| 1 | M | 48.3 | Very low | 57.9 | Low | 249 Ų | 249 | 186.4 Ų | 186.4 | 100% | 1.227 | 88% | 0.877 | S | S | * | * | | | | 0 | 112.1 | 0 | -73.7 | 168.3 | 176 | 0 | 0 | 106 | | |
| 2 | R | 50.1 | Low | 58.4 | Low | 245 Ų | 245 | 182.9 Ų | 182.9 | 93% | 0.925 | 87% | 0.869 | S | S | * | * | P | Polyproline II helix | trans | -93.9 | 119.7 | -169.1 | -169.1 | -179.7 | -75 | 156.7 | -5.5 | 106.9 | | |
| 3 | E | 67.3 | Low | 58.9 | Low | 180 Ų | 180 | 179.8 Ų | 179.8 | 84% | 0.841 | 86% | 0.861 | S | S | * | * | P | Polyproline II helix | trans | -64 | 135.9 | 176.7 | -63 | -172 | 130.8 | 0 | 0 | 109.5 | E5 | E3-E5 PolarHBondContact O-N 3.37Š|
| 4 | P | 58.6 | Low | 59.2 | Low | 119 Ų | 119 | 175.9 Ų | 175.9 | 77% | 0.773 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 123 | 173.7 | 28.8 | -30.4 | 0 | 0 | 0 | 110 | R6 | P4-R6 PolarHBondContact O-N 2.9Š|
| 5 | E | 60.3 | Low | 59.8 | Low | 190 Ų | 190 | 170.9 Ų | 170.9 | 89% | 0.888 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 117.8 | 172.7 | -65.2 | -175.5 | 124.6 | 0 | 0 | 109.5 | E3 E7 | E3-E5 PolarHBondContact O-N 3.37Å; E5-E7 PolarHBondContact O-N 2.99Å |
| 6 | R | 60.7 | Low | 60.4 | Low | 240 Ų | 240 | 167.6 Ų | 167.6 | 91% | 0.906 | 83% | 0.826 | S | S | * | * | | | trans | -75.3 | 105.9 | 169.4 | -72.9 | -161.6 | -90.4 | -171.5 | -5.6 | 107.4 | P4 E8 | P4-R6 PolarHBondContact O-N 2.9Å; R6-E8 PolarHBondContact O-N 3.23Å |
| 7 | E | 58.1 | Low | 60.9 | Low | 173 Ų | 173 | 167.9 Ų | 167.9 | 81% | 0.808 | 82% | 0.822 | S | S | * | * | | | trans | -54.5 | 103.9 | 166.9 | -67.9 | 179.2 | 161.5 | 0 | 0 | 109.1 | E5 Q9 | E5-E7 PolarHBondContact O-N 2.99Å; E7-Q9 PolarHBondContact O-N 3.49Å |
| 8 | E | 57.3 | Low | 60.9 | Low | 190 Ų | 190 | 169.4 Ų | 169.4 | 89% | 0.888 | 82% | 0.824 | S | S | * | * | | | trans | -64.6 | 101.4 | 164.6 | -82.9 | -173.8 | 111.7 | 0 | 0 | 108.1 | R6 P10 | R6-E8 PolarHBondContact O-N 3.23Å; E8-P10 WeakPolarHBondContact O-CD 3.41Å |
| 9 | Q | 57.7 | Low | 60.7 | Low | 165 Ų | 165 | 170.2 Ų | 170.2 | 77% | 0.771 | 82% | 0.822 | S | S | * | * | | | trans | -73.9 | 119.2 | 161.1 | -70.4 | 179 | 43.4 | 0 | 0 | 107.4 | E7 E11 | E7-Q9 PolarHBondContact O-N 3.49Å; Q9-E11 PolarHBondContact O-N 3.26Å |
| 10 | P | 58.6 | Low | 60.7 | Low | 123 Ų | 123 | 172.4 Ų | 172.4 | 80% | 0.799 | 82% | 0.822 | S | S | * | * | | | trans | -69.8 | 108.8 | 172.6 | 27.9 | -29.8 | 0 | 0 | 0 | 107.5 | E8 D12 | E8-P10 WeakPolarHBondContact O-CD 3.41Å; P10-D12 PolarHBondContact O-N 3.38Å |
| 11 | E | 59.8 | Low | 60.5 | Low | 176 Ų | 176 | 172.1 Ų | 172.1 | 82% | 0.822 | 82% | 0.82 | S | S | * | * | | | trans | -59.7 | 102.6 | 168.3 | -77.8 | -156.8 | 137.2 | 0 | 0 | 108.5 | Q9 N13 | Q9-E11 PolarHBondContact O-N 3.26Å; E11-N13 PolarHBondContact O-N 3.47Å |
| 12 | D | 63.6 | Low | 61 | Low | 145 Ų | 145 | 166.4 Ų | 166.4 | 78% | 0.775 | 79% | 0.793 | S | S | * | * | | | trans | -65.5 | 74.2 | 169 | -175.4 | 16.1 | 0 | 0 | 0 | 109.2 | P10 M14 | P10-D12 PolarHBondContact O-N 3.38Å; D12-M14 VanDerWaalsContact C-N 3.25Å; D12-M14 PolarHBondContact O-N 3.02Å |
| 13 | N | 65.4 | Low | 61.7 | Low | 143 Ų | 143 | 160 Ų | 160 | 77% | 0.765 | 78% | 0.777 | S | S | * | * | | | trans | -90.3 | 64 | 179 | -147.6 | 3.7 | 0 | 0 | 0 | 109.3 | E11 | E11-N13 PolarHBondContact O-N 3.47Š|
| 14 | M | 63.2 | Low | 61.5 | Low | 124 Ų | 124 | 158 Ų | 158 | 61% | 0.611 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -88.8 | 128.2 | 168.3 | -166.9 | 177 | -64.4 | 0 | 0 | 109.5 | D12 | D12-M14 VanDerWaalsContact C-N 3.25Å; D12-M14 PolarHBondContact O-N 3.02Å |
| 15 | P | 68.2 | Low | 61.5 | Low | 102 Ų | 102 | 158.9 Ų | 158.9 | 66% | 0.662 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 150.5 | 175.5 | 25.1 | -32.9 | 0 | 0 | 0 | 111 | K17 | P15-K17 PolarHBondContact O-N 3.36Š|
| 16 | P | 69.8 | Low | 61.4 | Low | 117 Ų | 117 | 157.9 Ų | 157.9 | 76% | 0.76 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 130.2 | -174.6 | 22.5 | -32.8 | 0 | 0 | 0 | 111.4 | F18 | P16-F18 PolarHBondContact O-N 3.27Š|
| 17 | K | 67.8 | Low | 61.3 | Low | 174 Ų | 174 | 151.4 Ų | 151.4 | 76% | 0.757 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 123.6 | 176.9 | -64.7 | -173.8 | -179.4 | -175.4 | 0 | 109.8 | P15 K19 | P15-K17 PolarHBondContact O-N 3.36Å; K17-K19 PolarHBondContact O-N 3.13Å |
| 18 | F | 62.2 | Low | 61.4 | Low | 195 Ų | 195 | 148.8 Ų | 148.8 | 86% | 0.855 | 75% | 0.749 | S | S | * | * | | | trans | -60.9 | 107.8 | 171.1 | -75.8 | -90.9 | 0 | 0 | 0 | 109.8 | P16 R20 | P16-F18 PolarHBondContact O-N 3.27Å; F18-R20 PolarHBondContact O-N 3.42Å |
| 19 | K | 56.1 | Low | 61.4 | Low | 183 Ų | 183 | 143.3 Ų | 143.3 | 80% | 0.796 | 74% | 0.743 | S | S | * | * | | | trans | -82.2 | 92.7 | 168.5 | -66.3 | -174.7 | -178.6 | -178.3 | 0 | 107.9 | K17 H21 | K17-K19 PolarHBondContact O-N 3.13Å; K19-H21 PolarHBondContact O-N 3.22Å |
| 20 | R | 61.9 | Low | 61.4 | Low | 215 Ų | 215 | 140.3 Ų | 140.3 | 81% | 0.811 | 74% | 0.741 | S | S | * | * | | | trans | -75.6 | 114.6 | 166.8 | -74.9 | -176.4 | 176.6 | -178.5 | -1.2 | 107.6 | F18 L22 | F18-R20 PolarHBondContact O-N 3.42Å; R20-L22 HydrophobicContact CB-CD1 4.4Å; R20-L22 PolarHBondContact O-N 3.19Å; R20-L22 VanDerWaalsContact O-N 3.13Å |
| 21 | H | 55.4 | Low | 61.3 | Low | 167 Ų | 167 | 140.8 Ų | 140.8 | 77% | 0.773 | 74% | 0.741 | S | S | * | * | | | trans | -73.8 | 97.2 | 165.8 | -63.6 | -88 | 0 | 0 | 0 | 106.4 | K19 N23 | K19-H21 PolarHBondContact O-N 3.22Å; H21-N23 PolarHBondContact O-N 2.79Å |
| 22 | L | 59.2 | Low | 61.2 | Low | 128 Ų | 128 | 143.3 Ų | 143.3 | 67% | 0.67 | 74% | 0.743 | S | S | * | * | | | trans | -68.5 | 120.7 | 165.7 | -101.6 | 80.6 | 0 | 0 | 0 | 106.6 | R20 | R20-L22 HydrophobicContact CB-CD1 4.4Å; R20-L22 PolarHBondContact O-N 3.19Å; R20-L22 VanDerWaalsContact O-N 3.13Å |
| 23 | N | 63.9 | Low | 60.7 | Low | 111 Ų | 111 | 141.9 Ų | 141.9 | 59% | 0.594 | 74% | 0.744 | S | S | * | * | | | trans | -80.5 | 128.6 | 164.6 | -70.2 | -33.1 | 0 | 0 | 0 | 107.3 | H21 D25 E26 | H21-N23 PolarHBondContact O-N 2.79Å; N23-D25 PolarHBondContact O-N 3.06Å; N23-E26 PolarHBondContact O-N 3.06Å |
