| 1 | M | 37 | Very low | 33 | Very low | 244 Ų | 244 | 179.1 Ų | 179.1 | 100% | 1.202 | 88% | 0.88 | S | S | * | * | | | | 0 | 113.8 | 0 | -96.6 | 176.2 | 160.5 | 0 | 0 | 108.9 | | |
| 2 | L | 32.7 | Very low | 33.3 | Very low | 180 Ų | 180 | 174.7 Ų | 174.7 | 94% | 0.942 | 87% | 0.871 | S | S | * | * | | | trans | -113.4 | 104.7 | 175.2 | -110.9 | 151.9 | 0 | 0 | 0 | 107.9 | | |
| 3 | V | 31.4 | Very low | 32.9 | Very low | 126 Ų | 126 | 168.4 Ų | 168.4 | 76% | 0.764 | 88% | 0.878 | S | S | * | * | | | trans | -78.8 | 118.8 | -177.9 | 178.5 | 0 | 0 | 0 | 0 | 108.9 | R5 | V3-R5 PolarHBondContact O-N 3.04Š|
| 4 | R | 30.6 | Very low | 32.6 | Very low | 230 Ų | 230 | 160.5 Ų | 160.5 | 87% | 0.868 | 86% | 0.858 | S | S | * | * | | | trans | -87 | 93.5 | -176.2 | -156.5 | 178.3 | -176.4 | -170.6 | 0.4 | 109.3 | T6 | R4-T6 PolarHBondContact O-N 3.43Š|
| 5 | R | 31.8 | Very low | 32.7 | Very low | 233 Ų | 233 | 157.2 Ų | 157.2 | 88% | 0.879 | 86% | 0.862 | S | S | * | * | | | trans | -77.1 | 105.1 | 169.7 | -86.5 | -175.4 | 170.3 | 179.2 | -2.5 | 109.8 | V3 T7 | V3-R5 PolarHBondContact O-N 3.04Å; R5-T7 PolarHBondContact O-N 2.86Å |
| 6 | T | 36.3 | Very low | 32.7 | Very low | 126 Ų | 126 | 152.9 Ų | 152.9 | 77% | 0.773 | 85% | 0.854 | S | S | * | * | | | trans | -79.4 | 98.8 | 168.5 | 44.1 | 0 | 0 | 0 | 0 | 109.1 | R4 A8 | R4-T6 PolarHBondContact O-N 3.43Å; T6-A8 PolarHBondContact O-N 3.18Å |
| 7 | T | 35.9 | Very low | 32.8 | Very low | 123 Ų | 123 | 153.8 Ų | 153.8 | 76% | 0.755 | 85% | 0.85 | S | S | * | * | | | trans | -75 | 121.5 | 167.9 | 41.1 | 0 | 0 | 0 | 0 | 109.4 | R5 C9 | R5-T7 PolarHBondContact O-N 2.86Å; T7-C9 PolarHBondContact O-N 2.83Å |
| 8 | A | 33.6 | Very low | 32.7 | Very low | 104 Ų | 104 | 158.7 Ų | 158.7 | 86% | 0.86 | 85% | 0.853 | S | S | * | * | | | trans | -66.9 | 107.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | T6 R10 | T6-A8 PolarHBondContact O-N 3.18Å; A8-R10 PolarHBondContact O-N 2.88Å |
| 9 | C | 32.3 | Very low | 32.6 | Very low | 121 Ų | 121 | 157.4 Ų | 157.4 | 82% | 0.818 | 85% | 0.846 | S | S | * | * | | | trans | -77.3 | 104.1 | 170.1 | -72.9 | 0 | 0 | 0 | 0 | 109.6 | T7 R11 | T7-C9 PolarHBondContact O-N 2.83Å; C9-R11 PolarHBondContact O-N 3.12Å |
| 10 | R | 29.1 | Very low | 32.6 | Very low | 237 Ų | 237 | 153.2 Ų | 153.2 | 89% | 0.894 | 83% | 0.834 | S | S | * | * | | | trans | -55.3 | 125.7 | 165.5 | -135.2 | 177.4 | -162.4 | -170.7 | 4.1 | 108.8 | A8 T12 | A8-R10 PolarHBondContact O-N 2.88Å; R10-T12 PolarHBondContact O-N 3.3Å |
| 11 | R | 32.2 | Very low | 32.4 | Very low | 246 Ų | 246 | 151.6 Ų | 151.6 | 93% | 0.928 | 83% | 0.829 | S | S | * | * | | | trans | -71.6 | 104.1 | 175.6 | -79.2 | 177.4 | 176.2 | 166.2 | -1.2 | 109.2 | C9 | C9-R11 PolarHBondContact O-N 3.12Š|
| 12 | T | 36.7 | Very low | 31.9 | Very low | 126 Ų | 126 | 150.5 Ų | 150.5 | 77% | 0.773 | 81% | 0.811 | S | S | * | * | | | trans | -116.6 | 124.8 | 153.1 | 43.5 | 0 | 0 | 0 | 0 | 107.6 | R10 G14 | R10-T12 PolarHBondContact O-N 3.3Å; T12-G14 PolarHBondContact O-N 2.88Å |
| 13 | G | 27.8 | Very low | 31.8 | Very low | 93 Ų | 93 | 149.9 Ų | 149.9 | 96% | 0.959 | 81% | 0.808 | S | S | * | * | S | Bend | trans | -61.5 | 115 | -176.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | | |
| 14 | G | 29.1 | Very low | 31.7 | Very low | 58 Ų | 58 | 149.3 Ų | 149.3 | 60% | 0.598 | 81% | 0.805 | S | S | * | * | S | Bend | trans | 171.2 | 131.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 106.2 | T12 A16 | T12-G14 PolarHBondContact O-N 2.88Å; G14-A16 PolarHBondContact O-N 3.09Å |
| 15 | A | 34.6 | Very low | 31.6 | Very low | 111 Ų | 111 | 142.7 Ų | 142.7 | 92% | 0.917 | 80% | 0.8 | S | S | * | * | | | trans | -60.4 | 81.5 | -171.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q17 | A15-Q17 VanDerWaalsContact C-N 3.29Å; A15-Q17 PolarHBondContact O-N 3.05Å |
| 16 | A | 32.6 | Very low | 31.6 | Very low | 88 Ų | 88 | 142.8 Ų | 142.8 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | | | trans | -77.5 | 88.3 | 177 | 0 | 0 | 0 | 0 | 0 | 108.1 | G14 R18 | G14-A16 PolarHBondContact O-N 3.09Å; A16-R18 PolarHBondContact O-N 3.35Å |
| 17 | Q | 33.5 | Very low | 31.3 | Very low | 168 Ų | 168 | 141.8 Ų | 141.8 | 79% | 0.785 | 80% | 0.798 | S | S | * | * | | | trans | -42.1 | 104.2 | 160.8 | -167.1 | 170.5 | 3.3 | 0 | 0 | 108.5 | A15 N19 | A15-Q17 VanDerWaalsContact C-N 3.29Å; A15-Q17 PolarHBondContact O-N 3.05Å; Q17-N19 VanDerWaalsContact C-N 3.31Å; Q17-N19 PolarHBondContact O-N 3.24Å |
| 18 | R | 31.8 | Very low | 31.3 | Very low | 243 Ų | 243 | 141.8 Ų | 141.8 | 92% | 0.917 | 80% | 0.8 | S | S | * | * | | | trans | -68.6 | 90.3 | 179.4 | -72.3 | -178.6 | 175.1 | -179 | -2.3 | 108.6 | A16 A20 | A16-R18 PolarHBondContact O-N 3.35Å; R18-A20 VanDerWaalsContact C-N 3.29Å; R18-A20 PolarHBondContact O-N 2.95Å |
| 19 | N | 31.1 | Very low | 31.1 | Very low | 133 Ų | 133 | 144.7 Ų | 144.7 | 71% | 0.711 | 80% | 0.8 | S | S | * | * | | | trans | -68.1 | 91.4 | 164.8 | -78.2 | -32.4 | 0 | 0 | 0 | 108 | Q17 V21 | Q17-N19 VanDerWaalsContact C-N 3.31Å; Q17-N19 PolarHBondContact O-N 3.24Å; N19-V21 VanDerWaalsContact C-N 3.34Å; N19-V21 PolarHBondContact O-N 3.01Å |
| 20 | A | 31.2 | Very low | 31.1 | Very low | 73 Ų | 73 | 144.9 Ų | 144.9 | 60% | 0.603 | 80% | 0.8 | S | S | * | * | | | trans | -70.9 | 94.7 | 165 | 0 | 0 | 0 | 0 | 0 | 107.6 | R18 W22 | R18-A20 VanDerWaalsContact C-N 3.29Å; R18-A20 PolarHBondContact O-N 2.95Å; A20-W22 VanDerWaalsContact O-CD1 3.25Å; A20-W22 PolarHBondContact O-N 2.99Å; A20-W22 VanDerWaalsContact O-N 3.12Å |
| 21 | V | 29.9 | Very low | 31.2 | Very low | 120 Ų | 120 | 138.6 Ų | 138.6 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | | | trans | -71.6 | 101.4 | 170 | 179.7 | 0 | 0 | 0 | 0 | 107.3 | N19 L23 | N19-V21 VanDerWaalsContact C-N 3.34Å; N19-V21 PolarHBondContact O-N 3.01Å; V21-L23 HydrophobicContact CG1-CG 4.46Å; V21-L23 PolarHBondContact O-N 3.33Å |
| 22 | W | 26.6 | Very low | 31.3 | Very low | 222 Ų | 222 | 131.1 Ų | 131.1 | 84% | 0.841 | 79% | 0.79 | S | S | * | * | | | trans | -78.5 | 97.3 | 168.6 | -68 | 84.2 | 0 | 0 | 0 | 107.6 | A20 T24 | A20-W22 VanDerWaalsContact O-CD1 3.25Å; A20-W22 PolarHBondContact O-N 2.99Å; A20-W22 VanDerWaalsContact O-N 3.12Å; W22-T24 PolarHBondContact O-N 2.93Å |
| 23 | L | 28.8 | Very low | 30.7 | Very low | 166 Ų | 166 | 136.5 Ų | 136.5 | 87% | 0.869 | 80% | 0.796 | S | S | * | * | | | trans | -66.2 | 91.3 | 163.3 | -81.6 | 158.3 | 0 | 0 | 0 | 107.3 | V21 A25 | V21-L23 HydrophobicContact CG1-CG 4.46Å; V21-L23 PolarHBondContact O-N 3.33Å; L23-A25 PolarHBondContact O-N 2.89Å |
| 24 | T | 30.6 | Very low | 31 | Very low | 114 Ų | 114 | 140 Ų | 140 | 70% | 0.699 | 79% | 0.792 | S | S | * | * | | | trans | -60.8 | 107.7 | 165.3 | 43.4 | 0 | 0 | 0 | 0 | 107.4 | W22 R26 | W22-T24 PolarHBondContact O-N 2.93Å; T24-R26 VanDerWaalsContact C-N 3.34Å; T24-R26 PolarHBondContact O-N 2.91Å |
| 25 | A | 29.1 | Very low | 31 | Very low | 92 Ų | 92 | 144 Ų | 144 | 76% | 0.76 | 81% | 0.805 | S | S | * | * | | | trans | -52.5 | 101.2 | 165.1 | 0 | 0 | 0 | 0 | 0 | 107.8 | L23 S27 | L23-A25 PolarHBondContact O-N 2.89Å; A25-S27 PolarHBondContact O-N 2.87Å |
| 26 | R | 30.8 | Very low | 30.8 | Very low | 235 Ų | 235 | 142.2 Ų | 142.2 | 89% | 0.887 | 80% | 0.797 | S | S | * | * | | | trans | -64.1 | 107.4 | 167.5 | -78 | -176.9 | 175 | -177.5 | -1.7 | 105.8 | T24 | T24-R26 VanDerWaalsContact C-N 3.34Å; T24-R26 PolarHBondContact O-N 2.91Å |
| 27 | S | 29.2 | Very low | 30.7 | Very low | 105 Ų | 105 | 144 Ų | 144 | 73% | 0.734 | 81% | 0.805 | S | S | * | * | | | trans | -49.5 | 149.4 | 171.3 | -53.5 | 0 | 0 | 0 | 0 | 110.9 | A25 | A25-S27 PolarHBondContact O-N 2.87Š|
| 28 | P | 37.3 | Very low | 30.4 | Very low | 123 Ų | 123 | 139.3 Ų | 139.3 | 80% | 0.799 | 80% | 0.801 | S | S | * | * | | | trans | -70.8 | 150.3 | -162.3 | 29.7 | -34 | 0 | 0 | 0 | 112.5 | | |
| 29 | L | 28.6 | Very low | 30.4 | Very low | 164 Ų | 164 | 134 Ų | 134 | 86% | 0.859 | 80% | 0.795 | S | S | * | * | | | trans | -35.8 | 129.7 | 173.7 | -66.8 | 146.9 | 0 | 0 | 0 | 113.3 | A31 | L29-A31 PolarHBondContact O-N 3.26Å; L29-A31 VanDerWaalsContact O-N 3.14Å |
| 30 | P | 32.6 | Very low | 30.8 | Very low | 126 Ų | 126 | 133.7 Ų | 133.7 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | | | trans | -73.3 | 102.7 | 160 | 28.8 | -27.7 | 0 | 0 | 0 | 108.3 | A32 | P30-A32 PolarHBondContact O-N 3.26Å; P30-A32 VanDerWaalsContact O-N 3.11Å |
| 31 | A | 31.7 | Very low | 31 | Very low | 105 Ų | 105 | 134 Ų | 134 | 87% | 0.868 | 80% | 0.803 | S | S | * | * | | | trans | -68.6 | 96.8 | 161 | 0 | 0 | 0 | 0 | 0 | 108.2 | L29 | L29-A31 PolarHBondContact O-N 3.26Å; L29-A31 VanDerWaalsContact O-N 3.14Å |
| 32 | A | 32.7 | Very low | 31.1 | Very low | 89 Ų | 89 | 135.1 Ų | 135.1 | 74% | 0.736 | 81% | 0.81 | S | S | * | * | | | trans | -133.6 | 78.5 | 165.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | P30 L34 | P30-A32 PolarHBondContact O-N 3.26Å; P30-A32 VanDerWaalsContact O-N 3.11Å; A32-L34 PolarHBondContact O-N 3.23Å |
| 33 | R | 24.9 | Very low | 31.4 | Very low | 239 Ų | 239 | 134.1 Ų | 134.1 | 90% | 0.902 | 81% | 0.812 | S | S | * | * | | | trans | -65.9 | 109.5 | 155 | -80.9 | -178.9 | 176.6 | -167.3 | -1.4 | 107 | | |
| 34 | L | 33.2 | Very low | 31.6 | Very low | 167 Ų | 167 | 130.7 Ų | 130.7 | 87% | 0.874 | 81% | 0.808 | S | S | * | * | | | trans | -136.3 | 93.7 | 148.9 | -78.6 | 177.6 | 0 | 0 | 0 | 107.9 | A32 | A32-L34 PolarHBondContact O-N 3.23Š|
| 35 | T | 29.2 | Very low | 31.6 | Very low | 141 Ų | 141 | 129.8 Ų | 129.8 | 87% | 0.865 | 81% | 0.812 | S | S | * | * | | | trans | -47.1 | 130 | 151.9 | 39.2 | 0 | 0 | 0 | 0 | 110.5 | | |
