | trans | -161 | 90.5 | 135.3 | -112 | 172.2 | -157.8 | -169.8 | 6.8 | 115 | | |
| 24 | T | 29.1 | Very low | 31.6 | Very low | 104 Ų | 104 | 138.4 Ų | 138.4 | 64% | 0.638 | 75% | 0.751 | S | S | * | * | | | trans | 19 | 139.4 | 130.9 | 59.6 | 0 | 0 | 0 | 0 | 121.9 | | |
| 25 | L | 28.5 | Very low | 31.6 | Very low | 164 Ų | 164 | 140.1 Ų | 140.1 | 86% | 0.859 | 75% | 0.753 | S | S | * | * | | | trans | 71.8 | 160.1 | 150.4 | -62.5 | 160.1 | 0 | 0 | 0 | 117.7 | | |
| 26 | S | 26.5 | Very low | 30.6 | Very low | 100 Ų | 100 | 140.7 Ų | 140.7 | 70% | 0.699 | 75% | 0.754 | S | S | * | * | | | cis | -173 | 149 | -28.1 | -174.8 | 0 | 0 | 0 | 0 | 112 | | |
| 27 | S | 24.8 | Very low | 30.6 | Very low | 106 Ų | 106 | 144 Ų | 144 | 74% | 0.741 | 76% | 0.762 | S | S | * | * | | | trans | 70.9 | 167.6 | 150.7 | -149.7 | 0 | 0 | 0 | 0 | 122.2 | | |
| 28 | C | 25.3 | Very low | 31.1 | Very low | 120 Ų | 120 | 146.6 Ų | 146.6 | 81% | 0.811 | 77% | 0.773 | S | S | * | * | | | trans | 73.9 | 126.9 | 162.1 | -69.1 | 0 | 0 | 0 | 0 | 121.4 | | |
| 29 | Q | 30.4 | Very low | 31.6 | Very low | 142 Ų | 142 | 147.7 Ų | 147.7 | 66% | 0.664 | 78% | 0.779 | S | S | * | * | | | trans | -75.7 | 174.4 | 158.9 | -59.3 | 176.8 | 5.6 | 0 | 0 | 110.3 | | |
| 30 | P | 29.6 | Very low | 32.4 | Very low | 129 Ų | 129 | 149.3 Ų | 149.3 | 84% | 0.838 | 79% | 0.788 | S | S | * | * | | | | -130.2 | 137.7 | 103.9 | 35.8 | -30.2 | 0 | 0 | 0 | 114.1 | | |
| 31 | R | 36 | Very low | 33.2 | Very low | 189 Ų | 189 | 150.4 Ų | 150.4 | 71% | 0.713 | 79% | 0.786 | S | S | * | * | | | trans | -76.2 | 152.7 | 158.4 | -77.4 | 170.1 | 170.4 | -175.9 | -3.1 | 109.3 | | |
| 32 | P | 34.3 | Very low | 34.1 | Very low | 112 Ų | 112 | 148.4 Ų | 148.4 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | | | | -139 | 145.9 | 115.7 | 29.9 | -14.6 | 0 | 0 | 0 | 115.3 | | |
| 33 | L | 28.6 | Very low | 34.7 | Very low | 148 Ų | 148 | 146.4 Ų | 146.4 | 78% | 0.775 | 77% | 0.774 | S | S | * | * | | | trans | 48.8 | 89.7 | 144 | -57.2 | 176.5 | 0 | 0 | 0 | 119.2 | | |
| 34 | Y | 31.7 | Very low | 35.6 | Very low | 192 Ų | 192 | 142.4 Ų | 142.4 | 75% | 0.753 | 77% | 0.769 | S | S | * | * | | | trans | -52.1 | 135.3 | 145.5 | 33.3 | -92.7 | 0 | 0 | 0 | 112.3 | | |
| 35 | S | 28.4 | Very low | 36.5 | Very low | 99 Ų | 99 | 144.6 Ų | 144.6 | 69% | 0.692 | 78% | 0.775 | S | S | * | * | | | | 179.1 | 140.8 | 125.5 | -171.8 | 0 | 0 | 0 | 0 | 113.2 | | |
| 36 | T | 36.4 | Very low | 37.4 | Very low | 122 Ų | 122 | 141.9 Ų | 141.9 | 75% | 0.748 | 77% | 0.771 | S | S | * | * | | | trans | 48.8 | 106.5 | 152.7 | 46.2 | 0 | 0 | 0 | 0 | 120.3 | | |
| 37 | K | 34.8 | Very low | 37.8 | Very low | 210 Ų | 210 | 141.7 Ų | 141.7 | 91% | 0.913 | 77% | 0.769 | S | S | * | * | | | | -153.2 | 156.2 | 100.3 | -103.2 | 159.7 | -174.4 | 173.6 | 0 | 110.6 | | |
| 38 | M | 44.5 | Very low | 39.2 | Very low | 192 Ų | 192 | 142.6 Ų | 142.6 | 95% | 0.946 | 77% | 0.772 | S | S | * | * | | | trans | -80.8 | 132.5 | -178.3 | -70.1 | 173 | 168.2 | 0 | 0 | 110.6 | | |
| 39 | E | 40.3 | Very low | 40.4 | Very low | 185 Ų | 185 | 142.7 Ų | 142.7 | 86% | 0.864 | 77% | 0.769 | S | S | * | * | | | trans | -118.6 | 119.2 | 168.4 | -171.3 | 169.6 | -140.5 | 0 | 0 | 108.8 | K41 | E39-K41 PolarHBondContact O-N 2.7Š|
| 40 | V | 48.3 | Very low | 41.2 | Very low | 142 Ų | 142 | 145.6 Ų | 145.6 | 86% | 0.861 | 78% | 0.78 | S | S | * | * | | | trans | -79.7 | 95.6 | -176.2 | 178.9 | 0 | 0 | 0 | 0 | 108.7 | G42 | V40-G42 VanDerWaalsContact C-N 3.35Å; V40-G42 PolarHBondContact O-N 3.38Å |
| 41 | K | 45.8 | Very low | 42.7 | Very low | 171 Ų | 171 | 147.7 Ų | 147.7 | 74% | 0.743 | 78% | 0.784 | S | S | * | * | | | trans | -71.3 | 87.5 | -178.2 | -158.7 | 169.5 | -172.2 | 166.2 | 0 | 111 | E39 Q43 | E39-K41 PolarHBondContact O-N 2.7Å; K41-Q43 VanDerWaalsContact C-N 3.25Å; K41-Q43 PolarHBondContact O-N 3.46Å |
| 42 | G | 49.2 | Very low | 42.8 | Very low | 68 Ų | 68 | 143 Ų | 143 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | | | trans | -66 | 78.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | V40 L44 | V40-G42 VanDerWaalsContact C-N 3.35Å; V40-G42 PolarHBondContact O-N 3.38Å; G42-L44 PolarHBondContact O-N 2.81Å |
| 43 | Q | 44.7 | Very low | 43.4 | Very low | 138 Ų | 138 | 143.6 Ų | 143.6 | 65% | 0.645 | 79% | 0.79 | S | S | * | * | | | trans | -74 | 92.8 | -175.5 | -151.4 | 96.3 | 17.8 | 0 | 0 | 110.2 | K41 I45 | K41-Q43 VanDerWaalsContact C-N 3.25Å; K41-Q43 PolarHBondContact O-N 3.46Å; Q43-I45 PolarHBondContact O-N 2.65Å |
| 44 | L | 51.5 | Low | 44.5 | Very low | 158 Ų | 158 | 142 Ų | 142 | 83% | 0.827 | 80% | 0.798 | S | S | * | * | | | trans | -62 | 116.8 | 171.8 | -72.6 | 173.4 | 0 | 0 | 0 | 109.9 | G42 S46 | G42-L44 PolarHBondContact O-N 2.81Å; L44-S46 VanDerWaalsContact C-N 3.27Å; L44-S46 PolarHBondContact O-N 3.17Å |
| 45 | I | 46.4 | Very low | 45.4 | Very low | 149 Ų | 149 | 136.6 Ų | 136.6 | 76% | 0.764 | 79% | 0.793 | S | S | * | * | | | trans | -84 | 71.5 | -178.5 | -47.8 | -179.7 | 0 | 0 | 0 | 110 | Q43 S47 | Q43-I45 PolarHBondContact O-N 2.65Å; I45-S47 PolarHBondContact O-N 3.09Å; I45-S47 VanDerWaalsContact O-N 3.14Å |
| 46 | S | 47.8 | Very low | 46.7 | Very low | 108 Ų | 108 | 139.8 Ų | 139.8 | 76% | 0.755 | 80% | 0.801 | S | S | * | * | | | trans | -61.8 | 110.9 | 164.2 | -63.2 | 0 | 0 | 0 | 0 | 108.8 | L44 P48 | L44-S46 VanDerWaalsContact C-N 3.27Å; L44-S46 PolarHBondContact O-N 3.17Å; S46-P48 WeakPolarHBondContact O-CD 3.37Å |
| 47 | S | 34.1 | Very low | 47.1 | Very low | 95 Ų | 95 | 142.7 Ų | 142.7 | 66% | 0.664 | 80% | 0.804 | S | S | * | * | | | trans | -75.2 | 119 | -170.2 | -67.4 | 0 | 0 | 0 | 0 | 112.3 | I45 T49 | I45-S47 PolarHBondContact O-N 3.09Å; I45-S47 VanDerWaalsContact O-N 3.14Å; S47-T49 PolarHBondContact O-N 3.44Å; S47-T49 VanDerWaalsContact O-N 3.16Å |
| 48 | P | 55.4 | Low | 48 | Very low | 125 Ų | 125 | 135.6 Ų | 135.6 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | | | trans | -91.6 | 70 | -171.7 | 36.7 | -35.4 | 0 | 0 | 0 | 112.3 | S46 | S46-P48 WeakPolarHBondContact O-CD 3.37Š|
| 49 | T | 50.3 | Low | 48.4 | Very low | 122 Ų | 122 | 135.4 Ų | 135.4 | 75% | 0.748 | 79% | 0.787 | S | S | * | * | | | trans | -131.7 | 53 | 179.5 | 50.8 | 0 | 0 | 0 | 0 | 113.5 | S47 | S47-T49 PolarHBondContact O-N 3.44Å; S47-T49 VanDerWaalsContact O-N 3.16Å |
| 50 | F | 46.7 | Very low | 49.1 | Very low | 204 Ų | 204 | 129.5 Ų | 129.5 | 90% | 0.895 | 77% | 0.77 | S | S | * | * | | | trans | -148.3 | 60.9 | 159.3 | -146.3 | -86.3 | 0 | 0 | 0 | 112.9 | | |
| 51 | N | 62.5 | Low | 49.8 | Very low | 173 Ų | 173 | 124.5 Ų | 124.5 | 93% | 0.925 | 74% | 0.744 | S | S | * | * | | | trans | -151.3 | 101.3 | 161.9 | -99.9 | -32.2 | 0 | 0 | 0 | 109.4 | | |
| 52 | A | 36.9 | Very low | 50.9 | Low | 89 Ų | 89 | 120.3 Ų | 120.3 | 74% | 0.736 | 73% | 0.734 | S | S | * | * | | | trans | -127.2 | 148 | 168.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | A54 | A52-A54 PolarHBondContact O-N 3.43Š|
| 53 | P | 47.5 | Very low | 52.2 | Low | 126 Ų | 126 | 122.2 Ų | 122.2 | 82% | 0.818 | 73% | 0.725 | S | S | * | * | | | trans | -68.4 | 127.1 | -157.9 | 24.9 | -34.6 | 0 | 0 | 0 | 113.7 | A55 | P53-A55 PolarHBondContact O-N 3.14Š|
| 54 | A | 50.4 | Low | 53.9 | Low | 114 Ų | 114 | 120.1 Ų | 120.1 | 94% | 0.942 | 72% | 0.721 | S | S | * | * | | | trans | -80.8 | 53.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | A52 | A52-A54 PolarHBondContact O-N 3.43Š|
| 55 | A | 52 | Low | 55.4 | Low | 79 Ų | 79 | 119.7 Ų | 119.7 | 65% | 0.653 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -155.6 | 84.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | P53 | P53-A55 PolarHBondContact O-N 3.14Š|
| 56 | L | 54.2 | Low | 57.2 | Low | 166 Ų | 166 | 115 Ų | 115 | 87% | 0.869 | 69% | 0.693 | S | S | * | * | S | Bend | trans | 175.3 | -13.6 | 150.1 | -101.6 | 158.9 | 0 | 0 | 0 | 114.4 | | |
| 57 | F | 44.9 | Very low | 59.3 | Low | 183 Ų | 183 | 114.6 Ų | 114.6 | 80% | 0.803 | 68% | 0.679 | S | S | * | * | | | trans | -109.8 | 82.5 | 177.1 | -69.2 | -78.3 | 0 | 0 | 0 | 112.2 | | |
| 58 | G | 54.2 | Low | 62.1 | Low | 61 Ų | 61 | 119.2 Ų | 119.2 | 63% | 0.629 | 68% | 0.682 | S | S | * | * | | | trans | -67.3 | 160.8 | 162.8 | 0 | 0 | 0 | 0 | 0 | 112 | A60 | G58-A60 VanDerWaalsContact C-N 3.26Å; G58-A60 PolarHBondContact O-N 3.29Å |
| 59 | E | 53.8 | Low | 64 | Low | 188 Ų | 188 | 118.2 Ų | 118.2 | 88% | 0.879 | 67% | 0.669 | S | S | * | * | S | Bend | trans | 60.9 | -43.9 | 169.1 | -54.5 | -164.1 | 125.4 | 0 | 0 | 119.1 | P62 | E59-P62 VanDerWaalsContact O-CD 3.27Å; E59-P62 WeakPolarHBondContact O-CD 3.19Å; E59-P62 WeakPolarHBondContact O-CG 3.31Å |
| 60 | A | 54.2 | Low | 66.1 | Low | 60 Ų | 60 | 120 Ų | 120 | 50% | 0.496 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -76.4 | -27.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | G58 Q63 V64 | G58-A60 VanDerWaalsContact C-N 3.26Å; G58-A60 PolarHBondContact O-N 3.29Å; A60-Q63 PolarHBondContact O-N 2.84Å; A60-V64 PolarHBondContact O-N 3.44Å |
| 61 | A | 64 | Low | 68.5 | Low | 38 Ų | 38 | 111.9 Ų | 111.9 | 31% | 0.314 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -62.4 | -36.7 | -174.7 | 0 | 0 | 0 | 0 | 0 | 116.9 | K65 | A61-K65 VanDerWaalsContact O-CD 3.26Å; A61-K65 WeakPolarHBondContact O-CD 3.13Å; A61-K65 WeakPolarHBondContact O-CE 3.24Å; A61-K65 VanDerWaalsContact O-CG 3.22Å; A61-K65 WeakPolarHBondContact O-CG 3.2Å |
| 62 | P | 68.6 | Low | 70.1 | Confident | 82 Ų | 82 | 108.3 Ų | 108.3 | 53% | 0.532 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -71.2 | -37.9 | 174.7 | 26 | -35.4 | 0 | 0 | 0 | 113.2 | E59 K65 S66 | E59-P62 VanDerWaalsContact O-CD 3.27Å; E59-P62 WeakPolarHBondContact O-CD 3.19Å; E59-P62 WeakPolarHBondContact O-CG 3.31Å; P62-K65 WeakPolarHBondContact O-CB 3.41Å; P62-K65 PolarHBondContact O-N 2.83Å; P62-S66 PolarHBondContact O-N 3.11Å |
| 63 | Q | 75.8 | Confident | 73 | Confident | 109 Ų | 109 | 107.6 Ų | 107.6 | 51% | 0.509 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -62.3 | -51.5 | -176.4 | -170.2 | 70.6 | 8 | 0 | 0 | 111.5 | A60 K65 S66 E67 | A60-Q63 PolarHBondContact O-N 2.84Å; Q63-K65 PolarHBondContact O-N 3.1Å; Q63-S66 PolarHBondContact O-N 3.05Å; Q63-S66 VanDerWaalsContact O-N 3.14Å; Q63-S66 PolarHBondContact O-OG 3.42Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.07Å; Q63-E67 PolarHBondContact NE2-OE1 2.72Å; Q63-E67 VanDerWaalsContact NE2-OE1 3.13Å; Q63-E67 WeakPolarHBondContact O-CB 3.43Å; Q63-E67 WeakPolarHBondContact O-CG 3.49Å; Q63-E67 PolarHBondContact O-N 3.36Å |
| 64 | V | 80.8 | Confident | 75.3 | Confident | 94 Ų | 94 | 104.7 Ų | 104.7 | 57% | 0.57 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -63 | -27.5 | 178.3 | 179.8 | 0 | 0 | 0 | 0 | 112.1 | A60 R68 | A60-V64 PolarHBondContact O-N 3.44Å; V64-R68 VanDerWaalsContact O-CB 3.24Å; V64-R68 WeakPolarHBondContact O-CB 3.31Å; V64-R68 PolarHBondContact O-N 2.7Å; V64-R68 VanDerWaalsContact O-N 3.07Å |
| 65 | K | 81.8 | Confident | 77.6 | Confident | 148 Ų | 148 | 107.5 Ų | 107.5 | 64% | 0.643 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -74.8 | -41.8 | 174.8 | -70.3 | 170.9 | -170.1 | 175.3 | 0 | 112.2 | A61 P62 Q63 R68 L69 | A61-K65 VanDerWaalsContact O-CD 3.26Å; A61-K65 WeakPolarHBondContact O-CD 3.13Å; A61-K65 WeakPolarHBondContact O-CE 3.24Å; A61-K65 VanDerWaalsContact O-CG 3.22Å; A61-K65 WeakPolarHBondContact O-CG 3.2Å; P62-K65 WeakPolarHBondContact O-CB 3.41Å; P62-K65 PolarHBondContact O-N 2.83Å; Q63-K65 PolarHBondContact O-N 3.1Å; K65-R68 PolarHBondContact O-N 2.73Å; K65-L69 WeakPolarHBondContact O-CB 3.5Å; K65-L69 PolarHBondContact O-N 3.3Å |
| 66 | S | 85.4 | Confident | 79.7 | Confident | 52 Ų | 52 | 109.7 Ų | 109.7 | 36% | 0.364 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -70.6 | -36.9 | 178.5 | 70.7 | 0 | 0 | 0 | 0 | 111.7 | P62 Q63 L69 R70 | P62-S66 PolarHBondContact O-N 3.11Å; Q63-S66 PolarHBondContact O-N 3.05Å; Q63-S66 VanDerWaalsContact O-N 3.14Å; Q63-S66 PolarHBondContact O-OG 3.42Å; S66-L69 PolarHBondContact O-N 2.87Å; S66-R70 WeakPolarHBondContact O-CB 3.45Å; S66-R70 PolarHBondContact O-N 3.29Å |
| 67 | E | 91.6 | Very high | 81.8 | Confident | 99 Ų | 99 | 108.7 Ų | 108.7 | 46% | 0.463 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.1 | -44 | 171.3 | -72.2 | 170.1 | -173.3 | 0 | 0 | 111.9 | Q63 L69 R70 G71 | Q63-E67 WeakPolarHBondContact CG-OE1 3.07Å; Q63-E67 PolarHBondContact NE2-OE1 2.72Å; Q63-E67 VanDerWaalsContact NE2-OE1 3.13Å; Q63-E67 WeakPolarHBondContact O-CB 3.43Å; Q63-E67 WeakPolarHBondContact O-CG 3.49Å; Q63-E67 PolarHBondContact O-N 3.36Å; E67-L69 PolarHBondContact O-N 3.34Å; E67-R70 PolarHBondContact O-N 3.3Å; E67-G71 PolarHBondContact O-N 3.01Å |
| 68 | R | 92.9 | Very high | 84.2 | Confident | 192 Ų | 192 | 103.8 Ų | 103.8 | 73% | 0.725 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.7 | -38.8 | 174.3 | -177.6 | 174.1 | 177.1 | 171.1 | -0.7 | 112.4 | V64 K65 L72 | V64-R68 VanDerWaalsContact O-CB 3.24Å; V64-R68 WeakPolarHBondContact O-CB 3.31Å; V64-R68 PolarHBondContact O-N 2.7Å; V64-R68 VanDerWaalsContact O-N 3.07Å; K65-R68 PolarHBondContact O-N 2.73Å; R68-L72 WeakPolarHBondContact O-CG 3.36Å; R68-L72 PolarHBondContact O-N 3.42Å; R68-L72 VanDerWaalsContact O-N 3.11Å |
| 69 | L | 95.6 | Very high | 86.3 | Confident | 104 Ų | 104 | 106.9 Ų | 106.9 | 55% | 0.545 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.5 | -45.8 | 175.3 | 179 | 59.4 | 0 | 0 | 0 | 111.1 | K65 S66 E67 G71 L72 L73 | K65-L69 WeakPolarHBondContact O-CB 3.5Å; K65-L69 PolarHBondContact O-N 3.3Å; S66-L69 PolarHBondContact O-N 2.87Å; E67-L69 PolarHBondContact O-N 3.34Å; L69-G71 PolarHBondContact O-N 3.31Å; L69-L72 WeakPolarHBondContact O-CB 3.49Å; L69-L72 PolarHBondContact O-N 2.94Å; L69-L72 VanDerWaalsContact O-N 3.08Å; L69-L73 HydrophobicContact CD1-CD1 4.46Å; L69-L73 HydrophobicContact CD1-CG 4.46Å; L69-L73 HydrophobicContact CG-CD1 4.22Å; L69-L73 WeakPolarHBondContact O-CG 3.18Å; L69-L73 PolarHBondContact O-N 2.98Å |
| 70 | R | 94.7 | Very high | 88.4 | Confident | 160 Ų | 160 | 103.5 Ų | 103.5 | 60% | 0.604 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -56.3 | -50 | 174.4 | -171.7 | -178.6 | -58.8 | 179 | 3.1 | 111.2 | S66 E67 L72 L73 D74 | S66-R70 WeakPolarHBondContact O-CB 3.45Å; S66-R70 PolarHBondContact O-N 3.29Å; E67-R70 PolarHBondContact O-N 3.3Å; R70-L72 PolarHBondContact O-N 3.35Å; R70-L73 PolarHBondContact O-N 2.95Å; R70-D74 WeakPolarHBondContact CG-OD2 3.43Å; R70-D74 PolarHBondContact O-N 3.39Å |
| 71 | G | 96.4 | Very high | 90.4 | Very high | 32 Ų | 32 | 106 Ų | 106 | 33% | 0.33 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.7 | -18.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | E67 L69 R75 | E67-G71 PolarHBondContact O-N 3.01Å; L69-G71 PolarHBondContact O-N 3.31Å; G71-R75 VanDerWaalsContact O-CD 3.23Å; G71-R75 WeakPolarHBondContact O-CD 3.3Å; G71-R75 WeakPolarHBondContact O-CG 3.49Å; G71-R75 PolarHBondContact O-N 3.24Å |
| 72 | L | 97.3 | Very high | 92 | Very high | 98 Ų | 98 | 106.5 Ų | 106.5 | 51% | 0.513 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -83.2 | -40.5 | 169.3 | -72.8 | 171.2 | 0 | 0 | 0 | 111.9 | R68 L69 R70 R75 Q76 | R68-L72 WeakPolarHBondContact O-CG 3.36Å; R68-L72 PolarHBondContact O-N 3.42Å; R68-L72 VanDerWaalsContact O-N 3.11Å; L69-L72 WeakPolarHBondContact O-CB 3.49Å; L69-L72 PolarHBondContact O-N 2.94Å; L69-L72 VanDerWaalsContact O-N 3.08Å; R70-L72 PolarHBondContact O-N 3.35Å; L72-R75 PolarHBondContact O-N 3Å; L72-Q76 PolarHBondContact O-N 3.33Å |
| 73 | L | 97 | Very high | 93.4 | Very high | 74 Ų | 74 | 106.8 Ų | 106.8 | 39% | 0.387 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.4 | -38.6 | 175.1 | -67.2 | 169.2 | 0 | 0 | 0 | 111.8 | L69 R70 Q76 R77 | L69-L73 HydrophobicContact CD1-CD1 4.46Å; L69-L73 HydrophobicContact CD1-CG 4.46Å; L69-L73 HydrophobicContact CG-CD1 4.22Å; L69-L73 WeakPolarHBondContact O-CG 3.18Å; L69-L73 PolarHBondContact O-N 2.98Å; R70-L73 PolarHBondContact O-N 2.95Å; L73-Q76 WeakPolarHBondContact O-CB 3.38Å; L73-Q76 PolarHBondContact O-N 3.39Å; L73-R77 VanDerWaalsContact O-CG 3.31Å; L73-R77 WeakPolarHBondContact O-CG 3.39Å; L73-R77 PolarHBondContact O-N 3.46Å |
| 74 | D | 96.6 | Very high | 94.3 | Very high | 65 Ų | 65 | 105.4 Ų | 105.4 | 35% | 0.348 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -73 | -30 | 177.4 | -62.5 | -30.5 | 0 | 0 | 0 | 112.1 | R70 R77 T78 | R70-D74 WeakPolarHBondContact CG-OD2 3.43Å; R70-D74 PolarHBondContact O-N 3.39Å; D74-R77 IonicContact OD1-CZ 3.77Å; D74-R77 IonicContact OD1-NH1 2.72Å; D74-R77 PolarHBondContact OD1-NH1 3.02Å; D74-T78 WeakPolarHBondContact O-CG2 3.47Å; D74-T78 PolarHBondContact O-N 2.84Å; D74-T78 PolarHBondContact O-OG1 2.73Å |
| 75 | R | 96.9 | Very high | 95.1 | Very high | 173 Ų | 173 | 105.6 Ų | 105.6 | 65% | 0.653 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -68.4 | -37.5 | 166.7 | -74.6 | 171.3 | -171 | -160.4 | 1.1 | 112.2 | G71 L72 T78 L79 | G71-R75 VanDerWaalsContact O-CD 3.23Å; G71-R75 WeakPolarHBondContact O-CD 3.3Å; G71-R75 WeakPolarHBondContact O-CG 3.49Å; G71-R75 PolarHBondContact O-N 3.24Å; L72-R75 PolarHBondContact O-N 3Å; R75-T78 WeakPolarHBondContact CA-OG1 3.26Å; R75-T78 PolarHBondContact O-OG1 3.37Å; R75-L79 VanDerWaalsContact O-CB 3.3Å; R75-L79 WeakPolarHBondContact O-CB 3.49Å; R75-L79 WeakPolarHBondContact O-CD1 3.35Å; R75-L79 WeakPolarHBondContact O-CG 3.48Å; R75-L79 PolarHBondContact O-N 2.99Å |
| 76 | Q | 97.2 | Very high | 95.8 | Very high | 125 Ų | 125 | 104.1 Ų | 104.1 | 58% | 0.584 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.1 | -45.1 | 174.4 | -173.8 | -176.8 | 8.2 | 0 | 0 | 111.1 | L72 L73 L79 Q80 | L72-Q76 PolarHBondContact O-N 3.33Å; L73-Q76 WeakPolarHBondContact O-CB 3.38Å; L73-Q76 PolarHBondContact O-N 3.39Å; Q76-L79 PolarHBondContact O-N 2.95Å; Q76-Q80 WeakPolarHBondContact O-CB 3.27Å; Q76-Q80 PolarHBondContact O-N 3.01Å |
| 77 | R | 97.4 | Very high | 96.3 | Very high | 146 Ų | 146 | 105.1 Ų | 105.1 | 55% | 0.551 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58.5 | -55.8 | 175.8 | -72.7 | 163.5 | 172.3 | 164.2 | -6.4 | 112 | L73 D74 L79 Q80 E81 | L73-R77 VanDerWaalsContact O-CG 3.31Å; L73-R77 WeakPolarHBondContact O-CG 3.39Å; L73-R77 PolarHBondContact O-N 3.46Å; D74-R77 IonicContact OD1-CZ 3.77Å; D74-R77 IonicContact OD1-NH1 2.72Å; D74-R77 PolarHBondContact OD1-NH1 3.02Å; R77-L79 VanDerWaalsContact C-N 3.31Å; R77-L79 PolarHBondContact O-N 3.33Å; R77-Q80 WeakPolarHBondContact O-CA 3.35Å; R77-Q80 WeakPolarHBondContact O-CB 3.32Å; R77-Q80 PolarHBondContact O-N 3.03Å; R77-E81 WeakPolarHBondContact O-CG 3.42Å; R77-E81 PolarHBondContact O-N 3.17Å |
| 78 | T | 97 | Very high | 96.4 | Very high | 79 Ų | 79 | 104.6 Ų | 104.6 | 49% | 0.485 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.3 | -33.7 | -179.6 | 47.3 | 0 | 0 | 0 | 0 | 113.4 | D74 R75 A82 | D74-T78 WeakPolarHBondContact O-CG2 3.47Å; D74-T78 PolarHBondContact O-N 2.84Å; D74-T78 PolarHBondContact O-OG1 2.73Å; R75-T78 WeakPolarHBondContact CA-OG1 3.26Å; R75-T78 PolarHBondContact O-OG1 3.37Å; T78-A82 VanDerWaalsContact O-CB 3.28Å; T78-A82 WeakPolarHBondContact O-CB 3.41Å; T78-A82 PolarHBondContact O-N 3.32Å |
| 79 | L | 97.9 | Very high | 96.5 | Very high | 127 Ų | 127 | 99.8 Ų | 99.8 | 67% | 0.665 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -69.5 | -38.4 | 171.1 | -72.8 | 170.9 | 0 | 0 | 0 | 112.7 | R75 Q76 R77 L83 | R75-L79 VanDerWaalsContact O-CB 3.3Å; R75-L79 WeakPolarHBondContact O-CB 3.49Å; R75-L79 WeakPolarHBondContact O-CD1 3.35Å; R75-L79 WeakPolarHBondContact O-CG 3.48Å; R75-L79 PolarHBondContact O-N 2.99Å; Q76-L79 PolarHBondContact O-N 2.95Å; R77-L79 VanDerWaalsContact C-N 3.31Å; R77-L79 PolarHBondContact O-N 3.33Å; L79-L83 WeakPolarHBondContact O-CB 3.3Å; L79-L83 PolarHBondContact O-N 3.26Å |
| 80 | Q | 96.9 | Very high | 96.4 | Very high | 116 Ų | 116 | 99 Ų | 99 | 54% | 0.542 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -68.5 | -38.2 | 176.7 | -171.8 | 62.8 | 48.3 | 0 | 0 | 112 | Q76 R77 L83 N84 | Q76-Q80 WeakPolarHBondContact O-CB 3.27Å; Q76-Q80 PolarHBondContact O-N 3.01Å; R77-Q80 WeakPolarHBondContact O-CA 3.35Å; R77-Q80 WeakPolarHBondContact O-CB 3.32Å; R77-Q80 PolarHBondContact O-N 3.03Å; Q80-L83 PolarHBondContact O-N 3.09Å; Q80-N84 WeakPolarHBondContact O-CB 3.47Å; Q80-N84 PolarHBondContact O-N 3.05Å |
| 81 | E | 97.3 | Very high | 96.1 | Very high | 114 Ų | 114 | 94.8 Ų | 94.8 | 53% | 0.533 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64.8 | -47.8 | 173.1 | -71.6 | 158 | -161.2 | 0 | 0 | 111.1 | R77 L83 N84 L85 | R77-E81 WeakPolarHBondContact O-CG 3.42Å; R77-E81 PolarHBondContact O-N 3.17Å; E81-L83 VanDerWaalsContact C-N 3.32Å; E81-L83 PolarHBondContact O-N 3.39Å; E81-N84 PolarHBondContact O-N 3.1Å; E81-L85 WeakPolarHBondContact O-CG 3.42Å; E81-L85 PolarHBondContact O-N 2.84Å |
| 82 | A | 97.3 | Very high | 95.8 | Very high | 47 Ų | 47 | 99 Ų | 99 | 39% | 0.388 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61 | -39.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | T78 L85 K86 | T78-A82 VanDerWaalsContact O-CB 3.28Å; T78-A82 WeakPolarHBondContact O-CB 3.41Å; T78-A82 PolarHBondContact O-N 3.32Å; A82-L85 PolarHBondContact O-N 3.32Å; A82-K86 WeakPolarHBondContact O-CG 3.42Å; A82-K86 PolarHBondContact O-N 3.45Å |
| 83 | L | 96.9 | Very high | 95.4 | Very high | 88 Ų | 88 | 97.5 Ų | 97.5 | 46% | 0.461 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.2 | -45.5 | 173.6 | 177.8 | 60.4 | 0 | 0 | 0 | 111.5 | L79 Q80 E81 L85 K86 L87 | L79-L83 WeakPolarHBondContact O-CB 3.3Å; L79-L83 PolarHBondContact O-N 3.26Å; Q80-L83 PolarHBondContact O-N 3.09Å; E81-L83 VanDerWaalsContact C-N 3.32Å; E81-L83 PolarHBondContact O-N 3.39Å; L83-L85 PolarHBondContact O-N 3.48Å; L83-K86 PolarHBondContact O-N 2.87Å; L83-L87 HydrophobicContact CD1-CD1 4.27Å; L83-L87 HydrophobicContact CD1-CG 4.32Å; L83-L87 HydrophobicContact CG-CD1 4.1Å; L83-L87 WeakPolarHBondContact O-CG 3.27Å; L83-L87 PolarHBondContact O-N 2.92Å |
| 84 | N | 96.2 | Very high | 94.9 | Very high | 80 Ų | 80 | 94.7 Ų | 94.7 | 43% | 0.428 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -60.5 | -45.6 | 177.3 | -167.3 | -44.5 | 0 | 0 | 0 | 111.1 | Q80 E81 K86 L87 Q88 | Q80-N84 WeakPolarHBondContact O-CB 3.47Å; Q80-N84 PolarHBondContact O-N 3.05Å; E81-N84 PolarHBondContact O-N 3.1Å; N84-K86 VanDerWaalsContact C-N 3.33Å; N84-K86 PolarHBondContact O-N 3.47Å; N84-L87 PolarHBondContact O-N 3.04Å; N84-Q88 WeakPolarHBondContact O-CG 3.48Å; N84-Q88 PolarHBondContact O-N 3.33Å; N84-Q88 PolarHBondContact OD1-NE2 2.9Å |
| 85 | L | 96.6 | Very high | 94.3 | Very high | 98 Ų | 98 | 95.6 Ų | 95.6 | 51% | 0.513 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -57.7 | -42.8 | 174.3 | -71.3 | 171.6 | 0 | 0 | 0 | 112.3 | E81 A82 L83 Q88 E89 | E81-L85 WeakPolarHBondContact O-CG 3.42Å; E81-L85 PolarHBondContact O-N 2.84Å; A82-L85 PolarHBondContact O-N 3.32Å; L83-L85 PolarHBondContact O-N 3.48Å; L85-Q88 PolarHBondContact O-N 2.96Å; L85-E89 WeakPolarHBondContact O-CG 3.36Å; L85-E89 PolarHBondContact O-N 3.15Å |
| 86 | K | 96.9 | Very high | 93.6 | Very high | 118 Ų | 118 | 93.4 Ų | 93.4 | 51% | 0.513 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -68.1 | -34.7 | 176.8 | -67 | -68 | 150.6 | -153.8 | 0 | 113.1 | A82 L83 N84 E89 L90 | A82-K86 WeakPolarHBondContact O-CG 3.42Å; A82-K86 PolarHBondContact O-N 3.45Å; L83-K86 PolarHBondContact O-N 2.87Å; N84-K86 VanDerWaalsContact C-N 3.33Å; N84-K86 PolarHBondContact O-N 3.47Å; K86-E89 WeakPolarHBondContact CD-OE2 3.36Å; K86-E89 IonicContact NZ-OE1 3.37Å; K86-E89 PolarHBondContact NZ-OE1 2.96Å; K86-E89 IonicContact NZ-OE2 3.24Å; K86-E89 PolarHBondContact NZ-OE2 3.4Å; K86-L90 WeakPolarHBondContact O-CB 3.44Å; K86-L90 PolarHBondContact O-N 2.83Å |
| 87 | L | 95.4 | Very high | 92.9 | Very high | 72 Ų | 72 | 92.4 Ų | 92.4 | 38% | 0.377 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -68 | -37 | 172.4 | -67.9 | 168.6 | 0 | 0 | 0 | 111.9 | L83 N84 L90 R91 P109 | L83-L87 HydrophobicContact CD1-CD1 4.27Å; L83-L87 HydrophobicContact CD1-CG 4.32Å; L83-L87 HydrophobicContact CG-CD1 4.1Å; L83-L87 WeakPolarHBondContact O-CG 3.27Å; L83-L87 PolarHBondContact O-N 2.92Å; N84-L87 PolarHBondContact O-N 3.04Å; L87-L90 PolarHBondContact O-N 3.24Å; L87-R91 WeakPolarHBondContact O-CB 3.41Å; L87-R91 PolarHBondContact O-N 2.82Å; L87-P109 HydrophobicContact CD2-CB 4.42Å; L87-P109 HydrophobicContact CD2-CG 3.79Å |
| 88 | Q | 94.5 | Very high | 92.1 | Very high | 89 Ų | 89 | 85.6 Ų | 85.6 | 42% | 0.416 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -68.5 | -40.6 | 173.7 | -70.3 | -178.2 | 32.1 | 0 | 0 | 112.9 | N84 L85 K92 | N84-Q88 WeakPolarHBondContact O-CG 3.48Å; N84-Q88 PolarHBondContact O-N 3.33Å; N84-Q88 PolarHBondContact OD1-NE2 2.9Å; L85-Q88 PolarHBondContact O-N 2.96Å; Q88-K92 WeakPolarHBondContact O-CD 3.46Å; Q88-K92 VanDerWaalsContact O-CG 3.27Å; Q88-K92 WeakPolarHBondContact O-CG 3.43Å; Q88-K92 PolarHBondContact O-N 3.31Å |
| 89 | E | 94.4 | Very high | 91.2 | Very high | 91 Ų | 91 | 86.9 Ų | 86.9 | 43% | 0.425 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -59.6 | -49.5 | 171.7 | -75.7 | 173.5 | -160.3 | 0 | 0 | 110.7 | L85 K86 R91 K92 V93 | L85-E89 WeakPolarHBondContact O-CG 3.36Å; L85-E89 PolarHBondContact O-N 3.15Å; K86-E89 WeakPolarHBondContact CD-OE2 3.36Å; K86-E89 IonicContact NZ-OE1 3.37Å; K86-E89 PolarHBondContact NZ-OE1 2.96Å; K86-E89 IonicContact NZ-OE2 3.24Å; K86-E89 PolarHBondContact NZ-OE2 3.4Å; E89-R91 PolarHBondContact O-N 2.9Å; E89-K92 WeakPolarHBondContact O-CB 3.25Å; E89-K92 PolarHBondContact O-N 3.29Å; E89-K92 VanDerWaalsContact O-N 3.17Å; E89-V93 PolarHBondContact O-N 2.94Å |
