| 1 | M | 42.8 | Very low | 43.5 | Very low | 240 Ų | 240 | 124.6 Ų | 124.6 | 100% | 1.182 | 84% | 0.842 | S | S | * | * | | | | 0 | 90.7 | 0 | -72.2 | 152.1 | 159.9 | 0 | 0 | 104.9 | | |
| 2 | E | 44.9 | Very low | 42.7 | Very low | 184 Ų | 184 | 119.6 Ų | 119.6 | 86% | 0.86 | 83% | 0.827 | S | S | * | * | | | | 61.4 | 119.8 | 99 | -97.6 | -121.2 | 89.7 | 0 | 0 | 110.1 | | |
| 3 | S | 47.4 | Very low | 42 | Very low | 93 Ų | 93 | 119.2 Ų | 119.2 | 65% | 0.65 | 83% | 0.825 | S | S | * | * | | | cis | -163.5 | 152.4 | 20.8 | -45.2 | 0 | 0 | 0 | 0 | 110 | | |
| 4 | G | 44.7 | Very low | 41.9 | Very low | 73 Ų | 73 | 118.8 Ų | 118.8 | 75% | 0.753 | 82% | 0.823 | S | S | * | * | | | | 83.2 | 121 | 127.3 | 0 | 0 | 0 | 0 | 0 | 120.1 | | |
| 5 | P | 50.9 | Low | 41.4 | Very low | 127 Ų | 127 | 124.3 Ų | 124.3 | 83% | 0.825 | 83% | 0.83 | S | S | * | * | | | trans | -93.4 | 149.2 | -168.4 | 37.4 | -33.9 | 0 | 0 | 0 | 114 | | |
| 6 | G | 44 | Very low | 40.7 | Very low | 77 Ų | 77 | 122.1 Ų | 122.1 | 79% | 0.794 | 82% | 0.824 | S | S | * | * | | | trans | -117 | 101.9 | 160.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | | |
| 7 | Q | 46.3 | Very low | 40.6 | Very low | 193 Ų | 193 | 122.5 Ų | 122.5 | 90% | 0.902 | 82% | 0.822 | S | S | * | * | | | trans | -52 | 139 | 163.3 | -67.1 | 165.2 | 63.7 | 0 | 0 | 108.1 | | |
| 8 | G | 40.8 | Very low | 40 | Very low | 72 Ų | 72 | 125.6 Ų | 125.6 | 74% | 0.742 | 82% | 0.823 | S | S | * | * | | | cis | 123.9 | 122.8 | 34.8 | 0 | 0 | 0 | 0 | 0 | 107.1 | | |
| 9 | A | 42.8 | Very low | 39.6 | Very low | 105 Ų | 105 | 123.2 Ų | 123.2 | 87% | 0.868 | 81% | 0.814 | S | S | * | * | | | trans | 79.4 | 93.7 | 167.5 | 0 | 0 | 0 | 0 | 0 | 119.2 | | |
| 10 | G | 37.5 | Very low | 39.3 | Very low | 72 Ų | 72 | 125.9 Ų | 125.9 | 74% | 0.742 | 82% | 0.815 | S | S | * | * | | | | -71.8 | 176.2 | 127.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | | |
| 11 | S | 36.4 | Very low | 39.9 | Very low | 135 Ų | 135 | 124 Ų | 124 | 94% | 0.944 | 80% | 0.803 | S | S | * | * | | | cis | -169.4 | 153.9 | 5.1 | -120.8 | 0 | 0 | 0 | 0 | 104.7 | | |
| 12 | G | 33.5 | Very low | 39.9 | Very low | 64 Ų | 64 | 117.8 Ų | 117.8 | 66% | 0.66 | 78% | 0.781 | S | S | * | * | | | trans | 155.8 | 81.7 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | | |
| 13 | S | 34.3 | Very low | 39.2 | Very low | 114 Ų | 114 | 115.9 Ų | 115.9 | 80% | 0.797 | 77% | 0.774 | S | S | * | * | | | | 88.6 | 122.5 | 97.5 | 61.7 | 0 | 0 | 0 | 0 | 110.6 | | |
| 14 | S | 40.6 | Very low | 38.3 | Very low | 114 Ų | 114 | 118.1 Ų | 118.1 | 80% | 0.797 | 78% | 0.775 | S | S | * | * | | | cis | -157.8 | 144.2 | 14.2 | -78.2 | 0 | 0 | 0 | 0 | 110.6 | | |
| 15 | Q | 33.4 | Very low | 37.6 | Very low | 201 Ų | 201 | 123.7 Ų | 123.7 | 94% | 0.939 | 77% | 0.773 | S | S | * | * | | | trans | 15.7 | 129.3 | 156.2 | -73.3 | 175.7 | 21.1 | 0 | 0 | 120.7 | | |
| 16 | A | 30.9 | Very low | 36.7 | Very low | 89 Ų | 89 | 125.1 Ų | 125.1 | 74% | 0.736 | 77% | 0.771 | S | S | * | * | | | trans | -127.4 | 143.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | | |
| 17 | V | 38.8 | Very low | 36.2 | Very low | 130 Ų | 130 | 128 Ų | 128 | 79% | 0.788 | 77% | 0.773 | S | S | * | * | | | trans | 92.8 | 143.7 | 136.9 | -174 | 0 | 0 | 0 | 0 | 119.5 | | |
| 18 | E | 30.5 | Very low | 35.6 | Very low | 177 Ų | 177 | 124.1 Ų | 124.1 | 83% | 0.827 | 77% | 0.767 | S | S | * | * | | | trans | 96.8 | 125.5 | 177 | -62.5 | -77.6 | 84.4 | 0 | 0 | 114.3 | | |
| 19 | A | 32.9 | Very low | 36.1 | Very low | 80 Ų | 80 | 125.8 Ų | 125.8 | 66% | 0.661 | 77% | 0.765 | S | S | * | * | | | cis | -165.4 | 150.1 | 8 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 20 | E | 32.3 | Very low | 35.7 | Very low | 177 Ų | 177 | 128.8 Ų | 128.8 | 83% | 0.827 | 77% | 0.765 | S | S | * | * | | | trans | 56.4 | 162.1 | 145.8 | -104.2 | -95.5 | 115.7 | 0 | 0 | 122.6 | | |
| 21 | P | 51.3 | Low | 35.4 | Very low | 88 Ų | 88 | 128.6 Ų | 128.6 | 57% | 0.571 | 76% | 0.763 | S | S | * | * | | | | -115.2 | -176.7 | -95.5 | 49 | -35.9 | 0 | 0 | 0 | 112.1 | | |
| 22 | P | 42.8 | Very low | 35.2 | Very low | 109 Ų | 109 | 134.7 Ų | 134.7 | 71% | 0.708 | 77% | 0.765 | S | S | * | * | | | | -159.1 | 170.3 | 65.3 | 40.8 | -16.3 | 0 | 0 | 0 | 118.5 | | |
| 23 | I | 30.4 | Very low | 35 | Very low | 143 Ų | 143 | 134.7 Ų | 134.7 | 73% | 0.733 | 77% | 0.765 | S | S | * | * | | | trans | 60.2 | 138.7 | 139.2 | -62.5 | -96.3 | 0 | 0 | 0 | 121.3 | | |
| 24 | Q | 29.2 | Very low | 35 | Very low | 141 Ų | 141 | 140.9 Ų | 140.9 | 66% | 0.659 | 77% | 0.771 | S | S | * | * | | | trans | 97.6 | 111.6 | 150 | -89 | 169 | 111.1 | 0 | 0 | 121.9 | | |
| 25 | R | 30.6 | Very low | 34.7 | Very low | 190 Ų | 190 | 143.1 Ų | 143.1 | 72% | 0.717 | 77% | 0.774 | S | S | * | * | | | | 70.3 | 127.2 | 113.2 | -158.4 | -170.6 | -85.3 | 136.6 | -0.5 | 120.2 | | |
| 26 | M | 32.3 | Very low | 34.7 | Very low | 157 Ų | 157 | 138.9 Ų | 138.9 | 77% | 0.773 | 77% | 0.773 | S | S | * | * | | | trans | 60.8 | 124.2 | 150.1 | -83.5 | 167.3 | 153.3 | 0 | 0 | 118.9 | | |
| 27 | T | 33.3 | Very low | 34.7 | Very low | 137 Ų | 137 | 138.3 Ų | 138.3 | 84% | 0.84 | 78% | 0.776 | S | S | * | * | | | | 162.2 | 136.1 | 106.1 | 41.5 | 0 | 0 | 0 | 0 | 110.9 | | |
| 28 | S | 32.2 | Very low | 34.4 | Very low | 112 Ų | 112 | 140.8 Ų | 140.8 | 78% | 0.783 | 78% | 0.784 | S | S | * | * | | | trans | -68.3 | -167.4 | 167.3 | -40.3 | 0 | 0 | 0 | 0 | 111 | | |
| 29 | P | 51.2 | Low | 34.7 | Very low | 106 Ų | 106 | 137 Ų | 137 | 69% | 0.688 | 78% | 0.782 | S | S | * | * | | | cis | -144.2 | -162.1 | -2.1 | 28.1 | -0.2 | 0 | 0 | 0 | 114.6 | | |
| 30 | I | 35.5 | Very low | 34.9 | Very low | 169 Ų | 169 | 138.1 Ų | 138.1 | 87% | 0.867 | 79% | 0.786 | S | S | * | * | | | trans | 95 | 123.1 | 155.6 | -54.4 | 157.5 | 0 | 0 | 0 | 115.5 | | |
| 31 | G | 31 | Very low | 35 | Very low | 68 Ų | 68 | 136.2 Ų | 136.2 | 70% | 0.701 | 79% | 0.79 | S | S | * | * | | | cis | 172.9 | -178.7 | 1 | 0 | 0 | 0 | 0 | 0 | 114.2 | | |
| 32 | R | 32 | Very low | 34.5 | Very low | 262 Ų | 262 | 140.2 Ų | 140.2 | 99% | 0.989 | 80% | 0.799 | S | S | * | * | | | trans | 66.1 | 121.6 | 152.4 | -162.5 | -177.5 | -81.1 | -131 | 0.9 | 116.9 | | |
| 33 | G | 29.5 | Very low | 34.5 | Very low | 64 Ų | 64 | 143.1 Ų | 143.1 | 66% | 0.66 | 80% | 0.802 | S | S | * | * | | | cis | 146.5 | 136.8 | 6 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 34 | R | 34.7 | Very low | 35.4 | Very low | 244 Ų | 244 | 142.8 Ų | 142.8 | 92% | 0.921 | 80% | 0.802 | S | S | * | * | | | trans | 163.1 | 98.3 | 141.7 | -90.8 | 167.6 | 74.1 | 168.7 | 1.9 | 114.6 | | |
| 35 | N | 34.2 | Very low | 36.1 | Very low | 162 Ų | 162 | 138.5 Ų | 138.5 | 87% | 0.866 | 80% | 0.795 | S | S | * | * | | | trans | 25.5 | 124.8 | 131.6 | -51.9 | -11.1 | 0 | 0 | 0 | 123.7 | | |
| 36 | A | 33.7 | Very low | 37 | Very low | 112 Ų | 112 | 137.4 Ų | 137.4 | 93% | 0.926 | 80% | 0.803 | S | S | * | * | | | | 162 | 132.8 | 121.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | | |
| 37 | G | 30.7 | Very low | 37.5 | Very low | 76 Ų | 76 | 137.1 Ų | 137.1 | 78% | 0.784 | 80% | 0.803 | S | S | * | * | | | cis | -177.3 | 166.8 | -2.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | | |
| 38 | L | 32.8 | Very low | 38 | Very low | 182 Ų | 182 | 135.9 Ų | 135.9 | 95% | 0.953 | 79% | 0.792 | S | S | * | * | | | trans | 92.3 | 121.6 | 161.3 | -149.9 | 68.7 | 0 | 0 | 0 | 120.9 | | |
| 39 | A | 36.9 | Very low | 38.7 | Very low | 97 Ų | 97 | 136.5 Ų | 136.5 | 80% | 0.802 | 79% | 0.791 | S | S | * | * | | | trans | 85.1 | 96.3 | 160.7 | 0 | 0 | 0 | 0 | 0 | 119.5 | | |
| 40 | S | 36.3 | Very low | 38.5 | Very low | 105 Ų | 105 | 140.8 Ų | 140.8 | 73% | 0.734 | 79% | 0.793 | S | S | * | * | | | trans | -79.8 | 130.2 | 168 | 171.3 | 0 | 0 | 0 | 0 | 110.8 | | |
| 41 | C | 34.7 | Very low | 38.8 | Very low | 136 Ų | 136 | 137.7 Ų | 137.7 | 92% | 0.919 | 79% | 0.786 | S | S | * | * | | | trans | -101.4 | 107 | 156.7 | -70.9 | 0 | 0 | 0 | 0 | 108.4 | | |
| 42 | K | 41.6 | Very low | 39 | Very low | 173 Ų | 173 | 141.7 Ų | 141.7 | 75% | 0.752 | 79% | 0.791 | S | S | * | * | | | trans | -77.8 | 114.3 | -174.3 | -151.1 | 168.6 | 178 | -177 | 0 | 108.6 | N44 | K42-N44 PolarHBondContact O-N 3.17Š|
| 43 | H | 42.8 | Very low | 39.5 | Very low | 169 Ų | 169 | 137.9 Ų | 137.9 | 78% | 0.782 | 79% | 0.787 | S | S | * | * | | | trans | -72.2 | 113.2 | 165.4 | 157.7 | -77.3 | 0 | 0 | 0 | 108 | | |
| 44 | N | 47.9 | Very low | 39.6 | Very low | 137 Ų | 137 | 140.7 Ų | 140.7 | 73% | 0.733 | 79% | 0.79 | S | S | * | * | | | trans | -101.9 | 119.9 | 162.5 | -76.3 | -0.3 | 0 | 0 | 0 | 107.8 | K42 | K42-N44 PolarHBondContact O-N 3.17Š|
| 45 | G | 44 | Very low | 39.7 | Very low | 50 Ų | 50 | 137.4 Ų | 137.4 | 52% | 0.515 | 79% | 0.786 | S | S | . | * | | | trans | -81.1 | -176.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | | |
| 46 | L | 50.8 | Low | 40.2 | Very low | 168 Ų | 168 | 135.7 Ų | 135.7 | 88% | 0.88 | 78% | 0.781 | S | S | * | * | | | trans | 79.3 | 116.3 | -175.5 | -97.5 | 59.1 | 0 | 0 | 0 | 113 | | |
| 47 | I | 42.8 | Very low | 40.8 | Very low | 151 Ų | 151 | 139 Ų | 139 | 77% | 0.774 | 78% | 0.775 | S | S | * | * | | | | -142.5 | 129.8 | 57.3 | -66.8 | 132.6 | 0 | 0 | 0 | 111.7 | T49 | I47-T49 HydrophobicContact CG2-CG2 4.28Š|
| 48 | N | 43.5 | Very low | 41.8 | Very low | 111 Ų | 111 | 143.9 Ų | 143.9 | 59% | 0.594 | 78% | 0.777 | S | S | * | * | | | trans | -100.8 | 117 | 160.9 | 173.2 | -27.2 | 0 | 0 | 0 | 107.4 | R50 | N48-R50 PolarHBondContact ND2-NH1 3.2Å; N48-R50 PolarHBondContact OD1-N 3.43Å; N48-R50 PolarHBondContact OD1-NH1 3.15Å |
| 49 | T | 47 | Very low | 42.3 | Very low | 125 Ų | 125 | 139 Ų | 139 | 77% | 0.767 | 77% | 0.77 | S | S | * | * | | | trans | -139.4 | 83.6 | 157.6 | 44.9 | 0 | 0 | 0 | 0 | 110.3 | I47 | I47-T49 HydrophobicContact CG2-CG2 4.28Š|
| 50 | R | 45.7 | Very low | 42.2 | Very low | 196 Ų | 196 | 143.2 Ų | 143.2 | 74% | 0.74 | 78% | 0.779 | S | S | * | * | | | trans | -39.4 | 135.4 | 147.3 | 59 | -166.7 | 175.5 | -92.3 | 3.4 | 111.8 | N48 | N48-R50 PolarHBondContact ND2-NH1 3.2Å; N48-R50 PolarHBondContact OD1-N 3.43Å; N48-R50 PolarHBondContact OD1-NH1 3.15Å |
| 51 | S | 43.4 | Very low | 42.4 | Very low | 103 Ų | 103 | 144.6 Ų | 144.6 | 72% | 0.72 | 78% | 0.782 | S | S | * | * | | | trans | 51 | 111 | 156.9 | -166.3 | 0 | 0 | 0 | 0 | 118.5 | | |