| 36 | G | 30.9 | Very low | 31.5 | Very low | 74 Ų | 74 | 128.5 Ų | 128.5 | 76% | 0.763 | 81% | 0.807 | S | S | * | * | | | trans | 172.7 | 74.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 37 | S | 30.6 | Very low | 31.5 | Very low | 126 Ų | 126 | 123.3 Ų | 123.3 | 88% | 0.881 | 80% | 0.801 | S | S | * | * | | | trans | -49.8 | 142.6 | 165.7 | 48.2 | 0 | 0 | 0 | 0 | 113.1 | | |
| 38 | G | 26.6 | Very low | 31.7 | Very low | 68 Ų | 68 | 123.6 Ų | 123.6 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | | | trans | 151.2 | 112.3 | 149.5 | 0 | 0 | 0 | 0 | 0 | 117.1 | | |
| 39 | V | 33 | Very low | 31.3 | Very low | 133 Ų | 133 | 128.7 Ų | 128.7 | 81% | 0.806 | 81% | 0.807 | S | S | * | * | | | trans | 85.3 | 106.6 | 152.7 | -163.3 | 0 | 0 | 0 | 0 | 117.8 | | |
| 40 | P | 38.4 | Very low | 31.5 | Very low | 125 Ų | 125 | 125.3 Ų | 125.3 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | | | trans | -85.6 | 113.3 | 165.8 | 33.3 | -25.1 | 0 | 0 | 0 | 109.1 | | |
| 41 | A | 36.6 | Very low | 31.8 | Very low | 80 Ų | 80 | 125.7 Ų | 125.7 | 66% | 0.661 | 80% | 0.802 | S | S | * | * | | | trans | -102.1 | 97.9 | 167.7 | 0 | 0 | 0 | 0 | 0 | 108.8 | F43 | A41-F43 PolarHBondContact O-N 3.11Å; A41-F43 VanDerWaalsContact O-N 3.09Å |
| 42 | T | 30.7 | Very low | 31.9 | Very low | 144 Ų | 144 | 129 Ų | 129 | 88% | 0.883 | 80% | 0.8 | S | S | * | * | | | trans | -48.4 | 106.2 | 154.6 | 36 | 0 | 0 | 0 | 0 | 109.3 | | |
| 43 | F | 33.4 | Very low | 32.1 | Very low | 201 Ų | 201 | 129.7 Ų | 129.7 | 88% | 0.882 | 80% | 0.797 | S | S | * | * | | | trans | -111.7 | 128.1 | 164.7 | -117 | -92.6 | 0 | 0 | 0 | 109.7 | A41 | A41-F43 PolarHBondContact O-N 3.11Å; A41-F43 VanDerWaalsContact O-N 3.09Å |
| 44 | A | 33.5 | Very low | 32.8 | Very low | 94 Ų | 94 | 124.1 Ų | 124.1 | 78% | 0.777 | 79% | 0.792 | S | S | * | * | | | trans | -57.9 | 141.1 | -161.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | G46 | A44-G46 VanDerWaalsContact C-N 3.31Å; A44-G46 PolarHBondContact O-N 3.14Å |
| 45 | A | 30.1 | Very low | 33 | Very low | 95 Ų | 95 | 124.3 Ų | 124.3 | 79% | 0.785 | 79% | 0.793 | S | S | * | * | | | trans | -61.5 | 87.5 | 166.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | V47 | A45-V47 PolarHBondContact O-N 3.04Š|
| 46 | G | 27.4 | Very low | 33.2 | Very low | 64 Ų | 64 | 129.2 Ų | 129.2 | 66% | 0.66 | 80% | 0.795 | S | S | * | * | | | trans | -74.3 | 95.8 | 165.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | A44 S48 | A44-G46 VanDerWaalsContact C-N 3.31Å; A44-G46 PolarHBondContact O-N 3.14Å; G46-S48 VanDerWaalsContact C-N 3.26Å; G46-S48 PolarHBondContact O-N 3.17Å |
| 47 | V | 31.2 | Very low | 33.3 | Very low | 126 Ų | 126 | 129.1 Ų | 129.1 | 76% | 0.764 | 79% | 0.794 | S | S | * | * | | | trans | -64.8 | 81.9 | 175.3 | -174.5 | 0 | 0 | 0 | 0 | 109.7 | A45 R49 | A45-V47 PolarHBondContact O-N 3.04Å; V47-R49 PolarHBondContact O-N 3.18Å |
| 48 | S | 32.8 | Very low | 33.5 | Very low | 111 Ų | 111 | 131.8 Ų | 131.8 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | | | trans | -93.1 | 95 | 174.3 | -58.8 | 0 | 0 | 0 | 0 | 108.8 | G46 A50 | G46-S48 VanDerWaalsContact C-N 3.26Å; G46-S48 PolarHBondContact O-N 3.17Å; S48-A50 VanDerWaalsContact C-N 3.26Å; S48-A50 PolarHBondContact O-N 3.44Å |
| 49 | R | 29.6 | Very low | 34.1 | Very low | 230 Ų | 230 | 140.5 Ų | 140.5 | 87% | 0.868 | 80% | 0.802 | S | S | * | * | | | trans | -61.9 | 88.2 | 167.3 | -75.9 | 179.2 | 179.8 | 163.9 | 0.5 | 108.7 | V47 V51 | V47-R49 PolarHBondContact O-N 3.18Å; R49-V51 PolarHBondContact O-N 3.33Å |
| 50 | A | 33 | Very low | 34.2 | Very low | 93 Ų | 93 | 144.2 Ų | 144.2 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | | | trans | -72.8 | 94.5 | 170.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | S48 Q52 | S48-A50 VanDerWaalsContact C-N 3.26Å; S48-A50 PolarHBondContact O-N 3.44Å; A50-Q52 PolarHBondContact O-N 3.23Å |
| 51 | V | 37.2 | Very low | 33.9 | Very low | 135 Ų | 135 | 141.5 Ų | 141.5 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 120.7 | 166.8 | 174.5 | 0 | 0 | 0 | 0 | 107.9 | R49 | R49-V51 PolarHBondContact O-N 3.33Š|
| 52 | Q | 34.6 | Very low | 33.9 | Very low | 173 Ų | 173 | 149 Ų | 149 | 81% | 0.808 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 136.6 | -176.5 | -70.5 | 179.7 | -16.7 | 0 | 0 | 112.3 | A50 | A50-Q52 PolarHBondContact O-N 3.23Š|
| 53 | P | 36.5 | Very low | 34.3 | Very low | 104 Ų | 104 | 153.5 Ų | 153.5 | 68% | 0.675 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 137.2 | 165.9 | 28.9 | -30.1 | 0 | 0 | 0 | 110.4 | L55 | P53-L55 PolarHBondContact O-N 3.37Å; P53-L55 VanDerWaalsContact O-N 3.12Å |
| 54 | P | 39.9 | Very low | 34.4 | Very low | 123 Ų | 123 | 151.7 Ų | 151.7 | 80% | 0.799 | 81% | 0.808 | S | S | * | * | | | trans | -70.4 | 109.9 | -178.1 | 27 | -32.5 | 0 | 0 | 0 | 110.8 | R56 | P54-R56 VanDerWaalsContact C-N 3.32Å; P54-R56 PolarHBondContact O-N 3.34Å |
| 55 | L | 36.9 | Very low | 34.7 | Very low | 171 Ų | 171 | 158.5 Ų | 158.5 | 90% | 0.895 | 81% | 0.814 | S | S | * | * | | | trans | -67.7 | 87.2 | 171.7 | -65.9 | 172 | 0 | 0 | 0 | 109.7 | P53 G57 | P53-L55 PolarHBondContact O-N 3.37Å; P53-L55 VanDerWaalsContact O-N 3.12Å; L55-G57 PolarHBondContact O-N 3.16Å |
| 56 | R | 34.6 | Very low | 35.1 | Very low | 244 Ų | 244 | 164.9 Ų | 164.9 | 92% | 0.921 | 82% | 0.817 | S | S | * | * | | | trans | -60.4 | 107.6 | 169.8 | -105.7 | -176.8 | 173.9 | -176.5 | -0.7 | 109.5 | P54 K58 | P54-R56 VanDerWaalsContact C-N 3.32Å; P54-R56 PolarHBondContact O-N 3.34Å; R56-K58 PolarHBondContact O-N 2.7Å |
| 57 | G | 32.6 | Very low | 35.5 | Very low | 71 Ų | 71 | 173 Ų | 173 | 73% | 0.732 | 83% | 0.828 | S | S | * | * | | | trans | -63.9 | 111.8 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | L55 R59 | L55-G57 PolarHBondContact O-N 3.16Å; G57-R59 PolarHBondContact O-N 2.77Å |
| 58 | K | 35.8 | Very low | 35.6 | Very low | 182 Ų | 182 | 175.7 Ų | 175.7 | 79% | 0.791 | 83% | 0.832 | S | S | * | * | | | trans | -82 | 98.9 | 156.7 | -72.5 | -177.7 | 178.7 | 178.8 | 0 | 107.6 | R56 Y60 | R56-K58 PolarHBondContact O-N 2.7Å; K58-Y60 WeakPolarHBondContact O-CD2 3.43Å; K58-Y60 PolarHBondContact O-N 2.9Å |
| 59 | R | 37.6 | Very low | 35.8 | Very low | 252 Ų | 252 | 180.8 Ų | 180.8 | 95% | 0.951 | 83% | 0.834 | S | S | * | * | | | trans | -59.8 | 98.9 | 171.1 | -74.5 | -177.9 | -179.4 | -162.1 | 0.1 | 108.8 | G57 G61 | G57-R59 PolarHBondContact O-N 2.77Å; R59-G61 PolarHBondContact O-N 2.75Å |
| 60 | Y | 35.3 | Very low | 36 | Very low | 210 Ų | 210 | 177.4 Ų | 177.4 | 82% | 0.824 | 83% | 0.833 | S | S | * | * | | | trans | -66.6 | 100.9 | 166.3 | -75.8 | -83 | 0 | 0 | 0 | 108.8 | K58 R62 | K58-Y60 WeakPolarHBondContact O-CD2 3.43Å; K58-Y60 PolarHBondContact O-N 2.9Å; Y60-R62 PolarHBondContact O-N 3.32Å |
| 61 | G | 33.7 | Very low | 36 | Very low | 69 Ų | 69 | 179.6 Ų | 179.6 | 71% | 0.711 | 83% | 0.831 | S | S | * | * | | | trans | -59.1 | 102.6 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | R59 R63 | R59-G61 PolarHBondContact O-N 2.75Å; G61-R63 PolarHBondContact O-N 3.06Å |
| 62 | R | 36.7 | Very low | 35.7 | Very low | 238 Ų | 238 | 179.8 Ų | 179.8 | 90% | 0.898 | 83% | 0.826 | S | S | * | * | | | trans | -65.8 | 95.8 | 170.1 | -72.2 | -175.8 | 176.2 | -175.8 | -0.4 | 108.2 | Y60 L64 | Y60-R62 PolarHBondContact O-N 3.32Å; R62-L64 PolarHBondContact O-N 3.1Å |
| 63 | R | 37.8 | Very low | 35.8 | Very low | 238 Ų | 238 | 177.7 Ų | 177.7 | 90% | 0.898 | 82% | 0.82 | S | S | * | * | | | trans | -59.6 | 99.3 | 165 | -72.4 | -177.7 | -177 | -120.1 | 2.2 | 107.9 | G61 R65 | G61-R63 PolarHBondContact O-N 3.06Å; R63-R65 VanDerWaalsContact C-N 3.31Å; R63-R65 PolarHBondContact O-N 3.03Å |
| 64 | L | 36.3 | Very low | 35.7 | Very low | 163 Ų | 163 | 180.3 Ų | 180.3 | 85% | 0.853 | 83% | 0.827 | S | S | * | * | | | trans | -58.1 | 95.6 | 164.6 | -88.8 | 119.8 | 0 | 0 | 0 | 107.7 | R62 R66 | R62-L64 PolarHBondContact O-N 3.1Å; L64-R66 VanDerWaalsContact C-N 3.27Å; L64-R66 PolarHBondContact O-N 3.04Å |
| 65 | R | 39.5 | Very low | 35.4 | Very low | 237 Ų | 237 | 180 Ų | 180 | 89% | 0.894 | 82% | 0.818 | S | S | * | * | | | trans | -62.9 | 97.5 | 163.6 | -73 | -169 | 179.5 | -138.7 | 2.1 | 106.8 | R63 R67 | R63-R65 VanDerWaalsContact C-N 3.31Å; R63-R65 PolarHBondContact O-N 3.03Å; R65-R67 PolarHBondContact O-N 3.25Å |
| 66 | R | 38.7 | Very low | 35.3 | Very low | 228 Ų | 228 | 177.3 Ų | 177.3 | 86% | 0.86 | 81% | 0.812 | S | S | * | * | | | trans | -52.6 | 129.4 | 172.6 | -77 | -176.6 | 176.1 | -178.5 | -1.3 | 108.4 | L64 H68 | L64-R66 VanDerWaalsContact C-N 3.27Å; L64-R66 PolarHBondContact O-N 3.04Å; R66-H68 PolarHBondContact O-N 3.45Å; R66-H68 VanDerWaalsContact O-N 3.16Å |
| 67 | R | 35.1 | Very low | 35.3 | Very low | 234 Ų | 234 | 170 Ų | 170 | 88% | 0.883 | 80% | 0.797 | S | S | * | * | | | trans | -64 | 104.3 | -178.4 | -64.5 | 168.8 | 171.5 | 171.3 | -4 | 109.2 | R65 | R65-R67 PolarHBondContact O-N 3.25Š|
| 68 | H | 33.7 | Very low | 35.4 | Very low | 183 Ų | 183 | 173.4 Ų | 173.4 | 85% | 0.847 | 80% | 0.798 | S | S | * | * | | | trans | -92.7 | 44.6 | 150 | -74.1 | -77.1 | 0 | 0 | 0 | 109.6 | R66 L70 | R66-H68 PolarHBondContact O-N 3.45Å; R66-H68 VanDerWaalsContact O-N 3.16Å; H68-L70 PolarHBondContact O-N 2.95Å |
| 69 | R | 35.9 | Very low | 35.4 | Very low | 218 Ų | 218 | 173 Ų | 173 | 82% | 0.823 | 80% | 0.799 | S | S | * | * | | | trans | -72.7 | 97.1 | 154.8 | -100.2 | -176.6 | 171.6 | 170.1 | -2 | 103.9 | L71 | R69-L71 PolarHBondContact O-N 3.03Š|
| 70 | L | 33.9 | Very low | 35.5 | Very low | 159 Ų | 159 | 168.3 Ų | 168.3 | 83% | 0.832 | 79% | 0.793 | S | S | * | * | | | trans | -41.8 | 87.1 | 149.3 | -89.9 | 146.5 | 0 | 0 | 0 | 106.6 | H68 L72 | H68-L70 PolarHBondContact O-N 2.95Å; L70-L72 PolarHBondContact O-N 3.03Å |