| 24 | D | 63.2 | Low | 60 | Low | 138 Ų | 138 | 142.6 Ų | 142.6 | 74% | 0.738 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -62.1 | -12.4 | -177.7 | -67.3 | -49.8 | 0 | 0 | 0 | 113.4 | E26 | D24-E26 VanDerWaalsContact C-N 3.27Å; D24-E26 PolarHBondContact O-N 2.92Å |
| 25 | D | 59.9 | Low | 59.8 | Low | 138 Ų | 138 | 148.5 Ų | 148.5 | 74% | 0.738 | 76% | 0.758 | S | S | * | * | G | 310 helix | trans | -72.1 | -17 | -180 | -50.2 | -41.9 | 0 | 0 | 0 | 113.4 | N23 | N23-D25 PolarHBondContact O-N 3.06Š|
| 26 | E | 56.7 | Low | 59.2 | Low | 169 Ų | 169 | 154 Ų | 154 | 79% | 0.79 | 77% | 0.766 | S | S | * | * | G | 310 helix | trans | -84.9 | -14.2 | -176.9 | -144.1 | 174.6 | 177.7 | 0 | 0 | 113.2 | N23 D24 T28 | N23-E26 PolarHBondContact O-N 3.06Å; D24-E26 VanDerWaalsContact C-N 3.27Å; D24-E26 PolarHBondContact O-N 2.92Å; E26-T28 PolarHBondContact O-N 3.22Å |
| 27 | V | 59.2 | Low | 58.3 | Low | 104 Ų | 104 | 156.8 Ų | 156.8 | 63% | 0.63 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | -10.7 | -172.6 | 178.3 | 0 | 0 | 0 | 0 | 113.3 | | |
| 28 | T | 59.4 | Low | 57.7 | Low | 117 Ų | 117 | 155.8 Ų | 155.8 | 72% | 0.718 | 78% | 0.777 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.3 | -3.6 | -173.7 | 66.1 | 0 | 0 | 0 | 0 | 115 | E26 S30 | E26-T28 PolarHBondContact O-N 3.22Å; T28-S30 PolarHBondContact O-N 3.03Å |
| 29 | G | 58.9 | Low | 57.2 | Low | 75 Ų | 75 | 153.7 Ų | 153.7 | 77% | 0.773 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.8 | -5.7 | -172.7 | 0 | 0 | 0 | 0 | 0 | 117 | | |
| 30 | S | 56.6 | Low | 56.8 | Low | 103 Ų | 103 | 154.2 Ų | 154.2 | 72% | 0.72 | 78% | 0.779 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.8 | 4.5 | -166 | 66.6 | 0 | 0 | 0 | 0 | 116.8 | T28 | T28-S30 PolarHBondContact O-N 3.03Š|
| 31 | V | 56.9 | Low | 56.3 | Low | 132 Ų | 132 | 152 Ų | 152 | 80% | 0.8 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -116.7 | 23.1 | -169.7 | -164.9 | 0 | 0 | 0 | 0 | 114.4 | | |
| 32 | R | 58.5 | Low | 55.8 | Low | 230 Ų | 230 | 151.2 Ų | 151.2 | 87% | 0.868 | 78% | 0.779 | S | S | * | * | | | trans | -129.9 | 0.1 | -179.7 | -158.5 | 160.7 | -175.6 | -173.7 | 1.5 | 119.1 | | |
| 33 | S | 51.3 | Low | 55.1 | Low | 115 Ų | 115 | 149.5 Ų | 149.5 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -106.3 | 78.9 | 168.9 | -82.2 | 0 | 0 | 0 | 0 | 111.9 | | |
| 34 | E | 52.7 | Low | 54.2 | Low | 158 Ų | 158 | 151 Ų | 151 | 74% | 0.738 | 79% | 0.786 | S | S | * | * | | | | 66.6 | 73 | 122.9 | -63.4 | 171 | 142.8 | 0 | 0 | 117.4 | R36 | E34-R36 PolarHBondContact O-N 3.42Š|
| 35 | R | 57.5 | Low | 53.7 | Low | 247 Ų | 247 | 153.7 Ų | 153.7 | 93% | 0.932 | 79% | 0.794 | S | S | * | * | | | trans | -53 | 82.8 | 141.2 | -70.8 | -178.9 | 157 | -152.6 | -5.7 | 110.8 | | |
| 36 | R | 55.3 | Low | 53.2 | Low | 219 Ų | 219 | 156.4 Ų | 156.4 | 83% | 0.826 | 80% | 0.802 | S | S | * | * | | | trans | -146.6 | 2.5 | 173 | -80.3 | -160.6 | 150.7 | 178.7 | -9.2 | 117.3 | E34 | E34-R36 PolarHBondContact O-N 3.42Š|
| 37 | N | 51.7 | Low | 52.8 | Low | 174 Ų | 174 | 156.8 Ų | 156.8 | 93% | 0.93 | 80% | 0.804 | S | S | * | * | S | Bend | trans | -111.9 | 37.3 | 172.9 | -104 | 25.1 | 0 | 0 | 0 | 112.8 | | |
| 38 | L | 55.3 | Low | 52.5 | Low | 153 Ų | 153 | 156.3 Ų | 156.3 | 80% | 0.801 | 80% | 0.798 | S | S | * | * | | | trans | -121.6 | 77.1 | -175.9 | -145.4 | 160 | 0 | 0 | 0 | 108.3 | | |
| 39 | L | 51.1 | Low | 52.1 | Low | 152 Ų | 152 | 159.3 Ų | 159.3 | 80% | 0.796 | 80% | 0.801 | S | S | * | * | | | trans | 151.4 | 89.7 | 157.1 | -79.8 | 168.4 | 0 | 0 | 0 | 108.8 | | |
| 40 | E | 47.3 | Very low | 51.8 | Low | 194 Ų | 194 | 165 Ų | 165 | 91% | 0.907 | 81% | 0.805 | S | S | * | * | | | trans | -123 | 99.8 | 148.4 | -154.5 | 162.6 | 178 | 0 | 0 | 104.6 | D42 | E40-D42 PolarHBondContact O-N 3.06Š|
| 41 | E | 51.7 | Low | 51.8 | Low | 168 Ų | 168 | 167 Ų | 167 | 79% | 0.785 | 81% | 0.807 | S | S | * | * | | | trans | -61.2 | 114.9 | 160.7 | -79.9 | 162.5 | 119.1 | 0 | 0 | 106.8 | | |
| 42 | D | 45 | Very low | 51.7 | Low | 151 Ų | 151 | 169 Ų | 169 | 81% | 0.807 | 80% | 0.8 | S | S | * | * | | | trans | -148.8 | 108.9 | 130.4 | -99.5 | -25.2 | 0 | 0 | 0 | 107.5 | E40 | E40-D42 PolarHBondContact O-N 3.06Š|
| 43 | S | 44.3 | Very low | 51.3 | Low | 92 Ų | 92 | 160.4 Ų | 160.4 | 64% | 0.643 | 78% | 0.784 | S | S | * | * | | | trans | -20.2 | 133.1 | 148.5 | 13.1 | 0 | 0 | 0 | 0 | 113.6 | | |
| 44 | D | 44.7 | Very low | 51.1 | Low | 142 Ų | 142 | 161.6 Ų | 161.6 | 76% | 0.759 | 79% | 0.789 | S | S | * | * | | | | 178 | 113.9 | 121.3 | -76.3 | -20.5 | 0 | 0 | 0 | 110.6 | E46 | D44-E46 PolarHBondContact O-N 3.28Š|
| 45 | E | 53.4 | Low | 51.1 | Low | 194 Ų | 194 | 158.3 Ų | 158.3 | 91% | 0.907 | 78% | 0.779 | S | S | * | * | | | trans | 40.5 | 59.1 | 144.8 | -56.3 | -171.9 | 164.1 | 0 | 0 | 121 | | |
| 46 | E | 50.6 | Low | 50.9 | Low | 195 Ų | 195 | 149 Ų | 149 | 91% | 0.911 | 76% | 0.761 | S | S | * | * | | | trans | -126.4 | 43.3 | 163.9 | -66 | -171.2 | 172.6 | 0 | 0 | 113.6 | D44 | D44-E46 PolarHBondContact O-N 3.28Š|
| 47 | E | 48.2 | Very low | 50.4 | Low | 178 Ų | 178 | 144.5 Ų | 144.5 | 83% | 0.832 | 76% | 0.76 | S | S | * | * | | | trans | -78.4 | 125.7 | 142.5 | -61 | -175.8 | 169.6 | 0 | 0 | 105.2 | | |
| 48 | D | 51.9 | Low | 49.9 | Very low | 94 Ų | 94 | 146.9 Ų | 146.9 | 50% | 0.503 | 76% | 0.755 | S | S | . | * | | | cis | -169.1 | 95.3 | 38.6 | -95.4 | -38.4 | 0 | 0 | 0 | 107.6 | F50 L51 | D48-F50 VanDerWaalsContact C-N 3.34Å; D48-L51 HydrophobicContact CB-CB 4.39Å |
| 49 | F | 51.1 | Low | 49.4 | Very low | 179 Ų | 179 | 149.2 Ų | 149.2 | 79% | 0.785 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -75.3 | -28 | 168.8 | -178.3 | -101.4 | 0 | 0 | 0 | 111.6 | | |
| 50 | F | 52.2 | Low | 48.8 | Very low | 195 Ų | 195 | 145.1 Ų | 145.1 | 86% | 0.855 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -84.6 | -19.4 | -170.3 | -79 | -88.2 | 0 | 0 | 0 | 115.2 | D48 | D48-F50 VanDerWaalsContact C-N 3.34Š|
| 51 | L | 56.9 | Low | 48.6 | Very low | 145 Ų | 145 | 141.1 Ų | 141.1 | 76% | 0.759 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -95.1 | -8.6 | 178.7 | -71.5 | 174.7 | 0 | 0 | 0 | 114 | D48 | D48-L51 HydrophobicContact CB-CB 4.39Š|
