| 1 | M | 55.2 | Low | 52.2 | Low | 244 Ų | 244 | 129.1 Ų | 129.1 | 100% | 1.202 | 82% | 0.819 | S | S | * | * | | | | 0 | 118.3 | 0 | -78.7 | -160.6 | 161.3 | 0 | 0 | 107.1 | | |
| 2 | D | 42.8 | Very low | 52.3 | Low | 163 Ų | 163 | 129.7 Ų | 129.7 | 87% | 0.872 | 82% | 0.82 | S | S | * | * | | | trans | -67.1 | 157.1 | -163 | -62.8 | -97 | 0 | 0 | 0 | 115.2 | | |
| 3 | A | 61 | Low | 52.1 | Low | 90 Ų | 90 | 129.7 Ų | 129.7 | 74% | 0.744 | 81% | 0.81 | S | S | * | * | | | trans | -61.5 | 178.7 | 167.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 4 | P | 56.4 | Low | 52.2 | Low | 120 Ų | 120 | 129.1 Ų | 129.1 | 78% | 0.779 | 81% | 0.813 | S | S | * | * | | | cis | -150.5 | 171.2 | 29.7 | 37.6 | -13.2 | 0 | 0 | 0 | 118.8 | | |
| 5 | S | 46.2 | Very low | 52.5 | Low | 117 Ų | 117 | 127.9 Ų | 127.9 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | | | trans | -49.4 | 142.3 | 166.9 | -43.6 | 0 | 0 | 0 | 0 | 114.7 | | |
| 6 | S | 58 | Low | 52.7 | Low | 116 Ų | 116 | 131.7 Ų | 131.7 | 81% | 0.811 | 80% | 0.804 | S | S | * | * | | | trans | -127.5 | 100.5 | 161.2 | 55.4 | 0 | 0 | 0 | 0 | 109.7 | | |
| 7 | S | 47.4 | Very low | 52.9 | Low | 116 Ų | 116 | 129.9 Ų | 129.9 | 81% | 0.811 | 80% | 0.799 | S | S | * | * | | | trans | -92.2 | 123.9 | 161.4 | -59.9 | 0 | 0 | 0 | 0 | 108.1 | | |
| 8 | T | 52.9 | Low | 53.3 | Low | 126 Ų | 126 | 127 Ų | 127 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | | | trans | -125 | 110.3 | 168.8 | -59.4 | 0 | 0 | 0 | 0 | 108.5 | | |
| 9 | S | 49.7 | Very low | 53.7 | Low | 114 Ų | 114 | 124.3 Ų | 124.3 | 80% | 0.797 | 78% | 0.776 | S | S | * | * | | | trans | -102.4 | 122.5 | 168.5 | -57.6 | 0 | 0 | 0 | 0 | 108.2 | | |
| 10 | T | 49.8 | Very low | 53.9 | Low | 117 Ų | 117 | 125.2 Ų | 125.2 | 72% | 0.718 | 77% | 0.77 | S | S | * | * | | | trans | -150.5 | 94.4 | 167 | -47 | 0 | 0 | 0 | 0 | 107.6 | | |
| 11 | S | 54.7 | Low | 54.2 | Low | 97 Ų | 97 | 126.5 Ų | 126.5 | 68% | 0.678 | 77% | 0.768 | S | S | * | * | | | | 84.2 | 114.6 | 97.7 | -60.1 | 0 | 0 | 0 | 0 | 115.3 | | |
| 12 | T | 53.2 | Low | 54.5 | Low | 136 Ų | 136 | 122 Ų | 122 | 83% | 0.834 | 74% | 0.744 | S | S | * | * | | | trans | 63.5 | 105.1 | 135.9 | 63.9 | 0 | 0 | 0 | 0 | 119.6 | | |
| 13 | N | 49.5 | Very low | 55.6 | Low | 130 Ų | 130 | 121.1 Ų | 121.1 | 70% | 0.695 | 73% | 0.734 | S | S | * | * | | | trans | -150.7 | 82.9 | 147.3 | -161.6 | 16.5 | 0 | 0 | 0 | 109.6 | | |
| 14 | S | 54.4 | Low | 55.8 | Low | 121 Ų | 121 | 123 Ų | 123 | 85% | 0.846 | 73% | 0.728 | S | S | * | * | | | trans | -129.6 | 22.6 | -177.4 | -59.4 | 0 | 0 | 0 | 0 | 114.1 | | |
| 15 | S | 56.5 | Low | 56.4 | Low | 112 Ų | 112 | 122.6 Ų | 122.6 | 78% | 0.783 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -130.5 | 7.2 | -174.2 | -48.6 | 0 | 0 | 0 | 0 | 115.8 | | |
| 16 | R | 55.4 | Low | 57.6 | Low | 188 Ų | 188 | 123 Ų | 123 | 71% | 0.709 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -96.9 | -15.5 | -177.6 | -73.9 | -174.6 | 168.3 | -168.5 | -2.4 | 116 | A18 | R16-A18 PolarHBondContact O-N 3.44Š|
| 17 | S | 55.8 | Low | 58.3 | Low | 102 Ų | 102 | 123.7 Ų | 123.7 | 71% | 0.713 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -77.3 | -18.4 | -173.4 | -70.5 | 0 | 0 | 0 | 0 | 116 | | |
| 18 | A | 59.8 | Low | 59.3 | Low | 77 Ų | 77 | 124.2 Ų | 124.2 | 64% | 0.636 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -79.4 | -33.4 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | R16 | R16-A18 PolarHBondContact O-N 3.44Å |
| 19 | S | 61.5 | Low | 59.9 | Low | 75 Ų | 75 | 123.5 Ų | 123.5 | 52% | 0.524 | 67% | 0.672 | S | S | . | * | H | α-helix | trans | -79.6 | -30.4 | -178.7 | 49.1 | 0 | 0 | 0 | 0 | 113.3 | | |
| 20 | E | 58.4 | Low | 60.5 | Low | 142 Ų | 142 | 124.4 Ų | 124.4 | 66% | 0.664 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -73.1 | -31.3 | 179 | -122.2 | 170.8 | 124.4 | 0 | 0 | 112.4 | H24 | E20-H24 PolarHBondContact O-N 3.4Å |
| 21 | Q | 60.2 | Low | 61 | Low | 153 Ų | 153 | 127.1 Ų | 127.1 | 72% | 0.715 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -69.1 | -33.9 | 176.7 | -116.8 | 176.9 | 2.4 | 0 | 0 | 112.9 | H25 | Q21-H25 PolarHBondContact O-N 3.36Å |
| 22 | Q | 61.7 | Low | 61.1 | Low | 151 Ų | 151 | 131.6 Ų | 131.6 | 71% | 0.706 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -69.2 | -38.2 | 177.2 | -96.5 | -172.8 | -30.7 | 0 | 0 | 112.7 | H25 Q26 | Q22-H25 PolarHBondContact O-N 3.42Å; Q22-Q26 PolarHBondContact O-N 3.12Å; Q22-Q26 VanDerWaalsContact O-N 3.12Å |
| 23 | H | 64.4 | Low | 61.3 | Low | 144 Ų | 144 | 132.6 Ų | 132.6 | 67% | 0.667 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -66.6 | -38.8 | 178 | -88.7 | -111.6 | 0 | 0 | 0 | 112.3 | Q27 | H23-Q27 PolarHBondContact O-N 3.2Å; H23-Q27 VanDerWaalsContact O-N 3.14Å |
| 24 | H | 65.6 | Low | 61.7 | Low | 130 Ų | 130 | 134.5 Ų | 134.5 | 60% | 0.602 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -69.8 | -35.5 | 176.5 | -97.6 | -34.7 | 0 | 0 | 0 | 113.5 | E20 Q27 Q28 | E20-H24 PolarHBondContact O-N 3.4Å; H24-Q27 PolarHBondContact O-N 3.29Å; H24-Q28 PolarHBondContact O-N 3.42Å |
| 25 | H | 69.1 | Low | 61.7 | Low | 110 Ų | 110 | 135.8 Ų | 135.8 | 51% | 0.509 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -68.7 | -37.3 | 177.1 | -160.9 | 77.6 | 0 | 0 | 0 | 112.1 | Q21 Q22 Q28 Q29 | Q21-H25 PolarHBondContact O-N 3.36Å; Q22-H25 PolarHBondContact O-N 3.42Å; H25-Q28 PolarHBondContact O-N 3.44Å; H25-Q29 PolarHBondContact CD2-NE2 3.49Å; H25-Q29 PolarHBondContact NE2-NE2 3.15Å; H25-Q29 PolarHBondContact O-N 3.37Å |
| 26 | Q | 72.4 | Confident | 61.7 | Low | 127 Ų | 127 | 139 Ų | 139 | 59% | 0.593 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -70 | -34.2 | 176.7 | -166.3 | 169.7 | 66 | 0 | 0 | 112.4 | Q22 Q29 Q30 | Q22-Q26 PolarHBondContact O-N 3.12Å; Q22-Q26 VanDerWaalsContact O-N 3.12Å; Q26-Q29 PolarHBondContact O-N 3.17Å; Q26-Q30 PolarHBondContact O-N 3.44Å |
| 27 | Q | 72.4 | Confident | 61.8 | Low | 129 Ų | 129 | 139.5 Ų | 139.5 | 60% | 0.603 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -70.7 | -31.4 | 176.7 | -162.2 | 171.9 | 42.2 | 0 | 0 | 112.8 | H23 H24 R31 | H23-Q27 PolarHBondContact O-N 3.2Å; H23-Q27 VanDerWaalsContact O-N 3.14Å; H24-Q27 PolarHBondContact O-N 3.29Å; Q27-R31 PolarHBondContact O-N 3.14Å |
| 28 | Q | 68 | Low | 61.6 | Low | 127 Ų | 127 | 139.4 Ų | 139.4 | 59% | 0.593 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -66.3 | -39.2 | 172.2 | -83.3 | -173 | -4.6 | 0 | 0 | 112.3 | H24 H25 Q30 R31 Y32 | H24-Q28 PolarHBondContact O-N 3.42Å; H25-Q28 PolarHBondContact O-N 3.44Å; Q28-Q30 VanDerWaalsContact C-N 3.29Å; Q28-Q30 PolarHBondContact O-N 3.34Å; Q28-R31 PolarHBondContact O-N 3.48Å; Q28-Y32 WeakPolarHBondContact O-CD2 3.42Å |
| 29 | Q | 65 | Low | 61.2 | Low | 112 Ų | 112 | 140 Ų | 140 | 52% | 0.523 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -66.6 | -29.4 | 179.8 | -67.5 | -171.2 | 14.9 | 0 | 0 | 113.3 | H25 Q26 H33 | H25-Q29 PolarHBondContact CD2-NE2 3.49Å; H25-Q29 PolarHBondContact NE2-NE2 3.15Å; H25-Q29 PolarHBondContact O-N 3.37Å; Q26-Q29 PolarHBondContact O-N 3.17Å; Q29-H33 PolarHBondContact O-ND1 3.4Å; Q29-H33 VanDerWaalsContact O-ND1 3.07Å |
| 30 | Q | 63.4 | Low | 60.5 | Low | 133 Ų | 133 | 140.2 Ų | 140.2 | 62% | 0.621 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -74.5 | -28.7 | 175.5 | -66.5 | -171 | 13.1 | 0 | 0 | 113 | Q26 Q28 Y32 H33 | Q26-Q30 PolarHBondContact O-N 3.44Å; Q28-Q30 VanDerWaalsContact C-N 3.29Å; Q28-Q30 PolarHBondContact O-N 3.34Å; Q30-Y32 VanDerWaalsContact C-N 3.29Å; Q30-Y32 PolarHBondContact O-N 3.44Å; Q30-H33 PolarHBondContact O-N 3.21Å |
| 31 | R | 60.2 | Low | 60.4 | Low | 174 Ų | 174 | 142.1 Ų | 142.1 | 66% | 0.657 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -69.1 | -26.2 | 174.5 | -94.3 | -144.3 | 73.9 | 134.9 | -0.2 | 113.6 | Q27 Q28 | Q27-R31 PolarHBondContact O-N 3.14Å; Q28-R31 PolarHBondContact O-N 3.48Å |
| 32 | Y | 55.4 | Low | 60.2 | Low | 190 Ų | 190 | 143.1 Ų | 143.1 | 75% | 0.745 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -75.8 | -25.3 | 179 | -87.4 | -82.7 | 0 | 0 | 0 | 113.7 | Q28 Q30 | Q28-Y32 WeakPolarHBondContact O-CD2 3.42Å; Q30-Y32 VanDerWaalsContact C-N 3.29Å; Q30-Y32 PolarHBondContact O-N 3.44Å |
| 33 | H | 58.8 | Low | 60.1 | Low | 157 Ų | 157 | 140.3 Ų | 140.3 | 73% | 0.727 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -86.5 | -17.8 | -177.1 | -74.1 | 83.3 | 0 | 0 | 0 | 114.3 | Q29 Q30 | Q29-H33 PolarHBondContact O-ND1 3.4Å; Q29-H33 VanDerWaalsContact O-ND1 3.07Å; Q30-H33 PolarHBondContact O-N 3.21Å |
| 34 | H | 56.6 | Low | 59.8 | Low | 170 Ų | 170 | 143 Ų | 143 | 79% | 0.787 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -95.5 | -0.4 | -173.7 | -101.6 | -44.1 | 0 | 0 | 0 | 116.5 | | |
| 35 | H | 56 | Low | 59.2 | Low | 148 Ų | 148 | 146.8 Ų | 146.8 | 69% | 0.685 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -96.1 | 6 | -177.8 | -103.6 | 50.7 | 0 | 0 | 0 | 115.8 | | |
| 36 | H | 54.8 | Low | 58.6 | Low | 181 Ų | 181 | 152.4 Ų | 152.4 | 84% | 0.838 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -100.1 | 10.5 | -171.5 | -109.1 | -50.9 | 0 | 0 | 0 | 117.1 | | |
| 37 | Q | 58 | Low | 57.2 | Low | 197 Ų | 197 | 150.7 Ų | 150.7 | 92% | 0.921 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -130.1 | 6.1 | -171.2 | -91.9 | -175.1 | 20.1 | 0 | 0 | 118.6 | | |
| 38 | A | 52.3 | Low | 55.6 | Low | 100 Ų | 100 | 149.5 Ų | 149.5 | 83% | 0.826 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -139.2 | 106.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | | |
| 39 | A | 51 | Low | 54.6 | Low | 91 Ų | 91 | 148.3 Ų | 148.3 | 75% | 0.752 | 77% | 0.771 | S | S | * | * | | | trans | 133.8 | 84.5 | 153 | 0 | 0 | 0 | 0 | 0 | 111.5 | H41 | A39-H41 PolarHBondContact O-N 3.43Š|
| 40 | G | 46.1 | Very low | 53.4 | Low | 78 Ų | 78 | 148.8 Ų | 148.8 | 80% | 0.804 | 79% | 0.787 | S | S | * | * | | | trans | -66.8 | 113.1 | 156.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | | |
| 41 | H | 56.1 | Low | 52.6 | Low | 182 Ų | 182 | 146.7 Ų | 146.7 | 84% | 0.843 | 79% | 0.792 | S | S | * | * | | | trans | -137.1 | 127.2 | 163.1 | -92.6 | 60.2 | 0 | 0 | 0 | 108.1 | A39 | A39-H41 PolarHBondContact O-N 3.43Š|
| 42 | Q | 57.2 | Low | 51.9 | Low | 174 Ų | 174 | 143.3 Ų | 143.3 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | | | trans | -66.9 | 141.7 | -165.4 | -62.2 | -74.2 | -23.7 | 0 | 0 | 113.2 | | |
| 43 | P | 60 | Low | 51.4 | Low | 93 Ų | 93 | 137.2 Ų | 137.2 | 60% | 0.604 | 80% | 0.796 | S | S | * | * | | | trans | -87.4 | 118.9 | 168 | 32.7 | -28.3 | 0 | 0 | 0 | 110.7 | Y45 | P43-Y45 HydrophobicContact CB-CD2 4.4Å; P43-Y45 HydrophobicContact CB-CE2 4.23Å; P43-Y45 HydrophobicContact CG-CD2 4.35Å; P43-Y45 HydrophobicContact CG-CE2 4.01Å; P43-Y45 PolarHBondContact O-N 3.35Å |
| 44 | F | 57.1 | Low | 51 | Low | 201 Ų | 201 | 138.3 Ų | 138.3 | 88% | 0.882 | 80% | 0.804 | S | S | * | * | | | trans | -74.5 | 105.6 | 165 | -90.6 | -87.1 | 0 | 0 | 0 | 109.4 | | |
| 45 | Y | 53.6 | Low | 50.1 | Low | 208 Ų | 208 | 135 Ų | 135 | 82% | 0.816 | 81% | 0.806 | S | S | * | * | | | trans | -80.4 | 116.2 | 165.9 | -82.1 | -93.6 | 0 | 0 | 0 | 109.6 | P43 | P43-Y45 HydrophobicContact CB-CD2 4.4Å; P43-Y45 HydrophobicContact CB-CE2 4.23Å; P43-Y45 HydrophobicContact CG-CD2 4.35Å; P43-Y45 HydrophobicContact CG-CE2 4.01Å; P43-Y45 PolarHBondContact O-N 3.35Å |
| 46 | Y | 55.4 | Low | 49.9 | Very low | 229 Ų | 229 | 136.9 Ų | 136.9 | 90% | 0.898 | 82% | 0.815 | S | S | * | * | | | trans | -87 | 104.9 | 156.3 | -101.6 | -84 | 0 | 0 | 0 | 108.3 | | |
| 47 | A | 43.8 | Very low | 49.3 | Very low | 90 Ų | 90 | 136.3 Ų | 136.3 | 74% | 0.744 | 81% | 0.811 | S | S | * | * | | | trans | -68.4 | 132.6 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | A49 | A47-A49 PolarHBondContact O-N 3.07Š|