| 71 | L | 33.7 | Very low | 35.5 | Very low | 139 Ų | 139 | 165.5 Ų | 165.5 | 73% | 0.728 | 79% | 0.787 | S | S | * | * | | | trans | -66.3 | 83.9 | 157.4 | -113.8 | 137.2 | 0 | 0 | 0 | 101.8 | R69 L73 | R69-L71 PolarHBondContact O-N 3.03Å; L71-L73 PolarHBondContact O-N 3.01Å |
| 72 | L | 31.6 | Very low | 35.6 | Very low | 139 Ų | 139 | 171.1 Ų | 171.1 | 73% | 0.728 | 80% | 0.795 | S | S | * | * | | | trans | -51.4 | 87.3 | 144.3 | -88.9 | 142.6 | 0 | 0 | 0 | 103.9 | L70 L74 | L70-L72 PolarHBondContact O-N 3.03Å; L72-L74 PolarHBondContact O-N 3.17Å |
| 73 | L | 35.7 | Very low | 35.4 | Very low | 129 Ų | 129 | 166 Ų | 166 | 68% | 0.675 | 78% | 0.784 | S | S | * | * | | | trans | -54.1 | 86.3 | 155.6 | -87.3 | 154.4 | 0 | 0 | 0 | 103.6 | L71 L75 | L71-L73 PolarHBondContact O-N 3.01Å; L73-L75 HydrophobicContact CB-CD1 3.73Å; L73-L75 HydrophobicContact CD2-CD1 3.71Å; L73-L75 HydrophobicContact CG-CD1 4.25Å; L73-L75 PolarHBondContact O-N 2.92Å |
| 74 | L | 34.5 | Very low | 35.2 | Very low | 159 Ų | 159 | 161.1 Ų | 161.1 | 83% | 0.832 | 78% | 0.776 | S | S | * | * | | | trans | -62 | 68.6 | 156.3 | -77.2 | 139.8 | 0 | 0 | 0 | 105.2 | L72 P76 | L72-L74 PolarHBondContact O-N 3.17Å; L74-P76 WeakPolarHBondContact O-CD 3.38Å |
| 75 | L | 33.9 | Very low | 35 | Very low | 116 Ų | 116 | 160.4 Ų | 160.4 | 61% | 0.607 | 77% | 0.772 | S | S | * | * | | | trans | -61.4 | 122.4 | 156.7 | -100.8 | 76.2 | 0 | 0 | 0 | 104 | L73 C77 | L73-L75 HydrophobicContact CB-CD1 3.73Å; L73-L75 HydrophobicContact CD2-CD1 3.71Å; L73-L75 HydrophobicContact CG-CD1 4.25Å; L73-L75 PolarHBondContact O-N 2.92Å; L75-C77 PolarHBondContact O-N 2.92Å |
| 76 | P | 35.7 | Very low | 34.8 | Very low | 116 Ų | 116 | 155.9 Ų | 155.9 | 75% | 0.753 | 76% | 0.764 | S | S | * | * | | | trans | -67.2 | 86.6 | 167.6 | 29.1 | -30.1 | 0 | 0 | 0 | 106.2 | L74 N78 | L74-P76 WeakPolarHBondContact O-CD 3.38Å; P76-N78 PolarHBondContact O-N 3.29Å |
| 77 | C | 33.4 | Very low | 34.4 | Very low | 91 Ų | 91 | 149.4 Ų | 149.4 | 62% | 0.615 | 76% | 0.76 | S | S | * | * | | | trans | -63.3 | 99.8 | 162.9 | -84.8 | 0 | 0 | 0 | 0 | 105.4 | L75 E79 | L75-C77 PolarHBondContact O-N 2.92Å; C77-E79 PolarHBondContact O-N 3.06Å |
| 78 | N | 34.6 | Very low | 34.2 | Very low | 142 Ų | 142 | 141 Ų | 141 | 76% | 0.759 | 75% | 0.747 | S | S | * | * | | | trans | -46.3 | 137.6 | 159.3 | -78.9 | -67.2 | 0 | 0 | 0 | 108 | P76 | P76-N78 PolarHBondContact O-N 3.29Š|
| 79 | E | 36.5 | Very low | 33.9 | Very low | 172 Ų | 172 | 136.7 Ų | 136.7 | 80% | 0.804 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -2.9 | 124.5 | 164.1 | -49.5 | -90.6 | 122.1 | 0 | 0 | 114 | C77 | C77-E79 PolarHBondContact O-N 3.06Š|
| 80 | D | 39.7 | Very low | 33.7 | Very low | 154 Ų | 154 | 133 Ų | 133 | 82% | 0.824 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 109.6 | -6.9 | 157.6 | -53.8 | -41.8 | 0 | 0 | 0 | 119.8 | | |
| 81 | E | 34.6 | Very low | 33.6 | Very low | 151 Ų | 151 | 131.8 Ų | 131.8 | 71% | 0.706 | 74% | 0.743 | S | S | * | * | | | trans | -131.9 | 94.4 | 173 | -65.1 | -166.5 | 173.9 | 0 | 0 | 113.1 | L83 | E81-L83 PolarHBondContact O-N 3.16Š|
| 82 | H | 37 | Very low | 33.3 | Very low | 187 Ų | 187 | 129.3 Ų | 129.3 | 87% | 0.866 | 74% | 0.743 | S | S | * | * | | | trans | -66.9 | 84 | 161.4 | -69.5 | -76.5 | 0 | 0 | 0 | 108.8 | L84 | H82-L84 PolarHBondContact O-N 3.39Š|
| 83 | L | 32.2 | Very low | 33.9 | Very low | 130 Ų | 130 | 128 Ų | 128 | 68% | 0.681 | 74% | 0.742 | S | S | * | * | | | trans | -63.1 | 87.6 | 162 | -87.2 | 165.8 | 0 | 0 | 0 | 108.2 | E81 L85 | E81-L83 PolarHBondContact O-N 3.16Å; L83-L85 PolarHBondContact O-N 3.24Å |
| 84 | L | 32.8 | Very low | 33.4 | Very low | 137 Ų | 137 | 129.4 Ų | 129.4 | 72% | 0.717 | 75% | 0.75 | S | S | * | * | | | trans | -64.6 | 71.9 | 162.3 | -114.1 | 148.4 | 0 | 0 | 0 | 107.5 | H82 L86 | H82-L84 PolarHBondContact O-N 3.39Å; L84-L86 HydrophobicContact CD2-CB 4.46Å; L84-L86 HydrophobicContact CD2-CD1 3.29Å; L84-L86 HydrophobicContact CD2-CG 3.7Å; L84-L86 PolarHBondContact O-N 2.87Å |
| 85 | L | 31.2 | Very low | 33.2 | Very low | 147 Ų | 147 | 130.2 Ų | 130.2 | 77% | 0.77 | 75% | 0.754 | S | S | * | * | | | trans | -78.2 | 64.4 | 168.4 | -136.2 | 149.4 | 0 | 0 | 0 | 107.3 | L83 A87 | L83-L85 PolarHBondContact O-N 3.24Å; L85-A87 PolarHBondContact O-N 2.68Å |
| 86 | L | 35.3 | Very low | 33.5 | Very low | 142 Ų | 142 | 129.7 Ų | 129.7 | 74% | 0.743 | 76% | 0.757 | S | S | * | * | | | trans | -67.8 | 84.6 | 160.7 | -92 | 165.1 | 0 | 0 | 0 | 106.7 | L84 G88 | L84-L86 HydrophobicContact CD2-CB 4.46Å; L84-L86 HydrophobicContact CD2-CD1 3.29Å; L84-L86 HydrophobicContact CD2-CG 3.7Å; L84-L86 PolarHBondContact O-N 2.87Å; L86-G88 PolarHBondContact O-N 2.96Å |
| 87 | A | 32.2 | Very low | 33 | Very low | 93 Ų | 93 | 130.1 Ų | 130.1 | 77% | 0.769 | 76% | 0.762 | S | S | * | * | | | trans | -57.3 | 104.8 | 154 | 0 | 0 | 0 | 0 | 0 | 107.5 | L85 | L85-A87 PolarHBondContact O-N 2.68Š|
| 88 | G | 29.3 | Very low | 32.7 | Very low | 58 Ų | 58 | 132 Ų | 132 | 60% | 0.598 | 77% | 0.774 | S | S | * | * | | | trans | 161.7 | 60.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L86 V90 | L86-G88 PolarHBondContact O-N 2.96Å; G88-V90 PolarHBondContact O-N 3.05Å |
| 89 | A | 28.2 | Very low | 32.3 | Very low | 92 Ų | 92 | 131.8 Ų | 131.8 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | | | trans | -49.3 | 110.8 | 165.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | | |
| 90 | V | 32.1 | Very low | 32.5 | Very low | 139 Ų | 139 | 129.2 Ų | 129.2 | 84% | 0.842 | 78% | 0.777 | S | S | * | * | | | trans | -109.3 | 78.9 | 156 | -177.2 | 0 | 0 | 0 | 0 | 105.9 | G88 | G88-V90 PolarHBondContact O-N 3.05Š|
| 91 | T | 30.6 | Very low | 31.9 | Very low | 134 Ų | 134 | 128.7 Ų | 128.7 | 82% | 0.822 | 78% | 0.779 | S | S | * | * | | | trans | -77.9 | 110 | 162.2 | 37 | 0 | 0 | 0 | 0 | 108.2 | | |
| 92 | A | 28.9 | Very low | 31.7 | Very low | 88 Ų | 88 | 125.6 Ų | 125.6 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | | | trans | -155.9 | 147.8 | 161.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | | |
| 93 | P | 42.6 | Very low | 31.3 | Very low | 111 Ų | 111 | 122.8 Ų | 122.8 | 72% | 0.721 | 78% | 0.778 | S | S | * | * | | | | -115 | 159.1 | -123.7 | 38.6 | -31.3 | 0 | 0 | 0 | 115.7 | | |
| 94 | L | 26.3 | Very low | 31.1 | Very low | 159 Ų | 159 | 124.5 Ų | 124.5 | 83% | 0.832 | 79% | 0.787 | S | S | * | * | | | trans | 43.6 | 116.4 | 138 | -58.7 | 169.5 | 0 | 0 | 0 | 118.5 | | |
| 95 | L | 31.1 | Very low | 30.9 | Very low | 176 Ų | 176 | 124.4 Ų | 124.4 | 92% | 0.921 | 79% | 0.792 | S | S | * | * | | | | -158.5 | 146.6 | 116.4 | -100.4 | 133.9 | 0 | 0 | 0 | 111.5 | | |
| 96 | P | 39.5 | Very low | 30.9 | Very low | 104 Ų | 104 | 121.9 Ų | 121.9 | 68% | 0.675 | 79% | 0.792 | S | S | * | * | | | trans | -104.2 | 154.5 | -162.6 | 38.4 | -27.2 | 0 | 0 | 0 | 111.7 | | |
| 97 | C | 24.1 | Very low | 30.5 | Very low | 126 Ų | 126 | 124.4 Ų | 124.4 | 85% | 0.851 | 80% | 0.797 | S | S | * | * | | | trans | -166 | 144.5 | 146.9 | -96.3 | 0 | 0 | 0 | 0 | 108.8 | | |
| 98 | C | 27.3 | Very low | 30.4 | Very low | 129 Ų | 129 | 125.7 Ų | 125.7 | 87% | 0.872 | 80% | 0.801 | S | S | * | * | | | trans | 90.9 | 83.6 | 173.3 | -49.3 | 0 | 0 | 0 | 0 | 115.5 | | |
| 99 | T | 27.2 | Very low | 30.4 | Very low | 138 Ų | 138 | 125.1 Ų | 125.1 | 85% | 0.847 | 80% | 0.795 | S | S | * | * | | | trans | -55.9 | 161.2 | 160.7 | 33.4 | 0 | 0 | 0 | 0 | 114.2 | | |
| 100 | P | 39.9 | Very low | 30.5 | Very low | 119 Ų | 119 | 126.4 Ų | 126.4 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | | | trans | -102.1 | 147.5 | -159.8 | 37.9 | -30.1 | 0 | 0 | 0 | 113.6 | | |
| 101 | T | 28 | Very low | 30.4 | Very low | 142 Ų | 142 | 128.2 Ų | 128.2 | 87% | 0.871 | 80% | 0.797 | S | S | * | * | | | trans | -134.6 | 128.7 | 160.5 | 37.7 | 0 | 0 | 0 | 0 | 110.3 | | |
| 102 | A | 29.4 | Very low | 30.2 | Very low | 86 Ų | 86 | 133 Ų | 133 | 71% | 0.711 | 80% | 0.8 | S | S | * | * | | | trans | 84.1 | 116.8 | 165.9 | 0 | 0 | 0 | 0 | 0 | 118 | L104 | A102-L104 PolarHBondContact O-N 2.87Š|
| 103 | P | 28.9 | Very low | 30.3 | Very low | 128 Ų | 128 | 133.2 Ų | 133.2 | 83% | 0.831 | 80% | 0.802 | S | S | * | * | | | trans | -78.7 | 105.1 | 176.1 | 32.3 | -30.1 | 0 | 0 | 0 | 109.5 | V105 | P103-V105 PolarHBondContact O-N 3.09Š|
| 104 | L | 29.2 | Very low | 29.5 | Very low | 167 Ų | 167 | 133.6 Ų | 133.6 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | | | trans | -80.4 | 113.4 | 167.3 | -72.7 | 173.2 | 0 | 0 | 0 | 109 | A102 A106 | A102-L104 PolarHBondContact O-N 2.87Å; L104-A106 PolarHBondContact O-N 3.06Å |
| 105 | V | 28.6 | Very low | 29.5 | Very low | 134 Ų | 134 | 131.9 Ų | 131.9 | 81% | 0.812 | 80% | 0.798 | S | S | * | * | | | trans | -55.2 | 94.7 | 169.9 | 176.7 | 0 | 0 | 0 | 0 | 109.1 | P103 K107 | P103-V105 PolarHBondContact O-N 3.09Å; V105-K107 PolarHBondContact O-N 2.95Å; V105-K107 VanDerWaalsContact O-N 3.16Å |
| 106 | A | 29.9 | Very low | 29.2 | Very low | 94 Ų | 94 | 129.5 Ų | 129.5 | 78% | 0.777 | 79% | 0.791 | S | S | * | * | | | trans | -78.7 | 96 | 174.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | L104 S108 | L104-A106 PolarHBondContact O-N 3.06Å; A106-S108 PolarHBondContact O-N 3.3Å; A106-S108 VanDerWaalsContact O-N 3.13Å |
| 107 | K | 27.3 | Very low | 28.6 | Very low | 195 Ų | 195 | 129.3 Ų | 129.3 | 85% | 0.848 | 79% | 0.791 | S | S | * | * | | | trans | -62.3 | 107.6 | 159.4 | -79.6 | 177.3 | 175.7 | 174.5 | 0 | 107.5 | V105 G109 | V105-K107 PolarHBondContact O-N 2.95Å; V105-K107 VanDerWaalsContact O-N 3.16Å; K107-G109 VanDerWaalsContact C-N 3.31Å; K107-G109 PolarHBondContact O-N 3.43Å |