| 52 | R | 54.6 | Low | 47.8 | Very low | 173 Ų | 173 | 141.4 Ų | 141.4 | 65% | 0.653 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -115.7 | 87.6 | 177 | -169.1 | 160.8 | 173.9 | 163.8 | -6.3 | 109.9 | T55 | R52-T55 HydrophobicContact CG-CG2 3.98Å; R52-T55 VanDerWaalsContact NE-CG2 3.33Å |
| 53 | G | 49.8 | Very low | 47.6 | Very low | 51 Ų | 51 | 140.9 Ų | 140.9 | 53% | 0.526 | 74% | 0.744 | S | S | . | * | | | trans | -53.4 | 165.6 | 167.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | T55 | G53-T55 PolarHBondContact O-N 3.31Š|
| 54 | P | 48.3 | Very low | 47.6 | Very low | 140 Ų | 140 | 143.6 Ų | 143.6 | 91% | 0.909 | 75% | 0.751 | S | S | * | * | | | trans | -53.1 | 114.2 | -168 | -22 | 30.2 | 0 | 0 | 0 | 111.8 | G56 | P54-G56 PolarHBondContact O-N 3.38Š|
| 55 | T | 51.3 | Low | 47.4 | Very low | 88 Ų | 88 | 146.2 Ų | 146.2 | 54% | 0.54 | 76% | 0.756 | S | S | . | * | | | trans | -78.5 | 106 | 175.4 | 48.7 | 0 | 0 | 0 | 0 | 109.5 | R52 G53 | R52-T55 HydrophobicContact CG-CG2 3.98Å; R52-T55 VanDerWaalsContact NE-CG2 3.33Å; G53-T55 PolarHBondContact O-N 3.31Å |
| 56 | G | 53.7 | Low | 46.9 | Very low | 52 Ų | 52 | 146 Ų | 146 | 54% | 0.536 | 76% | 0.757 | S | S | . | * | | | trans | -60.4 | 163.1 | 162.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | P54 R58 | P54-G56 PolarHBondContact O-N 3.38Å; G56-R58 PolarHBondContact O-N 3.09Å; G56-R58 VanDerWaalsContact O-N 3.09Å |
| 57 | P | 44.7 | Very low | 46.6 | Very low | 124 Ų | 124 | 146.3 Ų | 146.3 | 81% | 0.805 | 76% | 0.755 | S | S | * | * | | | trans | -60.3 | 116.5 | -172.3 | -19.3 | 30.4 | 0 | 0 | 0 | 111.3 | F59 | P57-F59 PolarHBondContact O-N 3.4Š|
| 58 | R | 41.9 | Very low | 46.5 | Very low | 224 Ų | 224 | 146 Ų | 146 | 85% | 0.845 | 75% | 0.753 | S | S | * | * | | | trans | -81.5 | 109 | 172.6 | -74.8 | -161.9 | 159 | 176.6 | -3.2 | 109.6 | G56 G60 | G56-R58 PolarHBondContact O-N 3.09Å; G56-R58 VanDerWaalsContact O-N 3.09Å; R58-G60 PolarHBondContact O-N 3.22Å |
| 59 | F | 45.3 | Very low | 46.2 | Very low | 202 Ų | 202 | 146.1 Ų | 146.1 | 89% | 0.886 | 76% | 0.757 | S | S | * | * | | | trans | -73.2 | 110.5 | 161.2 | -75.4 | -88.6 | 0 | 0 | 0 | 108.8 | P57 | P57-F59 PolarHBondContact O-N 3.4Š|
| 60 | G | 37 | Very low | 45.8 | Very low | 67 Ų | 67 | 146.5 Ų | 146.5 | 69% | 0.691 | 76% | 0.762 | S | S | * | * | | | trans | -100.4 | 142.8 | 167 | 0 | 0 | 0 | 0 | 0 | 110.3 | R58 | R58-G60 PolarHBondContact O-N 3.22Š|
| 61 | P | 44.3 | Very low | 45.7 | Very low | 110 Ų | 110 | 141.4 Ų | 141.4 | 71% | 0.714 | 75% | 0.75 | S | S | * | * | | | trans | -81.4 | 143.8 | 178.4 | 34.1 | -31.1 | 0 | 0 | 0 | 109.6 | | |
| 62 | Q | 34.8 | Very low | 44.8 | Very low | 174 Ų | 174 | 143.7 Ų | 143.7 | 81% | 0.813 | 76% | 0.757 | S | S | * | * | | | trans | 156.4 | 102.7 | 136.1 | -80.3 | 156.4 | 108.2 | 0 | 0 | 110.8 | | |
| 63 | N | 40.3 | Very low | 44.3 | Very low | 140 Ų | 140 | 140.8 Ų | 140.8 | 75% | 0.749 | 76% | 0.758 | S | S | * | * | | | trans | 73.4 | 132.4 | 133.1 | -67.2 | -0.9 | 0 | 0 | 0 | 122 | | |
| 64 | D | 45.6 | Very low | 44.1 | Very low | 148 Ų | 148 | 145.5 Ų | 145.5 | 79% | 0.791 | 77% | 0.771 | S | S | * | * | S | Bend | trans | 101.9 | 13 | 146.2 | -56.4 | -30.4 | 0 | 0 | 0 | 121.7 | | |
| 65 | K | 40 | Very low | 44 | Very low | 198 Ų | 198 | 148.1 Ų | 148.1 | 86% | 0.861 | 77% | 0.771 | S | S | * | * | | | trans | -136.6 | 25.1 | 164.2 | -63 | -172.5 | -176.2 | -177.1 | 0 | 115.6 | K67 | K65-K67 PolarHBondContact O-N 3.49Š|
| 66 | M | 42.7 | Very low | 43.9 | Very low | 188 Ų | 188 | 149.4 Ų | 149.4 | 93% | 0.926 | 78% | 0.779 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.9 | 28.1 | 171.4 | -156.6 | 106.7 | 84.3 | 0 | 0 | 114.1 | | |
| 67 | K | 44.7 | Very low | 43.6 | Very low | 202 Ų | 202 | 153.3 Ų | 153.3 | 88% | 0.878 | 79% | 0.786 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134.4 | 12 | -176.2 | -83.6 | -169 | 176.7 | -177.9 | 0 | 115.5 | K65 | K65-K67 PolarHBondContact O-N 3.49Š|
| 68 | H | 46.6 | Very low | 43.5 | Very low | 171 Ų | 171 | 154.4 Ų | 154.4 | 79% | 0.792 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -138.1 | 101.8 | 173.2 | -139.2 | 63.1 | 0 | 0 | 0 | 110.7 | | |
| 69 | V | 44.8 | Very low | 43.5 | Very low | 97 Ų | 97 | 148.6 Ų | 148.6 | 59% | 0.588 | 77% | 0.774 | S | S | * | * | | | trans | 78 | 89.2 | 159.6 | -161.5 | 0 | 0 | 0 | 0 | 114.1 | | |
| 70 | Q | 42 | Very low | 43.9 | Very low | 188 Ų | 188 | 148.1 Ų | 148.1 | 88% | 0.879 | 78% | 0.777 | S | S | * | * | | | cis | 47.1 | 14.1 | 21.9 | -142.9 | 100.7 | 65 | 0 | 0 | 117.4 | | |
| 71 | S | 51.4 | Low | 44.4 | Very low | 88 Ų | 88 | 153.5 Ų | 153.5 | 62% | 0.615 | 79% | 0.785 | S | S | * | * | | | trans | -149.3 | 68 | 168.1 | -168.5 | 0 | 0 | 0 | 0 | 110.7 | | |
| 72 | Q | 36.1 | Very low | 44.8 | Very low | 193 Ų | 193 | 156.6 Ų | 156.6 | 90% | 0.902 | 79% | 0.789 | S | S | * | * | | | trans | -168.3 | 58.3 | 148.1 | -102.3 | 175 | 99.6 | 0 | 0 | 106.5 | | |
| 73 | V | 45.1 | Very low | 45 | Very low | 111 Ų | 111 | 155.2 Ų | 155.2 | 67% | 0.673 | 79% | 0.788 | S | S | * | * | | | trans | -92.5 | 140.7 | 150.6 | 178 | 0 | 0 | 0 | 0 | 103.7 | | |
| 74 | D | 45 | Very low | 45.5 | Very low | 151 Ų | 151 | 156.6 Ų | 156.6 | 81% | 0.807 | 79% | 0.793 | S | S | * | * | | | trans | 98.5 | 83.7 | -162.2 | -58.5 | -9.4 | 0 | 0 | 0 | 108.4 | | |
| 75 | E | 46.3 | Very low | 45.6 | Very low | 194 Ų | 194 | 154 Ų | 154 | 91% | 0.907 | 79% | 0.786 | S | S | * | * | | | | -154.1 | 102.7 | 62.3 | -169.6 | 166.7 | -141.2 | 0 | 0 | 109.2 | I77 | E75-I77 PolarHBondContact O-N 2.73Š|
| 76 | V | 48.8 | Very low | 46.1 | Very low | 116 Ų | 116 | 154 Ų | 154 | 70% | 0.703 | 79% | 0.786 | S | S | * | * | | | trans | -84.6 | 113.3 | 173.6 | 168.2 | 0 | 0 | 0 | 0 | 107.3 | | |
| 77 | I | 47.6 | Very low | 46.1 | Very low | 133 Ų | 133 | 152 Ų | 152 | 68% | 0.682 | 79% | 0.785 | S | S | * | * | | | trans | 74.7 | 110.6 | 151.5 | -56.8 | 165.4 | 0 | 0 | 0 | 115.7 | E75 V79 | E75-I77 PolarHBondContact O-N 2.73Å; I77-V79 HydrophobicContact CG2-CG2 4.25Å |
| 78 | D | 43 | Very low | 46.4 | Very low | 148 Ų | 148 | 150.3 Ų | 150.3 | 79% | 0.791 | 78% | 0.783 | S | S | * | * | | | | -146.4 | 104.6 | 117.6 | -124.3 | 3.3 | 0 | 0 | 0 | 107.6 | | |