| 52 | L | 34.2 | Very low | 42.4 | Very low | 152 Ų | 152 | 143 Ų | 143 | 80% | 0.796 | 77% | 0.773 | S | S | * | * | | | trans | -138.3 | 74.4 | 139.6 | -146.4 | 153.1 | 0 | 0 | 0 | 108.2 | V54 | L52-V54 HydrophobicContact CD2-CB 3.8Å; L52-V54 HydrophobicContact CD2-CG2 3.49Å; L52-V54 VanDerWaalsContact CD2-CG2 3.49Å |
| 53 | M | 41.8 | Very low | 42.5 | Very low | 183 Ų | 183 | 141.5 Ų | 141.5 | 90% | 0.901 | 78% | 0.777 | S | S | * | * | | | trans | -69.2 | 120.7 | 147.3 | -74 | -173 | 153.9 | 0 | 0 | 106.4 | | |
| 54 | V | 32.9 | Very low | 41.9 | Very low | 122 Ų | 122 | 143.8 Ų | 143.8 | 74% | 0.739 | 78% | 0.781 | S | S | * | * | | | trans | -121.7 | 124.2 | 159.8 | 147.1 | 0 | 0 | 0 | 0 | 107 | L52 | L52-V54 HydrophobicContact CD2-CB 3.8Å; L52-V54 HydrophobicContact CD2-CG2 3.49Å; L52-V54 VanDerWaalsContact CD2-CG2 3.49Å |
| 55 | E | 36.4 | Very low | 41.4 | Very low | 176 Ų | 176 | 143.1 Ų | 143.1 | 82% | 0.822 | 79% | 0.787 | S | S | * | * | | | trans | -56.8 | 143.4 | 178.7 | -89 | 176.6 | 70.5 | 0 | 0 | 113.9 | | |
| 56 | T | 45.3 | Very low | 40.9 | Very low | 125 Ų | 125 | 145 Ų | 145 | 77% | 0.767 | 80% | 0.797 | S | S | * | * | | | trans | 8.8 | 112.5 | 141.3 | 23.2 | 0 | 0 | 0 | 0 | 119.1 | | |
| 57 | K | 45.9 | Very low | 40.3 | Very low | 183 Ų | 183 | 143 Ų | 143 | 80% | 0.796 | 79% | 0.794 | S | S | * | * | | | | -150.7 | 131.7 | 116.3 | -142.3 | 170.6 | 178.1 | 175.5 | 0 | 108.2 | | |
| 58 | E | 51 | Low | 40 | Very low | 178 Ų | 178 | 144.5 Ų | 144.5 | 83% | 0.832 | 80% | 0.798 | S | S | * | * | S | Bend | trans | 55.3 | 96.7 | 171.3 | 71 | -136.9 | 126.2 | 0 | 0 | 120.5 | | |
| 59 | G | 43 | Very low | 39.3 | Very low | 79 Ų | 79 | 150.3 Ų | 150.3 | 81% | 0.814 | 81% | 0.813 | S | S | * | * | | | trans | 105 | 81 | 140.3 | 0 | 0 | 0 | 0 | 0 | 118.3 | | |
| 60 | L | 36.5 | Very low | 38.7 | Very low | 186 Ų | 186 | 153.1 Ų | 153.1 | 97% | 0.974 | 82% | 0.818 | S | S | * | * | | | trans | -91 | 115.2 | 161.4 | -128.7 | 90.8 | 0 | 0 | 0 | 108.8 | | |
| 61 | V | 39 | Very low | 38.1 | Very low | 134 Ų | 134 | 147.4 Ų | 147.4 | 81% | 0.812 | 82% | 0.82 | S | S | * | * | | | trans | -120.5 | 129.7 | 168.3 | 166 | 0 | 0 | 0 | 0 | 109.3 | | |
| 62 | S | 34.9 | Very low | 37.6 | Very low | 102 Ų | 102 | 150.6 Ų | 150.6 | 71% | 0.713 | 82% | 0.823 | S | S | * | * | | | trans | -52.4 | 125.8 | -176.5 | -175.8 | 0 | 0 | 0 | 0 | 113.8 | Y64 | S62-Y64 PolarHBondContact O-N 3.46Š|
| 63 | V | 44.3 | Very low | 37.7 | Very low | 141 Ų | 141 | 151.5 Ų | 151.5 | 86% | 0.855 | 83% | 0.825 | S | S | * | * | | | trans | -92.7 | 72.7 | 170.6 | -174 | 0 | 0 | 0 | 0 | 109 | | |
| 64 | Y | 30 | Very low | 37.6 | Very low | 218 Ų | 218 | 149.3 Ų | 149.3 | 86% | 0.855 | 82% | 0.822 | S | S | * | * | | | trans | -151.6 | 106 | 156 | -118.5 | -85.1 | 0 | 0 | 0 | 108.7 | S62 | S62-Y64 PolarHBondContact O-N 3.46Š|
| 65 | S | 36.1 | Very low | 37.7 | Very low | 123 Ų | 123 | 149.4 Ų | 149.4 | 86% | 0.86 | 82% | 0.822 | S | S | * | * | | | trans | -108.5 | 128 | 166.7 | -77.7 | 0 | 0 | 0 | 0 | 108.9 | | |
| 66 | A | 34 | Very low | 37.6 | Very low | 88 Ų | 88 | 147.3 Ų | 147.3 | 73% | 0.727 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 154.5 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 67 | P | 38.6 | Very low | 37 | Very low | 126 Ų | 126 | 148.9 Ų | 148.9 | 82% | 0.818 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -81.1 | 132.1 | 179.3 | 30.9 | -30.2 | 0 | 0 | 0 | 112.2 | | |
| 68 | Q | 36.7 | Very low | 36.3 | Very low | 184 Ų | 184 | 144.9 Ų | 144.9 | 86% | 0.86 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 121.2 | 171.1 | -71.5 | -88.8 | 1.7 | 0 | 0 | 109.3 | | |
| 69 | Y | 29.3 | Very low | 36.2 | Very low | 232 Ų | 232 | 141.9 Ų | 141.9 | 91% | 0.91 | 81% | 0.811 | S | S | * | * | | | trans | -90.6 | 114.7 | 174 | -124.3 | -96.6 | 0 | 0 | 0 | 109.1 | | |
| 70 | Q | 34.6 | Very low | 35.5 | Very low | 185 Ų | 185 | 145.9 Ų | 145.9 | 86% | 0.864 | 81% | 0.808 | S | S | * | * | | | trans | -139 | 98.3 | 169.8 | -167.6 | 159.8 | 10.4 | 0 | 0 | 110.1 | | |
| 71 | G | 32.7 | Very low | 35.3 | Very low | 76 Ų | 76 | 144.6 Ų | 144.6 | 78% | 0.784 | 80% | 0.797 | S | S | * | * | | | trans | -116.8 | 106.9 | 174 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 72 | H | 33.3 | Very low | 35.1 | Very low | 169 Ų | 169 | 146.7 Ų | 146.7 | 78% | 0.782 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 135 | -167.4 | -174.9 | -82.7 | 0 | 0 | 0 | 113.2 | | |
| 73 | M | 36.1 | Very low | 35 | Very low | 172 Ų | 172 | 150.8 Ų | 150.8 | 85% | 0.847 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 141.3 | 172.3 | -63.4 | -172.8 | -167.8 | 0 | 0 | 111.4 | | |
| 74 | V | 39.8 | Very low | 34.4 | Very low | 136 Ų | 136 | 152 Ų | 152 | 82% | 0.824 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 123.1 | 174.3 | 176.7 | 0 | 0 | 0 | 0 | 109.1 | | |
| 75 | V | 33.5 | Very low | 34.5 | Very low | 124 Ų | 124 | 144.9 Ų | 144.9 | 75% | 0.752 | 80% | 0.8 | S | S | * | * | | | trans | -132.2 | 123.5 | 158.9 | -179.2 | 0 | 0 | 0 | 0 | 108.7 | L77 | V75-L77 HydrophobicContact CG1-CD1 4.04Š|
| 76 | N | 34.8 | Very low | 34.5 | Very low | 133 Ų | 133 | 148.9 Ų | 148.9 | 71% | 0.711 | 81% | 0.806 | S | S | * | * | | | trans | -88.3 | 128.4 | 178 | -174.2 | 14.2 | 0 | 0 | 0 | 109.3 | | |
| 77 | L | 33.5 | Very low | 34.4 | Very low | 158 Ų | 158 | 148.2 Ų | 148.2 | 83% | 0.827 | 81% | 0.808 | S | S | * | * | | | trans | -149.6 | 122.4 | 154.3 | -80.9 | 115.4 | 0 | 0 | 0 | 109.1 | V75 | V75-L77 HydrophobicContact CG1-CD1 4.04Š|
| 78 | S | 30.5 | Very low | 34.6 | Very low | 98 Ų | 98 | 149.9 Ų | 149.9 | 69% | 0.685 | 82% | 0.815 | S | S | * | * | | | trans | -91.7 | -175.2 | 163.5 | -51.8 | 0 | 0 | 0 | 0 | 109.4 | | |
| 79 | P | 48.7 | Very low | 34.5 | Very low | 116 Ų | 116 | 144.4 Ų | 144.4 | 75% | 0.753 | 81% | 0.808 | S | S | * | * | | | cis | -135.9 | -174.5 | -9.7 | 31.4 | -8.7 | 0 | 0 | 0 | 114.2 | | |
| 80 | Q | 28.6 | Very low | 34.9 | Very low | 162 Ų | 162 | 137.6 Ų | 137.6 | 76% | 0.757 | 81% | 0.808 | S | S | * | * | | | trans | 106.4 | 118 | 143.5 | -140.5 | -174.8 | -51.1 | 0 | 0 | 119 | | |
| 81 | Q | 31.4 | Very low | 34.8 | Very low | 160 Ų | 160 | 132.5 Ų | 132.5 | 75% | 0.748 | 81% | 0.805 | S | S | * | * | | | | 129.2 | 128 | 120.6 | -155.4 | 157.9 | -34.3 | 0 | 0 | 116.8 | | |
| 82 | E | 35.4 | Very low | 35 | Very low | 177 Ų | 177 | 132.5 Ų | 132.5 | 83% | 0.827 | 81% | 0.806 | S | S | * | * | | | trans | -69.3 | 145.9 | -177.2 | -47.1 | -174 | 89.4 | 0 | 0 | 114.6 | | |
| 83 | Q | 33.8 | Very low | 35.3 | Very low | 188 Ų | 188 | 127.7 Ų | 127.7 | 88% | 0.879 | 80% | 0.802 | S | S | * | * | | | | -174.3 | 121 | 127.5 | -112.6 | 174.1 | 59.7 | 0 | 0 | 114.5 | | |
| 84 | N | 31.7 | Very low | 36.1 | Very low | 167 Ų | 167 | 125.2 Ų | 125.2 | 89% | 0.893 | 80% | 0.799 | S | S | * | * | | | trans | -0.4 | 137.7 | 145.1 | -163 | 15.9 | 0 | 0 | 0 | 120.3 | | |
| 85 | G | 31.6 | Very low | 36.3 | Very low | 68 Ų | 68 | 124.7 Ų | 124.7 | 70% | 0.701 | 80% | 0.798 | S | S | * | * | | | trans | 149.1 | 114.2 | 154.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 86 | Q | 36.4 | Very low | 37.2 | Very low | 207 Ų | 207 | 127.5 Ų | 127.5 | 97% | 0.967 | 80% | 0.803 | S | S | * | * | | | trans | -54.9 | 137.7 | -179 | -73.1 | 159.3 | -77.3 | 0 | 0 | 115.1 | | |
| 87 | G | 32.3 | Very low | 37.5 | Very low | 75 Ų | 75 | 129.1 Ų | 129.1 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | | | trans | -168.8 | 112.9 | 165.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | | |
| 88 | V | 42.9 | Very low | 37.8 | Very low | 161 Ų | 161 | 129.5 Ų | 129.5 | 98% | 0.976 | 81% | 0.812 | S | S | * | * | | | trans | -59.9 | 127.2 | -179.7 | 173 | 0 | 0 | 0 | 0 | 111.2 | | |
| 89 | G | 33.2 | Very low | 38.6 | Very low | 68 Ų | 68 | 130.2 Ų | 130.2 | 70% | 0.701 | 81% | 0.809 | S | S | * | * | | | trans | -172.2 | 119.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 90 | G | 38.1 | Very low | 38.6 | Very low | 89 Ų | 89 | 130.2 Ų | 130.2 | 92% | 0.918 | 81% | 0.809 | S | S | * | * | | | trans | -64.3 | 155.7 | -170.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 91 | G | 32.6 | Very low | 39.7 | Very low | 78 Ų | 78 | 127.5 Ų | 127.5 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | | | trans | 171.7 | 118 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111 | | |
| 92 | G | 37.1 | Very low | 40.7 | Very low | 77 Ų | 77 | 123.8 Ų | 123.8 | 79% | 0.794 | 80% | 0.804 | S | S | * | * | | | trans | -0 | 118.2 | 171.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | | |
| 93 | G | 38.8 | Very low | 41 | Very low | 68 Ų | 68 | 122.7 Ų | 122.7 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 144.2 | 153.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | | |
| 94 | P | 53.4 | Low | 41.8 | Very low | 120 Ų | 120 | 119.5 Ų | 119.5 | 78% | 0.779 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 139.5 | 179.6 | 25.1 | -33.2 | 0 | 0 | 0 | 109.4 | Q96 | P94-Q96 PolarHBondContact O-N 2.53Å; P94-Q96 VanDerWaalsContact O-N 3.07Å |
| 95 | P | 44.9 | Very low | 42.8 | Very low | 125 Ų | 125 | 121 Ų | 121 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 122.5 | 170.7 | 26.2 | -31.2 | 0 | 0 | 0 | 107.5 | L97 | P95-L97 PolarHBondContact O-N 2.75Š|
| 96 | Q | 51.1 | Low | 43.4 | Very low | 183 Ų | 183 | 121.1 Ų | 121.1 | 86% | 0.855 | 80% | 0.802 | S | S | * | * | | | trans | -45.1 | 111.8 | 178.3 | -165.1 | 166 | 44 | 0 | 0 | 109.8 | P94 L98 | P94-Q96 PolarHBondContact O-N 2.53Å; P94-Q96 VanDerWaalsContact O-N 3.07Å; Q96-L98 PolarHBondContact O-N 3.5Å |
| 97 | L | 42.2 | Very low | 43.6 | Very low | 166 Ų | 166 | 120.2 Ų | 120.2 | 87% | 0.869 | 80% | 0.8 | S | S | * | * | | | trans | -46.8 | 113.3 | 168.1 | -94.4 | 152.9 | 0 | 0 | 0 | 108.2 | P95 N99 | P95-L97 PolarHBondContact O-N 2.75Å; L97-N99 PolarHBondContact O-N 3.31Å |
| 98 | L | 38.3 | Very low | 44.1 | Very low | 166 Ų | 166 | 123.2 Ų | 123.2 | 87% | 0.869 | 80% | 0.798 | S | S | * | * | | | trans | -58.5 | 111.4 | 173.5 | -73.9 | 163.9 | 0 | 0 | 0 | 107.4 | Q96 P100 | Q96-L98 PolarHBondContact O-N 3.5Å; L98-P100 VanDerWaalsContact O-CD 3.22Å; L98-P100 WeakPolarHBondContact O-CD 3.01Å |