| 108 | S | 30.7 | Very low | 28.9 | Very low | 121 Ų | 121 | 129 Ų | 129 | 85% | 0.846 | 79% | 0.787 | S | S | * | * | | | trans | -71.8 | 86 | 176.5 | 70.4 | 0 | 0 | 0 | 0 | 110.1 | A106 S110 | A106-S108 PolarHBondContact O-N 3.3Å; A106-S108 VanDerWaalsContact O-N 3.13Å; S108-S110 PolarHBondContact O-N 3.5Å |
| 109 | G | 28.7 | Very low | 28.9 | Very low | 46 Ų | 46 | 131.8 Ų | 131.8 | 47% | 0.474 | 79% | 0.792 | S | S | . | * | | | trans | -70 | 110.6 | 162 | 0 | 0 | 0 | 0 | 0 | 108.6 | K107 H111 | K107-G109 VanDerWaalsContact C-N 3.31Å; K107-G109 PolarHBondContact O-N 3.43Å; G109-H111 PolarHBondContact O-CD2 3.31Å; G109-H111 PolarHBondContact O-N 3.36Å |
| 110 | S | 30.2 | Very low | 29.1 | Very low | 118 Ų | 118 | 130.4 Ų | 130.4 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | | | trans | -64.2 | 96.4 | 171.3 | 176.9 | 0 | 0 | 0 | 0 | 109.1 | S108 R112 | S108-S110 PolarHBondContact O-N 3.5Å; S110-R112 PolarHBondContact O-N 3.08Å |
| 111 | H | 30.9 | Very low | 28.6 | Very low | 178 Ų | 178 | 129.2 Ų | 129.2 | 82% | 0.824 | 79% | 0.788 | S | S | * | * | | | trans | -87.3 | 97.9 | 174.5 | -63.6 | -67.2 | 0 | 0 | 0 | 109 | G109 A113 | G109-H111 PolarHBondContact O-CD2 3.31Å; G109-H111 PolarHBondContact O-N 3.36Å; H111-A113 PolarHBondContact O-N 3.3Å |
| 112 | R | 26.8 | Very low | 28.7 | Very low | 235 Ų | 235 | 126.9 Ų | 126.9 | 89% | 0.887 | 78% | 0.784 | S | S | * | * | | | trans | -69.9 | 103.7 | 172.9 | -133.8 | 178.5 | -172.4 | -179.9 | 2.1 | 108.7 | S110 | S110-R112 PolarHBondContact O-N 3.08Š|
| 113 | A | 29.2 | Very low | 28.7 | Very low | 92 Ų | 92 | 127.9 Ų | 127.9 | 76% | 0.76 | 78% | 0.783 | S | S | * | * | | | trans | -87.9 | 103.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | H111 V115 | H111-A113 PolarHBondContact O-N 3.3Å; A113-V115 PolarHBondContact O-N 3.05Å |
| 114 | T | 25.8 | Very low | 28.7 | Very low | 119 Ų | 119 | 126.7 Ų | 126.7 | 73% | 0.73 | 78% | 0.784 | S | S | * | * | | | trans | -84.7 | 107.9 | 175.2 | -41.5 | 0 | 0 | 0 | 0 | 109.2 | T116 | T114-T116 PolarHBondContact O-N 2.92Š|
| 115 | V | 27.3 | Very low | 28.8 | Very low | 122 Ų | 122 | 124 Ų | 124 | 74% | 0.739 | 78% | 0.775 | S | S | * | * | | | trans | -88.1 | 98.9 | 173.8 | -179.4 | 0 | 0 | 0 | 0 | 108.5 | A113 C117 | A113-V115 PolarHBondContact O-N 3.05Å; V115-C117 PolarHBondContact O-N 2.9Å |
| 116 | T | 24.5 | Very low | 28.9 | Very low | 126 Ų | 126 | 122.5 Ų | 122.5 | 77% | 0.773 | 77% | 0.77 | S | S | * | * | | | trans | -86.6 | 98 | 170.3 | 18.2 | 0 | 0 | 0 | 0 | 109.4 | T114 P118 | T114-T116 PolarHBondContact O-N 2.92Å; T116-P118 WeakPolarHBondContact O-CD 3.38Å |
| 117 | C | 26.7 | Very low | 28.8 | Very low | 100 Ų | 100 | 123.2 Ų | 123.2 | 68% | 0.676 | 77% | 0.768 | S | S | * | * | | | trans | -73.5 | 119.4 | 166.8 | -62.4 | 0 | 0 | 0 | 0 | 109 | V115 L119 | V115-C117 PolarHBondContact O-N 2.9Å; C117-L119 PolarHBondContact O-N 2.92Å |
| 118 | P | 30.7 | Very low | 28.8 | Very low | 121 Ų | 121 | 122.8 Ų | 122.8 | 79% | 0.786 | 77% | 0.769 | S | S | * | * | | | trans | -66.3 | 120.9 | 168.8 | 26.5 | -30.5 | 0 | 0 | 0 | 108.4 | T116 S120 | T116-P118 WeakPolarHBondContact O-CD 3.38Å; P118-S120 PolarHBondContact O-N 2.9Å |
| 119 | L | 27.8 | Very low | 28.8 | Very low | 186 Ų | 186 | 128.5 Ų | 128.5 | 97% | 0.974 | 77% | 0.772 | S | S | * | * | | | trans | -59.3 | 84.3 | 169.1 | -87.8 | 126.3 | 0 | 0 | 0 | 109.3 | C117 | C117-L119 PolarHBondContact O-N 2.92Š|
| 120 | S | 30.5 | Very low | 28.8 | Very low | 110 Ų | 110 | 129.5 Ų | 129.5 | 77% | 0.769 | 78% | 0.782 | S | S | * | * | | | trans | -85.2 | 130.5 | 166.9 | -162.2 | 0 | 0 | 0 | 0 | 108.7 | P118 A122 | P118-S120 PolarHBondContact O-N 2.9Å; S120-A122 PolarHBondContact O-N 2.73Å; S120-A122 VanDerWaalsContact O-N 3.14Å |
| 121 | A | 29.1 | Very low | 28.7 | Very low | 93 Ų | 93 | 129.3 Ų | 129.3 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | | | trans | -46.5 | 114.9 | -172 | 0 | 0 | 0 | 0 | 0 | 112.1 | P123 | A121-P123 WeakPolarHBondContact O-CD 3.2Š|
| 122 | A | 29.8 | Very low | 28.7 | Very low | 93 Ų | 93 | 128.3 Ų | 128.3 | 77% | 0.769 | 78% | 0.78 | S | S | * | * | | | trans | -57.6 | 120.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | S120 A124 | S120-A122 PolarHBondContact O-N 2.73Å; S120-A122 VanDerWaalsContact O-N 3.14Å; A122-A124 PolarHBondContact O-N 2.84Å |
| 123 | P | 30.6 | Very low | 28.9 | Very low | 107 Ų | 107 | 121.2 Ų | 121.2 | 70% | 0.695 | 77% | 0.772 | S | S | * | * | | | trans | -63.5 | 128.3 | 177.8 | 23.8 | -30.8 | 0 | 0 | 0 | 108.8 | A121 T125 | A121-P123 WeakPolarHBondContact O-CD 3.2Å; P123-T125 PolarHBondContact O-N 3.12Å |
| 124 | A | 29.1 | Very low | 29.1 | Very low | 103 Ų | 103 | 127.3 Ų | 127.3 | 85% | 0.851 | 78% | 0.775 | S | S | * | * | | | trans | -65.7 | 79.2 | 177 | 0 | 0 | 0 | 0 | 0 | 110.2 | A122 S126 | A122-A124 PolarHBondContact O-N 2.84Å; A124-S126 PolarHBondContact O-N 2.9Å; A124-S126 VanDerWaalsContact O-N 3.09Å |
| 125 | T | 30.7 | Very low | 29.3 | Very low | 111 Ų | 111 | 130 Ų | 130 | 68% | 0.681 | 78% | 0.78 | S | S | * | * | | | trans | -77.4 | 96.1 | 167.7 | 47.7 | 0 | 0 | 0 | 0 | 107.5 | P123 C127 | P123-T125 PolarHBondContact O-N 3.12Å; T125-C127 VanDerWaalsContact C-N 3.3Å; T125-C127 PolarHBondContact O-N 3.06Å |
| 126 | S | 30.2 | Very low | 29.5 | Very low | 102 Ų | 102 | 132 Ų | 132 | 71% | 0.713 | 79% | 0.785 | S | S | * | * | | | trans | -69.3 | 91.4 | 171.3 | 69.7 | 0 | 0 | 0 | 0 | 108.8 | A124 H128 | A124-S126 PolarHBondContact O-N 2.9Å; A124-S126 VanDerWaalsContact O-N 3.09Å; S126-H128 PolarHBondContact O-N 2.94Å |
| 127 | C | 28.3 | Very low | 29.6 | Very low | 110 Ų | 110 | 134.8 Ų | 134.8 | 74% | 0.743 | 79% | 0.789 | S | S | * | * | | | trans | -74.7 | 95 | 174.1 | -61.2 | 0 | 0 | 0 | 0 | 108.8 | T125 R129 | T125-C127 VanDerWaalsContact C-N 3.3Å; T125-C127 PolarHBondContact O-N 3.06Å; C127-R129 VanDerWaalsContact C-N 3.35Å; C127-R129 PolarHBondContact O-N 3.12Å |
| 128 | H | 27.6 | Very low | 29.8 | Very low | 185 Ų | 185 | 132.7 Ų | 132.7 | 86% | 0.856 | 79% | 0.785 | S | S | * | * | | | trans | -64.9 | 96 | 163.1 | -92.1 | -80.4 | 0 | 0 | 0 | 108.6 | S126 G130 | S126-H128 PolarHBondContact O-N 2.94Å; H128-G130 PolarHBondContact O-N 3.06Å |
| 129 | R | 30.1 | Very low | 29.9 | Very low | 242 Ų | 242 | 137.1 Ų | 137.1 | 91% | 0.913 | 80% | 0.795 | S | S | * | * | | | trans | -72.6 | 101.2 | 175.9 | -152.9 | 174.8 | -166.4 | 161.5 | 3.8 | 108.3 | C127 S131 | C127-R129 VanDerWaalsContact C-N 3.35Å; C127-R129 PolarHBondContact O-N 3.12Å; R129-S131 PolarHBondContact O-N 3.23Å |
| 130 | G | 28.7 | Very low | 30.3 | Very low | 67 Ų | 67 | 131.5 Ų | 131.5 | 69% | 0.691 | 78% | 0.775 | S | S | * | * | | | trans | -53.5 | 125.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | H128 L132 | H128-G130 PolarHBondContact O-N 3.06Å; G130-L132 PolarHBondContact O-N 3.06Å |
| 131 | S | 28.3 | Very low | 30.6 | Very low | 114 Ų | 114 | 132.3 Ų | 132.3 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | | | trans | -72.3 | 100.4 | 173.9 | 173.5 | 0 | 0 | 0 | 0 | 108.9 | R129 A133 | R129-S131 PolarHBondContact O-N 3.23Å; S131-A133 VanDerWaalsContact C-N 3.28Å; S131-A133 PolarHBondContact O-N 3.33Å |
| 132 | L | 31.4 | Very low | 30.8 | Very low | 156 Ų | 156 | 133.8 Ų | 133.8 | 82% | 0.817 | 78% | 0.78 | S | S | * | * | | | trans | -70.8 | 87.5 | 166.1 | -77.8 | 166.8 | 0 | 0 | 0 | 108.8 | G130 R134 | G130-L132 PolarHBondContact O-N 3.06Å; L132-R134 VanDerWaalsContact C-N 3.32Å; L132-R134 PolarHBondContact O-N 3.18Å |
| 133 | A | 31.5 | Very low | 31.1 | Very low | 86 Ų | 86 | 140.1 Ų | 140.1 | 71% | 0.711 | 78% | 0.784 | S | S | * | * | | | trans | -72.6 | 89.2 | 164.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | S131 Q135 | S131-A133 VanDerWaalsContact C-N 3.28Å; S131-A133 PolarHBondContact O-N 3.33Å; A133-Q135 PolarHBondContact O-N 3.31Å; A133-Q135 VanDerWaalsContact O-N 3.17Å |
| 134 | R | 32.5 | Very low | 31.2 | Very low | 220 Ų | 220 | 142.7 Ų | 142.7 | 83% | 0.83 | 79% | 0.789 | S | S | * | * | | | trans | -67.7 | 110.7 | 162.5 | -71.1 | -172.8 | -173.2 | -161.8 | 0.9 | 106.9 | L132 L136 | L132-R134 VanDerWaalsContact C-N 3.32Å; L132-R134 PolarHBondContact O-N 3.18Å; R134-L136 VanDerWaalsContact C-N 3.33Å; R134-L136 PolarHBondContact O-N 3.04Å |
| 135 | Q | 30.4 | Very low | 31.4 | Very low | 176 Ų | 176 | 145.7 Ų | 145.7 | 82% | 0.822 | 79% | 0.79 | S | S | * | * | | | trans | -56.1 | 97.4 | 166.5 | -84.1 | 173.6 | -24.2 | 0 | 0 | 108.2 | A133 H137 | A133-Q135 PolarHBondContact O-N 3.31Å; A133-Q135 VanDerWaalsContact O-N 3.17Å; Q135-H137 PolarHBondContact O-N 3.14Å |
| 136 | L | 31.3 | Very low | 31.6 | Very low | 164 Ų | 164 | 146.7 Ų | 146.7 | 86% | 0.859 | 79% | 0.79 | S | S | * | * | | | trans | -82.7 | 95.8 | 160.8 | -76.3 | 169.1 | 0 | 0 | 0 | 105.9 | R134 G138 | R134-L136 VanDerWaalsContact C-N 3.33Å; R134-L136 PolarHBondContact O-N 3.04Å; L136-G138 PolarHBondContact O-N 3.36Å |
| 137 | H | 26.9 | Very low | 31.6 | Very low | 184 Ų | 184 | 153.2 Ų | 153.2 | 85% | 0.852 | 80% | 0.799 | S | S | * | * | | | trans | -61.2 | 104.3 | 163 | -95 | -57.4 | 0 | 0 | 0 | 108 | Q135 | Q135-H137 PolarHBondContact O-N 3.14Š|
| 138 | G | 30 | Very low | 31.9 | Very low | 57 Ų | 57 | 159.2 Ų | 159.2 | 59% | 0.588 | 81% | 0.806 | S | S | * | * | | | trans | -168.7 | 109.9 | 172.2 | 0 | 0 | 0 | 0 | 0 | 107.1 | L136 A140 | L136-G138 PolarHBondContact O-N 3.36Å; G138-A140 VanDerWaalsContact C-N 3.26Å; G138-A140 PolarHBondContact O-N 3.27Å |