| 79 | V | 42.8 | Very low | 46.2 | Very low | 101 Ų | 101 | 149 Ų | 149 | 61% | 0.612 | 78% | 0.778 | S | S | * | * | | | | 71.6 | 115.3 | 105.7 | 169.7 | 0 | 0 | 0 | 0 | 111.7 | I77 Q81 | I77-V79 HydrophobicContact CG2-CG2 4.25Å; V79-Q81 VanDerWaalsContact C-N 3.3Å; V79-Q81 PolarHBondContact O-N 3.28Å |
| 80 | M | 52.6 | Low | 46.1 | Very low | 192 Ų | 192 | 155.1 Ų | 155.1 | 95% | 0.946 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -51 | 92.8 | 160.6 | -83.3 | -176.7 | 158.8 | 0 | 0 | 110 | | |
| 81 | Q | 48.7 | Very low | 46.1 | Very low | 181 Ų | 181 | 149.8 Ų | 149.8 | 85% | 0.846 | 79% | 0.786 | S | S | * | * | | | trans | -175.1 | 144 | 143.4 | -110.3 | 165.6 | 8.8 | 0 | 0 | 109.9 | V79 | V79-Q81 VanDerWaalsContact C-N 3.3Å; V79-Q81 PolarHBondContact O-N 3.28Å |
| 82 | E | 51.2 | Low | 45.7 | Very low | 175 Ų | 175 | 152.7 Ų | 152.7 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | | | trans | 85.7 | 63.4 | 161.2 | -141 | 168.5 | -145.3 | 0 | 0 | 117 | | |
| 83 | N | 39.2 | Very low | 46.3 | Very low | 145 Ų | 145 | 153.7 Ų | 153.7 | 78% | 0.775 | 79% | 0.785 | S | S | * | * | | | | -143.8 | 52 | 126.1 | -101.4 | -58.6 | 0 | 0 | 0 | 110.8 | S85 | N83-S85 PolarHBondContact O-N 2.93Š|
| 84 | I | 51.2 | Low | 46.1 | Very low | 168 Ų | 168 | 156.8 Ų | 156.8 | 86% | 0.862 | 80% | 0.797 | S | S | * | * | | | trans | -68.7 | 66.4 | 148.7 | -62.2 | 172.3 | 0 | 0 | 0 | 106.2 | | |
| 85 | S | 46.8 | Very low | 45.8 | Very low | 93 Ų | 93 | 155.5 Ų | 155.5 | 65% | 0.65 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -169.7 | 39.7 | 178.7 | -82.9 | 0 | 0 | 0 | 0 | 111.8 | N83 | N83-S85 PolarHBondContact O-N 2.93Š|
| 86 | K | 51.4 | Low | 45.5 | Very low | 198 Ų | 198 | 152.4 Ų | 152.4 | 86% | 0.861 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -167.3 | 31.8 | 156.4 | -114.3 | 165.2 | -172.9 | -179.4 | 0 | 118.4 | | |
| 87 | V | 43.4 | Very low | 45.5 | Very low | 147 Ų | 147 | 154.4 Ų | 154.4 | 89% | 0.891 | 79% | 0.785 | S | S | * | * | | | trans | -134.7 | 62.8 | 154.5 | 178.2 | 0 | 0 | 0 | 0 | 109.5 | | |
| 88 | I | 50.7 | Low | 45.3 | Very low | 166 Ų | 166 | 156.5 Ų | 156.5 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | | | trans | -122.4 | 89.8 | 146.6 | -67.5 | 177.8 | 0 | 0 | 0 | 104.1 | | |
| 89 | E | 42.2 | Very low | 45.2 | Very low | 145 Ų | 145 | 155.3 Ų | 155.3 | 68% | 0.678 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -167.7 | 107.2 | 144 | -113.9 | -171.2 | 137.3 | 0 | 0 | 110.7 | | |
| 90 | R | 42.9 | Very low | 45.1 | Very low | 225 Ų | 225 | 159.3 Ų | 159.3 | 85% | 0.849 | 80% | 0.795 | S | S | * | * | S | Bend | trans | 63.5 | 108.6 | 150.7 | -56.2 | 171.3 | -168.8 | -150.8 | -0.1 | 116.6 | | |
| 91 | G | 42.7 | Very low | 44.6 | Very low | 76 Ų | 76 | 155.6 Ų | 155.6 | 78% | 0.784 | 79% | 0.788 | S | S | * | * | | | cis | -175.7 | 146.8 | 9.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 92 | E | 41.3 | Very low | 44.1 | Very low | 148 Ų | 148 | 156.2 Ų | 156.2 | 69% | 0.692 | 79% | 0.791 | S | S | * | * | | | trans | 32.6 | 103.8 | 145.8 | -158.5 | 171.6 | 168.8 | 0 | 0 | 119.3 | | |
| 93 | R | 48.6 | Very low | 43.4 | Very low | 215 Ų | 215 | 152 Ų | 152 | 81% | 0.811 | 78% | 0.781 | S | S | * | * | | | trans | 80.1 | 78.4 | 148.9 | -64.3 | 172.4 | -176.9 | 154.4 | 12.3 | 117.9 | | |
| 94 | L | 40.8 | Very low | 43.7 | Very low | 175 Ų | 175 | 151.9 Ų | 151.9 | 92% | 0.916 | 78% | 0.779 | S | S | * | * | | | trans | -85.3 | 111.4 | 145.6 | -82.6 | 138.4 | 0 | 0 | 0 | 106.7 | | |
| 95 | D | 40.6 | Very low | 43.1 | Very low | 124 Ų | 124 | 149.1 Ų | 149.1 | 66% | 0.663 | 78% | 0.775 | S | S | * | * | | | | 81.6 | 126.9 | 57.6 | -155.6 | 35.9 | 0 | 0 | 0 | 113.2 | | |
| 96 | D | 39.3 | Very low | 42.8 | Very low | 130 Ų | 130 | 150.7 Ų | 150.7 | 70% | 0.695 | 78% | 0.777 | S | S | * | * | | | trans | 54.9 | 132.7 | 163.6 | -77.1 | -32 | 0 | 0 | 0 | 124.6 | | |
| 97 | L | 49 | Very low | 42.4 | Very low | 157 Ų | 157 | 146.9 Ų | 146.9 | 82% | 0.822 | 76% | 0.762 | S | S | * | * | | | trans | -52 | 126.7 | 165.2 | -75.2 | 58.1 | 0 | 0 | 0 | 110.6 | | |
| 98 | Q | 42.3 | Very low | 42.4 | Very low | 177 Ų | 177 | 144.2 Ų | 144.2 | 83% | 0.827 | 76% | 0.755 | S | S | * | * | | | trans | -160.8 | 92.7 | 142.9 | -116.2 | 166.5 | 10.3 | 0 | 0 | 107.9 | | |
| 99 | D | 41.5 | Very low | 41.7 | Very low | 123 Ų | 123 | 140.2 Ų | 140.2 | 66% | 0.658 | 74% | 0.742 | S | S | * | * | | | | 89.8 | 84.3 | 100.4 | -86.4 | -24.8 | 0 | 0 | 0 | 109.3 | | |
| 100 | K | 40.5 | Very low | 41.8 | Very low | 185 Ų | 185 | 135.4 Ų | 135.4 | 80% | 0.804 | 73% | 0.727 | S | S | * | * | | | | 85.2 | 127.6 | 89.1 | -87.8 | -174.3 | -178.7 | -169.9 | 0 | 111.4 | | |
| 101 | S | 41.9 | Very low | 41.7 | Very low | 114 Ų | 114 | 132.6 Ų | 132.6 | 80% | 0.797 | 72% | 0.721 | S | S | * | * | | | trans | 94.4 | 55 | 149.7 | -49.8 | 0 | 0 | 0 | 0 | 119.2 | | |
| 102 | E | 37.7 | Very low | 41.9 | Very low | 194 Ų | 194 | 132.8 Ų | 132.8 | 91% | 0.907 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -141.5 | 112.6 | 144.5 | -158.6 | 174.5 | -148.4 | 0 | 0 | 109.3 | | |
| 103 | S | 37 | Very low | 41.9 | Very low | 87 Ų | 87 | 129.6 Ų | 129.6 | 61% | 0.608 | 71% | 0.705 | S | S | * | * | | | cis | -172.2 | 99.1 | -13.9 | 41.3 | 0 | 0 | 0 | 0 | 104.5 | S105 | S103-S105 PolarHBondContact O-N 3.44Š|
| 104 | L | 45.3 | Very low | 41.6 | Very low | 142 Ų | 142 | 128.3 Ų | 128.3 | 74% | 0.743 | 70% | 0.7 | S | S | * | * | S | Bend | trans | 61.1 | -12.5 | 147.4 | -152 | 56.6 | 0 | 0 | 0 | 120.9 | H107 | L104-H107 WeakPolarHBondContact CA-CD2 3.33Å; L104-H107 PolarHBondContact O-CD2 3.49Å |
| 105 | S | 38.8 | Very low | 41.9 | Very low | 111 Ų | 111 | 122.7 Ų | 122.7 | 78% | 0.776 | 68% | 0.678 | S | S | * | * | G | 310 helix | trans | -87.7 | -25.9 | -176.8 | -165.4 | 0 | 0 | 0 | 0 | 114.1 | S103 H107 | S103-S105 PolarHBondContact O-N 3.44Å; S105-H107 PolarHBondContact O-N 3.34Å |
| 106 | D | 41.8 | Very low | 42.1 | Very low | 126 Ų | 126 | 125 Ų | 125 | 67% | 0.674 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -82.7 | 10.3 | 178 | -90.7 | -15 | 0 | 0 | 0 | 114.2 | A110 | D106-A110 WeakPolarHBondContact O-CB 3.21Å; D106-A110 PolarHBondContact O-N 3.48Å |