| 90 | L | 92.6 | Very high | 89.9 | Confident | 88 Ų | 88 | 88.3 Ų | 88.3 | 46% | 0.461 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -59 | -46.9 | 177.2 | -177.8 | 62.3 | 0 | 0 | 0 | 111.6 | K86 L87 K92 V93 C94 P109 | K86-L90 WeakPolarHBondContact O-CB 3.44Å; K86-L90 PolarHBondContact O-N 2.83Å; L87-L90 PolarHBondContact O-N 3.24Å; L90-K92 VanDerWaalsContact C-N 3.28Å; L90-K92 PolarHBondContact O-N 3.25Å; L90-V93 PolarHBondContact O-N 2.93Å; L90-V93 VanDerWaalsContact O-N 3.15Å; L90-C94 PolarHBondContact O-N 3.28Å; L90-C94 PolarHBondContact O-SG 2.89Å; L90-P109 HydrophobicContact CD2-CG 4.46Å |
| 91 | R | 88.6 | Confident | 88.6 | Confident | 70 Ų | 70 | 86.5 Ų | 86.5 | 26% | 0.264 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -58.9 | -37.4 | 176.5 | -177.2 | 172.2 | 170.9 | 148.1 | -4.5 | 112.1 | L87 E89 L95 P109 E114 | L87-R91 WeakPolarHBondContact O-CB 3.41Å; L87-R91 PolarHBondContact O-N 2.82Å; E89-R91 PolarHBondContact O-N 2.9Å; R91-L95 HydrophobicContact CG-CD1 4.14Å; R91-L95 WeakPolarHBondContact O-CB 3.47Å; R91-L95 WeakPolarHBondContact O-CD1 3.46Å; R91-L95 VanDerWaalsContact O-CG 3.22Å; R91-L95 WeakPolarHBondContact O-CG 3.01Å; R91-L95 PolarHBondContact O-N 3.39Å; R91-L95 VanDerWaalsContact O-N 3.11Å; R91-P109 PolarHBondContact NH1-O 2.77Å; R91-E114 IonicContact CZ-OE2 3.5Å; R91-E114 VanDerWaalsContact CZ-OE2 3.23Å; R91-E114 IonicContact NH1-OE2 2.77Å; R91-E114 PolarHBondContact NH1-OE2 3.48Å; R91-E114 IonicContact NH2-OE1 2.78Å; R91-E114 PolarHBondContact NH2-OE1 2.88Å; R91-E114 IonicContact NH2-OE2 3.21Å; R91-E114 PolarHBondContact NH2-OE2 2.89Å |
| 92 | K | 91.4 | Very high | 87 | Confident | 121 Ų | 121 | 81.7 Ų | 81.7 | 53% | 0.526 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -65.5 | -45.4 | 174.4 | -71.1 | 162.6 | -172.8 | 168.8 | 0 | 111.8 | Q88 E89 L90 L95 Q96 | Q88-K92 WeakPolarHBondContact O-CD 3.46Å; Q88-K92 VanDerWaalsContact O-CG 3.27Å; Q88-K92 WeakPolarHBondContact O-CG 3.43Å; Q88-K92 PolarHBondContact O-N 3.31Å; E89-K92 WeakPolarHBondContact O-CB 3.25Å; E89-K92 PolarHBondContact O-N 3.29Å; E89-K92 VanDerWaalsContact O-N 3.17Å; L90-K92 VanDerWaalsContact C-N 3.28Å; L90-K92 PolarHBondContact O-N 3.25Å; K92-L95 PolarHBondContact O-N 2.8Å; K92-Q96 WeakPolarHBondContact O-CG 3.47Å; K92-Q96 PolarHBondContact O-N 3.38Å; K92-Q96 VanDerWaalsContact O-N 3.09Å |
| 93 | V | 89 | Confident | 85.3 | Confident | 67 Ų | 67 | 86.5 Ų | 86.5 | 41% | 0.406 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -64.4 | -48.9 | 178 | 177.7 | 0 | 0 | 0 | 0 | 110.8 | E89 L90 L95 Q96 E97 | E89-V93 PolarHBondContact O-N 2.94Å; L90-V93 PolarHBondContact O-N 2.93Å; L90-V93 VanDerWaalsContact O-N 3.15Å; V93-L95 VanDerWaalsContact C-N 3.28Å; V93-L95 PolarHBondContact O-N 2.84Å; V93-Q96 WeakPolarHBondContact O-CB 3.3Å; V93-Q96 PolarHBondContact O-N 2.91Å; V93-E97 HydrophobicContact CG1-CG 4.31Å; V93-E97 PolarHBondContact O-N 3.37Å |
| 94 | C | 85.7 | Confident | 83.8 | Confident | 14 Ų | 14 | 84.6 Ų | 84.6 | 10% | 0.095 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -59.6 | -36.2 | 178.9 | -65.1 | 0 | 0 | 0 | 0 | 112.9 | L90 A98 L104 C108 | L90-C94 PolarHBondContact O-N 3.28Å; L90-C94 PolarHBondContact O-SG 2.89Å; C94-A98 VanDerWaalsContact O-CB 3.26Å; C94-A98 WeakPolarHBondContact O-CB 3.46Å; C94-A98 PolarHBondContact O-N 2.92Å; C94-L104 HydrophobicContact CB-CD1 4.03Å; C94-L104 WeakPolarHBondContact O-CD1 3.34Å; C94-C108 WeakPolarHBondContact CB-SG 3.43Å |
| 95 | L | 84.7 | Confident | 82.5 | Confident | 84 Ų | 84 | 83.3 Ų | 83.3 | 44% | 0.44 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -68.7 | -39.3 | 174.4 | -73.3 | 169.9 | 0 | 0 | 0 | 112.3 | R91 K92 V93 A98 E99 L104 | R91-L95 HydrophobicContact CG-CD1 4.14Å; R91-L95 WeakPolarHBondContact O-CB 3.47Å; R91-L95 WeakPolarHBondContact O-CD1 3.46Å; R91-L95 VanDerWaalsContact O-CG 3.22Å; R91-L95 WeakPolarHBondContact O-CG 3.01Å; R91-L95 PolarHBondContact O-N 3.39Å; R91-L95 VanDerWaalsContact O-N 3.11Å; K92-L95 PolarHBondContact O-N 2.8Å; V93-L95 VanDerWaalsContact C-N 3.28Å; V93-L95 PolarHBondContact O-N 2.84Å; L95-A98 PolarHBondContact O-N 2.89Å; L95-E99 PolarHBondContact O-N 3.05Å; L95-L104 HydrophobicContact CD2-CD1 4.34Å |
| 96 | Q | 81.7 | Confident | 80.7 | Confident | 127 Ų | 127 | 84.3 Ų | 84.3 | 59% | 0.593 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -65.4 | -42.2 | 174.2 | -71.8 | 173.8 | -10.3 | 0 | 0 | 111.8 | K92 V93 A98 E99 L100 | K92-Q96 WeakPolarHBondContact O-CG 3.47Å; K92-Q96 PolarHBondContact O-N 3.38Å; K92-Q96 VanDerWaalsContact O-N 3.09Å; V93-Q96 WeakPolarHBondContact O-CB 3.3Å; V93-Q96 PolarHBondContact O-N 2.91Å; Q96-A98 VanDerWaalsContact C-N 3.33Å; Q96-A98 PolarHBondContact O-N 3.06Å; Q96-E99 PolarHBondContact O-N 3.44Å; Q96-L100 WeakPolarHBondContact O-CG 3.4Å; Q96-L100 PolarHBondContact O-N 2.89Å |
| 97 | E | 81.4 | Confident | 79 | Confident | 105 Ų | 105 | 86.2 Ų | 86.2 | 49% | 0.491 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -65.3 | -35.6 | 173.6 | -69.6 | -172.7 | 167.2 | 0 | 0 | 112 | V93 L100 T101 | V93-E97 HydrophobicContact CG1-CG 4.31Å; V93-E97 PolarHBondContact O-N 3.37Å; E97-L100 PolarHBondContact O-N 3Å; E97-T101 WeakPolarHBondContact O-CB 3.41Å; E97-T101 WeakPolarHBondContact O-CG2 3.37Å; E97-T101 PolarHBondContact O-N 2.84Å; E97-T101 PolarHBondContact O-OG1 2.83Å |
| 98 | A | 80.7 | Confident | 77.1 | Confident | 2 Ų | 2 | 83.5 Ų | 83.5 | 2% | 0.017 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -68.4 | -35.6 | 174 | 0 | 0 | 0 | 0 | 0 | 113 | C94 L95 Q96 L100 G102 Q103 L104 | C94-A98 VanDerWaalsContact O-CB 3.26Å; C94-A98 WeakPolarHBondContact O-CB 3.46Å; C94-A98 PolarHBondContact O-N 2.92Å; L95-A98 PolarHBondContact O-N 2.89Å; Q96-A98 VanDerWaalsContact C-N 3.33Å; Q96-A98 PolarHBondContact O-N 3.06Å; A98-L100 VanDerWaalsContact C-N 3.31Å; A98-L100 PolarHBondContact O-N 3.42Å; A98-G102 WeakPolarHBondContact O-CA 3.3Å; A98-G102 PolarHBondContact O-N 3.49Å; A98-Q103 WeakPolarHBondContact CA-O 3.43Å; A98-Q103 WeakPolarHBondContact CB-O 3.43Å; A98-L104 HydrophobicContact CB-CB 3.97Å; A98-L104 HydrophobicContact CB-CD1 3.7Å; A98-L104 HydrophobicContact CB-CG 4.45Å |
| 99 | E | 78.1 | Confident | 75.3 | Confident | 107 Ų | 107 | 81 Ų | 81 | 50% | 0.5 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -63 | -37.1 | 171.1 | -76.5 | -157.6 | -144.2 | 0 | 0 | 112.2 | L95 Q96 R122 | L95-E99 PolarHBondContact O-N 3.05Å; Q96-E99 PolarHBondContact O-N 3.44Å; E99-R122 IonicContact OE1-NH1 3.23Å; E99-R122 PolarHBondContact OE1-NH1 2.94Å; E99-R122 IonicContact OE2-CZ 2.65Å; E99-R122 IonicContact OE2-NH1 2.89Å; E99-R122 PolarHBondContact OE2-NH1 3.46Å |
| 100 | L | 71.3 | Confident | 73.5 | Confident | 156 Ų | 156 | 79.7 Ų | 79.7 | 82% | 0.817 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -79.1 | -39.7 | -179.2 | -67.2 | 172.5 | 0 | 0 | 0 | 113.7 | Q96 E97 A98 | Q96-L100 WeakPolarHBondContact O-CG 3.4Å; Q96-L100 PolarHBondContact O-N 2.89Å; E97-L100 PolarHBondContact O-N 3Å; A98-L100 VanDerWaalsContact C-N 3.31Å; A98-L100 PolarHBondContact O-N 3.42Å |
| 101 | T | 69.6 | Low | 71.6 | Confident | 78 Ų | 78 | 81.9 Ų | 81.9 | 48% | 0.479 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -90.3 | -30.9 | -177.2 | 60.3 | 0 | 0 | 0 | 0 | 112.9 | E97 Q103 R121 | E97-T101 WeakPolarHBondContact O-CB 3.41Å; E97-T101 WeakPolarHBondContact O-CG2 3.37Å; E97-T101 PolarHBondContact O-N 2.84Å; E97-T101 PolarHBondContact O-OG1 2.83Å; T101-Q103 PolarHBondContact OG1-N 3.5Å; T101-Q103 PolarHBondContact OG1-O 3.25Å; T101-Q103 VanDerWaalsContact OG1-O 3.1Å; T101-R121 PolarHBondContact O-NH2 3.09Å |
| 102 | G | 63.9 | Low | 69.5 | Low | 13 Ų | 13 | 85 Ų | 85 | 13% | 0.134 | 45% | 0.452 | C | S | . | . | S | Bend | trans | 80.8 | 16.2 | -168.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | A98 | A98-G102 WeakPolarHBondContact O-CA 3.3Å; A98-G102 PolarHBondContact O-N 3.49Å |
| 103 | Q | 61.4 | Low | 67.7 | Low | 149 Ų | 149 | 82.6 Ų | 82.6 | 70% | 0.696 | 46% | 0.461 | S | S | * | . | | | trans | -140.1 | 137.7 | 176.7 | -64.6 | -67.2 | 1.2 | 0 | 0 | 110.6 | A98 T101 | A98-Q103 WeakPolarHBondContact CA-O 3.43Å; A98-Q103 WeakPolarHBondContact CB-O 3.43Å; T101-Q103 PolarHBondContact OG1-N 3.5Å; T101-Q103 PolarHBondContact OG1-O 3.25Å; T101-Q103 VanDerWaalsContact OG1-O 3.1Å |
| 104 | L | 65.3 | Low | 65.9 | Low | 48 Ų | 48 | 83.5 Ų | 83.5 | 25% | 0.251 | 46% | 0.461 | S | S | . | . | | | trans | -104.4 | 131.6 | 175.2 | -173.2 | 71.4 | 0 | 0 | 0 | 109.4 | C94 L95 A98 C108 L110 | C94-L104 HydrophobicContact CB-CD1 4.03Å; C94-L104 WeakPolarHBondContact O-CD1 3.34Å; L95-L104 HydrophobicContact CD2-CD1 4.34Å; A98-L104 HydrophobicContact CB-CB 3.97Å; A98-L104 HydrophobicContact CB-CD1 3.7Å; A98-L104 HydrophobicContact CB-CG 4.45Å; L104-C108 HydrophobicContact CD1-CB 4.48Å; L104-C108 VanDerWaalsContact CD1-SG 3.57Å; L104-C108 HydrophobicContact CD2-CB 4.33Å; L104-C108 HydrophobicContact CG-CB 4.28Å; L104-L110 HydrophobicContact CD2-CD1 4.26Å |
| 105 | P | 69 | Low | 64.1 | Low | 52 Ų | 52 | 93.6 Ų | 93.6 | 34% | 0.338 | 50% | 0.497 | S | S | . | . | | | trans | -58.1 | 139.1 | 175.3 | -25.9 | 34.6 | 0 | 0 | 0 | 112.6 | E107 C108 | P105-E107 PolarHBondContact O-N 2.89Å; P105-C108 WeakPolarHBondContact O-CB 3.28Å; P105-C108 PolarHBondContact O-N 3Å; P105-C108 PolarHBondContact O-SG 3.42Å |
| 106 | P | 59 | Low | 62.3 | Low | 119 Ų | 119 | 94.5 Ų | 94.5 | 77% | 0.773 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.3 | -19.4 | -176.8 | 28.2 | -34 | 0 | 0 | 0 | 113.6 | C108 | P106-C108 VanDerWaalsContact C-N 3.28Å; P106-C108 PolarHBondContact O-N 3.09Å |
| 107 | E | 61.9 | Low | 60.9 | Low | 158 Ų | 158 | 96.5 Ų | 96.5 | 74% | 0.738 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | 9.5 | 175.8 | -50.6 | 82.7 | 177.8 | 0 | 0 | 113.7 | P105 | P105-E107 PolarHBondContact O-N 2.89Š|
| 108 | C | 54.6 | Low | 59.3 | Low | 15 Ų | 15 | 99.5 Ų | 99.5 | 10% | 0.101 | 54% | 0.535 | C | S | . | . | S | Bend | trans | -61.4 | 139.1 | 175.3 | -73.2 | 0 | 0 | 0 | 0 | 111.5 | C94 L104 P105 P106 L110 | C94-C108 WeakPolarHBondContact CB-SG 3.43Å; L104-C108 HydrophobicContact CD1-CB 4.48Å; L104-C108 VanDerWaalsContact CD1-SG 3.57Å; L104-C108 HydrophobicContact CD2-CB 4.33Å; L104-C108 HydrophobicContact CG-CB 4.28Å; P105-C108 WeakPolarHBondContact O-CB 3.28Å; P105-C108 PolarHBondContact O-N 3Å; P105-C108 PolarHBondContact O-SG 3.42Å; P106-C108 VanDerWaalsContact C-N 3.28Å; P106-C108 PolarHBondContact O-N 3.09Å; C108-L110 VanDerWaalsContact C-N 3.27Å; C108-L110 HydrophobicContact CB-CG 4.33Å; C108-L110 PolarHBondContact O-N 2.97Å |
| 109 | P | 56.4 | Low | 57.7 | Low | 38 Ų | 38 | 102.3 Ų | 102.3 | 25% | 0.247 | 55% | 0.552 | C | S | . | * | | | trans | -65.9 | 81.8 | 173.1 | -22.1 | 34.5 | 0 | 0 | 0 | 112.6 | L87 L90 R91 | L87-P109 HydrophobicContact CD2-CB 4.42Å; L87-P109 HydrophobicContact CD2-CG 3.79Å; L90-P109 HydrophobicContact CD2-CG 4.46Å; R91-P109 PolarHBondContact NH1-O 2.77Å |
| 110 | L | 56.8 | Low | 56.5 | Low | 63 Ų | 63 | 108 Ų | 108 | 33% | 0.33 | 57% | 0.569 | S | S | . | * | | | trans | -99.7 | 134.7 | 170.1 | -60 | 178.6 | 0 | 0 | 0 | 108.3 | L104 C108 | L104-L110 HydrophobicContact CD2-CD1 4.26Å; C108-L110 VanDerWaalsContact C-N 3.27Å; C108-L110 HydrophobicContact CB-CG 4.33Å; C108-L110 PolarHBondContact O-N 2.97Å |
| 111 | E | 53.3 | Low | 55.5 | Low | 133 Ų | 133 | 108.7 Ų | 108.7 | 62% | 0.621 | 56% | 0.561 | S | S | * | * | | | trans | -66.5 | 145.3 | 179.4 | -69.5 | -61.3 | 123.5 | 0 | 0 | 110.5 | G113 E114 | E111-G113 VanDerWaalsContact C-N 3.3Å; E111-G113 PolarHBondContact O-N 2.85Å; E111-E114 PolarHBondContact O-N 2.83Å |
| 112 | P | 44.3 | Very low | 54.4 | Low | 137 Ų | 137 | 113.3 Ų | 113.3 | 89% | 0.89 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.6 | 81.2 | -178.4 | -25.9 | 36.3 | 0 | 0 | 0 | 114.5 | | |
| 113 | G | 52.7 | Low | 53.6 | Low | 70 Ų | 70 | 117.1 Ų | 117.1 | 72% | 0.722 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 147.2 | -19.8 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | E111 R115 | E111-G113 VanDerWaalsContact C-N 3.3Å; E111-G113 PolarHBondContact O-N 2.85Å; G113-R115 PolarHBondContact O-N 2.88Å |
| 114 | E | 52.5 | Low | 53 | Low | 86 Ų | 86 | 115.8 Ų | 115.8 | 40% | 0.402 | 60% | 0.596 | S | S | . | * | | | trans | -66.9 | 105.3 | 171.4 | -88.6 | -169.8 | 111.6 | 0 | 0 | 110 | R91 E111 | R91-E114 IonicContact CZ-OE2 3.5Å; R91-E114 VanDerWaalsContact CZ-OE2 3.23Å; R91-E114 IonicContact NH1-OE2 2.77Å; R91-E114 PolarHBondContact NH1-OE2 3.48Å; R91-E114 IonicContact NH2-OE1 2.78Å; R91-E114 PolarHBondContact NH2-OE1 2.88Å; R91-E114 IonicContact NH2-OE2 3.21Å; R91-E114 PolarHBondContact NH2-OE2 2.89Å; E111-E114 PolarHBondContact O-N 2.83Å |
| 115 | R | 47 | Very low | 51.8 | Low | 226 Ų | 226 | 120 Ų | 120 | 85% | 0.853 | 62% | 0.624 | S | S | * | * | | | trans | -59.7 | 133.8 | 172.1 | -67.1 | -180 | 179.5 | 168.2 | 0.6 | 108.9 | G113 Q117 | G113-R115 PolarHBondContact O-N 2.88Å; R115-Q117 PolarHBondContact O-N 3.3Å |
| 116 | P | 47.7 | Very low | 50.4 | Low | 102 Ų | 102 | 121.5 Ų | 121.5 | 66% | 0.662 | 64% | 0.641 | S | S | * | * | | | trans | -59.9 | 111.2 | 172.9 | 25.5 | -33.2 | 0 | 0 | 0 | 108.1 | L118 | P116-L118 PolarHBondContact O-N 3.13Š|
| 117 | Q | 51.1 | Low | 49.5 | Very low | 169 Ų | 169 | 125.3 Ų | 125.3 | 79% | 0.79 | 64% | 0.64 | S | S | * | * | | | trans | -60.2 | 133 | 175.5 | -63.1 | -168.1 | 13.3 | 0 | 0 | 107.5 | R115 V119 | R115-Q117 PolarHBondContact O-N 3.3Å; Q117-V119 PolarHBondContact O-N 3.29Å |
| 118 | L | 48.3 | Very low | 48.4 | Very low | 168 Ų | 168 | 122.4 Ų | 122.4 | 88% | 0.88 | 64% | 0.643 | S | S | * | * | | | trans | -58.6 | 113.2 | 173 | -78.3 | 89.1 | 0 | 0 | 0 | 107.1 | P116 R120 | P116-L118 PolarHBondContact O-N 3.13Å; L118-R120 PolarHBondContact O-N 2.67Å |
| 119 | V | 48.6 | Very low | 47.6 | Very low | 61 Ų | 61 | 130.4 Ų | 130.4 | 37% | 0.37 | 67% | 0.672 | S | S | . | * | | | trans | -70.7 | 73 | 174.9 | -173.5 | 0 | 0 | 0 | 0 | 107.4 | Q117 R121 | Q117-V119 PolarHBondContact O-N 3.29Å; V119-R121 PolarHBondContact O-N 3.24Å |
| 120 | R | 51.5 | Low | 47.2 | Very low | 226 Ų | 226 | 132.9 Ų | 132.9 | 85% | 0.853 | 69% | 0.688 | S | S | * | * | | | trans | -62.2 | 95 | 164.6 | 177 | -180 | 175.8 | 161.1 | 0.8 | 104.8 | L118 R122 | L118-R120 PolarHBondContact O-N 2.67Å; R120-R122 PolarHBondContact O-N 3.21Å; R120-R122 VanDerWaalsContact O-N 3.09Å |
| 121 | R | 51.7 | Low | 46.7 | Very low | 171 Ų | 171 | 135.1 Ų | 135.1 | 65% | 0.645 | 71% | 0.706 | S | S | * | * | | | trans | -32.6 | 119.9 | 171 | -72.8 | 179.1 | 166.2 | -173.7 | -7.4 | 108.1 | T101 V119 P123 | T101-R121 PolarHBondContact O-NH2 3.09Å; V119-R121 PolarHBondContact O-N 3.24Å; R121-P123 WeakPolarHBondContact O-CD 3.24Å |
| 122 | R | 46.6 | Very low | 46.2 | Very low | 176 Ų | 176 | 134.2 Ų | 134.2 | 66% | 0.664 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 116.9 | 156.6 | -84.3 | -179.7 | 165.8 | 126.9 | -1 | 104.6 | E99 R120 | E99-R122 IonicContact OE1-NH1 3.23Å; E99-R122 PolarHBondContact OE1-NH1 2.94Å; E99-R122 IonicContact OE2-CZ 2.65Å; E99-R122 IonicContact OE2-NH1 2.89Å; E99-R122 PolarHBondContact OE2-NH1 3.46Å; R120-R122 PolarHBondContact O-N 3.21Å; R120-R122 VanDerWaalsContact O-N 3.09Å |
| 123 | P | 47 | Very low | 46.1 | Very low | 92 Ų | 92 | 135.1 Ų | 135.1 | 60% | 0.597 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 130.6 | 161.7 | -15.5 | 30.8 | 0 | 0 | 0 | 104.9 | R121 T125 | R121-P123 WeakPolarHBondContact O-CD 3.24Å; P123-T125 PolarHBondContact O-N 3.15Å |
| 124 | P | 47.6 | Very low | 46.1 | Very low | 122 Ų | 122 | 137.7 Ų | 137.7 | 79% | 0.792 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 123.5 | 177.8 | 23.4 | -33.5 | 0 | 0 | 0 | 106.8 | A126 | P124-A126 PolarHBondContact O-N 2.81Š|
| 125 | T | 41.3 | Very low | 45.8 | Very low | 135 Ų | 135 | 141 Ų | 141 | 83% | 0.828 | 73% | 0.729 | S | S | * | * | | | trans | -50.4 | 102 | -158 | -52.2 | 0 | 0 | 0 | 0 | 110 | P123 R127 | P123-T125 PolarHBondContact O-N 3.15Å; T125-R127 VanDerWaalsContact C-N 3.27Å; T125-R127 PolarHBondContact O-N 3.37Å |
| 126 | A | 38.6 | Very low | 45.8 | Very low | 84 Ų | 84 | 138.2 Ų | 138.2 | 69% | 0.694 | 73% | 0.725 | S | S | * | * | | | trans | -68.8 | 96.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 105.9 | P124 A128 | P124-A126 PolarHBondContact O-N 2.81Å; A126-A128 PolarHBondContact O-N 3.04Å |
| 127 | R | 40.1 | Very low | 45.6 | Very low | 199 Ų | 199 | 137.4 Ų | 137.4 | 75% | 0.751 | 73% | 0.727 | S | S | * | * | | | trans | -42.7 | 118.8 | 150.8 | -76.2 | -176.7 | 171.2 | -174.2 | -2.7 | 104.5 | T125 Y129 | T125-R127 VanDerWaalsContact C-N 3.27Å; T125-R127 PolarHBondContact O-N 3.37Å; R127-Y129 HydrophobicContact CB-CD2 4.35Å; R127-Y129 HydrophobicContact CB-CE2 4.19Å; R127-Y129 WeakPolarHBondContact O-CD2 3.4Å; R127-Y129 PolarHBondContact O-N 3.2Å |
| 128 | A | 38.8 | Very low | 45.2 | Very low | 97 Ų | 97 | 137 Ų | 137 | 80% | 0.802 | 73% | 0.725 | S | S | * | * | | | trans | -70 | 76.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 107.7 | A126 P130 | A126-A128 PolarHBondContact O-N 3.04Å; A128-P130 WeakPolarHBondContact O-CD 3.31Å |
| 129 | Y | 37.4 | Very low | 45.4 | Very low | 184 Ų | 184 | 134.9 Ų | 134.9 | 72% | 0.722 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 121.8 | 160.4 | -74.2 | -76.5 | 0 | 0 | 0 | 105.4 | R127 | R127-Y129 HydrophobicContact CB-CD2 4.35Å; R127-Y129 HydrophobicContact CB-CE2 4.19Å; R127-Y129 WeakPolarHBondContact O-CD2 3.4Å; R127-Y129 PolarHBondContact O-N 3.2Å |
| 130 | P | 49.3 | Very low | 45.8 | Very low | 90 Ų | 90 | 137.4 Ų | 137.4 | 58% | 0.584 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -49.9 | 145.5 | 166.4 | -24.6 | 35 | 0 | 0 | 0 | 108.5 | A128 P132 | A128-P130 WeakPolarHBondContact O-CD 3.31Å; P130-P132 VanDerWaalsContact O-N 3.12Å |
| 131 | P | 44.5 | Very low | 46.2 | Very low | 110 Ų | 110 | 128.8 Ų | 128.8 | 71% | 0.714 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -50.6 | 126.1 | 179.3 | 22.6 | -33.7 | 0 | 0 | 0 | 108.3 | H133 | P131-H133 PolarHBondContact O-N 2.87Š|
| 132 | P | 42.9 | Very low | 47.3 | Very low | 114 Ų | 114 | 123.9 Ų | 123.9 | 74% | 0.74 | 69% | 0.692 | S | S | * | * | | | trans | -59 | 113.5 | -167.1 | 21.4 | -32.8 | 0 | 0 | 0 | 109.1 | P130 | P130-P132 VanDerWaalsContact O-N 3.12Š|
| 133 | H | 43.9 | Very low | 48.8 | Very low | 155 Ų | 155 | 120.5 Ų | 120.5 | 72% | 0.718 | 69% | 0.693 | S | S | * | * | | | trans | -54.5 | 129 | 174.1 | -66.4 | -81.4 | 0 | 0 | 0 | 107.5 | P131 N135 | P131-H133 PolarHBondContact O-N 2.87Å; H133-N135 PolarHBondContact O-N 3.29Å |
| 134 | P | 51.1 | Low | 50.5 | Low | 124 Ų | 124 | 119.6 Ų | 119.6 | 81% | 0.805 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -76.2 | 66.7 | -174.8 | 31.2 | -36.2 | 0 | 0 | 0 | 110.6 | | |
| 135 | N | 47.3 | Very low | 52.2 | Low | 157 Ų | 157 | 118 Ų | 118 | 84% | 0.84 | 68% | 0.676 | S | S | * | * | | | trans | -171.5 | 63.8 | 172.5 | -94.2 | -31.8 | 0 | 0 | 0 | 110.9 | H133 | H133-N135 PolarHBondContact O-N 3.29Š|
| 136 | Q | 46.4 | Very low | 54.4 | Low | 166 Ų | 166 | 117.2 Ų | 117.2 | 78% | 0.776 | 66% | 0.662 | S | S | * | * | | | trans | -146.9 | 124.1 | 154.5 | -121.2 | 163.7 | 61.8 | 0 | 0 | 109.4 | H138 | Q136-H138 VanDerWaalsContact C-N 3.32Å; Q136-H138 PolarHBondContact O-N 3.2Å |
| 137 | A | 42.7 | Very low | 56.9 | Low | 85 Ų | 85 | 118.7 Ų | 118.7 | 70% | 0.702 | 66% | 0.658 | S | S | * | * | | | trans | -74.2 | 88.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | H139 | A137-H139 VanDerWaalsContact C-N 3.29Å; A137-H139 PolarHBondContact O-CD2 3.13Å; A137-H139 VanDerWaalsContact O-CD2 3.3Å; A137-H139 PolarHBondContact O-N 2.9Å |
| 138 | H | 44.5 | Very low | 59.3 | Low | 161 Ų | 161 | 111.9 Ų | 111.9 | 75% | 0.745 | 65% | 0.645 | S | S | * | * | | | trans | -62 | 98.7 | 161.6 | -75.1 | -77.4 | 0 | 0 | 0 | 107.6 | Q136 S140 | Q136-H138 VanDerWaalsContact C-N 3.32Å; Q136-H138 PolarHBondContact O-N 3.2Å; H138-S140 PolarHBondContact O-N 2.8Å |
| 139 | H | 52.4 | Low | 61.9 | Low | 124 Ų | 124 | 108 Ų | 108 | 57% | 0.574 | 61% | 0.61 | S | S | * | * | | | trans | -57.8 | 103.2 | 166.9 | -74 | -96.7 | 0 | 0 | 0 | 107 | A137 L141 | A137-H139 VanDerWaalsContact C-N 3.29Å; A137-H139 PolarHBondContact O-CD2 3.13Å; A137-H139 VanDerWaalsContact O-CD2 3.3Å; A137-H139 PolarHBondContact O-N 2.9Å; H139-L141 HydrophobicContact CB-CD2 4.34Å; H139-L141 PolarHBondContact O-N 3.25Å |
| 140 | S | 56.5 | Low | 64.5 | Low | 113 Ų | 113 | 103.5 Ų | 103.5 | 79% | 0.79 | 60% | 0.596 | S | S | * | * | | | trans | -67.7 | 86.2 | 173.1 | 173.7 | 0 | 0 | 0 | 0 | 107.5 | H138 C142 | H138-S140 PolarHBondContact O-N 2.8Å; S140-C142 PolarHBondContact O-N 3.17Å |
| 141 | L | 60.5 | Low | 66.7 | Low | 45 Ų | 45 | 101.6 Ų | 101.6 | 24% | 0.236 | 59% | 0.587 | C | S | . | * | | | trans | -48.6 | 130.1 | 179.1 | -53.4 | -172.9 | 0 | 0 | 0 | 108.9 | H139 L208 | H139-L141 HydrophobicContact CB-CD2 4.34Å; H139-L141 PolarHBondContact O-N 3.25Å; L141-L208 HydrophobicContact CD1-CD1 4.15Å; L141-L208 HydrophobicContact CD2-CB 4.02Å; L141-L208 HydrophobicContact CD2-CD1 3.82Å; L141-L208 HydrophobicContact CD2-CD2 3.6Å; L141-L208 HydrophobicContact CD2-CG 3.98Å |
| 142 | C | 74.4 | Confident | 69.2 | Low | 68 Ų | 68 | 97.6 Ų | 97.6 | 46% | 0.459 | 56% | 0.56 | S | S | . | * | | | trans | -64.5 | 140.3 | 169.5 | -64.7 | 0 | 0 | 0 | 0 | 107.4 | S140 A144 E145 E146 | S140-C142 PolarHBondContact O-N 3.17Å; C142-A144 PolarHBondContact O-N 2.86Å; C142-E145 HydrophobicContact CB-CG 4.06Å; C142-E145 WeakPolarHBondContact CB-OE2 3.31Å; C142-E145 PolarHBondContact N-OE2 2.92Å; C142-E145 WeakPolarHBondContact O-CA 3.45Å; C142-E145 WeakPolarHBondContact O-CB 3.38Å; C142-E145 PolarHBondContact O-N 3.5Å; C142-E146 PolarHBondContact O-N 3.09Å; C142-E146 VanDerWaalsContact O-N 3.13Å |
| 143 | P | 76.6 | Confident | 71.7 | Confident | 105 Ų | 105 | 95.1 Ų | 95.1 | 68% | 0.682 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -56.5 | -19.5 | 179 | -29.5 | 36.5 | 0 | 0 | 0 | 114.4 | L147 | P143-L147 VanDerWaalsContact O-CB 3.24Å; P143-L147 WeakPolarHBondContact O-CB 3.43Å; P143-L147 PolarHBondContact O-N 3.42Å; P143-L147 VanDerWaalsContact O-N 3.15Å |
| 144 | A | 82.8 | Confident | 74.3 | Confident | 74 Ų | 74 | 93.9 Ų | 93.9 | 61% | 0.612 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -74.7 | -33.4 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | C142 A148 | C142-A144 PolarHBondContact O-N 2.86Å; A144-A148 VanDerWaalsContact O-CB 3.25Å; A144-A148 WeakPolarHBondContact O-CB 3.36Å; A144-A148 PolarHBondContact O-N 3.46Å |
| 145 | E | 84.9 | Confident | 76.5 | Confident | 89 Ų | 89 | 92.3 Ų | 92.3 | 42% | 0.416 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -75.3 | -40.6 | 176.4 | -62.9 | 172.1 | 131.2 | 0 | 0 | 110.8 | C142 A148 L149 | C142-E145 HydrophobicContact CB-CG 4.06Å; C142-E145 WeakPolarHBondContact CB-OE2 3.31Å; C142-E145 PolarHBondContact N-OE2 2.92Å; C142-E145 WeakPolarHBondContact O-CA 3.45Å; C142-E145 WeakPolarHBondContact O-CB 3.38Å; C142-E145 PolarHBondContact O-N 3.5Å; E145-A148 PolarHBondContact O-N 2.84Å; E145-L149 WeakPolarHBondContact O-CB 3.15Å; E145-L149 PolarHBondContact O-N 3.37Å |
| 146 | E | 87.3 | Confident | 78.9 | Confident | 117 Ų | 117 | 85 Ų | 85 | 55% | 0.547 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.5 | -47.2 | 172.1 | -175.4 | 175.5 | -155.6 | 0 | 0 | 111 | C142 A148 L149 E150 | C142-E146 PolarHBondContact O-N 3.09Å; C142-E146 VanDerWaalsContact O-N 3.13Å; E146-A148 VanDerWaalsContact C-N 3.33Å; E146-A148 PolarHBondContact O-N 3.15Å; E146-L149 PolarHBondContact O-N 2.87Å; E146-E150 WeakPolarHBondContact O-CB 3.41Å; E146-E150 PolarHBondContact O-N 3.47Å |
| 147 | L | 91.2 | Very high | 81.3 | Confident | 115 Ų | 115 | 79.5 Ų | 79.5 | 60% | 0.602 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -66.4 | -32.3 | 176 | -173 | 146.8 | 0 | 0 | 0 | 112.8 | P143 A151 | P143-L147 VanDerWaalsContact O-CB 3.24Å; P143-L147 WeakPolarHBondContact O-CB 3.43Å; P143-L147 PolarHBondContact O-N 3.42Å; P143-L147 VanDerWaalsContact O-N 3.15Å; L147-A151 VanDerWaalsContact O-CB 3.28Å; L147-A151 WeakPolarHBondContact O-CB 3.34Å; L147-A151 PolarHBondContact O-N 3.22Å |
| 148 | A | 89.9 | Confident | 84 | Confident | 57 Ų | 57 | 78.8 Ų | 78.8 | 47% | 0.471 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -69.7 | -39.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | A144 E145 E146 A151 L152 | A144-A148 VanDerWaalsContact O-CB 3.25Å; A144-A148 WeakPolarHBondContact O-CB 3.36Å; A144-A148 PolarHBondContact O-N 3.46Å; E145-A148 PolarHBondContact O-N 2.84Å; E146-A148 VanDerWaalsContact C-N 3.33Å; E146-A148 PolarHBondContact O-N 3.15Å; A148-A151 PolarHBondContact O-N 3.33Å; A148-L152 WeakPolarHBondContact O-CB 3.37Å; A148-L152 PolarHBondContact O-N 3.33Å |