| 139 | H | 33.1 | Very low | 32.1 | Very low | 214 Ų | 214 | 155.7 Ų | 155.7 | 99% | 0.991 | 80% | 0.802 | S | S | * | * | | | trans | -55.6 | 87.7 | 175.8 | -85.9 | -67.7 | 0 | 0 | 0 | 110.7 | | |
| 140 | A | 35.7 | Very low | 32.2 | Very low | 68 Ų | 68 | 148.4 Ų | 148.4 | 56% | 0.562 | 79% | 0.793 | S | S | * | * | | | trans | -150.5 | 117.5 | 162.7 | 0 | 0 | 0 | 0 | 0 | 107.2 | G138 T142 | G138-A140 VanDerWaalsContact C-N 3.26Å; G138-A140 PolarHBondContact O-N 3.27Å; A140-T142 PolarHBondContact O-N 3.22Å; A140-T142 PolarHBondContact O-OG1 2.75Å |
| 141 | S | 37.3 | Very low | 32.5 | Very low | 126 Ų | 126 | 149.9 Ų | 149.9 | 88% | 0.881 | 80% | 0.799 | S | S | * | * | | | trans | -49.9 | 85.3 | 170.5 | 168.1 | 0 | 0 | 0 | 0 | 110 | | |
| 142 | T | 34.3 | Very low | 32.6 | Very low | 125 Ų | 125 | 154.3 Ų | 154.3 | 77% | 0.767 | 80% | 0.8 | S | S | * | * | | | trans | -106.6 | 93.1 | 179.7 | -7.4 | 0 | 0 | 0 | 0 | 107.4 | A140 M144 | A140-T142 PolarHBondContact O-N 3.22Å; A140-T142 PolarHBondContact O-OG1 2.75Å; T142-M144 PolarHBondContact O-N 2.75Å |
| 143 | R | 36 | Very low | 32.7 | Very low | 225 Ų | 225 | 158 Ų | 158 | 85% | 0.849 | 80% | 0.803 | S | S | * | * | | | trans | -50.7 | 110.7 | 170.1 | -76.2 | 179.2 | 170.8 | -176.5 | -2.5 | 108.8 | L145 | R143-L145 PolarHBondContact O-N 2.81Š|
| 144 | M | 31.7 | Very low | 32.8 | Very low | 162 Ų | 162 | 165 Ų | 165 | 80% | 0.798 | 81% | 0.811 | S | S | * | * | | | trans | -67.2 | 96.8 | 177.7 | -172.3 | -177.8 | -77.7 | 0 | 0 | 109.3 | T142 I146 | T142-M144 PolarHBondContact O-N 2.75Å; M144-I146 HydrophobicContact CG-CG1 4.02Å; M144-I146 PolarHBondContact O-N 2.96Å; M144-I146 VanDerWaalsContact O-N 3.09Å; M144-I146 HydrophobicContact SD-CD1 4.34Å; M144-I146 HydrophobicContact SD-CG1 4.22Å |
| 145 | L | 32.5 | Very low | 33 | Very low | 166 Ų | 166 | 160.9 Ų | 160.9 | 87% | 0.869 | 81% | 0.811 | S | S | * | * | | | trans | -76.3 | 92.6 | 172 | -75.5 | 169.3 | 0 | 0 | 0 | 109.1 | R143 R147 | R143-L145 PolarHBondContact O-N 2.81Å; L145-R147 PolarHBondContact O-N 2.88Å; L145-R147 VanDerWaalsContact O-N 3.12Å |
| 146 | I | 35.9 | Very low | 33.1 | Very low | 131 Ų | 131 | 156.4 Ų | 156.4 | 67% | 0.672 | 81% | 0.811 | S | S | * | * | | | trans | -73.8 | 100.3 | 172.1 | -57.8 | 175.6 | 0 | 0 | 0 | 108.2 | M144 R148 | M144-I146 HydrophobicContact CG-CG1 4.02Å; M144-I146 PolarHBondContact O-N 2.96Å; M144-I146 VanDerWaalsContact O-N 3.09Å; M144-I146 HydrophobicContact SD-CD1 4.34Å; M144-I146 HydrophobicContact SD-CG1 4.22Å; I146-R148 PolarHBondContact O-N 3.06Å |
| 147 | R | 31.1 | Very low | 33.1 | Very low | 240 Ų | 240 | 152 Ų | 152 | 91% | 0.906 | 81% | 0.805 | S | S | * | * | | | trans | -72.3 | 97.5 | 173.9 | -163.4 | 178.9 | -176.6 | -169.4 | 1.2 | 109.1 | L145 S149 | L145-R147 PolarHBondContact O-N 2.88Å; L145-R147 VanDerWaalsContact O-N 3.12Å; R147-S149 PolarHBondContact O-N 3.13Å |
| 148 | R | 33 | Very low | 33.5 | Very low | 235 Ų | 235 | 148.7 Ų | 148.7 | 89% | 0.887 | 81% | 0.81 | S | S | * | * | | | trans | -69.8 | 97 | 170.3 | -71.6 | -175.9 | 179.3 | -174.6 | -0.1 | 109.4 | I146 A150 | I146-R148 PolarHBondContact O-N 3.06Å; R148-A150 PolarHBondContact O-N 3.06Å; R148-A150 VanDerWaalsContact O-N 3.13Å |
| 149 | S | 31.8 | Very low | 33.7 | Very low | 111 Ų | 111 | 148.7 Ų | 148.7 | 78% | 0.776 | 81% | 0.81 | S | S | * | * | | | trans | -70 | 102.4 | 164.8 | 39 | 0 | 0 | 0 | 0 | 108.6 | R147 A151 | R147-S149 PolarHBondContact O-N 3.13Å; S149-A151 PolarHBondContact O-N 2.97Å |
| 150 | A | 33.1 | Very low | 33.6 | Very low | 89 Ų | 89 | 148.4 Ų | 148.4 | 74% | 0.736 | 81% | 0.806 | S | S | * | * | | | trans | -62.8 | 106.4 | 170.2 | 0 | 0 | 0 | 0 | 0 | 108.4 | R148 Y152 | R148-A150 PolarHBondContact O-N 3.06Å; R148-A150 VanDerWaalsContact O-N 3.13Å; A150-Y152 VanDerWaalsContact C-N 3.28Å; A150-Y152 PolarHBondContact O-N 3.06Å |
| 151 | A | 35.1 | Very low | 33.4 | Very low | 99 Ų | 99 | 156.6 Ų | 156.6 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | | | trans | -65.5 | 91.7 | 168.8 | 0 | 0 | 0 | 0 | 0 | 108.1 | S149 R153 | S149-A151 PolarHBondContact O-N 2.97Å; A151-R153 PolarHBondContact O-N 3.42Å; A151-R153 VanDerWaalsContact O-N 3.13Å |
| 152 | Y | 30.5 | Very low | 33.2 | Very low | 207 Ų | 207 | 157.5 Ų | 157.5 | 81% | 0.812 | 82% | 0.823 | S | S | * | * | | | trans | -72.6 | 101.2 | 169 | -144.1 | -93.1 | 0 | 0 | 0 | 106.6 | A150 R154 | A150-Y152 VanDerWaalsContact C-N 3.28Å; A150-Y152 PolarHBondContact O-N 3.06Å; Y152-R154 PolarHBondContact O-N 3.17Å |
| 153 | R | 31.9 | Very low | 32.9 | Very low | 232 Ų | 232 | 154 Ų | 154 | 88% | 0.875 | 81% | 0.812 | S | S | * | * | | | trans | -60.7 | 103.5 | 168.5 | -80.3 | -172.7 | -176.8 | -174.6 | 1.2 | 107.3 | A151 T155 | A151-R153 PolarHBondContact O-N 3.42Å; A151-R153 VanDerWaalsContact O-N 3.13Å; R153-T155 PolarHBondContact O-N 3.14Å |
| 154 | R | 35 | Very low | 32.5 | Very low | 233 Ų | 233 | 148 Ų | 148 | 88% | 0.879 | 81% | 0.805 | S | S | * | * | | | trans | -76.7 | 102.2 | 160 | -75.9 | -173.6 | -178.1 | -171.7 | 1.2 | 106.7 | Y152 G156 | Y152-R154 PolarHBondContact O-N 3.17Å; R154-G156 PolarHBondContact O-N 2.78Å; R154-G156 VanDerWaalsContact O-N 3.1Å |
| 155 | T | 37.2 | Very low | 32.3 | Very low | 135 Ų | 135 | 152.1 Ų | 152.1 | 83% | 0.828 | 81% | 0.811 | S | S | * | * | | | trans | -61.7 | 104.8 | 157.6 | 34.5 | 0 | 0 | 0 | 0 | 106.8 | R153 G157 | R153-T155 PolarHBondContact O-N 3.14Å; T155-G157 PolarHBondContact O-N 2.97Å |
| 156 | G | 32.4 | Very low | 32.1 | Very low | 81 Ų | 81 | 154.8 Ų | 154.8 | 84% | 0.835 | 81% | 0.81 | S | S | * | * | | | trans | -67.9 | 92.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | R154 | R154-G156 PolarHBondContact O-N 2.78Å; R154-G156 VanDerWaalsContact O-N 3.1Å |
| 157 | G | 31.1 | Very low | 31.9 | Very low | 71 Ų | 71 | 154.8 Ų | 154.8 | 73% | 0.732 | 82% | 0.816 | S | S | * | * | | | trans | -83.2 | 119.6 | 155.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | T155 G159 | T155-G157 PolarHBondContact O-N 2.97Å; G157-G159 VanDerWaalsContact C-N 3.27Å; G157-G159 PolarHBondContact O-N 2.92Å |
| 158 | A | 34.8 | Very low | 32 | Very low | 115 Ų | 115 | 147.3 Ų | 147.3 | 95% | 0.95 | 81% | 0.806 | S | S | * | * | | | trans | -67 | 82.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | | |
| 159 | G | 33.8 | Very low | 31.7 | Very low | 57 Ų | 57 | 145.5 Ų | 145.5 | 59% | 0.588 | 80% | 0.804 | S | S | * | * | | | trans | -108.4 | 103.6 | 172 | 0 | 0 | 0 | 0 | 0 | 109.8 | G157 R161 | G157-G159 VanDerWaalsContact C-N 3.27Å; G157-G159 PolarHBondContact O-N 2.92Å; G159-R161 VanDerWaalsContact C-N 3.31Å; G159-R161 PolarHBondContact O-N 2.86Å |
| 160 | K | 31.3 | Very low | 31.7 | Very low | 208 Ų | 208 | 145.7 Ų | 145.7 | 90% | 0.904 | 80% | 0.801 | S | S | * | * | | | trans | -57.2 | 93.7 | 166.7 | -70.9 | 179 | 179.5 | 178.7 | 0 | 108.4 | T162 | K160-T162 PolarHBondContact O-N 2.77Š|
| 161 | R | 32.5 | Very low | 31.7 | Very low | 240 Ų | 240 | 147.3 Ų | 147.3 | 91% | 0.906 | 80% | 0.804 | S | S | * | * | | | trans | -93.7 | 89.2 | 171.7 | -80.5 | -172.9 | 162.3 | -146.2 | -3.8 | 108.6 | G159 G163 | G159-R161 VanDerWaalsContact C-N 3.31Å; G159-R161 PolarHBondContact O-N 2.86Å; R161-G163 PolarHBondContact O-N 2.88Å |
| 162 | T | 31.2 | Very low | 31.7 | Very low | 145 Ų | 145 | 150.4 Ų | 150.4 | 89% | 0.89 | 81% | 0.806 | S | S | * | * | | | trans | -67.3 | 80.9 | 158.3 | 41.6 | 0 | 0 | 0 | 0 | 108.4 | K160 | K160-T162 PolarHBondContact O-N 2.77Š|
| 163 | G | 29 | Very low | 31.8 | Very low | 53 Ų | 53 | 146.3 Ų | 146.3 | 55% | 0.546 | 81% | 0.805 | S | S | . | * | | | trans | -98.1 | 105 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | R161 W165 | R161-G163 PolarHBondContact O-N 2.88Å; G163-W165 PolarHBondContact O-N 2.89Å |
| 164 | S | 26.6 | Very low | 32 | Very low | 99 Ų | 99 | 139.9 Ų | 139.9 | 69% | 0.692 | 80% | 0.801 | S | S | * | * | | | trans | -57.8 | 120.2 | 167.9 | 171.9 | 0 | 0 | 0 | 0 | 109.6 | R166 | S164-R166 VanDerWaalsContact C-N 3.34Å; S164-R166 PolarHBondContact O-N 3.36Å |
| 165 | W | 29.1 | Very low | 31.9 | Very low | 247 Ų | 247 | 133 Ų | 133 | 94% | 0.936 | 79% | 0.794 | S | S | * | * | | | trans | -69.5 | 90.2 | 172.7 | -61.4 | 89 | 0 | 0 | 0 | 108.9 | G163 T167 | G163-W165 PolarHBondContact O-N 2.89Å; W165-T167 PolarHBondContact O-N 3.31Å |
| 166 | R | 28.3 | Very low | 31.5 | Very low | 222 Ų | 222 | 137.5 Ų | 137.5 | 84% | 0.838 | 80% | 0.796 | S | S | * | * | | | trans | -82.8 | 108.9 | 161.5 | -69.3 | -171.8 | -167.8 | -92.3 | 1.2 | 107.6 | S164 A168 | S164-R166 VanDerWaalsContact C-N 3.34Å; S164-R166 PolarHBondContact O-N 3.36Å; R166-A168 PolarHBondContact O-N 2.92Å |
| 167 | T | 32 | Very low | 31.5 | Very low | 131 Ų | 131 | 140.6 Ų | 140.6 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | | | trans | -57.1 | 103.3 | 174 | -33.2 | 0 | 0 | 0 | 0 | 108.7 | W165 K169 | W165-T167 PolarHBondContact O-N 3.31Å; T167-K169 PolarHBondContact O-N 3.06Å |
| 168 | A | 31.3 | Very low | 31.3 | Very low | 83 Ų | 83 | 143.3 Ų | 143.3 | 69% | 0.686 | 80% | 0.795 | S | S | * | * | | | trans | -65.4 | 99.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | R166 T170 | R166-A168 PolarHBondContact O-N 2.92Å; A168-T170 PolarHBondContact O-N 2.9Å; A168-T170 VanDerWaalsContact O-N 3.11Å |
| 169 | K | 27.8 | Very low | 31.3 | Very low | 198 Ų | 198 | 144.7 Ų | 144.7 | 86% | 0.861 | 79% | 0.785 | S | S | * | * | | | trans | -77.1 | 76.2 | 162.6 | -72.5 | -177.9 | 179.2 | 178.2 | 0 | 108 | T167 | T167-K169 PolarHBondContact O-N 3.06Š|
| 170 | T | 32.1 | Very low | 31.2 | Very low | 114 Ų | 114 | 147.4 Ų | 147.4 | 70% | 0.699 | 80% | 0.796 | S | S | * | * | | | trans | -112.7 | 107.4 | 160.5 | 34.7 | 0 | 0 | 0 | 0 | 107.5 | A168 L172 | A168-T170 PolarHBondContact O-N 2.9Å; A168-T170 VanDerWaalsContact O-N 3.11Å; T170-L172 PolarHBondContact O-N 2.9Å; T170-L172 VanDerWaalsContact O-N 3.14Å |