| 107 | H | 42 | Very low | 42.5 | Very low | 118 Ų | 118 | 125.6 Ų | 125.6 | 55% | 0.546 | 68% | 0.681 | S | S | . | * | G | 310 helix | trans | -83 | -14.3 | -167 | -81.1 | -94.7 | 0 | 0 | 0 | 116 | L104 S105 | L104-H107 WeakPolarHBondContact CA-CD2 3.33Å; L104-H107 PolarHBondContact O-CD2 3.49Å; S105-H107 PolarHBondContact O-N 3.34Å |
| 108 | A | 43 | Very low | 42.4 | Very low | 91 Ų | 91 | 122.9 Ų | 122.9 | 75% | 0.752 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.4 | -35.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | | |
| 109 | S | 37.1 | Very low | 42.9 | Very low | 82 Ų | 82 | 121.4 Ų | 121.4 | 57% | 0.573 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.8 | -24.7 | -177.1 | 54.1 | 0 | 0 | 0 | 0 | 113.3 | S112 | S109-S112 PolarHBondContact O-OG 3.07Š|
| 110 | A | 43.1 | Very low | 43.6 | Very low | 44 Ų | 44 | 124.8 Ų | 124.8 | 36% | 0.364 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -85 | -10.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | D106 R114 | D106-A110 WeakPolarHBondContact O-CB 3.21Å; D106-A110 PolarHBondContact O-N 3.48Å; A110-R114 PolarHBondContact O-N 3.31Å |
| 111 | F | 42.2 | Very low | 44.4 | Very low | 165 Ų | 165 | 125.5 Ų | 125.5 | 72% | 0.724 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -76.5 | -33.2 | 176.7 | -128.5 | -88 | 0 | 0 | 0 | 112.4 | | |
| 112 | S | 45.4 | Very low | 45.5 | Very low | 80 Ų | 80 | 125.5 Ų | 125.5 | 56% | 0.559 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -77.8 | -30.4 | 178.8 | 71 | 0 | 0 | 0 | 0 | 113 | S109 | S109-S112 PolarHBondContact O-OG 3.07Å |
| 113 | S | 42.3 | Very low | 46.8 | Very low | 82 Ų | 82 | 123.7 Ų | 123.7 | 57% | 0.573 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -83 | -25.5 | -176.8 | -131.9 | 0 | 0 | 0 | 0 | 113.3 | | |
| 114 | R | 42.6 | Very low | 48.3 | Very low | 188 Ų | 188 | 128.6 Ų | 128.6 | 71% | 0.709 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -79.4 | -23 | 170.6 | -71.2 | -170.5 | -174.6 | -131.8 | 2.9 | 113.7 | A110 K116 Q117 L118 | A110-R114 PolarHBondContact O-N 3.31Å; R114-K116 VanDerWaalsContact C-N 3.28Å; R114-K116 PolarHBondContact O-N 3.39Å; R114-Q117 PolarHBondContact O-N 3.16Å; R114-L118 HydrophobicContact CB-CD1 4.5Å; R114-L118 WeakPolarHBondContact O-CD1 3.26Å; R114-L118 VanDerWaalsContact O-CG 3.26Å; R114-L118 WeakPolarHBondContact O-CG 3.42Å; R114-L118 PolarHBondContact O-N 3.32Å; R114-L118 VanDerWaalsContact O-N 3.16Å |
| 115 | A | 46 | Very low | 49.6 | Very low | 56 Ų | 56 | 131 Ų | 131 | 46% | 0.463 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -62.2 | -33.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 116 | K | 46 | Very low | 51.7 | Low | 173 Ų | 173 | 130.2 Ų | 130.2 | 75% | 0.752 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -78.1 | -26.3 | 179.5 | -76.5 | 178.7 | 178 | 171.2 | 0 | 114.1 | R114 | R114-K116 VanDerWaalsContact C-N 3.28Å; R114-K116 PolarHBondContact O-N 3.39Å |
| 117 | Q | 46.8 | Very low | 53.6 | Low | 143 Ų | 143 | 128.3 Ų | 128.3 | 67% | 0.668 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -88.3 | -27.8 | 179 | -63.5 | -170.6 | 28.3 | 0 | 0 | 113 | R114 | R114-Q117 PolarHBondContact O-N 3.16Å |
| 118 | L | 47.4 | Very low | 55.5 | Low | 100 Ų | 100 | 129.9 Ų | 129.9 | 52% | 0.524 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -67.5 | -36 | 172.7 | -69.5 | 166.3 | 0 | 0 | 0 | 111.9 | R114 R120 R121 M122 | R114-L118 HydrophobicContact CB-CD1 4.5Å; R114-L118 WeakPolarHBondContact O-CD1 3.26Å; R114-L118 VanDerWaalsContact O-CG 3.26Å; R114-L118 WeakPolarHBondContact O-CG 3.42Å; R114-L118 PolarHBondContact O-N 3.32Å; R114-L118 VanDerWaalsContact O-N 3.16Å; L118-R120 PolarHBondContact O-N 3.32Å; L118-R121 PolarHBondContact O-N 2.8Å; L118-M122 PolarHBondContact O-N 2.81Å |
| 119 | H | 52.5 | Low | 57.6 | Low | 145 Ų | 145 | 130.5 Ų | 130.5 | 67% | 0.671 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -63.5 | -39.3 | -177.7 | -132.9 | 32.5 | 0 | 0 | 0 | 113.1 | W123 | H119-W123 WeakPolarHBondContact O-CB 3.48Å; H119-W123 PolarHBondContact O-N 3.23Å |
| 120 | R | 57.2 | Low | 60.1 | Low | 194 Ų | 194 | 135.7 Ų | 135.7 | 73% | 0.732 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -67.8 | -39.1 | 178.6 | -76.6 | 175.3 | 176.7 | -169.9 | -2.2 | 112.3 | L118 W124 | L118-R120 PolarHBondContact O-N 3.32Å; R120-W124 PolarHBondContact O-N 2.99Å |
| 121 | R | 57.3 | Low | 62.6 | Low | 201 Ų | 201 | 140.3 Ų | 140.3 | 76% | 0.758 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -71.5 | -36.2 | 178.9 | -66.1 | -167.9 | -172.6 | -123 | 4.9 | 112.3 | L118 R125 | L118-R121 PolarHBondContact O-N 2.8Å; R121-R125 PolarHBondContact O-N 2.98Å |
| 122 | M | 63.9 | Low | 65.1 | Low | 113 Ų | 113 | 136.6 Ų | 136.6 | 56% | 0.557 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -66.9 | -46.3 | 174.3 | -75.9 | 175.3 | 172.7 | 0 | 0 | 111.4 | L118 W124 R125 D126 | L118-M122 PolarHBondContact O-N 2.81Å; M122-W124 VanDerWaalsContact C-N 3.29Å; M122-W124 PolarHBondContact O-N 3.25Å; M122-R125 CarbonylContact O-C 3.58Å; M122-R125 WeakPolarHBondContact O-CA 3.4Å; M122-R125 WeakPolarHBondContact O-CB 3.27Å; M122-R125 PolarHBondContact O-N 3.22Å; M122-D126 PolarHBondContact O-N 3.46Å |
| 123 | W | 65.4 | Low | 67.4 | Low | 157 Ų | 157 | 137.6 Ų | 137.6 | 60% | 0.595 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -59.8 | -38.1 | 179.8 | -168.4 | 66 | 0 | 0 | 0 | 113.2 | H119 M127 | H119-W123 WeakPolarHBondContact O-CB 3.48Å; H119-W123 PolarHBondContact O-N 3.23Å; W123-M127 HydrophobicContact CD2-CE 4.05Å; W123-M127 HydrophobicContact CE3-CE 3.78Å; W123-M127 HydrophobicContact CH2-CE 3.24Å; W123-M127 HydrophobicContact CZ2-CE 3.49Å; W123-M127 VanDerWaalsContact CZ2-CE 3.49Å; W123-M127 HydrophobicContact CZ2-SD 4.34Å; W123-M127 HydrophobicContact CZ3-CE 3.37Å; W123-M127 WeakPolarHBondContact O-CB 3.27Å; W123-M127 PolarHBondContact O-N 2.96Å |