| 99 | N | 49.1 | Very low | 43.9 | Very low | 113 Ų | 113 | 121.1 Ų | 121.1 | 60% | 0.604 | 79% | 0.788 | S | S | * | * | | | trans | -69.9 | 113.2 | 177.2 | -164.5 | -44.8 | 0 | 0 | 0 | 107.8 | L97 S101 | L97-N99 PolarHBondContact O-N 3.31Å; N99-S101 PolarHBondContact O-N 3.18Å; N99-S101 WeakPolarHBondContact OD1-CB 3.22Å; N99-S101 PolarHBondContact OD1-N 3.31Å; N99-S101 PolarHBondContact OD1-OG 3.27Å |
| 100 | P | 47.7 | Very low | 44.1 | Very low | 117 Ų | 117 | 124.1 Ų | 124.1 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.1 | 4.4 | -174.3 | 28.8 | -33.3 | 0 | 0 | 0 | 113.6 | L98 | L98-P100 VanDerWaalsContact O-CD 3.22Å; L98-P100 WeakPolarHBondContact O-CD 3.01Å |
| 101 | S | 50.7 | Low | 44.2 | Very low | 104 Ų | 104 | 129.5 Ų | 129.5 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.3 | 4.3 | -176.4 | -31 | 0 | 0 | 0 | 0 | 113.9 | N99 | N99-S101 PolarHBondContact O-N 3.18Å; N99-S101 WeakPolarHBondContact OD1-CB 3.22Å; N99-S101 PolarHBondContact OD1-N 3.31Å; N99-S101 PolarHBondContact OD1-OG 3.27Å |
| 102 | A | 53.2 | Low | 44.3 | Very low | 82 Ų | 82 | 137 Ų | 137 | 68% | 0.678 | 80% | 0.799 | S | S | * | * | | | trans | -108.6 | 8.9 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | P104 | A102-P104 WeakPolarHBondContact O-CD 3.25Š|
| 103 | L | 40.9 | Very low | 44.8 | Very low | 155 Ų | 155 | 138.7 Ų | 138.7 | 81% | 0.812 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -82.9 | 118.3 | 172.6 | -89.3 | 161.7 | 0 | 0 | 0 | 110 | Q105 | L103-Q105 PolarHBondContact O-N 3.46Š|
| 104 | P | 51.7 | Low | 44.7 | Very low | 120 Ų | 120 | 141.5 Ų | 141.5 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | | | trans | -61.5 | 122.1 | 169.2 | -17.7 | 31.2 | 0 | 0 | 0 | 109.7 | A102 G106 | A102-P104 WeakPolarHBondContact O-CD 3.25Å; P104-G106 PolarHBondContact O-N 3.18Å |
| 105 | Q | 53.4 | Low | 44.5 | Very low | 198 Ų | 198 | 143.1 Ų | 143.1 | 93% | 0.925 | 80% | 0.796 | S | S | * | * | | | trans | -49.8 | 110.9 | 174.8 | -155.4 | 168.3 | 1.6 | 0 | 0 | 110.8 | L103 | L103-Q105 PolarHBondContact O-N 3.46Š|
| 106 | G | 43.5 | Very low | 44.4 | Very low | 71 Ų | 71 | 145 Ų | 145 | 73% | 0.732 | 80% | 0.797 | S | S | * | * | | | trans | -156.4 | 90.7 | -174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | P104 | P104-G106 PolarHBondContact O-N 3.18Š|
| 107 | M | 40.9 | Very low | 44 | Very low | 189 Ų | 189 | 143.9 Ų | 143.9 | 93% | 0.931 | 80% | 0.797 | S | S | * | * | | | trans | 72.1 | 102.1 | 165.6 | -140.7 | 139.7 | 77.8 | 0 | 0 | 117.4 | | |
| 108 | D | 43.1 | Very low | 43.6 | Very low | 138 Ų | 138 | 144.1 Ų | 144.1 | 74% | 0.738 | 79% | 0.787 | S | S | * | * | | | trans | -58.9 | 145.9 | -177.7 | -72.7 | -87.9 | 0 | 0 | 0 | 115.5 | C110 | D108-C110 PolarHBondContact O-N 3.25Š|
| 109 | P | 37.5 | Very low | 43.5 | Very low | 117 Ų | 117 | 140.1 Ų | 140.1 | 76% | 0.76 | 77% | 0.773 | S | S | * | * | | | trans | -76.1 | 104.8 | 170.9 | 30.9 | -31.4 | 0 | 0 | 0 | 110.7 | F111 | P109-F111 PolarHBondContact O-N 3.49Š|
| 110 | C | 37.7 | Very low | 43.4 | Very low | 130 Ų | 130 | 142.8 Ų | 142.8 | 88% | 0.878 | 78% | 0.782 | S | S | * | * | | | trans | -78.4 | 61 | 172.1 | -71.3 | 0 | 0 | 0 | 0 | 112.6 | D108 | D108-C110 PolarHBondContact O-N 3.25Š|
| 111 | F | 39.8 | Very low | 43.4 | Very low | 202 Ų | 202 | 142.7 Ų | 142.7 | 89% | 0.886 | 78% | 0.775 | S | S | * | * | | | trans | -108.6 | 102.2 | 157.9 | -111.6 | -88 | 0 | 0 | 0 | 108.1 | P109 | P109-F111 PolarHBondContact O-N 3.49Š|
| 112 | R | 36.2 | Very low | 43 | Very low | 237 Ų | 237 | 144.6 Ų | 144.6 | 89% | 0.894 | 77% | 0.774 | S | S | * | * | | | trans | -114.6 | 116.4 | 168.1 | -103.6 | -148.4 | 176.5 | -171 | 1.3 | 109.9 | | |
| 113 | P | 47.1 | Very low | 42.5 | Very low | 112 Ų | 112 | 147 Ų | 147 | 73% | 0.727 | 78% | 0.775 | S | S | * | * | | | trans | -86.5 | 110.8 | 154.9 | 30.9 | -21.4 | 0 | 0 | 0 | 107.6 | | |
| 114 | N | 36.3 | Very low | 42.6 | Very low | 127 Ų | 127 | 150 Ų | 150 | 68% | 0.679 | 78% | 0.776 | S | S | * | * | | | trans | 173.5 | 132 | 146.4 | -103.8 | -84.7 | 0 | 0 | 0 | 112.2 | | |
| 115 | L | 49.7 | Very low | 42.1 | Very low | 153 Ų | 153 | 148.3 Ų | 148.3 | 80% | 0.801 | 77% | 0.772 | S | S | * | * | | | trans | 20.5 | 112.8 | 154.5 | -70.1 | 93.2 | 0 | 0 | 0 | 119.2 | | |
| 116 | I | 42.7 | Very low | 41.5 | Very low | 164 Ų | 164 | 151.2 Ų | 151.2 | 84% | 0.841 | 77% | 0.774 | S | S | * | * | | | trans | -120 | 95 | 151.5 | -60.8 | 176.3 | 0 | 0 | 0 | 104.9 | | |
| 117 | L | 41.4 | Very low | 41.5 | Very low | 160 Ų | 160 | 151 Ų | 151 | 84% | 0.838 | 77% | 0.772 | S | S | * | * | | | | 42.2 | 99.3 | 105.3 | -88.6 | 167.3 | 0 | 0 | 0 | 113 | S119 | L117-S119 PolarHBondContact O-N 3.39Š|
| 118 | Y | 34.7 | Very low | 41.5 | Very low | 172 Ų | 172 | 149.6 Ų | 149.6 | 68% | 0.675 | 77% | 0.768 | S | S | * | * | | | trans | -46.5 | 121.6 | 167.9 | -158.3 | -99.8 | 0 | 0 | 0 | 109.9 | E120 L123 | Y118-E120 PolarHBondContact O-N 3.14Å; Y118-L123 HydrophobicContact CE1-CD1 4.29Å |
| 119 | S | 36 | Very low | 41.3 | Very low | 82 Ų | 82 | 146.6 Ų | 146.6 | 57% | 0.573 | 77% | 0.77 | S | S | * | * | | | trans | -69 | 115 | 179.4 | -156.8 | 0 | 0 | 0 | 0 | 108.8 | L117 N121 M122 | L117-S119 PolarHBondContact O-N 3.39Å; S119-N121 VanDerWaalsContact CB-OD1 3.25Å; S119-N121 WeakPolarHBondContact CB-OD1 3.04Å; S119-N121 PolarHBondContact O-N 3.46Å; S119-N121 PolarHBondContact OG-OD1 3.21Å; S119-M122 PolarHBondContact O-N 2.94Å |
| 120 | E | 47.1 | Very low | 41.3 | Very low | 169 Ų | 169 | 144.3 Ų | 144.3 | 79% | 0.79 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | 21.2 | -172.9 | -145.7 | 176.9 | 118.2 | 0 | 0 | 114.9 | Y118 | Y118-E120 PolarHBondContact O-N 3.14Š|
| 121 | N | 47.5 | Very low | 41.3 | Very low | 114 Ų | 114 | 145.6 Ų | 145.6 | 61% | 0.61 | 77% | 0.771 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.7 | -10.6 | -175.6 | -3.1 | 67.9 | 0 | 0 | 0 | 113.6 | S119 L123 | S119-N121 VanDerWaalsContact CB-OD1 3.25Å; S119-N121 WeakPolarHBondContact CB-OD1 3.04Å; S119-N121 PolarHBondContact O-N 3.46Å; S119-N121 PolarHBondContact OG-OD1 3.21Å; N121-L123 VanDerWaalsContact C-N 3.34Å |
| 122 | M | 43.6 | Very low | 41.3 | Very low | 145 Ų | 145 | 139 Ų | 139 | 71% | 0.714 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -74 | -28.3 | 164.5 | -87.5 | -164 | -149.3 | 0 | 0 | 112.1 | S119 R124 A125 | S119-M122 PolarHBondContact O-N 2.94Å; M122-R124 PolarHBondContact O-N 3.3Å; M122-R124 VanDerWaalsContact O-N 3.15Å; M122-A125 PolarHBondContact O-N 3.43Å |
| 123 | L | 41 | Very low | 41.9 | Very low | 131 Ų | 131 | 135.5 Ų | 135.5 | 69% | 0.686 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | -5.2 | -178.8 | -110.7 | 148.3 | 0 | 0 | 0 | 114.3 | Y118 N121 | Y118-L123 HydrophobicContact CE1-CD1 4.29Å; N121-L123 VanDerWaalsContact C-N 3.34Å |
| 124 | R | 43 | Very low | 41.3 | Very low | 220 Ų | 220 | 135.9 Ų | 135.9 | 83% | 0.83 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.1 | -1 | 175.1 | -72.7 | -79.9 | -72.7 | -93.2 | -2 | 113.6 | M122 | M122-R124 PolarHBondContact O-N 3.3Å; M122-R124 VanDerWaalsContact O-N 3.15Å |
| 125 | A | 41.2 | Very low | 41.6 | Very low | 84 Ų | 84 | 136 Ų | 136 | 69% | 0.694 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -96.8 | -6.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | M122 G127 | M122-A125 PolarHBondContact O-N 3.43Å; A125-G127 VanDerWaalsContact C-N 3.32Å |
| 126 | W | 41.1 | Very low | 41 | Very low | 258 Ų | 258 | 136.5 Ų | 136.5 | 98% | 0.977 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -96 | 20.9 | 178.6 | -137.7 | 5.3 | 0 | 0 | 0 | 113.8 | | |
| 127 | G | 43.2 | Very low | 40.7 | Very low | 67 Ų | 67 | 135.7 Ų | 135.7 | 69% | 0.691 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -135.1 | 43.5 | -175.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | A125 | A125-G127 VanDerWaalsContact C-N 3.32Š|
| 128 | D | 42.1 | Very low | 41 | Very low | 159 Ų | 159 | 132.5 Ų | 132.5 | 85% | 0.85 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -159.2 | 135.3 | 151.4 | -156.6 | 14.4 | 0 | 0 | 0 | 109.4 | | |
| 129 | G | 39.1 | Very low | 41.2 | Very low | 75 Ų | 75 | 132.8 Ų | 132.8 | 77% | 0.773 | 77% | 0.767 | S | S | * | * | | | trans | -70.7 | 159.4 | -161.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | | |
| 130 | G | 36.1 | Very low | 41.6 | Very low | 69 Ų | 69 | 136 Ų | 136 | 71% | 0.711 | 78% | 0.776 | S | S | * | * | | | trans | 139.7 | 91.7 | 156.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 131 | V | 39.7 | Very low | 41.4 | Very low | 157 Ų | 157 | 134.6 Ų | 134.6 | 95% | 0.952 | 77% | 0.769 | S | S | * | * | | | trans | 48.1 | 120.7 | 136 | -178.3 | 0 | 0 | 0 | 0 | 118.5 | | |
| 132 | G | 39.1 | Very low | 40.8 | Very low | 65 Ų | 65 | 137.1 Ų | 137.1 | 67% | 0.67 | 78% | 0.782 | S | S | * | * | | | trans | 155.4 | 82.8 | 148.5 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 133 | D | 47.8 | Very low | 40.8 | Very low | 163 Ų | 163 | 137.4 Ų | 137.4 | 87% | 0.872 | 79% | 0.786 | S | S | * | * | | | trans | 18.4 | 106.1 | 158.6 | -87.5 | -55.1 | 0 | 0 | 0 | 118.8 | | |
| 134 | C | 35.8 | Very low | 40.4 | Very low | 119 Ų | 119 | 135.9 Ų | 135.9 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | | | trans | -130.8 | 117.4 | 149.5 | 34.6 | 0 | 0 | 0 | 0 | 109 | E136 | C134-E136 PolarHBondContact O-N 3.37Š|
| 135 | C | 41.6 | Very low | 40 | Very low | 131 Ų | 131 | 131.8 Ų | 131.8 | 89% | 0.885 | 80% | 0.797 | S | S | * | * | | | trans | -75.8 | 99.3 | -172.4 | -5.8 | 0 | 0 | 0 | 0 | 110.3 | | |
| 136 | E | 37.1 | Very low | 39.5 | Very low | 163 Ų | 163 | 131.2 Ų | 131.2 | 76% | 0.762 | 80% | 0.8 | S | S | * | * | | | trans | -118 | 116.2 | 165.2 | -173.9 | 179.9 | 122.5 | 0 | 0 | 107.1 | C134 T138 | C134-E136 PolarHBondContact O-N 3.37Å; E136-T138 PolarHBondContact O-N 3.46Å; E136-T138 PolarHBondContact OE1-OG1 3.31Å |
| 137 | T | 36.7 | Very low | 38.9 | Very low | 147 Ų | 147 | 124 Ų | 124 | 90% | 0.902 | 79% | 0.788 | S | S | * | * | | | trans | -96.7 | 88.3 | 173.2 | 61.6 | 0 | 0 | 0 | 0 | 109 | | |
| 138 | T | 48.7 | Very low | 38.1 | Very low | 93 Ų | 93 | 125.6 Ų | 125.6 | 57% | 0.571 | 79% | 0.789 | S | S | * | * | | | trans | -68.5 | 136.3 | 166.8 | -46.2 | 0 | 0 | 0 | 0 | 110.1 | E136 I140 | E136-T138 PolarHBondContact O-N 3.46Å; E136-T138 PolarHBondContact OE1-OG1 3.31Å; T138-I140 HydrophobicContact CG2-CD1 4.44Å; T138-I140 HydrophobicContact CG2-CG1 4.14Å |