| 171 | P | 32.8 | Very low | 31.1 | Very low | 123 Ų | 123 | 140.8 Ų | 140.8 | 80% | 0.799 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 117.2 | 177.6 | 25.1 | -30.4 | 0 | 0 | 0 | 108.7 | | |
| 172 | L | 34.4 | Very low | 31.2 | Very low | 164 Ų | 164 | 136 Ų | 136 | 86% | 0.859 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -59 | 130.3 | 168.5 | -78 | 154 | 0 | 0 | 0 | 108.2 | T170 A174 | T170-L172 PolarHBondContact O-N 2.9Å; T170-L172 VanDerWaalsContact O-N 3.14Å; L172-A174 PolarHBondContact O-N 3.44Å |
| 173 | P | 32.5 | Very low | 31.1 | Very low | 122 Ų | 122 | 134.9 Ų | 134.9 | 79% | 0.792 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -61 | 125.9 | 176.7 | 23.9 | -30.9 | 0 | 0 | 0 | 108.7 | A175 | P173-A175 PolarHBondContact O-N 3.01Š|
| 174 | A | 36.5 | Very low | 31.2 | Very low | 97 Ų | 97 | 136.6 Ų | 136.6 | 80% | 0.802 | 79% | 0.791 | S | S | * | * | | | trans | -55.6 | 103.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | L172 R176 | L172-A174 PolarHBondContact O-N 3.44Å; A174-R176 PolarHBondContact O-N 3.34Å |
| 175 | A | 34.4 | Very low | 31.5 | Very low | 88 Ų | 88 | 138.4 Ų | 138.4 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | | | trans | -63.3 | 101.8 | 168.6 | 0 | 0 | 0 | 0 | 0 | 107.3 | P173 L177 | P173-A175 PolarHBondContact O-N 3.01Å; A175-L177 VanDerWaalsContact C-N 3.26Å; A175-L177 PolarHBondContact O-N 2.95Å |
| 176 | R | 27.6 | Very low | 31.5 | Very low | 229 Ų | 229 | 136.5 Ų | 136.5 | 86% | 0.864 | 80% | 0.796 | S | S | * | * | | | trans | -60 | 91.5 | 165.7 | -91.4 | -177 | 168.1 | -168.1 | -2.2 | 107.8 | A174 T178 | A174-R176 PolarHBondContact O-N 3.34Å; R176-T178 VanDerWaalsContact C-N 3.32Å; R176-T178 PolarHBondContact O-N 3.11Å |
| 177 | L | 31.7 | Very low | 31.7 | Very low | 147 Ų | 147 | 130 Ų | 130 | 77% | 0.77 | 79% | 0.79 | S | S | * | * | | | trans | -80.9 | 90.7 | 158 | -73.3 | 171.6 | 0 | 0 | 0 | 106.6 | A175 L179 | A175-L177 VanDerWaalsContact C-N 3.26Å; A175-L177 PolarHBondContact O-N 2.95Å; L177-L179 PolarHBondContact O-N 3.45Å |
| 178 | T | 28.3 | Very low | 31.6 | Very low | 127 Ų | 127 | 127.9 Ų | 127.9 | 78% | 0.779 | 79% | 0.786 | S | S | * | * | | | trans | -66.9 | 86.5 | 162.7 | 43.2 | 0 | 0 | 0 | 0 | 108.1 | R176 | R176-T178 VanDerWaalsContact C-N 3.32Å; R176-T178 PolarHBondContact O-N 3.11Å |
| 179 | L | 33.4 | Very low | 31.4 | Very low | 144 Ų | 144 | 127.2 Ų | 127.2 | 75% | 0.754 | 79% | 0.787 | S | S | * | * | | | trans | -114.7 | 113.7 | 160.3 | -90.8 | 153.3 | 0 | 0 | 0 | 106.9 | L177 G181 | L177-L179 PolarHBondContact O-N 3.45Å; L179-G181 PolarHBondContact O-N 2.97Å |
| 180 | S | 33.7 | Very low | 31.6 | Very low | 115 Ų | 115 | 124.2 Ų | 124.2 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -28.1 | 120.9 | 171.8 | 53 | 0 | 0 | 0 | 0 | 114.7 | | |
| 181 | G | 28.9 | Very low | 31.5 | Very low | 68 Ų | 68 | 124.3 Ų | 124.3 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | S | Bend | trans | 81 | 132.2 | 155.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | L179 | L179-G181 PolarHBondContact O-N 2.97Š|
| 182 | V | 33.3 | Very low | 31.1 | Very low | 141 Ų | 141 | 129.2 Ų | 129.2 | 86% | 0.855 | 79% | 0.793 | S | S | * | * | | | trans | 83.5 | 76.5 | 176.8 | -160.7 | 0 | 0 | 0 | 0 | 114.5 | A184 | V182-A184 PolarHBondContact O-N 2.92Š|
| 183 | S | 29.4 | Very low | 30.9 | Very low | 120 Ų | 120 | 126.6 Ų | 126.6 | 84% | 0.839 | 80% | 0.795 | S | S | * | * | | | trans | -62.3 | 102.6 | 163.3 | -46.5 | 0 | 0 | 0 | 0 | 110.4 | | |
| 184 | A | 31.1 | Very low | 30.6 | Very low | 90 Ų | 90 | 125.5 Ų | 125.5 | 74% | 0.744 | 79% | 0.786 | S | S | * | * | | | trans | -108.4 | 87 | 162.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | V182 F186 | V182-A184 PolarHBondContact O-N 2.92Å; A184-F186 PolarHBondContact O-N 3.5Å |
| 185 | T | 32.6 | Very low | 30.1 | Very low | 137 Ų | 137 | 129.1 Ų | 129.1 | 84% | 0.84 | 79% | 0.786 | S | S | * | * | | | trans | -69.8 | 94.2 | 170.8 | -1.3 | 0 | 0 | 0 | 0 | 108.2 | A187 | T185-A187 VanDerWaalsContact C-N 3.31Å; T185-A187 PolarHBondContact O-N 2.67Å |
| 186 | F | 28.8 | Very low | 29.8 | Very low | 206 Ų | 206 | 129.4 Ų | 129.4 | 90% | 0.904 | 79% | 0.788 | S | S | * | * | | | trans | -78.4 | 87.9 | 169.7 | -147 | -95.2 | 0 | 0 | 0 | 107.9 | A184 A188 | A184-F186 PolarHBondContact O-N 3.5Å; F186-A188 PolarHBondContact O-N 2.97Å; F186-A188 VanDerWaalsContact O-N 3.16Å |
| 187 | A | 32.4 | Very low | 29.6 | Very low | 85 Ų | 85 | 122.5 Ų | 122.5 | 70% | 0.702 | 79% | 0.789 | S | S | * | * | | | trans | -63.6 | 113 | 171.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | T185 G189 | T185-A187 VanDerWaalsContact C-N 3.31Å; T185-A187 PolarHBondContact O-N 2.67Å; A187-G189 VanDerWaalsContact C-N 3.34Å; A187-G189 PolarHBondContact O-N 3.13Å |
| 188 | A | 31.1 | Very low | 29.2 | Very low | 88 Ų | 88 | 119.1 Ų | 119.1 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | | | trans | -62.6 | 97.6 | 169.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | F186 V190 | F186-A188 PolarHBondContact O-N 2.97Å; F186-A188 VanDerWaalsContact O-N 3.16Å; A188-V190 PolarHBondContact O-N 3.05Å |
| 189 | G | 26.9 | Very low | 29.2 | Very low | 69 Ų | 69 | 124.3 Ų | 124.3 | 71% | 0.711 | 80% | 0.795 | S | S | * | * | | | trans | -63.6 | 95.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | A187 S191 | A187-G189 VanDerWaalsContact C-N 3.34Å; A187-G189 PolarHBondContact O-N 3.13Å; G189-S191 VanDerWaalsContact C-N 3.3Å; G189-S191 PolarHBondContact O-N 3.19Å |
| 190 | V | 31.4 | Very low | 28.9 | Very low | 134 Ų | 134 | 124.1 Ų | 124.1 | 81% | 0.812 | 80% | 0.799 | S | S | * | * | | | trans | -73.2 | 90.7 | 165.2 | -177.3 | 0 | 0 | 0 | 0 | 106.5 | A188 R192 | A188-V190 PolarHBondContact O-N 3.05Å; V190-R192 PolarHBondContact O-N 3.28Å; V190-R192 VanDerWaalsContact O-N 3.08Å |
| 191 | S | 30 | Very low | 28.6 | Very low | 117 Ų | 117 | 129.5 Ų | 129.5 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | | | trans | -70.9 | 103.1 | 171 | -63.6 | 0 | 0 | 0 | 0 | 108.2 | G189 A193 | G189-S191 VanDerWaalsContact C-N 3.3Å; G189-S191 PolarHBondContact O-N 3.19Å; S191-A193 PolarHBondContact O-N 2.76Å |
| 192 | R | 25.4 | Very low | 28.5 | Very low | 225 Ų | 225 | 133 Ų | 133 | 85% | 0.849 | 81% | 0.81 | S | S | * | * | | | trans | -54.9 | 117.4 | 165.3 | -98.8 | 177.9 | 176 | 164.8 | -1.8 | 108.8 | V190 V194 | V190-R192 PolarHBondContact O-N 3.28Å; V190-R192 VanDerWaalsContact O-N 3.08Å; R192-V194 HydrophobicContact CB-CG2 4.25Å; R192-V194 PolarHBondContact O-N 3.09Å |
| 193 | A | 29.5 | Very low | 28.3 | Very low | 109 Ų | 109 | 131.7 Ų | 131.7 | 90% | 0.901 | 80% | 0.802 | S | S | * | * | | | trans | -75.3 | 105.6 | 160.1 | 0 | 0 | 0 | 0 | 0 | 107.6 | S191 | S191-A193 PolarHBondContact O-N 2.76Š|
| 194 | V | 26.1 | Very low | 28.1 | Very low | 99 Ų | 99 | 131.3 Ų | 131.3 | 60% | 0.6 | 80% | 0.8 | S | S | * | * | | | trans | -121.8 | 147.2 | 168.7 | 175 | 0 | 0 | 0 | 0 | 107.1 | R192 | R192-V194 HydrophobicContact CB-CG2 4.25Å; R192-V194 PolarHBondContact O-N 3.09Å |
| 195 | H | 27 | Very low | 28 | Very low | 173 Ų | 173 | 132 Ų | 132 | 80% | 0.801 | 80% | 0.799 | S | S | * | * | | | trans | 95.9 | 95 | -176.8 | -62.5 | -58.8 | 0 | 0 | 0 | 113.7 | | |
| 196 | A | 27.2 | Very low | 27.8 | Very low | 94 Ų | 94 | 131.2 Ų | 131.2 | 78% | 0.777 | 80% | 0.799 | S | S | * | * | | | | 59.6 | 98.9 | 61.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 197 | G | 23 | Very low | 27.9 | Very low | 85 Ų | 85 | 126.9 Ų | 126.9 | 88% | 0.876 | 79% | 0.794 | S | S | * | * | | | trans | 63.7 | 115.9 | 135.3 | 0 | 0 | 0 | 0 | 0 | 118.9 | | |
| 198 | G | 24.3 | Very low | 27.7 | Very low | 76 Ų | 76 | 128.2 Ų | 128.2 | 78% | 0.784 | 80% | 0.799 | S | S | * | * | | | trans | 128 | 118.2 | 132.3 | 0 | 0 | 0 | 0 | 0 | 116.9 | | |
| 199 | R | 28.4 | Very low | 27.5 | Very low | 236 Ų | 236 | 129.2 Ų | 129.2 | 89% | 0.891 | 80% | 0.8 | S | S | * | * | | | trans | 77.9 | 97.3 | 150.2 | -74.1 | 176.4 | 155.9 | 157.3 | -6.5 | 118.2 | R201 | R199-R201 PolarHBondContact O-N 2.84Š|
| 200 | T | 26.9 | Very low | 27.9 | Very low | 139 Ų | 139 | 132 Ų | 132 | 85% | 0.853 | 81% | 0.805 | S | S | * | * | | | trans | -20.5 | 115 | 138.5 | 37.4 | 0 | 0 | 0 | 0 | 114 | | |
| 201 | R | 27.9 | Very low | 27.8 | Very low | 229 Ų | 229 | 132.2 Ų | 132.2 | 86% | 0.864 | 81% | 0.807 | S | S | * | * | | | trans | -120.1 | 108.6 | 151.5 | -82.7 | -172.9 | -178.8 | -177 | 1.1 | 107.8 | R199 V203 | R199-R201 PolarHBondContact O-N 2.84Å; R201-V203 HydrophobicContact CB-CG2 4.4Å; R201-V203 PolarHBondContact O-N 2.95Å |
| 202 | T | 24.9 | Very low | 27.8 | Very low | 142 Ų | 142 | 131.4 Ų | 131.4 | 87% | 0.871 | 81% | 0.808 | S | S | * | * | | | trans | -60.1 | 112.7 | 159.4 | 12.9 | 0 | 0 | 0 | 0 | 107.7 | | |
| 203 | V | 30.3 | Very low | 28 | Very low | 113 Ų | 113 | 125 Ų | 125 | 69% | 0.685 | 80% | 0.803 | S | S | * | * | | | trans | -113.5 | 94.2 | 170.1 | -165.2 | 0 | 0 | 0 | 0 | 106.9 | R201 S205 | R201-V203 HydrophobicContact CB-CG2 4.4Å; R201-V203 PolarHBondContact O-N 2.95Å; V203-S205 PolarHBondContact O-N 3.19Å |
| 204 | S | 24.5 | Very low | 28.5 | Very low | 112 Ų | 112 | 125.9 Ų | 125.9 | 78% | 0.783 | 80% | 0.8 | S | S | * | * | | | trans | -63.2 | 116.1 | 167.3 | -55.6 | 0 | 0 | 0 | 0 | 108.1 | | |
| 205 | S | 29.9 | Very low | 28.7 | Very low | 104 Ų | 104 | 126.1 Ų | 126.1 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | | | trans | -117.9 | 101.4 | 173.6 | -49.4 | 0 | 0 | 0 | 0 | 107.6 | V203 S207 | V203-S205 PolarHBondContact O-N 3.19Å; S205-S207 PolarHBondContact O-N 2.88Å |