| 48 | A | 37.9 | Very low | 48.7 | Very low | 105 Ų | 105 | 134.6 Ų | 134.6 | 87% | 0.868 | 81% | 0.805 | S | S | * | * | | | trans | -64.5 | 120.6 | 168.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | | |
| 49 | A | 47.6 | Very low | 48.1 | Very low | 102 Ų | 102 | 133.4 Ų | 133.4 | 84% | 0.843 | 80% | 0.802 | S | S | * | * | | | trans | -91.7 | 105.6 | 165.6 | 0 | 0 | 0 | 0 | 0 | 109 | A47 | A47-A49 PolarHBondContact O-N 3.07Š|
| 50 | S | 40.1 | Very low | 47.5 | Very low | 122 Ų | 122 | 135.1 Ų | 135.1 | 85% | 0.853 | 81% | 0.808 | S | S | * | * | | | trans | -76 | 117.7 | 162.7 | 168 | 0 | 0 | 0 | 0 | 108.9 | | |
| 51 | A | 47.1 | Very low | 47.4 | Very low | 89 Ų | 89 | 142.4 Ų | 142.4 | 74% | 0.736 | 81% | 0.812 | S | S | * | * | | | trans | -156 | 99.5 | 158.4 | 0 | 0 | 0 | 0 | 0 | 106.3 | | |
| 52 | A | 44.4 | Very low | 46.5 | Very low | 102 Ų | 102 | 138.5 Ų | 138.5 | 84% | 0.843 | 81% | 0.81 | S | S | * | * | | | | 46.8 | 99.8 | 82.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 53 | G | 45.3 | Very low | 46.1 | Very low | 62 Ų | 62 | 137.3 Ų | 137.3 | 64% | 0.639 | 81% | 0.808 | S | S | * | * | | | trans | 122 | 121.2 | 150.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | | |
| 54 | M | 50.7 | Low | 45.8 | Very low | 181 Ų | 181 | 137.4 Ų | 137.4 | 89% | 0.892 | 82% | 0.817 | S | S | * | * | | | trans | 86.4 | 96.6 | 145.1 | -48.3 | -55.5 | 146.3 | 0 | 0 | 117.8 | | |
| 55 | A | 38.5 | Very low | 45.8 | Very low | 101 Ų | 101 | 133.6 Ų | 133.6 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | | | trans | -58.5 | 129.6 | 152 | 0 | 0 | 0 | 0 | 0 | 111 | | |
| 56 | Q | 50.7 | Low | 45.4 | Very low | 187 Ų | 187 | 128.2 Ų | 128.2 | 87% | 0.874 | 81% | 0.811 | S | S | * | * | | | trans | -149.9 | 103.2 | 149.2 | -67.9 | -142.6 | -67.2 | 0 | 0 | 106.6 | | |
| 57 | F | 43.1 | Very low | 45.7 | Very low | 169 Ų | 169 | 124.1 Ų | 124.1 | 74% | 0.741 | 81% | 0.809 | S | S | * | * | | | | 66.3 | 111.9 | 90 | -173.2 | -96.3 | 0 | 0 | 0 | 114 | | |
| 58 | M | 44.1 | Very low | 46.2 | Very low | 161 Ų | 161 | 125.2 Ų | 125.2 | 79% | 0.793 | 81% | 0.809 | S | S | * | * | | | trans | 21 | 130.9 | 154.5 | -57.1 | -172.3 | -152.4 | 0 | 0 | 119.8 | | |
| 59 | G | 40 | Very low | 47.1 | Very low | 75 Ų | 75 | 127.1 Ų | 127.1 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | | | trans | 158.8 | 98.4 | 152.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | R61 | G59-R61 PolarHBondContact O-N 3.44Š|
| 60 | S | 38.9 | Very low | 47 | Very low | 126 Ų | 126 | 128.8 Ų | 128.8 | 88% | 0.881 | 80% | 0.804 | S | S | * | * | | | trans | -44.7 | 119.5 | 163 | -45.5 | 0 | 0 | 0 | 0 | 111.4 | | |
| 61 | R | 43.2 | Very low | 47.5 | Very low | 232 Ų | 232 | 128.8 Ų | 128.8 | 88% | 0.875 | 80% | 0.799 | S | S | * | * | | | trans | -165.7 | 122.1 | 151.8 | -115.1 | 168.6 | 162.2 | -165.8 | -7.5 | 111.9 | G59 | G59-R61 PolarHBondContact O-N 3.44Š|
| 62 | A | 37 | Very low | 47.3 | Very low | 99 Ų | 99 | 132.1 Ų | 132.1 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | | | trans | -57.8 | 131.8 | 166.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 63 | I | 48.6 | Very low | 47.2 | Very low | 149 Ų | 149 | 135 Ų | 135 | 76% | 0.764 | 80% | 0.799 | S | S | * | * | | | trans | -150.4 | 111.8 | 156 | -78.7 | 112.8 | 0 | 0 | 0 | 106.7 | | |
| 64 | A | 54.2 | Low | 47.2 | Very low | 96 Ų | 96 | 135.9 Ų | 135.9 | 79% | 0.793 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -98.6 | 131.6 | 159.2 | 0 | 0 | 0 | 0 | 0 | 107.5 | | |
| 65 | P | 58.1 | Low | 47.1 | Very low | 121 Ų | 121 | 136 Ų | 136 | 79% | 0.786 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -85.8 | 125 | 173.3 | 31.3 | -28.9 | 0 | 0 | 0 | 110.7 | | |
| 66 | A | 44.4 | Very low | 47.3 | Very low | 94 Ų | 94 | 139.1 Ų | 139.1 | 78% | 0.777 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 143.3 | 168.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 67 | V | 63 | Low | 47.3 | Very low | 143 Ų | 143 | 138 Ų | 138 | 87% | 0.867 | 79% | 0.792 | S | S | * | * | | | trans | -119.7 | 119 | 162.1 | -81.8 | 0 | 0 | 0 | 0 | 108.4 | | |
| 68 | P | 53.5 | Low | 47.4 | Very low | 113 Ų | 113 | 138.6 Ų | 138.6 | 73% | 0.734 | 80% | 0.797 | S | S | * | * | | | trans | -112.6 | 133.3 | 171 | 35.5 | -24.3 | 0 | 0 | 0 | 111.1 | | |
| 69 | V | 56.8 | Low | 47.3 | Very low | 145 Ų | 145 | 140.1 Ų | 140.1 | 88% | 0.879 | 80% | 0.802 | S | S | * | * | | | trans | 176.6 | 145.4 | 155.4 | -102.3 | 0 | 0 | 0 | 0 | 107.5 | | |
| 70 | D | 45.4 | Very low | 47.6 | Very low | 137 Ų | 137 | 141.4 Ų | 141.4 | 73% | 0.733 | 80% | 0.799 | S | S | * | * | | | cis | -176.4 | 168.7 | -28.5 | -156.7 | -46 | 0 | 0 | 0 | 103.7 | | |
| 71 | V | 51.5 | Low | 48.1 | Very low | 122 Ų | 122 | 140.7 Ų | 140.7 | 74% | 0.739 | 79% | 0.794 | S | S | * | * | | | trans | 83.2 | 132.6 | 160.6 | -165.4 | 0 | 0 | 0 | 0 | 117.8 | | |
| 72 | Q | 42.2 | Very low | 48 | Very low | 160 Ų | 160 | 134.4 Ų | 134.4 | 75% | 0.748 | 79% | 0.791 | S | S | * | * | | | cis | 178.8 | 133.9 | -18.6 | -176.2 | 152 | -89.2 | 0 | 0 | 106.2 | | |
| 73 | L | 42.3 | Very low | 48.3 | Very low | 161 Ų | 161 | 134.3 Ų | 134.3 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | | | trans | 63.4 | 112.5 | 141.4 | -163.4 | 72 | 0 | 0 | 0 | 121.6 | | |
| 74 | A | 46 | Very low | 47.9 | Very low | 82 Ų | 82 | 132.1 Ų | 132.1 | 68% | 0.678 | 80% | 0.795 | S | S | * | * | | | | 153.6 | 104.8 | 119.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 75 | Q | 47.3 | Very low | 47.3 | Very low | 182 Ų | 182 | 132.4 Ų | 132.4 | 85% | 0.85 | 80% | 0.797 | S | S | * | * | | | | 91.1 | 88.1 | 104.1 | -160.6 | 175.1 | 72.2 | 0 | 0 | 111.3 | | |
| 76 | Q | 43.9 | Very low | 46.5 | Very low | 167 Ų | 167 | 131.4 Ų | 131.4 | 78% | 0.78 | 80% | 0.799 | S | S | * | * | | | | 65.3 | 101.7 | 85.5 | -159.5 | -170.1 | 51.8 | 0 | 0 | 113.8 | | |
| 77 | Q | 49.7 | Very low | 46.7 | Very low | 165 Ų | 165 | 131.6 Ų | 131.6 | 77% | 0.771 | 80% | 0.801 | S | S | * | * | | | trans | 141.6 | 114.1 | 142.9 | -82.1 | 172.4 | 11.3 | 0 | 0 | 110.5 | | |
| 78 | Q | 45 | Very low | 46.3 | Very low | 181 Ų | 181 | 131.1 Ų | 131.1 | 85% | 0.846 | 80% | 0.801 | S | S | * | * | | | | 167.1 | 127.7 | 97.2 | -148.6 | 149.5 | -26.9 | 0 | 0 | 110.5 | | |
| 79 | Q | 42.4 | Very low | 45.8 | Very low | 192 Ų | 192 | 130.8 Ų | 130.8 | 90% | 0.897 | 81% | 0.808 | S | S | * | * | | | trans | -83.5 | 133.7 | 176.9 | -69.2 | 164.2 | -18.4 | 0 | 0 | 110.6 | | |
| 80 | S | 45.8 | Very low | 45 | Very low | 103 Ų | 103 | 127.2 Ų | 127.2 | 72% | 0.72 | 80% | 0.8 | S | S | * | * | | | trans | -167.2 | 100.4 | 152.1 | -9.8 | 0 | 0 | 0 | 0 | 108.3 | | |
| 81 | S | 49 | Very low | 45 | Very low | 110 Ų | 110 | 126.3 Ų | 126.3 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | | | | 65 | 103.5 | 105.5 | 66.1 | 0 | 0 | 0 | 0 | 116.7 | | |
| 82 | A | 42.8 | Very low | 44.7 | Very low | 100 Ų | 100 | 126 Ų | 126 | 83% | 0.826 | 81% | 0.807 | S | S | * | * | | | | 76.5 | 123.7 | 128.6 | 0 | 0 | 0 | 0 | 0 | 121.8 | | |
| 83 | A | 43 | Very low | 44.6 | Very low | 98 Ų | 98 | 122.2 Ų | 122.2 | 81% | 0.81 | 81% | 0.811 | S | S | * | * | | | trans | 84.7 | 94 | 137 | 0 | 0 | 0 | 0 | 0 | 120 | | |
| 84 | A | 39.3 | Very low | 44.6 | Very low | 102 Ų | 102 | 119.2 Ų | 119.2 | 84% | 0.843 | 81% | 0.81 | S | S | * | * | | | | 43.6 | 96.2 | 128.2 | 0 | 0 | 0 | 0 | 0 | 119.2 | | |
| 85 | A | 42 | Very low | 44.3 | Very low | 103 Ų | 103 | 119.9 Ų | 119.9 | 85% | 0.851 | 82% | 0.815 | S | S | * | * | | | trans | -82.6 | 110.7 | 156.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | | |
| 86 | A | 42.1 | Very low | 44.1 | Very low | 99 Ų | 99 | 116 Ų | 116 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | | | | 76.1 | 93.4 | 71.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 87 | A | 48 | Very low | 43.9 | Very low | 98 Ų | 98 | 115.6 Ų | 115.6 | 81% | 0.81 | 82% | 0.818 | S | S | * | * | | | trans | -80.4 | 150.7 | 162.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | | |
| 88 | P | 55 | Low | 43.9 | Very low | 134 Ų | 134 | 116.3 Ų | 116.3 | 87% | 0.87 | 82% | 0.818 | S | S | * | * | | | trans | -93.7 | 133.3 | 179.3 | 34.6 | -28.3 | 0 | 0 | 0 | 111.7 | | |
| 89 | A | 41.8 | Very low | 44 | Very low | 106 Ų | 106 | 114.2 Ų | 114.2 | 88% | 0.876 | 82% | 0.818 | S | S | * | * | | | trans | -133.6 | 125.7 | 161.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | | |
| 90 | G | 41.5 | Very low | 44.2 | Very low | 69 Ų | 69 | 114.8 Ų | 114.8 | 71% | 0.711 | 82% | 0.817 | S | S | * | * | | | trans | -107.7 | 130 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | | |
| 91 | S | 44.4 | Very low | 44.1 | Very low | 118 Ų | 118 | 113.9 Ų | 113.9 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | | | trans | 57.7 | 135.8 | 144.1 | 63.1 | 0 | 0 | 0 | 0 | 119.7 | | |
| 92 | S | 45.1 | Very low | 43.9 | Very low | 115 Ų | 115 | 115.4 Ų | 115.4 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | | | cis | 177.9 | 144.3 | 5 | 42.1 | 0 | 0 | 0 | 0 | 109.7 | | |
| 93 | G | 40.2 | Very low | 44.4 | Very low | 81 Ų | 81 | 117 Ų | 117 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | | | trans | 84.5 | 146.7 | 147.6 | 0 | 0 | 0 | 0 | 0 | 117.5 | | |
| 94 | A | 41.7 | Very low | 44.4 | Very low | 98 Ų | 98 | 118 Ų | 118 | 81% | 0.81 | 82% | 0.818 | S | S | * | * | | | cis | -173.1 | 154.4 | -14.6 | 0 | 0 | 0 | 0 | 0 | 107.1 | | |
| 95 | A | 39.9 | Very low | 44.6 | Very low | 96 Ų | 96 | 118.2 Ų | 118.2 | 79% | 0.793 | 82% | 0.82 | S | S | * | * | | | trans | 69.5 | 102.5 | 165.4 | 0 | 0 | 0 | 0 | 0 | 117.2 | | |
| 96 | A | 44.1 | Very low | 44.8 | Very low | 100 Ų | 100 | 118.3 Ų | 118.3 | 83% | 0.826 | 82% | 0.82 | S | S | * | * | | | | 69 | 101.3 | 76.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | | |
| 97 | D | 40.4 | Very low | 45.2 | Very low | 160 Ų | 160 | 118.2 Ų | 118.2 | 86% | 0.856 | 82% | 0.82 | S | S | * | * | | | | -170.2 | 154.6 | 105.5 | -136.8 | -44.5 | 0 | 0 | 0 | 111.7 | | |
| 98 | K | 48 | Very low | 45.2 | Very low | 179 Ų | 179 | 118.7 Ų | 118.7 | 78% | 0.778 | 82% | 0.824 | S | S | * | * | | | trans | -83.6 | 145 | -171.4 | -63.2 | 163.5 | 177.5 | 174.7 | 0 | 110.6 | | |
| 99 | T | 47.7 | Very low | 44.8 | Very low | 137 Ų | 137 | 116 Ų | 116 | 84% | 0.84 | 82% | 0.82 | S | S | * | * | | | | 160.4 | 120.5 | 123.2 | 40.7 | 0 | 0 | 0 | 0 | 113.7 | | |
| 100 | K | 47 | Very low | 45.3 | Very low | 205 Ų | 205 | 116.5 Ų | 116.5 | 89% | 0.891 | 82% | 0.817 | S | S | * | * | | | trans | 72.8 | 135.7 | 133.2 | -156.9 | 172.8 | -177.3 | -179.5 | 0 | 121.7 | | |
| 101 | A | 42.8 | Very low | 45.9 | Very low | 84 Ų | 84 | 123 Ų | 123 | 69% | 0.694 | 83% | 0.826 | S | S | * | * | | | trans | 80.5 | 105.1 | 158.9 | 0 | 0 | 0 | 0 | 0 | 117 | | |
| 102 | V | 44.4 | Very low | 46.7 | Very low | 141 Ų | 141 | 128.7 Ų | 128.7 | 86% | 0.855 | 83% | 0.829 | S | S | * | * | | | | 73.7 | 127.4 | 76.9 | 178.3 | 0 | 0 | 0 | 0 | 113.1 | | |
| 103 | V | 55 | Low | 47.4 | Very low | 134 Ų | 134 | 128.7 Ų | 128.7 | 81% | 0.812 | 83% | 0.827 | S | S | * | * | | | trans | 101 | 116.2 | 172.7 | -163.8 | 0 | 0 | 0 | 0 | 117.5 | | |
| 104 | P | 43.1 | Very low | 48.3 | Very low | 120 Ų | 120 | 132.1 Ų | 132.1 | 78% | 0.779 | 83% | 0.832 | S | S | * | * | | | trans | -105.5 | 135.9 | 169.6 | 36.2 | -26 | 0 | 0 | 0 | 115.2 | | |
| 105 | A | 42.6 | Very low | 49.4 | Very low | 106 Ų | 106 | 134.9 Ų | 134.9 | 88% | 0.876 | 83% | 0.825 | S | S | * | * | | | trans | 22.8 | 129.3 | 146.8 | 0 | 0 | 0 | 0 | 0 | 124.2 | | |
| 106 | A | 45.4 | Very low | 50.2 | Low | 104 Ų | 104 | 134.2 Ų | 134.2 | 86% | 0.86 | 81% | 0.808 | S | S | * | * | | | trans | -153.4 | 150.1 | 148 | 0 | 0 | 0 | 0 | 0 | 108 | | |