| 149 | L | 92.5 | Very high | 86.5 | Confident | 15 Ų | 15 | 72 Ų | 72 | 8% | 0.079 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -62.1 | -48.6 | 171.7 | 176.1 | 63.5 | 0 | 0 | 0 | 110.7 | E145 E146 A151 L152 E153 L201 V204 R205 L208 L210 | E145-L149 WeakPolarHBondContact O-CB 3.15Å; E145-L149 PolarHBondContact O-N 3.37Å; E146-L149 PolarHBondContact O-N 2.87Å; L149-A151 VanDerWaalsContact C-N 3.27Å; L149-A151 PolarHBondContact O-N 3.21Å; L149-L152 PolarHBondContact O-N 2.92Å; L149-L152 VanDerWaalsContact O-N 3.09Å; L149-E153 HydrophobicContact CD1-CG 4.43Å; L149-E153 WeakPolarHBondContact O-CG 3.49Å; L149-E153 PolarHBondContact O-N 3.29Å; L149-L201 HydrophobicContact CD1-CD1 3.46Å; L149-L201 VanDerWaalsContact CD1-CD1 3.46Å; L149-V204 HydrophobicContact CB-CG1 4.43Å; L149-V204 HydrophobicContact CD1-CB 4.48Å; L149-V204 HydrophobicContact CD1-CG1 3.96Å; L149-R205 HydrophobicContact CD1-CG 4.01Å; L149-L208 HydrophobicContact CD2-CD1 4.34Å; L149-L210 HydrophobicContact CD2-CD1 3.94Å |
| 150 | E | 93.3 | Very high | 88.7 | Confident | 90 Ų | 90 | 69.5 Ų | 69.5 | 42% | 0.421 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -65.1 | -29.6 | 179.1 | -154.5 | -156.1 | -170.2 | 0 | 0 | 112.4 | E146 R154 | E146-E150 WeakPolarHBondContact O-CB 3.41Å; E146-E150 PolarHBondContact O-N 3.47Å; E150-R154 VanDerWaalsContact O-CG 3.31Å; E150-R154 WeakPolarHBondContact O-CG 3.36Å; E150-R154 PolarHBondContact O-N 2.92Å; E150-R154 PolarHBondContact O-NH1 2.96Å; E150-R154 IonicContact OE1-CZ 3.14Å; E150-R154 IonicContact OE1-NH1 3.8Å; E150-R154 IonicContact OE1-NH2 3.65Å; E150-R154 PolarHBondContact OE1-NH2 3.32Å; E150-R154 IonicContact OE2-CZ 2.73Å; E150-R154 IonicContact OE2-NH1 3.95Å; E150-R154 PolarHBondContact OE2-NH1 2.95Å; E150-R154 IonicContact OE2-NH2 2.73Å; E150-R154 PolarHBondContact OE2-NH2 2.73Å |
| 151 | A | 95.8 | Very high | 90.7 | Very high | 49 Ų | 49 | 70.9 Ų | 70.9 | 41% | 0.405 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -69.9 | -41.5 | 170.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L147 A148 L149 R154 E155 | L147-A151 VanDerWaalsContact O-CB 3.28Å; L147-A151 WeakPolarHBondContact O-CB 3.34Å; L147-A151 PolarHBondContact O-N 3.22Å; A148-A151 PolarHBondContact O-N 3.33Å; L149-A151 VanDerWaalsContact C-N 3.27Å; L149-A151 PolarHBondContact O-N 3.21Å; A151-R154 PolarHBondContact O-N 3.32Å; A151-E155 PolarHBondContact O-N 3.02Å |
| 152 | L | 96 | Very high | 92.5 | Very high | 27 Ų | 27 | 72.5 Ų | 72.5 | 14% | 0.141 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -67.3 | -37.8 | 176.9 | -176.3 | 57.8 | 0 | 0 | 0 | 112.1 | A148 L149 R154 E155 V156 L197 Q200 L201 V204 | A148-L152 WeakPolarHBondContact O-CB 3.37Å; A148-L152 PolarHBondContact O-N 3.33Å; L149-L152 PolarHBondContact O-N 2.92Å; L149-L152 VanDerWaalsContact O-N 3.09Å; L152-R154 VanDerWaalsContact C-N 3.33Å; L152-R154 PolarHBondContact O-N 3.44Å; L152-E155 PolarHBondContact O-N 3.24Å; L152-V156 WeakPolarHBondContact O-CG2 3.19Å; L152-V156 PolarHBondContact O-N 2.89Å; L152-L197 HydrophobicContact CD1-CD2 3.91Å; L152-Q200 HydrophobicContact CD1-CB 4.45Å; L152-Q200 HydrophobicContact CD2-CB 4.14Å; L152-L201 HydrophobicContact CD2-CB 4.24Å; L152-L201 HydrophobicContact CD2-CD1 4.3Å; L152-L201 HydrophobicContact CG-CB 4.37Å; L152-L201 HydrophobicContact CG-CD1 4.25Å; L152-V204 HydrophobicContact CD2-CG2 4.09Å |
| 153 | E | 96.1 | Very high | 93.6 | Very high | 61 Ų | 61 | 69.5 Ų | 69.5 | 29% | 0.285 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -64.3 | -36.2 | 173.6 | -71.1 | -175.9 | 179.7 | 0 | 0 | 112.5 | L149 S157 L201 R205 | L149-E153 HydrophobicContact CD1-CG 4.43Å; L149-E153 WeakPolarHBondContact O-CG 3.49Å; L149-E153 PolarHBondContact O-N 3.29Å; E153-S157 WeakPolarHBondContact O-CB 3.34Å; E153-S157 PolarHBondContact O-N 3.15Å; E153-S157 PolarHBondContact O-OG 3.14Å; E153-L201 HydrophobicContact CG-CD1 3.41Å; E153-L201 VanDerWaalsContact CG-CD1 3.41Å; E153-L201 HydrophobicContact CG-CD2 4.11Å; E153-L201 HydrophobicContact CG-CG 4.41Å; E153-R205 IonicContact OE1-CZ 3.28Å; E153-R205 IonicContact OE1-NE 2.7Å; E153-R205 PolarHBondContact OE1-NE 2.89Å; E153-R205 IonicContact OE1-NH2 3.09Å; E153-R205 PolarHBondContact OE1-NH2 2.78Å; E153-R205 IonicContact OE2-NH2 3.9Å |
| 154 | R | 97.6 | Very high | 94.6 | Very high | 130 Ų | 130 | 65.5 Ų | 65.5 | 49% | 0.491 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -66.7 | -42.5 | 170.7 | -73 | 176.6 | -174.7 | 108.8 | -2.2 | 112 | E150 A151 L152 S157 V158 | E150-R154 VanDerWaalsContact O-CG 3.31Å; E150-R154 WeakPolarHBondContact O-CG 3.36Å; E150-R154 PolarHBondContact O-N 2.92Å; E150-R154 PolarHBondContact O-NH1 2.96Å; E150-R154 IonicContact OE1-CZ 3.14Å; E150-R154 IonicContact OE1-NH1 3.8Å; E150-R154 IonicContact OE1-NH2 3.65Å; E150-R154 PolarHBondContact OE1-NH2 3.32Å; E150-R154 IonicContact OE2-CZ 2.73Å; E150-R154 IonicContact OE2-NH1 3.95Å; E150-R154 PolarHBondContact OE2-NH1 2.95Å; E150-R154 IonicContact OE2-NH2 2.73Å; E150-R154 PolarHBondContact OE2-NH2 2.73Å; A151-R154 PolarHBondContact O-N 3.32Å; L152-R154 VanDerWaalsContact C-N 3.33Å; L152-R154 PolarHBondContact O-N 3.44Å; R154-S157 WeakPolarHBondContact O-CB 3.39Å; R154-S157 PolarHBondContact O-N 3.47Å; R154-V158 WeakPolarHBondContact O-CG2 3.31Å; R154-V158 PolarHBondContact O-N 3.39Å |
| 155 | E | 97.3 | Very high | 95.4 | Very high | 90 Ų | 90 | 63.3 Ų | 63.3 | 42% | 0.421 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -64.7 | -42.8 | 178.4 | -170.8 | 63.5 | -165.2 | 0 | 0 | 111.7 | A151 L152 S157 V158 Q159 L197 | A151-E155 PolarHBondContact O-N 3.02Å; L152-E155 PolarHBondContact O-N 3.24Å; E155-S157 PolarHBondContact O-N 3.36Å; E155-V158 PolarHBondContact O-N 3.42Å; E155-Q159 WeakPolarHBondContact O-CB 3.29Å; E155-Q159 PolarHBondContact O-N 2.75Å; E155-L197 HydrophobicContact CG-CD1 3.91Å; E155-L197 HydrophobicContact CG-CD2 3.97Å |
| 156 | V | 98.1 | Very high | 96 | Very high | 4 Ų | 4 | 59.4 Ų | 59.4 | 2% | 0.024 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -56 | -49.4 | 169.4 | 169.2 | 0 | 0 | 0 | 0 | 110.5 | L152 V158 Q159 Q160 L194 L197 E198 L201 | L152-V156 WeakPolarHBondContact O-CG2 3.19Å; L152-V156 PolarHBondContact O-N 2.89Å; V156-V158 VanDerWaalsContact C-N 3.33Å; V156-V158 PolarHBondContact O-N 2.69Å; V156-Q159 PolarHBondContact O-N 2.91Å; V156-Q159 VanDerWaalsContact O-N 3.15Å; V156-Q160 HydrophobicContact CG1-CG 4.42Å; V156-Q160 WeakPolarHBondContact O-CG 3.49Å; V156-Q160 PolarHBondContact O-N 2.74Å; V156-L194 HydrophobicContact CG1-CD1 4.23Å; V156-L197 HydrophobicContact CG2-CB 3.68Å; V156-E198 HydrophobicContact CG1-CG 3.84Å; V156-E198 HydrophobicContact CG2-CG 4.38Å; V156-L201 HydrophobicContact CG2-CB 4.39Å; V156-L201 HydrophobicContact CG2-CD2 4.29Å |
| 157 | S | 97.8 | Very high | 96.5 | Very high | 51 Ų | 51 | 59.7 Ų | 59.7 | 36% | 0.357 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -60.8 | -39.4 | -179.6 | -59.8 | 0 | 0 | 0 | 0 | 112.7 | E153 R154 E155 Q161 | E153-S157 WeakPolarHBondContact O-CB 3.34Å; E153-S157 PolarHBondContact O-N 3.15Å; E153-S157 PolarHBondContact O-OG 3.14Å; R154-S157 WeakPolarHBondContact O-CB 3.39Å; R154-S157 PolarHBondContact O-N 3.47Å; E155-S157 PolarHBondContact O-N 3.36Å; S157-Q161 WeakPolarHBondContact O-CG 3.44Å; S157-Q161 PolarHBondContact O-N 3.18Å |
| 158 | V | 98.2 | Very high | 96.8 | Very high | 70 Ų | 70 | 62.1 Ų | 62.1 | 42% | 0.424 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -67.7 | -44.4 | 174.1 | 168.9 | 0 | 0 | 0 | 0 | 110.6 | R154 E155 V156 Q160 Q161 I162 | R154-V158 WeakPolarHBondContact O-CG2 3.31Å; R154-V158 PolarHBondContact O-N 3.39Å; E155-V158 PolarHBondContact O-N 3.42Å; V156-V158 VanDerWaalsContact C-N 3.33Å; V156-V158 PolarHBondContact O-N 2.69Å; V158-Q160 VanDerWaalsContact C-N 3.34Å; V158-Q160 PolarHBondContact O-N 3.01Å; V158-Q161 WeakPolarHBondContact O-CB 3.36Å; V158-Q161 PolarHBondContact O-N 3.14Å; V158-Q161 VanDerWaalsContact O-N 3.09Å; V158-I162 HydrophobicContact CG1-CD1 3.82Å; V158-I162 HydrophobicContact CG1-CG1 4.41Å; V158-I162 WeakPolarHBondContact O-CG1 3.09Å; V158-I162 PolarHBondContact O-N 3.08Å |
| 159 | Q | 98.3 | Very high | 97.1 | Very high | 17 Ų | 17 | 64 Ų | 64 | 8% | 0.079 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -66.6 | -33.8 | 179.9 | -171.8 | 61.7 | 14.9 | 0 | 0 | 112.6 | E155 V156 Q161 I162 A163 A190 R193 L194 L197 | E155-Q159 WeakPolarHBondContact O-CB 3.29Å; E155-Q159 PolarHBondContact O-N 2.75Å; V156-Q159 PolarHBondContact O-N 2.91Å; V156-Q159 VanDerWaalsContact O-N 3.15Å; Q159-Q161 VanDerWaalsContact C-N 3.33Å; Q159-Q161 PolarHBondContact O-N 2.68Å; Q159-I162 PolarHBondContact O-N 2.77Å; Q159-A163 WeakPolarHBondContact O-CB 3.39Å; Q159-A163 PolarHBondContact O-N 3.03Å; Q159-A190 PolarHBondContact NE2-O 2.91Å; Q159-R193 HydrophobicContact CG-CG 4.39Å; Q159-L194 HydrophobicContact CB-CD1 4.24Å; Q159-L194 HydrophobicContact CG-CB 3.93Å; Q159-L194 HydrophobicContact CG-CD1 4.23Å; Q159-L197 HydrophobicContact CB-CD1 3.72Å; Q159-L197 HydrophobicContact CG-CD1 3.92Å |
| 160 | Q | 98.2 | Very high | 97.2 | Very high | 72 Ų | 72 | 63.4 Ų | 63.4 | 34% | 0.336 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -60.4 | -42.1 | 169.9 | -72.1 | -179.4 | -2.1 | 0 | 0 | 111.4 | V156 V158 A163 A164 L194 E198 | V156-Q160 HydrophobicContact CG1-CG 4.42Å; V156-Q160 WeakPolarHBondContact O-CG 3.49Å; V156-Q160 PolarHBondContact O-N 2.74Å; V158-Q160 VanDerWaalsContact C-N 3.34Å; V158-Q160 PolarHBondContact O-N 3.01Å; Q160-A163 PolarHBondContact O-N 3.26Å; Q160-A164 VanDerWaalsContact O-CB 3.31Å; Q160-A164 WeakPolarHBondContact O-CB 3.41Å; Q160-A164 PolarHBondContact O-N 3.09Å; Q160-L194 HydrophobicContact CB-CD1 4.49Å; Q160-L194 HydrophobicContact CG-CD1 3.46Å; Q160-L194 VanDerWaalsContact CG-CD1 3.46Å; Q160-L194 HydrophobicContact CG-CD2 3.83Å; Q160-L194 HydrophobicContact CG-CG 4.3Å; Q160-E198 PolarHBondContact NE2-OE1 2.98Å |
| 161 | Q | 98.3 | Very high | 97.3 | Very high | 143 Ų | 143 | 63.7 Ų | 63.7 | 67% | 0.668 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -66.3 | -38.4 | 174.6 | -66.5 | -179.6 | 28.8 | 0 | 0 | 112.3 | S157 V158 Q159 A164 A165 | S157-Q161 WeakPolarHBondContact O-CG 3.44Å; S157-Q161 PolarHBondContact O-N 3.18Å; V158-Q161 WeakPolarHBondContact O-CB 3.36Å; V158-Q161 PolarHBondContact O-N 3.14Å; V158-Q161 VanDerWaalsContact O-N 3.09Å; Q159-Q161 VanDerWaalsContact C-N 3.33Å; Q159-Q161 PolarHBondContact O-N 2.68Å; Q161-A164 PolarHBondContact O-N 3.04Å; Q161-A165 VanDerWaalsContact O-CB 3.3Å; Q161-A165 WeakPolarHBondContact O-CB 3.39Å; Q161-A165 PolarHBondContact O-N 3.3Å |
| 162 | I | 97.9 | Very high | 97.2 | Very high | 79 Ų | 79 | 62.5 Ų | 62.5 | 41% | 0.405 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -64.3 | -47.7 | 175.2 | -68.5 | 168.8 | 0 | 0 | 0 | 110.7 | V158 Q159 A164 A165 A166 A190 | V158-I162 HydrophobicContact CG1-CD1 3.82Å; V158-I162 HydrophobicContact CG1-CG1 4.41Å; V158-I162 WeakPolarHBondContact O-CG1 3.09Å; V158-I162 PolarHBondContact O-N 3.08Å; Q159-I162 PolarHBondContact O-N 2.77Å; I162-A164 PolarHBondContact O-N 3.48Å; I162-A165 PolarHBondContact O-N 3.39Å; I162-A165 VanDerWaalsContact O-N 3.17Å; I162-A166 WeakPolarHBondContact O-CB 3.26Å; I162-A166 PolarHBondContact O-N 3.48Å; I162-A190 HydrophobicContact CG2-CB 4.24Å |
| 163 | A | 98.3 | Very high | 97 | Very high | 4 Ų | 4 | 65.9 Ų | 65.9 | 3% | 0.033 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62.9 | -40.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112 | Q159 Q160 A166 R167 A190 L191 | Q159-A163 WeakPolarHBondContact O-CB 3.39Å; Q159-A163 PolarHBondContact O-N 3.03Å; Q160-A163 PolarHBondContact O-N 3.26Å; A163-A166 PolarHBondContact O-N 2.68Å; A163-R167 PolarHBondContact O-N 2.86Å; A163-A190 HydrophobicContact CB-CB 4.19Å; A163-L191 HydrophobicContact CB-CD2 4.01Å; A163-L191 HydrophobicContact CB-CG 4.44Å |
| 164 | A | 97.8 | Very high | 96.7 | Very high | 21 Ų | 21 | 70.4 Ų | 70.4 | 17% | 0.174 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -64.4 | -38.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q160 Q161 I162 R168 | Q160-A164 VanDerWaalsContact O-CB 3.31Å; Q160-A164 WeakPolarHBondContact O-CB 3.41Å; Q160-A164 PolarHBondContact O-N 3.09Å; Q161-A164 PolarHBondContact O-N 3.04Å; I162-A164 PolarHBondContact O-N 3.48Å; A164-R168 WeakPolarHBondContact O-CG 3.47Å; A164-R168 PolarHBondContact O-N 3.18Å; A164-R168 VanDerWaalsContact O-N 3.13Å; A164-R168 PolarHBondContact O-NH1 2.81Å |
| 165 | A | 97.8 | Very high | 96.4 | Very high | 29 Ų | 29 | 65.4 Ų | 65.4 | 24% | 0.24 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -67.6 | -43 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q161 I162 R167 R168 L169 | Q161-A165 VanDerWaalsContact O-CB 3.3Å; Q161-A165 WeakPolarHBondContact O-CB 3.39Å; Q161-A165 PolarHBondContact O-N 3.3Å; I162-A165 PolarHBondContact O-N 3.39Å; I162-A165 VanDerWaalsContact O-N 3.17Å; A165-R167 VanDerWaalsContact C-N 3.34Å; A165-R167 PolarHBondContact O-N 3.32Å; A165-R168 PolarHBondContact O-N 3.5Å; A165-L169 WeakPolarHBondContact O-CB 3.27Å; A165-L169 VanDerWaalsContact O-CG 3.3Å; A165-L169 WeakPolarHBondContact O-CG 3.22Å; A165-L169 PolarHBondContact O-N 2.84Å |
| 166 | A | 97.8 | Very high | 96.3 | Very high | 7 Ų | 7 | 63.9 Ų | 63.9 | 6% | 0.058 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -60.6 | -42.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | I162 A163 L169 A170 V186 Q187 A190 | I162-A166 WeakPolarHBondContact O-CB 3.26Å; I162-A166 PolarHBondContact O-N 3.48Å; A163-A166 PolarHBondContact O-N 2.68Å; A166-L169 PolarHBondContact O-N 2.76Å; A166-A170 WeakPolarHBondContact O-CB 3.43Å; A166-A170 PolarHBondContact O-N 3.22Å; A166-V186 HydrophobicContact CB-CG1 4.4Å; A166-Q187 HydrophobicContact CB-CB 4.1Å; A166-A190 HydrophobicContact CB-CB 4.33Å |
| 167 | R | 97.6 | Very high | 96.1 | Very high | 123 Ų | 123 | 69.7 Ų | 69.7 | 46% | 0.464 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -59 | -49.9 | 172.4 | -173.1 | 171.7 | 73.9 | -108.9 | 9.7 | 112.3 | A163 A165 L169 A170 L171 Q187 | A163-R167 PolarHBondContact O-N 2.86Å; A165-R167 VanDerWaalsContact C-N 3.34Å; A165-R167 PolarHBondContact O-N 3.32Å; R167-L169 PolarHBondContact O-N 3.1Å; R167-A170 PolarHBondContact O-N 2.86Å; R167-L171 HydrophobicContact CG-CD1 3.96Å; R167-L171 WeakPolarHBondContact O-CG 3.45Å; R167-L171 PolarHBondContact O-N 3.48Å; R167-Q187 HydrophobicContact CB-CG 4.33Å |
| 168 | R | 97.6 | Very high | 96 | Very high | 165 Ų | 165 | 70.9 Ų | 70.9 | 62% | 0.623 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -58 | -36.7 | 175.1 | -69.5 | -173.4 | -56.2 | -95.5 | 5.9 | 112.3 | A164 A165 A172 | A164-R168 WeakPolarHBondContact O-CG 3.47Å; A164-R168 PolarHBondContact O-N 3.18Å; A164-R168 VanDerWaalsContact O-N 3.13Å; A164-R168 PolarHBondContact O-NH1 2.81Å; A165-R168 PolarHBondContact O-N 3.5Å; R168-A172 PolarHBondContact O-N 3.29Å |
| 169 | L | 96.4 | Very high | 95.9 | Very high | 97 Ų | 97 | 72 Ų | 72 | 51% | 0.508 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -73.5 | -35.4 | 178.1 | -71.9 | 170.7 | 0 | 0 | 0 | 112.7 | A165 A166 R167 A172 R183 | A165-L169 WeakPolarHBondContact O-CB 3.27Å; A165-L169 VanDerWaalsContact O-CG 3.3Å; A165-L169 WeakPolarHBondContact O-CG 3.22Å; A165-L169 PolarHBondContact O-N 2.84Å; A166-L169 PolarHBondContact O-N 2.76Å; R167-L169 PolarHBondContact O-N 3.1Å; L169-A172 WeakPolarHBondContact O-CB 3.47Å; L169-R183 WeakPolarHBondContact O-CD 3.33Å; L169-R183 PolarHBondContact O-NH1 3.46Å |
| 170 | A | 95.6 | Very high | 95.8 | Very high | 2 Ų | 2 | 74.5 Ų | 74.5 | 2% | 0.017 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -73.3 | -32.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | A166 R167 A172 R180 R183 R184 Q187 | A166-A170 WeakPolarHBondContact O-CB 3.43Å; A166-A170 PolarHBondContact O-N 3.22Å; R167-A170 PolarHBondContact O-N 2.86Å; A170-A172 VanDerWaalsContact C-N 3.33Å; A170-R180 PolarHBondContact O-NH1 2.94Å; A170-R183 HydrophobicContact CB-CB 4.02Å; A170-R184 HydrophobicContact CB-CG 4.23Å; A170-Q187 VanDerWaalsContact CB-OE1 3.3Å |
| 171 | L | 94.9 | Very high | 95.8 | Very high | 97 Ų | 97 | 79.3 Ų | 79.3 | 51% | 0.508 | 40% | 0.399 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.4 | -1.4 | 175.9 | -64.9 | 176.8 | 0 | 0 | 0 | 114 | R167 | R167-L171 HydrophobicContact CG-CD1 3.96Å; R167-L171 WeakPolarHBondContact O-CG 3.45Å; R167-L171 PolarHBondContact O-N 3.48Å |
| 172 | A | 94.7 | Very high | 95.7 | Very high | 23 Ų | 23 | 80.2 Ų | 80.2 | 19% | 0.19 | 40% | 0.396 | C | S | . | . | | | trans | -60.7 | 150.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | R168 L169 A170 L175 R180 | R168-A172 PolarHBondContact O-N 3.29Å; L169-A172 WeakPolarHBondContact O-CB 3.47Å; A170-A172 VanDerWaalsContact C-N 3.33Å; A172-L175 HydrophobicContact CB-CD1 4.22Å; A172-L175 HydrophobicContact CB-CD2 4.39Å; A172-L175 HydrophobicContact CB-CG 4.37Å; A172-R180 PolarHBondContact O-NH1 3.31Å; A172-R180 PolarHBondContact O-NH2 3.48Å; A172-R180 VanDerWaalsContact O-NH2 3.15Å |
| 173 | P | 90.5 | Very high | 95.7 | Very high | 98 Ų | 98 | 80.3 Ų | 80.3 | 64% | 0.636 | 39% | 0.391 | S | S | * | . | S | Bend | trans | -68 | 173.4 | 166.9 | 31.3 | -35.9 | 0 | 0 | 0 | 111.3 | L175 | P173-L175 VanDerWaalsContact C-N 3.3Å; P173-L175 WeakPolarHBondContact O-CG 3.42Å; P173-L175 PolarHBondContact O-N 2.89Å |
| 174 | D | 89.8 | Confident | 95.7 | Very high | 157 Ų | 157 | 86.6 Ų | 86.6 | 84% | 0.84 | 41% | 0.414 | S | S | * | . | S | Bend | trans | 56.3 | 36.7 | 169.7 | -47.7 | -31.9 | 0 | 0 | 0 | 115.3 | | |
| 175 | L | 91.3 | Very high | 95.7 | Very high | 24 Ų | 24 | 90.4 Ų | 90.4 | 13% | 0.126 | 43% | 0.429 | C | S | . | . | | | trans | -104.9 | 133.3 | 175.7 | -52.9 | -171.7 | 0 | 0 | 0 | 111.5 | A172 P173 Q179 R180 R183 | A172-L175 HydrophobicContact CB-CD1 4.22Å; A172-L175 HydrophobicContact CB-CD2 4.39Å; A172-L175 HydrophobicContact CB-CG 4.37Å; P173-L175 VanDerWaalsContact C-N 3.3Å; P173-L175 WeakPolarHBondContact O-CG 3.42Å; P173-L175 PolarHBondContact O-N 2.89Å; L175-Q179 HydrophobicContact CB-CB 4.46Å; L175-R180 HydrophobicContact CB-CB 4.26Å; L175-R180 HydrophobicContact CD1-CB 4.38Å; L175-R180 HydrophobicContact CD1-CG 4.49Å; L175-R183 VanDerWaalsContact CD2-NH2 3.34Å |
| 176 | S | 95.9 | Very high | 95.7 | Very high | 58 Ų | 58 | 93 Ų | 93 | 41% | 0.406 | 44% | 0.442 | S | S | . | . | | | trans | -64.4 | 155.5 | 165.2 | 71.8 | 0 | 0 | 0 | 0 | 110.9 | E178 Q179 R180 | S176-E178 VanDerWaalsContact C-N 3.28Å; S176-E178 PolarHBondContact O-N 3.28Å; S176-Q179 WeakPolarHBondContact O-CB 3.49Å; S176-Q179 PolarHBondContact O-N 3.33Å; S176-Q179 VanDerWaalsContact OG-CG 3.26Å; S176-Q179 WeakPolarHBondContact OG-CG 3.39Å; S176-Q179 PolarHBondContact OG-N 2.95Å; S176-R180 PolarHBondContact O-N 3.02Å |
| 177 | T | 93.9 | Very high | 95.7 | Very high | 127 Ų | 127 | 94.8 Ų | 94.8 | 78% | 0.779 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -52.4 | -46.1 | 179.9 | 48.8 | 0 | 0 | 0 | 0 | 112.2 | R180 R181 | T177-R180 PolarHBondContact O-N 2.7Å; T177-R181 WeakPolarHBondContact O-CB 3.32Å; T177-R181 PolarHBondContact O-N 3.37Å |
| 178 | E | 95.9 | Very high | 95.7 | Very high | 75 Ų | 75 | 91 Ų | 91 | 35% | 0.35 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64.7 | -38.7 | 177.3 | -179.9 | 61.1 | -174 | 0 | 0 | 112.8 | S176 R182 | S176-E178 VanDerWaalsContact C-N 3.28Å; S176-E178 PolarHBondContact O-N 3.28Å; E178-R182 WeakPolarHBondContact O-CB 3.33Å; E178-R182 VanDerWaalsContact O-CG 3.3Å; E178-R182 WeakPolarHBondContact O-CG 3.42Å; E178-R182 PolarHBondContact O-N 3.25Å; E178-R182 IonicContact OE1-CZ 3.73Å; E178-R182 IonicContact OE1-NE 2.68Å; E178-R182 PolarHBondContact OE1-NE 3.29Å; E178-R182 IonicContact OE1-NH2 2.65Å; E178-R182 PolarHBondContact OE1-NH2 3.25Å |
| 179 | Q | 96.2 | Very high | 95.8 | Very high | 94 Ų | 94 | 85.8 Ų | 85.8 | 44% | 0.439 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -67.8 | -42.2 | 173.5 | -72.7 | 171.3 | -3 | 0 | 0 | 111.7 | L175 S176 R182 R183 | L175-Q179 HydrophobicContact CB-CB 4.46Å; S176-Q179 WeakPolarHBondContact O-CB 3.49Å; S176-Q179 PolarHBondContact O-N 3.33Å; S176-Q179 VanDerWaalsContact OG-CG 3.26Å; S176-Q179 WeakPolarHBondContact OG-CG 3.39Å; S176-Q179 PolarHBondContact OG-N 2.95Å; Q179-R182 PolarHBondContact O-N 3.19Å; Q179-R183 WeakPolarHBondContact O-CG 3.27Å; Q179-R183 PolarHBondContact O-N 3.03Å |
| 180 | R | 96.3 | Very high | 95.8 | Very high | 69 Ų | 69 | 81.5 Ų | 81.5 | 26% | 0.26 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -64 | -41.8 | 177.4 | -166.3 | 177.4 | -61.2 | -74.7 | 5.2 | 111 | A170 A172 L175 S176 T177 R183 R184 | A170-R180 PolarHBondContact O-NH1 2.94Å; A172-R180 PolarHBondContact O-NH1 3.31Å; A172-R180 PolarHBondContact O-NH2 3.48Å; A172-R180 VanDerWaalsContact O-NH2 3.15Å; L175-R180 HydrophobicContact CB-CB 4.26Å; L175-R180 HydrophobicContact CD1-CB 4.38Å; L175-R180 HydrophobicContact CD1-CG 4.49Å; S176-R180 PolarHBondContact O-N 3.02Å; T177-R180 PolarHBondContact O-N 2.7Å; R180-R183 PolarHBondContact O-N 3.41Å; R180-R184 WeakPolarHBondContact O-CB 3.45Å; R180-R184 WeakPolarHBondContact O-CG 3.45Å; R180-R184 PolarHBondContact O-N 2.99Å |
| 181 | R | 96.8 | Very high | 96 | Very high | 174 Ų | 174 | 85.2 Ų | 85.2 | 66% | 0.657 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -58 | -50.7 | 172.2 | -177.7 | 176.1 | 177 | -113.5 | -3.6 | 111.6 | T177 R183 R184 Q185 | T177-R181 WeakPolarHBondContact O-CB 3.32Å; T177-R181 PolarHBondContact O-N 3.37Å; R181-R183 PolarHBondContact O-N 3.43Å; R181-R184 PolarHBondContact O-N 2.72Å; R181-Q185 PolarHBondContact O-N 2.84Å |
| 182 | R | 97.4 | Very high | 96.1 | Very high | 161 Ų | 161 | 87.9 Ų | 87.9 | 61% | 0.608 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -62.1 | -38.2 | 178.1 | -72.2 | 174.2 | -174 | -113.9 | -1.4 | 112.9 | E178 Q179 Q185 V186 | E178-R182 WeakPolarHBondContact O-CB 3.33Å; E178-R182 VanDerWaalsContact O-CG 3.3Å; E178-R182 WeakPolarHBondContact O-CG 3.42Å; E178-R182 PolarHBondContact O-N 3.25Å; E178-R182 IonicContact OE1-CZ 3.73Å; E178-R182 IonicContact OE1-NE 2.68Å; E178-R182 PolarHBondContact OE1-NE 3.29Å; E178-R182 IonicContact OE1-NH2 2.65Å; E178-R182 PolarHBondContact OE1-NH2 3.25Å; Q179-R182 PolarHBondContact O-N 3.19Å; R182-Q185 WeakPolarHBondContact O-CB 3.46Å; R182-Q185 PolarHBondContact O-N 3.45Å; R182-V186 WeakPolarHBondContact O-CG2 3.17Å; R182-V186 PolarHBondContact O-N 3.1Å |
| 183 | R | 97.9 | Very high | 96.3 | Very high | 81 Ų | 81 | 91.6 Ų | 91.6 | 31% | 0.306 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -72.6 | -36.4 | 176.4 | -67.5 | -174.4 | -167.4 | -171.3 | 5.3 | 113 | L169 A170 L175 Q179 R180 R181 Q185 V186 Q187 | L169-R183 WeakPolarHBondContact O-CD 3.33Å; L169-R183 PolarHBondContact O-NH1 3.46Å; A170-R183 HydrophobicContact CB-CB 4.02Å; L175-R183 VanDerWaalsContact CD2-NH2 3.34Å; Q179-R183 WeakPolarHBondContact O-CG 3.27Å; Q179-R183 PolarHBondContact O-N 3.03Å; R180-R183 PolarHBondContact O-N 3.41Å; R181-R183 PolarHBondContact O-N 3.43Å; R183-Q185 VanDerWaalsContact C-N 3.33Å; R183-V186 PolarHBondContact O-N 3.02Å; R183-Q187 PolarHBondContact O-N 3.15Å |
| 184 | R | 97.2 | Very high | 96.6 | Very high | 136 Ų | 136 | 87.9 Ų | 87.9 | 51% | 0.513 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62 | -39.4 | 170.3 | -78.2 | 179.3 | 169.8 | 178.6 | -6 | 111.6 | A170 R180 R181 Q187 A188 | A170-R184 HydrophobicContact CB-CG 4.23Å; R180-R184 WeakPolarHBondContact O-CB 3.45Å; R180-R184 WeakPolarHBondContact O-CG 3.45Å; R180-R184 PolarHBondContact O-N 2.99Å; R181-R184 PolarHBondContact O-N 2.72Å; R184-Q187 PolarHBondContact O-N 3.34Å; R184-A188 PolarHBondContact O-N 2.9Å |
| 185 | Q | 97.9 | Very high | 97 | Very high | 102 Ų | 102 | 86.2 Ų | 86.2 | 48% | 0.477 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -60.1 | -52.2 | 172.2 | -172.7 | 62.8 | 55.8 | 0 | 0 | 111.2 | R181 R182 R183 Q187 A188 D189 | R181-Q185 PolarHBondContact O-N 2.84Å; R182-Q185 WeakPolarHBondContact O-CB 3.46Å; R182-Q185 PolarHBondContact O-N 3.45Å; R183-Q185 VanDerWaalsContact C-N 3.33Å; Q185-Q187 PolarHBondContact O-N 3.42Å; Q185-A188 WeakPolarHBondContact O-CB 3.33Å; Q185-A188 PolarHBondContact O-N 3.02Å; Q185-D189 PolarHBondContact NE2-OD1 3.26Å; Q185-D189 PolarHBondContact O-N 3.09Å |
| 186 | V | 98.1 | Very high | 97.4 | Very high | 84 Ų | 84 | 88.8 Ų | 88.8 | 51% | 0.509 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -59.4 | -33.5 | 177.4 | 171.5 | 0 | 0 | 0 | 0 | 112.6 | A166 R182 R183 A190 | A166-V186 HydrophobicContact CB-CG1 4.4Å; R182-V186 WeakPolarHBondContact O-CG2 3.17Å; R182-V186 PolarHBondContact O-N 3.1Å; R183-V186 PolarHBondContact O-N 3.02Å; V186-A190 VanDerWaalsContact O-CB 3.27Å; V186-A190 WeakPolarHBondContact O-CB 3.45Å; V186-A190 PolarHBondContact O-N 3.11Å |
| 187 | Q | 98.1 | Very high | 97.4 | Very high | 43 Ų | 43 | 86.2 Ų | 86.2 | 20% | 0.201 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -65.6 | -46.3 | 171.7 | 178.4 | -173.9 | -22 | 0 | 0 | 111.9 | A166 R167 A170 R183 R184 Q185 D189 A190 L191 | A166-Q187 HydrophobicContact CB-CB 4.1Å; R167-Q187 HydrophobicContact CB-CG 4.33Å; A170-Q187 VanDerWaalsContact CB-OE1 3.3Å; R183-Q187 PolarHBondContact O-N 3.15Å; R184-Q187 PolarHBondContact O-N 3.34Å; Q185-Q187 PolarHBondContact O-N 3.42Å; Q187-D189 VanDerWaalsContact C-N 3.35Å; Q187-A190 PolarHBondContact O-N 2.86Å; Q187-L191 HydrophobicContact CG-CD1 4.09Å; Q187-L191 VanDerWaalsContact O-CG 3.31Å; Q187-L191 WeakPolarHBondContact O-CG 3.43Å; Q187-L191 PolarHBondContact O-N 3.34Å |