| 139 | F | 38.7 | Very low | 37.5 | Very low | 178 Ų | 178 | 122.3 Ų | 122.3 | 78% | 0.781 | 78% | 0.784 | S | S | * | * | | | trans | -73.5 | 114.9 | 167 | -173.5 | -85.5 | 0 | 0 | 0 | 109.2 | | |
| 140 | I | 43.4 | Very low | 37.3 | Very low | 149 Ų | 149 | 123.2 Ų | 123.2 | 76% | 0.764 | 79% | 0.785 | S | S | * | * | | | trans | -146.3 | 120.2 | 156.3 | -47.6 | 178.2 | 0 | 0 | 0 | 108.9 | T138 | T138-I140 HydrophobicContact CG2-CD1 4.44Å; T138-I140 HydrophobicContact CG2-CG1 4.14Å |
| 141 | E | 42.5 | Very low | 36.9 | Very low | 139 Ų | 139 | 125.4 Ų | 125.4 | 65% | 0.65 | 79% | 0.789 | S | S | * | * | | | trans | -55.6 | 127.4 | 162.5 | -92.5 | 164.7 | 77.2 | 0 | 0 | 111.2 | | |
| 142 | D | 36.4 | Very low | 36.6 | Very low | 167 Ų | 167 | 127 Ų | 127 | 89% | 0.893 | 78% | 0.783 | S | S | * | * | | | trans | -129.6 | 112 | 156.4 | -123 | -17.6 | 0 | 0 | 0 | 108 | | |
| 143 | L | 43.6 | Very low | 36.2 | Very low | 152 Ų | 152 | 131.5 Ų | 131.5 | 80% | 0.796 | 79% | 0.792 | S | S | * | * | | | trans | -74.3 | 122.2 | -179.2 | -82.1 | 91.6 | 0 | 0 | 0 | 110.6 | | |
| 144 | A | 32.1 | Very low | 35.3 | Very low | 98 Ų | 98 | 127.2 Ų | 127.2 | 81% | 0.81 | 79% | 0.786 | S | S | * | * | | | | -161.8 | 115.9 | 126.5 | 0 | 0 | 0 | 0 | 0 | 111 | | |
| 145 | S | 33.9 | Very low | 35.1 | Very low | 134 Ų | 134 | 128.7 Ų | 128.7 | 94% | 0.937 | 79% | 0.785 | S | S | * | * | | | trans | -57.5 | 139.3 | 167.5 | -79.7 | 0 | 0 | 0 | 0 | 111.9 | | |
| 146 | G | 30.6 | Very low | 34.7 | Very low | 72 Ų | 72 | 130 Ų | 130 | 74% | 0.742 | 78% | 0.78 | S | S | * | * | | | trans | -162.6 | 76.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112 | | |
| 147 | S | 28.7 | Very low | 34.3 | Very low | 106 Ų | 106 | 131.8 Ų | 131.8 | 74% | 0.741 | 79% | 0.786 | S | S | * | * | | | trans | 43.8 | 112.3 | 146 | -163.4 | 0 | 0 | 0 | 0 | 119.7 | | |
| 148 | S | 27 | Very low | 34.2 | Very low | 101 Ų | 101 | 128.8 Ų | 128.8 | 71% | 0.706 | 78% | 0.776 | S | S | * | * | | | trans | 59.5 | 128.5 | 131.3 | 72.8 | 0 | 0 | 0 | 0 | 121 | | |
| 149 | A | 29.1 | Very low | 33.3 | Very low | 90 Ų | 90 | 132 Ų | 132 | 74% | 0.744 | 79% | 0.79 | S | S | * | * | | | trans | 75.3 | 114.2 | 137.7 | 0 | 0 | 0 | 0 | 0 | 118.1 | | |
| 150 | A | 34.3 | Very low | 33 | Very low | 95 Ų | 95 | 126.4 Ų | 126.4 | 79% | 0.785 | 78% | 0.782 | S | S | * | * | | | | 24.4 | 117.2 | 126.6 | 0 | 0 | 0 | 0 | 0 | 117.2 | | |
| 151 | S | 27.9 | Very low | 32.6 | Very low | 114 Ų | 114 | 129 Ų | 129 | 80% | 0.797 | 79% | 0.788 | S | S | * | * | | | trans | -165.3 | 104.2 | 146.4 | -74.6 | 0 | 0 | 0 | 0 | 105 | | |
| 152 | K | 34.2 | Very low | 32.1 | Very low | 191 Ų | 191 | 130.9 Ų | 130.9 | 83% | 0.83 | 79% | 0.794 | S | S | * | * | | | | 21.6 | 94.6 | 72.7 | -158.1 | 174.4 | -177.2 | 175.7 | 0 | 111.7 | | |
| 153 | D | 29.9 | Very low | 32.3 | Very low | 159 Ų | 159 | 130.4 Ų | 130.4 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | S | Bend | trans | 23 | 119.2 | 147 | -60.2 | -68.8 | 0 | 0 | 0 | 117.8 | | |
| 154 | G | 29.5 | Very low | 31.7 | Very low | 74 Ų | 74 | 129.8 Ų | 129.8 | 76% | 0.763 | 78% | 0.784 | S | S | * | * | | | trans | 142 | 82.7 | 153.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 155 | L | 32.4 | Very low | 31.8 | Very low | 149 Ų | 149 | 133 Ų | 133 | 78% | 0.78 | 79% | 0.786 | S | S | * | * | | | trans | 34.2 | 115.4 | 130.1 | -153.7 | 80.3 | 0 | 0 | 0 | 118.1 | | |
| 156 | M | 31.2 | Very low | 31.7 | Very low | 158 Ų | 158 | 131.4 Ų | 131.4 | 78% | 0.778 | 78% | 0.775 | S | S | * | * | | | | 165.9 | 104.1 | 125.9 | -76.7 | -34.3 | 165.2 | 0 | 0 | 112.3 | | |
| 157 | F | 28.8 | Very low | 31.7 | Very low | 202 Ų | 202 | 132.6 Ų | 132.6 | 89% | 0.886 | 77% | 0.768 | S | S | * | * | | | | 42 | 142.9 | 129.1 | -141.7 | -98.4 | 0 | 0 | 0 | 124.8 | | |
| 158 | A | 35.3 | Very low | 31.9 | Very low | 84 Ų | 84 | 135.2 Ų | 135.2 | 69% | 0.694 | 77% | 0.769 | S | S | * | * | | | trans | 108.5 | 98.3 | 155.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | | |
| 159 | D | 30.3 | Very low | 32.4 | Very low | 160 Ų | 160 | 137.5 Ų | 137.5 | 86% | 0.856 | 77% | 0.773 | S | S | * | * | | | | 85 | 142.5 | 72 | -168 | 31.8 | 0 | 0 | 0 | 113.1 | | |
| 160 | G | 32 | Very low | 33.2 | Very low | 60 Ų | 60 | 137.9 Ų | 137.9 | 62% | 0.619 | 78% | 0.776 | S | S | * | * | | | trans | 107.3 | 79.4 | 156.6 | 0 | 0 | 0 | 0 | 0 | 118.8 | | |
| 161 | K | 35.6 | Very low | 33.5 | Very low | 205 Ų | 205 | 140.7 Ų | 140.7 | 89% | 0.891 | 77% | 0.77 | S | S | * | * | | | trans | -19.9 | 135.5 | 143 | -50.8 | 161 | -176.4 | -178.5 | 0 | 114.9 | | |
| 162 | F | 30.8 | Very low | 34.6 | Very low | 177 Ų | 177 | 142.9 Ų | 142.9 | 78% | 0.776 | 77% | 0.771 | S | S | * | * | | | | -171.5 | 127.6 | 122.2 | -159.4 | -120.3 | 0 | 0 | 0 | 110.7 | E164 | F162-E164 HydrophobicContact CD1-CB 4.44Å; F162-E164 HydrophobicContact CE1-CB 3.92Å; F162-E164 WeakPolarHBondContact CE1-OE2 3.04Å; F162-E164 HydrophobicContact CZ-CB 4.48Å; F162-E164 WeakPolarHBondContact CZ-OE2 3.39Å |
| 163 | L | 41.3 | Very low | 34.7 | Very low | 158 Ų | 158 | 140.2 Ų | 140.2 | 83% | 0.827 | 76% | 0.762 | S | S | * | * | | | trans | -65.7 | -173.9 | 165.7 | -89.8 | 149.8 | 0 | 0 | 0 | 110.6 | | |
| 164 | E | 31 | Very low | 35.4 | Very low | 138 Ų | 138 | 137.8 Ų | 137.8 | 65% | 0.645 | 75% | 0.753 | S | S | * | * | | | trans | 98.4 | 104.1 | 158.4 | -146 | 166.6 | 178.8 | 0 | 0 | 112.2 | F162 | F162-E164 HydrophobicContact CD1-CB 4.44Å; F162-E164 HydrophobicContact CE1-CB 3.92Å; F162-E164 WeakPolarHBondContact CE1-OE2 3.04Å; F162-E164 HydrophobicContact CZ-CB 4.48Å; F162-E164 WeakPolarHBondContact CZ-OE2 3.39Å |
| 165 | L | 35 | Very low | 35.9 | Very low | 165 Ų | 165 | 141.5 Ų | 141.5 | 86% | 0.864 | 76% | 0.755 | S | S | * | * | | | | -140.8 | 120 | 64.5 | -73 | 151.9 | 0 | 0 | 0 | 112.6 | | |
| 166 | S | 30.9 | Very low | 36.3 | Very low | 101 Ų | 101 | 138.7 Ų | 138.7 | 71% | 0.706 | 75% | 0.747 | S | S | * | * | | | trans | -48 | 149.9 | 143.9 | -147 | 0 | 0 | 0 | 0 | 108.9 | | |
| 167 | V | 29.7 | Very low | 36.6 | Very low | 97 Ų | 97 | 141.7 Ų | 141.7 | 59% | 0.588 | 75% | 0.752 | S | S | * | * | | | | 168.7 | 161.3 | 51.4 | 76 | 0 | 0 | 0 | 0 | 106.1 | | |
| 168 | E | 33.7 | Very low | 37.3 | Very low | 161 Ų | 161 | 138 Ų | 138 | 75% | 0.752 | 74% | 0.741 | S | S | * | * | | | trans | 59.8 | 110 | 164.9 | -86 | 69.4 | -109.4 | 0 | 0 | 119.4 | | |
| 169 | D | 36.8 | Very low | 37.7 | Very low | 150 Ų | 150 | 140.7 Ų | 140.7 | 80% | 0.802 | 74% | 0.742 | S | S | * | * | | | | 175.7 | 132.9 | 87.1 | -168.1 | 37.4 | 0 | 0 | 0 | 110.4 | K171 | D169-K171 PolarHBondContact O-N 3.4Š|
| 170 | A | 46.9 | Very low | 38.3 | Very low | 97 Ų | 97 | 140.5 Ų | 140.5 | 80% | 0.802 | 74% | 0.741 | S | S | * | * | | | trans | -81.6 | 111.1 | 179 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 171 | K | 39.8 | Very low | 38.8 | Very low | 154 Ų | 154 | 144.1 Ų | 144.1 | 67% | 0.67 | 75% | 0.747 | S | S | * | * | | | trans | -144.9 | 102.7 | 160 | -163.5 | 171.3 | -177.1 | 176.7 | 0 | 111.7 | D169 Q173 | D169-K171 PolarHBondContact O-N 3.4Å; K171-Q173 VanDerWaalsContact CE-OE1 3.25Å; K171-Q173 PolarHBondContact O-N 2.78Å |
| 172 | I | 50.8 | Low | 39.1 | Very low | 160 Ų | 160 | 141.5 Ų | 141.5 | 82% | 0.821 | 74% | 0.742 | S | S | * | * | | | trans | -59 | 112.3 | 160.2 | -61.4 | 168.8 | 0 | 0 | 0 | 106.7 | | |
| 173 | Q | 36.8 | Very low | 39.7 | Very low | 135 Ų | 135 | 140.2 Ų | 140.2 | 63% | 0.631 | 74% | 0.744 | S | S | * | * | | | trans | -123.4 | 81.8 | 171.7 | -164.7 | 102.2 | 46.6 | 0 | 0 | 108 | K171 | K171-Q173 VanDerWaalsContact CE-OE1 3.25Å; K171-Q173 PolarHBondContact O-N 2.78Å |
| 174 | T | 45.2 | Very low | 39.6 | Very low | 108 Ų | 108 | 140.2 Ų | 140.2 | 66% | 0.663 | 74% | 0.74 | S | S | * | * | | | trans | -42.5 | 150.3 | 148.1 | -51.5 | 0 | 0 | 0 | 0 | 110.9 | | |
| 175 | L | 39 | Very low | 39.5 | Very low | 152 Ų | 152 | 142.7 Ų | 142.7 | 80% | 0.796 | 75% | 0.748 | S | S | * | * | | | trans | 99.1 | 135.4 | 179.4 | -59.9 | 159 | 0 | 0 | 0 | 112.4 | | |
| 176 | S | 41.6 | Very low | 39.6 | Very low | 90 Ų | 90 | 143.5 Ų | 143.5 | 63% | 0.629 | 75% | 0.748 | S | S | * | * | | | cis | -167.4 | 130 | -6 | 178.9 | 0 | 0 | 0 | 0 | 102.7 | | |
| 177 | Y | 37.1 | Very low | 39.9 | Very low | 221 Ų | 221 | 147.3 Ų | 147.3 | 87% | 0.867 | 75% | 0.754 | S | S | * | * | | | trans | -99.7 | 108.8 | 164.8 | -151.9 | -88.8 | 0 | 0 | 0 | 106.1 | I179 | Y177-I179 PolarHBondContact O-N 3.38Š|
| 178 | D | 43.3 | Very low | 40.2 | Very low | 125 Ų | 125 | 150.7 Ų | 150.7 | 67% | 0.668 | 77% | 0.768 | S | S | * | * | | | trans | -56.2 | 119.4 | 168.7 | -79.4 | -87.6 | 0 | 0 | 0 | 108.6 | D180 | D178-D180 PolarHBondContact O-N 3.21Š|
| 179 | I | 43.6 | Very low | 40.2 | Very low | 140 Ų | 140 | 152.2 Ų | 152.2 | 72% | 0.718 | 78% | 0.775 | S | S | * | * | | | trans | -81.8 | 105.8 | 160.6 | -84.2 | 165.6 | 0 | 0 | 0 | 104.5 | Y177 D181 | Y177-I179 PolarHBondContact O-N 3.38Å; I179-D181 PolarHBondContact O-N 2.92Å |
| 180 | D | 43.2 | Very low | 40 | Very low | 156 Ų | 156 | 150.6 Ų | 150.6 | 83% | 0.834 | 78% | 0.776 | S | S | * | * | | | trans | -68.7 | 107.5 | 156.9 | -81.3 | -68.4 | 0 | 0 | 0 | 106.5 | D178 D182 | D178-D180 PolarHBondContact O-N 3.21Å; D180-D182 PolarHBondContact O-N 2.89Å |
| 181 | D | 42.2 | Very low | 39.4 | Very low | 137 Ų | 137 | 156 Ų | 156 | 73% | 0.733 | 78% | 0.784 | S | S | * | * | | | trans | -56.3 | 124.4 | 158.9 | -76.5 | -73.1 | 0 | 0 | 0 | 108.9 | I179 | I179-D181 PolarHBondContact O-N 2.92Š|
| 182 | D | 42.4 | Very low | 39.6 | Very low | 149 Ų | 149 | 158.3 Ų | 158.3 | 80% | 0.797 | 79% | 0.791 | S | S | * | * | | | trans | -166.5 | 92.3 | 140 | -86 | -34.5 | 0 | 0 | 0 | 107.9 | D180 | D180-D182 PolarHBondContact O-N 2.89Š|
| 183 | D | 43.7 | Very low | 38.7 | Very low | 151 Ų | 151 | 155.9 Ų | 155.9 | 81% | 0.807 | 79% | 0.788 | S | S | * | * | | | trans | 66.7 | 130.6 | 138.3 | -59.4 | -43.2 | 0 | 0 | 0 | 122.8 | | |
| 184 | E | 38.7 | Very low | 38.8 | Very low | 158 Ų | 158 | 153 Ų | 153 | 74% | 0.738 | 78% | 0.782 | S | S | * | * | | | trans | 93.3 | 86.5 | 152.5 | -137.5 | 175.4 | 81.6 | 0 | 0 | 117.1 | | |