| 107 | A | 51.8 | Low | 51 | Low | 98 Ų | 98 | 140.8 Ų | 140.8 | 81% | 0.81 | 81% | 0.812 | S | S | * | * | | | cis | -172.1 | 124 | -16.8 | 0 | 0 | 0 | 0 | 0 | 105.1 | | |
| 108 | A | 47.1 | Very low | 52.4 | Low | 108 Ų | 108 | 137.4 Ų | 137.4 | 89% | 0.893 | 79% | 0.79 | S | S | * | * | | | trans | -148.1 | 78.8 | 170 | 0 | 0 | 0 | 0 | 0 | 109.7 | | |
| 109 | G | 47.2 | Very low | 52.9 | Low | 77 Ų | 77 | 132.7 Ų | 132.7 | 79% | 0.794 | 78% | 0.777 | S | S | * | * | | | trans | -92 | 103 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 110 | S | 51.8 | Low | 53.9 | Low | 117 Ų | 117 | 132.9 Ų | 132.9 | 82% | 0.818 | 77% | 0.766 | S | S | * | * | | | trans | -81.5 | 119.8 | 161.8 | -179.1 | 0 | 0 | 0 | 0 | 109.4 | R112 | S110-R112 PolarHBondContact O-N 3.36Š|
| 111 | K | 53.5 | Low | 54.4 | Low | 204 Ų | 204 | 126.9 Ų | 126.9 | 89% | 0.887 | 75% | 0.746 | S | S | * | * | | | trans | -64.3 | 113.1 | -175.9 | -61.8 | 177.2 | 179.4 | 179.3 | 0 | 110.4 | | |
| 112 | R | 62.6 | Low | 55 | Low | 238 Ų | 238 | 128.9 Ų | 128.9 | 90% | 0.898 | 74% | 0.742 | S | S | * | * | | | trans | -65 | 138.1 | 173.3 | -73.5 | -175.1 | -178.1 | -153 | 0.6 | 110.6 | S110 T114 | S110-R112 PolarHBondContact O-N 3.36Å; R112-T114 PolarHBondContact O-N 3.1Å |
| 113 | P | 59 | Low | 56 | Low | 116 Ų | 116 | 125.8 Ų | 125.8 | 75% | 0.753 | 74% | 0.738 | S | S | * | * | | | trans | -69.3 | 121.1 | -173.4 | 27.1 | -33.5 | 0 | 0 | 0 | 111.6 | K115 | P113-K115 PolarHBondContact O-N 3.27Š|
| 114 | T | 59.7 | Low | 56.7 | Low | 153 Ų | 153 | 129.1 Ų | 129.1 | 94% | 0.939 | 74% | 0.736 | S | S | * | * | | | trans | -70.6 | 46.3 | 170.6 | -173 | 0 | 0 | 0 | 0 | 112.2 | R112 | R112-T114 PolarHBondContact O-N 3.1Š|
| 115 | K | 63.7 | Low | 57.9 | Low | 156 Ų | 156 | 125.5 Ų | 125.5 | 68% | 0.678 | 72% | 0.721 | S | S | * | * | | | trans | -102.6 | 104 | 178.4 | -159.6 | 92.5 | 176.2 | -171.1 | 0 | 108.6 | P113 R117 | P113-K115 PolarHBondContact O-N 3.27Å; K115-R117 PolarHBondContact O-N 3.41Å |
| 116 | D | 58.1 | Low | 59.7 | Low | 81 Ų | 81 | 127.3 Ų | 127.3 | 43% | 0.433 | 71% | 0.705 | S | S | . | * | | | trans | -35.2 | 110.3 | 161.4 | 179.7 | -5.1 | 0 | 0 | 0 | 111.1 | H118 R127 | D116-H118 PolarHBondContact O-N 3.18Å; D116-H118 WeakPolarHBondContact OD1-CB 3.37Å; D116-H118 IonicContact OD1-CD2 3.38Å; D116-H118 PolarHBondContact OD1-CD2 2.88Å; D116-H118 IonicContact OD1-CG 2.69Å; D116-H118 PolarHBondContact OD1-N 2.97Å; D116-R127 VanDerWaalsContact CG-CZ 3.5Å; D116-R127 IonicContact OD1-CZ 3.2Å; D116-R127 IonicContact OD1-NE 3.51Å; D116-R127 PolarHBondContact OD1-NE 3.48Å; D116-R127 IonicContact OD1-NH2 3.01Å; D116-R127 PolarHBondContact OD1-NH2 3.39Å; D116-R127 WeakPolarHBondContact OD2-CD 3.35Å; D116-R127 IonicContact OD2-CZ 2.64Å; D116-R127 IonicContact OD2-NE 3.18Å; D116-R127 PolarHBondContact OD2-NE 3.32Å; D116-R127 IonicContact OD2-NH2 2.77Å |
| 117 | R | 61 | Low | 61.4 | Low | 238 Ų | 238 | 128.6 Ų | 128.6 | 90% | 0.898 | 69% | 0.687 | S | S | * | * | | | trans | -82.6 | 14.4 | 179.9 | -60.7 | -175.8 | 85.8 | -161.4 | 7.8 | 113.1 | K115 T119 | K115-R117 PolarHBondContact O-N 3.41Å; R117-T119 PolarHBondContact O-N 3.41Å |
| 118 | H | 68.2 | Low | 63 | Low | 89 Ų | 89 | 130.2 Ų | 130.2 | 41% | 0.412 | 68% | 0.681 | S | S | . | * | P | Polyproline II helix | trans | -70.6 | 133.1 | 177.4 | -71.5 | -157.3 | 0 | 0 | 0 | 109.8 | D116 K120 R127 | D116-H118 PolarHBondContact O-N 3.18Å; D116-H118 WeakPolarHBondContact OD1-CB 3.37Å; D116-H118 IonicContact OD1-CD2 3.38Å; D116-H118 PolarHBondContact OD1-CD2 2.88Å; D116-H118 IonicContact OD1-CG 2.69Å; D116-H118 PolarHBondContact OD1-N 2.97Å; H118-K120 PolarHBondContact O-N 3.13Å; H118-K120 VanDerWaalsContact O-N 3.15Å; H118-R127 HydrophobicContact CB-CG 4.33Å; H118-R127 PolarHBondContact CD2-NH2 2.81Å; H118-R127 PolarHBondContact CE1-NE 3.44Å; H118-R127 PolarHBondContact CE1-NH1 3.22Å; H118-R127 PolarHBondContact CE1-NH2 3.02Å; H118-R127 WeakPolarHBondContact ND1-CD 3.29Å; H118-R127 WeakPolarHBondContact ND1-CG 3.48Å; H118-R127 VanDerWaalsContact ND1-CZ 3.28Å; H118-R127 PolarHBondContact ND1-NE 2.84Å; H118-R127 PolarHBondContact NE2-NH2 3.28Å |
| 119 | T | 59.9 | Low | 65.1 | Low | 81 Ų | 81 | 136.5 Ų | 136.5 | 50% | 0.497 | 68% | 0.681 | S | S | . | * | P | Polyproline II helix | trans | -57.3 | 121.9 | 178.1 | 43.9 | 0 | 0 | 0 | 0 | 107.8 | R117 R126 | R117-T119 PolarHBondContact O-N 3.41Å; T119-R126 WeakPolarHBondContact O-CD 3.38Å; T119-R126 WeakPolarHBondContact O-CG 3.44Å; T119-R126 PolarHBondContact O-NE 3.04Å; T119-R126 WeakPolarHBondContact OG1-CD 3.32Å; T119-R126 PolarHBondContact OG1-NE 3.32Å; T119-R126 PolarHBondContact OG1-NH1 3.47Å |
| 120 | K | 68.2 | Low | 67.1 | Low | 140 Ų | 140 | 137.8 Ų | 137.8 | 61% | 0.609 | 67% | 0.668 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -77.8 | 134 | 174.1 | -63.9 | 179.2 | 176.2 | -171.9 | 0 | 107.2 | H118 | H118-K120 PolarHBondContact O-N 3.13Å; H118-K120 VanDerWaalsContact O-N 3.15Å |
| 121 | V | 57.1 | Low | 69.2 | Low | 79 Ų | 79 | 136.3 Ų | 136.3 | 48% | 0.479 | 66% | 0.656 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -119.2 | 129.3 | 165.4 | 160.4 | 0 | 0 | 0 | 0 | 106 | G123 R124 R126 | V121-G123 VanDerWaalsContact C-N 3.35Å; V121-G123 PolarHBondContact O-N 2.89Å; V121-R124 PolarHBondContact N-O 3.28Å; V121-R124 PolarHBondContact O-N 3.22Å; V121-R126 HydrophobicContact CB-CG 4.16Å; V121-R126 HydrophobicContact CG2-CG 4.32Å |
| 122 | E | 55.7 | Low | 71.2 | Confident | 127 Ų | 127 | 130.7 Ų | 130.7 | 59% | 0.593 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 55.1 | 46.4 | 179 | -157.9 | 46.9 | -130.1 | 0 | 0 | 113.9 | R124 N177 | E122-R124 PolarHBondContact O-N 3.32Å; E122-N177 WeakPolarHBondContact CG-ND2 3.37Å |
| 123 | G | 65.5 | Low | 72.8 | Confident | 76 Ų | 76 | 125.9 Ų | 125.9 | 78% | 0.784 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 65 | -7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | V121 | V121-G123 VanDerWaalsContact C-N 3.35Å; V121-G123 PolarHBondContact O-N 2.89Å |
| 124 | R | 69.1 | Low | 74.6 | Confident | 204 Ų | 204 | 122.8 Ų | 122.8 | 77% | 0.77 | 62% | 0.619 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -110.3 | 145.9 | -174.6 | -169.6 | 173.9 | 174.8 | 123.8 | -2.6 | 110.1 | V121 E122 | V121-R124 PolarHBondContact N-O 3.28Å; V121-R124 PolarHBondContact O-N 3.22Å; E122-R124 PolarHBondContact O-N 3.32Å |
| 125 | G | 69.6 | Low | 76.3 | Confident | 44 Ų | 44 | 116.6 Ų | 116.6 | 45% | 0.454 | 58% | 0.583 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -64.3 | 136.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | R127 | G125-R127 PolarHBondContact O-N 3.49Å |
| 126 | R | 78.7 | Confident | 77.8 | Confident | 144 Ų | 144 | 111.7 Ų | 111.7 | 54% | 0.543 | 57% | 0.572 | S | S | . | * | S | Bend | trans | -72.7 | -1.9 | 170.2 | -68.4 | 178.9 | -160.9 | -156.4 | 6.5 | 113.5 | T119 V121 | T119-R126 WeakPolarHBondContact O-CD 3.38Å; T119-R126 WeakPolarHBondContact O-CG 3.44Å; T119-R126 PolarHBondContact O-NE 3.04Å; T119-R126 WeakPolarHBondContact OG1-CD 3.32Å; T119-R126 PolarHBondContact OG1-NE 3.32Å; T119-R126 PolarHBondContact OG1-NH1 3.47Å; V121-R126 HydrophobicContact CB-CG 4.16Å; V121-R126 HydrophobicContact CG2-CG 4.32Å |
| 127 | R | 83.1 | Confident | 79.6 | Confident | 131 Ų | 131 | 116.6 Ų | 116.6 | 49% | 0.494 | 59% | 0.585 | S | S | . | * | P | Polyproline II helix | trans | -81.5 | 119.2 | 175.9 | -63.9 | -177.5 | -167.4 | -121.8 | -1.6 | 109.5 | D116 H118 G125 | D116-R127 VanDerWaalsContact CG-CZ 3.5Å; D116-R127 IonicContact OD1-CZ 3.2Å; D116-R127 IonicContact OD1-NE 3.51Å; D116-R127 PolarHBondContact OD1-NE 3.48Å; D116-R127 IonicContact OD1-NH2 3.01Å; D116-R127 PolarHBondContact OD1-NH2 3.39Å; D116-R127 WeakPolarHBondContact OD2-CD 3.35Å; D116-R127 IonicContact OD2-CZ 2.64Å; D116-R127 IonicContact OD2-NE 3.18Å; D116-R127 PolarHBondContact OD2-NE 3.32Å; D116-R127 IonicContact OD2-NH2 2.77Å; H118-R127 HydrophobicContact CB-CG 4.33Å; H118-R127 PolarHBondContact CD2-NH2 2.81Å; H118-R127 PolarHBondContact CE1-NE 3.44Å; H118-R127 PolarHBondContact CE1-NH1 3.22Å; H118-R127 PolarHBondContact CE1-NH2 3.02Å; H118-R127 WeakPolarHBondContact ND1-CD 3.29Å; H118-R127 WeakPolarHBondContact ND1-CG 3.48Å; H118-R127 VanDerWaalsContact ND1-CZ 3.28Å; H118-R127 PolarHBondContact ND1-NE 2.84Å; H118-R127 PolarHBondContact NE2-NH2 3.28Å; G125-R127 PolarHBondContact O-N 3.49Å |
| 128 | I | 84.7 | Confident | 81.3 | Confident | 131 Ų | 131 | 106.1 Ų | 106.1 | 67% | 0.672 | 55% | 0.547 | S | S | * | . | P | Polyproline II helix | trans | -98.6 | 129.6 | 169.9 | -54 | -57.6 | 0 | 0 | 0 | 108.6 | M130 | I128-M130 HydrophobicContact CG2-CE 3.65Š|
| 129 | R | 91.5 | Very high | 82.6 | Confident | 240 Ų | 240 | 106.7 Ų | 106.7 | 91% | 0.906 | 55% | 0.549 | S | S | * | . | P | Polyproline II helix | trans | -84.2 | 116.5 | 172.7 | -70.9 | 180 | 175.3 | -110.5 | 1.6 | 108.4 | | |
| 130 | M | 88.1 | Confident | 84.4 | Confident | 105 Ų | 105 | 108.3 Ų | 108.3 | 52% | 0.517 | 55% | 0.551 | S | S | . | * | P | Polyproline II helix | trans | -97.7 | 135.6 | -178.8 | -86 | -66.3 | 99.7 | 0 | 0 | 113.1 | I128 C134 A135 | I128-M130 HydrophobicContact CG2-CE 3.65Å; M130-C134 HydrophobicContact SD-CB 4.08Å; M130-A135 HydrophobicContact CB-CB 4.33Å |
| 131 | P | 95.4 | Very high | 85.8 | Confident | 85 Ų | 85 | 103.3 Ų | 103.3 | 55% | 0.552 | 53% | 0.53 | S | S | * | . | P | Polyproline II helix | trans | -56.4 | 145.6 | 168 | -23.3 | 33.7 | 0 | 0 | 0 | 111 | L133 C134 A135 | P131-L133 VanDerWaalsContact C-N 3.3Å; P131-L133 PolarHBondContact O-N 3.32Å; P131-C134 PolarHBondContact O-N 2.88Å; P131-A135 PolarHBondContact O-N 3.38Å |
| 132 | A | 95.7 | Very high | 87.6 | Confident | 86 Ų | 86 | 100.2 Ų | 100.2 | 71% | 0.711 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -54.7 | -42.8 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | C134 A135 A136 | A132-C134 VanDerWaalsContact C-N 3.33Å; A132-C134 PolarHBondContact O-N 2.77Å; A132-A135 PolarHBondContact O-N 2.97Å; A132-A136 WeakPolarHBondContact O-CB 3.11Å; A132-A136 PolarHBondContact O-N 3.32Å |
| 133 | L | 96.6 | Very high | 89.5 | Confident | 137 Ų | 137 | 104.3 Ų | 104.3 | 72% | 0.717 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.2 | -35.3 | 178.7 | -68.5 | -179.5 | 0 | 0 | 0 | 113 | P131 R137 | P131-L133 VanDerWaalsContact C-N 3.3Å; P131-L133 PolarHBondContact O-N 3.32Å; L133-R137 WeakPolarHBondContact O-CG 3.38Å; L133-R137 PolarHBondContact O-N 2.99Å |
| 134 | C | 96.1 | Very high | 91 | Very high | 52 Ų | 52 | 107 Ų | 107 | 35% | 0.351 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -72.5 | -45.9 | 177.7 | -175 | 0 | 0 | 0 | 0 | 110.2 | M130 P131 A132 A136 R137 V138 | M130-C134 HydrophobicContact SD-CB 4.08Å; P131-C134 PolarHBondContact O-N 2.88Å; A132-C134 VanDerWaalsContact C-N 3.33Å; A132-C134 PolarHBondContact O-N 2.77Å; C134-A136 VanDerWaalsContact C-N 3.29Å; C134-A136 PolarHBondContact O-N 3.43Å; C134-R137 PolarHBondContact O-N 3.44Å; C134-R137 VanDerWaalsContact O-N 3.12Å; C134-V138 WeakPolarHBondContact O-CG2 3.01Å; C134-V138 PolarHBondContact O-N 3.03Å |
| 135 | A | 95.4 | Very high | 92.2 | Very high | 22 Ų | 22 | 100 Ų | 100 | 18% | 0.182 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -57.7 | -42.4 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | M130 P131 A132 R137 V138 F139 | M130-A135 HydrophobicContact CB-CB 4.33Å; P131-A135 PolarHBondContact O-N 3.38Å; A132-A135 PolarHBondContact O-N 2.97Å; A135-R137 VanDerWaalsContact C-N 3.34Å; A135-R137 PolarHBondContact O-N 3.23Å; A135-V138 PolarHBondContact O-N 3.35Å; A135-F139 HydrophobicContact CB-CD2 4.41Å; A135-F139 HydrophobicContact CB-CE2 3.89Å; A135-F139 HydrophobicContact CB-CZ 4.43Å; A135-F139 WeakPolarHBondContact O-CD2 3.29Å; A135-F139 VanDerWaalsContact O-CG 3.25Å; A135-F139 WeakPolarHBondContact O-CG 3.22Å; A135-F139 PolarHBondContact O-N 2.98Å |