| 188 | A | 98 | Very high | 97.5 | Very high | 43 Ų | 43 | 84 Ų | 84 | 36% | 0.355 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -63.9 | -40 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | R184 Q185 L191 R192 | R184-A188 PolarHBondContact O-N 2.9Å; Q185-A188 WeakPolarHBondContact O-CB 3.33Å; Q185-A188 PolarHBondContact O-N 3.02Å; A188-L191 PolarHBondContact O-N 2.94Å; A188-R192 WeakPolarHBondContact O-CG 3.43Å; A188-R192 PolarHBondContact O-N 3.03Å |
| 189 | D | 98.2 | Very high | 97.5 | Very high | 57 Ų | 57 | 86.2 Ų | 86.2 | 31% | 0.305 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -63.8 | -44.2 | 176 | -58.8 | -23.3 | 0 | 0 | 0 | 111.2 | Q185 Q187 L191 R192 R193 | Q185-D189 PolarHBondContact NE2-OD1 3.26Å; Q185-D189 PolarHBondContact O-N 3.09Å; Q187-D189 VanDerWaalsContact C-N 3.35Å; D189-L191 VanDerWaalsContact C-N 3.35Å; D189-L191 PolarHBondContact O-N 3.45Å; D189-R192 PolarHBondContact O-N 3.06Å; D189-R192 IonicContact OD1-CZ 3.69Å; D189-R192 IonicContact OD1-NE 3.9Å; D189-R192 IonicContact OD1-NH2 2.7Å; D189-R192 PolarHBondContact OD1-NH2 3.3Å; D189-R193 PolarHBondContact O-N 3.26Å |
| 190 | A | 98.1 | Very high | 97.5 | Very high | 7 Ų | 7 | 85.9 Ų | 85.9 | 6% | 0.058 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -65.1 | -35.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q159 I162 A163 A166 V186 Q187 L194 | Q159-A190 PolarHBondContact NE2-O 2.91Å; I162-A190 HydrophobicContact CG2-CB 4.24Å; A163-A190 HydrophobicContact CB-CB 4.19Å; A166-A190 HydrophobicContact CB-CB 4.33Å; V186-A190 VanDerWaalsContact O-CB 3.27Å; V186-A190 WeakPolarHBondContact O-CB 3.45Å; V186-A190 PolarHBondContact O-N 3.11Å; Q187-A190 PolarHBondContact O-N 2.86Å; A190-L194 WeakPolarHBondContact O-CB 3.34Å; A190-L194 PolarHBondContact O-N 3.22Å |
| 191 | L | 98.1 | Very high | 97.4 | Very high | 80 Ų | 80 | 83.4 Ų | 83.4 | 42% | 0.419 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -71.5 | -39.6 | 175.5 | -72.7 | 168.1 | 0 | 0 | 0 | 112.5 | A163 Q187 A188 D189 L194 H195 | A163-L191 HydrophobicContact CB-CD2 4.01Å; A163-L191 HydrophobicContact CB-CG 4.44Å; Q187-L191 HydrophobicContact CG-CD1 4.09Å; Q187-L191 VanDerWaalsContact O-CG 3.31Å; Q187-L191 WeakPolarHBondContact O-CG 3.43Å; Q187-L191 PolarHBondContact O-N 3.34Å; A188-L191 PolarHBondContact O-N 2.94Å; D189-L191 VanDerWaalsContact C-N 3.35Å; D189-L191 PolarHBondContact O-N 3.45Å; L191-L194 WeakPolarHBondContact O-CB 3.41Å; L191-L194 PolarHBondContact O-N 3.09Å; L191-H195 PolarHBondContact O-N 3.17Å; L191-H195 VanDerWaalsContact O-N 3.1Å |
| 192 | R | 98.3 | Very high | 97.2 | Very high | 152 Ų | 152 | 76 Ų | 76 | 57% | 0.574 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -60.8 | -47 | 172.7 | -72.4 | -172.8 | -63.5 | 146.8 | -3.9 | 111.2 | A188 D189 L194 H195 E196 | A188-R192 WeakPolarHBondContact O-CG 3.43Å; A188-R192 PolarHBondContact O-N 3.03Å; D189-R192 PolarHBondContact O-N 3.06Å; D189-R192 IonicContact OD1-CZ 3.69Å; D189-R192 IonicContact OD1-NE 3.9Å; D189-R192 IonicContact OD1-NH2 2.7Å; D189-R192 PolarHBondContact OD1-NH2 3.3Å; R192-L194 VanDerWaalsContact C-N 3.26Å; R192-L194 PolarHBondContact O-N 3.07Å; R192-H195 PolarHBondContact O-N 3.07Å; R192-H195 VanDerWaalsContact O-N 3.17Å; R192-E196 PolarHBondContact O-N 2.91Å |
| 193 | R | 97.9 | Very high | 97 | Very high | 102 Ų | 102 | 72 Ų | 72 | 39% | 0.385 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -65.2 | -28.2 | 177.1 | -177.1 | 55.7 | 178.3 | -176.9 | 3.6 | 113.2 | Q159 D189 E196 L197 | Q159-R193 HydrophobicContact CG-CG 4.39Å; D189-R193 PolarHBondContact O-N 3.26Å; R193-E196 WeakPolarHBondContact CD-OE2 3.41Å; R193-E196 IonicContact CZ-OE2 3.02Å; R193-E196 IonicContact NE-OE2 2.82Å; R193-E196 IonicContact NH1-OE2 3.6Å; R193-E196 PolarHBondContact NH1-OE2 3.22Å; R193-L197 HydrophobicContact CG-CD1 4.43Å; R193-L197 WeakPolarHBondContact O-CG 3.35Å; R193-L197 PolarHBondContact O-N 2.98Å |
| 194 | L | 98.3 | Very high | 96.6 | Very high | 20 Ų | 20 | 70.4 Ų | 70.4 | 11% | 0.105 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -65.9 | -48.9 | 171.3 | 178.1 | 58.3 | 0 | 0 | 0 | 111.1 | V156 Q159 Q160 A190 L191 R192 E196 L197 E198 | V156-L194 HydrophobicContact CG1-CD1 4.23Å; Q159-L194 HydrophobicContact CB-CD1 4.24Å; Q159-L194 HydrophobicContact CG-CB 3.93Å; Q159-L194 HydrophobicContact CG-CD1 4.23Å; Q160-L194 HydrophobicContact CB-CD1 4.49Å; Q160-L194 HydrophobicContact CG-CD1 3.46Å; Q160-L194 VanDerWaalsContact CG-CD1 3.46Å; Q160-L194 HydrophobicContact CG-CD2 3.83Å; Q160-L194 HydrophobicContact CG-CG 4.3Å; A190-L194 WeakPolarHBondContact O-CB 3.34Å; A190-L194 PolarHBondContact O-N 3.22Å; L191-L194 WeakPolarHBondContact O-CB 3.41Å; L191-L194 PolarHBondContact O-N 3.09Å; R192-L194 VanDerWaalsContact C-N 3.26Å; R192-L194 PolarHBondContact O-N 3.07Å; L194-E196 VanDerWaalsContact C-N 3.32Å; L194-E196 PolarHBondContact O-N 2.85Å; L194-L197 PolarHBondContact O-N 2.88Å; L194-L197 VanDerWaalsContact O-N 3.09Å; L194-E198 HydrophobicContact CD1-CG 3.94Å; L194-E198 WeakPolarHBondContact CD1-OE1 3.33Å; L194-E198 HydrophobicContact CG-CG 4.33Å; L194-E198 WeakPolarHBondContact O-CG 3.28Å; L194-E198 PolarHBondContact O-N 2.85Å |
| 195 | H | 97.9 | Very high | 96.2 | Very high | 121 Ų | 121 | 65.8 Ų | 65.8 | 56% | 0.56 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -58.9 | -42.3 | 177.4 | -170.9 | -67.1 | 0 | 0 | 0 | 112 | L191 R192 L197 E198 E199 | L191-H195 PolarHBondContact O-N 3.17Å; L191-H195 VanDerWaalsContact O-N 3.1Å; R192-H195 PolarHBondContact O-N 3.07Å; R192-H195 VanDerWaalsContact O-N 3.17Å; H195-L197 VanDerWaalsContact C-N 3.27Å; H195-L197 PolarHBondContact O-N 3.17Å; H195-E198 PolarHBondContact O-N 3.42Å; H195-E199 IonicContact CE1-OE2 2.75Å; H195-E199 IonicContact ND1-OE2 2.91Å; H195-E199 PolarHBondContact ND1-OE2 2.88Å; H195-E199 WeakPolarHBondContact O-CB 3.33Å; H195-E199 PolarHBondContact O-N 3.23Å |
| 196 | E | 97.9 | Very high | 95.7 | Very high | 79 Ų | 79 | 64 Ų | 64 | 37% | 0.369 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -56 | -39.7 | 174.8 | -71.4 | 169.6 | -162.3 | 0 | 0 | 112.8 | R192 R193 L194 Q200 | R192-E196 PolarHBondContact O-N 2.91Å; R193-E196 WeakPolarHBondContact CD-OE2 3.41Å; R193-E196 IonicContact CZ-OE2 3.02Å; R193-E196 IonicContact NE-OE2 2.82Å; R193-E196 IonicContact NH1-OE2 3.6Å; R193-E196 PolarHBondContact NH1-OE2 3.22Å; L194-E196 VanDerWaalsContact C-N 3.32Å; L194-E196 PolarHBondContact O-N 2.85Å; E196-Q200 WeakPolarHBondContact O-CB 3.45Å; E196-Q200 WeakPolarHBondContact O-CG 3.43Å; E196-Q200 PolarHBondContact O-N 3.09Å; E196-Q200 PolarHBondContact O-NE2 3.04Å |
| 197 | L | 97.4 | Very high | 95.1 | Very high | 3 Ų | 3 | 68.2 Ų | 68.2 | 2% | 0.016 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -79.4 | -35.9 | -179.6 | -68.4 | 167 | 0 | 0 | 0 | 112.3 | L152 E155 V156 Q159 R193 L194 H195 Q200 L201 | L152-L197 HydrophobicContact CD1-CD2 3.91Å; E155-L197 HydrophobicContact CG-CD1 3.91Å; E155-L197 HydrophobicContact CG-CD2 3.97Å; V156-L197 HydrophobicContact CG2-CB 3.68Å; Q159-L197 HydrophobicContact CB-CD1 3.72Å; Q159-L197 HydrophobicContact CG-CD1 3.92Å; R193-L197 HydrophobicContact CG-CD1 4.43Å; R193-L197 WeakPolarHBondContact O-CG 3.35Å; R193-L197 PolarHBondContact O-N 2.98Å; L194-L197 PolarHBondContact O-N 2.88Å; L194-L197 VanDerWaalsContact O-N 3.09Å; H195-L197 VanDerWaalsContact C-N 3.27Å; H195-L197 PolarHBondContact O-N 3.17Å; L197-Q200 PolarHBondContact O-N 2.93Å; L197-L201 VanDerWaalsContact O-CB 3.3Å; L197-L201 WeakPolarHBondContact O-CB 3.19Å; L197-L201 PolarHBondContact O-N 2.82Å |
| 198 | E | 95.8 | Very high | 94.4 | Very high | 81 Ų | 81 | 67.3 Ų | 67.3 | 38% | 0.379 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -69.1 | -35.2 | 174.6 | -71.3 | 177.9 | 163.3 | 0 | 0 | 111.4 | V156 Q160 L194 H195 L201 G202 | V156-E198 HydrophobicContact CG1-CG 3.84Å; V156-E198 HydrophobicContact CG2-CG 4.38Å; Q160-E198 PolarHBondContact NE2-OE1 2.98Å; L194-E198 HydrophobicContact CD1-CG 3.94Å; L194-E198 WeakPolarHBondContact CD1-OE1 3.33Å; L194-E198 HydrophobicContact CG-CG 4.33Å; L194-E198 WeakPolarHBondContact O-CG 3.28Å; L194-E198 PolarHBondContact O-N 2.85Å; H195-E198 PolarHBondContact O-N 3.42Å; E198-L201 PolarHBondContact O-N 2.65Å; E198-G202 PolarHBondContact O-N 2.89Å |
| 199 | E | 96.2 | Very high | 93.2 | Very high | 122 Ų | 122 | 68.2 Ų | 68.2 | 57% | 0.57 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -64.9 | -50.8 | 170.1 | -174.4 | 173 | 174.4 | 0 | 0 | 110.9 | H195 L201 G202 D203 | H195-E199 IonicContact CE1-OE2 2.75Å; H195-E199 IonicContact ND1-OE2 2.91Å; H195-E199 PolarHBondContact ND1-OE2 2.88Å; H195-E199 WeakPolarHBondContact O-CB 3.33Å; H195-E199 PolarHBondContact O-N 3.23Å; E199-L201 VanDerWaalsContact C-N 3.26Å; E199-L201 PolarHBondContact O-N 3.21Å; E199-G202 PolarHBondContact O-N 3.37Å; E199-G202 VanDerWaalsContact O-N 3.14Å; E199-D203 VanDerWaalsContact O-CB 3.31Å; E199-D203 WeakPolarHBondContact O-CB 3.41Å; E199-D203 PolarHBondContact O-N 2.98Å |
| 200 | Q | 96 | Very high | 92 | Very high | 86 Ų | 86 | 68.9 Ų | 68.9 | 40% | 0.402 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -56.9 | -38.2 | 173.7 | -75.4 | 165.2 | 26.9 | 0 | 0 | 112.6 | L152 E196 L197 D203 V204 | L152-Q200 HydrophobicContact CD1-CB 4.45Å; L152-Q200 HydrophobicContact CD2-CB 4.14Å; E196-Q200 WeakPolarHBondContact O-CB 3.45Å; E196-Q200 WeakPolarHBondContact O-CG 3.43Å; E196-Q200 PolarHBondContact O-N 3.09Å; E196-Q200 PolarHBondContact O-NE2 3.04Å; L197-Q200 PolarHBondContact O-N 2.93Å; Q200-D203 PolarHBondContact O-N 3.47Å; Q200-V204 WeakPolarHBondContact O-CG2 3.45Å; Q200-V204 PolarHBondContact O-N 2.95Å |
| 201 | L | 94.7 | Very high | 90.2 | Very high | 17 Ų | 17 | 73.1 Ų | 73.1 | 9% | 0.089 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -66.8 | -43.3 | 176.9 | -178.5 | 66.5 | 0 | 0 | 0 | 111.7 | L149 L152 E153 V156 L197 E198 E199 D203 R205 | L149-L201 HydrophobicContact CD1-CD1 3.46Å; L149-L201 VanDerWaalsContact CD1-CD1 3.46Å; L152-L201 HydrophobicContact CD2-CB 4.24Å; L152-L201 HydrophobicContact CD2-CD1 4.3Å; L152-L201 HydrophobicContact CG-CB 4.37Å; L152-L201 HydrophobicContact CG-CD1 4.25Å; E153-L201 HydrophobicContact CG-CD1 3.41Å; E153-L201 VanDerWaalsContact CG-CD1 3.41Å; E153-L201 HydrophobicContact CG-CD2 4.11Å; E153-L201 HydrophobicContact CG-CG 4.41Å; V156-L201 HydrophobicContact CG2-CB 4.39Å; V156-L201 HydrophobicContact CG2-CD2 4.29Å; L197-L201 VanDerWaalsContact O-CB 3.3Å; L197-L201 WeakPolarHBondContact O-CB 3.19Å; L197-L201 PolarHBondContact O-N 2.82Å; E198-L201 PolarHBondContact O-N 2.65Å; E199-L201 VanDerWaalsContact C-N 3.26Å; E199-L201 PolarHBondContact O-N 3.21Å; L201-D203 VanDerWaalsContact C-N 3.3Å; L201-R205 WeakPolarHBondContact O-CB 3.3Å; L201-R205 VanDerWaalsContact O-CG 3.27Å; L201-R205 WeakPolarHBondContact O-CG 3.33Å; L201-R205 PolarHBondContact O-N 3.22Å |
| 202 | G | 92.2 | Very high | 88.2 | Confident | 19 Ų | 19 | 74 Ų | 74 | 20% | 0.196 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -60.5 | -41.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | E198 E199 R205 A206 | E198-G202 PolarHBondContact O-N 2.89Å; E199-G202 PolarHBondContact O-N 3.37Å; E199-G202 VanDerWaalsContact O-N 3.14Å; G202-R205 PolarHBondContact O-N 3.29Å; G202-A206 VanDerWaalsContact O-CB 3.24Å; G202-A206 WeakPolarHBondContact O-CB 3.5Å; G202-A206 PolarHBondContact O-N 3.34Å |
| 203 | D | 92.1 | Very high | 86 | Confident | 78 Ų | 78 | 72.6 Ų | 72.6 | 42% | 0.417 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -66.5 | -43.5 | -178.9 | -147.6 | 50.7 | 0 | 0 | 0 | 112.1 | E199 Q200 L201 R207 | E199-D203 VanDerWaalsContact O-CB 3.31Å; E199-D203 WeakPolarHBondContact O-CB 3.41Å; E199-D203 PolarHBondContact O-N 2.98Å; Q200-D203 PolarHBondContact O-N 3.47Å; L201-D203 VanDerWaalsContact C-N 3.3Å; D203-R207 WeakPolarHBondContact O-CD 3.31Å; D203-R207 WeakPolarHBondContact O-CG 3.45Å; D203-R207 PolarHBondContact O-N 2.87Å; D203-R207 PolarHBondContact O-NE 3.32Å; D203-R207 IonicContact OD1-NH2 3.46Å; D203-R207 IonicContact OD2-CZ 2.68Å; D203-R207 VanDerWaalsContact OD2-CZ 3.28Å; D203-R207 IonicContact OD2-NE 3.69Å; D203-R207 PolarHBondContact OD2-NE 3.3Å; D203-R207 VanDerWaalsContact OD2-NE 3.09Å; D203-R207 IonicContact OD2-NH2 3.61Å; D203-R207 PolarHBondContact OD2-NH2 2.92Å |
| 204 | V | 89.4 | Confident | 83.7 | Confident | 46 Ų | 46 | 73.3 Ų | 73.3 | 28% | 0.279 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -64.7 | -49.9 | 171.7 | 175.1 | 0 | 0 | 0 | 0 | 110.6 | L149 L152 Q200 A206 R207 L208 | L149-V204 HydrophobicContact CB-CG1 4.43Å; L149-V204 HydrophobicContact CD1-CB 4.48Å; L149-V204 HydrophobicContact CD1-CG1 3.96Å; L152-V204 HydrophobicContact CD2-CG2 4.09Å; Q200-V204 WeakPolarHBondContact O-CG2 3.45Å; Q200-V204 PolarHBondContact O-N 2.95Å; V204-A206 VanDerWaalsContact C-N 3.28Å; V204-A206 PolarHBondContact O-N 3.5Å; V204-R207 PolarHBondContact O-N 3.17Å; V204-R207 VanDerWaalsContact O-N 3.15Å; V204-L208 HydrophobicContact CG1-CD1 3.94Å; V204-L208 HydrophobicContact CG1-CG 4.36Å; V204-L208 VanDerWaalsContact O-CG 3.32Å; V204-L208 WeakPolarHBondContact O-CG 3.23Å; V204-L208 PolarHBondContact O-N 3.12Å |
| 205 | R | 89.4 | Confident | 81.4 | Confident | 39 Ų | 39 | 77.5 Ų | 77.5 | 15% | 0.147 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -58 | -40 | 178.9 | -74.2 | 172.9 | 173.2 | -170.4 | -3.3 | 112.1 | L149 E153 L201 G202 L208 G209 L210 | L149-R205 HydrophobicContact CD1-CG 4.01Å; E153-R205 IonicContact OE1-CZ 3.28Å; E153-R205 IonicContact OE1-NE 2.7Å; E153-R205 PolarHBondContact OE1-NE 2.89Å; E153-R205 IonicContact OE1-NH2 3.09Å; E153-R205 PolarHBondContact OE1-NH2 2.78Å; E153-R205 IonicContact OE2-NH2 3.9Å; L201-R205 WeakPolarHBondContact O-CB 3.3Å; L201-R205 VanDerWaalsContact O-CG 3.27Å; L201-R205 WeakPolarHBondContact O-CG 3.33Å; L201-R205 PolarHBondContact O-N 3.22Å; G202-R205 PolarHBondContact O-N 3.29Å; R205-L208 CarbonylContact O-C 3.48Å; R205-L208 PolarHBondContact O-N 3.17Å; R205-G209 PolarHBondContact O-N 3.04Å; R205-G209 VanDerWaalsContact O-N 3.11Å; R205-L210 HydrophobicContact CB-CB 4.18Å; R205-L210 HydrophobicContact CG-CB 4.46Å; R205-L210 PolarHBondContact O-N 3.04Å |
| 206 | A | 87 | Confident | 78.8 | Confident | 64 Ų | 64 | 77.2 Ų | 77.2 | 53% | 0.529 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -65.1 | -43.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | G202 V204 L208 G209 | G202-A206 VanDerWaalsContact O-CB 3.24Å; G202-A206 WeakPolarHBondContact O-CB 3.5Å; G202-A206 PolarHBondContact O-N 3.34Å; V204-A206 VanDerWaalsContact C-N 3.28Å; V204-A206 PolarHBondContact O-N 3.5Å; A206-L208 PolarHBondContact O-N 2.99Å; A206-G209 PolarHBondContact O-N 3.37Å; A206-G209 VanDerWaalsContact O-N 3.1Å |
| 207 | R | 86.4 | Confident | 76.2 | Confident | 173 Ų | 173 | 80.9 Ų | 80.9 | 65% | 0.653 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -60.7 | -29.6 | 173.9 | -68.5 | 157.8 | -165.5 | -78.1 | -2.1 | 112.5 | D203 V204 | D203-R207 WeakPolarHBondContact O-CD 3.31Å; D203-R207 WeakPolarHBondContact O-CG 3.45Å; D203-R207 PolarHBondContact O-N 2.87Å; D203-R207 PolarHBondContact O-NE 3.32Å; D203-R207 IonicContact OD1-NH2 3.46Å; D203-R207 IonicContact OD2-CZ 2.68Å; D203-R207 VanDerWaalsContact OD2-CZ 3.28Å; D203-R207 IonicContact OD2-NE 3.69Å; D203-R207 PolarHBondContact OD2-NE 3.3Å; D203-R207 VanDerWaalsContact OD2-NE 3.09Å; D203-R207 IonicContact OD2-NH2 3.61Å; D203-R207 PolarHBondContact OD2-NH2 2.92Å; V204-R207 PolarHBondContact O-N 3.17Å; V204-R207 VanDerWaalsContact O-N 3.15Å |
| 208 | L | 82.9 | Confident | 73.4 | Confident | 24 Ų | 24 | 86.8 Ų | 86.8 | 13% | 0.126 | 49% | 0.49 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.5 | 2.9 | 178.1 | -59.7 | -174.7 | 0 | 0 | 0 | 113.9 | L141 L149 V204 R205 A206 L210 | L141-L208 HydrophobicContact CD1-CD1 4.15Å; L141-L208 HydrophobicContact CD2-CB 4.02Å; L141-L208 HydrophobicContact CD2-CD1 3.82Å; L141-L208 HydrophobicContact CD2-CD2 3.6Å; L141-L208 HydrophobicContact CD2-CG 3.98Å; L149-L208 HydrophobicContact CD2-CD1 4.34Å; V204-L208 HydrophobicContact CG1-CD1 3.94Å; V204-L208 HydrophobicContact CG1-CG 4.36Å; V204-L208 VanDerWaalsContact O-CG 3.32Å; V204-L208 WeakPolarHBondContact O-CG 3.23Å; V204-L208 PolarHBondContact O-N 3.12Å; R205-L208 CarbonylContact O-C 3.48Å; R205-L208 PolarHBondContact O-N 3.17Å; A206-L208 PolarHBondContact O-N 2.99Å; L208-L210 HydrophobicContact CB-CD1 4.34Å; L208-L210 HydrophobicContact CB-CG 4.21Å; L208-L210 PolarHBondContact O-N 3.2Å |
| 209 | G | 72.1 | Confident | 70.3 | Confident | 62 Ų | 62 | 90.7 Ų | 90.7 | 64% | 0.639 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.2 | 11.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115 | R205 A206 | R205-G209 PolarHBondContact O-N 3.04Å; R205-G209 VanDerWaalsContact O-N 3.11Å; A206-G209 PolarHBondContact O-N 3.37Å; A206-G209 VanDerWaalsContact O-N 3.1Å |
| 210 | L | 73.1 | Confident | 67.7 | Low | 72 Ų | 72 | 90.6 Ų | 90.6 | 38% | 0.377 | 52% | 0.522 | S | S | . | . | | | trans | -78.7 | 132.4 | 179.4 | -63.9 | 176.4 | 0 | 0 | 0 | 110.1 | L149 R205 L208 V212 | L149-L210 HydrophobicContact CD2-CD1 3.94Å; R205-L210 HydrophobicContact CB-CB 4.18Å; R205-L210 HydrophobicContact CG-CB 4.46Å; R205-L210 PolarHBondContact O-N 3.04Å; L208-L210 HydrophobicContact CB-CD1 4.34Å; L208-L210 HydrophobicContact CB-CG 4.21Å; L208-L210 PolarHBondContact O-N 3.2Å; L210-V212 PolarHBondContact O-N 3.29Å |
| 211 | P | 61 | Low | 64.7 | Low | 96 Ų | 96 | 94.8 Ų | 94.8 | 62% | 0.623 | 55% | 0.547 | S | S | * | . | | | trans | -63.8 | 132.7 | 179.9 | 26.3 | -34 | 0 | 0 | 0 | 110.7 | L213 | P211-L213 PolarHBondContact O-N 3.48Š|
| 212 | V | 55.3 | Low | 61.6 | Low | 97 Ų | 97 | 99.5 Ų | 99.5 | 59% | 0.588 | 58% | 0.581 | S | S | * | * | | | trans | -73 | 78.4 | 174.6 | -175.7 | 0 | 0 | 0 | 0 | 109.2 | L210 | L210-V212 PolarHBondContact O-N 3.29Š|
| 213 | L | 53.3 | Low | 58.8 | Low | 123 Ų | 123 | 105.4 Ų | 105.4 | 64% | 0.644 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 123.7 | 167 | -68 | 175.9 | 0 | 0 | 0 | 108.6 | P211 L215 | P211-L213 PolarHBondContact O-N 3.48Å; L213-L215 PolarHBondContact O-N 3.49Å |
| 214 | P | 49 | Very low | 55.9 | Low | 118 Ų | 118 | 105.1 Ų | 105.1 | 77% | 0.766 | 63% | 0.629 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 126.4 | 170.7 | 26.6 | -32.5 | 0 | 0 | 0 | 108.9 | | |
| 215 | L | 49.9 | Very low | 53.2 | Low | 107 Ų | 107 | 108.7 Ų | 108.7 | 56% | 0.56 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 141.6 | -179.5 | -168.3 | 69.2 | 0 | 0 | 0 | 109.9 | L213 Q217 | L213-L215 PolarHBondContact O-N 3.49Å; L215-Q217 PolarHBondContact O-N 3.47Å; L215-Q217 VanDerWaalsContact O-N 3.09Å |
| 216 | P | 43.2 | Very low | 50.4 | Low | 116 Ų | 116 | 112.5 Ų | 112.5 | 75% | 0.753 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 117.4 | -176.4 | -27.6 | 36 | 0 | 0 | 0 | 112.9 | | |
| 217 | Q | 42.8 | Very low | 47.8 | Very low | 155 Ų | 155 | 116.3 Ų | 116.3 | 72% | 0.724 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -65 | 138.5 | 168.1 | -65.6 | -178.3 | -7.9 | 0 | 0 | 109.1 | L215 L219 | L215-Q217 PolarHBondContact O-N 3.47Å; L215-Q217 VanDerWaalsContact O-N 3.09Å; Q217-L219 PolarHBondContact O-N 2.91Å; Q217-L219 VanDerWaalsContact O-N 3.14Å |
| 218 | P | 39.6 | Very low | 45.2 | Very low | 127 Ų | 127 | 114.6 Ų | 114.6 | 83% | 0.825 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 116.8 | 177.2 | 26 | -33.2 | 0 | 0 | 0 | 109.9 | | |
| 219 | L | 30.9 | Very low | 42.8 | Very low | 164 Ų | 164 | 118 Ų | 118 | 86% | 0.859 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 129.3 | -177.2 | -68.9 | 166.2 | 0 | 0 | 0 | 111.3 | Q217 | Q217-L219 PolarHBondContact O-N 2.91Å; Q217-L219 VanDerWaalsContact O-N 3.14Å |
| 220 | P | 41.1 | Very low | 40.9 | Very low | 119 Ų | 119 | 124.5 Ų | 124.5 | 77% | 0.773 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 143 | 167.4 | 29.6 | -33.1 | 0 | 0 | 0 | 110.2 | S222 | P220-S222 PolarHBondContact O-N 2.82Š|
| 221 | L | 32.5 | Very low | 39.4 | Very low | 175 Ų | 175 | 125 Ų | 125 | 92% | 0.916 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 128.5 | 176.6 | -76.2 | 161.4 | 0 | 0 | 0 | 110.5 | T223 | L221-T223 PolarHBondContact O-N 2.88Š|
| 222 | S | 30.5 | Very low | 38.2 | Very low | 115 Ų | 115 | 126.5 Ų | 126.5 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 120.5 | -176.2 | -173.4 | 0 | 0 | 0 | 0 | 112.1 | P220 | P220-S222 PolarHBondContact O-N 2.82Š|
| 223 | T | 32.5 | Very low | 37.5 | Very low | 143 Ų | 143 | 128 Ų | 128 | 88% | 0.877 | 79% | 0.791 | S | S | * | * | | | trans | -118.1 | 124.9 | 150.4 | 33.9 | 0 | 0 | 0 | 0 | 106.4 | L221 | L221-T223 PolarHBondContact O-N 2.88Š|
| 224 | G | 32.6 | Very low | 36.9 | Very low | 73 Ų | 73 | 128.4 Ų | 128.4 | 75% | 0.753 | 79% | 0.793 | S | S | * | * | | | trans | -91.2 | 153.7 | -152.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 225 | S | 31.3 | Very low | 36.5 | Very low | 121 Ų | 121 | 125.7 Ų | 125.7 | 85% | 0.846 | 79% | 0.786 | S | S | * | * | | | trans | -146 | 147.2 | 145.5 | -170.5 | 0 | 0 | 0 | 0 | 110.8 | | |
| 226 | V | 31.5 | Very low | 36.4 | Very low | 119 Ų | 119 | 129.3 Ų | 129.3 | 72% | 0.721 | 80% | 0.803 | S | S | * | * | | | trans | -72.7 | 165.5 | 163 | -139.1 | 0 | 0 | 0 | 0 | 107 | | |
| 227 | I | 32 | Very low | 36.2 | Very low | 143 Ų | 143 | 131.3 Ų | 131.3 | 73% | 0.733 | 80% | 0.795 | S | S | * | * | | | cis | -153.2 | 178.2 | 20.1 | -35.5 | 155.6 | 0 | 0 | 0 | 110.4 | | |
| 228 | T | 31.5 | Very low | 36.1 | Very low | 138 Ų | 138 | 130.8 Ų | 130.8 | 85% | 0.847 | 80% | 0.797 | S | S | * | * | | | trans | 89.8 | 145.8 | 158.3 | 66.3 | 0 | 0 | 0 | 0 | 118.7 | | |
| 229 | A | 33.6 | Very low | 36.3 | Very low | 96 Ų | 96 | 131 Ų | 131 | 79% | 0.793 | 80% | 0.796 | S | S | * | * | | | trans | -127.4 | 134.8 | -177.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | | |
| 230 | Q | 32.7 | Very low | 36.5 | Very low | 198 Ų | 198 | 128 Ų | 128 | 93% | 0.925 | 78% | 0.777 | S | S | * | * | | | trans | -158.3 | 132 | 150.4 | -108.4 | 169.2 | 23.6 | 0 | 0 | 107.6 | | |
| 231 | G | 41.3 | Very low | 36.3 | Very low | 83 Ų | 83 | 129 Ų | 129 | 86% | 0.856 | 78% | 0.775 | S | S | * | * | | | trans | -92.7 | 121.1 | -172.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 232 | V | 35 | Very low | 36.6 | Very low | 127 Ų | 127 | 125 Ų | 125 | 77% | 0.77 | 76% | 0.763 | S | S | * | * | | | trans | -138.9 | 137.2 | 162.3 | -171.6 | 0 | 0 | 0 | 0 | 108.3 | L234 | V232-L234 PolarHBondContact O-N 2.76Š|
| 233 | C | 41.1 | Very low | 36.7 | Very low | 127 Ų | 127 | 126.4 Ų | 126.4 | 86% | 0.858 | 76% | 0.756 | S | S | * | * | | | trans | -67.9 | 122.9 | -176.9 | -57.6 | 0 | 0 | 0 | 0 | 111.8 | | |
| 234 | L | 40.2 | Very low | 36.8 | Very low | 132 Ų | 132 | 125.3 Ų | 125.3 | 69% | 0.691 | 74% | 0.741 | S | S | * | * | | | trans | -114.9 | 77.5 | 177 | -69.8 | -180 | 0 | 0 | 0 | 112.2 | V232 | V232-L234 PolarHBondContact O-N 2.76Š|
| 235 | G | 40.5 | Very low | 37.2 | Very low | 61 Ų | 61 | 127.5 Ų | 127.5 | 63% | 0.629 | 74% | 0.736 | S | S | * | * | | | trans | -67.4 | 159.6 | 145.5 | 0 | 0 | 0 | 0 | 0 | 110 | | |
| 236 | M | 47.8 | Very low | 37.7 | Very low | 184 Ų | 184 | 125.9 Ų | 125.9 | 91% | 0.906 | 72% | 0.72 | S | S | * | * | | | trans | 63.2 | 63.9 | 172.1 | -55.9 | 170.8 | 62 | 0 | 0 | 116.4 | | |
| 237 | R | 40.3 | Very low | 38.1 | Very low | 157 Ų | 157 | 125.4 Ų | 125.4 | 59% | 0.592 | 72% | 0.718 | S | S | * | * | | | trans | -125.5 | 21 | 164.2 | -78.2 | -72.7 | 175.5 | 161.6 | -0.5 | 114.9 | | |
| 238 | L | 39.7 | Very low | 38.4 | Very low | 144 Ų | 144 | 125.5 Ų | 125.5 | 75% | 0.754 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.6 | -11 | 179.4 | -109.9 | 168.2 | 0 | 0 | 0 | 114.9 | Q240 | L238-Q240 VanDerWaalsContact C-N 3.27Å; L238-Q240 PolarHBondContact O-N 3.18Å |
| 239 | T | 43.4 | Very low | 38.4 | Very low | 133 Ų | 133 | 127.5 Ų | 127.5 | 82% | 0.816 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.2 | -1.7 | 175.7 | 40.6 | 0 | 0 | 0 | 0 | 114.1 | | |
| 240 | Q | 35.9 | Very low | 38.4 | Very low | 99 Ų | 99 | 127.2 Ų | 127.2 | 46% | 0.463 | 71% | 0.71 | S | S | . | * | | | trans | -113.4 | 34.2 | -168.5 | -152.3 | -174.8 | -7.9 | 0 | 0 | 114.2 | L238 | L238-Q240 VanDerWaalsContact C-N 3.27Å; L238-Q240 PolarHBondContact O-N 3.18Å |
| 241 | L | 37.6 | Very low | 38.5 | Very low | 140 Ų | 140 | 126.2 Ų | 126.2 | 73% | 0.733 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -119.7 | 34.3 | 166.3 | -69.1 | 175.7 | 0 | 0 | 0 | 111.2 | E244 | L241-E244 WeakPolarHBondContact CA-OE1 3.15Š|
| 242 | S | 36.9 | Very low | 38 | Very low | 93 Ų | 93 | 127.6 Ų | 127.6 | 65% | 0.65 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -129.3 | 7.7 | -179.7 | -173.1 | 0 | 0 | 0 | 0 | 112.4 | | |
| 243 | Q | 34.5 | Very low | 37.7 | Very low | 143 Ų | 143 | 127.2 Ų | 127.2 | 67% | 0.668 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -124.5 | -10.6 | -167.1 | -163.5 | 158.5 | 7.4 | 0 | 0 | 114.4 | | |
| 244 | E | 34.3 | Very low | 37.2 | Very low | 121 Ų | 121 | 126.9 Ų | 126.9 | 57% | 0.565 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -77.2 | -26.9 | 169.8 | 49.1 | -89.7 | 91.5 | 0 | 0 | 114 | L241 V246 | L241-E244 WeakPolarHBondContact CA-OE1 3.15Å; E244-V246 PolarHBondContact O-N 2.77Å |