| 124 | W | 68.5 | Low | 70 | Confident | 189 Ų | 189 | 136.1 Ų | 136.1 | 72% | 0.716 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -67.9 | -36 | 175 | -82.4 | 58.8 | 0 | 0 | 0 | 112.5 | R120 M122 K128 | R120-W124 PolarHBondContact O-N 2.99Å; M122-W124 VanDerWaalsContact C-N 3.29Å; M122-W124 PolarHBondContact O-N 3.25Å; W124-K128 VanDerWaalsContact O-CB 3.29Å; W124-K128 WeakPolarHBondContact O-CB 3.29Å; W124-K128 PolarHBondContact O-N 2.9Å |
| 125 | R | 73.3 | Confident | 72.5 | Confident | 194 Ų | 194 | 133 Ų | 133 | 73% | 0.732 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -70.9 | -43.2 | 177 | -151.1 | 157.3 | 176.8 | 120.5 | -6.9 | 110.6 | R121 M122 K128 M129 | R121-R125 PolarHBondContact O-N 2.98Å; M122-R125 CarbonylContact O-C 3.58Å; M122-R125 WeakPolarHBondContact O-CA 3.4Å; M122-R125 WeakPolarHBondContact O-CB 3.27Å; M122-R125 PolarHBondContact O-N 3.22Å; R125-K128 PolarHBondContact O-N 3.27Å; R125-M129 WeakPolarHBondContact O-CB 3.48Å; R125-M129 VanDerWaalsContact O-CG 3.27Å; R125-M129 WeakPolarHBondContact O-CG 3.38Å; R125-M129 PolarHBondContact O-N 2.89Å |
| 126 | D | 82.3 | Confident | 75 | Confident | 93 Ų | 93 | 134.1 Ų | 134.1 | 50% | 0.497 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -63.3 | -41.7 | 174.6 | -67 | -32.1 | 0 | 0 | 0 | 111.8 | M122 M129 R130 | M122-D126 PolarHBondContact O-N 3.46Å; D126-M129 PolarHBondContact O-N 2.91Å; D126-R130 WeakPolarHBondContact O-CB 3.27Å; D126-R130 VanDerWaalsContact O-CG 3.27Å; D126-R130 WeakPolarHBondContact O-CG 3.46Å; D126-R130 PolarHBondContact O-N 2.95Å |
| 127 | M | 81 | Confident | 77.4 | Confident | 87 Ų | 87 | 129.4 Ų | 129.4 | 43% | 0.429 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -66.1 | -42 | 176.3 | -170.9 | 121.7 | 66 | 0 | 0 | 111.9 | W123 R130 M131 | W123-M127 HydrophobicContact CD2-CE 4.05Å; W123-M127 HydrophobicContact CE3-CE 3.78Å; W123-M127 HydrophobicContact CH2-CE 3.24Å; W123-M127 HydrophobicContact CZ2-CE 3.49Å; W123-M127 VanDerWaalsContact CZ2-CE 3.49Å; W123-M127 HydrophobicContact CZ2-SD 4.34Å; W123-M127 HydrophobicContact CZ3-CE 3.37Å; W123-M127 WeakPolarHBondContact O-CB 3.27Å; W123-M127 PolarHBondContact O-N 2.96Å; M127-R130 PolarHBondContact O-N 2.85Å; M127-M131 WeakPolarHBondContact O-CB 3.49Å; M127-M131 PolarHBondContact O-N 3.43Å |
| 128 | K | 81.8 | Confident | 79.8 | Confident | 150 Ų | 150 | 126.5 Ų | 126.5 | 65% | 0.652 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -63.1 | -43.6 | 175.5 | -172.9 | 173.3 | 179.7 | 177.2 | 0 | 111.4 | W124 R125 M131 I132 | W124-K128 VanDerWaalsContact O-CB 3.29Å; W124-K128 WeakPolarHBondContact O-CB 3.29Å; W124-K128 PolarHBondContact O-N 2.9Å; R125-K128 PolarHBondContact O-N 3.27Å; K128-M131 PolarHBondContact O-N 3.33Å; K128-I132 HydrophobicContact CG-CD1 4.29Å; K128-I132 WeakPolarHBondContact O-CG1 3.22Å; K128-I132 PolarHBondContact O-N 3.48Å; K128-I132 VanDerWaalsContact O-N 3.09Å |
| 129 | M | 86.9 | Confident | 82.1 | Confident | 104 Ų | 104 | 123.8 Ų | 123.8 | 51% | 0.512 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -65.1 | -43 | 176.3 | -69.1 | -58 | -68.9 | 0 | 0 | 111.8 | R125 D126 M131 I132 I133 | R125-M129 WeakPolarHBondContact O-CB 3.48Å; R125-M129 VanDerWaalsContact O-CG 3.27Å; R125-M129 WeakPolarHBondContact O-CG 3.38Å; R125-M129 PolarHBondContact O-N 2.89Å; D126-M129 PolarHBondContact O-N 2.91Å; M129-M131 PolarHBondContact O-N 3.4Å; M129-I132 PolarHBondContact O-N 2.86Å; M129-I133 VanDerWaalsContact O-CG1 3.27Å; M129-I133 WeakPolarHBondContact O-CG1 3.42Å; M129-I133 PolarHBondContact O-N 2.93Å |
| 130 | R | 90.5 | Very high | 84.2 | Confident | 192 Ų | 192 | 121.6 Ų | 121.6 | 73% | 0.725 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -60.2 | -42.4 | 174.9 | -77.8 | 176.1 | 179.3 | -162 | 0.2 | 112.4 | D126 M127 I133 A134 | D126-R130 WeakPolarHBondContact O-CB 3.27Å; D126-R130 VanDerWaalsContact O-CG 3.27Å; D126-R130 WeakPolarHBondContact O-CG 3.46Å; D126-R130 PolarHBondContact O-N 2.95Å; M127-R130 PolarHBondContact O-N 2.85Å; R130-I133 PolarHBondContact O-N 3.31Å; R130-A134 WeakPolarHBondContact O-CB 3.34Å; R130-A134 PolarHBondContact O-N 3.32Å |
| 131 | M | 94.8 | Very high | 86.1 | Confident | 141 Ų | 141 | 116.6 Ų | 116.6 | 70% | 0.695 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -59.8 | -45.6 | 174.5 | -95.7 | -91.5 | -78.3 | 0 | 0 | 112.2 | M127 K128 M129 A134 L135 | M127-M131 WeakPolarHBondContact O-CB 3.49Å; M127-M131 PolarHBondContact O-N 3.43Å; K128-M131 PolarHBondContact O-N 3.33Å; M129-M131 PolarHBondContact O-N 3.4Å; M131-A134 PolarHBondContact O-N 3.01Å; M131-L135 PolarHBondContact O-N 3.26Å |
| 132 | I | 94.6 | Very high | 87.9 | Confident | 87 Ų | 87 | 111.6 Ų | 111.6 | 45% | 0.446 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62.6 | -46.2 | 178 | -66.9 | 165.6 | 0 | 0 | 0 | 110.5 | K128 M129 A134 L135 V136 | K128-I132 HydrophobicContact CG-CD1 4.29Å; K128-I132 WeakPolarHBondContact O-CG1 3.22Å; K128-I132 PolarHBondContact O-N 3.48Å; K128-I132 VanDerWaalsContact O-N 3.09Å; M129-I132 PolarHBondContact O-N 2.86Å; I132-A134 PolarHBondContact O-N 2.95Å; I132-L135 PolarHBondContact O-N 3.47Å; I132-V136 WeakPolarHBondContact O-CG2 3.4Å; I132-V136 PolarHBondContact O-N 3.49Å; I132-V136 VanDerWaalsContact O-N 3.08Å |
| 133 | I | 94.6 | Very high | 89.4 | Confident | 100 Ų | 100 | 111.8 Ų | 111.8 | 51% | 0.513 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -60.5 | -45.6 | 177.7 | -66.5 | 163.9 | 0 | 0 | 0 | 110.7 | M129 R130 L135 V136 V137 | M129-I133 VanDerWaalsContact O-CG1 3.27Å; M129-I133 WeakPolarHBondContact O-CG1 3.42Å; M129-I133 PolarHBondContact O-N 2.93Å; R130-I133 PolarHBondContact O-N 3.31Å; I133-L135 VanDerWaalsContact C-N 3.33Å; I133-L135 PolarHBondContact O-N 3.01Å; I133-V136 PolarHBondContact O-N 3.41Å; I133-V137 HydrophobicContact CG2-CG2 4.49Å; I133-V137 WeakPolarHBondContact O-CG2 3.33Å; I133-V137 PolarHBondContact O-N 3.09Å |
| 134 | A | 95.9 | Very high | 90.8 | Very high | 52 Ų | 52 | 109.2 Ų | 109.2 | 43% | 0.43 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60 | -42.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112 | R130 M131 I132 V136 V137 V138 | R130-A134 WeakPolarHBondContact O-CB 3.34Å; R130-A134 PolarHBondContact O-N 3.32Å; M131-A134 PolarHBondContact O-N 3.01Å; I132-A134 PolarHBondContact O-N 2.95Å; A134-V136 PolarHBondContact O-N 3.4Å; A134-V137 PolarHBondContact O-N 3.41Å; A134-V138 WeakPolarHBondContact O-CG2 3.36Å; A134-V138 PolarHBondContact O-N 3.34Å |