| 185 | F | 29.4 | Very low | 38.1 | Very low | 189 Ų | 189 | 155 Ų | 155 | 83% | 0.829 | 79% | 0.789 | S | S | * | * | | | | 156.3 | 68.3 | 123.7 | -81.9 | -70.6 | 0 | 0 | 0 | 109.4 | | |
| 186 | Q | 37.6 | Very low | 38.3 | Very low | 182 Ų | 182 | 152.8 Ų | 152.8 | 85% | 0.85 | 79% | 0.787 | S | S | * | * | | | trans | -105.6 | 116.8 | 164.7 | -174.7 | 165.9 | 26 | 0 | 0 | 107.4 | | |
| 187 | E | 36.2 | Very low | 37.9 | Very low | 181 Ų | 181 | 156.6 Ų | 156.6 | 85% | 0.846 | 79% | 0.794 | S | S | * | * | | | trans | 160.8 | 112.6 | 162 | -92.1 | 164.6 | 161.1 | 0 | 0 | 104.8 | | |
| 188 | L | 36.3 | Very low | 38.3 | Very low | 169 Ų | 169 | 149.1 Ų | 149.1 | 89% | 0.885 | 77% | 0.774 | S | S | * | * | | | cis | -149.1 | 107.1 | 33.1 | -69.1 | 94 | 0 | 0 | 0 | 109.8 | | |
| 189 | E | 32.7 | Very low | 38.1 | Very low | 192 Ų | 192 | 153.2 Ų | 153.2 | 90% | 0.897 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -124.5 | 131.3 | 151.4 | -81.6 | -170.8 | 92.9 | 0 | 0 | 107.7 | | |
| 190 | S | 33.8 | Very low | 38.4 | Very low | 117 Ų | 117 | 151.3 Ų | 151.3 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | | | trans | 78.8 | 104.2 | 166.3 | 73.3 | 0 | 0 | 0 | 0 | 119.1 | | |
| 191 | E | 34.7 | Very low | 38.4 | Very low | 209 Ų | 209 | 150.5 Ų | 150.5 | 98% | 0.977 | 78% | 0.777 | S | S | * | * | | | | -106.1 | 124.6 | 129.9 | -98.5 | -176.9 | 116.1 | 0 | 0 | 108.8 | | |
| 192 | Y | 43.1 | Very low | 38.6 | Very low | 204 Ų | 204 | 152.1 Ų | 152.1 | 80% | 0.8 | 78% | 0.777 | S | S | * | * | | | trans | -78 | 132.7 | -176.3 | 163.8 | -90.3 | 0 | 0 | 0 | 110.7 | | |
| 193 | S | 31.7 | Very low | 38.9 | Very low | 108 Ų | 108 | 152.5 Ų | 152.5 | 76% | 0.755 | 78% | 0.778 | S | S | * | * | | | trans | -153.2 | 105 | 141.9 | -161.7 | 0 | 0 | 0 | 0 | 109.6 | | |
| 194 | S | 40.4 | Very low | 39.2 | Very low | 75 Ų | 75 | 154.9 Ų | 154.9 | 52% | 0.524 | 79% | 0.787 | S | S | . | * | | | trans | -66.8 | 119.8 | 169.1 | 169.2 | 0 | 0 | 0 | 0 | 110.4 | | |
| 195 | D | 28.8 | Very low | 39.5 | Very low | 149 Ų | 149 | 155.7 Ų | 155.7 | 80% | 0.797 | 79% | 0.793 | S | S | * | * | | | trans | -135.2 | 118.9 | 146.6 | -88.4 | -50.9 | 0 | 0 | 0 | 108.9 | | |
| 196 | S | 43.7 | Very low | 40.3 | Very low | 107 Ų | 107 | 151.7 Ų | 151.7 | 75% | 0.748 | 79% | 0.786 | S | S | * | * | | | trans | -77.3 | 120.1 | 170.2 | -69.5 | 0 | 0 | 0 | 0 | 108.8 | | |
| 197 | E | 34.3 | Very low | 40.6 | Very low | 169 Ų | 169 | 148.3 Ų | 148.3 | 79% | 0.79 | 78% | 0.78 | S | S | * | * | | | trans | -173.1 | 123.7 | 142.3 | 50.6 | -168 | 119.8 | 0 | 0 | 113.1 | | |
| 198 | S | 44.4 | Very low | 41.5 | Very low | 64 Ų | 64 | 150 Ų | 150 | 45% | 0.448 | 78% | 0.778 | S | S | . | * | | | trans | 56 | 105.6 | 146 | 51.5 | 0 | 0 | 0 | 0 | 119.5 | D200 | S198-D200 WeakPolarHBondContact CB-OD1 3.35Å; S198-D200 PolarHBondContact O-N 3.34Å |
| 199 | E | 39.9 | Very low | 41.9 | Very low | 211 Ų | 211 | 147.1 Ų | 147.1 | 99% | 0.986 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -61.8 | 23.1 | 157.3 | 55 | -166.7 | 79.9 | 0 | 0 | 115 | | |
| 200 | D | 49.5 | Very low | 43 | Very low | 100 Ų | 100 | 145.7 Ų | 145.7 | 54% | 0.535 | 76% | 0.757 | S | S | . | * | | | trans | -134 | 53.6 | -175.6 | 68.3 | -81.4 | 0 | 0 | 0 | 114.9 | S198 | S198-D200 WeakPolarHBondContact CB-OD1 3.35Å; S198-D200 PolarHBondContact O-N 3.34Å |
| 201 | N | 43.4 | Very low | 44 | Very low | 140 Ų | 140 | 146.3 Ų | 146.3 | 75% | 0.749 | 75% | 0.751 | S | S | * | * | | | trans | -137.3 | 76.8 | 159.9 | -91 | -72.9 | 0 | 0 | 0 | 113.6 | | |
| 202 | F | 45.2 | Very low | 45.2 | Very low | 171 Ų | 171 | 138.4 Ų | 138.4 | 75% | 0.75 | 73% | 0.725 | S | S | * | * | | | trans | 28.2 | 113.5 | 132.1 | -70.9 | -91.2 | 0 | 0 | 0 | 119.5 | | |
| 203 | L | 49.3 | Very low | 45.8 | Very low | 156 Ų | 156 | 134.8 Ų | 134.8 | 82% | 0.817 | 72% | 0.719 | S | S | * | * | | | trans | 75.2 | 60.1 | 136.7 | -51.7 | -179.1 | 0 | 0 | 0 | 120.3 | | |
| 204 | M | 51 | Low | 47.1 | Very low | 202 Ų | 202 | 133 Ų | 133 | 100% | 0.995 | 71% | 0.706 | S | S | * | * | | | trans | -155.4 | 72 | 145.4 | -119.8 | 162 | 97.4 | 0 | 0 | 114.1 | | |
| 205 | M | 43.9 | Very low | 48.3 | Very low | 175 Ų | 175 | 132.9 Ų | 132.9 | 86% | 0.862 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -150.1 | 126.6 | 149.4 | -157.9 | 155.8 | -152.6 | 0 | 0 | 109.6 | | |
| 206 | P | 47.6 | Very low | 49.8 | Very low | 104 Ų | 104 | 130.6 Ų | 130.6 | 68% | 0.675 | 69% | 0.685 | S | S | * | * | | | trans | -62.9 | 135.3 | 179.3 | -18.2 | 30.2 | 0 | 0 | 0 | 110.3 | R208 | P206-R208 PolarHBondContact O-N 3Š|
| 207 | P | 43.1 | Very low | 50.5 | Low | 112 Ų | 112 | 128.5 Ų | 128.5 | 73% | 0.727 | 67% | 0.671 | S | S | * | * | | | trans | -63.8 | 101.2 | -178.1 | -16.4 | 28.7 | 0 | 0 | 0 | 111.2 | | |
| 208 | R | 55 | Low | 51.8 | Low | 215 Ų | 215 | 126.1 Ų | 126.1 | 81% | 0.811 | 66% | 0.661 | S | S | * | * | | | trans | -117.4 | 113.3 | 162.8 | -65.6 | -164.1 | -174.3 | 171.3 | 3.4 | 103.2 | P206 | P206-R208 PolarHBondContact O-N 3Š|
| 209 | D | 45.1 | Very low | 52.8 | Low | 109 Ų | 109 | 127.8 Ų | 127.8 | 58% | 0.583 | 67% | 0.668 | S | S | * | * | S | Bend | cis | -165.4 | 68.9 | 49.8 | -71.1 | -62.4 | 0 | 0 | 0 | 111.8 | | |
| 210 | H | 54.4 | Low | 53.7 | Low | 162 Ų | 162 | 118.3 Ų | 118.3 | 75% | 0.75 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -99.6 | -22.3 | 163.7 | -47.8 | -52.2 | 0 | 0 | 0 | 111.8 | S214 | H210-S214 WeakPolarHBondContact O-CB 3.49Å; H210-S214 PolarHBondContact O-N 3.3Å; H210-S214 VanDerWaalsContact O-N 3.11Å |
| 211 | L | 54.6 | Low | 54 | Low | 131 Ų | 131 | 115.7 Ų | 115.7 | 69% | 0.686 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -72.8 | -42.2 | 175.1 | -83.7 | 156 | 0 | 0 | 0 | 111.7 | S214 V215 | L211-S214 PolarHBondContact O-N 3.44Å; L211-V215 VanDerWaalsContact O-CB 3.28Å; L211-V215 WeakPolarHBondContact O-CB 3.28Å; L211-V215 VanDerWaalsContact O-CG2 3.22Å; L211-V215 WeakPolarHBondContact O-CG2 3.41Å; L211-V215 PolarHBondContact O-N 3.21Å |
| 212 | G | 60.8 | Low | 54.6 | Low | 42 Ų | 42 | 116.3 Ų | 116.3 | 43% | 0.433 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -63.9 | -44.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.3 | F216 | G212-F216 WeakPolarHBondContact O-CB 3.42Å; G212-F216 PolarHBondContact O-N 2.91Å |
| 213 | L | 55.3 | Low | 55.2 | Low | 128 Ų | 128 | 118.3 Ų | 118.3 | 67% | 0.67 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -67.1 | -39 | 176.5 | -125.5 | 88.6 | 0 | 0 | 0 | 112.6 | S217 | L213-S217 WeakPolarHBondContact O-CB 3.36Å; L213-S217 PolarHBondContact O-N 3.35Å |
| 214 | S | 59.6 | Low | 55.4 | Low | 71 Ų | 71 | 115 Ų | 115 | 50% | 0.497 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -70.1 | -43.1 | 177.7 | 179.8 | 0 | 0 | 0 | 0 | 112.1 | H210 L211 S217 M218 | H210-S214 WeakPolarHBondContact O-CB 3.49Å; H210-S214 PolarHBondContact O-N 3.3Å; H210-S214 VanDerWaalsContact O-N 3.11Å; L211-S214 PolarHBondContact O-N 3.44Å; S214-S217 CarbonylContact O-C 3.51Å; S214-S217 WeakPolarHBondContact O-CB 3.39Å; S214-S217 PolarHBondContact O-N 2.99Å; S214-M218 VanDerWaalsContact O-CB 3.27Å; S214-M218 WeakPolarHBondContact O-CB 3.32Å; S214-M218 PolarHBondContact O-N 3.13Å |
| 215 | V | 64.8 | Low | 55.4 | Low | 72 Ų | 72 | 112.2 Ų | 112.2 | 44% | 0.436 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -67.5 | -40.7 | 174.6 | 171.3 | 0 | 0 | 0 | 0 | 110.4 | L211 S217 M218 V219 | L211-V215 VanDerWaalsContact O-CB 3.28Å; L211-V215 WeakPolarHBondContact O-CB 3.28Å; L211-V215 VanDerWaalsContact O-CG2 3.22Å; L211-V215 WeakPolarHBondContact O-CG2 3.41Å; L211-V215 PolarHBondContact O-N 3.21Å; V215-S217 VanDerWaalsContact C-N 3.33Å; V215-S217 PolarHBondContact O-N 3.25Å; V215-M218 CarbonylContact O-C 3.49Å; V215-M218 PolarHBondContact O-N 3.44Å; V215-M218 VanDerWaalsContact O-N 3.14Å; V215-V219 HydrophobicContact CG1-CG2 4.09Å; V215-V219 VanDerWaalsContact O-CB 3.3Å; V215-V219 WeakPolarHBondContact O-CB 3.22Å; V215-V219 WeakPolarHBondContact O-CG2 3.35Å; V215-V219 PolarHBondContact O-N 2.9Å |
| 216 | F | 60.5 | Low | 56 | Low | 101 Ų | 101 | 105.6 Ų | 105.6 | 44% | 0.443 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -60.6 | -44.8 | 172.3 | -179.5 | -102.9 | 0 | 0 | 0 | 110.8 | G212 M218 V219 C220 | G212-F216 WeakPolarHBondContact O-CB 3.42Å; G212-F216 PolarHBondContact O-N 2.91Å; F216-M218 VanDerWaalsContact C-N 3.27Å; F216-M218 PolarHBondContact O-N 3.37Å; F216-V219 PolarHBondContact O-N 2.92Å; F216-C220 WeakPolarHBondContact O-CB 3.36Å; F216-C220 PolarHBondContact O-N 3.38Å; F216-C220 PolarHBondContact O-SG 3.22Å |
| 217 | S | 58.5 | Low | 56.3 | Low | 64 Ų | 64 | 105.4 Ų | 105.4 | 45% | 0.448 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -61.5 | -33.2 | 173.5 | -173.2 | 0 | 0 | 0 | 0 | 112.5 | L213 S214 V215 C220 C221 | L213-S217 WeakPolarHBondContact O-CB 3.36Å; L213-S217 PolarHBondContact O-N 3.35Å; S214-S217 CarbonylContact O-C 3.51Å; S214-S217 WeakPolarHBondContact O-CB 3.39Å; S214-S217 PolarHBondContact O-N 2.99Å; V215-S217 VanDerWaalsContact C-N 3.33Å; V215-S217 PolarHBondContact O-N 3.25Å; S217-C220 WeakPolarHBondContact CA-SG 3.17Å; S217-C220 PolarHBondContact O-SG 3.42Å; S217-C220 VanDerWaalsContact O-SG 3.36Å; S217-C221 WeakPolarHBondContact O-CB 3.42Å; S217-C221 PolarHBondContact O-SG 3.49Å |
| 218 | M | 62.9 | Low | 56.7 | Low | 119 Ų | 119 | 103.5 Ų | 103.5 | 59% | 0.586 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -80.4 | -37.6 | 179.5 | -163.6 | 157.8 | 70.1 | 0 | 0 | 111.1 | S214 V215 F216 C221 F222 | S214-M218 VanDerWaalsContact O-CB 3.27Å; S214-M218 WeakPolarHBondContact O-CB 3.32Å; S214-M218 PolarHBondContact O-N 3.13Å; V215-M218 CarbonylContact O-C 3.49Å; V215-M218 PolarHBondContact O-N 3.44Å; V215-M218 VanDerWaalsContact O-N 3.14Å; F216-M218 VanDerWaalsContact C-N 3.27Å; F216-M218 PolarHBondContact O-N 3.37Å; M218-C221 CarbonylContact O-C 3.58Å; M218-C221 PolarHBondContact O-N 3.01Å; M218-F222 WeakPolarHBondContact O-CB 3.19Å; M218-F222 PolarHBondContact O-N 3.46Å |
| 219 | V | 63.7 | Low | 56.6 | Low | 98 Ų | 98 | 95 Ų | 95 | 59% | 0.594 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -73.3 | -39.6 | 177.6 | 169.8 | 0 | 0 | 0 | 0 | 111.7 | V215 F216 C221 F222 | V215-V219 HydrophobicContact CG1-CG2 4.09Å; V215-V219 VanDerWaalsContact O-CB 3.3Å; V215-V219 WeakPolarHBondContact O-CB 3.22Å; V215-V219 WeakPolarHBondContact O-CG2 3.35Å; V215-V219 PolarHBondContact O-N 2.9Å; F216-V219 PolarHBondContact O-N 2.92Å; V219-C221 PolarHBondContact O-N 2.92Å; V219-F222 PolarHBondContact O-N 3.48Å |