| 245 | D | 40 | Very low | 36.8 | Very low | 119 Ų | 119 | 128.7 Ų | 128.7 | 64% | 0.636 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -86.2 | 1.6 | -174.5 | -115.4 | -9.1 | 0 | 0 | 0 | 114.7 | | |
| 246 | V | 41.5 | Very low | 36.2 | Very low | 86 Ų | 86 | 132 Ų | 132 | 52% | 0.521 | 73% | 0.727 | S | S | . | * | S | Bend | trans | -106.6 | -24 | -172.7 | -177.4 | 0 | 0 | 0 | 0 | 112.8 | E244 L248 S250 | E244-V246 PolarHBondContact O-N 2.77Å; V246-L248 PolarHBondContact O-N 2.7Å; V246-S250 PolarHBondContact O-OG 2.97Å |
| 247 | V | 40.5 | Very low | 35.4 | Very low | 110 Ų | 110 | 132.7 Ų | 132.7 | 67% | 0.667 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | -21.8 | -164.7 | 179 | 0 | 0 | 0 | 0 | 114.1 | | |
| 248 | L | 38.1 | Very low | 34.9 | Very low | 145 Ų | 145 | 130.9 Ų | 130.9 | 76% | 0.759 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | -0.1 | -167.4 | -66.7 | 179.1 | 0 | 0 | 0 | 116.6 | V246 | V246-L248 PolarHBondContact O-N 2.7Š|
| 249 | H | 32.7 | Very low | 34.5 | Very low | 180 Ų | 180 | 127.9 Ų | 127.9 | 83% | 0.833 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -143 | 39.2 | 178.5 | -69.3 | -47.6 | 0 | 0 | 0 | 113.7 | | |
| 250 | S | 32 | Very low | 33.8 | Very low | 89 Ų | 89 | 126.6 Ų | 126.6 | 62% | 0.622 | 75% | 0.746 | S | S | * | * | | | trans | -105.1 | 30.7 | -179.6 | -64.9 | 0 | 0 | 0 | 0 | 114.8 | V246 S252 | V246-S250 PolarHBondContact O-OG 2.97Å; S250-S252 VanDerWaalsContact C-N 3.33Å; S250-S252 PolarHBondContact O-N 3.03Å |
| 251 | E | 34.7 | Very low | 33.4 | Very low | 177 Ų | 177 | 127.2 Ų | 127.2 | 83% | 0.827 | 76% | 0.762 | S | S | * | * | | | trans | -90.6 | 43 | 176.7 | 60.8 | -177.3 | 101.3 | 0 | 0 | 113.9 | | |
| 252 | S | 31.5 | Very low | 33 | Very low | 112 Ų | 112 | 128.7 Ų | 128.7 | 78% | 0.783 | 77% | 0.765 | S | S | * | * | | | trans | -163.2 | 84.4 | 171.8 | -82.8 | 0 | 0 | 0 | 0 | 112.9 | S250 | S250-S252 VanDerWaalsContact C-N 3.33Å; S250-S252 PolarHBondContact O-N 3.03Å |
| 253 | S | 29.6 | Very low | 32.7 | Very low | 120 Ų | 120 | 130 Ų | 130 | 84% | 0.839 | 77% | 0.765 | S | S | * | * | | | trans | -165.3 | 100 | 162.3 | -81.4 | 0 | 0 | 0 | 0 | 111.4 | | |
| 254 | S | 29.5 | Very low | 32.5 | Very low | 120 Ų | 120 | 129.9 Ų | 129.9 | 84% | 0.839 | 77% | 0.768 | S | S | * | * | | | trans | -168 | 84.9 | 162.4 | -95 | 0 | 0 | 0 | 0 | 110.7 | | |
| 255 | L | 31.3 | Very low | 32.3 | Very low | 170 Ų | 170 | 131.6 Ų | 131.6 | 89% | 0.89 | 78% | 0.776 | S | S | * | * | | | trans | -150.3 | 91.2 | 163.4 | -82 | -173.9 | 0 | 0 | 0 | 110.2 | | |
| 256 | S | 29.3 | Very low | 32.1 | Very low | 129 Ų | 129 | 134.6 Ų | 134.6 | 90% | 0.902 | 79% | 0.787 | S | S | * | * | | | trans | 157.5 | 99 | 138.7 | -70.2 | 0 | 0 | 0 | 0 | 110.6 | | |
| 257 | E | 29.8 | Very low | 32.5 | Very low | 200 Ų | 200 | 134.7 Ų | 134.7 | 94% | 0.935 | 79% | 0.789 | S | S | * | * | | | trans | -110.8 | 165 | 145.6 | -166.9 | 160.5 | 103.6 | 0 | 0 | 108.3 | | |
| 258 | S | 30.5 | Very low | 32.1 | Very low | 118 Ų | 118 | 138.4 Ų | 138.4 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | | | trans | -92.6 | 152.1 | -153.9 | -61.3 | 0 | 0 | 0 | 0 | 115.3 | | |
| 259 | G | 31.5 | Very low | 31.6 | Very low | 82 Ų | 82 | 135.4 Ų | 135.4 | 85% | 0.845 | 80% | 0.803 | S | S | * | * | | | trans | 88 | 120.7 | 140.8 | 0 | 0 | 0 | 0 | 0 | 117.2 | | |
| 260 | A | 27.8 | Very low | 31.2 | Very low | 105 Ų | 105 | 131.8 Ų | 131.8 | 87% | 0.868 | 80% | 0.797 | S | S | * | * | | | trans | -147.2 | 106.4 | 167.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 261 | S | 27.3 | Very low | 30.9 | Very low | 113 Ų | 113 | 136.1 Ų | 136.1 | 79% | 0.79 | 80% | 0.804 | S | S | * | * | | | trans | -162.3 | 104 | 152.9 | 57 | 0 | 0 | 0 | 0 | 107.5 | | |
| 262 | H | 30.6 | Very low | 30.4 | Very low | 171 Ų | 171 | 132.9 Ų | 132.9 | 79% | 0.792 | 80% | 0.801 | S | S | * | * | | | | 76.1 | 115.9 | 93.1 | -152.9 | -47.3 | 0 | 0 | 0 | 110.5 | | |
| 263 | D | 30.5 | Very low | 30.3 | Very low | 121 Ų | 121 | 135.4 Ų | 135.4 | 65% | 0.647 | 81% | 0.805 | S | S | * | * | | | cis | -154.1 | 163.8 | 2.5 | -117.9 | -174.9 | 0 | 0 | 0 | 110.9 | | |
| 264 | N | 29.1 | Very low | 30.2 | Very low | 140 Ų | 140 | 134 Ų | 134 | 75% | 0.749 | 80% | 0.801 | S | S | * | * | | | trans | 162.4 | 138.5 | 130.3 | -97.9 | 16.2 | 0 | 0 | 0 | 114.8 | | |
| 265 | E | 30.5 | Very low | 30.1 | Very low | 157 Ų | 157 | 137.3 Ų | 137.3 | 73% | 0.734 | 80% | 0.803 | S | S | * | * | | | trans | 39.2 | 111.7 | 145.3 | -35.8 | -53.1 | 68.4 | 0 | 0 | 122.2 | | |
| 266 | E | 36.4 | Very low | 30 | Very low | 182 Ų | 182 | 139.8 Ų | 139.8 | 85% | 0.85 | 80% | 0.8 | S | S | * | * | | | | 6.9 | 159.6 | 123.8 | -123.8 | 87.9 | -145.5 | 0 | 0 | 121.2 | | |
| 267 | P | 49.3 | Very low | 30.7 | Very low | 88 Ų | 88 | 138.4 Ų | 138.4 | 57% | 0.571 | 79% | 0.788 | S | S | * | * | | | | -131.3 | -145.9 | -79 | 45.4 | -29.9 | 0 | 0 | 0 | 112.7 | | |
| 268 | H | 33 | Very low | 30.5 | Very low | 188 Ų | 188 | 134 Ų | 134 | 87% | 0.87 | 78% | 0.78 | S | S | * | * | | | trans | 88.9 | 152.9 | 170.7 | -48 | -69.4 | 0 | 0 | 0 | 118.3 | | |
| 269 | G | 26.5 | Very low | 31.8 | Very low | 82 Ų | 82 | 134 Ų | 134 | 85% | 0.845 | 78% | 0.777 | S | S | * | * | | | trans | 126 | 93.5 | 165.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | | |
| 270 | C | 24.1 | Very low | 32.3 | Very low | 104 Ų | 104 | 135.9 Ų | 135.9 | 70% | 0.703 | 77% | 0.774 | S | S | * | * | | | trans | -89.1 | 173.2 | -179.9 | -160.5 | 0 | 0 | 0 | 0 | 113.1 | | |
| 271 | F | 27 | Very low | 32.7 | Very low | 179 Ų | 179 | 140.4 Ų | 140.4 | 79% | 0.785 | 78% | 0.775 | S | S | * | * | | | trans | 84.2 | 95.8 | 165.6 | -53 | -68.2 | 0 | 0 | 0 | 120.2 | | |
| 272 | S | 24 | Very low | 32.8 | Very low | 109 Ų | 109 | 139.1 Ų | 139.1 | 76% | 0.762 | 77% | 0.771 | S | S | * | * | | | | 41.1 | 141.6 | 106 | -50.1 | 0 | 0 | 0 | 0 | 123 | | |
| 273 | L | 27.8 | Very low | 32.6 | Very low | 166 Ų | 166 | 142 Ų | 142 | 87% | 0.869 | 78% | 0.775 | S | S | * | * | | | trans | 104.7 | 98.5 | 134.3 | -144.3 | 95.6 | 0 | 0 | 0 | 120.1 | | |
| 274 | A | 28.6 | Very low | 32.7 | Very low | 90 Ų | 90 | 141.4 Ų | 141.4 | 74% | 0.744 | 77% | 0.772 | S | S | * | * | | | trans | 65.7 | -178.5 | 135 | 0 | 0 | 0 | 0 | 0 | 122.3 | | |
| 275 | E | 26.7 | Very low | 32.9 | Very low | 189 Ų | 189 | 141.1 Ų | 141.1 | 88% | 0.883 | 77% | 0.766 | S | S | * | * | | | trans | 64.2 | 96 | 172 | -78 | -176.1 | 109.8 | 0 | 0 | 122.1 | | |
| 276 | R | 30.3 | Very low | 33.1 | Very low | 222 Ų | 222 | 140 Ų | 140 | 84% | 0.838 | 76% | 0.764 | S | S | * | * | | | | -38 | 165 | 127.4 | -116.3 | -179.4 | 170.4 | 159.4 | -2.3 | 112.5 | | |
| 277 | P | 42.9 | Very low | 33 | Very low | 100 Ų | 100 | 141.3 Ų | 141.3 | 65% | 0.649 | 76% | 0.761 | S | S | * | * | | | cis | -148 | 140.2 | 12.8 | 33.1 | -8.7 | 0 | 0 | 0 | 119.6 | | |
| 278 | S | 26 | Very low | 32.2 | Very low | 109 Ų | 109 | 141.2 Ų | 141.2 | 76% | 0.762 | 77% | 0.768 | S | S | * | * | | | trans | 69.7 | -171.3 | 140.5 | -34.9 | 0 | 0 | 0 | 0 | 117.4 | | |
| 279 | P | 57.6 | Low | 32.1 | Very low | 116 Ų | 116 | 138.3 Ų | 138.3 | 75% | 0.753 | 76% | 0.763 | S | S | * | * | | | trans | -126.4 | -168.1 | -135.4 | 38.9 | -14.8 | 0 | 0 | 0 | 114.5 | | |
| 280 | P | 42.8 | Very low | 32.3 | Very low | 123 Ų | 123 | 139.9 Ų | 139.9 | 80% | 0.799 | 76% | 0.761 | S | S | * | * | | | | -153.7 | -176.8 | 91 | 41.3 | -21.8 | 0 | 0 | 0 | 117.1 | | |
| 281 | K | 34.8 | Very low | 32.5 | Very low | 200 Ų | 200 | 138.7 Ų | 138.7 | 87% | 0.87 | 77% | 0.766 | S | S | * | * | | | trans | -64 | 158.3 | 176.7 | -45.5 | 144.1 | -179.3 | 171.2 | 0 | 113.7 | | |
| 282 | A | 31 | Very low | 32.6 | Very low | 86 Ų | 86 | 134 Ų | 134 | 71% | 0.711 | 77% | 0.768 | S | S | * | * | | | | -164.7 | 134.1 | 128.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | | |
| 283 | W | 25.4 | Very low | 32.9 | Very low | 232 Ų | 232 | 134.2 Ų | 134.2 | 88% | 0.879 | 77% | 0.77 | S | S | * | * | | | | 37.3 | 144.2 | 122.2 | -68.7 | 61.7 | 0 | 0 | 0 | 121.3 | | |
| 284 | D | 32.8 | Very low | 33.8 | Very low | 108 Ų | 108 | 131.3 Ų | 131.3 | 58% | 0.578 | 76% | 0.761 | S | S | * | * | | | cis | -170.6 | 171.7 | -12.5 | -164 | 14 | 0 | 0 | 0 | 111.5 | | |
| 285 | Q | 34.2 | Very low | 34 | Very low | 134 Ų | 134 | 134 Ų | 134 | 63% | 0.626 | 76% | 0.758 | S | S | * | * | | | trans | 75.1 | 144.3 | 144 | -100.1 | 172.2 | 85.9 | 0 | 0 | 123.7 | | |
| 286 | L | 34.1 | Very low | 34.5 | Very low | 133 Ų | 133 | 135.5 Ų | 135.5 | 70% | 0.696 | 76% | 0.755 | S | S | * | * | | | trans | 71.8 | 144.3 | 156.2 | -61.2 | 158.1 | 0 | 0 | 0 | 117.9 | | |
| 287 | R | 34.8 | Very low | 34.7 | Very low | 210 Ų | 210 | 136.2 Ų | 136.2 | 79% | 0.792 | 76% | 0.758 | S | S | * | * | | | cis | -167.2 | 122 | -11.9 | 163.7 | 177 | -85.1 | -103.5 | 1.8 | 111.9 | | |
| 288 | A | 32 | Very low | 34.4 | Very low | 86 Ų | 86 | 137.8 Ų | 137.8 | 71% | 0.711 | 77% | 0.766 | S | S | * | * | | | trans | 61.6 | 169.1 | 145.1 | 0 | 0 | 0 | 0 | 0 | 118.4 | | |
| 289 | V | 30.5 | Very low | 35.1 | Very low | 126 Ų | 126 | 138 Ų | 138 | 76% | 0.764 | 77% | 0.765 | S | S | * | * | | | cis | -158.6 | 151 | -21.2 | 119.3 | 0 | 0 | 0 | 0 | 109.2 | | |
| 290 | S | 31.8 | Very low | 33.8 | Very low | 116 Ų | 116 | 144.4 Ų | 144.4 | 81% | 0.811 | 77% | 0.774 | S | S | * | * | | | trans | 60.7 | 154.7 | 170.9 | -68.9 | 0 | 0 | 0 | 0 | 117.3 | | |
| 291 | G | 27.4 | Very low | 33.4 | Very low | 78 Ų | 78 | 148 Ų | 148 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | | | cis | 126 | 107 | -1.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | | |
| 292 | G | 28.6 | Very low | 34.3 | Very low | 80 Ų | 80 | 144 Ų | 144 | 83% | 0.825 | 77% | 0.772 | S | S | * | * | | | trans | 175.6 | 94.9 | -179 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 293 | S | 31.3 | Very low | 35.2 | Very low | 114 Ų | 114 | 145.2 Ų | 145.2 | 80% | 0.797 | 77% | 0.772 | S | S | * | * | | | trans | -71.8 | 160.8 | 145 | -131.5 | 0 | 0 | 0 | 0 | 107.9 | | |
| 294 | P | 46.7 | Very low | 36.2 | Very low | 105 Ų | 105 | 140 Ų | 140 | 68% | 0.682 | 77% | 0.769 | S | S | * | * | | | cis | -150.6 | -173.2 | 38 | 43.7 | -22.3 | 0 | 0 | 0 | 117.4 | | |
| 295 | E | 31.7 | Very low | 36.6 | Very low | 146 Ų | 146 | 140 Ų | 140 | 68% | 0.682 | 78% | 0.777 | S | S | * | * | | | trans | 27.5 | 121.5 | 147.5 | -100.4 | 67.2 | -175.8 | 0 | 0 | 121.3 | | |
| 296 | R | 38.3 | Very low | 36.7 | Very low | 221 Ų | 221 | 140.4 Ų | 140.4 | 83% | 0.834 | 78% | 0.783 | S | S | * | * | | | | -179.2 | 138.3 | 97.3 | -93.7 | -180 | -131.1 | -60.4 | 4 | 114.4 | | |
| 297 | R | 34.5 | Very low | 37 | Very low | 237 Ų | 237 | 140.6 Ų | 140.6 | 89% | 0.894 | 78% | 0.784 | S | S | * | * | | | trans | 31.5 | 141 | 148 | -59.9 | -173.2 | -178.3 | -117.2 | -1 | 122.5 | | |
| 298 | T | 36.1 | Very low | 36.9 | Very low | 134 Ų | 134 | 140.4 Ų | 140.4 | 82% | 0.822 | 79% | 0.785 | S | S | * | * | | | trans | -61.2 | 174.2 | 159.6 | 48.1 | 0 | 0 | 0 | 0 | 113.2 | | |
| 299 | P | 41.5 | Very low | 36.9 | Very low | 114 Ų | 114 | 139.5 Ų | 139.5 | 74% | 0.74 | 79% | 0.785 | S | S | * | * | | | cis | -130 | 179.9 | 6 | 42.8 | -27.7 | 0 | 0 | 0 | 115.5 | | |
| 300 | W | 30.1 | Very low | 37.2 | Very low | 250 Ų | 250 | 140.6 Ų | 140.6 | 95% | 0.947 | 79% | 0.786 | S | S | * | * | | | trans | -123.4 | 132 | 166.8 | -77.3 | 92.8 | 0 | 0 | 0 | 112.7 | | |
| 301 | K | 33.4 | Very low | 37.6 | Very low | 197 Ų | 197 | 141.2 Ų | 141.2 | 86% | 0.857 | 78% | 0.779 | S | S | * | * | | | trans | -142.9 | 160.6 | 160.3 | -103.8 | -167.8 | 174.1 | -174.4 | 0 | 108.4 | | |
| 302 | P | 53.9 | Low | 38.4 | Very low | 116 Ų | 116 | 146.3 Ų | 146.3 | 75% | 0.753 | 78% | 0.78 | S | S | * | * | | | trans | -98.8 | 164 | -148.6 | 37.5 | -38.5 | 0 | 0 | 0 | 115.7 | | |
| 303 | P | 49.4 | Very low | 38.5 | Very low | 112 Ų | 112 | 147.4 Ų | 147.4 | 73% | 0.727 | 78% | 0.775 | S | S | * | * | | | trans | -116.7 | 176.7 | 156 | 41.6 | -31.2 | 0 | 0 | 0 | 111.8 | | |
| 304 | P | 46.2 | Very low | 38.6 | Very low | 123 Ų | 123 | 151.4 Ų | 151.4 | 80% | 0.799 | 77% | 0.772 | S | S | * | * | | | | -132.2 | 177 | -50.9 | 38.7 | -24.1 | 0 | 0 | 0 | 112.9 | | |
| 305 | S | 42.1 | Very low | 38.3 | Very low | 107 Ų | 107 | 155 Ų | 155 | 75% | 0.748 | 77% | 0.772 | S | S | * | * | | | trans | -89.3 | 168 | 173.5 | -48 | 0 | 0 | 0 | 0 | 112.8 | | |
| 306 | D | 35.4 | Very low | 38.5 | Very low | 143 Ų | 143 | 154.7 Ų | 154.7 | 77% | 0.765 | 78% | 0.776 | S | S | * | * | | | trans | 166.1 | 149.5 | 135 | -99 | 8.1 | 0 | 0 | 0 | 111.3 | | |
| 307 | L | 41.4 | Very low | 38.3 | Very low | 137 Ų | 137 | 149.3 Ų | 149.3 | 72% | 0.717 | 77% | 0.771 | S | S | * | * | | | cis | -123.1 | -143.8 | -11.3 | -68.7 | 106.6 | 0 | 0 | 0 | 107.8 | | |
| 308 | Y | 31.7 | Very low | 38.5 | Very low | 206 Ų | 206 | 144.7 Ų | 144.7 | 81% | 0.808 | 77% | 0.769 | S | S | * | * | | | cis | -156.9 | 117 | -3.4 | -161.2 | -75.8 | 0 | 0 | 0 | 112.7 | | |
| 309 | G | 33.9 | Very low | 38.3 | Very low | 68 Ų | 68 | 142.7 Ų | 142.7 | 70% | 0.701 | 77% | 0.767 | S | S | * | * | | | trans | 65.8 | 162 | 154.3 | 0 | 0 | 0 | 0 | 0 | 120.5 | | |
| 310 | D | 36.3 | Very low | 38.3 | Very low | 148 Ų | 148 | 143.1 Ų | 143.1 | 79% | 0.791 | 77% | 0.772 | S | S | * | * | | | cis | -161.4 | 166.7 | -23.9 | -162.2 | 7.3 | 0 | 0 | 0 | 111.2 | | |
| 311 | L | 39.7 | Very low | 39.1 | Very low | 129 Ų | 129 | 136.3 Ų | 136.3 | 68% | 0.675 | 76% | 0.76 | S | S | * | * | | | trans | 86.7 | 124.2 | 146.6 | -127.6 | 67.9 | 0 | 0 | 0 | 121.1 | | |
| 312 | K | 43.3 | Very low | 39 | Very low | 185 Ų | 185 | 133.3 Ų | 133.3 | 80% | 0.804 | 76% | 0.759 | S | S | * | * | | | trans | 96.8 | 81 | 152.6 | -52.8 | -169.2 | -179.8 | 170 | 0 | 121.5 | | |
| 313 | S | 30.8 | Very low | 38.1 | Very low | 104 Ų | 104 | 133.2 Ų | 133.2 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | | | | 86.3 | 99 | 113.1 | -167.4 | 0 | 0 | 0 | 0 | 122.8 | | |
| 314 | R | 34 | Very low | 38.1 | Very low | 198 Ų | 198 | 133.1 Ų | 133.1 | 75% | 0.747 | 76% | 0.76 | S | S | * | * | | | | 68.6 | 110.2 | 128.5 | -71.1 | -170.6 | 168.2 | -149.9 | 2 | 122.9 | | |
| 315 | R | 40.2 | Very low | 37.3 | Very low | 180 Ų | 180 | 133.7 Ų | 133.7 | 68% | 0.679 | 76% | 0.762 | S | S | * | * | | | | 72.8 | 110.5 | 114.8 | -69 | -175.3 | -179.4 | 176.9 | -0.7 | 122.2 | | |
| 316 | N | 35.2 | Very low | 37.2 | Very low | 140 Ų | 140 | 139.3 Ų | 139.3 | 75% | 0.749 | 77% | 0.766 | S | S | * | * | | | | 81.2 | 150.5 | 118.1 | -61 | 12.4 | 0 | 0 | 0 | 121.8 | | |
| 317 | S | 35.7 | Very low | 37.2 | Very low | 107 Ų | 107 | 136.9 Ų | 136.9 | 75% | 0.748 | 76% | 0.761 | S | S | * | * | | | trans | 94.2 | 103.2 | 149 | -61.9 | 0 | 0 | 0 | 0 | 120.1 | | |
| 318 | V | 38.4 | Very low | 37.3 | Very low | 140 Ų | 140 | 137.4 Ų | 137.4 | 85% | 0.848 | 76% | 0.763 | S | S | * | * | | | trans | 10.3 | 156.6 | 132.4 | -61.8 | 0 | 0 | 0 | 0 | 122.3 | | |
| 319 | A | 31.1 | Very low | 38.2 | Very low | 93 Ų | 93 | 133.1 Ų | 133.1 | 77% | 0.769 | 76% | 0.761 | S | S | * | * | | | trans | 91.4 | 115.5 | 157 | 0 | 0 | 0 | 0 | 0 | 118.4 | | |
| 320 | S | 42.3 | Very low | 38.4 | Very low | 123 Ų | 123 | 140.2 Ų | 140.2 | 86% | 0.86 | 77% | 0.767 | S | S | * | * | | | trans | -78.4 | 143 | 153.9 | -45.2 | 0 | 0 | 0 | 0 | 109.8 | | |
| 321 | P | 46.3 | Very low | 38.5 | Very low | 107 Ų | 107 | 138.4 Ų | 138.4 | 70% | 0.695 | 77% | 0.766 | S | S | * | * | | | trans | -144.5 | 173.9 | 135.4 | 36.9 | -21.7 | 0 | 0 | 0 | 115.1 | | |
| 322 | T | 31.1 | Very low | 38.2 | Very low | 134 Ų | 134 | 136.8 Ų | 136.8 | 82% | 0.822 | 77% | 0.771 | S | S | * | * | | | trans | 63.9 | 102.2 | 154.6 | 42.4 | 0 | 0 | 0 | 0 | 121.1 | | |
| 323 | S | 35 | Very low | 37.9 | Very low | 114 Ų | 114 | 133 Ų | 133 | 80% | 0.797 | 77% | 0.768 | S | S | * | * | | | trans | -62.1 | 179.1 | 140.1 | -24.7 | 0 | 0 | 0 | 0 | 111.1 | | |
| 324 | P | 49.1 | Very low | 38.3 | Very low | 110 Ų | 110 | 132.9 Ų | 132.9 | 71% | 0.714 | 77% | 0.766 | S | S | * | * | | | cis | -149.7 | -160.5 | 30.4 | 44.5 | -22 | 0 | 0 | 0 | 117.2 | | |
| 325 | T | 30.8 | Very low | 38.5 | Very low | 135 Ų | 135 | 131.9 Ų | 131.9 | 83% | 0.828 | 77% | 0.768 | S | S | * | * | | | trans | 70.9 | 138.3 | 170.3 | 26.8 | 0 | 0 | 0 | 0 | 116.9 | | |
| 326 | R | 39.8 | Very low | 38.4 | Very low | 224 Ų | 224 | 131.3 Ų | 131.3 | 85% | 0.845 | 77% | 0.773 | S | S | * | * | | | cis | -152 | 140.3 | 34.1 | -157.8 | -167.8 | -178.1 | -140.6 | 3.8 | 114.8 | | |
| 327 | S | 35.9 | Very low | 38.7 | Very low | 93 Ų | 93 | 127.2 Ų | 127.2 | 65% | 0.65 | 76% | 0.763 | S | S | * | * | | | trans | 52.9 | 111.2 | 149.6 | 59.4 | 0 | 0 | 0 | 0 | 122.9 | | |
| 328 | L | 42.6 | Very low | 39.3 | Very low | 147 Ų | 147 | 134.4 Ų | 134.4 | 77% | 0.77 | 77% | 0.774 | S | S | * | * | | | trans | -78.3 | 172.7 | 144.6 | -64.1 | 169.8 | 0 | 0 | 0 | 111.3 | | |
| 329 | P | 50 | Low | 39.4 | Very low | 117 Ų | 117 | 133.3 Ų | 133.3 | 76% | 0.76 | 77% | 0.773 | S | S | * | * | | | | -115.9 | 121.7 | 111.7 | 32.3 | -31.9 | 0 | 0 | 0 | 111.6 | | |
| 330 | R | 38.4 | Very low | 40.1 | Very low | 217 Ų | 217 | 134.8 Ų | 134.8 | 82% | 0.819 | 77% | 0.772 | S | S | * | * | | | | 65.2 | 109.7 | 90.9 | -71.8 | -174.5 | 172.7 | 115.2 | -3.5 | 112.5 | | |
| 331 | S | 39.2 | Very low | 40.3 | Very low | 110 Ų | 110 | 134.9 Ų | 134.9 | 77% | 0.769 | 77% | 0.77 | S | S | * | * | | | cis | 84.3 | 116.1 | 23.8 | -39.3 | 0 | 0 | 0 | 0 | 116.4 | | |
| 332 | A | 34 | Very low | 40.3 | Very low | 95 Ų | 95 | 134.3 Ų | 134.3 | 79% | 0.785 | 77% | 0.774 | S | S | * | * | | | trans | -160.5 | 127.3 | 159.6 | 0 | 0 | 0 | 0 | 0 | 105.9 | | |
| 333 | S | 36.6 | Very low | 40.9 | Very low | 106 Ų | 106 | 133.7 Ų | 133.7 | 74% | 0.741 | 77% | 0.77 | S | S | * | * | | | cis | 64 | 125.1 | 9.8 | -141.5 | 0 | 0 | 0 | 0 | 113.9 | | |
| 334 | S | 38.9 | Very low | 41.8 | Very low | 100 Ų | 100 | 134.4 Ų | 134.4 | 70% | 0.699 | 77% | 0.772 | S | S | * | * | | | cis | -175.2 | -178.6 | -2.9 | 33.4 | 0 | 0 | 0 | 0 | 109.4 | | |
| 335 | F | 37.1 | Very low | 41.3 | Very low | 178 Ų | 178 | 135.2 Ų | 135.2 | 78% | 0.781 | 78% | 0.775 | S | S | * | * | | | trans | 78 | 95.8 | 147.9 | -157.3 | -79.5 | 0 | 0 | 0 | 117.8 | | |
| 336 | E | 39.8 | Very low | 41.9 | Very low | 168 Ų | 168 | 136.9 Ų | 136.9 | 79% | 0.785 | 78% | 0.778 | S | S | * | * | | | | -159.5 | 159.8 | 122.8 | -157.6 | 52.3 | -102.7 | 0 | 0 | 108.3 | | |
| 337 | G | 40.7 | Very low | 41.9 | Very low | 53 Ų | 53 | 133.1 Ų | 133.1 | 55% | 0.546 | 78% | 0.78 | S | S | . | * | | | trans | -96.8 | 154.4 | -171.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | | |
| 338 | R | 47.3 | Very low | 42.2 | Very low | 259 Ų | 259 | 140.6 Ų | 140.6 | 98% | 0.977 | 79% | 0.794 | S | S | * | * | | | trans | 73.2 | 156.9 | 179.9 | -43.6 | 169.6 | -174.9 | -144.7 | -2.4 | 111.3 | | |
| 339 | S | 42 | Very low | 41.9 | Very low | 117 Ų | 117 | 137.3 Ų | 137.3 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | | | cis | -151.4 | -168.8 | 17.7 | 59.4 | 0 | 0 | 0 | 0 | 112.5 | | |
| 340 | V | 45.8 | Very low | 41.1 | Very low | 124 Ų | 124 | 136.8 Ų | 136.8 | 75% | 0.752 | 80% | 0.8 | S | S | * | * | | | trans | -62.1 | 140.4 | -177 | -179.3 | 0 | 0 | 0 | 0 | 112.8 | A342 | V340-A342 PolarHBondContact O-N 2.98Š|
| 341 | P | 47 | Very low | 41.1 | Very low | 124 Ų | 124 | 129.8 Ų | 129.8 | 81% | 0.805 | 80% | 0.796 | S | S | * | * | | | trans | -67.8 | 111.1 | 168.7 | 28.7 | -34.1 | 0 | 0 | 0 | 110.9 | | |
| 342 | A | 44.7 | Very low | 41.5 | Very low | 95 Ų | 95 | 130 Ų | 130 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 157.5 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | V340 | V340-A342 PolarHBondContact O-N 2.98Š|
| 343 | T | 43.2 | Very low | 41.6 | Very low | 122 Ų | 122 | 133.6 Ų | 133.6 | 75% | 0.748 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -71 | 142.7 | 175.7 | 42.8 | 0 | 0 | 0 | 0 | 112.2 | V345 | T343-V345 PolarHBondContact O-N 2.91Š|
| 344 | P | 54.1 | Low | 41.3 | Very low | 128 Ų | 128 | 135.5 Ų | 135.5 | 83% | 0.831 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 118.8 | 174.4 | 29 | -33.1 | 0 | 0 | 0 | 110.8 | | |
| 345 | V | 40.4 | Very low | 40.9 | Very low | 127 Ų | 127 | 136.5 Ų | 136.5 | 77% | 0.77 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -87.8 | 128.9 | 174.2 | 177 | 0 | 0 | 0 | 0 | 109.7 | T343 | T343-V345 PolarHBondContact O-N 2.91Š|
| 346 | L | 42.9 | Very low | 40.9 | Very low | 171 Ų | 171 | 137.5 Ų | 137.5 | 90% | 0.895 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 120.8 | 176.5 | -66.8 | 173 | 0 | 0 | 0 | 111 | | |
| 347 | T | 39.8 | Very low | 41.3 | Very low | 144 Ų | 144 | 134.8 Ų | 134.8 | 88% | 0.883 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -79 | 137.4 | 176.8 | -42.3 | 0 | 0 | 0 | 0 | 111.5 | | |
| 348 | R | 42.2 | Very low | 40.8 | Very low | 251 Ų | 251 | 141.3 Ų | 141.3 | 95% | 0.947 | 82% | 0.819 | S | S | * | * | | | trans | -108.3 | 121 | 179.2 | -174 | -176.5 | -170.7 | 175.7 | 3.5 | 109.6 | | |
| 349 | G | 35.2 | Very low | 40.1 | Very low | 78 Ų | 78 | 132.2 Ų | 132.2 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | | | trans | -154.6 | 149.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 350 | A | 34.4 | Very low | 39.8 | Very low | 105 Ų | 105 | 134 Ų | 134 | 87% | 0.868 | 81% | 0.806 | S | S | * | * | | | trans | -104.2 | 166.4 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112 | | |
| 351 | G | 37.9 | Very low | 39.3 | Very low | 71 Ų | 71 | 136.6 Ų | 136.6 | 73% | 0.732 | 81% | 0.81 | S | S | * | * | | | trans | -75.9 | -154.6 | 169.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 352 | P | 47.3 | Very low | 38.7 | Very low | 115 Ų | 115 | 136.4 Ų | 136.4 | 75% | 0.747 | 81% | 0.811 | S | S | * | * | | | cis | -137.9 | 171.6 | 23.7 | 35.2 | -14.6 | 0 | 0 | 0 | 116.1 | | |
| 353 | Q | 35.5 | Very low | 38.2 | Very low | 170 Ų | 170 | 142.8 Ų | 142.8 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | | | | 164.8 | 156.3 | 117.7 | -94 | -64.1 | 9.2 | 0 | 0 | 115.9 | | |
| 354 | L | 31.7 | Very low | 37.9 | Very low | 146 Ų | 146 | 142.7 Ų | 142.7 | 76% | 0.764 | 81% | 0.806 | S | S | * | * | | | trans | 55.7 | 98.2 | 148.6 | -154.7 | 70.6 | 0 | 0 | 0 | 120.8 | | |
| 355 | C | 30.5 | Very low | 36.8 | Very low | 120 Ų | 120 | 147.9 Ų | 147.9 | 81% | 0.811 | 81% | 0.809 | S | S | * | * | | | | -177.8 | 134.5 | 112.4 | -101.6 | 0 | 0 | 0 | 0 | 112.9 | | |
| 356 | K | 36.6 | Very low | 36.5 | Very low | 200 Ų | 200 | 147.2 Ų | 147.2 | 87% | 0.87 | 81% | 0.81 | S | S | * | * | | | trans | -147 | 145.2 | 163.6 | -90.2 | -164.7 | 173.7 | -170.5 | 0 | 107.6 | | |
| 357 | P | 47.5 | Very low | 36.2 | Very low | 111 Ų | 111 | 143 Ų | 143 | 72% | 0.721 | 81% | 0.808 | S | S | * | * | | | | -138.6 | 178.8 | 100.9 | 15.7 | 7.6 | 0 | 0 | 0 | 112.3 | | |
| 358 | E | 30.1 | Very low | 35.7 | Very low | 189 Ų | 189 | 141.7 Ų | 141.7 | 88% | 0.883 | 81% | 0.805 | S | S | * | * | | | cis | -164.9 | 166.1 | -28 | -105.2 | 162.7 | 164.1 | 0 | 0 | 109.1 | | |
| 359 | G | 32.5 | Very low | 35.5 | Very low | 69 Ų | 69 | 137.9 Ų | 137.9 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | | | trans | 84.9 | 143.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 360 | L | 35.7 | Very low | 35.5 | Very low | 155 Ų | 155 | 142 Ų | 142 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | | | cis | -137.2 | 144.8 | -4.7 | -75 | 172.3 | 0 | 0 | 0 | 111.4 | | |
| 361 | H | 35.4 | Very low | 35.7 | Very low | 178 Ų | 178 | 141.4 Ų | 141.4 | 82% | 0.824 | 79% | 0.791 | S | S | * | * | | | trans | 26 | 131.3 | 161.9 | -57.1 | -66.8 | 0 | 0 | 0 | 123.5 | | |
| 362 | S | 35.8 | Very low | 35.6 | Very low | 120 Ų | 120 | 147.7 Ų | 147.7 | 84% | 0.839 | 80% | 0.801 | S | S | * | * | | | trans | -96.8 | 142.5 | 169.8 | -40.3 | 0 | 0 | 0 | 0 | 112.9 | | |
| 363 | R | 34.6 | Very low | 35 | Very low | 229 Ų | 229 | 150.7 Ų | 150.7 | 86% | 0.864 | 81% | 0.807 | S | S | * | * | | | trans | 178.3 | 167.8 | 140.5 | -96.6 | -165.5 | -155.9 | -90.7 | 4.9 | 108.4 | | |
| 364 | Q | 35.3 | Very low | 34.7 | Very low | 120 Ų | 120 | 146 Ų | 146 | 56% | 0.561 | 81% | 0.805 | S | S | * | * | | | cis | 179.6 | 109.6 | -40.4 | 170.1 | -169.9 | -12.6 | 0 | 0 | 106.6 | | |
| 365 | W | 31.9 | Very low | 34.8 | Very low | 236 Ų | 236 | 148.5 Ų | 148.5 | 89% | 0.894 | 81% | 0.81 | S | S | * | * | | | trans | 63.5 | 144.3 | 168.1 | -58.9 | 32.1 | 0 | 0 | 0 | 113.3 | | |
| 366 | S | 33 | Very low | 35.4 | Very low | 113 Ų | 113 | 148.5 Ų | 148.5 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | | | cis | -150.7 | 171.1 | 39.2 | -63.2 | 0 | 0 | 0 | 0 | 111.2 | | |
| 367 | G | 37.4 | Very low | 35.1 | Very low | 82 Ų | 82 | 150.5 Ų | 150.5 | 85% | 0.845 | 81% | 0.811 | S | S | * | * | | | trans | -81.9 | 141.9 | 166.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 368 | S | 29.4 | Very low | 34.5 | Very low | 118 Ų | 118 | 148.8 Ų | 148.8 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | | | trans | -126.2 | 146.1 | 151.4 | -168.8 | 0 | 0 | 0 | 0 | 108.2 | | |