| 135 | L | 97 | Very high | 92.1 | Very high | 123 Ų | 123 | 104 Ų | 104 | 64% | 0.644 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.7 | -44.4 | 177.2 | -168.4 | 158.8 | 0 | 0 | 0 | 111.5 | M131 I132 I133 V137 V138 A139 | M131-L135 PolarHBondContact O-N 3.26Å; I132-L135 PolarHBondContact O-N 3.47Å; I133-L135 VanDerWaalsContact C-N 3.33Å; I133-L135 PolarHBondContact O-N 3.01Å; L135-V137 VanDerWaalsContact C-N 3.35Å; L135-V137 PolarHBondContact O-N 2.98Å; L135-V138 PolarHBondContact O-N 3.08Å; L135-A139 WeakPolarHBondContact O-CB 3.17Å; L135-A139 PolarHBondContact O-N 3.22Å |
| 136 | V | 97.1 | Very high | 93 | Very high | 78 Ų | 78 | 99.4 Ų | 99.4 | 47% | 0.473 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.2 | -43.6 | 177.1 | 172.9 | 0 | 0 | 0 | 0 | 111.2 | I132 I133 A134 A139 L140 | I132-V136 WeakPolarHBondContact O-CG2 3.4Å; I132-V136 PolarHBondContact O-N 3.49Å; I132-V136 VanDerWaalsContact O-N 3.08Å; I133-V136 PolarHBondContact O-N 3.41Å; A134-V136 PolarHBondContact O-N 3.4Å; V136-A139 PolarHBondContact O-N 3.29Å; V136-L140 HydrophobicContact CG1-CD1 4.26Å; V136-L140 WeakPolarHBondContact O-CG 3.44Å; V136-L140 PolarHBondContact O-N 3.47Å |
| 137 | V | 97.2 | Very high | 93.6 | Very high | 74 Ų | 74 | 98 Ų | 98 | 45% | 0.448 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.7 | -44.6 | 177.5 | 173.2 | 0 | 0 | 0 | 0 | 111.3 | I133 A134 L135 A139 L140 L141 | I133-V137 HydrophobicContact CG2-CG2 4.49Å; I133-V137 WeakPolarHBondContact O-CG2 3.33Å; I133-V137 PolarHBondContact O-N 3.09Å; A134-V137 PolarHBondContact O-N 3.41Å; L135-V137 VanDerWaalsContact C-N 3.35Å; L135-V137 PolarHBondContact O-N 2.98Å; V137-A139 PolarHBondContact O-N 3.01Å; V137-L140 PolarHBondContact O-N 3.37Å; V137-L141 HydrophobicContact CG1-CD1 4.28Å; V137-L141 WeakPolarHBondContact O-CG 3.39Å; V137-L141 PolarHBondContact O-N 3.31Å |
| 138 | V | 96.9 | Very high | 94.3 | Very high | 83 Ų | 83 | 97.7 Ų | 97.7 | 50% | 0.503 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.2 | -42.9 | 177.2 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | A134 L135 L140 L141 L142 | A134-V138 WeakPolarHBondContact O-CG2 3.36Å; A134-V138 PolarHBondContact O-N 3.34Å; L135-V138 PolarHBondContact O-N 3.08Å; V138-L140 PolarHBondContact O-N 3.48Å; V138-L141 PolarHBondContact O-N 2.98Å; V138-L142 HydrophobicContact CG1-CD1 4.37Å; V138-L142 WeakPolarHBondContact O-CG 3.35Å; V138-L142 PolarHBondContact O-N 3.28Å |
| 139 | A | 96.4 | Very high | 94.9 | Very high | 43 Ų | 43 | 95.2 Ų | 95.2 | 36% | 0.355 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.2 | -43.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | L135 V136 V137 L142 I143 | L135-A139 WeakPolarHBondContact O-CB 3.17Å; L135-A139 PolarHBondContact O-N 3.22Å; V136-A139 PolarHBondContact O-N 3.29Å; V137-A139 PolarHBondContact O-N 3.01Å; A139-L142 PolarHBondContact O-N 3.26Å; A139-I143 WeakPolarHBondContact O-CG1 3.41Å; A139-I143 PolarHBondContact O-N 3.11Å |
| 140 | L | 96.6 | Very high | 95.1 | Very high | 98 Ų | 98 | 95.4 Ų | 95.4 | 51% | 0.513 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.8 | -42.3 | 175.3 | -73.2 | 173.3 | 0 | 0 | 0 | 112.1 | V136 V137 V138 L142 I143 I144 | V136-L140 HydrophobicContact CG1-CD1 4.26Å; V136-L140 WeakPolarHBondContact O-CG 3.44Å; V136-L140 PolarHBondContact O-N 3.47Å; V137-L140 PolarHBondContact O-N 3.37Å; V138-L140 PolarHBondContact O-N 3.48Å; L140-L142 VanDerWaalsContact C-N 3.35Å; L140-L142 PolarHBondContact O-N 3.06Å; L140-I143 PolarHBondContact O-N 3.33Å; L140-I144 WeakPolarHBondContact O-CG1 3.48Å; L140-I144 PolarHBondContact O-N 2.95Å; L140-I144 VanDerWaalsContact O-N 3.11Å |
| 141 | L | 96.3 | Very high | 95.2 | Very high | 90 Ų | 90 | 96 Ų | 96 | 47% | 0.471 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.4 | -42.9 | 176 | -74 | 176 | 0 | 0 | 0 | 111.7 | V137 V138 I143 I144 I145 | V137-L141 HydrophobicContact CG1-CD1 4.28Å; V137-L141 WeakPolarHBondContact O-CG 3.39Å; V137-L141 PolarHBondContact O-N 3.31Å; V138-L141 PolarHBondContact O-N 2.98Å; L141-I143 VanDerWaalsContact C-N 3.34Å; L141-I143 PolarHBondContact O-N 3.48Å; L141-I144 PolarHBondContact O-N 3.32Å; L141-I145 HydrophobicContact CB-CD1 4.29Å; L141-I145 VanDerWaalsContact O-CB 3.23Å; L141-I145 WeakPolarHBondContact O-CB 3.5Å; L141-I145 WeakPolarHBondContact O-CG1 3.26Å; L141-I145 PolarHBondContact O-N 3.3Å |
| 142 | L | 95.1 | Very high | 95.1 | Very high | 95 Ų | 95 | 99.3 Ų | 99.3 | 50% | 0.497 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.7 | -42.4 | 176 | -69.6 | 175.1 | 0 | 0 | 0 | 111.8 | V138 A139 L140 I144 I145 I146 | V138-L142 HydrophobicContact CG1-CD1 4.37Å; V138-L142 WeakPolarHBondContact O-CG 3.35Å; V138-L142 PolarHBondContact O-N 3.28Å; A139-L142 PolarHBondContact O-N 3.26Å; L140-L142 VanDerWaalsContact C-N 3.35Å; L140-L142 PolarHBondContact O-N 3.06Å; L142-I144 PolarHBondContact O-N 3.47Å; L142-I145 PolarHBondContact O-N 3.26Å; L142-I146 HydrophobicContact CB-CD1 4.36Å; L142-I146 WeakPolarHBondContact O-CB 2.87Å; L142-I146 WeakPolarHBondContact O-CD1 3.23Å; L142-I146 WeakPolarHBondContact O-CG1 3.19Å; L142-I146 PolarHBondContact O-N 2.85Å |
| 143 | I | 95.3 | Very high | 94.9 | Very high | 117 Ų | 117 | 105.7 Ų | 105.7 | 60% | 0.6 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -60.3 | -34.4 | 177.2 | -71 | 169.7 | 0 | 0 | 0 | 111.8 | A139 L140 L141 P147 | A139-I143 WeakPolarHBondContact O-CG1 3.41Å; A139-I143 PolarHBondContact O-N 3.11Å; L140-I143 PolarHBondContact O-N 3.33Å; L141-I143 VanDerWaalsContact C-N 3.34Å; L141-I143 PolarHBondContact O-N 3.48Å; I143-P147 WeakPolarHBondContact O-CD 3.33Å; I143-P147 WeakPolarHBondContact O-CG 3.27Å |
| 144 | I | 94.8 | Very high | 93.7 | Very high | 104 Ų | 104 | 112 Ų | 112 | 53% | 0.533 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -85 | -42.8 | 179 | -62.6 | 171.4 | 0 | 0 | 0 | 111.4 | L140 L141 L142 P147 V148 | L140-I144 WeakPolarHBondContact O-CG1 3.48Å; L140-I144 PolarHBondContact O-N 2.95Å; L140-I144 VanDerWaalsContact O-N 3.11Å; L141-I144 PolarHBondContact O-N 3.32Å; L142-I144 PolarHBondContact O-N 3.47Å; I144-P147 VanDerWaalsContact O-CD 3.26Å; I144-P147 WeakPolarHBondContact O-CD 3.46Å; I144-P147 VanDerWaalsContact O-CG 3.27Å; I144-P147 WeakPolarHBondContact O-CG 3.04Å; I144-V148 HydrophobicContact CG2-CG2 4.35Å; I144-V148 WeakPolarHBondContact O-CB 3.36Å; I144-V148 WeakPolarHBondContact O-CG2 3.38Å; I144-V148 PolarHBondContact O-N 3.46Å |