| 220 | C | 59.3 | Low | 57.1 | Low | 13 Ų | 13 | 97.6 Ų | 97.6 | 9% | 0.088 | 53% | 0.534 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.2 | -1.9 | 171.7 | 72.9 | 0 | 0 | 0 | 0 | 113.1 | F216 S217 S262 | F216-C220 WeakPolarHBondContact O-CB 3.36Å; F216-C220 PolarHBondContact O-N 3.38Å; F216-C220 PolarHBondContact O-SG 3.22Å; S217-C220 WeakPolarHBondContact CA-SG 3.17Å; S217-C220 PolarHBondContact O-SG 3.42Å; S217-C220 VanDerWaalsContact O-SG 3.36Å; C220-S262 CarbonylContact O-C 3.53Å; C220-S262 VanDerWaalsContact O-O 3.14Å; C220-S262 PolarHBondContact O-OG 2.93Å |
| 221 | C | 56.8 | Low | 57.2 | Low | 45 Ų | 45 | 98.8 Ų | 98.8 | 30% | 0.304 | 53% | 0.533 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.1 | -15.7 | 170.8 | -67.5 | 0 | 0 | 0 | 0 | 114.1 | S217 M218 V219 | S217-C221 WeakPolarHBondContact O-CB 3.42Å; S217-C221 PolarHBondContact O-SG 3.49Å; M218-C221 CarbonylContact O-C 3.58Å; M218-C221 PolarHBondContact O-N 3.01Å; V219-C221 PolarHBondContact O-N 2.92Å |
| 222 | F | 55.9 | Low | 57.1 | Low | 152 Ų | 152 | 97.7 Ų | 97.7 | 67% | 0.667 | 53% | 0.528 | S | S | * | . | | | trans | -125 | 70.7 | -175.6 | -101.6 | -91.8 | 0 | 0 | 0 | 112.5 | M218 V219 | M218-F222 WeakPolarHBondContact O-CB 3.19Å; M218-F222 PolarHBondContact O-N 3.46Å; V219-F222 PolarHBondContact O-N 3.48Å |
| 223 | W | 58 | Low | 56.8 | Low | 214 Ų | 214 | 99.2 Ų | 99.2 | 81% | 0.811 | 53% | 0.531 | S | S | * | . | S | Bend | trans | -137.9 | 141.4 | 136.8 | -131.4 | 35.6 | 0 | 0 | 0 | 106 | L225 | W223-L225 PolarHBondContact O-N 2.95Š|
| 224 | P | 52.8 | Low | 56.2 | Low | 86 Ų | 86 | 100.2 Ų | 100.2 | 56% | 0.558 | 53% | 0.533 | S | S | * | . | S | Bend | | -51.3 | 6.3 | -126.7 | 22.9 | -37 | 0 | 0 | 0 | 121.3 | I227 | P224-I227 HydrophobicContact CB-CD1 4.32Å; P224-I227 WeakPolarHBondContact O-CB 3.5Å; P224-I227 WeakPolarHBondContact O-CD1 3.28Å |
| 225 | L | 50.4 | Low | 55.6 | Low | 143 Ų | 143 | 104 Ų | 104 | 75% | 0.749 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.8 | -6.8 | -174.5 | -110.9 | 80 | 0 | 0 | 0 | 115.9 | W223 I227 | W223-L225 PolarHBondContact O-N 2.95Å; L225-I227 PolarHBondContact O-N 3.37Å |
| 226 | G | 57.9 | Low | 54.7 | Low | 36 Ų | 36 | 104.3 Ų | 104.3 | 37% | 0.371 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -67.2 | -13.7 | 166.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | | |
| 227 | I | 53.9 | Low | 54.1 | Low | 100 Ų | 100 | 104.8 Ų | 104.8 | 51% | 0.513 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -81.5 | -28.7 | -167 | -62.5 | 167.3 | 0 | 0 | 0 | 112.8 | P224 L225 Y231 | P224-I227 HydrophobicContact CB-CD1 4.32Å; P224-I227 WeakPolarHBondContact O-CB 3.5Å; P224-I227 WeakPolarHBondContact O-CD1 3.28Å; L225-I227 PolarHBondContact O-N 3.37Å; I227-Y231 PolarHBondContact O-N 2.92Å |
| 228 | A | 50.3 | Low | 53.4 | Low | 73 Ų | 73 | 110.7 Ų | 110.7 | 60% | 0.603 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -79.5 | -27.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | F230 Y231 L232 | A228-F230 VanDerWaalsContact C-N 3.29Å; A228-F230 PolarHBondContact O-N 2.88Å; A228-Y231 PolarHBondContact O-N 2.98Å; A228-L232 PolarHBondContact O-N 3.48Å |
| 229 | A | 53.1 | Low | 52.5 | Low | 35 Ų | 35 | 108.7 Ų | 108.7 | 29% | 0.289 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -66.3 | -29.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | S233 L258 | A229-S233 PolarHBondContact O-OG 3.27Å; A229-L258 HydrophobicContact CB-CD1 3.7Å; A229-L258 HydrophobicContact CB-CD2 4.08Å; A229-L258 HydrophobicContact CB-CG 4.41Å |
| 230 | F | 55.9 | Low | 51.6 | Low | 165 Ų | 165 | 108.9 Ų | 108.9 | 72% | 0.724 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -84.1 | -27.8 | 172.8 | -159.8 | -95.7 | 0 | 0 | 0 | 112.2 | A228 S233 | A228-F230 VanDerWaalsContact C-N 3.29Å; A228-F230 PolarHBondContact O-N 2.88Å; F230-S233 PolarHBondContact O-N 3.4Å |
| 231 | Y | 56.3 | Low | 50.7 | Low | 186 Ų | 186 | 113.4 Ų | 113.4 | 73% | 0.729 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -73.4 | -34.7 | -176 | -148.9 | -97.2 | 0 | 0 | 0 | 113.3 | I227 A228 S233 H234 | I227-Y231 PolarHBondContact O-N 2.92Å; A228-Y231 PolarHBondContact O-N 2.98Å; Y231-S233 VanDerWaalsContact C-N 3.33Å; Y231-H234 WeakPolarHBondContact O-CB 3.2Å; Y231-H234 PolarHBondContact O-N 3.32Å |
| 232 | L | 53.4 | Low | 50.3 | Low | 109 Ų | 109 | 120.1 Ų | 120.1 | 57% | 0.571 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -77.9 | -17.3 | 176 | -170 | 59 | 0 | 0 | 0 | 113.5 | A228 H234 T236 | A228-L232 PolarHBondContact O-N 3.48Å; L232-H234 PolarHBondContact O-N 2.89Å; L232-T236 PolarHBondContact O-N 2.89Å; L232-T236 PolarHBondContact O-OG1 3.42Å |
| 233 | S | 52.9 | Low | 49.9 | Very low | 73 Ų | 73 | 115.6 Ų | 115.6 | 51% | 0.51 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -72.7 | -16.3 | 169.3 | -60.8 | 0 | 0 | 0 | 0 | 112.6 | A229 F230 Y231 | A229-S233 PolarHBondContact O-OG 3.27Å; F230-S233 PolarHBondContact O-N 3.4Å; Y231-S233 VanDerWaalsContact C-N 3.33Å |
| 234 | H | 44.1 | Very low | 49.1 | Very low | 150 Ų | 150 | 112.4 Ų | 112.4 | 69% | 0.694 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -86.9 | -28.2 | 177.7 | -156.8 | -89.6 | 0 | 0 | 0 | 113.4 | Y231 L232 | Y231-H234 WeakPolarHBondContact O-CB 3.2Å; Y231-H234 PolarHBondContact O-N 3.32Å; L232-H234 PolarHBondContact O-N 2.89Å |
| 235 | E | 46.8 | Very low | 49 | Very low | 151 Ų | 151 | 117.6 Ų | 117.6 | 71% | 0.706 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -82.8 | -32.3 | 177 | -160.4 | 88.5 | 163.6 | 0 | 0 | 112.2 | | |
| 236 | T | 44.7 | Very low | 48.6 | Very low | 77 Ų | 77 | 119.4 Ų | 119.4 | 47% | 0.472 | 64% | 0.642 | S | S | . | * | G | 310 helix | trans | -83.3 | -13.9 | -174.5 | 50.4 | 0 | 0 | 0 | 0 | 114.5 | L232 K238 A239 | L232-T236 PolarHBondContact O-N 2.89Å; L232-T236 PolarHBondContact O-OG1 3.42Å; T236-K238 VanDerWaalsContact C-N 3.29Å; T236-K238 PolarHBondContact O-N 3.48Å; T236-A239 PolarHBondContact O-N 3.25Å |
| 237 | N | 48.8 | Very low | 48 | Very low | 112 Ų | 112 | 123.8 Ų | 123.8 | 60% | 0.599 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -78.7 | -8.2 | 175.9 | -158.3 | -10.5 | 0 | 0 | 0 | 113.3 | A239 | N237-A239 VanDerWaalsContact C-N 3.28Å; N237-A239 PolarHBondContact O-N 3Å |
| 238 | K | 42.7 | Very low | 47.5 | Very low | 187 Ų | 187 | 122.4 Ų | 122.4 | 81% | 0.813 | 66% | 0.66 | S | S | * | * | G | 310 helix | trans | -77.1 | -13.7 | 171.5 | -72.3 | -147.1 | 162.9 | -168.3 | 0 | 113.9 | T236 S241 | T236-K238 VanDerWaalsContact C-N 3.29Å; T236-K238 PolarHBondContact O-N 3.48Å; K238-S241 PolarHBondContact O-OG 3.48Å |
| 239 | A | 45.5 | Very low | 47.5 | Very low | 77 Ų | 77 | 123 Ų | 123 | 64% | 0.636 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -101.8 | -0.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | T236 N237 S241 | T236-A239 PolarHBondContact O-N 3.25Å; N237-A239 VanDerWaalsContact C-N 3.28Å; N237-A239 PolarHBondContact O-N 3Å; A239-S241 PolarHBondContact O-N 3.07Å |
| 240 | V | 44.1 | Very low | 47.3 | Very low | 102 Ų | 102 | 124 Ų | 124 | 62% | 0.618 | 66% | 0.664 | S | S | * | * | | | trans | -85.3 | 10.4 | 177.6 | 179.1 | 0 | 0 | 0 | 0 | 111.9 | K242 | V240-K242 PolarHBondContact O-N 3.03Š|
| 241 | S | 41.4 | Very low | 47.1 | Very low | 108 Ų | 108 | 120.2 Ų | 120.2 | 76% | 0.755 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78 | 11.3 | 175 | 47.2 | 0 | 0 | 0 | 0 | 114.5 | K238 A239 | K238-S241 PolarHBondContact O-OG 3.48Å; A239-S241 PolarHBondContact O-N 3.07Å |
| 242 | K | 47.3 | Very low | 47.1 | Very low | 187 Ų | 187 | 114.6 Ų | 114.6 | 81% | 0.813 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.9 | -0.3 | 179.9 | -78 | -175 | 178.4 | 177.4 | 0 | 116.3 | V240 D244 | V240-K242 PolarHBondContact O-N 3.03Å; K242-D244 PolarHBondContact O-N 2.91Å |
| 243 | G | 48.1 | Very low | 47.2 | Very low | 56 Ų | 56 | 117.7 Ų | 117.7 | 58% | 0.577 | 65% | 0.65 | S | S | * | * | | | trans | 65.6 | 40.5 | 156.2 | 0 | 0 | 0 | 0 | 0 | 118.2 | | |
| 244 | D | 41.4 | Very low | 47.4 | Very low | 148 Ų | 148 | 122.5 Ų | 122.5 | 79% | 0.791 | 66% | 0.657 | S | S | * | * | | | trans | -112.4 | 111.6 | 169.2 | -81.7 | -43.9 | 0 | 0 | 0 | 111.8 | K242 H246 | K242-D244 PolarHBondContact O-N 2.91Å; D244-H246 VanDerWaalsContact C-N 3.26Å; D244-H246 PolarHBondContact O-N 2.82Å; D244-H246 VanDerWaalsContact O-N 3.14Å |
| 245 | F | 49.8 | Very low | 48.6 | Very low | 195 Ų | 195 | 118.1 Ų | 118.1 | 86% | 0.855 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | 21.2 | -169.4 | -86.7 | -91.2 | 0 | 0 | 0 | 115.6 | | |
| 246 | H | 42.8 | Very low | 49.6 | Very low | 180 Ų | 180 | 116.1 Ų | 116.1 | 83% | 0.833 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.1 | -10.4 | 172.4 | -160.9 | -99.5 | 0 | 0 | 0 | 113.1 | D244 | D244-H246 VanDerWaalsContact C-N 3.26Å; D244-H246 PolarHBondContact O-N 2.82Å; D244-H246 VanDerWaalsContact O-N 3.14Å |
| 247 | L | 44.9 | Very low | 50.6 | Low | 129 Ų | 129 | 119.3 Ų | 119.3 | 68% | 0.675 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -95.7 | -4.4 | -174.6 | -152.3 | 73.5 | 0 | 0 | 0 | 114.5 | S249 S250 | L247-S249 VanDerWaalsContact C-N 3.31Å; L247-S249 PolarHBondContact O-N 3.42Å; L247-S250 PolarHBondContact O-N 3.11Å; L247-S250 PolarHBondContact O-OG 3.5Å |
| 248 | A | 43.6 | Very low | 51.5 | Low | 71 Ų | 71 | 118 Ų | 118 | 59% | 0.587 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | -29.7 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | S250 S251 | A248-S250 VanDerWaalsContact C-N 3.3Å; A248-S250 PolarHBondContact O-N 2.84Å; A248-S251 PolarHBondContact O-N 3.29Å |
| 249 | S | 49.6 | Very low | 52.8 | Low | 84 Ų | 84 | 111.1 Ų | 111.1 | 59% | 0.587 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -68.7 | -26.2 | 177.9 | -172.1 | 0 | 0 | 0 | 0 | 113.3 | L247 S251 S252 | L247-S249 VanDerWaalsContact C-N 3.31Å; L247-S249 PolarHBondContact O-N 3.42Å; S249-S251 VanDerWaalsContact C-N 3.3Å; S249-S251 PolarHBondContact O-N 2.78Å; S249-S252 PolarHBondContact O-N 2.82Å |