| 369 | Q | 38.8 | Very low | 34.6 | Very low | 171 Ų | 171 | 147.1 Ų | 147.1 | 80% | 0.799 | 80% | 0.803 | S | S | * | * | | | trans | -74.5 | 151.1 | 160.4 | -66.8 | 170.9 | -9.5 | 0 | 0 | 108.1 | | |
| 370 | D | 34.8 | Very low | 35.1 | Very low | 165 Ų | 165 | 149.2 Ų | 149.2 | 88% | 0.882 | 80% | 0.804 | S | S | * | * | | | trans | -148.1 | 154.2 | 135.8 | -130.3 | -36.7 | 0 | 0 | 0 | 110.1 | | |
| 371 | S | 38.5 | Very low | 35.3 | Very low | 92 Ų | 92 | 146.9 Ų | 146.9 | 64% | 0.643 | 81% | 0.808 | S | S | * | * | | | trans | -125.6 | 126.3 | -163.4 | -63.2 | 0 | 0 | 0 | 0 | 113.5 | | |
| 372 | Q | 35.9 | Very low | 35.4 | Very low | 203 Ų | 203 | 143.6 Ų | 143.6 | 95% | 0.949 | 81% | 0.805 | S | S | * | * | | | trans | -137.9 | 108.1 | 152 | -68.9 | -162.7 | 8.2 | 0 | 0 | 110.7 | | |
| 373 | M | 33.3 | Very low | 35.6 | Very low | 177 Ų | 177 | 145.1 Ų | 145.1 | 87% | 0.872 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -96.7 | 122.6 | 169.4 | -77.5 | -76.7 | -77.4 | 0 | 0 | 109 | | |
| 374 | G | 31 | Very low | 35.6 | Very low | 73 Ų | 73 | 145.9 Ų | 145.9 | 75% | 0.753 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 140.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | | |
| 375 | F | 33.6 | Very low | 35.6 | Very low | 197 Ų | 197 | 144.3 Ų | 144.3 | 86% | 0.864 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 157 | 173.4 | -61.3 | -94.7 | 0 | 0 | 0 | 111.5 | | |
| 376 | P | 42.1 | Very low | 35.7 | Very low | 120 Ų | 120 | 138.9 Ų | 138.9 | 78% | 0.779 | 81% | 0.812 | S | S | * | * | | | | -121.9 | 143 | 87.2 | 4.1 | 17 | 0 | 0 | 0 | 111.6 | | |
| 377 | R | 31 | Very low | 36.2 | Very low | 242 Ų | 242 | 140.9 Ų | 140.9 | 91% | 0.913 | 81% | 0.813 | S | S | * | * | | | | 79.4 | 130.1 | 60.3 | -158.9 | -178.9 | -166.4 | -150.9 | 2.8 | 112.3 | | |
| 378 | A | 33.9 | Very low | 36.1 | Very low | 76 Ų | 76 | 147.2 Ų | 147.2 | 63% | 0.628 | 82% | 0.818 | S | S | * | * | | | trans | -101.4 | 160.5 | -167.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 379 | D | 31.8 | Very low | 36.4 | Very low | 153 Ų | 153 | 147.9 Ų | 147.9 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | | | trans | 63.7 | 159 | 155.3 | -58.2 | -33.5 | 0 | 0 | 0 | 120.5 | | |
| 380 | P | 44.9 | Very low | 36.2 | Very low | 113 Ų | 113 | 143.9 Ų | 143.9 | 73% | 0.734 | 81% | 0.813 | S | S | * | * | | | cis | -114.9 | 169.8 | -7.3 | 39.8 | -29.1 | 0 | 0 | 0 | 113.8 | | |
| 381 | A | 39.9 | Very low | 36.3 | Very low | 107 Ų | 107 | 146.9 Ų | 146.9 | 88% | 0.884 | 81% | 0.812 | S | S | * | * | | | trans | -86 | 118.6 | 161.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | | |
| 382 | S | 35.8 | Very low | 36.5 | Very low | 109 Ų | 109 | 148.9 Ų | 148.9 | 76% | 0.762 | 82% | 0.82 | S | S | * | * | | | trans | -153.7 | 156.4 | 167 | -168.9 | 0 | 0 | 0 | 0 | 110.6 | | |
| 383 | D | 41.6 | Very low | 36.9 | Very low | 152 Ų | 152 | 150.3 Ų | 150.3 | 81% | 0.813 | 82% | 0.817 | S | S | * | * | | | trans | -37.6 | 129 | -163.3 | -67.7 | -53.8 | 0 | 0 | 0 | 118.7 | | |
| 384 | R | 33.7 | Very low | 37 | Very low | 244 Ų | 244 | 153.5 Ų | 153.5 | 92% | 0.921 | 82% | 0.819 | S | S | * | * | | | | -150.1 | 130 | 123.5 | -126.9 | 174.8 | -175 | 175.6 | 3 | 113.8 | | |
| 385 | A | 36.1 | Very low | 37.1 | Very low | 87 Ų | 87 | 155.6 Ų | 155.6 | 72% | 0.719 | 82% | 0.822 | S | S | * | * | | | trans | -64.5 | 137.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | L387 | A385-L387 PolarHBondContact O-N 3.49Š|
| 386 | S | 34.1 | Very low | 37.5 | Very low | 123 Ų | 123 | 153.7 Ų | 153.7 | 86% | 0.86 | 82% | 0.821 | S | S | * | * | | | trans | -71.5 | 92.2 | -180 | -60.8 | 0 | 0 | 0 | 0 | 112.6 | | |
| 387 | L | 43.2 | Very low | 37.2 | Very low | 154 Ų | 154 | 153 Ų | 153 | 81% | 0.806 | 82% | 0.819 | S | S | * | * | | | trans | -121.7 | 87.6 | 169.5 | -71.1 | 178.5 | 0 | 0 | 0 | 111.2 | A385 | A385-L387 PolarHBondContact O-N 3.49Š|
| 388 | F | 35.1 | Very low | 37.9 | Very low | 215 Ų | 215 | 147.1 Ų | 147.1 | 94% | 0.943 | 82% | 0.815 | S | S | * | * | | | trans | -118.6 | 125.6 | 166.2 | -89.9 | -78.6 | 0 | 0 | 0 | 111.8 | | |
| 389 | V | 35.3 | Very low | 38.2 | Very low | 133 Ų | 133 | 152.6 Ų | 152.6 | 81% | 0.806 | 83% | 0.828 | S | S | * | * | | | trans | -77.1 | 124.7 | -170.8 | 176.1 | 0 | 0 | 0 | 0 | 111.1 | R391 | V389-R391 PolarHBondContact O-N 3.42Å; V389-R391 VanDerWaalsContact O-N 3.08Å |
| 390 | A | 34.3 | Very low | 38.5 | Very low | 87 Ų | 87 | 149.3 Ų | 149.3 | 72% | 0.719 | 82% | 0.822 | S | S | * | * | | | trans | -63.4 | 107.4 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | T392 | A390-T392 PolarHBondContact O-N 3.2Š|
| 391 | R | 37.9 | Very low | 38.2 | Very low | 228 Ų | 228 | 151.7 Ų | 151.7 | 86% | 0.86 | 83% | 0.827 | S | S | * | * | | | trans | -88.8 | 79.2 | -174.1 | -166.8 | 178.8 | -169 | 132.4 | 1.8 | 112 | V389 | V389-R391 PolarHBondContact O-N 3.42Å; V389-R391 VanDerWaalsContact O-N 3.08Å |
| 392 | T | 41.9 | Very low | 37.9 | Very low | 133 Ų | 133 | 154.2 Ų | 154.2 | 82% | 0.816 | 83% | 0.825 | S | S | * | * | | | trans | -64.6 | 134.5 | 175.6 | 52.5 | 0 | 0 | 0 | 0 | 111.7 | A390 | A390-T392 PolarHBondContact O-N 3.2Š|
| 393 | R | 43.5 | Very low | 37.8 | Very low | 234 Ų | 234 | 155.2 Ų | 155.2 | 88% | 0.883 | 83% | 0.826 | S | S | * | * | | | trans | -113.2 | 144.4 | 169.1 | -91 | -173.9 | 169.1 | -91.1 | 5.8 | 109.4 | | |
| 394 | R | 35.3 | Very low | 37.6 | Very low | 243 Ų | 243 | 154.6 Ų | 154.6 | 92% | 0.917 | 82% | 0.823 | S | S | * | * | | | trans | -94 | 141.3 | -174.9 | -55.8 | 171.4 | 73.7 | -141 | 6.5 | 112 | | |
| 395 | S | 33.3 | Very low | 37.5 | Very low | 118 Ų | 118 | 153.7 Ų | 153.7 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | | | trans | -160.1 | 120 | 142.8 | -80 | 0 | 0 | 0 | 0 | 105.6 | | |
| 396 | N | 42.5 | Very low | 37.4 | Very low | 157 Ų | 157 | 153.5 Ų | 153.5 | 84% | 0.84 | 82% | 0.818 | S | S | * | * | | | | 91.4 | 142.1 | 50.9 | -167.3 | 31.5 | 0 | 0 | 0 | 112 | | |
| 397 | S | 36.4 | Very low | 37.4 | Very low | 104 Ų | 104 | 152.9 Ų | 152.9 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | | | trans | 72 | 139.7 | -155.3 | 87.2 | 0 | 0 | 0 | 0 | 113.8 | | |
| 398 | S | 44.4 | Very low | 36.8 | Very low | 119 Ų | 119 | 149.5 Ų | 149.5 | 83% | 0.832 | 82% | 0.823 | S | S | * | * | | | cis | -136.6 | 164 | 0.8 | -66.4 | 0 | 0 | 0 | 0 | 112 | | |
| 399 | E | 41.8 | Very low | 36.6 | Very low | 191 Ų | 191 | 143.5 Ų | 143.5 | 89% | 0.893 | 82% | 0.821 | S | S | * | * | | | trans | -124.6 | 161.5 | 177.1 | -170.8 | -174.6 | 156.6 | 0 | 0 | 110.8 | | |
| 400 | A | 38.1 | Very low | 36.4 | Very low | 84 Ų | 84 | 141.1 Ų | 141.1 | 69% | 0.694 | 82% | 0.824 | S | S | * | * | | | trans | 84.7 | 155.5 | 164.2 | 0 | 0 | 0 | 0 | 0 | 119.1 | | |
| 401 | L | 37.5 | Very low | 36.5 | Very low | 163 Ų | 163 | 142.4 Ų | 142.4 | 85% | 0.853 | 84% | 0.835 | S | S | * | * | | | trans | 70.2 | 116.1 | -167.2 | -49.1 | -174.7 | 0 | 0 | 0 | 113 | | |
| 402 | L | 34 | Very low | 36.2 | Very low | 160 Ų | 160 | 135.3 Ų | 135.3 | 84% | 0.838 | 83% | 0.833 | S | S | * | * | | | cis | -138.5 | 166.1 | 6.3 | -72.2 | 168.2 | 0 | 0 | 0 | 111.6 | | |
| 403 | V | 34.6 | Very low | 35.7 | Very low | 130 Ų | 130 | 134.7 Ų | 134.7 | 79% | 0.788 | 83% | 0.834 | S | S | * | * | | | trans | -126.9 | 139 | 172.4 | 172 | 0 | 0 | 0 | 0 | 109.5 | | |
| 404 | D | 37.2 | Very low | 36.1 | Very low | 139 Ų | 139 | 129 Ų | 129 | 74% | 0.743 | 83% | 0.827 | S | S | * | * | | | trans | 60.6 | 151.8 | 176.5 | -87.1 | -35.9 | 0 | 0 | 0 | 116.3 | | |
| 405 | R | 31.7 | Very low | 36.5 | Very low | 225 Ų | 225 | 123.4 Ų | 123.4 | 85% | 0.849 | 82% | 0.822 | S | S | * | * | | | cis | -148.5 | 159.7 | 24.9 | -168.1 | 169.1 | 172.9 | 75.8 | -0 | 112.5 | | |
| 406 | A | 34.3 | Very low | 36.5 | Very low | 84 Ų | 84 | 123.9 Ų | 123.9 | 69% | 0.694 | 82% | 0.82 | S | S | * | * | | | trans | -89.6 | 170.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | | |
| 407 | A | 33.8 | Very low | 36.7 | Very low | 110 Ų | 110 | 122.4 Ų | 122.4 | 91% | 0.909 | 82% | 0.819 | S | S | * | * | | | trans | 79.3 | 148.6 | 165.2 | 0 | 0 | 0 | 0 | 0 | 119 | | |
| 408 | G | 30.8 | Very low | 36.5 | Very low | 83 Ų | 83 | 125.6 Ų | 125.6 | 86% | 0.856 | 83% | 0.827 | S | S | * | * | | | trans | 110.7 | 110.8 | 172.3 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 409 | G | 31 | Very low | 35.9 | Very low | 88 Ų | 88 | 124.3 Ų | 124.3 | 91% | 0.907 | 82% | 0.824 | S | S | * | * | | | trans | -98.6 | 163.8 | 162.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 410 | G | 30.7 | Very low | 36.4 | Very low | 83 Ų | 83 | 120.3 Ų | 120.3 | 86% | 0.856 | 81% | 0.814 | S | S | * | * | | | trans | 150.3 | 124.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | | |
| 411 | A | 35.9 | Very low | 36 | Very low | 115 Ų | 115 | 121.8 Ų | 121.8 | 95% | 0.95 | 82% | 0.82 | S | S | * | * | | | trans | -85 | 139.8 | 170.5 | 0 | 0 | 0 | 0 | 0 | 110 | | |
| 412 | G | 31.7 | Very low | 35.7 | Very low | 79 Ų | 79 | 118 Ų | 118 | 81% | 0.814 | 81% | 0.812 | S | S | * | * | | | trans | 173.9 | 92.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | | |
| 413 | S | 32.3 | Very low | 35.7 | Very low | 120 Ų | 120 | 116.3 Ų | 116.3 | 84% | 0.839 | 81% | 0.813 | S | S | * | * | | | trans | -91.7 | 156 | 143.9 | -62 | 0 | 0 | 0 | 0 | 107.1 | | |
| 414 | P | 51.8 | Low | 35.6 | Very low | 113 Ų | 113 | 113.7 Ų | 113.7 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | | | cis | -135.7 | -159.8 | 34.4 | 37.8 | -15.1 | 0 | 0 | 0 | 113.3 | | |
| 415 | P | 42.6 | Very low | 36.2 | Very low | 127 Ų | 127 | 113 Ų | 113 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | | | | -143.7 | 173.5 | 88.4 | 39 | -22.9 | 0 | 0 | 0 | 115.8 | | |
| 416 | T | 34.6 | Very low | 37.2 | Very low | 127 Ų | 127 | 107.5 Ų | 107.5 | 78% | 0.779 | 81% | 0.809 | S | S | * | * | | | trans | -120.4 | 145.1 | -178.7 | -49.3 | 0 | 0 | 0 | 0 | 110.1 | | |
| 417 | P | 44.8 | Very low | 37.1 | Very low | 127 Ų | 127 | 110 Ų | 110 | 83% | 0.825 | 82% | 0.815 | S | S | * | * | | | trans | -84.2 | 174.1 | -170.3 | 33.3 | -37.7 | 0 | 0 | 0 | 115.9 | | |
| 418 | L | 32.2 | Very low | 36.8 | Very low | 171 Ų | 171 | 109.8 Ų | 109.8 | 90% | 0.895 | 81% | 0.806 | S | S | * | * | | | trans | -108.4 | 119.8 | -170.8 | -79.9 | 165.8 | 0 | 0 | 0 | 115.1 | | |
| 419 | A | 32.9 | Very low | 36.9 | Very low | 91 Ų | 91 | 114.6 Ų | 114.6 | 75% | 0.752 | 80% | 0.803 | S | S | * | * | | | trans | 63.1 | 175.2 | 139.3 | 0 | 0 | 0 | 0 | 0 | 119.2 | | |
| 420 | P | 52 | Low | 37 | Very low | 107 Ų | 107 | 115.4 Ų | 115.4 | 70% | 0.695 | 80% | 0.795 | S | S | * | * | | | cis | -135.9 | 167.6 | -4 | 41.3 | -25 | 0 | 0 | 0 | 117.7 | | |
| 421 | S | 30 | Very low | 37.3 | Very low | 116 Ų | 116 | 116.4 Ų | 116.4 | 81% | 0.811 | 79% | 0.789 | S | S | * | * | | | trans | 64.9 | 149.9 | 150.8 | 69 | 0 | 0 | 0 | 0 | 119.7 | | |
| 422 | A | 31.5 | Very low | 37 | Very low | 84 Ų | 84 | 119.4 Ų | 119.4 | 69% | 0.694 | 78% | 0.783 | S | S | * | * | | | cis | -156.8 | 172.4 | 18.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | | |
| 423 | S | 33.9 | Very low | 37.2 | Very low | 124 Ų | 124 | 121.6 Ų | 121.6 | 87% | 0.867 | 78% | 0.781 | S | S | * | * | | | trans | 55.9 | 130.2 | 153 | 63.1 | 0 | 0 | 0 | 0 | 123.5 | | |
| 424 | G | 32.2 | Very low | 37.1 | Very low | 74 Ų | 74 | 122 Ų | 122 | 76% | 0.763 | 77% | 0.773 | S | S | * | * | | | trans | 125.1 | 114.1 | 141.5 | 0 | 0 | 0 | 0 | 0 | 119 | | |
| 425 | P | 50.8 | Low | 36.2 | Very low | 125 Ų | 125 | 125.2 Ų | 125.2 | 81% | 0.812 | 77% | 0.772 | S | S | * | * | | | trans | -93.6 | -176.1 | 167.1 | 41.6 | -36.5 | 0 | 0 | 0 | 111.3 | | |
| 426 | P | 51.7 | Low | 35.5 | Very low | 110 Ų | 110 | 126.5 Ų | 126.5 | 71% | 0.714 | 77% | 0.767 | S | S | * | * | | | cis | -146.9 | 176.8 | 17.5 | 45.8 | -26.3 | 0 | 0 | 0 | 119.4 | | |
| 427 | V | 32.6 | Very low | 35.5 | Very low | 136 Ų | 136 | 131 Ų | 131 | 82% | 0.824 | 77% | 0.769 | S | S | * | * | | | trans | 53.4 | 134.5 | 138.5 | 164.7 | 0 | 0 | 0 | 0 | 119.4 | | |
| 428 | C | 27 | Very low | 35.4 | Very low | 106 Ų | 106 | 130.2 Ų | 130.2 | 72% | 0.716 | 76% | 0.764 | S | S | * | * | | | cis | -155.5 | 169.7 | 6.1 | -131.1 | 0 | 0 | 0 | 0 | 107.8 | | |
| 429 | K | 32 | Very low | 35.3 | Very low | 183 Ų | 183 | 130 Ų | 130 | 80% | 0.796 | 76% | 0.758 | S | S | * | * | | | cis | -175.3 | 161.4 | 49.6 | -130 | 165.4 | -171.6 | 178.8 | 0 | 109.5 | | |
| 430 | S | 33.2 | Very low | 36.5 | Very low | 106 Ų | 106 | 130.6 Ų | 130.6 | 74% | 0.741 | 76% | 0.755 | S | S | * | * | | | trans | 11.5 | 143.9 | 153.9 | 57.2 | 0 | 0 | 0 | 0 | 121.4 | | |
| 431 | S | 36.8 | Very low | 35.3 | Very low | 103 Ų | 103 | 132.7 Ų | 132.7 | 72% | 0.72 | 77% | 0.766 | S | S | * | * | | | cis | -157.2 | 162.2 | 27.5 | 54.6 | 0 | 0 | 0 | 0 | 115.1 | | |
| 432 | E | 31.1 | Very low | 35.2 | Very low | 178 Ų | 178 | 132.5 Ų | 132.5 | 83% | 0.832 | 76% | 0.764 | S | S | * | * | | | trans | 6.9 | 147.2 | 137.6 | -47 | 175.1 | 143.2 | 0 | 0 | 118.7 | | |
| 433 | V | 35.2 | Very low | 35.2 | Very low | 125 Ų | 125 | 132.7 Ų | 132.7 | 76% | 0.758 | 77% | 0.766 | S | S | * | * | | | cis | -149.3 | 146.5 | 43.7 | 173.4 | 0 | 0 | 0 | 0 | 113.9 | | |
| 434 | L | 30.4 | Very low | 34.9 | Very low | 130 Ų | 130 | 136.2 Ų | 136.2 | 68% | 0.681 | 77% | 0.766 | S | S | * | * | | | trans | -11.4 | 161.6 | 149.6 | -52 | 172.9 | 0 | 0 | 0 | 119.8 | | |
| 435 | Y | 32.2 | Very low | 34.8 | Very low | 179 Ų | 179 | 137.1 Ų | 137.1 | 70% | 0.702 | 76% | 0.761 | S | S | * | * | | | cis | -156.6 | 149.5 | 6.5 | -126.9 | -41.4 | 0 | 0 | 0 | 112.9 | | |
| 436 | E | 28.7 | Very low | 34.1 | Very low | 154 Ų | 154 | 135.6 Ų | 135.6 | 72% | 0.72 | 75% | 0.753 | S | S | * | * | | | trans | 49.7 | 144.7 | 140.6 | -98.6 | 175.8 | 172 | 0 | 0 | 126.8 | | |
| 437 | R | 34.6 | Very low | 33.4 | Very low | 222 Ų | 222 | 141.2 Ų | 141.2 | 84% | 0.838 | 76% | 0.76 | S | S | * | * | | | trans | -128.3 | 137.5 | 155.4 | 156.7 | -170.2 | -67.5 | 137.5 | 2.3 | 106.7 | | |
| 438 | P | 42.3 | Very low | 33.5 | Very low | 110 Ų | 110 | 141 Ų | 141 | 71% | 0.714 | 76% | 0.759 | S | S | * | * | | | trans | -133.2 | 162.5 | 137.1 | 10.5 | 11.9 | 0 | 0 | 0 | 115.3 | | |
| 439 | Q | 31.1 | Very low | 33.9 | Very low | 166 Ų | 166 | 141.1 Ų | 141.1 | 78% | 0.776 | 77% | 0.767 | S | S | * | * | | | trans | -98.1 | -164.1 | 162.4 | -71.9 | -91.8 | 6.6 | 0 | 0 | 108 | | |
| 440 | P | 56.8 | Low | 34 | Very low | 104 Ų | 104 | 135.9 Ų | 135.9 | 68% | 0.675 | 77% | 0.765 | S | S | * | * | | | | -119.6 | -179.3 | -69.4 | 37.3 | -24.2 | 0 | 0 | 0 | 111.5 | | |
| 441 | T | 27.6 | Very low | 35.3 | Very low | 151 Ų | 151 | 136.4 Ų | 136.4 | 93% | 0.926 | 77% | 0.766 | S | S | * | * | | | trans | -162.2 | 177.4 | 157.8 | 1.2 | 0 | 0 | 0 | 0 | 113.4 | | |
| 442 | S | 28.3 | Very low | 36.1 | Very low | 112 Ų | 112 | 137.2 Ų | 137.2 | 78% | 0.783 | 77% | 0.769 | S | S | * | * | | | trans | -134 | 173.5 | -166 | 58.7 | 0 | 0 | 0 | 0 | 114.2 | | |
| 443 | A | 30.5 | Very low | 36.5 | Very low | 88 Ų | 88 | 135.8 Ų | 135.8 | 73% | 0.727 | 77% | 0.767 | S | S | * | * | | | trans | 99.1 | 108 | 148.2 | 0 | 0 | 0 | 0 | 0 | 122 | | |
| 444 | F | 27.1 | Very low | 37.9 | Very low | 198 Ų | 198 | 135.5 Ų | 135.5 | 87% | 0.868 | 77% | 0.768 | S | S | * | * | | | | 74.9 | 137 | 118.1 | -124.7 | -105.3 | 0 | 0 | 0 | 124.3 | | |
| 445 | S | 31.8 | Very low | 39.4 | Very low | 94 Ų | 94 | 134.8 Ų | 134.8 | 66% | 0.657 | 77% | 0.771 | S | S | * | * | | | trans | 69.9 | 154.6 | 157.2 | -91.1 | 0 | 0 | 0 | 0 | 120.2 | | |
| 446 | S | 35.4 | Very low | 39.5 | Very low | 92 Ų | 92 | 137.1 Ų | 137.1 | 64% | 0.643 | 78% | 0.779 | S | S | * | * | | | cis | -169.7 | 137.3 | -17.3 | -108 | 0 | 0 | 0 | 0 | 114.1 | | |
| 447 | R | 37.5 | Very low | 39.7 | Very low | 229 Ų | 229 | 134.3 Ų | 134.3 | 86% | 0.864 | 78% | 0.782 | S | S | * | * | | | trans | 59.2 | 171.7 | 156.4 | -49.4 | -177.6 | 170 | -151.9 | -3.4 | 117.6 | | |
| 448 | T | 35.1 | Very low | 39.6 | Very low | 132 Ų | 132 | 128.5 Ų | 128.5 | 81% | 0.81 | 78% | 0.781 | S | S | * | * | | | cis | -153.9 | 140.4 | 6.6 | -33.4 | 0 | 0 | 0 | 0 | 112.4 | | |
| 449 | A | 34.6 | Very low | 39.3 | Very low | 107 Ų | 107 | 134.2 Ų | 134.2 | 88% | 0.884 | 79% | 0.788 | S | S | * | * | | | trans | -173.5 | 165.5 | 152.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 450 | G | 33.7 | Very low | 40.2 | Very low | 73 Ų | 73 | 132.1 Ų | 132.1 | 75% | 0.753 | 79% | 0.789 | S | S | * | * | | | trans | -131.8 | -178.9 | -166 | 0 | 0 | 0 | 0 | 0 | 118.7 | | |
| 451 | P | 59.8 | Low | 39.1 | Very low | 117 Ų | 117 | 131.7 Ų | 131.7 | 76% | 0.76 | 79% | 0.789 | S | S | * | * | | | trans | -114.1 | -172.2 | -157.8 | 45.2 | -36.1 | 0 | 0 | 0 | 114.9 | | |
| 452 | P | 54.6 | Low | 39.7 | Very low | 121 Ų | 121 | 130.2 Ų | 130.2 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | | | | -150.6 | 162.2 | 88.1 | 40.2 | -22.1 | 0 | 0 | 0 | 118.4 | | |
| 453 | D | 39 | Very low | 39.9 | Very low | 147 Ų | 147 | 130.1 Ų | 130.1 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | | | trans | -93.5 | -161.8 | 164.1 | -54 | -73.4 | 0 | 0 | 0 | 110.8 | | |
| 454 | P | 65.8 | Low | 40.1 | Very low | 120 Ų | 120 | 130.3 Ų | 130.3 | 78% | 0.779 | 79% | 0.792 | S | S | * | * | | | cis | -133.8 | -145.6 | -6.6 | 39.3 | -15.1 | 0 | 0 | 0 | 111.1 | | |
| 455 | P | 61 | Low | 41.1 | Very low | 114 Ų | 114 | 127.5 Ų | 127.5 | 74% | 0.74 | 79% | 0.794 | S | S | * | * | | | cis | -134.2 | -164.2 | -10.4 | 47.2 | -28.5 | 0 | 0 | 0 | 113.9 | | |
| 456 | R | 34.8 | Very low | 41.3 | Very low | 229 Ų | 229 | 127.2 Ų | 127.2 | 86% | 0.864 | 80% | 0.797 | S | S | * | * | | | cis | -161.7 | 146.2 | 3.1 | -145.4 | 172.4 | -167 | 168.1 | 5 | 112.5 | | |
| 457 | A | 33.6 | Very low | 41.5 | Very low | 95 Ų | 95 | 128.1 Ų | 128.1 | 79% | 0.785 | 80% | 0.803 | S | S | * | * | | | trans | 51.7 | 157 | 144.9 | 0 | 0 | 0 | 0 | 0 | 122.6 | | |
| 458 | A | 31.9 | Very low | 41.5 | Very low | 99 Ų | 99 | 129.3 Ų | 129.3 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | | | cis | -168.1 | 168.1 | -23.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 459 | R | 36.6 | Very low | 41.2 | Very low | 230 Ų | 230 | 127 Ų | 127 | 87% | 0.868 | 81% | 0.811 | S | S | * | * | | | trans | -84.4 | 161.5 | 172.3 | -64.6 | 176.1 | 167.9 | 172.5 | -5.6 | 112.1 | | |
| 460 | P | 48.9 | Very low | 41.2 | Very low | 123 Ų | 123 | 126.7 Ų | 126.7 | 80% | 0.799 | 81% | 0.808 | S | S | * | * | | | | -130.3 | 168.7 | 80.9 | 10.9 | 13 | 0 | 0 | 0 | 112.6 | | |
| 461 | S | 33.5 | Very low | 42 | Very low | 94 Ų | 94 | 128.5 Ų | 128.5 | 66% | 0.657 | 81% | 0.807 | S | S | * | * | | | cis | 102.7 | 103.2 | 21.8 | -60.5 | 0 | 0 | 0 | 0 | 116.2 | | |
| 462 | S | 39.9 | Very low | 40.7 | Very low | 120 Ų | 120 | 134.2 Ų | 134.2 | 84% | 0.839 | 81% | 0.813 | S | S | * | * | | | trans | 47.3 | 125.2 | 142 | 61.9 | 0 | 0 | 0 | 0 | 123 | | |
| 463 | A | 32.5 | Very low | 39.7 | Very low | 110 Ų | 110 | 136.3 Ų | 136.3 | 91% | 0.909 | 82% | 0.817 | S | S | * | * | | | trans | -156.1 | 154.3 | 148.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 464 | A | 35.1 | Very low | 40.8 | Very low | 93 Ų | 93 | 134.5 Ų | 134.5 | 77% | 0.769 | 81% | 0.813 | S | S | * | * | | | trans | -147.1 | 156.8 | 165.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | | |
| 465 | P | 48.7 | Very low | 40.1 | Very low | 138 Ų | 138 | 134.9 Ų | 134.9 | 90% | 0.896 | 82% | 0.815 | S | S | * | * | | | | -150.3 | -162.4 | 119.6 | 38.9 | -20.9 | 0 | 0 | 0 | 113.5 | | |
| 466 | A | 35.7 | Very low | 39 | Very low | 89 Ų | 89 | 136 Ų | 136 | 74% | 0.736 | 82% | 0.82 | S | S | * | * | | | trans | -135.1 | 159.5 | -169.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 467 | S | 39 | Very low | 38.8 | Very low | 110 Ų | 110 | 131.5 Ų | 131.5 | 77% | 0.769 | 82% | 0.822 | S | S | * | * | | | trans | 50.6 | 114.9 | 149.8 | 64.7 | 0 | 0 | 0 | 0 | 123 | | |
| 468 | R | 37.4 | Very low | 38.7 | Very low | 254 Ų | 254 | 130.2 Ų | 130.2 | 96% | 0.958 | 82% | 0.818 | S | S | * | * | | | | 149.7 | 138.6 | 123.5 | -86.4 | -174.8 | 167 | -163.6 | -3 | 112.3 | | |
| 469 | G | 28.8 | Very low | 39.2 | Very low | 84 Ų | 84 | 133 Ų | 133 | 87% | 0.866 | 82% | 0.819 | S | S | * | * | | | trans | 158.3 | 129.9 | 165.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | | |
| 470 | A | 34 | Very low | 39.3 | Very low | 101 Ų | 101 | 131.5 Ų | 131.5 | 84% | 0.835 | 82% | 0.819 | S | S | * | * | | | trans | -147 | 176.7 | 168.1 | 0 | 0 | 0 | 0 | 0 | 106.8 | | |
| 471 | P | 50.4 | Low | 38.6 | Very low | 111 Ų | 111 | 133.6 Ų | 133.6 | 72% | 0.721 | 82% | 0.823 | S | S | * | * | | | cis | -137.7 | -176.5 | 4.5 | 42.2 | -24.5 | 0 | 0 | 0 | 115.1 | | |
| 472 | R | 32.6 | Very low | 39.3 | Very low | 236 Ų | 236 | 136 Ų | 136 | 89% | 0.891 | 83% | 0.828 | S | S | * | * | | | trans | 168.4 | 161.6 | 131 | -90.9 | 164.3 | -170 | -165.3 | 3.2 | 113.3 | | |
| 473 | L | 35.3 | Very low | 39.1 | Very low | 165 Ų | 165 | 137 Ų | 137 | 86% | 0.864 | 82% | 0.824 | S | S | * | * | | | trans | -140.3 | -180 | 174 | -67.7 | 171.1 | 0 | 0 | 0 | 107.8 | | |
| 474 | P | 61.3 | Low | 39 | Very low | 110 Ų | 110 | 143 Ų | 143 | 71% | 0.714 | 83% | 0.825 | S | S | * | * | | | | -106.1 | -159.2 | -72.8 | 34.9 | -18.3 | 0 | 0 | 0 | 110.1 | | |
| 475 | P | 51.4 | Low | 39.2 | Very low | 127 Ų | 127 | 143.4 Ų | 143.4 | 83% | 0.825 | 82% | 0.822 | S | S | * | * | | | | -148 | -173 | 96.2 | 40.4 | -23.5 | 0 | 0 | 0 | 115.1 | | |
| 476 | V | 38.5 | Very low | 39 | Very low | 138 Ų | 138 | 144.7 Ų | 144.7 | 84% | 0.836 | 82% | 0.82 | S | S | * | * | | | trans | -118.5 | 139.1 | -179.5 | 172.6 | 0 | 0 | 0 | 0 | 110.3 | | |
| 477 | C | 29.3 | Very low | 39.1 | Very low | 135 Ų | 135 | 146.2 Ų | 146.2 | 91% | 0.912 | 82% | 0.816 | S | S | * | * | | | trans | 175.6 | 150.7 | 154.5 | -100.3 | 0 | 0 | 0 | 0 | 108.1 | | |
| 478 | G | 32 | Very low | 38.9 | Very low | 68 Ų | 68 | 151.8 Ų | 151.8 | 70% | 0.701 | 82% | 0.82 | S | S | * | * | | | cis | 175.4 | 152.1 | -6.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 479 | D | 43.1 | Very low | 38.5 | Very low | 156 Ų | 156 | 143.1 Ų | 143.1 | 83% | 0.834 | 81% | 0.81 | S | S | * | * | | | trans | -73.4 | 144.5 | -176.2 | -50.2 | -88.3 | 0 | 0 | 0 | 113.6 | | |
| 480 | F | 37.1 | Very low | 38.7 | Very low | 200 Ų | 200 | 147.3 Ų | 147.3 | 88% | 0.877 | 81% | 0.811 | S | S | * | * | | | trans | -156.3 | 118.2 | 158.3 | -98.1 | -63.7 | 0 | 0 | 0 | 115.8 | | |
| 481 | L | 35.3 | Very low | 39.9 | Very low | 166 Ų | 166 | 147.6 Ų | 147.6 | 87% | 0.869 | 81% | 0.805 | S | S | * | * | | | trans | 62.3 | 162.1 | 145.5 | -116.4 | 71.8 | 0 | 0 | 0 | 123.1 | | |
| 482 | L | 47.3 | Very low | 39.3 | Very low | 146 Ų | 146 | 153 Ų | 153 | 76% | 0.764 | 81% | 0.811 | S | S | * | * | | | trans | -133 | 169.1 | -171.2 | -97.6 | 169.4 | 0 | 0 | 0 | 111.7 | | |
| 483 | D | 37.2 | Very low | 39.4 | Very low | 140 Ų | 140 | 146.3 Ų | 146.3 | 75% | 0.749 | 80% | 0.801 | S | S | * | * | | | trans | 67.6 | 132.6 | 157.5 | -65.2 | -10.3 | 0 | 0 | 0 | 122.1 | | |
| 484 | Y | 29.3 | Very low | 39.2 | Very low | 237 Ų | 237 | 142.3 Ų | 142.3 | 93% | 0.929 | 80% | 0.799 | S | S | * | * | | | trans | -149.9 | 158.4 | 148.7 | -139.6 | -94.5 | 0 | 0 | 0 | 110.4 | | |
| 485 | S | 39.4 | Very low | 37.7 | Very low | 101 Ų | 101 | 141.2 Ų | 141.2 | 71% | 0.706 | 81% | 0.808 | S | S | * | * | | | trans | -110.2 | 176.8 | -149.3 | -52.4 | 0 | 0 | 0 | 0 | 117.6 | | |
| 486 | L | 45.6 | Very low | 36.6 | Very low | 165 Ų | 165 | 139.3 Ų | 139.3 | 86% | 0.864 | 81% | 0.811 | S | S | * | * | | | trans | -50.5 | 166.2 | 173 | -69.5 | 98.1 | 0 | 0 | 0 | 114.5 | | |
| 487 | D | 37.3 | Very low | 36.6 | Very low | 121 Ų | 121 | 137.9 Ų | 137.9 | 65% | 0.647 | 81% | 0.814 | S | S | * | * | | | | -176.5 | 169 | 61.1 | -177 | 29.9 | 0 | 0 | 0 | 114 | | |
| 488 | R | 33.8 | Very low | 36.7 | Very low | 226 Ų | 226 | 134.9 Ų | 134.9 | 85% | 0.853 | 81% | 0.805 | S | S | * | * | | | trans | 80.7 | 144.7 | 163.1 | -48.2 | -165 | 173.6 | -169.3 | -5.8 | 120 | | |
| 489 | G | 29.2 | Very low | 36.7 | Very low | 73 Ų | 73 | 144.3 Ų | 144.3 | 75% | 0.753 | 82% | 0.82 | S | S | * | * | | | cis | 178 | 159.2 | -6.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 490 | L | 34.3 | Very low | 36.2 | Very low | 171 Ų | 171 | 139.8 Ų | 139.8 | 90% | 0.895 | 81% | 0.81 | S | S | * | * | | | trans | -86 | 179.1 | 172.2 | -120.6 | 78 | 0 | 0 | 0 | 111.1 | | |
| 491 | P | 57.5 | Low | 35.8 | Very low | 108 Ų | 108 | 138.8 Ų | 138.8 | 70% | 0.701 | 81% | 0.808 | S | S | * | * | | | cis | -139.2 | -151.9 | 37.8 | 40.1 | -15.8 | 0 | 0 | 0 | 112.6 | | |
| 492 | R | 37.8 | Very low | 35.4 | Very low | 224 Ų | 224 | 138.9 Ų | 138.9 | 85% | 0.845 | 81% | 0.806 | S | S | * | * | | | cis | -161 | -173.5 | -1.1 | -139.4 | 168.7 | 71.3 | -173.7 | -4.3 | 106.4 | | |
| 493 | S | 35.9 | Very low | 34.8 | Very low | 96 Ų | 96 | 139.6 Ų | 139.6 | 67% | 0.671 | 81% | 0.81 | S | S | * | * | | | cis | -168.4 | 152.6 | 4.6 | -149.1 | 0 | 0 | 0 | 0 | 110.7 | | |