| 145 | I | 95.4 | Very high | 93.6 | Very high | 79 Ų | 79 | 115.1 Ų | 115.1 | 41% | 0.405 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -68.9 | -42.4 | -174.7 | -71.4 | 174.3 | 0 | 0 | 0 | 111.4 | L141 L142 V148 I149 | L141-I145 HydrophobicContact CB-CD1 4.29Å; L141-I145 VanDerWaalsContact O-CB 3.23Å; L141-I145 WeakPolarHBondContact O-CB 3.5Å; L141-I145 WeakPolarHBondContact O-CG1 3.26Å; L141-I145 PolarHBondContact O-N 3.3Å; L142-I145 PolarHBondContact O-N 3.26Å; I145-V148 PolarHBondContact O-N 2.85Å; I145-I149 HydrophobicContact CG2-CD1 3.34Å; I145-I149 HydrophobicContact CG2-CG1 3.94Å; I145-I149 WeakPolarHBondContact O-CB 3.31Å; I145-I149 WeakPolarHBondContact O-CG1 3.15Å; I145-I149 PolarHBondContact O-N 3.19Å |
| 146 | I | 93.6 | Very high | 93.4 | Very high | 97 Ų | 97 | 114.6 Ų | 114.6 | 50% | 0.497 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -55.6 | -55.2 | 179.8 | -68.8 | 167.5 | 0 | 0 | 0 | 112.1 | L142 V148 I149 L150 | L142-I146 HydrophobicContact CB-CD1 4.36Å; L142-I146 WeakPolarHBondContact O-CB 2.87Å; L142-I146 WeakPolarHBondContact O-CD1 3.23Å; L142-I146 WeakPolarHBondContact O-CG1 3.19Å; L142-I146 PolarHBondContact O-N 2.85Å; I146-V148 VanDerWaalsContact C-N 3.35Å; I146-V148 PolarHBondContact O-N 3.46Å; I146-I149 PolarHBondContact O-N 3.42Å; I146-L150 HydrophobicContact CG2-CD1 3.86Å; I146-L150 WeakPolarHBondContact O-CB 3.38Å; I146-L150 VanDerWaalsContact O-CG 3.24Å; I146-L150 WeakPolarHBondContact O-CG 3.44Å; I146-L150 PolarHBondContact O-N 3Å |
| 147 | P | 93.9 | Very high | 93.2 | Very high | 65 Ų | 65 | 116.7 Ų | 116.7 | 42% | 0.422 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -66.6 | -36.1 | 179.3 | 25.8 | -33.9 | 0 | 0 | 0 | 112.1 | I143 I144 L150 R151 | I143-P147 WeakPolarHBondContact O-CD 3.33Å; I143-P147 WeakPolarHBondContact O-CG 3.27Å; I144-P147 VanDerWaalsContact O-CD 3.26Å; I144-P147 WeakPolarHBondContact O-CD 3.46Å; I144-P147 VanDerWaalsContact O-CG 3.27Å; I144-P147 WeakPolarHBondContact O-CG 3.04Å; P147-L150 PolarHBondContact O-N 2.79Å; P147-R151 VanDerWaalsContact O-CB 3.31Å; P147-R151 WeakPolarHBondContact O-CB 3.45Å; P147-R151 PolarHBondContact O-N 3.44Å |
| 148 | V | 95.8 | Very high | 93 | Very high | 79 Ų | 79 | 119.2 Ų | 119.2 | 48% | 0.479 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -61.4 | -49.9 | 176.6 | 169.6 | 0 | 0 | 0 | 0 | 110.7 | I144 I145 I146 L150 R151 Y152 | I144-V148 HydrophobicContact CG2-CG2 4.35Å; I144-V148 WeakPolarHBondContact O-CB 3.36Å; I144-V148 WeakPolarHBondContact O-CG2 3.38Å; I144-V148 PolarHBondContact O-N 3.46Å; I145-V148 PolarHBondContact O-N 2.85Å; I146-V148 VanDerWaalsContact C-N 3.35Å; I146-V148 PolarHBondContact O-N 3.46Å; V148-L150 PolarHBondContact O-N 2.84Å; V148-R151 CarbonylContact O-C 3.58Å; V148-R151 WeakPolarHBondContact O-CB 3.42Å; V148-R151 PolarHBondContact O-N 3Å; V148-Y152 WeakPolarHBondContact O-CB 3.24Å; V148-Y152 PolarHBondContact O-N 3.43Å |
| 149 | I | 94.8 | Very high | 92.7 | Very high | 98 Ų | 98 | 121.4 Ų | 121.4 | 50% | 0.503 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -62.3 | -43.4 | 178.4 | -69.3 | 176.1 | 0 | 0 | 0 | 111 | I145 I146 R151 Y152 R153 | I145-I149 HydrophobicContact CG2-CD1 3.34Å; I145-I149 HydrophobicContact CG2-CG1 3.94Å; I145-I149 WeakPolarHBondContact O-CB 3.31Å; I145-I149 WeakPolarHBondContact O-CG1 3.15Å; I145-I149 PolarHBondContact O-N 3.19Å; I146-I149 PolarHBondContact O-N 3.42Å; I149-R151 VanDerWaalsContact C-N 3.29Å; I149-R151 PolarHBondContact O-N 3.46Å; I149-Y152 PolarHBondContact O-N 2.91Å; I149-R153 VanDerWaalsContact O-CB 3.32Å; I149-R153 WeakPolarHBondContact O-CB 3.32Å; I149-R153 PolarHBondContact O-N 3.19Å |
| 150 | L | 90.8 | Very high | 92.5 | Very high | 108 Ų | 108 | 126.7 Ų | 126.7 | 57% | 0.565 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -63.3 | -36 | 176.7 | -71.3 | 173.2 | 0 | 0 | 0 | 112.2 | I146 P147 V148 K154 | I146-L150 HydrophobicContact CG2-CD1 3.86Å; I146-L150 WeakPolarHBondContact O-CB 3.38Å; I146-L150 VanDerWaalsContact O-CG 3.24Å; I146-L150 WeakPolarHBondContact O-CG 3.44Å; I146-L150 PolarHBondContact O-N 3Å; P147-L150 PolarHBondContact O-N 2.79Å; V148-L150 PolarHBondContact O-N 2.84Å; L150-K154 WeakPolarHBondContact O-CB 3.33Å; L150-K154 PolarHBondContact O-N 3.5Å |
| 151 | R | 93.1 | Very high | 92.2 | Very high | 206 Ų | 206 | 128.7 Ų | 128.7 | 78% | 0.777 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -70.8 | -33 | 173 | -105.5 | -70.9 | -167 | -177.8 | 3.4 | 113.1 | P147 V148 I149 | P147-R151 VanDerWaalsContact O-CB 3.31Å; P147-R151 WeakPolarHBondContact O-CB 3.45Å; P147-R151 PolarHBondContact O-N 3.44Å; V148-R151 CarbonylContact O-C 3.58Å; V148-R151 WeakPolarHBondContact O-CB 3.42Å; V148-R151 PolarHBondContact O-N 3Å; I149-R151 VanDerWaalsContact C-N 3.29Å; I149-R151 PolarHBondContact O-N 3.46Å |
| 152 | Y | 92.7 | Very high | 91.8 | Very high | 209 Ų | 209 | 131.7 Ų | 131.7 | 82% | 0.82 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -80.8 | -28.9 | -177.8 | -137.3 | -91.3 | 0 | 0 | 0 | 112.5 | V148 I149 | V148-Y152 WeakPolarHBondContact O-CB 3.24Å; V148-Y152 PolarHBondContact O-N 3.43Å; I149-Y152 PolarHBondContact O-N 2.91Å |
| 153 | R | 88.6 | Confident | 91.6 | Very high | 221 Ų | 221 | 134.8 Ų | 134.8 | 83% | 0.834 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -82 | -17 | 178.7 | -174.2 | 175.7 | 166.7 | -148.1 | -4.8 | 113.1 | I149 | I149-R153 VanDerWaalsContact O-CB 3.32Å; I149-R153 WeakPolarHBondContact O-CB 3.32Å; I149-R153 PolarHBondContact O-N 3.19Å |
| 154 | K | 70.2 | Confident | 91.2 | Very high | 234 Ų | 234 | 136.4 Ų | 136.4 | 100% | 1.017 | 62% | 0.623 | S | S | * | * | | | trans | -104 | 0 | -177.5 | -166.5 | 174.2 | -166.1 | -179.9 | 0 | 110.9 | L150 | L150-K154 WeakPolarHBondContact O-CB 3.33Å; L150-K154 PolarHBondContact O-N 3.5Å |