| 250 | S | 49.3 | Very low | 54.3 | Low | 58 Ų | 58 | 111.4 Ų | 111.4 | 41% | 0.406 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -71.9 | -21.7 | -179.3 | 74.1 | 0 | 0 | 0 | 0 | 114 | L247 A248 | L247-S250 PolarHBondContact O-N 3.11Å; L247-S250 PolarHBondContact O-OG 3.5Å; A248-S250 VanDerWaalsContact C-N 3.3Å; A248-S250 PolarHBondContact O-N 2.84Å |
| 251 | S | 51 | Low | 55.8 | Low | 85 Ų | 85 | 111.1 Ų | 111.1 | 59% | 0.594 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -71.3 | -31.4 | 178.3 | -168.9 | 0 | 0 | 0 | 0 | 112.3 | A248 S249 A255 | A248-S251 PolarHBondContact O-N 3.29Å; S249-S251 VanDerWaalsContact C-N 3.3Å; S249-S251 PolarHBondContact O-N 2.78Å; S251-A255 PolarHBondContact O-N 2.76Å |
| 252 | S | 56 | Low | 57.4 | Low | 67 Ų | 67 | 107.4 Ų | 107.4 | 47% | 0.469 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -71.3 | -41.8 | -179.2 | 178.9 | 0 | 0 | 0 | 0 | 112.8 | S249 R254 A255 L256 | S249-S252 PolarHBondContact O-N 2.82Å; S252-R254 VanDerWaalsContact C-N 3.32Å; S252-R254 PolarHBondContact O-N 3.06Å; S252-A255 PolarHBondContact O-N 3.34Å; S252-L256 WeakPolarHBondContact O-CG 3.22Å; S252-L256 PolarHBondContact O-N 3.49Å |
| 253 | R | 56.2 | Low | 58.9 | Low | 175 Ų | 175 | 102.1 Ų | 102.1 | 66% | 0.66 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -61.4 | -41.2 | 179.5 | -63.2 | -175 | -174.1 | -156.5 | -0.1 | 111.5 | L256 F257 | R253-L256 PolarHBondContact O-N 3.32Å; R253-F257 WeakPolarHBondContact O-CD2 3.28Å; R253-F257 PolarHBondContact O-N 3.36Å |
| 254 | R | 57.6 | Low | 60.5 | Low | 174 Ų | 174 | 103.3 Ų | 103.3 | 66% | 0.657 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -67.9 | -37.9 | 178.7 | -58.5 | -179.3 | 90.5 | -171.7 | 6.2 | 112 | S252 L258 | S252-R254 VanDerWaalsContact C-N 3.32Å; S252-R254 PolarHBondContact O-N 3.06Å; R254-L258 WeakPolarHBondContact O-CD1 3.07Å; R254-L258 WeakPolarHBondContact O-CG 3.37Å; R254-L258 PolarHBondContact O-N 3.37Å; R254-L258 VanDerWaalsContact O-N 3.13Å |
| 255 | A | 69.4 | Low | 62.5 | Low | 58 Ų | 58 | 100.5 Ų | 100.5 | 48% | 0.479 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66.7 | -40.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | S251 S252 L258 A259 | S251-A255 PolarHBondContact O-N 2.76Å; S252-A255 PolarHBondContact O-N 3.34Å; A255-L258 PolarHBondContact O-N 3.14Å; A255-A259 WeakPolarHBondContact O-CB 3.16Å; A255-A259 PolarHBondContact O-N 2.97Å |
| 256 | L | 67.3 | Low | 64.1 | Low | 108 Ų | 108 | 92.2 Ų | 92.2 | 57% | 0.565 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.3 | -43.1 | 175.2 | -72.5 | 174.7 | 0 | 0 | 0 | 112.1 | S252 R253 L258 A259 V260 | S252-L256 WeakPolarHBondContact O-CG 3.22Å; S252-L256 PolarHBondContact O-N 3.49Å; R253-L256 PolarHBondContact O-N 3.32Å; L256-L258 VanDerWaalsContact C-N 3.34Å; L256-L258 PolarHBondContact O-N 2.69Å; L256-A259 PolarHBondContact O-N 2.91Å; L256-V260 VanDerWaalsContact O-CG2 3.28Å; L256-V260 WeakPolarHBondContact O-CG2 3.14Å; L256-V260 PolarHBondContact O-N 3.45Å |
| 257 | F | 66.8 | Low | 66 | Low | 145 Ų | 145 | 86.2 Ų | 86.2 | 64% | 0.636 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.2 | -40.5 | 175.4 | -81.3 | -68 | 0 | 0 | 0 | 112.5 | R253 V260 L261 | R253-F257 WeakPolarHBondContact O-CD2 3.28Å; R253-F257 PolarHBondContact O-N 3.36Å; F257-V260 PolarHBondContact O-N 3.03Å; F257-L261 WeakPolarHBondContact O-CB 3.45Å; F257-L261 WeakPolarHBondContact O-CG 3.42Å; F257-L261 PolarHBondContact O-N 3.24Å |
| 258 | L | 66.1 | Low | 68 | Low | 84 Ų | 84 | 82.3 Ų | 82.3 | 44% | 0.44 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -67.1 | -39.6 | 176.4 | -72.8 | 166.5 | 0 | 0 | 0 | 112.2 | A229 R254 A255 L256 L261 S262 | A229-L258 HydrophobicContact CB-CD1 3.7Å; A229-L258 HydrophobicContact CB-CD2 4.08Å; A229-L258 HydrophobicContact CB-CG 4.41Å; R254-L258 WeakPolarHBondContact O-CD1 3.07Å; R254-L258 WeakPolarHBondContact O-CG 3.37Å; R254-L258 PolarHBondContact O-N 3.37Å; R254-L258 VanDerWaalsContact O-N 3.13Å; A255-L258 PolarHBondContact O-N 3.14Å; L256-L258 VanDerWaalsContact C-N 3.34Å; L256-L258 PolarHBondContact O-N 2.69Å; L258-L261 PolarHBondContact O-N 3.18Å; L258-S262 VanDerWaalsContact O-CB 3.28Å; L258-S262 WeakPolarHBondContact O-CB 3.36Å; L258-S262 PolarHBondContact O-N 2.97Å |
| 259 | A | 71.4 | Confident | 70.1 | Confident | 42 Ų | 42 | 83 Ų | 83 | 35% | 0.347 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.9 | -47.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111 | A255 L256 S262 I263 | A255-A259 WeakPolarHBondContact O-CB 3.16Å; A255-A259 PolarHBondContact O-N 2.97Å; L256-A259 PolarHBondContact O-N 2.91Å; A259-S262 WeakPolarHBondContact O-CB 3.43Å; A259-S262 PolarHBondContact O-N 2.83Å; A259-I263 WeakPolarHBondContact O-CD1 3.45Å; A259-I263 WeakPolarHBondContact O-CG1 3.3Å; A259-I263 PolarHBondContact O-N 2.7Å |
| 260 | V | 76.1 | Confident | 71.8 | Confident | 83 Ų | 83 | 86.6 Ų | 86.6 | 50% | 0.503 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.9 | -41.4 | 178.7 | 173.6 | 0 | 0 | 0 | 0 | 112.2 | L256 F257 S262 I263 T264 | L256-V260 VanDerWaalsContact O-CG2 3.28Å; L256-V260 WeakPolarHBondContact O-CG2 3.14Å; L256-V260 PolarHBondContact O-N 3.45Å; F257-V260 PolarHBondContact O-N 3.03Å; V260-S262 VanDerWaalsContact C-N 3.34Å; V260-I263 PolarHBondContact O-N 3.3Å; V260-T264 WeakPolarHBondContact O-CG2 3.21Å; V260-T264 PolarHBondContact O-N 3.46Å; V260-T264 PolarHBondContact O-OG1 3.23Å |
| 261 | L | 75.5 | Confident | 73.7 | Confident | 96 Ų | 96 | 87.7 Ų | 87.7 | 50% | 0.503 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.3 | -38.5 | 175.3 | -70.9 | 172.1 | 0 | 0 | 0 | 111.7 | F257 L258 T264 I265 | F257-L261 WeakPolarHBondContact O-CB 3.45Å; F257-L261 WeakPolarHBondContact O-CG 3.42Å; F257-L261 PolarHBondContact O-N 3.24Å; L258-L261 PolarHBondContact O-N 3.18Å; L261-T264 WeakPolarHBondContact CA-OG1 3.3Å; L261-T264 PolarHBondContact O-N 3.34Å; L261-T264 PolarHBondContact O-OG1 3.07Å; L261-I265 WeakPolarHBondContact O-CB 3.27Å; L261-I265 WeakPolarHBondContact O-CD1 3.29Å; L261-I265 WeakPolarHBondContact O-CG1 3.34Å; L261-I265 PolarHBondContact O-N 3.32Å |
| 262 | S | 74.9 | Confident | 75.6 | Confident | 31 Ų | 31 | 85.5 Ų | 85.5 | 22% | 0.217 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -64.5 | -43.2 | 175.2 | -162.8 | 0 | 0 | 0 | 0 | 111.5 | C220 L258 A259 V260 G266 | C220-S262 CarbonylContact O-C 3.53Å; C220-S262 VanDerWaalsContact O-O 3.14Å; C220-S262 PolarHBondContact O-OG 2.93Å; L258-S262 VanDerWaalsContact O-CB 3.28Å; L258-S262 WeakPolarHBondContact O-CB 3.36Å; L258-S262 PolarHBondContact O-N 2.97Å; A259-S262 WeakPolarHBondContact O-CB 3.43Å; A259-S262 PolarHBondContact O-N 2.83Å; V260-S262 VanDerWaalsContact C-N 3.34Å; S262-G266 PolarHBondContact O-N 3.49Å |
| 263 | I | 79.4 | Confident | 77.2 | Confident | 76 Ų | 76 | 87.5 Ų | 87.5 | 39% | 0.39 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.2 | -46.3 | 177.9 | -68.6 | 161.3 | 0 | 0 | 0 | 110.7 | A259 V260 T267 | A259-I263 WeakPolarHBondContact O-CD1 3.45Å; A259-I263 WeakPolarHBondContact O-CG1 3.3Å; A259-I263 PolarHBondContact O-N 2.7Å; V260-I263 PolarHBondContact O-N 3.3Å; I263-T267 VanDerWaalsContact O-CB 3.29Å; I263-T267 WeakPolarHBondContact O-CB 3.4Å; I263-T267 PolarHBondContact O-N 3.32Å; I263-T267 PolarHBondContact O-OG1 2.99Å |
| 264 | T | 82.4 | Confident | 78.8 | Confident | 81 Ų | 81 | 81 Ų | 81 | 50% | 0.497 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -67.4 | -43.1 | -178.7 | 48 | 0 | 0 | 0 | 0 | 112.4 | V260 L261 G268 | V260-T264 WeakPolarHBondContact O-CG2 3.21Å; V260-T264 PolarHBondContact O-N 3.46Å; V260-T264 PolarHBondContact O-OG1 3.23Å; L261-T264 WeakPolarHBondContact CA-OG1 3.3Å; L261-T264 PolarHBondContact O-N 3.34Å; L261-T264 PolarHBondContact O-OG1 3.07Å; T264-G268 PolarHBondContact O-N 3.42Å |
| 265 | I | 82.4 | Confident | 80.5 | Confident | 89 Ų | 89 | 77 Ų | 77 | 46% | 0.456 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -67.3 | -45.3 | 176.3 | -65.9 | 167 | 0 | 0 | 0 | 110.8 | L261 T267 G268 I269 | L261-I265 WeakPolarHBondContact O-CB 3.27Å; L261-I265 WeakPolarHBondContact O-CD1 3.29Å; L261-I265 WeakPolarHBondContact O-CG1 3.34Å; L261-I265 PolarHBondContact O-N 3.32Å; I265-T267 VanDerWaalsContact C-N 3.34Å; I265-T267 PolarHBondContact O-N 2.91Å; I265-G268 PolarHBondContact O-N 2.83Å; I265-I269 HydrophobicContact CG2-CD1 3.65Å; I265-I269 HydrophobicContact CG2-CG1 4.35Å; I265-I269 VanDerWaalsContact O-CG1 3.3Å; I265-I269 WeakPolarHBondContact O-CG1 3.37Å; I265-I269 PolarHBondContact O-N 2.76Å |
| 266 | G | 82.8 | Confident | 81.7 | Confident | 20 Ų | 20 | 77 Ų | 77 | 21% | 0.206 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -60.7 | -43.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | S262 Y270 | S262-G266 PolarHBondContact O-N 3.49Å; G266-Y270 VanDerWaalsContact O-CB 3.31Å; G266-Y270 WeakPolarHBondContact O-CB 3.41Å; G266-Y270 PolarHBondContact O-N 3.24Å |
| 267 | T | 84.3 | Confident | 82.9 | Confident | 54 Ų | 54 | 76.6 Ų | 76.6 | 33% | 0.331 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -67.3 | -43.2 | 177.1 | -51.9 | 0 | 0 | 0 | 0 | 111.4 | I263 I265 I269 Y270 V271 | I263-T267 VanDerWaalsContact O-CB 3.29Å; I263-T267 WeakPolarHBondContact O-CB 3.4Å; I263-T267 PolarHBondContact O-N 3.32Å; I263-T267 PolarHBondContact O-OG1 2.99Å; I265-T267 VanDerWaalsContact C-N 3.34Å; I265-T267 PolarHBondContact O-N 2.91Å; T267-I269 PolarHBondContact O-N 3.33Å; T267-Y270 PolarHBondContact O-N 3.5Å; T267-V271 HydrophobicContact CG2-CG2 4.43Å; T267-V271 WeakPolarHBondContact O-CG2 3.46Å; T267-V271 PolarHBondContact O-N 3Å |
| 268 | G | 86.3 | Confident | 84.1 | Confident | 47 Ų | 47 | 75.2 Ų | 75.2 | 49% | 0.485 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.5 | -42.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | T264 I265 G272 | T264-G268 PolarHBondContact O-N 3.42Å; I265-G268 PolarHBondContact O-N 2.83Å; G268-G272 PolarHBondContact O-N 3.38Å |
| 269 | I | 86.7 | Confident | 85.4 | Confident | 86 Ų | 86 | 73.4 Ų | 73.4 | 44% | 0.441 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -66.5 | -42.9 | 175.8 | -66.7 | 169.6 | 0 | 0 | 0 | 110.6 | I265 T267 G272 L273 | I265-I269 HydrophobicContact CG2-CD1 3.65Å; I265-I269 HydrophobicContact CG2-CG1 4.35Å; I265-I269 VanDerWaalsContact O-CG1 3.3Å; I265-I269 WeakPolarHBondContact O-CG1 3.37Å; I265-I269 PolarHBondContact O-N 2.76Å; T267-I269 PolarHBondContact O-N 3.33Å; I269-G272 PolarHBondContact O-N 2.88Å; I269-L273 HydrophobicContact CG2-CD1 3.9Å; I269-L273 HydrophobicContact CG2-CG 4.17Å; I269-L273 WeakPolarHBondContact O-CB 3.34Å; I269-L273 WeakPolarHBondContact O-CG 3.31Å; I269-L273 PolarHBondContact O-N 2.97Å |