| 494 | G | 30.8 | Very low | 35.4 | Very low | 81 Ų | 81 | 138.5 Ų | 138.5 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | | | trans | 121.3 | 116.2 | 139.6 | 0 | 0 | 0 | 0 | 0 | 121.2 | | |
| 495 | G | 30 | Very low | 35.5 | Very low | 87 Ų | 87 | 132 Ų | 132 | 90% | 0.897 | 81% | 0.806 | S | S | * | * | | | trans | 130.2 | 117.9 | 146.7 | 0 | 0 | 0 | 0 | 0 | 118.8 | | |
| 496 | G | 29.1 | Very low | 35.1 | Very low | 86 Ų | 86 | 131.3 Ų | 131.3 | 89% | 0.887 | 81% | 0.806 | S | S | * | * | | | trans | 102.6 | 137.1 | 158.2 | 0 | 0 | 0 | 0 | 0 | 117.9 | | |
| 497 | A | 38.3 | Very low | 34.2 | Very low | 109 Ų | 109 | 132 Ų | 132 | 90% | 0.901 | 81% | 0.805 | S | S | * | * | | | trans | -161.9 | 155.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 498 | G | 30.5 | Very low | 34.3 | Very low | 71 Ų | 71 | 132.9 Ų | 132.9 | 73% | 0.732 | 81% | 0.814 | S | S | * | * | | | trans | 81.7 | 137.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | | |
| 499 | W | 32.9 | Very low | 34.5 | Very low | 267 Ų | 267 | 127.9 Ų | 127.9 | 100% | 1.011 | 81% | 0.811 | S | S | * | * | | | cis | -126 | -179.7 | 8.2 | -61.3 | 73.7 | 0 | 0 | 0 | 108.7 | | |
| 500 | G | 31.6 | Very low | 34.6 | Very low | 61 Ų | 61 | 127.3 Ų | 127.3 | 63% | 0.629 | 81% | 0.805 | S | S | * | * | | | cis | 146.1 | 146.5 | -0.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | | |
| 501 | E | 28.6 | Very low | 35.6 | Very low | 178 Ų | 178 | 124.9 Ų | 124.9 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | | | trans | 68 | 141.5 | -178.2 | -56.5 | -165.4 | 128.6 | 0 | 0 | 116.8 | | |
| 502 | M | 27.7 | Very low | 34.2 | Very low | 168 Ų | 168 | 127.2 Ų | 127.2 | 83% | 0.828 | 81% | 0.805 | S | S | * | * | | | cis | -146.2 | 171.2 | -8.3 | -125.9 | -166.2 | -168.5 | 0 | 0 | 114 | | |
| 503 | L | 34.5 | Very low | 33.8 | Very low | 161 Ų | 161 | 121.6 Ų | 121.6 | 84% | 0.843 | 80% | 0.801 | S | S | * | * | | | trans | -93.1 | -172.1 | -175.1 | -84.3 | 166.1 | 0 | 0 | 0 | 111.8 | | |
| 504 | P | 49.4 | Very low | 33.4 | Very low | 118 Ų | 118 | 126 Ų | 126 | 77% | 0.766 | 80% | 0.803 | S | S | * | * | | | cis | -131.8 | 173 | -0.2 | 20.6 | 4.5 | 0 | 0 | 0 | 116.9 | | |
| 505 | A | 31.3 | Very low | 33.5 | Very low | 100 Ų | 100 | 131 Ų | 131 | 83% | 0.826 | 80% | 0.796 | S | S | * | * | | | trans | -124.3 | 140 | 145.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | | |
| 506 | A | 31.8 | Very low | 33.6 | Very low | 86 Ų | 86 | 133.4 Ų | 133.4 | 71% | 0.711 | 79% | 0.788 | S | S | * | * | | | trans | -169.1 | 152.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 107.7 | | |
| 507 | E | 26.6 | Very low | 33.7 | Very low | 181 Ų | 181 | 132.3 Ų | 132.3 | 85% | 0.846 | 78% | 0.777 | S | S | * | * | | | cis | -155.7 | 168.7 | -4.6 | -129.6 | 172.8 | 165.7 | 0 | 0 | 109.5 | | |
| 508 | V | 38.8 | Very low | 33.4 | Very low | 138 Ų | 138 | 134.9 Ų | 134.9 | 84% | 0.836 | 78% | 0.775 | S | S | * | * | | | trans | -122.1 | 128.8 | 169.4 | 172 | 0 | 0 | 0 | 0 | 109.7 | | |
| 509 | P | 38.9 | Very low | 33.6 | Very low | 122 Ų | 122 | 138.3 Ų | 138.3 | 79% | 0.792 | 78% | 0.776 | S | S | * | * | | | trans | -121.8 | 121.4 | 147.4 | 12 | 8.9 | 0 | 0 | 0 | 111.1 | | |
| 510 | G | 29.9 | Very low | 33.5 | Very low | 60 Ų | 60 | 130.8 Ų | 130.8 | 62% | 0.619 | 76% | 0.759 | S | S | * | * | | | trans | -86.4 | -160.8 | 147.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 511 | P | 55.5 | Low | 33.6 | Very low | 121 Ų | 121 | 136 Ų | 136 | 79% | 0.786 | 77% | 0.77 | S | S | * | * | | | cis | -120 | -172.8 | -6.3 | 41.7 | -29.3 | 0 | 0 | 0 | 111.4 | | |
| 512 | L | 28.5 | Very low | 34 | Very low | 156 Ų | 156 | 134.7 Ų | 134.7 | 82% | 0.817 | 77% | 0.767 | S | S | * | * | | | | -179.5 | 136.5 | 128.1 | -99.5 | 166.1 | 0 | 0 | 0 | 111.2 | | |
| 513 | S | 29.3 | Very low | 34.6 | Very low | 107 Ų | 107 | 133 Ų | 133 | 75% | 0.748 | 77% | 0.769 | S | S | * | * | | | trans | 40.3 | 151.1 | 145 | -69.3 | 0 | 0 | 0 | 0 | 123.3 | | |
| 514 | R | 27.6 | Very low | 34.5 | Very low | 189 Ų | 189 | 128.2 Ų | 128.2 | 71% | 0.713 | 76% | 0.759 | S | S | * | * | | | cis | 176.7 | 146.6 | -21.6 | -159.3 | -162.1 | -180 | -174.4 | 3 | 105.8 | | |
| 515 | R | 31.9 | Very low | 34.4 | Very low | 184 Ų | 184 | 129.1 Ų | 129.1 | 69% | 0.694 | 77% | 0.765 | S | S | * | * | | | trans | 64.2 | 159.3 | 167.3 | -68.5 | -172.4 | 160.3 | 164 | -5.2 | 115.5 | | |
| 516 | D | 33.5 | Very low | 35.2 | Very low | 138 Ų | 138 | 129.9 Ų | 129.9 | 74% | 0.738 | 76% | 0.761 | S | S | * | * | | | cis | -140.5 | 158.3 | -32.3 | -83.7 | -35.1 | 0 | 0 | 0 | 103.4 | | |
| 517 | G | 29.9 | Very low | 36.2 | Very low | 63 Ų | 63 | 130.7 Ų | 130.7 | 65% | 0.649 | 76% | 0.759 | S | S | * | * | | | cis | 102.7 | 76.9 | 27.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 518 | L | 33.3 | Very low | 36.5 | Very low | 163 Ų | 163 | 128.8 Ų | 128.8 | 85% | 0.853 | 76% | 0.76 | S | S | * | * | | | trans | 170.9 | 129.9 | 138.8 | -91 | 163.6 | 0 | 0 | 0 | 114.8 | | |
| 519 | L | 33.6 | Very low | 36.2 | Very low | 144 Ų | 144 | 132.5 Ų | 132.5 | 75% | 0.754 | 76% | 0.76 | S | S | * | * | | | trans | 25.3 | 119.7 | 146.1 | -61.5 | 173.7 | 0 | 0 | 0 | 122.8 | | |
| 520 | T | 31.4 | Very low | 35.8 | Very low | 109 Ų | 109 | 131 Ų | 131 | 67% | 0.669 | 76% | 0.758 | S | S | * | * | | | | 48.5 | 120.7 | 112.5 | -44.6 | 0 | 0 | 0 | 0 | 120.8 | | |
| 521 | M | 32.7 | Very low | 35.8 | Very low | 171 Ų | 171 | 133 Ų | 133 | 84% | 0.842 | 77% | 0.768 | S | S | * | * | | | | -171.7 | 154 | 118.1 | -95.1 | -52.4 | -84.8 | 0 | 0 | 111.4 | | |
| 522 | L | 37 | Very low | 34.6 | Very low | 150 Ų | 150 | 134.6 Ų | 134.6 | 79% | 0.785 | 77% | 0.771 | S | S | * | * | | | trans | -86.8 | 145.1 | 175.6 | -71.4 | 80.9 | 0 | 0 | 0 | 111.6 | | |
| 523 | P | 40.3 | Very low | 34.8 | Very low | 131 Ų | 131 | 133.1 Ų | 133.1 | 85% | 0.851 | 77% | 0.773 | S | S | * | * | | | trans | -84.1 | 113.1 | 162 | 32.5 | -29.6 | 0 | 0 | 0 | 111 | | |
| 524 | G | 32.9 | Very low | 34.8 | Very low | 62 Ų | 62 | 135.7 Ų | 135.7 | 64% | 0.639 | 78% | 0.779 | S | S | * | * | | | trans | -89.7 | 160.6 | 164.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 525 | P | 47 | Very low | 35 | Very low | 137 Ų | 137 | 132.1 Ų | 132.1 | 89% | 0.89 | 78% | 0.783 | S | S | * | * | | | trans | -87.4 | 136.3 | -178.2 | 33.7 | -33.8 | 0 | 0 | 0 | 113.4 | | |
| 526 | P | 49.9 | Very low | 36 | Very low | 115 Ų | 115 | 128.8 Ų | 128.8 | 75% | 0.747 | 79% | 0.785 | S | S | * | * | | | trans | -128.2 | 168.2 | 167.3 | 41.4 | -29.4 | 0 | 0 | 0 | 113.2 | | |
| 527 | P | 52.6 | Low | 36 | Very low | 104 Ų | 104 | 129.6 Ų | 129.6 | 68% | 0.675 | 79% | 0.788 | S | S | * | * | | | cis | -132.5 | 168.9 | -47.5 | 38.2 | -24.4 | 0 | 0 | 0 | 112.2 | Y529 | P527-Y529 HydrophobicContact CG-CE2 4.42Š|
| 528 | V | 31.4 | Very low | 36.2 | Very low | 141 Ų | 141 | 133.6 Ų | 133.6 | 86% | 0.855 | 79% | 0.794 | S | S | * | * | | | trans | -80.5 | 139.4 | 164.3 | 177.3 | 0 | 0 | 0 | 0 | 109.2 | | |
| 529 | Y | 33.9 | Very low | 36.2 | Very low | 215 Ų | 215 | 136.7 Ų | 136.7 | 84% | 0.843 | 79% | 0.794 | S | S | * | * | | | trans | -109.2 | 135 | 163 | -96.9 | -82.8 | 0 | 0 | 0 | 110.4 | P527 | P527-Y529 HydrophobicContact CG-CE2 4.42Š|
| 530 | A | 30.3 | Very low | 36 | Very low | 92 Ų | 92 | 135.5 Ų | 135.5 | 76% | 0.76 | 79% | 0.793 | S | S | * | * | | | trans | -123.2 | 150.5 | 165.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | | |
| 531 | A | 30 | Very low | 36 | Very low | 100 Ų | 100 | 139.3 Ų | 139.3 | 83% | 0.826 | 80% | 0.8 | S | S | * | * | | | trans | -152.9 | 126.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | | |
| 532 | D | 30.6 | Very low | 36.2 | Very low | 156 Ų | 156 | 138.1 Ų | 138.1 | 83% | 0.834 | 80% | 0.798 | S | S | * | * | | | trans | -84.6 | 151.5 | -172.2 | -52.9 | -86.5 | 0 | 0 | 0 | 113.1 | | |
| 533 | S | 31.8 | Very low | 36.8 | Very low | 124 Ų | 124 | 136.8 Ų | 136.8 | 87% | 0.867 | 80% | 0.798 | S | S | * | * | | | trans | -157.2 | 111.8 | 162.6 | -69.5 | 0 | 0 | 0 | 0 | 113.1 | | |
| 534 | N | 29.4 | Very low | 36.5 | Very low | 162 Ų | 162 | 139.5 Ų | 139.5 | 87% | 0.866 | 80% | 0.799 | S | S | * | * | | | trans | -20.5 | 134 | 173.2 | -61 | -29 | 0 | 0 | 0 | 121.2 | | |
| 535 | S | 31.9 | Very low | 36.6 | Very low | 114 Ų | 114 | 143.6 Ų | 143.6 | 80% | 0.797 | 81% | 0.812 | S | S | * | * | | | trans | -33.4 | 177.9 | 146.4 | -44.9 | 0 | 0 | 0 | 0 | 117.5 | | |
| 536 | P | 53.5 | Low | 35.9 | Very low | 114 Ų | 114 | 148.6 Ų | 148.6 | 74% | 0.74 | 81% | 0.813 | S | S | * | * | | | cis | -132.9 | -167 | -46.2 | 37.5 | -20.6 | 0 | 0 | 0 | 110.9 | | |
| 537 | L | 33 | Very low | 35 | Very low | 155 Ų | 155 | 148.1 Ų | 148.1 | 81% | 0.812 | 82% | 0.818 | S | S | * | * | | | trans | -178 | 127.9 | 137.4 | -99.8 | 162.1 | 0 | 0 | 0 | 115.1 | | |
| 538 | L | 33 | Very low | 34 | Very low | 146 Ų | 146 | 149.1 Ų | 149.1 | 76% | 0.764 | 82% | 0.823 | S | S | * | * | | | trans | 27.8 | 135.3 | 152.9 | -65.9 | 171.8 | 0 | 0 | 0 | 124.7 | | |
| 539 | R | 33.2 | Very low | 33.9 | Very low | 229 Ų | 229 | 153.3 Ų | 153.3 | 86% | 0.864 | 82% | 0.823 | S | S | * | * | | | trans | 12.7 | 149.3 | 135.3 | -67.2 | -177.2 | 166.6 | 164.5 | -2.5 | 118.6 | | |
| 540 | T | 29.6 | Very low | 33.8 | Very low | 119 Ų | 119 | 149.3 Ų | 149.3 | 73% | 0.73 | 82% | 0.821 | S | S | * | * | | | | -176.4 | 121.9 | 73.2 | -62.8 | 0 | 0 | 0 | 0 | 114.5 | | |
| 541 | K | 32 | Very low | 34.4 | Very low | 188 Ų | 188 | 153.9 Ų | 153.9 | 82% | 0.817 | 82% | 0.824 | S | S | * | * | | | trans | 67.5 | 118.2 | 137.8 | -172.2 | 173 | 178.7 | -178.4 | 0 | 121.8 | | |
| 542 | D | 36.8 | Very low | 35.1 | Very low | 147 Ų | 147 | 155.1 Ų | 155.1 | 79% | 0.786 | 82% | 0.823 | S | S | * | * | | | trans | -64.4 | 159.6 | 154.8 | -51.6 | -86.3 | 0 | 0 | 0 | 112.6 | | |
| 543 | P | 49.6 | Very low | 35.3 | Very low | 122 Ų | 122 | 153.8 Ų | 153.8 | 79% | 0.792 | 83% | 0.825 | S | S | * | * | | | | -143.8 | 168.2 | 103.5 | 38.5 | -25.3 | 0 | 0 | 0 | 115.9 | | |
| 544 | H | 33.4 | Very low | 35.3 | Very low | 187 Ų | 187 | 151.4 Ų | 151.4 | 87% | 0.866 | 82% | 0.82 | S | S | * | * | | | trans | -51.5 | 147.5 | 178 | -56 | -44 | 0 | 0 | 0 | 115.8 | | |
| 545 | T | 34.9 | Very low | 35.7 | Very low | 149 Ų | 149 | 151.8 Ų | 151.8 | 91% | 0.914 | 82% | 0.821 | S | S | * | * | | | trans | -135 | 150.5 | 133.1 | 48.4 | 0 | 0 | 0 | 0 | 111.3 | | |
| 546 | R | 33.3 | Very low | 36.7 | Very low | 242 Ų | 242 | 151.9 Ų | 151.9 | 91% | 0.913 | 82% | 0.819 | S | S | * | * | | | trans | -115.7 | 118 | -174.7 | 171.5 | -165 | -172.8 | -174.5 | 5.5 | 108.7 | | |
| 547 | A | 31.4 | Very low | 36.3 | Very low | 104 Ų | 104 | 151.8 Ų | 151.8 | 86% | 0.86 | 82% | 0.818 | S | S | * | * | | | trans | -139.5 | 142.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | | |
| 548 | T | 30.9 | Very low | 36.3 | Very low | 126 Ų | 126 | 152.4 Ų | 152.4 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | | | trans | -120.6 | 149.7 | -173.5 | 48 | 0 | 0 | 0 | 0 | 112.3 | | |
| 549 | R | 28.7 | Very low | 36.2 | Very low | 229 Ų | 229 | 151.5 Ų | 151.5 | 86% | 0.864 | 82% | 0.817 | S | S | * | * | | | trans | 63.3 | 110 | 145.8 | 179.7 | -158.4 | 179.7 | -166.3 | 0.7 | 117.2 | | |
| 550 | T | 33.2 | Very low | 36.2 | Very low | 130 Ų | 130 | 145.1 Ų | 145.1 | 80% | 0.798 | 81% | 0.814 | S | S | * | * | | | | -165.5 | 145.9 | 113.2 | 22.9 | 0 | 0 | 0 | 0 | 111.9 | | |
| 551 | K | 41.4 | Very low | 36.3 | Very low | 189 Ų | 189 | 149.3 Ų | 149.3 | 82% | 0.822 | 83% | 0.825 | S | S | * | * | | | trans | -96.3 | 156.9 | 149.8 | -66.3 | -172.9 | 178.4 | -173.2 | 0 | 108 | | |
| 552 | P | 45.3 | Very low | 36.2 | Very low | 125 Ų | 125 | 143.9 Ų | 143.9 | 81% | 0.812 | 82% | 0.822 | S | S | * | * | | | | -132.2 | 173.1 | 118.8 | 37.1 | -29.2 | 0 | 0 | 0 | 112.9 | | |
| 553 | C | 35.3 | Very low | 36.4 | Very low | 129 Ų | 129 | 142.9 Ų | 142.9 | 87% | 0.872 | 82% | 0.824 | S | S | * | * | | | trans | -104.5 | 154.4 | 173.1 | -59.7 | 0 | 0 | 0 | 0 | 110.4 | | |
| 554 | G | 30.8 | Very low | 35.4 | Very low | 73 Ų | 73 | 145.8 Ų | 145.8 | 75% | 0.753 | 83% | 0.827 | S | S | * | * | | | trans | -166.6 | 144.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 555 | L | 37.8 | Very low | 35.2 | Very low | 170 Ų | 170 | 143.1 Ų | 143.1 | 89% | 0.89 | 82% | 0.823 | S | S | * | * | | | trans | -156.5 | 167.5 | 177.5 | -69.4 | 175.9 | 0 | 0 | 0 | 107.5 | | |
| 556 | P | 53.5 | Low | 35.1 | Very low | 116 Ų | 116 | 145 Ų | 145 | 75% | 0.753 | 82% | 0.821 | S | S | * | * | | | | -110.6 | -160.1 | -51.8 | 37.5 | -21.6 | 0 | 0 | 0 | 108.9 | | |
| 557 | P | 46 | Very low | 35.8 | Very low | 113 Ų | 113 | 138.7 Ų | 138.7 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | | | | -153.5 | 163.3 | 77.9 | 38.9 | -17.7 | 0 | 0 | 0 | 118.3 | | |
| 558 | E | 32.7 | Very low | 35.9 | Very low | 168 Ų | 168 | 141.3 Ų | 141.3 | 79% | 0.785 | 81% | 0.812 | S | S | * | * | | | trans | 56.4 | 128 | 142.1 | -64 | -62.3 | 83.7 | 0 | 0 | 126 | | |
| 559 | V | 29.5 | Very low | 36.5 | Very low | 126 Ų | 126 | 140.2 Ų | 140.2 | 76% | 0.764 | 81% | 0.806 | S | S | * | * | | | trans | 65.5 | 116.3 | 134.4 | 178.8 | 0 | 0 | 0 | 0 | 122.2 | | |
| 560 | A | 34 | Very low | 36.8 | Very low | 96 Ų | 96 | 136.7 Ų | 136.7 | 79% | 0.793 | 80% | 0.804 | S | S | * | * | | | | -163.4 | 149.1 | 127.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | | |
| 561 | E | 31.2 | Very low | 36.8 | Very low | 206 Ų | 206 | 137.9 Ų | 137.9 | 96% | 0.963 | 81% | 0.805 | S | S | * | * | | | trans | -99.2 | 158.4 | 173.4 | -66.5 | -164.7 | 144 | 0 | 0 | 112.6 | | |
| 562 | G | 30.3 | Very low | 36.4 | Very low | 74 Ų | 74 | 140.1 Ų | 140.1 | 76% | 0.763 | 81% | 0.808 | S | S | * | * | | | trans | 172.1 | 118.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 563 | P | 40.5 | Very low | 36 | Very low | 126 Ų | 126 | 141 Ų | 141 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | | | trans | -100 | -166.9 | -174.7 | 40.1 | -37.2 | 0 | 0 | 0 | 114.1 | | |
| 564 | E | 29.3 | Very low | 36.3 | Very low | 184 Ų | 184 | 139.7 Ų | 139.7 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | | | trans | 86.6 | 142.2 | 175.3 | -62.1 | -98.9 | 89.2 | 0 | 0 | 116.6 | | |
| 565 | V | 29 | Very low | 37 | Very low | 130 Ų | 130 | 141.6 Ų | 141.6 | 79% | 0.788 | 79% | 0.792 | S | S | * | * | | | trans | -144.3 | 125.2 | -165.1 | 174.2 | 0 | 0 | 0 | 0 | 110.5 | | |
| 566 | H | 33.3 | Very low | 37.1 | Very low | 188 Ų | 188 | 139.4 Ų | 139.4 | 87% | 0.87 | 79% | 0.788 | S | S | * | * | | | trans | -130.9 | 152.2 | 160.2 | -89.1 | -53.2 | 0 | 0 | 0 | 111.5 | | |
| 567 | P | 47.7 | Very low | 36.2 | Very low | 111 Ų | 111 | 140.7 Ų | 140.7 | 72% | 0.721 | 79% | 0.794 | S | S | * | * | | | trans | -101.3 | 154.3 | -152.1 | 37.6 | -36 | 0 | 0 | 0 | 115.2 | | |
| 568 | N | 33.4 | Very low | 35.8 | Very low | 159 Ų | 159 | 146.8 Ų | 146.8 | 85% | 0.85 | 80% | 0.802 | S | S | * | * | | | trans | -151 | 155.6 | 145.1 | -122.2 | -13.7 | 0 | 0 | 0 | 109.9 | | |
| 569 | P | 44.1 | Very low | 36.5 | Very low | 102 Ų | 102 | 146.4 Ų | 146.4 | 66% | 0.662 | 80% | 0.804 | S | S | * | * | | | trans | -92.2 | -169 | -169.3 | 37.3 | -35.6 | 0 | 0 | 0 | 113.7 | | |
| 570 | L | 34.2 | Very low | 37 | Very low | 156 Ų | 156 | 144.7 Ų | 144.7 | 82% | 0.817 | 80% | 0.795 | S | S | * | * | | | trans | 85.8 | 90.3 | 173.3 | -49.2 | 177.7 | 0 | 0 | 0 | 117 | | |
| 571 | L | 33.8 | Very low | 37.5 | Very low | 154 Ų | 154 | 144.8 Ų | 144.8 | 81% | 0.806 | 79% | 0.79 | S | S | * | * | | | | -172.3 | 136.7 | 104.6 | -121.9 | 75.5 | 0 | 0 | 0 | 111.1 | | |
| 572 | W | 32.1 | Very low | 38.4 | Very low | 237 Ų | 237 | 138.8 Ų | 138.8 | 90% | 0.898 | 78% | 0.776 | S | S | * | * | | | trans | -97 | 110 | 176.2 | -172 | -67 | 0 | 0 | 0 | 110.4 | | |
| 573 | M | 37 | Very low | 39.3 | Very low | 144 Ų | 144 | 137.9 Ų | 137.9 | 71% | 0.709 | 77% | 0.767 | S | S | * | * | | | trans | -116 | 135.2 | 174.3 | -76.5 | -73.7 | 110.1 | 0 | 0 | 110.9 | | |
| 574 | P | 41.5 | Very low | 39.8 | Very low | 100 Ų | 100 | 138 Ų | 138 | 65% | 0.649 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 145.6 | 177.8 | 32 | -34.3 | 0 | 0 | 0 | 111.8 | | |
| 575 | P | 45.5 | Very low | 41.1 | Very low | 114 Ų | 114 | 138.9 Ų | 138.9 | 74% | 0.74 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 150.8 | -179.6 | 30.7 | -35.4 | 0 | 0 | 0 | 112.5 | | |
| 576 | P | 40.2 | Very low | 42.3 | Very low | 124 Ų | 124 | 135.7 Ų | 135.7 | 81% | 0.805 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 140.6 | 178.5 | 28.4 | -34.8 | 0 | 0 | 0 | 112.2 | R578 | P576-R578 PolarHBondContact O-N 2.84Š|
| 577 | T | 34.2 | Very low | 44.2 | Very low | 142 Ų | 142 | 128.4 Ų | 128.4 | 87% | 0.871 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 116.9 | -179.9 | 50 | 0 | 0 | 0 | 0 | 111.9 | | |
| 578 | R | 39.3 | Very low | 45.7 | Very low | 241 Ų | 241 | 130.4 Ų | 130.4 | 91% | 0.909 | 71% | 0.71 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 144.6 | 168.8 | -63.9 | -174.3 | -173.2 | 171.9 | 3 | 110.5 | P576 | P576-R578 PolarHBondContact O-N 2.84Š|
| 579 | I | 46.6 | Very low | 48 | Very low | 161 Ų | 161 | 129.8 Ų | 129.8 | 83% | 0.826 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 130.9 | 173.9 | -60.2 | 165.5 | 0 | 0 | 0 | 108.5 | | |
| 580 | P | 40 | Very low | 49.7 | Very low | 89 Ų | 89 | 128.7 Ų | 128.7 | 58% | 0.578 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 144.1 | 177.9 | 26.5 | -33.4 | 0 | 0 | 0 | 112.1 | E584 | P580-E584 WeakPolarHBondContact CB-OE2 3.4Š|
| 581 | S | 44.3 | Very low | 52.3 | Low | 99 Ų | 99 | 127.1 Ų | 127.1 | 69% | 0.692 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 167.2 | -179.6 | 69.9 | 0 | 0 | 0 | 0 | 112.2 | G583 | S581-G583 PolarHBondContact O-N 2.94Š|
| 582 | A | 49.2 | Very low | 55 | Low | 79 Ų | 79 | 122.8 Ų | 122.8 | 65% | 0.653 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.8 | -12 | -165.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | | |
| 583 | G | 50.6 | Low | 57.8 | Low | 56 Ų | 56 | 116.9 Ų | 116.9 | 58% | 0.577 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.7 | -38.4 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | S581 R585 S586 | S581-G583 PolarHBondContact O-N 2.94Å; G583-R585 PolarHBondContact O-N 3.25Å; G583-S586 WeakPolarHBondContact O-CB 3.46Å; G583-S586 PolarHBondContact O-N 2.93Å |
| 584 | E | 51.1 | Low | 60.3 | Low | 127 Ų | 127 | 115.1 Ų | 115.1 | 59% | 0.593 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -66.5 | -14.7 | -175.1 | -62.8 | -174.4 | 145.6 | 0 | 0 | 113.8 | P580 S586 G587 H588 | P580-E584 WeakPolarHBondContact CB-OE2 3.4Å; E584-S586 PolarHBondContact O-N 3.02Å; E584-G587 PolarHBondContact O-N 2.77Å; E584-H588 PolarHBondContact O-ND1 3.31Å |
| 585 | R | 55.9 | Low | 62.8 | Low | 203 Ų | 203 | 112.1 Ų | 112.1 | 77% | 0.766 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -65.3 | -15.9 | 173.1 | -62.2 | -177.4 | 175.3 | -166.5 | -1.7 | 113.2 | G583 | G583-R585 PolarHBondContact O-N 3.25Å |
| 586 | S | 54.4 | Low | 65 | Low | 63 Ų | 63 | 111.7 Ų | 111.7 | 44% | 0.441 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -82.9 | -44.3 | 175.4 | -166.7 | 0 | 0 | 0 | 0 | 112.4 | G583 E584 H588 K589 N590 | G583-S586 WeakPolarHBondContact O-CB 3.46Å; G583-S586 PolarHBondContact O-N 2.93Å; E584-S586 PolarHBondContact O-N 3.02Å; S586-H588 VanDerWaalsContact C-N 3.33Å; S586-H588 PolarHBondContact O-N 3.47Å; S586-K589 WeakPolarHBondContact O-CA 3.24Å; S586-K589 WeakPolarHBondContact O-CB 3.36Å; S586-K589 PolarHBondContact O-N 3.03Å; S586-N590 PolarHBondContact O-N 3.04Å; S586-N590 VanDerWaalsContact O-N 3.09Å |
| 587 | G | 73.1 | Confident | 67.5 | Low | 35 Ų | 35 | 114.1 Ų | 114.1 | 36% | 0.361 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -56.9 | -41.6 | -173 | 0 | 0 | 0 | 0 | 0 | 114.1 | E584 K589 N590 L591 | E584-G587 PolarHBondContact O-N 2.77Å; G587-K589 VanDerWaalsContact C-N 3.26Å; G587-K589 PolarHBondContact O-N 2.89Å; G587-N590 PolarHBondContact O-N 3.33Å; G587-L591 PolarHBondContact O-N 3.11Å |
| 588 | H | 78.7 | Confident | 70.1 | Confident | 153 Ų | 153 | 110.9 Ų | 110.9 | 71% | 0.708 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -62.3 | -29.9 | 176.1 | -70.1 | 82.8 | 0 | 0 | 0 | 113.6 | E584 S586 A592 | E584-H588 PolarHBondContact O-ND1 3.31Å; S586-H588 VanDerWaalsContact C-N 3.33Å; S586-H588 PolarHBondContact O-N 3.47Å; H588-A592 WeakPolarHBondContact O-CB 3.4Å; H588-A592 PolarHBondContact O-N 3.08Å |
| 589 | K | 81.9 | Confident | 72.6 | Confident | 147 Ų | 147 | 106.4 Ų | 106.4 | 64% | 0.639 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -78.7 | -39.5 | 175.7 | -62.8 | -174.7 | 178.8 | -174.5 | 0 | 111.3 | S586 G587 A592 L593 | S586-K589 WeakPolarHBondContact O-CA 3.24Å; S586-K589 WeakPolarHBondContact O-CB 3.36Å; S586-K589 PolarHBondContact O-N 3.03Å; G587-K589 VanDerWaalsContact C-N 3.26Å; G587-K589 PolarHBondContact O-N 2.89Å; K589-A592 PolarHBondContact O-N 3.18Å; K589-L593 WeakPolarHBondContact O-CG 3.5Å; K589-L593 PolarHBondContact O-N 3.37Å |
| 590 | N | 80.2 | Confident | 74.7 | Confident | 78 Ų | 78 | 105.6 Ų | 105.6 | 42% | 0.417 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -63.7 | -48.4 | 178 | -62.1 | -16.4 | 0 | 0 | 0 | 110.8 | S586 G587 A592 L593 E594 | S586-N590 PolarHBondContact O-N 3.04Å; S586-N590 VanDerWaalsContact O-N 3.09Å; G587-N590 PolarHBondContact O-N 3.33Å; N590-A592 VanDerWaalsContact C-N 3.28Å; N590-A592 PolarHBondContact O-N 3.21Å; N590-L593 PolarHBondContact O-N 3.47Å; N590-L593 VanDerWaalsContact O-N 3.09Å; N590-E594 WeakPolarHBondContact O-CG 3.41Å; N590-E594 PolarHBondContact O-N 2.88Å |
| 591 | L | 89.5 | Confident | 76.9 | Confident | 123 Ų | 123 | 105.6 Ų | 105.6 | 64% | 0.644 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -57.6 | -38 | 174 | -108.1 | 71.7 | 0 | 0 | 0 | 113 | G587 G595 | G587-L591 PolarHBondContact O-N 3.11Å; L591-G595 PolarHBondContact O-N 3.06Å |
| 592 | A | 88.9 | Confident | 78.6 | Confident | 64 Ų | 64 | 108.9 Ų | 108.9 | 53% | 0.529 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -68.7 | -37 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | H588 K589 N590 L596 | H588-A592 WeakPolarHBondContact O-CB 3.4Å; H588-A592 PolarHBondContact O-N 3.08Å; K589-A592 PolarHBondContact O-N 3.18Å; N590-A592 VanDerWaalsContact C-N 3.28Å; N590-A592 PolarHBondContact O-N 3.21Å; A592-L596 VanDerWaalsContact O-CB 3.31Å; A592-L596 WeakPolarHBondContact O-CB 3.48Å; A592-L596 PolarHBondContact O-N 2.72Å |
| 593 | L | 92.8 | Very high | 80.2 | Confident | 112 Ų | 112 | 109.9 Ų | 109.9 | 59% | 0.586 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -72.8 | -36.5 | 175.7 | -69.7 | 170 | 0 | 0 | 0 | 112.1 | K589 N590 L596 R597 | K589-L593 WeakPolarHBondContact O-CG 3.5Å; K589-L593 PolarHBondContact O-N 3.37Å; N590-L593 PolarHBondContact O-N 3.47Å; N590-L593 VanDerWaalsContact O-N 3.09Å; L593-L596 PolarHBondContact O-N 2.97Å; L593-R597 VanDerWaalsContact O-CB 3.27Å; L593-R597 WeakPolarHBondContact O-CB 3.38Å; L593-R597 PolarHBondContact O-N 2.87Å |
| 594 | E | 87.9 | Confident | 81.3 | Confident | 107 Ų | 107 | 109 Ų | 109 | 50% | 0.5 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.4 | -49.2 | 171.9 | -72.1 | 170 | 158.9 | 0 | 0 | 110.9 | N590 L596 R597 D598 | N590-E594 WeakPolarHBondContact O-CG 3.41Å; N590-E594 PolarHBondContact O-N 2.88Å; E594-L596 VanDerWaalsContact C-N 3.29Å; E594-L596 PolarHBondContact O-N 2.89Å; E594-R597 WeakPolarHBondContact O-CB 3.41Å; E594-R597 PolarHBondContact O-N 3.48Å; E594-R597 VanDerWaalsContact O-N 3.17Å; E594-D598 WeakPolarHBondContact O-CB 3.49Å; E594-D598 PolarHBondContact O-N 2.93Å |
| 595 | G | 94.1 | Very high | 81.9 | Confident | 38 Ų | 38 | 106.2 Ų | 106.2 | 39% | 0.392 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -59 | -37.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | L591 W599 | L591-G595 PolarHBondContact O-N 3.06Å; G595-W599 VanDerWaalsContact O-CB 3.29Å; G595-W599 WeakPolarHBondContact O-CB 3.26Å; G595-W599 PolarHBondContact O-N 3.38Å |
| 596 | L | 92.8 | Very high | 82 | Confident | 105 Ų | 105 | 103.4 Ų | 103.4 | 55% | 0.55 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -70.9 | -40.7 | 175.1 | -176.6 | 63.1 | 0 | 0 | 0 | 112.4 | A592 L593 E594 W599 Y600 | A592-L596 VanDerWaalsContact O-CB 3.31Å; A592-L596 WeakPolarHBondContact O-CB 3.48Å; A592-L596 PolarHBondContact O-N 2.72Å; L593-L596 PolarHBondContact O-N 2.97Å; E594-L596 VanDerWaalsContact C-N 3.29Å; E594-L596 PolarHBondContact O-N 2.89Å; L596-W599 PolarHBondContact O-N 3.45Å; L596-Y600 WeakPolarHBondContact O-CB 3.44Å; L596-Y600 PolarHBondContact O-N 3.47Å |
| 597 | R | 91.9 | Very high | 81.7 | Confident | 174 Ų | 174 | 104.4 Ų | 104.4 | 66% | 0.657 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -60.2 | -48 | 174.3 | 179.8 | -172.8 | -177.3 | -167.2 | 0.6 | 110.8 | L593 E594 Y600 I601 | L593-R597 VanDerWaalsContact O-CB 3.27Å; L593-R597 WeakPolarHBondContact O-CB 3.38Å; L593-R597 PolarHBondContact O-N 2.87Å; E594-R597 WeakPolarHBondContact O-CB 3.41Å; E594-R597 PolarHBondContact O-N 3.48Å; E594-R597 VanDerWaalsContact O-N 3.17Å; R597-Y600 PolarHBondContact O-N 3.12Å; R597-I601 HydrophobicContact CG-CD1 3.96Å; R597-I601 WeakPolarHBondContact O-CG1 3.44Å; R597-I601 PolarHBondContact O-N 3.19Å |