| 136 | A | 96.1 | Very high | 93.5 | Very high | 54 Ų | 54 | 100.8 Ų | 100.8 | 45% | 0.446 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -57.3 | -44.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | A132 C134 F139 Q140 | A132-A136 WeakPolarHBondContact O-CB 3.11Å; A132-A136 PolarHBondContact O-N 3.32Å; C134-A136 VanDerWaalsContact C-N 3.29Å; C134-A136 PolarHBondContact O-N 3.43Å; A136-F139 PolarHBondContact O-N 3.04Å; A136-Q140 WeakPolarHBondContact O-CB 3.31Å; A136-Q140 PolarHBondContact O-N 3.29Å |
| 137 | R | 96.9 | Very high | 94.3 | Very high | 184 Ų | 184 | 96.5 Ų | 96.5 | 69% | 0.694 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -65.6 | -40.3 | 176.2 | -66.6 | -172.8 | -149.6 | -179.9 | 4.6 | 112.1 | L133 C134 A135 Q140 L141 | L133-R137 WeakPolarHBondContact O-CG 3.38Å; L133-R137 PolarHBondContact O-N 2.99Å; C134-R137 PolarHBondContact O-N 3.44Å; C134-R137 VanDerWaalsContact O-N 3.12Å; A135-R137 VanDerWaalsContact C-N 3.34Å; A135-R137 PolarHBondContact O-N 3.23Å; R137-Q140 PolarHBondContact O-N 3.13Å; R137-L141 WeakPolarHBondContact O-CB 3.43Å; R137-L141 PolarHBondContact O-N 2.81Å |
| 138 | V | 96.4 | Very high | 94.8 | Very high | 18 Ų | 18 | 99.4 Ų | 99.4 | 11% | 0.109 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -62.8 | -47.8 | 176.3 | 175.2 | 0 | 0 | 0 | 0 | 110.1 | C134 A135 Q140 L141 T142 D150 T153 I154 | C134-V138 WeakPolarHBondContact O-CG2 3.01Å; C134-V138 PolarHBondContact O-N 3.03Å; A135-V138 PolarHBondContact O-N 3.35Å; V138-Q140 VanDerWaalsContact C-N 3.26Å; V138-Q140 PolarHBondContact O-N 3.25Å; V138-L141 PolarHBondContact O-N 2.9Å; V138-T142 WeakPolarHBondContact O-CB 3.32Å; V138-T142 PolarHBondContact O-N 3Å; V138-T142 PolarHBondContact O-OG1 2.79Å; V138-D150 HydrophobicContact CG1-CB 4.24Å; V138-T153 HydrophobicContact CG1-CG2 4.17Å; V138-I154 HydrophobicContact CG1-CD1 4.12Å; V138-I154 HydrophobicContact CG2-CD1 3.98Å |
| 139 | F | 95.7 | Very high | 95.1 | Very high | 100 Ų | 100 | 96.5 Ų | 96.5 | 44% | 0.439 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.7 | -35 | 177.6 | -64.1 | -43.9 | 0 | 0 | 0 | 113 | A135 A136 R143 D150 | A135-F139 HydrophobicContact CB-CD2 4.41Å; A135-F139 HydrophobicContact CB-CE2 3.89Å; A135-F139 HydrophobicContact CB-CZ 4.43Å; A135-F139 WeakPolarHBondContact O-CD2 3.29Å; A135-F139 VanDerWaalsContact O-CG 3.25Å; A135-F139 WeakPolarHBondContact O-CG 3.22Å; A135-F139 PolarHBondContact O-N 2.98Å; A136-F139 PolarHBondContact O-N 3.04Å; F139-R143 WeakPolarHBondContact O-CG 3.45Å; F139-R143 PolarHBondContact O-N 3.36Å; F139-D150 WeakPolarHBondContact CD1-OD1 3.31Å; F139-D150 WeakPolarHBondContact CE1-OD2 3.46Å |
| 140 | Q | 97 | Very high | 95.2 | Very high | 116 Ų | 116 | 88.2 Ų | 88.2 | 54% | 0.542 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -66 | -50.5 | 173.8 | 177.4 | 155.6 | 8.2 | 0 | 0 | 111 | A136 R137 V138 T142 R143 E144 | A136-Q140 WeakPolarHBondContact O-CB 3.31Å; A136-Q140 PolarHBondContact O-N 3.29Å; R137-Q140 PolarHBondContact O-N 3.13Å; V138-Q140 VanDerWaalsContact C-N 3.26Å; V138-Q140 PolarHBondContact O-N 3.25Å; Q140-T142 VanDerWaalsContact C-N 3.32Å; Q140-T142 PolarHBondContact O-N 3.36Å; Q140-R143 WeakPolarHBondContact O-CB 3.27Å; Q140-R143 PolarHBondContact O-N 3.48Å; Q140-R143 VanDerWaalsContact O-N 3.07Å; Q140-E144 HydrophobicContact CG-CG 4.49Å; Q140-E144 WeakPolarHBondContact CG-OE1 3.38Å; Q140-E144 PolarHBondContact NE2-OE1 3.46Å; Q140-E144 WeakPolarHBondContact O-CG 3.49Å; Q140-E144 PolarHBondContact O-N 2.87Å |
| 141 | L | 96.9 | Very high | 95.4 | Very high | 35 Ų | 35 | 85.1 Ų | 85.1 | 18% | 0.183 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -61.7 | -38.5 | 178.2 | -174.3 | 65.4 | 0 | 0 | 0 | 112.4 | R137 V138 R143 E144 L145 T153 W156 L157 | R137-L141 WeakPolarHBondContact O-CB 3.43Å; R137-L141 PolarHBondContact O-N 2.81Å; V138-L141 PolarHBondContact O-N 2.9Å; L141-R143 PolarHBondContact O-N 3.25Å; L141-E144 PolarHBondContact O-N 2.9Å; L141-E144 VanDerWaalsContact O-N 3.12Å; L141-L145 HydrophobicContact CD1-CD1 3.98Å; L141-L145 HydrophobicContact CD1-CD2 4.4Å; L141-L145 HydrophobicContact CD1-CG 3.91Å; L141-L145 HydrophobicContact CD2-CD1 4.24Å; L141-L145 HydrophobicContact CG-CD1 3.74Å; L141-L145 HydrophobicContact CG-CG 4.08Å; L141-L145 WeakPolarHBondContact O-CB 3.37Å; L141-L145 WeakPolarHBondContact O-CG 3.41Å; L141-L145 PolarHBondContact O-N 3.49Å; L141-T153 HydrophobicContact CB-CG2 4.05Å; L141-T153 HydrophobicContact CD2-CG2 3.72Å; L141-T153 HydrophobicContact CG-CG2 3.86Å; L141-W156 HydrophobicContact CD1-CZ3 4.41Å; L141-W156 HydrophobicContact CD2-CE3 4.2Å; L141-W156 HydrophobicContact CD2-CZ3 3.9Å; L141-L157 HydrophobicContact CD2-CD1 4Å; L141-L157 HydrophobicContact CD2-CD2 3.74Å; L141-L157 HydrophobicContact CD2-CG 3.89Å |
| 142 | T | 96.1 | Very high | 95.3 | Very high | 14 Ų | 14 | 84.6 Ų | 84.6 | 9% | 0.086 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -55.4 | -41 | 174.4 | -59.3 | 0 | 0 | 0 | 0 | 111 | V138 Q140 G146 H147 D150 T153 | V138-T142 WeakPolarHBondContact O-CB 3.32Å; V138-T142 PolarHBondContact O-N 3Å; V138-T142 PolarHBondContact O-OG1 2.79Å; Q140-T142 VanDerWaalsContact C-N 3.32Å; Q140-T142 PolarHBondContact O-N 3.36Å; T142-G146 PolarHBondContact O-N 3.35Å; T142-H147 HydrophobicContact CG2-CB 4.14Å; T142-H147 WeakPolarHBondContact CG2-O 3.21Å; T142-H147 PolarHBondContact O-N 3.42Å; T142-H147 VanDerWaalsContact O-N 3.09Å; T142-D150 PolarHBondContact OG1-OD1 3.17Å; T142-T153 WeakPolarHBondContact CA-OG1 3.36Å; T142-T153 WeakPolarHBondContact CB-OG1 3.4Å; T142-T153 WeakPolarHBondContact OG1-CB 3.48Å; T142-T153 PolarHBondContact OG1-OG1 2.77Å |
| 143 | R | 96 | Very high | 95.3 | Very high | 213 Ų | 213 | 80.5 Ų | 80.5 | 80% | 0.804 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -72.4 | -38 | 176.9 | -66 | 171.7 | -174.5 | -176.3 | 1.7 | 112.4 | F139 Q140 L141 G146 | F139-R143 WeakPolarHBondContact O-CG 3.45Å; F139-R143 PolarHBondContact O-N 3.36Å; Q140-R143 WeakPolarHBondContact O-CB 3.27Å; Q140-R143 PolarHBondContact O-N 3.48Å; Q140-R143 VanDerWaalsContact O-N 3.07Å; L141-R143 PolarHBondContact O-N 3.25Å; R143-G146 PolarHBondContact O-N 3.25Å |
| 144 | E | 96.3 | Very high | 95.2 | Very high | 131 Ų | 131 | 77.5 Ų | 77.5 | 61% | 0.612 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -70.2 | -37.4 | -179.7 | -69.9 | 173.4 | -170.2 | 0 | 0 | 112.4 | Q140 L141 | Q140-E144 HydrophobicContact CG-CG 4.49Å; Q140-E144 WeakPolarHBondContact CG-OE1 3.38Å; Q140-E144 PolarHBondContact NE2-OE1 3.46Å; Q140-E144 WeakPolarHBondContact O-CG 3.49Å; Q140-E144 PolarHBondContact O-N 2.87Å; L141-E144 PolarHBondContact O-N 2.9Å; L141-E144 VanDerWaalsContact O-N 3.12Å |
| 145 | L | 94.9 | Very high | 95 | Very high | 58 Ų | 58 | 81 Ų | 81 | 30% | 0.304 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -81.4 | -16.3 | 176.4 | -63.4 | 176.4 | 0 | 0 | 0 | 113.4 | L141 H147 T153 W156 | L141-L145 HydrophobicContact CD1-CD1 3.98Å; L141-L145 HydrophobicContact CD1-CD2 4.4Å; L141-L145 HydrophobicContact CD1-CG 3.91Å; L141-L145 HydrophobicContact CD2-CD1 4.24Å; L141-L145 HydrophobicContact CG-CD1 3.74Å; L141-L145 HydrophobicContact CG-CG 4.08Å; L141-L145 WeakPolarHBondContact O-CB 3.37Å; L141-L145 WeakPolarHBondContact O-CG 3.41Å; L141-L145 PolarHBondContact O-N 3.49Å; L145-H147 VanDerWaalsContact C-N 3.33Å; L145-T153 HydrophobicContact CD1-CG2 4.41Å; L145-W156 HydrophobicContact CD1-CD2 3.61Å; L145-W156 HydrophobicContact CD1-CE3 3.57Å; L145-W156 HydrophobicContact CD1-CG 4.08Å; L145-W156 HydrophobicContact CD1-CH2 4.38Å; L145-W156 HydrophobicContact CD1-CZ2 4.41Å; L145-W156 HydrophobicContact CD1-CZ3 3.99Å; L145-W156 HydrophobicContact CD2-CH2 4.27Å; L145-W156 HydrophobicContact CD2-CZ2 4Å |
| 146 | G | 95.5 | Very high | 95 | Very high | 60 Ų | 60 | 83.8 Ų | 83.8 | 62% | 0.619 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 73.6 | 22.3 | -175 | 0 | 0 | 0 | 0 | 0 | 114.1 | T142 R143 | T142-G146 PolarHBondContact O-N 3.35Å; R143-G146 PolarHBondContact O-N 3.25Å |
| 147 | H | 95.7 | Very high | 95 | Very high | 54 Ų | 54 | 84.3 Ų | 84.3 | 25% | 0.25 | 41% | 0.411 | C | S | . | . | | | trans | -72.9 | 148.5 | 176.1 | -67.9 | -178.2 | 0 | 0 | 0 | 110.9 | T142 L145 E152 T153 W156 | T142-H147 HydrophobicContact CG2-CB 4.14Å; T142-H147 WeakPolarHBondContact CG2-O 3.21Å; T142-H147 PolarHBondContact O-N 3.42Å; T142-H147 VanDerWaalsContact O-N 3.09Å; L145-H147 VanDerWaalsContact C-N 3.33Å; H147-E152 HydrophobicContact CB-CB 4.06Å; H147-T153 WeakPolarHBondContact ND1-CA 3.05Å; H147-T153 PolarHBondContact ND1-N 3.42Å; H147-T153 PolarHBondContact ND1-OG1 3.27Å; H147-W156 AromaticContact CE1-CG 3.92Å |
| 148 | K | 93.2 | Very high | 94.7 | Very high | 192 Ų | 192 | 80.3 Ų | 80.3 | 84% | 0.835 | 40% | 0.403 | S | S | * | . | S | Bend | trans | -84.8 | -27.9 | -177.5 | -63.5 | 173.3 | -173.3 | -71.6 | 0 | 111.3 | E152 | K148-E152 WeakPolarHBondContact CA-OE2 3.03Å; K148-E152 PolarHBondContact N-OE2 3.25Å |
| 149 | T | 92.2 | Very high | 94.5 | Very high | 70 Ų | 70 | 84.6 Ų | 84.6 | 43% | 0.429 | 42% | 0.422 | S | S | . | . | S | Bend | trans | -133.8 | 151.4 | -175.2 | 73.9 | 0 | 0 | 0 | 0 | 111.7 | G151 E152 T153 | T149-G151 PolarHBondContact O-N 2.99Å; T149-E152 PolarHBondContact N-OE2 3.47Å; T149-E152 PolarHBondContact O-N 3.15Å; T149-E152 WeakPolarHBondContact OG1-CG 3.17Å; T149-E152 PolarHBondContact OG1-N 2.82Å; T149-E152 PolarHBondContact OG1-OE2 3.3Å; T149-T153 PolarHBondContact O-N 3.21Å |
| 150 | D | 92.7 | Very high | 94.3 | Very high | 67 Ų | 67 | 85.5 Ų | 85.5 | 36% | 0.358 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -65.3 | -26.9 | 175 | -51.2 | -48.5 | 0 | 0 | 0 | 111.9 | V138 F139 T142 E152 T153 I154 | V138-D150 HydrophobicContact CG1-CB 4.24Å; F139-D150 WeakPolarHBondContact CD1-OD1 3.31Å; F139-D150 WeakPolarHBondContact CE1-OD2 3.46Å; T142-D150 PolarHBondContact OG1-OD1 3.17Å; D150-E152 VanDerWaalsContact C-N 3.34Å; D150-E152 PolarHBondContact O-N 2.92Å; D150-T153 PolarHBondContact O-N 3.42Å; D150-I154 VanDerWaalsContact O-CG1 3.31Å; D150-I154 WeakPolarHBondContact O-CG1 3.36Å; D150-I154 PolarHBondContact O-N 2.9Å |
| 151 | G | 92 | Very high | 94 | Very high | 40 Ų | 40 | 81.6 Ų | 81.6 | 41% | 0.412 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -58.2 | -45.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | T149 T153 I154 E155 | T149-G151 PolarHBondContact O-N 2.99Å; G151-T153 PolarHBondContact O-N 3.35Å; G151-I154 PolarHBondContact O-N 3.25Å; G151-E155 WeakPolarHBondContact O-CG 3.45Å; G151-E155 PolarHBondContact O-N 2.95Å |
| 152 | E | 94.2 | Very high | 93.7 | Very high | 73 Ų | 73 | 85.2 Ų | 85.2 | 34% | 0.341 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -63.2 | -40.8 | 176.2 | -68.3 | 164.6 | 151.8 | 0 | 0 | 111.6 | H147 K148 T149 D150 I154 E155 W156 | H147-E152 HydrophobicContact CB-CB 4.06Å; K148-E152 WeakPolarHBondContact CA-OE2 3.03Å; K148-E152 PolarHBondContact N-OE2 3.25Å; T149-E152 PolarHBondContact N-OE2 3.47Å; T149-E152 PolarHBondContact O-N 3.15Å; T149-E152 WeakPolarHBondContact OG1-CG 3.17Å; T149-E152 PolarHBondContact OG1-N 2.82Å; T149-E152 PolarHBondContact OG1-OE2 3.3Å; D150-E152 VanDerWaalsContact C-N 3.34Å; D150-E152 PolarHBondContact O-N 2.92Å; E152-I154 VanDerWaalsContact C-N 3.35Å; E152-I154 PolarHBondContact O-N 3.37Å; E152-E155 PolarHBondContact O-N 3.33Å; E152-W156 WeakPolarHBondContact O-CB 3.4Å; E152-W156 PolarHBondContact O-N 3.24Å |