| 270 | Y | 85.3 | Confident | 86.4 | Confident | 160 Ų | 160 | 78.4 Ų | 78.4 | 63% | 0.627 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -60.4 | -49.8 | 179.2 | -179.2 | -101.4 | 0 | 0 | 0 | 111.9 | G266 T267 G272 L273 A274 | G266-Y270 VanDerWaalsContact O-CB 3.31Å; G266-Y270 WeakPolarHBondContact O-CB 3.41Å; G266-Y270 PolarHBondContact O-N 3.24Å; T267-Y270 PolarHBondContact O-N 3.5Å; Y270-G272 VanDerWaalsContact C-N 3.35Å; Y270-G272 PolarHBondContact O-N 3.42Å; Y270-L273 PolarHBondContact O-N 2.96Å; Y270-A274 WeakPolarHBondContact O-CB 3.22Å; Y270-A274 PolarHBondContact O-N 2.71Å |
| 271 | V | 90.5 | Very high | 87 | Confident | 80 Ų | 80 | 79.2 Ų | 79.2 | 49% | 0.485 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -63.7 | -42.3 | 176.8 | 175.9 | 0 | 0 | 0 | 0 | 110.8 | T267 L273 A274 V275 | T267-V271 HydrophobicContact CG2-CG2 4.43Å; T267-V271 WeakPolarHBondContact O-CG2 3.46Å; T267-V271 PolarHBondContact O-N 3Å; V271-L273 PolarHBondContact O-N 3.41Å; V271-A274 PolarHBondContact O-N 3.34Å; V271-V275 WeakPolarHBondContact O-CG2 3.33Å; V271-V275 PolarHBondContact O-N 2.99Å |
| 272 | G | 90.5 | Very high | 87.6 | Confident | 40 Ų | 40 | 78 Ų | 78 | 41% | 0.412 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -61.3 | -44.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | G268 I269 Y270 V275 A276 | G268-G272 PolarHBondContact O-N 3.38Å; I269-G272 PolarHBondContact O-N 2.88Å; Y270-G272 VanDerWaalsContact C-N 3.35Å; Y270-G272 PolarHBondContact O-N 3.42Å; G272-V275 PolarHBondContact O-N 2.84Å; G272-A276 VanDerWaalsContact O-CB 3.25Å; G272-A276 WeakPolarHBondContact O-CB 3.47Å; G272-A276 PolarHBondContact O-N 3.26Å |
| 273 | L | 89.3 | Confident | 88.1 | Confident | 108 Ų | 108 | 84.3 Ų | 84.3 | 57% | 0.565 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -66.3 | -40.2 | 176.2 | -73.6 | 178.5 | 0 | 0 | 0 | 111.9 | I269 Y270 V271 A276 L277 | I269-L273 HydrophobicContact CG2-CD1 3.9Å; I269-L273 HydrophobicContact CG2-CG 4.17Å; I269-L273 WeakPolarHBondContact O-CB 3.34Å; I269-L273 WeakPolarHBondContact O-CG 3.31Å; I269-L273 PolarHBondContact O-N 2.97Å; Y270-L273 PolarHBondContact O-N 2.96Å; V271-L273 PolarHBondContact O-N 3.41Å; L273-A276 PolarHBondContact O-N 3.33Å; L273-L277 WeakPolarHBondContact O-CB 3.41Å; L273-L277 PolarHBondContact O-N 3.42Å |
| 274 | A | 89.8 | Confident | 88.2 | Confident | 40 Ų | 40 | 83.9 Ų | 83.9 | 33% | 0.331 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.4 | -48.3 | 176 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y270 V271 L277 I278 | Y270-A274 WeakPolarHBondContact O-CB 3.22Å; Y270-A274 PolarHBondContact O-N 2.71Å; V271-A274 PolarHBondContact O-N 3.34Å; A274-L277 PolarHBondContact O-N 2.88Å; A274-I278 WeakPolarHBondContact O-CD1 3.2Å; A274-I278 VanDerWaalsContact O-CG1 3.22Å; A274-I278 WeakPolarHBondContact O-CG1 3.25Å; A274-I278 PolarHBondContact O-N 3.47Å |
| 275 | V | 94.4 | Very high | 87.3 | Confident | 90 Ų | 90 | 88 Ų | 88 | 55% | 0.545 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.7 | -44.5 | 177.5 | 175.3 | 0 | 0 | 0 | 0 | 111.4 | V271 G272 L277 I278 A279 | V271-V275 WeakPolarHBondContact O-CG2 3.33Å; V271-V275 PolarHBondContact O-N 2.99Å; G272-V275 PolarHBondContact O-N 2.84Å; V275-L277 VanDerWaalsContact C-N 3.31Å; V275-L277 PolarHBondContact O-N 2.83Å; V275-I278 PolarHBondContact O-N 3.43Å; V275-A279 WeakPolarHBondContact O-CB 3.46Å; V275-A279 PolarHBondContact O-N 3.44Å |
| 276 | A | 93.2 | Very high | 86.2 | Confident | 56 Ų | 56 | 92.1 Ų | 92.1 | 46% | 0.463 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.8 | -39.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | G272 L273 A279 Y280 | G272-A276 VanDerWaalsContact O-CB 3.25Å; G272-A276 WeakPolarHBondContact O-CB 3.47Å; G272-A276 PolarHBondContact O-N 3.26Å; L273-A276 PolarHBondContact O-N 3.33Å; A276-A279 PolarHBondContact O-N 3.5Å; A276-Y280 WeakPolarHBondContact O-CB 3.32Å; A276-Y280 PolarHBondContact O-N 3.29Å |
| 277 | L | 92.5 | Very high | 84.6 | Confident | 101 Ų | 101 | 100.8 Ų | 100.8 | 53% | 0.529 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.7 | -46 | 176.6 | -177.2 | 62.7 | 0 | 0 | 0 | 111.3 | L273 A274 V275 A279 Y280 L281 | L273-L277 WeakPolarHBondContact O-CB 3.41Å; L273-L277 PolarHBondContact O-N 3.42Å; A274-L277 PolarHBondContact O-N 2.88Å; V275-L277 VanDerWaalsContact C-N 3.31Å; V275-L277 PolarHBondContact O-N 2.83Å; L277-A279 PolarHBondContact O-N 3.5Å; L277-Y280 PolarHBondContact O-N 2.85Å; L277-L281 HydrophobicContact CD1-CD1 4.35Å; L277-L281 HydrophobicContact CD1-CG 4.38Å; L277-L281 HydrophobicContact CG-CD1 4.17Å; L277-L281 WeakPolarHBondContact O-CB 3.43Å; L277-L281 VanDerWaalsContact O-CG 3.29Å; L277-L281 WeakPolarHBondContact O-CG 3.2Å; L277-L281 PolarHBondContact O-N 3.34Å |
| 278 | I | 92.9 | Very high | 84.6 | Confident | 116 Ų | 116 | 103.1 Ų | 103.1 | 60% | 0.595 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.2 | -46.4 | 176.7 | -65.4 | 161.7 | 0 | 0 | 0 | 110.3 | A274 V275 Y280 L281 S282 | A274-I278 WeakPolarHBondContact O-CD1 3.2Å; A274-I278 VanDerWaalsContact O-CG1 3.22Å; A274-I278 WeakPolarHBondContact O-CG1 3.25Å; A274-I278 PolarHBondContact O-N 3.47Å; V275-I278 PolarHBondContact O-N 3.43Å; I278-Y280 VanDerWaalsContact C-N 3.32Å; I278-Y280 PolarHBondContact O-N 3.32Å; I278-L281 PolarHBondContact O-N 2.92Å; I278-S282 WeakPolarHBondContact O-CB 3.29Å; I278-S282 PolarHBondContact O-N 3.39Å; I278-S282 PolarHBondContact O-OG 3.11Å |
| 279 | A | 93 | Very high | 84.5 | Confident | 45 Ų | 45 | 106.1 Ų | 106.1 | 37% | 0.372 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.2 | -34.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113 | V275 A276 L277 S282 K283 | V275-A279 WeakPolarHBondContact O-CB 3.46Å; V275-A279 PolarHBondContact O-N 3.44Å; A276-A279 PolarHBondContact O-N 3.5Å; L277-A279 PolarHBondContact O-N 3.5Å; A279-S282 VanDerWaalsContact CA-OG 3.32Å; A279-S282 WeakPolarHBondContact CA-OG 3.29Å; A279-S282 PolarHBondContact O-OG 3.2Å; A279-K283 WeakPolarHBondContact O-CB 3.39Å; A279-K283 PolarHBondContact O-N 2.87Å; A279-K283 VanDerWaalsContact O-N 3.11Å |
| 280 | Y | 92.8 | Very high | 84.4 | Confident | 147 Ų | 147 | 107.2 Ų | 107.2 | 58% | 0.576 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -68.2 | -48.6 | 174.3 | -179.4 | -100.7 | 0 | 0 | 0 | 110.5 | A276 L277 I278 S282 K283 N284 | A276-Y280 WeakPolarHBondContact O-CB 3.32Å; A276-Y280 PolarHBondContact O-N 3.29Å; L277-Y280 PolarHBondContact O-N 2.85Å; I278-Y280 VanDerWaalsContact C-N 3.32Å; I278-Y280 PolarHBondContact O-N 3.32Å; Y280-S282 VanDerWaalsContact C-N 3.33Å; Y280-S282 PolarHBondContact O-N 2.97Å; Y280-K283 PolarHBondContact O-N 2.74Å; Y280-N284 WeakPolarHBondContact CD1-ND2 3.46Å; Y280-N284 WeakPolarHBondContact CE1-ND2 3.19Å; Y280-N284 VanDerWaalsContact CE2-ND2 3.32Å; Y280-N284 WeakPolarHBondContact CE2-ND2 3.38Å; Y280-N284 PolarHBondContact O-N 3.37Å; Y280-N284 PolarHBondContact O-ND2 3.33Å |
| 281 | L | 88.1 | Confident | 84.4 | Confident | 100 Ų | 100 | 104.1 Ų | 104.1 | 52% | 0.524 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.6 | -40.5 | 177.3 | -69.1 | 173.7 | 0 | 0 | 0 | 111.6 | L277 I278 K283 N284 H285 | L277-L281 HydrophobicContact CD1-CD1 4.35Å; L277-L281 HydrophobicContact CD1-CG 4.38Å; L277-L281 HydrophobicContact CG-CD1 4.17Å; L277-L281 WeakPolarHBondContact O-CB 3.43Å; L277-L281 VanDerWaalsContact O-CG 3.29Å; L277-L281 WeakPolarHBondContact O-CG 3.2Å; L277-L281 PolarHBondContact O-N 3.34Å; I278-L281 PolarHBondContact O-N 2.92Å; L281-K283 VanDerWaalsContact C-N 3.29Å; L281-K283 PolarHBondContact O-N 2.85Å; L281-N284 PolarHBondContact O-N 3.23Å; L281-H285 VanDerWaalsContact O-CB 3.29Å; L281-H285 WeakPolarHBondContact O-CB 3.32Å; L281-H285 PolarHBondContact O-N 3.06Å |
| 282 | S | 88.4 | Confident | 84 | Confident | 72 Ų | 72 | 105.6 Ų | 105.6 | 50% | 0.503 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.1 | -33.8 | 177 | 67.5 | 0 | 0 | 0 | 0 | 112.5 | I278 A279 Y280 | I278-S282 WeakPolarHBondContact O-CB 3.29Å; I278-S282 PolarHBondContact O-N 3.39Å; I278-S282 PolarHBondContact O-OG 3.11Å; A279-S282 VanDerWaalsContact CA-OG 3.32Å; A279-S282 WeakPolarHBondContact CA-OG 3.29Å; A279-S282 PolarHBondContact O-OG 3.2Å; Y280-S282 VanDerWaalsContact C-N 3.33Å; Y280-S282 PolarHBondContact O-N 2.97Å |
| 283 | K | 85.7 | Confident | 83.5 | Confident | 163 Ų | 163 | 109.9 Ų | 109.9 | 71% | 0.709 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -70.9 | -38.6 | 173.5 | -90.7 | 176.2 | 160.3 | 163.8 | 0 | 112.8 | A279 Y280 L281 | A279-K283 WeakPolarHBondContact O-CB 3.39Å; A279-K283 PolarHBondContact O-N 2.87Å; A279-K283 VanDerWaalsContact O-N 3.11Å; Y280-K283 PolarHBondContact O-N 2.74Å; L281-K283 VanDerWaalsContact C-N 3.29Å; L281-K283 PolarHBondContact O-N 2.85Å |
| 284 | N | 79.9 | Confident | 83.1 | Confident | 66 Ų | 66 | 110.1 Ų | 110.1 | 35% | 0.353 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -77.1 | -24.7 | 178.7 | -72.3 | -78.7 | 0 | 0 | 0 | 112.9 | Y280 L281 H286 L287 | Y280-N284 WeakPolarHBondContact CD1-ND2 3.46Å; Y280-N284 WeakPolarHBondContact CE1-ND2 3.19Å; Y280-N284 VanDerWaalsContact CE2-ND2 3.32Å; Y280-N284 WeakPolarHBondContact CE2-ND2 3.38Å; Y280-N284 PolarHBondContact O-N 3.37Å; Y280-N284 PolarHBondContact O-ND2 3.33Å; L281-N284 PolarHBondContact O-N 3.23Å; N284-H286 PolarHBondContact O-N 3.37Å; N284-L287 PolarHBondContact O-N 3.5Å |
| 285 | H | 64.5 | Low | 82.6 | Confident | 169 Ų | 169 | 115.5 Ų | 115.5 | 78% | 0.782 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | -3.6 | 176.2 | -161.2 | -77 | 0 | 0 | 0 | 113.3 | L281 | L281-H285 VanDerWaalsContact O-CB 3.29Å; L281-H285 WeakPolarHBondContact O-CB 3.32Å; L281-H285 PolarHBondContact O-N 3.06Å |
| 286 | H | 59.8 | Low | 81.6 | Confident | 174 Ų | 174 | 117.6 Ų | 117.6 | 81% | 0.806 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.9 | 8.5 | 174.4 | -161.3 | -71.8 | 0 | 0 | 0 | 112.3 | N284 | N284-H286 PolarHBondContact O-N 3.37Š|
| 287 | L | 48.7 | Very low | 80.6 | Confident | 202 Ų | 202 | 123.2 Ų | 123.2 | 100% | 1.058 | 62% | 0.619 | S | S | * | * | | | trans | -108.7 | 0 | 170.2 | -87.2 | 158.7 | 0 | 0 | 0 | 109.4 | N284 | N284-L287 PolarHBondContact O-N 3.5Š|