| 598 | D | 89.3 | Confident | 80.6 | Confident | 74 Ų | 74 | 107.8 Ų | 107.8 | 40% | 0.396 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64 | -40.1 | 178.1 | -89.1 | 22.3 | 0 | 0 | 0 | 112.7 | E594 Y600 I601 R602 | E594-D598 WeakPolarHBondContact O-CB 3.49Å; E594-D598 PolarHBondContact O-N 2.93Å; D598-Y600 VanDerWaalsContact C-N 3.33Å; D598-I601 PolarHBondContact O-N 2.94Å; D598-R602 WeakPolarHBondContact O-CG 3.27Å; D598-R602 PolarHBondContact O-N 2.98Å; D598-R602 PolarHBondContact O-NE 3.14Å; D598-R602 IonicContact OD2-NH1 2.67Å |
| 599 | W | 90.5 | Very high | 79 | Confident | 148 Ų | 148 | 103.1 Ų | 103.1 | 56% | 0.561 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -60.9 | -42.8 | 172.3 | -178.5 | 97 | 0 | 0 | 0 | 111.2 | G595 L596 R602 N603 | G595-W599 VanDerWaalsContact O-CB 3.29Å; G595-W599 WeakPolarHBondContact O-CB 3.26Å; G595-W599 PolarHBondContact O-N 3.38Å; L596-W599 PolarHBondContact O-N 3.45Å; W599-R602 PolarHBondContact O-N 3.07Å; W599-N603 WeakPolarHBondContact CZ2-ND2 3.22Å; W599-N603 PolarHBondContact NE1-ND2 3.1Å; W599-N603 WeakPolarHBondContact O-CB 3.43Å; W599-N603 PolarHBondContact O-N 3.35Å; W599-N603 VanDerWaalsContact O-N 3.1Å; W599-N603 PolarHBondContact O-ND2 3.25Å |
| 600 | Y | 92.2 | Very high | 77.4 | Confident | 144 Ų | 144 | 102.7 Ų | 102.7 | 57% | 0.565 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -67.5 | -41.2 | 176.4 | -169.1 | -93.1 | 0 | 0 | 0 | 112.3 | L596 R597 D598 R602 N603 S604 | L596-Y600 WeakPolarHBondContact O-CB 3.44Å; L596-Y600 PolarHBondContact O-N 3.47Å; R597-Y600 PolarHBondContact O-N 3.12Å; D598-Y600 VanDerWaalsContact C-N 3.33Å; Y600-R602 VanDerWaalsContact C-N 3.34Å; Y600-R602 PolarHBondContact O-N 3.13Å; Y600-N603 PolarHBondContact O-N 2.89Å; Y600-S604 WeakPolarHBondContact O-CB 3.49Å; Y600-S604 PolarHBondContact O-N 3.41Å; Y600-S604 PolarHBondContact O-OG 3.21Å |
| 601 | I | 84.9 | Confident | 75.5 | Confident | 89 Ų | 89 | 107.2 Ų | 107.2 | 46% | 0.456 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -59.6 | -44.1 | 175.4 | -70.7 | 165.6 | 0 | 0 | 0 | 110.8 | R597 D598 N603 | R597-I601 HydrophobicContact CG-CD1 3.96Å; R597-I601 WeakPolarHBondContact O-CG1 3.44Å; R597-I601 PolarHBondContact O-N 3.19Å; D598-I601 PolarHBondContact O-N 2.94Å; I601-N603 VanDerWaalsContact C-N 3.35Å; I601-N603 PolarHBondContact O-N 2.96Å |
| 602 | R | 80.8 | Confident | 73 | Confident | 167 Ų | 167 | 112.7 Ų | 112.7 | 63% | 0.63 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -67.5 | -30.4 | 178 | -72.7 | -177.2 | -71.7 | -100.6 | 1.5 | 113.8 | D598 W599 Y600 | D598-R602 WeakPolarHBondContact O-CG 3.27Å; D598-R602 PolarHBondContact O-N 2.98Å; D598-R602 PolarHBondContact O-NE 3.14Å; D598-R602 IonicContact OD2-NH1 2.67Å; W599-R602 PolarHBondContact O-N 3.07Å; Y600-R602 VanDerWaalsContact C-N 3.34Å; Y600-R602 PolarHBondContact O-N 3.13Å |
| 603 | N | 82.7 | Confident | 70.4 | Confident | 100 Ų | 100 | 120.3 Ų | 120.3 | 54% | 0.535 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -105.2 | -17.7 | -171.5 | -66.6 | -16.9 | 0 | 0 | 0 | 115.3 | W599 Y600 I601 G605 | W599-N603 WeakPolarHBondContact CZ2-ND2 3.22Å; W599-N603 PolarHBondContact NE1-ND2 3.1Å; W599-N603 WeakPolarHBondContact O-CB 3.43Å; W599-N603 PolarHBondContact O-N 3.35Å; W599-N603 VanDerWaalsContact O-N 3.1Å; W599-N603 PolarHBondContact O-ND2 3.25Å; Y600-N603 PolarHBondContact O-N 2.89Å; I601-N603 VanDerWaalsContact C-N 3.35Å; I601-N603 PolarHBondContact O-N 2.96Å; N603-G605 VanDerWaalsContact C-N 3.25Å; N603-G605 PolarHBondContact O-N 3.48Å |
| 604 | S | 74 | Confident | 67.8 | Low | 37 Ų | 37 | 121.1 Ų | 121.1 | 26% | 0.259 | 64% | 0.638 | S | S | . | * | S | Bend | trans | -77.5 | 0.6 | -174 | 56.9 | 0 | 0 | 0 | 0 | 115.4 | Y600 L606 | Y600-S604 WeakPolarHBondContact O-CB 3.49Å; Y600-S604 PolarHBondContact O-N 3.41Å; Y600-S604 PolarHBondContact O-OG 3.21Å; S604-L606 PolarHBondContact O-N 3.42Å |
| 605 | G | 64.3 | Low | 65.4 | Low | 70 Ų | 70 | 122.3 Ų | 122.3 | 72% | 0.722 | 65% | 0.652 | S | S | * | * | S | Bend | trans | 70.7 | -8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 116.1 | N603 A607 | N603-G605 VanDerWaalsContact C-N 3.25Å; N603-G605 PolarHBondContact O-N 3.48Å; G605-A607 PolarHBondContact O-N 3.16Å |
| 606 | L | 56.6 | Low | 62.7 | Low | 144 Ų | 144 | 127.9 Ų | 127.9 | 75% | 0.754 | 67% | 0.672 | S | S | * | * | | | trans | -71.7 | -5.7 | -178.5 | -81.1 | 143.1 | 0 | 0 | 0 | 114.7 | S604 A608 | S604-L606 PolarHBondContact O-N 3.42Å; L606-A608 PolarHBondContact O-N 3.11Å |
| 607 | A | 49.2 | Very low | 60.4 | Low | 83 Ų | 83 | 129 Ų | 129 | 69% | 0.686 | 69% | 0.685 | S | S | * | * | | | trans | -77.1 | 67.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | G605 G609 | G605-A607 PolarHBondContact O-N 3.16Å; A607-G609 PolarHBondContact O-N 3.21Å |
| 608 | A | 50.4 | Low | 57.6 | Low | 107 Ų | 107 | 126.3 Ų | 126.3 | 88% | 0.884 | 69% | 0.693 | S | S | * | * | | | trans | -75.1 | 87.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | L606 | L606-A608 PolarHBondContact O-N 3.11Š|
| 609 | G | 44.2 | Very low | 55.3 | Low | 54 Ų | 54 | 129.7 Ų | 129.7 | 56% | 0.557 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -160.6 | 142.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | A607 Q611 | A607-G609 PolarHBondContact O-N 3.21Å; G609-Q611 PolarHBondContact O-N 3.14Å |
| 610 | P | 48.4 | Very low | 52.6 | Low | 138 Ų | 138 | 125.4 Ų | 125.4 | 90% | 0.896 | 72% | 0.718 | S | S | * | * | | | trans | -78.5 | 96.8 | -165.9 | 30.7 | -35.3 | 0 | 0 | 0 | 112.4 | | |
| 611 | Q | 39.3 | Very low | 50.2 | Low | 174 Ų | 174 | 124.9 Ų | 124.9 | 81% | 0.813 | 73% | 0.732 | S | S | * | * | | | trans | -122.1 | 140 | 158.6 | -94 | -65.2 | 7.1 | 0 | 0 | 112.1 | G609 R613 | G609-Q611 PolarHBondContact O-N 3.14Å; Q611-R613 PolarHBondContact O-N 2.77Å |
| 612 | R | 38.8 | Very low | 48.7 | Very low | 238 Ų | 238 | 126.1 Ų | 126.1 | 90% | 0.898 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 123.5 | -173.9 | -68.1 | 175.7 | 174.3 | 165.5 | -2.8 | 110 | | |
| 613 | R | 33.5 | Very low | 46.4 | Very low | 224 Ų | 224 | 127 Ų | 127 | 85% | 0.845 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 140.2 | 157.7 | -75.3 | -176.2 | 175.6 | 168.3 | -0.7 | 109.1 | Q611 V615 | Q611-R613 PolarHBondContact O-N 2.77Å; R613-V615 PolarHBondContact O-N 3.41Å |
| 614 | P | 39.1 | Very low | 44.5 | Very low | 129 Ų | 129 | 127.4 Ų | 127.4 | 84% | 0.838 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 133.9 | 163.3 | -19.1 | 32.1 | 0 | 0 | 0 | 109.7 | | |
| 615 | V | 35.8 | Very low | 43.1 | Very low | 132 Ų | 132 | 131.4 Ų | 131.4 | 80% | 0.8 | 79% | 0.79 | S | S | * | * | | | trans | -107.1 | 130 | 175.7 | 174.4 | 0 | 0 | 0 | 0 | 107.8 | R613 | R613-V615 PolarHBondContact O-N 3.41Š|
| 616 | L | 38.3 | Very low | 41.6 | Very low | 155 Ų | 155 | 138 Ų | 138 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | | | trans | -65.9 | 135.4 | 171.7 | -83.5 | 79.3 | 0 | 0 | 0 | 109.5 | S618 | L616-S618 PolarHBondContact O-N 3.38Å; L616-S618 VanDerWaalsContact O-N 3.14Å |
| 617 | P | 43.9 | Very low | 40.7 | Very low | 127 Ų | 127 | 138.9 Ų | 138.9 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | | | trans | -70.6 | 109.7 | 175.9 | 28.6 | -33.2 | 0 | 0 | 0 | 110.4 | | |
| 618 | S | 33.3 | Very low | 39.8 | Very low | 118 Ų | 118 | 144.2 Ų | 144.2 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | | | trans | -75.7 | 134.1 | 165.9 | -173.5 | 0 | 0 | 0 | 0 | 109.7 | L616 | L616-S618 PolarHBondContact O-N 3.38Å; L616-S618 VanDerWaalsContact O-N 3.14Å |
| 619 | V | 41.9 | Very low | 39.1 | Very low | 145 Ų | 145 | 143.3 Ų | 143.3 | 88% | 0.879 | 81% | 0.807 | S | S | * | * | | | trans | -70.5 | 141.1 | 175.2 | 177.8 | 0 | 0 | 0 | 0 | 110.3 | | |
| 620 | G | 33.8 | Very low | 38.5 | Very low | 59 Ų | 59 | 150.9 Ų | 150.9 | 61% | 0.608 | 82% | 0.818 | S | S | * | * | | | trans | -156.6 | 153.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | | |
| 621 | P | 40.4 | Very low | 37.6 | Very low | 132 Ų | 132 | 149.8 Ų | 149.8 | 86% | 0.857 | 81% | 0.813 | S | S | * | * | | | trans | -85.9 | 157.8 | -161.1 | -12 | 30.9 | 0 | 0 | 0 | 115.3 | | |
| 622 | P | 53.8 | Low | 37.3 | Very low | 115 Ų | 115 | 150 Ų | 150 | 75% | 0.747 | 81% | 0.807 | S | S | * | * | | | trans | -96.4 | 150.5 | -177.2 | 37.3 | -34.5 | 0 | 0 | 0 | 114.2 | | |
| 623 | H | 33 | Very low | 36.9 | Very low | 187 Ų | 187 | 147.3 Ų | 147.3 | 87% | 0.866 | 81% | 0.805 | S | S | * | * | | | trans | -154.6 | 163.1 | 162.7 | -99.8 | -46.8 | 0 | 0 | 0 | 111.1 | | |
| 624 | P | 41.7 | Very low | 37 | Very low | 107 Ų | 107 | 143.4 Ų | 143.4 | 70% | 0.695 | 81% | 0.806 | S | S | * | * | | | trans | -97.4 | 171.4 | -130.2 | -7 | 28.2 | 0 | 0 | 0 | 116.8 | | |
| 625 | P | 45.3 | Very low | 36.6 | Very low | 121 Ų | 121 | 140.8 Ų | 140.8 | 79% | 0.786 | 80% | 0.802 | S | S | * | * | | | trans | -86 | 158.7 | -176 | 35.8 | -35.9 | 0 | 0 | 0 | 113.7 | | |
| 626 | F | 32.8 | Very low | 36.4 | Very low | 210 Ų | 210 | 143.4 Ų | 143.4 | 92% | 0.921 | 81% | 0.806 | S | S | * | * | | | trans | -126.3 | 136.3 | 160.6 | -93 | -88 | 0 | 0 | 0 | 110.7 | | |
| 627 | L | 37.6 | Very low | 36.1 | Very low | 162 Ų | 162 | 140 Ų | 140 | 85% | 0.848 | 80% | 0.8 | S | S | * | * | | | trans | -89.8 | 143.6 | 170.8 | -64.6 | 169.1 | 0 | 0 | 0 | 109.5 | | |
| 628 | H | 31.2 | Very low | 35.7 | Very low | 195 Ų | 195 | 141.2 Ų | 141.2 | 90% | 0.903 | 80% | 0.799 | S | S | * | * | | | trans | -157.6 | 133.8 | 133.6 | -121.5 | -75.5 | 0 | 0 | 0 | 111.6 | | |
| 629 | A | 35.1 | Very low | 35.6 | Very low | 87 Ų | 87 | 146.5 Ų | 146.5 | 72% | 0.719 | 80% | 0.802 | S | S | * | * | | | trans | -97.1 | 148.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 630 | R | 30.7 | Very low | 34.9 | Very low | 213 Ų | 213 | 143.5 Ų | 143.5 | 80% | 0.804 | 80% | 0.8 | S | S | * | * | | | trans | -159.6 | 130.9 | 147.8 | -117.4 | 173.9 | -176.1 | -160.9 | -1.1 | 111.1 | Y632 | R630-Y632 HydrophobicContact CG-CE2 4.38Š|
| 631 | C | 29.8 | Very low | 34.9 | Very low | 116 Ų | 116 | 145.4 Ų | 145.4 | 78% | 0.784 | 81% | 0.81 | S | S | * | * | | | trans | -97.3 | 146.3 | 170.2 | -49.9 | 0 | 0 | 0 | 0 | 108.9 | | |
| 632 | Y | 33 | Very low | 35.3 | Very low | 178 Ų | 178 | 145.2 Ų | 145.2 | 70% | 0.698 | 81% | 0.809 | S | S | * | * | | | trans | -147.6 | 171.6 | 157.5 | -82.2 | -62.8 | 0 | 0 | 0 | 110.1 | R630 | R630-Y632 HydrophobicContact CG-CE2 4.38Š|
| 633 | E | 31.6 | Very low | 34.2 | Very low | 182 Ų | 182 | 145.6 Ų | 145.6 | 85% | 0.85 | 82% | 0.815 | S | S | * | * | | | trans | -105.7 | -177.5 | -142 | -68.3 | 165.8 | 98.1 | 0 | 0 | 116.5 | | |
| 634 | V | 34.2 | Very low | 34.3 | Very low | 142 Ų | 142 | 145.2 Ų | 145.2 | 86% | 0.861 | 81% | 0.813 | S | S | * | * | | | trans | -73.2 | 144.4 | -178.2 | 173.6 | 0 | 0 | 0 | 0 | 112.4 | | |
| 635 | G | 30.3 | Very low | 34 | Very low | 74 Ų | 74 | 144.4 Ų | 144.4 | 76% | 0.763 | 82% | 0.816 | S | S | * | * | | | trans | -152.9 | 149.6 | 164.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | | |
| 636 | Q | 32.7 | Very low | 34.1 | Very low | 187 Ų | 187 | 144.5 Ų | 144.5 | 87% | 0.874 | 82% | 0.816 | S | S | * | * | | | trans | -124.2 | 160.6 | -177.4 | -70.8 | -173.1 | -8.6 | 0 | 0 | 112.8 | | |
| 637 | A | 32.6 | Very low | 34.3 | Very low | 84 Ų | 84 | 141 Ų | 141 | 69% | 0.694 | 81% | 0.806 | S | S | * | * | | | trans | 93.9 | 113.3 | 145.7 | 0 | 0 | 0 | 0 | 0 | 121.8 | | |
| 638 | L | 34.8 | Very low | 34.8 | Very low | 151 Ų | 151 | 139.1 Ų | 139.1 | 79% | 0.791 | 80% | 0.804 | S | S | * | * | | | | 84 | 124.8 | 128.2 | -65.1 | 170.2 | 0 | 0 | 0 | 123.5 | | |
| 639 | Y | 31.3 | Very low | 35.1 | Very low | 230 Ų | 230 | 137.6 Ų | 137.6 | 90% | 0.902 | 80% | 0.797 | S | S | * | * | | | trans | 59.3 | 128.9 | 151.8 | -77.4 | -72.4 | 0 | 0 | 0 | 122.9 | | |
| 640 | G | 27.4 | Very low | 35.1 | Very low | 81 Ų | 81 | 138.4 Ų | 138.4 | 84% | 0.835 | 80% | 0.797 | S | S | * | * | | | trans | 158.5 | 110.7 | 155.5 | 0 | 0 | 0 | 0 | 0 | 117.1 | | |
| 641 | A | 33 | Very low | 35.5 | Very low | 99 Ų | 99 | 139 Ų | 139 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | | | trans | -160.4 | 144.1 | 163.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | | |
| 642 | P | 49.7 | Very low | 35.8 | Very low | 129 Ų | 129 | 138.2 Ų | 138.2 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | | | | -156.4 | 173.8 | 77.2 | 41.8 | -22.4 | 0 | 0 | 0 | 117.5 | | |
| 643 | S | 31 | Very low | 35.7 | Very low | 123 Ų | 123 | 138.9 Ų | 138.9 | 86% | 0.86 | 80% | 0.802 | S | S | * | * | | | trans | -166 | 167.8 | 146.2 | -164.6 | 0 | 0 | 0 | 0 | 110.5 | | |
| 644 | Q | 35.5 | Very low | 36 | Very low | 178 Ų | 178 | 136.7 Ų | 136.7 | 83% | 0.832 | 80% | 0.802 | S | S | * | * | | | trans | -138.7 | 157 | -163.1 | -59.7 | -173.9 | 1.1 | 0 | 0 | 117.3 | | |
| 645 | A | 34.2 | Very low | 36.1 | Very low | 91 Ų | 91 | 133.7 Ų | 133.7 | 75% | 0.752 | 79% | 0.792 | S | S | * | * | | | trans | 70.4 | 163.9 | 141.6 | 0 | 0 | 0 | 0 | 0 | 119 | | |
| 646 | P | 47.3 | Very low | 36.5 | Very low | 123 Ų | 123 | 135.3 Ų | 135.3 | 80% | 0.799 | 79% | 0.788 | S | S | * | * | | | cis | -125.5 | 172.7 | 6.1 | 41 | -25.8 | 0 | 0 | 0 | 117.3 | | |
| 647 | L | 37.3 | Very low | 36.9 | Very low | 135 Ų | 135 | 132.7 Ų | 132.7 | 71% | 0.707 | 79% | 0.788 | S | S | * | * | | | trans | -103.8 | 171.8 | 173.9 | -70.7 | 169.2 | 0 | 0 | 0 | 111.8 | | |
| 648 | P | 48.1 | Very low | 37.1 | Very low | 124 Ų | 124 | 135.1 Ų | 135.1 | 81% | 0.805 | 79% | 0.794 | S | S | * | * | | | | -126.6 | 170.8 | 109.8 | 36.2 | -31.1 | 0 | 0 | 0 | 114.8 | | |
| 649 | H | 37.5 | Very low | 37.1 | Very low | 163 Ų | 163 | 133.2 Ų | 133.2 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | | | trans | -104.5 | 171.7 | -166.9 | -49.5 | 75.5 | 0 | 0 | 0 | 110.8 | | |
| 650 | S | 36 | Very low | 37.8 | Very low | 103 Ų | 103 | 125.6 Ų | 125.6 | 72% | 0.72 | 79% | 0.785 | S | S | * | * | | | cis | -160.5 | -163.9 | 23.3 | 53.5 | 0 | 0 | 0 | 0 | 108.1 | | |
| 651 | R | 38.1 | Very low | 38.2 | Very low | 226 Ų | 226 | 132.7 Ų | 132.7 | 85% | 0.853 | 79% | 0.786 | S | S | * | * | | | cis | -163.1 | 170.6 | 10.2 | -149.3 | 163.1 | -179.3 | 175.1 | -0.2 | 109.6 | | |
| 652 | S | 35.9 | Very low | 38.3 | Very low | 99 Ų | 99 | 137.6 Ų | 137.6 | 69% | 0.692 | 79% | 0.785 | S | S | * | * | | | | -166.1 | 114.7 | -89 | 53.3 | 0 | 0 | 0 | 0 | 111.1 | | |
| 653 | F | 32.5 | Very low | 37.8 | Very low | 192 Ų | 192 | 141.5 Ų | 141.5 | 84% | 0.842 | 79% | 0.785 | S | S | * | * | | | trans | -147.1 | 108.9 | 160.6 | -163.3 | -94.9 | 0 | 0 | 0 | 112.9 | | |
| 654 | T | 37.2 | Very low | 38.3 | Very low | 137 Ų | 137 | 139 Ų | 139 | 84% | 0.84 | 77% | 0.771 | S | S | * | * | | | trans | -147.1 | 124.8 | 171 | 45.4 | 0 | 0 | 0 | 0 | 108.3 | | |
| 655 | A | 35.4 | Very low | 38.5 | Very low | 79 Ų | 79 | 136.8 Ų | 136.8 | 65% | 0.653 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 152.3 | 173 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 656 | P | 40 | Very low | 39 | Very low | 107 Ų | 107 | 141.3 Ų | 141.3 | 70% | 0.695 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 151 | -176.8 | 31.1 | -35.7 | 0 | 0 | 0 | 112.7 | V658 | P656-V658 PolarHBondContact O-N 3.07Š|
| 657 | P | 40.1 | Very low | 38.9 | Very low | 132 Ų | 132 | 142.2 Ų | 142.2 | 86% | 0.857 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 121 | 170.3 | 29.7 | -33 | 0 | 0 | 0 | 110.1 | | |
| 658 | V | 36.2 | Very low | 39.1 | Very low | 136 Ų | 136 | 146 Ų | 146 | 82% | 0.824 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 134.8 | 175.9 | -179.7 | 0 | 0 | 0 | 0 | 109.6 | P656 | P656-V658 PolarHBondContact O-N 3.07Š|
| 659 | S | 36.6 | Very low | 39 | Very low | 110 Ų | 110 | 144.5 Ų | 144.5 | 77% | 0.769 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -65 | 158.1 | -179.8 | -164.6 | 0 | 0 | 0 | 0 | 112.7 | | |
| 660 | G | 45.3 | Very low | 39.4 | Very low | 71 Ų | 71 | 141.5 Ų | 141.5 | 73% | 0.732 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 138.2 | -167.9 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 661 | R | 34.9 | Very low | 39.8 | Very low | 230 Ų | 230 | 144 Ų | 144 | 87% | 0.868 | 76% | 0.757 | S | S | * | * | | | trans | -126 | 140.9 | 167.4 | -76.3 | -73.2 | 178.9 | 156.3 | -3.2 | 108.8 | | |
| 662 | Y | 36.1 | Very low | 40 | Very low | 201 Ų | 201 | 139.4 Ų | 139.4 | 79% | 0.788 | 75% | 0.749 | S | S | * | * | | | trans | -69 | 143.3 | -178.1 | -76.4 | -107.2 | 0 | 0 | 0 | 110.7 | A664 | Y662-A664 VanDerWaalsContact C-N 3.33Š|
| 663 | Y | 39.2 | Very low | 40.2 | Very low | 212 Ų | 212 | 138.5 Ų | 138.5 | 83% | 0.831 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -90.4 | 7.1 | 177.3 | -116 | -84.9 | 0 | 0 | 0 | 113.6 | | |
| 664 | A | 41 | Very low | 40.6 | Very low | 69 Ų | 69 | 132.1 Ų | 132.1 | 57% | 0.57 | 73% | 0.726 | S | S | * | * | | | trans | -76.3 | -32.3 | -174 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y662 F666 | Y662-A664 VanDerWaalsContact C-N 3.33Å; A664-F666 PolarHBondContact O-N 2.88Å; A664-F666 VanDerWaalsContact O-N 3.12Å |
| 665 | D | 40 | Very low | 40.7 | Very low | 132 Ų | 132 | 134.8 Ų | 134.8 | 71% | 0.706 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | 0.9 | -162.9 | -55.7 | -24.4 | 0 | 0 | 0 | 114.8 | | |
| 666 | F | 44.2 | Very low | 41.1 | Very low | 186 Ų | 186 | 137.3 Ų | 137.3 | 82% | 0.816 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.7 | 4 | -175.2 | -77.4 | -71.6 | 0 | 0 | 0 | 115.4 | A664 | A664-F666 PolarHBondContact O-N 2.88Å; A664-F666 VanDerWaalsContact O-N 3.12Å |
| 667 | L | 44.6 | Very low | 41.4 | Very low | 143 Ų | 143 | 136.2 Ų | 136.2 | 75% | 0.749 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -107 | -4.9 | -177.6 | -68.4 | 178.8 | 0 | 0 | 0 | 115.6 | | |
| 668 | Y | 43.2 | Very low | 41.5 | Very low | 213 Ų | 213 | 136.1 Ų | 136.1 | 84% | 0.835 | 71% | 0.709 | S | S | * | * | | | trans | -142.6 | 106.7 | 176.7 | -90.9 | -87.4 | 0 | 0 | 0 | 113.3 | P670 | Y668-P670 WeakPolarHBondContact O-CD 3.38Š|
| 669 | P | 44.8 | Very low | 41.8 | Very low | 94 Ų | 94 | 136.4 Ų | 136.4 | 61% | 0.61 | 71% | 0.705 | S | S | * | * | | | trans | -77.7 | 114.1 | 155.9 | -8.5 | 26.3 | 0 | 0 | 0 | 109 | E671 | P669-E671 PolarHBondContact O-N 3.2Š|
| 670 | P | 46.4 | Very low | 42.2 | Very low | 99 Ų | 99 | 136.3 Ų | 136.3 | 64% | 0.643 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.6 | -7.6 | -174.8 | 30.6 | -36.1 | 0 | 0 | 0 | 114.1 | Y668 L672 S673 | Y668-P670 WeakPolarHBondContact O-CD 3.38Å; P670-L672 VanDerWaalsContact C-N 3.35Å; P670-L672 PolarHBondContact O-N 2.82Å; P670-S673 PolarHBondContact O-OG 3.16Å; P670-S673 VanDerWaalsContact O-OG 3.1Å |
| 671 | E | 44.7 | Very low | 42.1 | Very low | 156 Ų | 156 | 140.9 Ų | 140.9 | 73% | 0.729 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -76.6 | -17.9 | -170.6 | -57.8 | -177.2 | 163.5 | 0 | 0 | 114.1 | P669 | P669-E671 PolarHBondContact O-N 3.2Å |
| 672 | L | 41.1 | Very low | 42.3 | Very low | 129 Ų | 129 | 139.5 Ų | 139.5 | 68% | 0.675 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -86.4 | -24.2 | -176.5 | -65.1 | -179.8 | 0 | 0 | 0 | 114.1 | P670 | P670-L672 VanDerWaalsContact C-N 3.35Å; P670-L672 PolarHBondContact O-N 2.82Å |
| 673 | S | 40.2 | Very low | 42.1 | Very low | 81 Ų | 81 | 132.8 Ų | 132.8 | 57% | 0.566 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -72.5 | -41.8 | 176.7 | 51.7 | 0 | 0 | 0 | 0 | 111.6 | P670 R675 L676 S677 | P670-S673 PolarHBondContact O-OG 3.16Å; P670-S673 VanDerWaalsContact O-OG 3.1Å; S673-R675 PolarHBondContact O-N 3.02Å; S673-L676 PolarHBondContact O-N 2.99Å; S673-L676 VanDerWaalsContact O-N 3.16Å; S673-S677 PolarHBondContact O-OG 2.91Å |
| 674 | A | 42.3 | Very low | 41.9 | Very low | 58 Ų | 58 | 132.2 Ų | 132.2 | 48% | 0.479 | 71% | 0.707 | S | S | . | * | H | α-helix | trans | -55.8 | -35.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | L676 | A674-L676 VanDerWaalsContact C-N 3.31Å; A674-L676 PolarHBondContact O-N 3.37Å |
| 675 | R | 39.2 | Very low | 41.6 | Very low | 193 Ų | 193 | 137.5 Ų | 137.5 | 73% | 0.728 | 72% | 0.72 | S | S | * | * | H | α-helix | trans | -76.9 | -7.3 | -177.9 | -75.8 | -61 | -153.7 | 169 | 5.9 | 115.8 | S673 | S673-R675 PolarHBondContact O-N 3.02Å |
| 676 | L | 43.9 | Very low | 41.2 | Very low | 131 Ų | 131 | 135.8 Ų | 135.8 | 69% | 0.686 | 72% | 0.718 | S | S | * | * | H | α-helix | trans | -104.3 | -22.6 | 178 | -68.5 | 174 | 0 | 0 | 0 | 113.1 | S673 A674 | S673-L676 PolarHBondContact O-N 2.99Å; S673-L676 VanDerWaalsContact O-N 3.16Å; A674-L676 VanDerWaalsContact C-N 3.31Å; A674-L676 PolarHBondContact O-N 3.37Å |
| 677 | S | 45.5 | Very low | 40.6 | Very low | 84 Ų | 84 | 132.7 Ų | 132.7 | 59% | 0.587 | 72% | 0.72 | S | S | * | * | H | α-helix | trans | -67 | -34.5 | 177.5 | -54.9 | 0 | 0 | 0 | 0 | 113.3 | S673 L679 | S673-S677 PolarHBondContact O-OG 2.91Å; S677-L679 PolarHBondContact O-N 2.97Å; S677-L679 VanDerWaalsContact O-N 3.11Å |
| 678 | D | 41.5 | Very low | 39.8 | Very low | 131 Ų | 131 | 131.4 Ų | 131.4 | 70% | 0.701 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | 2.1 | -174.3 | -66.8 | -15.2 | 0 | 0 | 0 | 114.7 | | |
| 679 | L | 44.4 | Very low | 39.4 | Very low | 141 Ų | 141 | 126.9 Ų | 126.9 | 74% | 0.738 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.5 | 4.6 | -174.2 | -76.1 | 171.7 | 0 | 0 | 0 | 114.8 | S677 | S677-L679 PolarHBondContact O-N 2.97Å; S677-L679 VanDerWaalsContact O-N 3.11Å |
| 680 | T | 44.2 | Very low | 38.9 | Very low | 108 Ų | 108 | 128.9 Ų | 128.9 | 66% | 0.663 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -139.6 | 87.9 | 177.8 | 53.8 | 0 | 0 | 0 | 0 | 112.4 | | |
| 681 | L | 42.2 | Very low | 38.5 | Very low | 168 Ų | 168 | 130.1 Ų | 130.1 | 88% | 0.88 | 73% | 0.734 | S | S | * | * | | | trans | 174.1 | 83.4 | 138.3 | -95.1 | 163.6 | 0 | 0 | 0 | 111.4 | | |
| 682 | E | 39.4 | Very low | 37.9 | Very low | 200 Ų | 200 | 131 Ų | 131 | 94% | 0.935 | 74% | 0.738 | S | S | * | * | | | trans | -132.5 | 103.8 | 158.2 | -85.7 | -66.6 | 167.3 | 0 | 0 | 106.1 | | |
| 683 | G | 33.1 | Very low | 37.7 | Very low | 60 Ų | 60 | 131 Ų | 131 | 62% | 0.619 | 74% | 0.744 | S | S | * | * | | | trans | 170.5 | 88.5 | -168.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | | |
| 684 | E | 33.6 | Very low | 38.2 | Very low | 201 Ų | 201 | 133 Ų | 133 | 94% | 0.939 | 76% | 0.755 | S | S | * | * | | | trans | 72.9 | 159 | 159.4 | -50.6 | -163.5 | 119.8 | 0 | 0 | 118.5 | | |
| 685 | Q | 34.5 | Very low | 37.9 | Very low | 180 Ų | 180 | 133.4 Ų | 133.4 | 84% | 0.841 | 76% | 0.764 | S | S | * | * | | | trans | -147.8 | 158.6 | -156.7 | -70 | -174.2 | -3.9 | 0 | 0 | 114.5 | | |
| 686 | S | 31.9 | Very low | 37.9 | Very low | 95 Ų | 95 | 130.8 Ų | 130.8 | 66% | 0.664 | 77% | 0.769 | S | S | * | * | | | trans | 76.5 | 125.3 | 144.7 | -67.3 | 0 | 0 | 0 | 0 | 122 | | |
| 687 | S | 31.9 | Very low | 37.7 | Very low | 121 Ų | 121 | 131.9 Ų | 131.9 | 85% | 0.846 | 78% | 0.775 | S | S | * | * | | | trans | 68.8 | 144 | 147.9 | 72.4 | 0 | 0 | 0 | 0 | 117.8 | | |
| 688 | S | 28.8 | Very low | 37.3 | Very low | 116 Ų | 116 | 138 Ų | 138 | 81% | 0.811 | 81% | 0.809 | S | S | * | * | | | cis | -159.1 | 178.7 | -7 | 58.1 | 0 | 0 | 0 | 0 | 108.1 | | |
| 689 | S | 33.3 | Very low | 37.1 | Very low | 118 Ų | 118 | 138.4 Ų | 138.4 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | | | cis | -140.7 | -129.5 | 10.7 | 60.6 | 0 | 0 | 0 | 0 | 112.2 | | |
| 690 | D | 35.7 | Very low | 36.8 | Very low | 137 Ų | 137 | 138.3 Ų | 138.3 | 73% | 0.733 | 82% | 0.818 | S | S | * | * | | | trans | -158.4 | 152.9 | -168.6 | -164.4 | -11 | 0 | 0 | 0 | 110.8 | | |
| 691 | T | 36.2 | Very low | 36.3 | Very low | 125 Ų | 125 | 139.9 Ų | 139.9 | 77% | 0.767 | 83% | 0.827 | S | S | * | * | | | trans | -169.5 | 120.8 | 133.3 | 22.5 | 0 | 0 | 0 | 0 | 115.2 | | |
| 692 | Q | 32.1 | Very low | 36 | Very low | 175 Ų | 175 | 138.3 Ų | 138.3 | 82% | 0.818 | 82% | 0.824 | S | S | * | * | | | trans | 76.8 | 108.8 | 143 | -70.6 | -176 | -64.1 | 0 | 0 | 122.9 | | |
| 693 | T | 37 | Very low | 35.8 | Very low | 129 Ų | 129 | 134.4 Ų | 134.4 | 79% | 0.791 | 82% | 0.817 | S | S | * | * | | | trans | -65.6 | -180 | 142.7 | 43.3 | 0 | 0 | 0 | 0 | 112.5 | | |
| 694 | P | 50.7 | Low | 36 | Very low | 123 Ų | 123 | 139.4 Ų | 139.4 | 80% | 0.799 | 83% | 0.83 | S | S | * | * | | | cis | -118.8 | -175 | 0.3 | 42.5 | -27.6 | 0 | 0 | 0 | 112.6 | | |
| 695 | G | 36 | Very low | 36.1 | Very low | 65 Ų | 65 | 135 Ų | 135 | 67% | 0.67 | 82% | 0.822 | S | S | * | * | | | cis | 106.4 | 117.3 | 8.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 696 | T | 40.2 | Very low | 36.2 | Very low | 138 Ų | 138 | 131.5 Ų | 131.5 | 85% | 0.847 | 82% | 0.821 | S | S | * | * | | | trans | -179.6 | 159.5 | 157.6 | -76.4 | 0 | 0 | 0 | 0 | 110.2 | | |
| 697 | L | 39 | Very low | 36.6 | Very low | 155 Ų | 155 | 134.6 Ų | 134.6 | 81% | 0.812 | 83% | 0.834 | S | S | * | * | | | trans | -51.7 | 157.2 | 173.8 | -64.8 | 85.6 | 0 | 0 | 0 | 112.7 | | |
| 698 | V | 38.4 | Very low | 37 | Very low | 213 Ų | 213 | 135.8 Ų | 135.8 | 100% | 1.291 | 83% | 0.833 | S | S | * | * | | | cis | -136.5 | 0 | 41.6 | 170.8 | 0 | 0 | 0 | 0 | 112.6 | | |