| 153 | T | 96.3 | Very high | 93.3 | Very high | 0 Ų | 0 | 89 Ų | 89 | 0% | 0 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -63.4 | -40.3 | 175.7 | -54.7 | 0 | 0 | 0 | 0 | 111.9 | V138 L141 T142 L145 H147 T149 D150 G151 L157 | V138-T153 HydrophobicContact CG1-CG2 4.17Å; L141-T153 HydrophobicContact CB-CG2 4.05Å; L141-T153 HydrophobicContact CD2-CG2 3.72Å; L141-T153 HydrophobicContact CG-CG2 3.86Å; T142-T153 WeakPolarHBondContact CA-OG1 3.36Å; T142-T153 WeakPolarHBondContact CB-OG1 3.4Å; T142-T153 WeakPolarHBondContact OG1-CB 3.48Å; T142-T153 PolarHBondContact OG1-OG1 2.77Å; L145-T153 HydrophobicContact CD1-CG2 4.41Å; H147-T153 WeakPolarHBondContact ND1-CA 3.05Å; H147-T153 PolarHBondContact ND1-N 3.42Å; H147-T153 PolarHBondContact ND1-OG1 3.27Å; T149-T153 PolarHBondContact O-N 3.21Å; D150-T153 PolarHBondContact O-N 3.42Å; G151-T153 PolarHBondContact O-N 3.35Å; T153-L157 WeakPolarHBondContact O-CB 3.41Å; T153-L157 WeakPolarHBondContact O-CG 3.48Å; T153-L157 PolarHBondContact O-N 3.43Å |
| 154 | I | 93.4 | Very high | 92.9 | Very high | 74 Ų | 74 | 82 Ų | 82 | 38% | 0.379 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -68.5 | -42.1 | 175.4 | -63.7 | -56.2 | 0 | 0 | 0 | 111.1 | V138 D150 G151 E152 W156 L157 L158 | V138-I154 HydrophobicContact CG1-CD1 4.12Å; V138-I154 HydrophobicContact CG2-CD1 3.98Å; D150-I154 VanDerWaalsContact O-CG1 3.31Å; D150-I154 WeakPolarHBondContact O-CG1 3.36Å; D150-I154 PolarHBondContact O-N 2.9Å; G151-I154 PolarHBondContact O-N 3.25Å; E152-I154 VanDerWaalsContact C-N 3.35Å; E152-I154 PolarHBondContact O-N 3.37Å; I154-W156 VanDerWaalsContact C-N 3.32Å; I154-W156 PolarHBondContact O-N 2.85Å; I154-L157 HydrophobicContact CD1-CD1 4.16Å; I154-L157 PolarHBondContact O-N 3.07Å; I154-L158 HydrophobicContact CG2-CD1 4.15Å; I154-L158 HydrophobicContact CG2-CG 4.42Å; I154-L158 VanDerWaalsContact O-CG 3.31Å; I154-L158 WeakPolarHBondContact O-CG 3.33Å; I154-L158 PolarHBondContact O-N 3.25Å |
| 155 | E | 92.2 | Very high | 92.4 | Very high | 125 Ų | 125 | 78.4 Ų | 78.4 | 58% | 0.584 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -58.9 | -44.7 | 175 | -75.9 | 175.6 | -173.6 | 0 | 0 | 111.4 | G151 E152 L158 Q159 | G151-E155 WeakPolarHBondContact O-CG 3.45Å; G151-E155 PolarHBondContact O-N 2.95Å; E152-E155 PolarHBondContact O-N 3.33Å; E155-L158 PolarHBondContact O-N 3Å; E155-Q159 WeakPolarHBondContact O-CG 3.47Å; E155-Q159 PolarHBondContact O-N 2.92Å |
| 156 | W | 95.9 | Very high | 92 | Very high | 81 Ų | 81 | 79.3 Ų | 79.3 | 31% | 0.307 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -62.4 | -44.3 | 175 | 179.7 | 89.9 | 0 | 0 | 0 | 112.4 | L141 L145 H147 E152 I154 L158 Q159 Q160 | L141-W156 HydrophobicContact CD1-CZ3 4.41Å; L141-W156 HydrophobicContact CD2-CE3 4.2Å; L141-W156 HydrophobicContact CD2-CZ3 3.9Å; L145-W156 HydrophobicContact CD1-CD2 3.61Å; L145-W156 HydrophobicContact CD1-CE3 3.57Å; L145-W156 HydrophobicContact CD1-CG 4.08Å; L145-W156 HydrophobicContact CD1-CH2 4.38Å; L145-W156 HydrophobicContact CD1-CZ2 4.41Å; L145-W156 HydrophobicContact CD1-CZ3 3.99Å; L145-W156 HydrophobicContact CD2-CH2 4.27Å; L145-W156 HydrophobicContact CD2-CZ2 4Å; H147-W156 AromaticContact CE1-CG 3.92Å; E152-W156 WeakPolarHBondContact O-CB 3.4Å; E152-W156 PolarHBondContact O-N 3.24Å; I154-W156 VanDerWaalsContact C-N 3.32Å; I154-W156 PolarHBondContact O-N 2.85Å; W156-L158 VanDerWaalsContact C-N 3.26Å; W156-L158 PolarHBondContact O-N 3.38Å; W156-Q159 PolarHBondContact O-N 3.06Å; W156-Q160 HydrophobicContact CD2-CG 4.04Å; W156-Q160 HydrophobicContact CE3-CG 4.24Å; W156-Q160 HydrophobicContact CH2-CG 3.98Å; W156-Q160 HydrophobicContact CZ2-CG 3.76Å; W156-Q160 HydrophobicContact CZ3-CG 4.21Å; W156-Q160 WeakPolarHBondContact O-CG 3.18Å; W156-Q160 PolarHBondContact O-N 2.88Å |
| 157 | L | 95.1 | Very high | 91.5 | Very high | 66 Ų | 66 | 80.5 Ų | 80.5 | 35% | 0.346 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -59.8 | -38.3 | 174.8 | -79.7 | 170.6 | 0 | 0 | 0 | 111.8 | L141 T153 I154 A161 | L141-L157 HydrophobicContact CD2-CD1 4Å; L141-L157 HydrophobicContact CD2-CD2 3.74Å; L141-L157 HydrophobicContact CD2-CG 3.89Å; T153-L157 WeakPolarHBondContact O-CB 3.41Å; T153-L157 WeakPolarHBondContact O-CG 3.48Å; T153-L157 PolarHBondContact O-N 3.43Å; I154-L157 HydrophobicContact CD1-CD1 4.16Å; I154-L157 PolarHBondContact O-N 3.07Å; L157-A161 WeakPolarHBondContact O-CB 3.31Å; L157-A161 PolarHBondContact O-N 3.35Å |
| 158 | L | 91.6 | Very high | 90.9 | Very high | 99 Ų | 99 | 82.1 Ų | 82.1 | 52% | 0.518 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -67.8 | -40 | 177.8 | -72.2 | 173.4 | 0 | 0 | 0 | 111.9 | I154 E155 W156 A161 E162 | I154-L158 HydrophobicContact CG2-CD1 4.15Å; I154-L158 HydrophobicContact CG2-CG 4.42Å; I154-L158 VanDerWaalsContact O-CG 3.31Å; I154-L158 WeakPolarHBondContact O-CG 3.33Å; I154-L158 PolarHBondContact O-N 3.25Å; E155-L158 PolarHBondContact O-N 3Å; W156-L158 VanDerWaalsContact C-N 3.26Å; W156-L158 PolarHBondContact O-N 3.38Å; L158-A161 CarbonylContact O-C 3.53Å; L158-A161 PolarHBondContact O-N 2.77Å; L158-E162 WeakPolarHBondContact O-CG 3.49Å; L158-E162 PolarHBondContact O-N 2.84Å |
| 159 | Q | 91.4 | Very high | 90.3 | Very high | 108 Ų | 108 | 75.7 Ų | 75.7 | 51% | 0.505 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.4 | -47.6 | 173.8 | -71.8 | 172.3 | -1.6 | 0 | 0 | 111.6 | E155 W156 A161 E162 | E155-Q159 WeakPolarHBondContact O-CG 3.47Å; E155-Q159 PolarHBondContact O-N 2.92Å; W156-Q159 PolarHBondContact O-N 3.06Å; Q159-A161 PolarHBondContact O-N 2.64Å; Q159-E162 VanDerWaalsContact O-CB 3.29Å; Q159-E162 WeakPolarHBondContact O-CB 3.38Å; Q159-E162 WeakPolarHBondContact O-CG 3.45Å; Q159-E162 PolarHBondContact O-N 3.3Å; Q159-E162 VanDerWaalsContact O-N 3.13Å |
| 160 | Q | 92.1 | Very high | 89.5 | Confident | 119 Ų | 119 | 75.5 Ų | 75.5 | 56% | 0.556 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -65.8 | -29.3 | 177 | -64.2 | -55 | -47.9 | 0 | 0 | 112.4 | W156 E162 P163 | W156-Q160 HydrophobicContact CD2-CG 4.04Å; W156-Q160 HydrophobicContact CE3-CG 4.24Å; W156-Q160 HydrophobicContact CH2-CG 3.98Å; W156-Q160 HydrophobicContact CZ2-CG 3.76Å; W156-Q160 HydrophobicContact CZ3-CG 4.21Å; W156-Q160 WeakPolarHBondContact O-CG 3.18Å; W156-Q160 PolarHBondContact O-N 2.88Å; Q160-E162 VanDerWaalsContact C-N 3.34Å; Q160-P163 WeakPolarHBondContact O-CD 3.33Å |
| 161 | A | 91.2 | Very high | 88.5 | Confident | 34 Ų | 34 | 75.5 Ų | 75.5 | 28% | 0.281 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -81.4 | -8.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | L157 L158 Q159 P163 A164 I165 | L157-A161 WeakPolarHBondContact O-CB 3.31Å; L157-A161 PolarHBondContact O-N 3.35Å; L158-A161 CarbonylContact O-C 3.53Å; L158-A161 PolarHBondContact O-N 2.77Å; Q159-A161 PolarHBondContact O-N 2.64Å; A161-P163 VanDerWaalsContact C-CD 3.45Å; A161-A164 CarbonylContact O-C 3.59Å; A161-A164 WeakPolarHBondContact O-CA 3.36Å; A161-A164 WeakPolarHBondContact O-CB 2.91Å; A161-A164 PolarHBondContact O-N 3.01Å; A161-I165 HydrophobicContact CB-CD1 3.92Å; A161-I165 HydrophobicContact CB-CG1 4.29Å; A161-I165 VanDerWaalsContact O-CG1 3.27Å; A161-I165 WeakPolarHBondContact O-CG1 3.4Å; A161-I165 PolarHBondContact O-N 3.18Å |
| 162 | E | 89.3 | Confident | 87.2 | Confident | 112 Ų | 112 | 74.5 Ų | 74.5 | 52% | 0.523 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -49.7 | -47.8 | 179.9 | -74.9 | 176.2 | -168.1 | 0 | 0 | 113.1 | L158 Q159 Q160 A164 I165 V166 | L158-E162 WeakPolarHBondContact O-CG 3.49Å; L158-E162 PolarHBondContact O-N 2.84Å; Q159-E162 VanDerWaalsContact O-CB 3.29Å; Q159-E162 WeakPolarHBondContact O-CB 3.38Å; Q159-E162 WeakPolarHBondContact O-CG 3.45Å; Q159-E162 PolarHBondContact O-N 3.3Å; Q159-E162 VanDerWaalsContact O-N 3.13Å; Q160-E162 VanDerWaalsContact C-N 3.34Å; E162-A164 VanDerWaalsContact C-N 3.29Å; E162-A164 PolarHBondContact O-N 3.42Å; E162-I165 PolarHBondContact O-N 3.09Å; E162-V166 VanDerWaalsContact O-CG2 3.31Å; E162-V166 WeakPolarHBondContact O-CG2 3.45Å; E162-V166 PolarHBondContact O-N 2.86Å |
| 163 | P | 87.6 | Confident | 86 | Confident | 93 Ų | 93 | 77 Ų | 77 | 60% | 0.604 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -60.9 | -39.1 | 178.7 | -21.6 | 34.1 | 0 | 0 | 0 | 112.4 | Q160 A161 A167 | Q160-P163 WeakPolarHBondContact O-CD 3.33Å; A161-P163 VanDerWaalsContact C-CD 3.45Å; P163-A167 WeakPolarHBondContact O-CB 3.34Å; P163-A167 PolarHBondContact O-N 3.35Å |
| 164 | A | 89 | Confident | 84.4 | Confident | 66 Ų | 66 | 80.4 Ų | 80.4 | 55% | 0.545 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -71.2 | -39.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | A161 E162 A167 A168 | A161-A164 CarbonylContact O-C 3.59Å; A161-A164 WeakPolarHBondContact O-CA 3.36Å; A161-A164 WeakPolarHBondContact O-CB 2.91Å; A161-A164 PolarHBondContact O-N 3.01Å; E162-A164 VanDerWaalsContact C-N 3.29Å; E162-A164 PolarHBondContact O-N 3.42Å; A164-A167 PolarHBondContact O-N 3.07Å; A164-A168 VanDerWaalsContact O-CB 3.29Å; A164-A168 WeakPolarHBondContact O-CB 3.48Å; A164-A168 PolarHBondContact O-N 3.29Å |
| 165 | I | 86 | Confident | 83 | Confident | 55 Ų | 55 | 80.7 Ų | 80.7 | 28% | 0.282 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.5 | -43.4 | 177 | -67.6 | 164.2 | 0 | 0 | 0 | 110.3 | A161 E162 A168 T169 | A161-I165 HydrophobicContact CB-CD1 3.92Å; A161-I165 HydrophobicContact CB-CG1 4.29Å; A161-I165 VanDerWaalsContact O-CG1 3.27Å; A161-I165 WeakPolarHBondContact O-CG1 3.4Å; A161-I165 PolarHBondContact O-N 3.18Å; E162-I165 PolarHBondContact O-N 3.09Å; I165-A168 PolarHBondContact O-N 3.48Å; I165-T169 WeakPolarHBondContact O-CB 3.37Å; I165-T169 PolarHBondContact O-N 3.26Å; I165-T169 PolarHBondContact O-OG1 3.37Å |
| 166 | V | 85.2 | Confident | 81.5 | Confident | 77 Ų | 77 | 79.6 Ų | 79.6 | 47% | 0.467 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.2 | -46.9 | 177.8 | 173.2 | 0 | 0 | 0 | 0 | 110.6 | E162 A168 T169 G170 | E162-V166 VanDerWaalsContact O-CG2 3.31Å; E162-V166 WeakPolarHBondContact O-CG2 3.45Å; E162-V166 PolarHBondContact O-N 2.86Å; V166-A168 VanDerWaalsContact C-N 3.3Å; V166-A168 PolarHBondContact O-N 2.92Å; V166-T169 PolarHBondContact O-N 2.8Å; V166-G170 VanDerWaalsContact O-CA 3.32Å; V166-G170 WeakPolarHBondContact O-CA 3.44Å; V166-G170 PolarHBondContact O-N 3.12Å |
| 167 | A | 85.2 | Confident | 79.7 | Confident | 86 Ų | 86 | 80.6 Ų | 80.6 | 71% | 0.711 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -60.5 | -39.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | P163 A164 | P163-A167 WeakPolarHBondContact O-CB 3.34Å; P163-A167 PolarHBondContact O-N 3.35Å; A164-A167 PolarHBondContact O-N 3.07Å |
| 168 | A | 82.9 | Confident | 77.7 | Confident | 88 Ų | 88 | 85.7 Ų | 85.7 | 73% | 0.727 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -77.7 | -35.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | A164 I165 V166 | A164-A168 VanDerWaalsContact O-CB 3.29Å; A164-A168 WeakPolarHBondContact O-CB 3.48Å; A164-A168 PolarHBondContact O-N 3.29Å; I165-A168 PolarHBondContact O-N 3.48Å; V166-A168 VanDerWaalsContact C-N 3.3Å; V166-A168 PolarHBondContact O-N 2.92Å |
| 169 | T | 81.4 | Confident | 75.7 | Confident | 57 Ų | 57 | 82.3 Ų | 82.3 | 35% | 0.35 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -101.3 | -15.6 | -171.2 | -39.2 | 0 | 0 | 0 | 0 | 112.5 | I165 V166 T171 | I165-T169 WeakPolarHBondContact O-CB 3.37Å; I165-T169 PolarHBondContact O-N 3.26Å; I165-T169 PolarHBondContact O-OG1 3.37Å; V166-T169 PolarHBondContact O-N 2.8Å; T169-T171 PolarHBondContact O-N 3.02Å; T169-T171 PolarHBondContact O-OG1 3.45Å |
| 170 | G | 75.1 | Confident | 73.8 | Confident | 65 Ų | 65 | 81.9 Ų | 81.9 | 67% | 0.67 | 53% | 0.525 | S | S | * | . | S | Bend | trans | 61.9 | -2 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | V166 | V166-G170 VanDerWaalsContact O-CA 3.32Å; V166-G170 WeakPolarHBondContact O-CA 3.44Å; V166-G170 PolarHBondContact O-N 3.12Å |