| 206 | S | 28.2 | Very low | 28.9 | Very low | 120 Ų | 120 | 122.1 Ų | 122.1 | 84% | 0.839 | 81% | 0.809 | S | S | * | * | | | trans | -58.7 | 122.2 | 177.9 | -37.4 | 0 | 0 | 0 | 0 | 110.3 | S208 | S206-S208 PolarHBondContact O-N 3.3Š|
| 207 | S | 30.6 | Very low | 29 | Very low | 116 Ų | 116 | 122.4 Ų | 122.4 | 81% | 0.811 | 81% | 0.811 | S | S | * | * | | | trans | -70.2 | 109.7 | 174.6 | 52.5 | 0 | 0 | 0 | 0 | 110.2 | S205 S209 | S205-S207 PolarHBondContact O-N 2.88Å; S207-S209 PolarHBondContact O-N 2.94Å |
| 208 | S | 29 | Very low | 29.4 | Very low | 113 Ų | 113 | 125 Ų | 125 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | | | trans | -72.4 | 118.4 | 166.2 | 51.6 | 0 | 0 | 0 | 0 | 109.7 | S206 | S206-S208 PolarHBondContact O-N 3.3Š|
| 209 | S | 27.2 | Very low | 29.6 | Very low | 108 Ų | 108 | 130 Ų | 130 | 76% | 0.755 | 81% | 0.812 | S | S | * | * | | | trans | -51.5 | 125.6 | 174.4 | -52.1 | 0 | 0 | 0 | 0 | 111.9 | S207 T211 | S207-S209 PolarHBondContact O-N 2.94Å; S209-T211 PolarHBondContact O-N 3.18Å |
| 210 | P | 33.7 | Very low | 29.7 | Very low | 127 Ų | 127 | 125 Ų | 125 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | | | trans | -76.3 | 114.5 | 171.7 | 28.1 | -29.8 | 0 | 0 | 0 | 109.9 | A212 | P210-A212 PolarHBondContact O-N 3.22Š|
| 211 | T | 30.8 | Very low | 29.7 | Very low | 139 Ų | 139 | 121.7 Ų | 121.7 | 85% | 0.853 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 116 | 170.7 | -39.9 | 0 | 0 | 0 | 0 | 109.6 | S209 A213 | S209-T211 PolarHBondContact O-N 3.18Å; T211-A213 PolarHBondContact O-N 3.22Å |
| 212 | A | 29.7 | Very low | 29.8 | Very low | 101 Ų | 101 | 122.1 Ų | 122.1 | 84% | 0.835 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 119.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | P210 | P210-A212 PolarHBondContact O-N 3.22Š|
| 213 | A | 29.7 | Very low | 30 | Very low | 90 Ų | 90 | 122.2 Ų | 122.2 | 74% | 0.744 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -103.5 | 147.7 | 167.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | T211 | T211-A213 PolarHBondContact O-N 3.22Š|
| 214 | P | 38.5 | Very low | 29.9 | Very low | 128 Ų | 128 | 123.9 Ų | 123.9 | 83% | 0.831 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 150.7 | -146.2 | 32.1 | -34.8 | 0 | 0 | 0 | 114.4 | A216 | P214-A216 PolarHBondContact O-N 3.3Š|
| 215 | A | 31.4 | Very low | 30 | Very low | 103 Ų | 103 | 124 Ų | 124 | 85% | 0.851 | 81% | 0.809 | S | S | * | * | | | trans | -57.2 | 114.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | A217 | A215-A217 PolarHBondContact O-N 3.1Š|
| 216 | A | 31.2 | Very low | 30.1 | Very low | 89 Ų | 89 | 123.3 Ų | 123.3 | 74% | 0.736 | 81% | 0.809 | S | S | * | * | | | trans | -71.4 | 110.9 | 164.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | P214 V218 | P214-A216 PolarHBondContact O-N 3.3Å; A216-V218 PolarHBondContact O-N 3.45Å |
| 217 | A | 28.7 | Very low | 29.9 | Very low | 101 Ų | 101 | 124 Ų | 124 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | | | trans | -56.8 | 114.5 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | A215 | A215-A217 PolarHBondContact O-N 3.1Š|
| 218 | V | 31.5 | Very low | 29.7 | Very low | 138 Ų | 138 | 124 Ų | 124 | 84% | 0.836 | 81% | 0.807 | S | S | * | * | | | trans | -106 | 121.3 | 168.2 | 176.6 | 0 | 0 | 0 | 0 | 107.6 | A216 | A216-V218 PolarHBondContact O-N 3.45Š|
| 219 | Q | 29.5 | Very low | 29.5 | Very low | 181 Ų | 181 | 123.4 Ų | 123.4 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | | | trans | -59.5 | 136 | -171.1 | -69.6 | -166 | -25.2 | 0 | 0 | 113.4 | | |
| 220 | P | 30.4 | Very low | 29.5 | Very low | 133 Ų | 133 | 123.7 Ų | 123.7 | 86% | 0.864 | 81% | 0.81 | S | S | * | * | | | trans | -81.8 | 128.2 | 168.9 | 30.7 | -28 | 0 | 0 | 0 | 110.1 | | |
| 221 | G | 26.4 | Very low | 29.1 | Very low | 69 Ų | 69 | 121 Ų | 121 | 71% | 0.711 | 81% | 0.806 | S | S | * | * | | | trans | 150.2 | 69.8 | 167.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | | |
| 222 | R | 29.2 | Very low | 28.9 | Very low | 237 Ų | 237 | 122.1 Ų | 122.1 | 89% | 0.894 | 81% | 0.807 | S | S | * | * | | | trans | -148.3 | 86.1 | 149.1 | -80.3 | -157.4 | 165.8 | 166 | -5.2 | 109.7 | L224 | R222-L224 PolarHBondContact O-N 3.27Š|
| 223 | T | 29.9 | Very low | 28.8 | Very low | 144 Ų | 144 | 128.6 Ų | 128.6 | 88% | 0.883 | 81% | 0.809 | S | S | * | * | | | trans | -68.8 | 99.4 | 165.5 | -29.3 | 0 | 0 | 0 | 0 | 107.5 | | |
| 224 | L | 28.9 | Very low | 29 | Very low | 149 Ų | 149 | 129.8 Ų | 129.8 | 78% | 0.78 | 81% | 0.81 | S | S | * | * | | | trans | -86 | 131.7 | 165.5 | -74.6 | 171.1 | 0 | 0 | 0 | 108.1 | R222 A226 | R222-L224 PolarHBondContact O-N 3.27Å; L224-A226 PolarHBondContact O-N 2.96Å; L224-A226 VanDerWaalsContact O-N 3.1Å |
| 225 | P | 26.7 | Very low | 28.6 | Very low | 113 Ų | 113 | 131.6 Ų | 131.6 | 73% | 0.734 | 81% | 0.811 | S | S | * | * | | | trans | -69 | 110.7 | -176.3 | 27.4 | -32.2 | 0 | 0 | 0 | 109.4 | T227 | P225-T227 PolarHBondContact O-N 2.94Š|
| 226 | A | 30.4 | Very low | 28.6 | Very low | 90 Ų | 90 | 134.8 Ų | 134.8 | 74% | 0.744 | 81% | 0.813 | S | S | * | * | | | trans | -67.9 | 101.7 | 162.5 | 0 | 0 | 0 | 0 | 0 | 107 | L224 C228 | L224-A226 PolarHBondContact O-N 2.96Å; L224-A226 VanDerWaalsContact O-N 3.1Å; A226-C228 PolarHBondContact O-N 3.18Å |
| 227 | T | 25.6 | Very low | 28.5 | Very low | 134 Ų | 134 | 137.4 Ų | 137.4 | 82% | 0.822 | 82% | 0.815 | S | S | * | * | | | trans | -59 | 100.1 | 169.7 | 19.4 | 0 | 0 | 0 | 0 | 108.7 | P225 A229 | P225-T227 PolarHBondContact O-N 2.94Å; T227-A229 VanDerWaalsContact C-N 3.33Å; T227-A229 PolarHBondContact O-N 2.95Å |
| 228 | C | 24.8 | Very low | 28.4 | Very low | 116 Ų | 116 | 137.8 Ų | 137.8 | 78% | 0.784 | 81% | 0.811 | S | S | * | * | | | trans | -64.6 | 90.3 | 171 | -71.3 | 0 | 0 | 0 | 0 | 109.7 | A226 C230 | A226-C228 PolarHBondContact O-N 3.18Å; C228-C230 PolarHBondContact O-N 3.45Å |
| 229 | A | 25.4 | Very low | 28.2 | Very low | 101 Ų | 101 | 136.5 Ų | 136.5 | 84% | 0.835 | 81% | 0.806 | S | S | * | * | | | trans | -79.2 | 60.8 | 160.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | T227 G231 | T227-A229 VanDerWaalsContact C-N 3.33Å; T227-A229 PolarHBondContact O-N 2.95Å; A229-G231 PolarHBondContact O-N 3.4Å |
| 230 | C | 26.3 | Very low | 28.1 | Very low | 114 Ų | 114 | 133.3 Ų | 133.3 | 77% | 0.77 | 80% | 0.799 | S | S | * | * | | | trans | -96.1 | 80.6 | 170.2 | -72 | 0 | 0 | 0 | 0 | 108.1 | C228 N232 | C228-C230 PolarHBondContact O-N 3.45Å; C230-N232 PolarHBondContact O-N 2.84Å |
| 231 | G | 25.4 | Very low | 28 | Very low | 72 Ų | 72 | 132.8 Ų | 132.8 | 74% | 0.742 | 80% | 0.796 | S | S | * | * | | | trans | -60.6 | 120.8 | 164.8 | 0 | 0 | 0 | 0 | 0 | 110 | A229 R233 | A229-G231 PolarHBondContact O-N 3.4Å; G231-R233 PolarHBondContact O-N 3.26Å |
| 232 | N | 27.4 | Very low | 28 | Very low | 161 Ų | 161 | 136.3 Ų | 136.3 | 86% | 0.861 | 80% | 0.804 | S | S | * | * | | | trans | -13.1 | 108.8 | 164.7 | -67.4 | -27.3 | 0 | 0 | 0 | 115.6 | C230 | C230-N232 PolarHBondContact O-N 2.84Š|
| 233 | R | 28 | Very low | 28 | Very low | 237 Ų | 237 | 129 Ų | 129 | 89% | 0.894 | 79% | 0.794 | S | S | * | * | | | trans | -134.6 | 121 | 146.7 | -82 | -168.5 | 165.7 | -179 | -5.2 | 109.1 | G231 | G231-R233 PolarHBondContact O-N 3.26Š|
| 234 | P | 33.9 | Very low | 27.9 | Very low | 116 Ų | 116 | 133.5 Ų | 133.5 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | | | trans | -77.2 | 138.3 | -164.6 | 31.5 | -33.9 | 0 | 0 | 0 | 111.4 | L236 | P234-L236 PolarHBondContact O-N 2.9Š|
| 235 | L | 30.6 | Very low | 27.9 | Very low | 165 Ų | 165 | 132.5 Ų | 132.5 | 86% | 0.864 | 80% | 0.797 | S | S | * | * | | | trans | 38.8 | 82.8 | 139.9 | -58.4 | 171.9 | 0 | 0 | 0 | 114.4 | N237 | L235-N237 PolarHBondContact O-N 2.96Š|
| 236 | L | 31.3 | Very low | 28.2 | Very low | 170 Ų | 170 | 132.7 Ų | 132.7 | 89% | 0.89 | 80% | 0.796 | S | S | * | * | | | trans | -58.6 | 102 | 150.3 | -89.3 | 159.1 | 0 | 0 | 0 | 106.9 | P234 C238 | P234-L236 PolarHBondContact O-N 2.9Å; L236-C238 PolarHBondContact O-N 3.13Å |
| 237 | N | 28.7 | Very low | 28.1 | Very low | 144 Ų | 144 | 133.2 Ų | 133.2 | 77% | 0.77 | 80% | 0.801 | S | S | * | * | | | trans | -44.9 | 100.4 | 172 | -145.8 | -0.9 | 0 | 0 | 0 | 108.3 | L235 C239 | L235-N237 PolarHBondContact O-N 2.96Å; N237-C239 VanDerWaalsContact C-N 3.28Å; N237-C239 PolarHBondContact O-N 3.4Å |
| 238 | C | 25.7 | Very low | 28.2 | Very low | 110 Ų | 110 | 135.6 Ų | 135.6 | 74% | 0.743 | 80% | 0.8 | S | S | * | * | | | trans | -70.5 | 93.4 | 170.9 | -73.7 | 0 | 0 | 0 | 0 | 106.1 | L236 T240 | L236-C238 PolarHBondContact O-N 3.13Å; C238-T240 PolarHBondContact O-N 3.46Å |
| 239 | C | 27.8 | Very low | 28.4 | Very low | 111 Ų | 111 | 136.3 Ų | 136.3 | 75% | 0.75 | 81% | 0.806 | S | S | * | * | | | trans | -63 | 91 | 160.6 | -67.8 | 0 | 0 | 0 | 0 | 106.8 | N237 P241 | N237-C239 VanDerWaalsContact C-N 3.28Å; N237-C239 PolarHBondContact O-N 3.4Å; C239-P241 WeakPolarHBondContact O-CD 3.34Å |
| 240 | T | 27.2 | Very low | 28.7 | Very low | 114 Ų | 114 | 133.7 Ų | 133.7 | 70% | 0.699 | 79% | 0.789 | S | S | * | * | | | trans | -57.6 | 113.3 | 161.4 | 30 | 0 | 0 | 0 | 0 | 107.8 | C238 T242 | C238-T240 PolarHBondContact O-N 3.46Å; T240-T242 VanDerWaalsContact C-N 3.34Å; T240-T242 PolarHBondContact O-N 2.78Å |
| 241 | P | 28.6 | Very low | 28.9 | Very low | 121 Ų | 121 | 134.2 Ų | 134.2 | 79% | 0.786 | 79% | 0.793 | S | S | * | * | | | trans | -74 | 92.6 | 174.2 | 29.4 | -29.6 | 0 | 0 | 0 | 108.4 | C239 A243 | C239-P241 WeakPolarHBondContact O-CD 3.34Å; P241-A243 PolarHBondContact O-N 3.42Å |