| 171 | T | 71.5 | Confident | 71.8 | Confident | 68 Ų | 68 | 83.3 Ų | 83.3 | 42% | 0.417 | 54% | 0.535 | S | S | . | . | S | Bend | trans | -134.5 | -7.5 | -168.9 | 48.1 | 0 | 0 | 0 | 0 | 114.2 | T169 I174 | T169-T171 PolarHBondContact O-N 3.02Å; T169-T171 PolarHBondContact O-OG1 3.45Å; T171-I174 VanDerWaalsContact CB-CD1 3.45Å; T171-I174 HydrophobicContact CG2-CD1 3.82Å; T171-I174 WeakPolarHBondContact OG1-CD1 3.04Å |
| 172 | G | 64.5 | Low | 70 | Confident | 19 Ų | 19 | 82.6 Ų | 82.6 | 20% | 0.196 | 53% | 0.53 | C | S | . | . | S | Bend | trans | 59.2 | 107.4 | -180 | 0 | 0 | 0 | 0 | 0 | 112.4 | I174 | G172-I174 PolarHBondContact O-N 2.85Š|
| 173 | T | 70.1 | Confident | 68.3 | Low | 124 Ų | 124 | 81.5 Ų | 81.5 | 76% | 0.761 | 53% | 0.531 | S | S | * | . | S | Bend | trans | 68 | 13.1 | 164.3 | 73.9 | 0 | 0 | 0 | 0 | 118.6 | P175 | T173-P175 WeakPolarHBondContact O-CD 3.14Š|
| 174 | I | 61.1 | Low | 66.4 | Low | 72 Ų | 72 | 81 Ų | 81 | 37% | 0.369 | 53% | 0.529 | S | S | . | . | | | trans | -61.4 | 114.1 | 174.3 | -60 | -175.6 | 0 | 0 | 0 | 109.5 | T171 G172 A176 | T171-I174 VanDerWaalsContact CB-CD1 3.45Å; T171-I174 HydrophobicContact CG2-CD1 3.82Å; T171-I174 WeakPolarHBondContact OG1-CD1 3.04Å; G172-I174 PolarHBondContact O-N 2.85Å; I174-A176 PolarHBondContact O-N 3.18Å |
| 175 | P | 63.7 | Low | 64.7 | Low | 81 Ų | 81 | 84.2 Ų | 84.2 | 53% | 0.526 | 54% | 0.536 | S | S | . | . | | | trans | -66.3 | 138.7 | 179 | 26.6 | -31.4 | 0 | 0 | 0 | 109.4 | T173 N177 F178 | T173-P175 WeakPolarHBondContact O-CD 3.14Å; P175-N177 PolarHBondContact O-N 3.31Å; P175-F178 PolarHBondContact O-N 3.18Å |
| 176 | A | 61.1 | Low | 63.2 | Low | 102 Ų | 102 | 87.4 Ų | 87.4 | 84% | 0.843 | 55% | 0.545 | S | S | * | . | G | 310 helix | trans | -56 | -12.8 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | I174 F178 | I174-A176 PolarHBondContact O-N 3.18Å; A176-F178 PolarHBondContact O-N 2.96Å |
| 177 | N | 59 | Low | 61.5 | Low | 102 Ų | 102 | 88 Ų | 88 | 55% | 0.545 | 55% | 0.552 | S | S | . | * | G | 310 helix | trans | -78.2 | -7.9 | -176.8 | -142.2 | -47.8 | 0 | 0 | 0 | 115.1 | E122 P175 | E122-N177 WeakPolarHBondContact CG-ND2 3.37Å; P175-N177 PolarHBondContact O-N 3.31Å |
| 178 | F | 53.5 | Low | 59.8 | Low | 172 Ų | 172 | 87.8 Ų | 87.8 | 75% | 0.754 | 55% | 0.55 | S | S | * | * | G | 310 helix | trans | -124 | 14.4 | 178.6 | -74.8 | -82.3 | 0 | 0 | 0 | 114.9 | P175 A176 | P175-F178 PolarHBondContact O-N 3.18Å; A176-F178 PolarHBondContact O-N 2.96Å |
| 179 | S | 49.3 | Very low | 58.3 | Low | 28 Ų | 28 | 87.3 Ų | 87.3 | 20% | 0.196 | 55% | 0.547 | C | S | . | . | | | trans | -135.6 | 30.7 | -161.3 | -119.1 | 0 | 0 | 0 | 0 | 118 | L181 A182 | S179-L181 PolarHBondContact O-N 3.35Å; S179-A182 PolarHBondContact O-N 2.9Å; S179-A182 WeakPolarHBondContact OG-CB 3.25Å |
| 180 | S | 50.2 | Low | 56.6 | Low | 99 Ų | 99 | 87.4 Ų | 87.4 | 69% | 0.692 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -65.4 | -15.7 | 163.8 | 55.5 | 0 | 0 | 0 | 0 | 113.2 | | |
| 181 | L | 50.9 | Low | 55.2 | Low | 149 Ų | 149 | 87.7 Ų | 87.7 | 78% | 0.78 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -87.9 | -16.4 | 178.7 | -62.1 | 176.2 | 0 | 0 | 0 | 114 | S179 | S179-L181 PolarHBondContact O-N 3.35Å |
| 182 | A | 53.3 | Low | 53.8 | Low | 20 Ų | 20 | 89.1 Ų | 89.1 | 17% | 0.165 | 57% | 0.568 | C | S | . | * | H | α-helix | trans | -92.5 | -18.3 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | S179 R186 | S179-A182 PolarHBondContact O-N 2.9Å; S179-A182 WeakPolarHBondContact OG-CB 3.25Å; A182-R186 VanDerWaalsContact CB-NH2 3.3Å; A182-R186 WeakPolarHBondContact O-CG 3.41Å; A182-R186 PolarHBondContact O-NE 3Å; A182-R186 PolarHBondContact O-NH2 3.21Å |
| 183 | V | 53 | Low | 52.9 | Low | 89 Ų | 89 | 95.7 Ų | 95.7 | 54% | 0.539 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -71.6 | -39.6 | 170.9 | -179.4 | 0 | 0 | 0 | 0 | 110.2 | L185 R186 S187 | V183-L185 PolarHBondContact O-N 2.99Å; V183-R186 PolarHBondContact O-N 3.35Å; V183-S187 PolarHBondContact O-N 3.31Å; V183-S187 VanDerWaalsContact O-N 3.13Å; V183-S187 PolarHBondContact O-OG 2.85Å |
| 184 | S | 49.1 | Very low | 51.9 | Low | 83 Ų | 83 | 96.5 Ų | 96.5 | 58% | 0.58 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -69.3 | -30.9 | 179.9 | -56.2 | 0 | 0 | 0 | 0 | 113.8 | A188 | S184-A188 PolarHBondContact O-N 3.41Å |
| 185 | L | 52.9 | Low | 51.1 | Low | 132 Ų | 132 | 97.8 Ų | 97.8 | 69% | 0.691 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -78.6 | -22.4 | 178.7 | -157.4 | 66.6 | 0 | 0 | 0 | 113 | V183 A189 | V183-L185 PolarHBondContact O-N 2.99Å; L185-A189 WeakPolarHBondContact O-CB 3.42Å; L185-A189 PolarHBondContact O-N 3.12Å |
| 186 | R | 54.2 | Low | 50.2 | Low | 123 Ų | 123 | 99.2 Ų | 99.2 | 46% | 0.464 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -88.3 | -26.7 | 176.9 | -66.4 | -176.4 | -77.3 | -103 | 3.4 | 112.8 | A182 V183 A188 G190 | A182-R186 VanDerWaalsContact CB-NH2 3.3Å; A182-R186 WeakPolarHBondContact O-CG 3.41Å; A182-R186 PolarHBondContact O-NE 3Å; A182-R186 PolarHBondContact O-NH2 3.21Å; V183-R186 PolarHBondContact O-N 3.35Å; R186-A188 VanDerWaalsContact C-N 3.3Å; R186-G190 PolarHBondContact O-N 3.12Å; R186-G190 VanDerWaalsContact O-N 3.1Å |
| 187 | S | 49.5 | Very low | 49.2 | Very low | 89 Ų | 89 | 98.4 Ų | 98.4 | 62% | 0.622 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -72.2 | -22.1 | 168.5 | -63.2 | 0 | 0 | 0 | 0 | 113.2 | V183 | V183-S187 PolarHBondContact O-N 3.31Å; V183-S187 VanDerWaalsContact O-N 3.13Å; V183-S187 PolarHBondContact O-OG 2.85Å |
| 188 | A | 50.5 | Low | 48.5 | Very low | 81 Ų | 81 | 98.5 Ų | 98.5 | 67% | 0.669 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -90.4 | -22.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 114 | S184 R186 | S184-A188 PolarHBondContact O-N 3.41Å; R186-A188 VanDerWaalsContact C-N 3.3Å |
| 189 | A | 51.2 | Low | 48 | Very low | 78 Ų | 78 | 101.1 Ų | 101.1 | 65% | 0.645 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -104.3 | 2.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | L185 | L185-A189 WeakPolarHBondContact O-CB 3.42Å; L185-A189 PolarHBondContact O-N 3.12Å |
| 190 | G | 45.2 | Very low | 47.8 | Very low | 60 Ų | 60 | 105 Ų | 105 | 62% | 0.619 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -114.5 | 6.5 | -176.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | R186 | R186-G190 PolarHBondContact O-N 3.12Å; R186-G190 VanDerWaalsContact O-N 3.1Å |
| 191 | A | 45.2 | Very low | 47.7 | Very low | 71 Ų | 71 | 106 Ų | 106 | 59% | 0.587 | 67% | 0.67 | S | S | * | * | | | trans | -94.6 | 9.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114 | H193 | A191-H193 PolarHBondContact O-CD2 2.96Å; A191-H193 PolarHBondContact O-NE2 3.27Å |
| 192 | S | 42 | Very low | 47.5 | Very low | 98 Ų | 98 | 103.4 Ų | 103.4 | 69% | 0.685 | 67% | 0.67 | S | S | * | * | | | trans | -105.7 | 87.7 | 170.3 | 59.4 | 0 | 0 | 0 | 0 | 110.2 | | |
| 193 | H | 46.8 | Very low | 47.3 | Very low | 157 Ų | 157 | 111.9 Ų | 111.9 | 73% | 0.727 | 70% | 0.703 | S | S | * | * | | | trans | -47.3 | 128.2 | 160.6 | -36.8 | -91.1 | 0 | 0 | 0 | 110.7 | A191 S195 | A191-H193 PolarHBondContact O-CD2 2.96Å; A191-H193 PolarHBondContact O-NE2 3.27Å; H193-S195 PolarHBondContact O-N 2.97Å |
| 194 | P | 48.3 | Very low | 46.9 | Very low | 140 Ų | 140 | 116.7 Ų | 116.7 | 91% | 0.909 | 72% | 0.72 | S | S | * | * | | | trans | -89.3 | 67.3 | 152 | 34.7 | -28.4 | 0 | 0 | 0 | 107.4 | | |
| 195 | S | 45.4 | Very low | 46.6 | Very low | 100 Ų | 100 | 120.3 Ų | 120.3 | 70% | 0.699 | 73% | 0.727 | S | S | * | * | | | trans | -112.5 | 110.7 | 169.3 | -174.6 | 0 | 0 | 0 | 0 | 107.6 | H193 | H193-S195 PolarHBondContact O-N 2.97Š|
| 196 | S | 42.9 | Very low | 46.3 | Very low | 111 Ų | 111 | 120.9 Ų | 120.9 | 78% | 0.776 | 73% | 0.73 | S | S | * | * | S | Bend | trans | 74.3 | 119.8 | 165.2 | -153.2 | 0 | 0 | 0 | 0 | 118.1 | | |
| 197 | A | 40.2 | Very low | 46.4 | Very low | 84 Ų | 84 | 120.2 Ų | 120.2 | 69% | 0.694 | 74% | 0.742 | S | S | * | * | | | trans | 60.2 | 120.5 | 143 | 0 | 0 | 0 | 0 | 0 | 119.1 | | |
| 198 | S | 44.2 | Very low | 47.1 | Very low | 105 Ų | 105 | 121.4 Ų | 121.4 | 73% | 0.734 | 75% | 0.747 | S | S | * | * | | | trans | 131.3 | 108.1 | 138.5 | -57.6 | 0 | 0 | 0 | 0 | 114.6 | | |
| 199 | R | 43.6 | Very low | 47.2 | Very low | 227 Ų | 227 | 122.3 Ų | 122.3 | 86% | 0.857 | 75% | 0.746 | S | S | * | * | | | trans | 73.7 | 90.8 | 136 | -56 | 171.3 | 97.5 | 166.4 | 5.2 | 116.8 | V201 | R199-V201 PolarHBondContact O-N 3.4Å; R199-V201 VanDerWaalsContact O-N 3.15Å |
| 200 | A | 45.6 | Very low | 47 | Very low | 109 Ų | 109 | 125.8 Ų | 125.8 | 90% | 0.901 | 75% | 0.749 | S | S | * | * | | | trans | -58.8 | 110.1 | 152.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | A202 | A200-A202 PolarHBondContact O-N 3.32Š|
| 201 | V | 46.8 | Very low | 47.1 | Very low | 121 Ų | 121 | 130.7 Ų | 130.7 | 73% | 0.733 | 76% | 0.756 | S | S | * | * | | | trans | -89.6 | 90.9 | 165.3 | -76.2 | 0 | 0 | 0 | 0 | 107.7 | R199 | R199-V201 PolarHBondContact O-N 3.4Å; R199-V201 VanDerWaalsContact O-N 3.15Å |
| 202 | A | 48.3 | Very low | 47.1 | Very low | 93 Ų | 93 | 136 Ų | 136 | 77% | 0.769 | 77% | 0.768 | S | S | * | * | | | trans | -79.7 | 115.2 | 166.3 | 0 | 0 | 0 | 0 | 0 | 108 | A200 H204 | A200-A202 PolarHBondContact O-N 3.32Å; A202-H204 PolarHBondContact O-N 2.93Å |
| 203 | F | 49.4 | Very low | 47.3 | Very low | 198 Ų | 198 | 137.6 Ų | 137.6 | 87% | 0.868 | 77% | 0.774 | S | S | * | * | | | trans | -63.7 | 126.8 | 172.5 | -79.5 | -89.8 | 0 | 0 | 0 | 110.1 | | |
| 204 | H | 43.6 | Very low | 47.1 | Very low | 190 Ų | 190 | 134.5 Ų | 134.5 | 88% | 0.88 | 78% | 0.775 | S | S | * | * | | | trans | -44 | 141.6 | 169.2 | -77.2 | -94.2 | 0 | 0 | 0 | 113.2 | A202 | A202-H204 PolarHBondContact O-N 2.93Š|
| 205 | H | 43.2 | Very low | 47.5 | Very low | 160 Ų | 160 | 132.1 Ų | 132.1 | 74% | 0.741 | 77% | 0.767 | S | S | * | * | | | | 170.2 | 105.9 | 118.2 | 174.4 | -48.9 | 0 | 0 | 0 | 113.2 | | |
| 206 | L | 45.9 | Very low | 47.4 | Very low | 143 Ų | 143 | 135.6 Ų | 135.6 | 75% | 0.749 | 78% | 0.775 | S | S | * | * | | | trans | 77.5 | 147.6 | 147.8 | -74.9 | 80.6 | 0 | 0 | 0 | 124 | | |
| 207 | P | 56.9 | Low | 48 | Very low | 110 Ų | 110 | 138.4 Ų | 138.4 | 71% | 0.714 | 78% | 0.78 | S | S | * | * | | | trans | -132.8 | -155 | -140.6 | 47.6 | -25.6 | 0 | 0 | 0 | 113.1 | | |
| 208 | P | 64.6 | Low | 48 | Very low | 114 Ų | 114 | 137.4 Ų | 137.4 | 74% | 0.74 | 78% | 0.778 | S | S | * | * | | | | -113.2 | -164.5 | -122.7 | 39 | -14.9 | 0 | 0 | 0 | 111.4 | | |
| 209 | P | 51.4 | Low | 48.1 | Very low | 99 Ų | 99 | 145 Ų | 145 | 64% | 0.643 | 79% | 0.791 | S | S | * | * | | | | -145.1 | 174.7 | 65.1 | 20.6 | 8.2 | 0 | 0 | 0 | 112.9 | | |
| 210 | Q | 46.8 | Very low | 48.4 | Very low | 152 Ų | 152 | 141.3 Ų | 141.3 | 71% | 0.71 | 79% | 0.788 | S | S | * | * | | | | 168 | 125.1 | 90.9 | -68.8 | -94.9 | -25.3 | 0 | 0 | 108.7 | | |
| 211 | H | 48.2 | Very low | 48.5 | Very low | 162 Ų | 162 | 144.1 Ų | 144.1 | 75% | 0.75 | 78% | 0.782 | S | S | * | * | | | trans | 50.5 | 108.7 | 144.1 | -60.5 | -93 | 0 | 0 | 0 | 123 | | |
| 212 | E | 45.2 | Very low | 48.6 | Very low | 183 Ų | 183 | 147.2 Ų | 147.2 | 86% | 0.855 | 79% | 0.789 | S | S | * | * | | | | -171.4 | 95.4 | 125.6 | -114 | -175.9 | 146.4 | 0 | 0 | 109.9 | | |
| 213 | V | 45.2 | Very low | 48.9 | Very low | 131 Ų | 131 | 152 Ų | 152 | 79% | 0.794 | 80% | 0.795 | S | S | * | * | | | | 28.6 | 95.9 | 104.4 | -57.6 | 0 | 0 | 0 | 0 | 115.8 | | |
| 214 | A | 44.3 | Very low | 49.1 | Very low | 93 Ų | 93 | 148 Ų | 148 | 77% | 0.769 | 79% | 0.789 | S | S | * | * | | | trans | 172.8 | 126.2 | 132.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | | |
| 215 | A | 55.5 | Low | 49.3 | Very low | 89 Ų | 89 | 147 Ų | 147 | 74% | 0.736 | 78% | 0.784 | S | S | * | * | | | trans | 56.5 | 85 | 144 | 0 | 0 | 0 | 0 | 0 | 116.1 | | |
| 216 | M | 42.6 | Very low | 49.8 | Very low | 173 Ų | 173 | 148.7 Ų | 148.7 | 85% | 0.852 | 79% | 0.792 | S | S | * | * | | | | 50.3 | 101.2 | 67.3 | -155.7 | 172.4 | 69.7 | 0 | 0 | 109.5 | | |
| 217 | L | 56.1 | Low | 50 | Low | 170 Ų | 170 | 149.1 Ų | 149.1 | 89% | 0.89 | 79% | 0.79 | S | S | * | * | | | trans | 159.2 | 96.1 | 140.3 | -79.8 | 162.8 | 0 | 0 | 0 | 111.6 | | |
| 218 | G | 40.5 | Very low | 49.4 | Very low | 64 Ų | 64 | 151.5 Ų | 151.5 | 66% | 0.66 | 79% | 0.792 | S | S | * | * | | | | 82.7 | 93.7 | 129.8 | 0 | 0 | 0 | 0 | 0 | 119.7 | | |
| 219 | W | 46.1 | Very low | 48.6 | Very low | 263 Ų | 263 | 153.9 Ų | 153.9 | 100% | 0.996 | 79% | 0.793 | S | S | * | * | | | trans | -152.7 | 65.8 | 136.8 | -132.9 | -76.5 | 0 | 0 | 0 | 110.5 | | |
| 220 | N | 50.4 | Low | 48.1 | Very low | 151 Ų | 151 | 155.7 Ų | 155.7 | 81% | 0.807 | 79% | 0.793 | S | S | * | * | | | trans | -107 | 118.5 | 168.8 | -113.7 | -25.8 | 0 | 0 | 0 | 108.9 | | |
| 221 | H | 47.2 | Very low | 48.1 | Very low | 167 Ų | 167 | 156.4 Ų | 156.4 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | | | | 64.9 | 93.8 | 129.9 | -138.1 | 87.1 | 0 | 0 | 0 | 117.5 | | |
| 222 | H | 49.7 | Very low | 47.5 | Very low | 187 Ų | 187 | 156.7 Ų | 156.7 | 87% | 0.866 | 80% | 0.802 | S | S | * | * | | | trans | -164.2 | 108.7 | 149.5 | -90.7 | 93.7 | 0 | 0 | 0 | 109.5 | | |
| 223 | H | 55 | Low | 48 | Very low | 194 Ų | 194 | 156.2 Ų | 156.2 | 90% | 0.898 | 81% | 0.805 | S | S | * | * | | | trans | -140.1 | 118.5 | 155.5 | -118.7 | -71 | 0 | 0 | 0 | 108.7 | | |
| 224 | P | 53 | Low | 49.1 | Very low | 114 Ų | 114 | 155.1 Ų | 155.1 | 74% | 0.74 | 80% | 0.801 | S | S | * | * | | | trans | -85.6 | 146.3 | -172.8 | 32.7 | -32.6 | 0 | 0 | 0 | 112.6 | | |
| 225 | H | 46.9 | Very low | 50.3 | Low | 169 Ų | 169 | 156.3 Ų | 156.3 | 78% | 0.782 | 80% | 0.8 | S | S | * | * | | | trans | -51.7 | 129 | 160.9 | -105.4 | -79.2 | 0 | 0 | 0 | 111.5 | | |
| 226 | Q | 53.8 | Low | 51 | Low | 195 Ų | 195 | 157.8 Ų | 157.8 | 91% | 0.911 | 80% | 0.802 | S | S | * | * | | | trans | -115.7 | 119 | 148.1 | -94.9 | -149 | 6 | 0 | 0 | 109.3 | | |
| 227 | Q | 50 | Low | 51.4 | Low | 151 Ų | 151 | 154.6 Ų | 154.6 | 71% | 0.706 | 80% | 0.795 | S | S | * | * | | | trans | -90.8 | 157.5 | 172.3 | -83.2 | -173 | -6.4 | 0 | 0 | 110.8 | | |
| 228 | Q | 44.2 | Very low | 51 | Low | 161 Ų | 161 | 155.9 Ų | 155.9 | 75% | 0.752 | 80% | 0.796 | S | S | * | * | | | trans | 86.6 | 120.3 | 145.6 | -87.8 | -179.4 | -1 | 0 | 0 | 120.1 | | |
| 229 | Q | 48.4 | Very low | 51.3 | Low | 163 Ų | 163 | 161.4 Ų | 161.4 | 76% | 0.762 | 81% | 0.805 | S | S | * | * | | | trans | 122.2 | 128.4 | 145.3 | -65.5 | -179 | 36.9 | 0 | 0 | 110.5 | | |
| 230 | Q | 41.6 | Very low | 50.9 | Low | 138 Ų | 138 | 157.7 Ų | 157.7 | 65% | 0.645 | 80% | 0.799 | S | S | * | * | | | cis | -175.5 | 151.3 | 4.5 | -112.9 | -179.7 | 89.3 | 0 | 0 | 105.2 | | |
| 231 | Q | 46.3 | Very low | 50.2 | Low | 167 Ų | 167 | 154.9 Ų | 154.9 | 78% | 0.78 | 80% | 0.796 | S | S | * | * | | | trans | 85.4 | 90.1 | 154.3 | -65.2 | -179.9 | 77.7 | 0 | 0 | 120.6 | | |
| 232 | L | 36.1 | Very low | 50.1 | Low | 167 Ų | 167 | 152.3 Ų | 152.3 | 87% | 0.874 | 79% | 0.794 | S | S | * | * | | | | 33.9 | 109.9 | 114.8 | -115.4 | 73.8 | 0 | 0 | 0 | 117.6 | | |
| 233 | L | 54.7 | Low | 49.6 | Very low | 174 Ų | 174 | 152.4 Ų | 152.4 | 91% | 0.911 | 80% | 0.795 | S | S | * | * | | | trans | -146 | 124.8 | 152.5 | -133.3 | 74 | 0 | 0 | 0 | 111.3 | | |
| 234 | P | 69.4 | Low | 49 | Very low | 108 Ų | 108 | 150.3 Ų | 150.3 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 163.6 | -174.3 | 34.5 | -34.3 | 0 | 0 | 0 | 113.4 | | |
| 235 | P | 69.2 | Low | 48.9 | Very low | 118 Ų | 118 | 151.1 Ų | 151.1 | 77% | 0.766 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 142.6 | 175.9 | 29.8 | -34 | 0 | 0 | 0 | 110.8 | | |
| 236 | P | 69.5 | Low | 48.9 | Very low | 119 Ų | 119 | 145.6 Ų | 145.6 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 147.4 | 179.2 | 27.1 | -32.4 | 0 | 0 | 0 | 111.7 | | |
| 237 | P | 51.2 | Low | 48.4 | Very low | 107 Ų | 107 | 139.8 Ų | 139.8 | 70% | 0.695 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 140.2 | -168.6 | 30 | -34.2 | 0 | 0 | 0 | 112.6 | Q239 | P237-Q239 PolarHBondContact O-N 3.44Å; P237-Q239 VanDerWaalsContact O-N 3.12Å |
| 238 | Q | 47.8 | Very low | 48.3 | Very low | 196 Ų | 196 | 135.2 Ų | 135.2 | 92% | 0.916 | 76% | 0.763 | S | S | * | * | | | trans | -67 | 101.1 | 163.1 | -67.4 | -174.4 | -13.4 | 0 | 0 | 108.7 | | |
| 239 | Q | 46.7 | Very low | 48.6 | Very low | 181 Ų | 181 | 133.7 Ų | 133.7 | 85% | 0.846 | 76% | 0.756 | S | S | * | * | | | trans | -91.5 | 117.9 | 169.3 | -93.3 | 171.3 | -5.6 | 0 | 0 | 110.2 | P237 | P237-Q239 PolarHBondContact O-N 3.44Å; P237-Q239 VanDerWaalsContact O-N 3.12Å |
| 240 | Q | 36.9 | Very low | 48.7 | Very low | 185 Ų | 185 | 131.6 Ų | 131.6 | 86% | 0.864 | 75% | 0.745 | S | S | * | * | | | trans | -74.7 | 146.7 | 170.1 | -72.8 | 163.1 | -41 | 0 | 0 | 111.2 | | |
| 241 | A | 36.2 | Very low | 49.2 | Very low | 92 Ų | 92 | 132.5 Ų | 132.5 | 76% | 0.76 | 75% | 0.751 | S | S | * | * | | | trans | 73.8 | 148 | 158.7 | 0 | 0 | 0 | 0 | 0 | 117.6 | | |
| 242 | P | 45.8 | Very low | 49.6 | Very low | 112 Ų | 112 | 134.7 Ų | 134.7 | 73% | 0.727 | 75% | 0.752 | S | S | * | * | | | cis | -125.6 | 137.5 | 20.4 | 20.6 | 3.4 | 0 | 0 | 0 | 116.2 | D244 | P242-D244 PolarHBondContact O-N 3.37Š|
| 243 | Q | 38.1 | Very low | 50.2 | Low | 190 Ų | 190 | 132.6 Ų | 132.6 | 89% | 0.888 | 74% | 0.736 | S | S | * | * | | | trans | 15.3 | 101.8 | 138.1 | -50.5 | 175.8 | 36.1 | 0 | 0 | 116.6 | | |
| 244 | D | 42.6 | Very low | 50 | Low | 150 Ų | 150 | 134.7 Ų | 134.7 | 80% | 0.802 | 73% | 0.732 | S | S | * | * | | | trans | -133.3 | 111.4 | 166 | -135.4 | -33.2 | 0 | 0 | 0 | 110.7 | P242 G246 | P242-D244 PolarHBondContact O-N 3.37Å; D244-G246 PolarHBondContact O-N 3.28Å; D244-G246 VanDerWaalsContact O-N 3.13Å |
| 245 | P | 51 | Low | 49 | Very low | 130 Ų | 130 | 140.6 Ų | 140.6 | 84% | 0.844 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.3 | 81.8 | -175.9 | 34.3 | -31.3 | 0 | 0 | 0 | 109.5 | | |
| 246 | G | 47.5 | Very low | 48.1 | Very low | 53 Ų | 53 | 145.5 Ų | 145.5 | 55% | 0.546 | 75% | 0.745 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -163.3 | -16.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | D244 G248 | D244-G246 PolarHBondContact O-N 3.28Å; D244-G246 VanDerWaalsContact O-N 3.13Å; G246-G248 VanDerWaalsContact C-N 3.29Å; G246-G248 PolarHBondContact O-N 2.69Å |
| 247 | A | 44 | Very low | 46.9 | Very low | 74 Ų | 74 | 148.4 Ų | 148.4 | 61% | 0.612 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.9 | 2.6 | -170.6 | 0 | 0 | 0 | 0 | 0 | 115 | F250 | A247-F250 HydrophobicContact CB-CE1 4.12Å; A247-F250 WeakPolarHBondContact O-CE1 3.19Å |
| 248 | G | 47.8 | Very low | 46.6 | Very low | 55 Ų | 55 | 146.4 Ų | 146.4 | 57% | 0.567 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.9 | -10.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | G246 | G246-G248 VanDerWaalsContact C-N 3.29Å; G246-G248 PolarHBondContact O-N 2.69Å |
| 249 | E | 50 | Low | 47 | Very low | 128 Ų | 128 | 144.6 Ų | 144.6 | 60% | 0.598 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -94.2 | -26.5 | -172.4 | -86.1 | -156.1 | 112.3 | 0 | 0 | 115 | M251 K253 | E249-M251 VanDerWaalsContact C-N 3.31Å; E249-M251 PolarHBondContact O-N 3.13Å; E249-K253 VanDerWaalsContact CD-NZ 3.27Å; E249-K253 IonicContact OE1-NZ 3.46Å; E249-K253 PolarHBondContact OE1-NZ 3.47Å; E249-K253 IonicContact OE2-NZ 3.64Å |
| 250 | F | 51 | Low | 47.3 | Very low | 120 Ų | 120 | 142.5 Ų | 142.5 | 53% | 0.526 | 74% | 0.738 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -78.6 | -14.5 | -173 | 62.1 | -102.7 | 0 | 0 | 0 | 114 | A247 | A247-F250 HydrophobicContact CB-CE1 4.12Å; A247-F250 WeakPolarHBondContact O-CE1 3.19Å |
| 251 | M | 51.8 | Low | 48.1 | Very low | 156 Ų | 156 | 140 Ų | 140 | 77% | 0.768 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.3 | -14.6 | -177.8 | -141.8 | 177.7 | -74.2 | 0 | 0 | 113.2 | E249 | E249-M251 VanDerWaalsContact C-N 3.31Å; E249-M251 PolarHBondContact O-N 3.13Å |
| 252 | R | 54.6 | Low | 49 | Very low | 214 Ų | 214 | 143.4 Ų | 143.4 | 81% | 0.808 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.9 | -13.5 | 172.7 | -82.9 | -175.8 | 174 | 94.2 | -1.5 | 114.2 | | |
| 253 | K | 47.8 | Very low | 49.2 | Very low | 123 Ų | 123 | 148.1 Ų | 148.1 | 54% | 0.535 | 74% | 0.744 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -95.7 | 12.1 | -173.5 | -82.1 | 162.8 | 167.8 | 164.8 | 0 | 115.6 | E249 | E249-K253 VanDerWaalsContact CD-NZ 3.27Å; E249-K253 IonicContact OE1-NZ 3.46Å; E249-K253 PolarHBondContact OE1-NZ 3.47Å; E249-K253 IonicContact OE2-NZ 3.64Å |
| 254 | R | 51.9 | Low | 49.5 | Very low | 217 Ų | 217 | 147 Ų | 147 | 82% | 0.819 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.4 | 7.9 | 178 | -77.7 | -157.1 | -84.5 | 159.1 | -9.3 | 115.9 | | |
| 255 | Y | 48.6 | Very low | 49.6 | Very low | 232 Ų | 232 | 145.9 Ų | 145.9 | 91% | 0.91 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -128.9 | 12.4 | -174.8 | -105.3 | -87.7 | 0 | 0 | 0 | 114.9 | | |
| 256 | R | 48.6 | Very low | 49.7 | Very low | 222 Ų | 222 | 146 Ų | 146 | 84% | 0.838 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -128.7 | -4.2 | -176.4 | -158.4 | 166.5 | 178.2 | 104.1 | 0.9 | 116.2 | | |
| 257 | E | 45.4 | Very low | 49.7 | Very low | 180 Ų | 180 | 147.6 Ų | 147.6 | 84% | 0.841 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -132 | 91.9 | -179.6 | -78.6 | 155.4 | 165.2 | 0 | 0 | 107.8 | | |
| 258 | G | 45.4 | Very low | 49.9 | Very low | 64 Ų | 64 | 148.7 Ų | 148.7 | 66% | 0.66 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -172.8 | -22.6 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | | |
| 259 | D | 55.1 | Low | 49.7 | Very low | 159 Ų | 159 | 157.3 Ų | 157.3 | 85% | 0.85 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -110.7 | -2.8 | -175.5 | -75.3 | -72.2 | 0 | 0 | 0 | 114.6 | | |
| 260 | D | 53.2 | Low | 49.5 | Very low | 136 Ų | 136 | 159.9 Ų | 159.9 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -105.8 | -5.1 | -172.8 | -67.9 | -58.7 | 0 | 0 | 0 | 115.9 | | |
| 261 | D | 53.7 | Low | 48.9 | Very low | 133 Ų | 133 | 163.3 Ų | 163.3 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -117.1 | 5.8 | -174.2 | -82.6 | -41.1 | 0 | 0 | 0 | 115.5 | | |
| 262 | L | 55.4 | Low | 48.3 | Very low | 164 Ų | 164 | 163.3 Ų | 163.3 | 86% | 0.859 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -91.4 | -2.7 | -180 | -157.2 | 61.9 | 0 | 0 | 0 | 114.1 | | |
| 263 | F | 49 | Very low | 48 | Very low | 210 Ų | 210 | 159.5 Ų | 159.5 | 92% | 0.921 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -125.7 | 16.4 | -179.3 | -109.4 | -85.8 | 0 | 0 | 0 | 114.6 | | |
| 264 | K | 44.7 | Very low | 47.6 | Very low | 166 Ų | 166 | 160.7 Ų | 160.7 | 72% | 0.722 | 81% | 0.806 | S | S | * | * | | | trans | -98.6 | 109.8 | -175 | -150.2 | 158.6 | 177.7 | 179.2 | 0 | 111.7 | | |
| 265 | D | 45.7 | Very low | 47 | Very low | 127 Ų | 127 | 153.9 Ų | 153.9 | 68% | 0.679 | 80% | 0.804 | S | S | * | * | | | trans | -27.2 | 130.7 | 173.4 | -96.5 | -68.9 | 0 | 0 | 0 | 115.9 | A267 | D265-A267 HydrophobicContact CB-CB 4.34Å; D265-A267 PolarHBondContact O-N 3.25Å |
| 266 | P | 51.4 | Low | 46.6 | Very low | 133 Ų | 133 | 145.9 Ų | 145.9 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | 14.8 | 168.8 | 30.7 | -33.8 | 0 | 0 | 0 | 114.1 | | |