| 242 | T | 27 | Very low | 29.2 | Very low | 144 Ų | 144 | 138.7 Ų | 138.7 | 88% | 0.883 | 80% | 0.795 | S | S | * | * | | | trans | -71.1 | 81.1 | 160.7 | 24.5 | 0 | 0 | 0 | 0 | 108.7 | T240 | T240-T242 VanDerWaalsContact C-N 3.34Å; T240-T242 PolarHBondContact O-N 2.78Å |
| 243 | A | 28.4 | Very low | 29.3 | Very low | 84 Ų | 84 | 142.6 Ų | 142.6 | 69% | 0.694 | 80% | 0.798 | S | S | * | * | | | trans | -127.9 | 95.5 | 162.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | P241 | P241-A243 PolarHBondContact O-N 3.42Š|
| 244 | R | 27.1 | Very low | 29.5 | Very low | 238 Ų | 238 | 135.6 Ų | 135.6 | 90% | 0.898 | 79% | 0.79 | S | S | * | * | | | trans | -53.9 | 126.1 | 168.9 | -83.1 | 177.3 | 166.3 | 175.7 | -4.6 | 108.2 | V246 | R244-V246 PolarHBondContact O-N 3.14Š|
| 245 | P | 30 | Very low | 29.2 | Very low | 127 Ų | 127 | 135.5 Ų | 135.5 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | | | trans | -69.8 | 103.9 | 177.7 | 27.2 | -31 | 0 | 0 | 0 | 108.6 | A247 | P245-A247 PolarHBondContact O-N 2.94Š|
| 246 | V | 31.8 | Very low | 29.2 | Very low | 117 Ų | 117 | 135 Ų | 135 | 71% | 0.709 | 79% | 0.785 | S | S | * | * | | | trans | -77.6 | 99.9 | 162.3 | 177.4 | 0 | 0 | 0 | 0 | 105.9 | R244 K248 | R244-V246 PolarHBondContact O-N 3.14Å; V246-K248 VanDerWaalsContact C-N 3.35Å; V246-K248 HydrophobicContact CG1-CD 4.45Å; V246-K248 HydrophobicContact CG1-CG 4.2Å; V246-K248 PolarHBondContact O-N 3.49Å |
| 247 | A | 28.4 | Very low | 29 | Very low | 102 Ų | 102 | 132.8 Ų | 132.8 | 84% | 0.843 | 78% | 0.778 | S | S | * | * | | | trans | -61.8 | 97.2 | 169.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | P245 | P245-A247 PolarHBondContact O-N 2.94Š|
| 248 | K | 28.1 | Very low | 28.9 | Very low | 183 Ų | 183 | 131 Ų | 131 | 80% | 0.796 | 78% | 0.776 | S | S | * | * | | | trans | -122.1 | 107.7 | 158.3 | -80.3 | -175.8 | 178 | -178.6 | 0 | 107.3 | V246 G250 | V246-K248 VanDerWaalsContact C-N 3.35Å; V246-K248 HydrophobicContact CG1-CD 4.45Å; V246-K248 HydrophobicContact CG1-CG 4.2Å; V246-K248 PolarHBondContact O-N 3.49Å; K248-G250 PolarHBondContact O-N 3.19Å |
| 249 | S | 30.5 | Very low | 29.3 | Very low | 132 Ų | 132 | 131.3 Ų | 131.3 | 92% | 0.923 | 78% | 0.777 | S | S | * | * | | | trans | -57.1 | 103.6 | 169.8 | 58.2 | 0 | 0 | 0 | 0 | 108.6 | | |
| 250 | G | 30.6 | Very low | 29.6 | Very low | 45 Ų | 45 | 134.3 Ų | 134.3 | 46% | 0.464 | 78% | 0.784 | S | S | . | * | | | trans | -168 | 110.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 106.8 | K248 H252 | K248-G250 PolarHBondContact O-N 3.19Å; G250-H252 PolarHBondContact O-N 3.25Å |
| 251 | S | 30.4 | Very low | 29.8 | Very low | 125 Ų | 125 | 134.3 Ų | 134.3 | 87% | 0.874 | 79% | 0.789 | S | S | * | * | | | trans | -52.3 | 83.6 | 174.7 | 156.4 | 0 | 0 | 0 | 0 | 110.5 | | |
| 252 | H | 32 | Very low | 30 | Very low | 167 Ų | 167 | 133 Ų | 133 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | | | trans | -121.6 | 107.1 | 173.7 | -69.7 | -65.8 | 0 | 0 | 0 | 109.1 | G250 A254 | G250-H252 PolarHBondContact O-N 3.25Å; H252-A254 PolarHBondContact O-N 3.31Å |
| 253 | R | 29.4 | Very low | 30.3 | Very low | 243 Ų | 243 | 130.6 Ų | 130.6 | 92% | 0.917 | 78% | 0.783 | S | S | * | * | | | trans | -43.1 | 98.4 | 169 | -154.4 | 178.6 | -164.8 | -179.8 | 3.4 | 109.8 | T255 | R253-T255 PolarHBondContact O-N 2.87Š|
| 254 | A | 31.5 | Very low | 30.5 | Very low | 89 Ų | 89 | 132 Ų | 132 | 74% | 0.736 | 79% | 0.785 | S | S | * | * | | | trans | -81.5 | 96.2 | 176 | 0 | 0 | 0 | 0 | 0 | 109.4 | H252 L256 | H252-A254 PolarHBondContact O-N 3.31Å; A254-L256 PolarHBondContact O-N 3.16Å |
| 255 | T | 29 | Very low | 30.7 | Very low | 114 Ų | 114 | 125.5 Ų | 125.5 | 70% | 0.699 | 78% | 0.782 | S | S | * | * | | | trans | -77.5 | 99.6 | 169.5 | -48.8 | 0 | 0 | 0 | 0 | 108.2 | R253 T257 | R253-T255 PolarHBondContact O-N 2.87Å; T255-T257 PolarHBondContact O-N 2.89Å; T255-T257 VanDerWaalsContact O-N 3.13Å |
| 256 | L | 29 | Very low | 30.9 | Very low | 156 Ų | 156 | 125.1 Ų | 125.1 | 82% | 0.817 | 78% | 0.778 | S | S | * | * | | | trans | -77.6 | 91.3 | 173.4 | -78.5 | 162.5 | 0 | 0 | 0 | 109.7 | A254 C258 | A254-L256 PolarHBondContact O-N 3.16Å; L256-C258 PolarHBondContact O-N 3.09Å |
| 257 | T | 26.9 | Very low | 30.8 | Very low | 122 Ų | 122 | 124.6 Ų | 124.6 | 75% | 0.748 | 78% | 0.78 | S | S | * | * | | | trans | -85.1 | 101 | 164.1 | 18.6 | 0 | 0 | 0 | 0 | 109 | T255 P259 | T255-T257 PolarHBondContact O-N 2.89Å; T255-T257 VanDerWaalsContact O-N 3.13Å; T257-P259 WeakPolarHBondContact O-CD 3.2Å |
| 258 | C | 28.1 | Very low | 31 | Very low | 107 Ų | 107 | 125.5 Ų | 125.5 | 72% | 0.723 | 78% | 0.778 | S | S | * | * | | | trans | -81.5 | 111 | 167.3 | -64.4 | 0 | 0 | 0 | 0 | 108.9 | L256 L260 | L256-C258 PolarHBondContact O-N 3.09Å; C258-L260 PolarHBondContact O-N 2.95Å |
| 259 | P | 33.3 | Very low | 31.1 | Very low | 117 Ų | 117 | 125.7 Ų | 125.7 | 76% | 0.76 | 78% | 0.782 | S | S | * | * | | | trans | -67.9 | 114.7 | 166.1 | 27.7 | -31.1 | 0 | 0 | 0 | 108.1 | T257 S261 | T257-P259 WeakPolarHBondContact O-CD 3.2Å; P259-S261 PolarHBondContact O-N 3.37Å |
| 260 | L | 33.4 | Very low | 31.3 | Very low | 173 Ų | 173 | 131 Ų | 131 | 91% | 0.906 | 78% | 0.782 | S | S | * | * | | | trans | -60.5 | 99.6 | 169.9 | -91 | 129.9 | 0 | 0 | 0 | 108.7 | C258 A262 | C258-L260 PolarHBondContact O-N 2.95Å; L260-A262 PolarHBondContact O-N 3.18Å |
| 261 | S | 32.2 | Very low | 31.4 | Very low | 115 Ų | 115 | 132.3 Ų | 132.3 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | | | trans | -54.3 | 125.2 | 161.9 | -81.3 | 0 | 0 | 0 | 0 | 108.6 | P259 A263 | P259-S261 PolarHBondContact O-N 3.37Å; S261-A263 PolarHBondContact O-N 3.43Å |
| 262 | A | 32.9 | Very low | 31.6 | Very low | 94 Ų | 94 | 132 Ų | 132 | 78% | 0.777 | 79% | 0.792 | S | S | * | * | | | trans | -41.8 | 118 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L260 | L260-A262 PolarHBondContact O-N 3.18Š|
| 263 | A | 32.7 | Very low | 31.9 | Very low | 92 Ų | 92 | 132.2 Ų | 132.2 | 76% | 0.76 | 80% | 0.798 | S | S | * | * | | | trans | -58.7 | 130.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109 | S261 A265 | S261-A263 PolarHBondContact O-N 3.43Å; A263-A265 PolarHBondContact O-N 3.24Å |
| 264 | P | 32.6 | Very low | 31.9 | Very low | 114 Ų | 114 | 124.6 Ų | 124.6 | 74% | 0.74 | 79% | 0.788 | S | S | * | * | | | trans | -62.4 | 123.5 | -178.8 | 23.5 | -31.4 | 0 | 0 | 0 | 109.4 | T266 | P264-T266 VanDerWaalsContact C-N 3.35Å; P264-T266 PolarHBondContact O-N 3.21Å |
| 265 | A | 32.9 | Very low | 32.2 | Very low | 101 Ų | 101 | 135.7 Ų | 135.7 | 84% | 0.835 | 81% | 0.81 | S | S | * | * | | | trans | -62.9 | 95.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | A263 S267 | A263-A265 PolarHBondContact O-N 3.24Å; A265-S267 PolarHBondContact O-N 3.21Å |
| 266 | T | 33.1 | Very low | 32.3 | Very low | 120 Ų | 120 | 136.8 Ų | 136.8 | 74% | 0.736 | 82% | 0.816 | S | S | * | * | | | trans | -71.7 | 96.3 | 170.9 | 53 | 0 | 0 | 0 | 0 | 108.1 | P264 C268 | P264-T266 VanDerWaalsContact C-N 3.35Å; P264-T266 PolarHBondContact O-N 3.21Å; T266-C268 PolarHBondContact O-N 2.92Å |
| 267 | S | 30.8 | Very low | 32.5 | Very low | 106 Ų | 106 | 135.7 Ų | 135.7 | 74% | 0.741 | 82% | 0.816 | S | S | * | * | | | trans | -73.4 | 112.2 | 167.8 | 60.2 | 0 | 0 | 0 | 0 | 108.4 | A265 H269 | A265-S267 PolarHBondContact O-N 3.21Å; S267-H269 PolarHBondContact O-N 3.13Å |
| 268 | C | 32.4 | Very low | 32.8 | Very low | 121 Ų | 121 | 136.5 Ų | 136.5 | 82% | 0.818 | 82% | 0.82 | S | S | * | * | | | trans | -75.5 | 105.5 | 176.9 | -63.1 | 0 | 0 | 0 | 0 | 109 | T266 R270 | T266-C268 PolarHBondContact O-N 2.92Å; C268-R270 PolarHBondContact O-N 2.98Å |
| 269 | H | 29.9 | Very low | 33.1 | Very low | 186 Ų | 186 | 138.2 Ų | 138.2 | 86% | 0.861 | 83% | 0.825 | S | S | * | * | | | trans | -61 | 129.1 | 170 | -110 | -85.1 | 0 | 0 | 0 | 110.4 | S267 G271 | S267-H269 PolarHBondContact O-N 3.13Å; H269-G271 PolarHBondContact O-N 3.01Å |
| 270 | R | 33.5 | Very low | 33.1 | Very low | 245 Ų | 245 | 139.6 Ų | 139.6 | 93% | 0.925 | 83% | 0.829 | S | S | * | * | | | trans | -70.5 | 95.4 | 177.2 | -146.7 | 178.6 | -164.3 | 170.5 | 2.2 | 108.2 | C268 S272 | C268-R270 PolarHBondContact O-N 2.98Å; R270-S272 PolarHBondContact O-N 2.99Å; R270-S272 VanDerWaalsContact O-N 3.14Å |
| 271 | G | 33.5 | Very low | 33 | Very low | 72 Ų | 72 | 137.3 Ų | 137.3 | 74% | 0.742 | 82% | 0.824 | S | S | * | * | | | trans | -66.3 | 107.3 | 170.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | H269 L273 | H269-G271 PolarHBondContact O-N 3.01Å; G271-L273 PolarHBondContact O-N 2.72Å |
| 272 | S | 33.8 | Very low | 33.1 | Very low | 117 Ų | 117 | 138.9 Ų | 138.9 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | | | trans | -69.3 | 112.2 | 167.2 | -179.1 | 0 | 0 | 0 | 0 | 108.1 | R270 A274 | R270-S272 PolarHBondContact O-N 2.99Å; R270-S272 VanDerWaalsContact O-N 3.14Å; S272-A274 PolarHBondContact O-N 3.21Å |
| 273 | L | 38.8 | Very low | 33.1 | Very low | 172 Ų | 172 | 142.4 Ų | 142.4 | 90% | 0.901 | 83% | 0.829 | S | S | * | * | | | trans | -85.3 | 109.5 | 168.2 | -81.6 | 166.1 | 0 | 0 | 0 | 107.6 | G271 | G271-L273 PolarHBondContact O-N 2.72Š|
| 274 | A | 30 | Very low | 33.1 | Very low | 84 Ų | 84 | 146.6 Ų | 146.6 | 69% | 0.694 | 84% | 0.835 | S | S | * | * | | | trans | -74.4 | 145.7 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | S272 | S272-A274 PolarHBondContact O-N 3.21Š|
| 275 | R | 36.6 | Very low | 33.2 | Very low | 321 Ų | 321 | 149.5 Ų | 149.5 | 100% | 1.211 | 84% | 0.844 | S | S | * | * | | | trans | 86 | 0 | 174.1 | -56.1 | -172.9 | -173.9 | -154 | 1.5 | 116.1 | | |