| 267 | A | 48.5 | Very low | 46.2 | Very low | 86 Ų | 86 | 143 Ų | 143 | 71% | 0.711 | 79% | 0.792 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | 2.6 | -170.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | D265 | D265-A267 HydrophobicContact CB-CB 4.34Å; D265-A267 PolarHBondContact O-N 3.25Å |
| 268 | A | 47.2 | Very low | 46.2 | Very low | 97 Ų | 97 | 138.8 Ų | 138.8 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -115.8 | 19.4 | -171.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | | |
| 269 | R | 45.5 | Very low | 46.2 | Very low | 237 Ų | 237 | 144.6 Ų | 144.6 | 89% | 0.894 | 80% | 0.799 | S | S | * | * | | | trans | -112.3 | 31.2 | -170.6 | -119.9 | -167.4 | -172 | 177.5 | 5.2 | 116.7 | | |
| 270 | Q | 44.1 | Very low | 45.4 | Very low | 182 Ų | 182 | 145.4 Ų | 145.4 | 85% | 0.85 | 80% | 0.798 | S | S | * | * | | | trans | -138.3 | 95.2 | 172.1 | -64.4 | -167.7 | 0.7 | 0 | 0 | 110.5 | | |
| 271 | H | 39.3 | Very low | 45.1 | Very low | 191 Ų | 191 | 147.8 Ų | 147.8 | 88% | 0.884 | 80% | 0.804 | S | S | * | * | | | trans | -166.3 | 141.6 | 155.1 | -113.6 | -86.3 | 0 | 0 | 0 | 110 | | |
| 272 | H | 40 | Very low | 44.6 | Very low | 157 Ų | 157 | 151.2 Ų | 151.2 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | | | trans | 81.4 | 107.7 | -175.6 | -94.6 | -94.2 | 0 | 0 | 0 | 116.3 | | |
| 273 | P | 47.5 | Very low | 44.1 | Very low | 134 Ų | 134 | 147.7 Ų | 147.7 | 87% | 0.87 | 81% | 0.807 | S | S | * | * | | | | -124.6 | 145 | 87.7 | 35.7 | -28.9 | 0 | 0 | 0 | 114.3 | | |
| 274 | D | 38.3 | Very low | 43.8 | Very low | 147 Ų | 147 | 149 Ų | 149 | 79% | 0.786 | 81% | 0.806 | S | S | * | * | | | trans | -78.4 | 141.5 | 173.3 | -179.9 | 33.3 | 0 | 0 | 0 | 110.1 | | |
| 275 | G | 40.6 | Very low | 43.5 | Very low | 75 Ų | 75 | 147.3 Ų | 147.3 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | | | trans | 123.8 | 117.4 | 166.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | | |
| 276 | G | 39.7 | Very low | 44 | Very low | 63 Ų | 63 | 147.2 Ų | 147.2 | 65% | 0.649 | 81% | 0.813 | S | S | * | * | | | trans | 110.1 | 84.3 | 147 | 0 | 0 | 0 | 0 | 0 | 117 | | |
| 277 | D | 40.8 | Very low | 43.9 | Very low | 161 Ų | 161 | 146.4 Ų | 146.4 | 86% | 0.861 | 81% | 0.808 | S | S | * | * | | | | 51.3 | 127.5 | 128.8 | -36.7 | -45.3 | 0 | 0 | 0 | 121.7 | | |
| 278 | A | 45 | Very low | 43.8 | Very low | 92 Ų | 92 | 147.3 Ų | 147.3 | 76% | 0.76 | 82% | 0.816 | S | S | * | * | | | trans | 90.8 | 125.7 | 141.8 | 0 | 0 | 0 | 0 | 0 | 120.6 | | |
| 279 | E | 45.9 | Very low | 44.1 | Very low | 186 Ų | 186 | 149 Ų | 149 | 87% | 0.869 | 82% | 0.816 | S | S | * | * | | | trans | 79.5 | 90 | 150.8 | -66.4 | -172.9 | 154 | 0 | 0 | 120 | | |
| 280 | E | 37 | Very low | 44.5 | Very low | 177 Ų | 177 | 141.7 Ų | 141.7 | 83% | 0.827 | 81% | 0.806 | S | S | * | * | | | | 29.2 | 111.3 | 116.5 | -160.4 | 169.8 | 156.2 | 0 | 0 | 117.2 | | |
| 281 | H | 48.3 | Very low | 44.7 | Very low | 185 Ų | 185 | 141.7 Ų | 141.7 | 86% | 0.856 | 81% | 0.809 | S | S | * | * | | | trans | -172.6 | 101.4 | 132.5 | -106 | -134.3 | 0 | 0 | 0 | 111.6 | | |
| 282 | K | 41.8 | Very low | 45 | Very low | 206 Ų | 206 | 143.6 Ų | 143.6 | 90% | 0.896 | 81% | 0.808 | S | S | * | * | | | trans | -4.2 | 115.2 | 145.6 | -168.4 | -178.5 | -172.4 | 177.1 | 0 | 117 | | |
| 283 | A | 45.5 | Very low | 45.1 | Very low | 90 Ų | 90 | 141.3 Ų | 141.3 | 74% | 0.744 | 82% | 0.816 | S | S | * | * | | | | 158.6 | 121.1 | 118.2 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 284 | R | 42.7 | Very low | 45.8 | Very low | 237 Ų | 237 | 142 Ų | 142 | 89% | 0.894 | 82% | 0.818 | S | S | * | * | | | trans | 73.8 | 103.5 | 134.4 | -148 | 171 | -169.4 | -134.5 | 2.3 | 120.2 | | |
| 285 | V | 39.7 | Very low | 46.3 | Very low | 130 Ų | 130 | 139.5 Ų | 139.5 | 79% | 0.788 | 82% | 0.817 | S | S | * | * | | | trans | -66 | 132.6 | 163.9 | 175 | 0 | 0 | 0 | 0 | 112.5 | | |
| 286 | T | 55 | Low | 46.8 | Very low | 125 Ų | 125 | 141.9 Ų | 141.9 | 77% | 0.767 | 82% | 0.819 | S | S | * | * | | | trans | -156.2 | 124.9 | 147.4 | 47.7 | 0 | 0 | 0 | 0 | 110.1 | | |
| 287 | P | 50.5 | Low | 47.1 | Very low | 117 Ų | 117 | 146.3 Ų | 146.3 | 76% | 0.76 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -86.8 | 140.1 | 170.4 | 32.1 | -30.3 | 0 | 0 | 0 | 112.2 | | |
| 288 | A | 45.1 | Very low | 47.3 | Very low | 105 Ų | 105 | 144.1 Ų | 144.1 | 87% | 0.868 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 134.5 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | | |
| 289 | T | 53.3 | Low | 47.2 | Very low | 132 Ų | 132 | 144.7 Ų | 144.7 | 81% | 0.81 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -88.9 | 125.6 | 171.6 | -45.9 | 0 | 0 | 0 | 0 | 109.6 | M291 | T289-M291 PolarHBondContact O-N 3.01Š|
| 290 | A | 55 | Low | 47.1 | Very low | 84 Ų | 84 | 139.5 Ų | 139.5 | 69% | 0.694 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 125.7 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | | |
| 291 | M | 47.9 | Very low | 47.4 | Very low | 182 Ų | 182 | 136.5 Ų | 136.5 | 90% | 0.897 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -95.9 | 116.4 | 172.9 | -68 | -164.5 | -67.9 | 0 | 0 | 110.2 | T289 | T289-M291 PolarHBondContact O-N 3.01Š|
| 292 | W | 45.8 | Very low | 47.2 | Very low | 231 Ų | 231 | 130.3 Ų | 130.3 | 88% | 0.875 | 82% | 0.818 | S | S | * | * | | | trans | -160.7 | 104.9 | 155.2 | 41.1 | -82.2 | 0 | 0 | 0 | 111.1 | | |
| 293 | A | 42.5 | Very low | 47.4 | Very low | 108 Ų | 108 | 124.4 Ų | 124.4 | 89% | 0.893 | 81% | 0.808 | S | S | * | * | | | trans | -148.8 | 106.3 | 159.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | | |
| 294 | V | 61.5 | Low | 47.7 | Very low | 150 Ų | 150 | 127.7 Ų | 127.7 | 91% | 0.909 | 81% | 0.806 | S | S | * | * | | | trans | -112.1 | 118.5 | 165.4 | 64.3 | 0 | 0 | 0 | 0 | 107.2 | | |
| 295 | A | 48.6 | Very low | 48.3 | Very low | 94 Ų | 94 | 127.9 Ų | 127.9 | 78% | 0.777 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -103.7 | 143.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | | |
| 296 | P | 51.1 | Low | 49.1 | Very low | 125 Ų | 125 | 130.4 Ų | 130.4 | 81% | 0.812 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -92.3 | 142.1 | 176 | 34 | -30 | 0 | 0 | 0 | 112.8 | | |
| 297 | N | 45.9 | Very low | 49.3 | Very low | 156 Ų | 156 | 132.5 Ų | 132.5 | 83% | 0.834 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 140.2 | 174.6 | -175.8 | 18.7 | 0 | 0 | 0 | 112 | | |
| 298 | S | 45.7 | Very low | 49.6 | Very low | 115 Ų | 115 | 131.8 Ų | 131.8 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | | | trans | -138.1 | 120.3 | 168.9 | -72.2 | 0 | 0 | 0 | 0 | 109.4 | | |
| 299 | A | 43.5 | Very low | 49.9 | Very low | 103 Ų | 103 | 132.8 Ų | 132.8 | 85% | 0.851 | 80% | 0.804 | S | S | * | * | | | trans | -157 | 128.9 | 157.6 | 0 | 0 | 0 | 0 | 0 | 109.5 | | |
| 300 | G | 43.7 | Very low | 49.9 | Very low | 77 Ų | 77 | 136.3 Ų | 136.3 | 79% | 0.794 | 80% | 0.802 | S | S | * | * | | | trans | 137.3 | 77.1 | 156.1 | 0 | 0 | 0 | 0 | 0 | 118.4 | | |
| 301 | A | 43 | Very low | 49.2 | Very low | 115 Ų | 115 | 136.8 Ų | 136.8 | 95% | 0.95 | 81% | 0.806 | S | S | * | * | | | trans | 61.6 | 137.5 | 132.9 | 0 | 0 | 0 | 0 | 0 | 123.5 | | |
| 302 | G | 43.4 | Very low | 49 | Very low | 55 Ų | 55 | 137 Ų | 137 | 57% | 0.567 | 80% | 0.802 | S | S | * | * | | | trans | 126.7 | 72.5 | 162.4 | 0 | 0 | 0 | 0 | 0 | 113 | | |
| 303 | A | 46.6 | Very low | 48.7 | Very low | 82 Ų | 82 | 129.8 Ų | 129.8 | 68% | 0.678 | 80% | 0.8 | S | S | * | * | | | | 80.6 | 169.7 | 92.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | | |
| 304 | F | 51.9 | Low | 48.4 | Very low | 159 Ų | 159 | 128.8 Ų | 128.8 | 70% | 0.697 | 80% | 0.8 | S | S | * | * | | | trans | 61.6 | 82.9 | 164.2 | 34.7 | -96.9 | 0 | 0 | 0 | 117.9 | | |
| 305 | W | 55.2 | Low | 47.2 | Very low | 241 Ų | 241 | 125.4 Ų | 125.4 | 91% | 0.913 | 80% | 0.796 | S | S | * | * | | | | -159.4 | 82.1 | 120.7 | -77.6 | 113.6 | 0 | 0 | 0 | 108.7 | Q307 | W305-Q307 PolarHBondContact O-N 3.47Š|
| 306 | M | 55.2 | Low | 46.7 | Very low | 183 Ų | 183 | 124.9 Ų | 124.9 | 90% | 0.901 | 80% | 0.799 | S | S | * | * | | | trans | -68.1 | 113 | 168.8 | -144.6 | 136.7 | 79.8 | 0 | 0 | 107.5 | | |
| 307 | Q | 60.8 | Low | 46.3 | Very low | 169 Ų | 169 | 123.7 Ų | 123.7 | 79% | 0.79 | 79% | 0.794 | S | S | * | * | | | trans | -99.7 | 122.9 | 166.2 | -78.1 | -77 | -57.7 | 0 | 0 | 107.7 | W305 | W305-Q307 PolarHBondContact O-N 3.47Š|
| 308 | P | 55.5 | Low | 46.2 | Very low | 101 Ų | 101 | 121.8 Ų | 121.8 | 66% | 0.656 | 79% | 0.788 | S | S | * | * | | | trans | -95.9 | 157.3 | 166.7 | 35.1 | -27.4 | 0 | 0 | 0 | 111.3 | | |
| 309 | T | 52.9 | Low | 46.4 | Very low | 127 Ų | 127 | 121.6 Ų | 121.6 | 78% | 0.779 | 78% | 0.782 | S | S | * | * | | | trans | 76.7 | 137.7 | 158.5 | -146.1 | 0 | 0 | 0 | 0 | 115 | | |
| 310 | W | 51.5 | Low | 46.2 | Very low | 206 Ų | 206 | 125.3 Ų | 125.3 | 78% | 0.78 | 78% | 0.782 | S | S | * | * | | | cis | -157.3 | 152.1 | 29.4 | 30 | -70.3 | 0 | 0 | 0 | 109.6 | F312 | W310-F312 AromaticContact CE3-CD2 3.71Å; W310-F312 HydrophobicContact CE3-CD2 3.71Å; W310-F312 AromaticContact CE3-CE2 3.57Å; W310-F312 HydrophobicContact CE3-CE2 3.57Å; W310-F312 AromaticContact CZ3-CD2 3.84Å; W310-F312 HydrophobicContact CZ3-CD2 3.84Å; W310-F312 AromaticContact CZ3-CE2 3.63Å; W310-F312 HydrophobicContact CZ3-CE2 3.63Å |
| 311 | A | 40.6 | Very low | 46.1 | Very low | 93 Ų | 93 | 125.4 Ų | 125.4 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | | | trans | -84.6 | 138.7 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113 | | |
| 312 | F | 43.3 | Very low | 46.3 | Very low | 186 Ų | 186 | 126 Ų | 126 | 82% | 0.816 | 77% | 0.769 | S | S | * | * | | | trans | -152.6 | 124.7 | 150.2 | -78.6 | -82.6 | 0 | 0 | 0 | 104.5 | W310 | W310-F312 AromaticContact CE3-CD2 3.71Å; W310-F312 HydrophobicContact CE3-CD2 3.71Å; W310-F312 AromaticContact CE3-CE2 3.57Å; W310-F312 HydrophobicContact CE3-CE2 3.57Å; W310-F312 AromaticContact CZ3-CD2 3.84Å; W310-F312 HydrophobicContact CZ3-CD2 3.84Å; W310-F312 AromaticContact CZ3-CE2 3.63Å; W310-F312 HydrophobicContact CZ3-CE2 3.63Å |
| 313 | G | 39.3 | Very low | 46.5 | Very low | 81 Ų | 81 | 131.2 Ų | 131.2 | 84% | 0.835 | 78% | 0.783 | S | S | * | * | | | cis | 115.1 | 87.7 | 17.6 | 0 | 0 | 0 | 0 | 0 | 109.5 | | |
| 314 | G | 37.5 | Very low | 46.5 | Very low | 87 Ų | 87 | 135.4 Ų | 135.4 | 90% | 0.897 | 79% | 0.789 | S | S | * | * | | | trans | 96.9 | 137.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 315 | G | 35.9 | Very low | 46.5 | Very low | 79 Ų | 79 | 137.2 Ų | 137.2 | 81% | 0.814 | 80% | 0.797 | S | S | * | * | | | cis | 143.5 | 122 | 7.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | | |
| 316 | G | 38.4 | Very low | 45.9 | Very low | 82 Ų | 82 | 133.3 Ų | 133.3 | 85% | 0.845 | 79% | 0.79 | S | S | * | * | | | trans | 71.9 | 154.7 | 168.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 317 | S | 42.3 | Very low | 45.4 | Very low | 100 Ų | 100 | 129.6 Ų | 129.6 | 70% | 0.699 | 78% | 0.783 | S | S | * | * | | | cis | -166.3 | 122.7 | 0.7 | -158 | 0 | 0 | 0 | 0 | 105.2 | | |
| 318 | T | 44.9 | Very low | 45.1 | Very low | 116 Ų | 116 | 127.9 Ų | 127.9 | 71% | 0.712 | 78% | 0.784 | S | S | * | * | | | | 64.1 | 132.3 | 115.9 | 69.3 | 0 | 0 | 0 | 0 | 119.9 | | |
| 319 | V | 49.5 | Very low | 44.3 | Very low | 112 Ų | 112 | 134.6 Ų | 134.6 | 68% | 0.679 | 80% | 0.796 | S | S | * | * | | | trans | 77.1 | 130.4 | 147.2 | -117.2 | 0 | 0 | 0 | 0 | 123.2 | | |
| 320 | Q | 39.4 | Very low | 43.9 | Very low | 180 Ų | 180 | 134.5 Ų | 134.5 | 84% | 0.841 | 80% | 0.801 | S | S | * | * | | | trans | 63.9 | 144.8 | 137.5 | -94.7 | 168.6 | -60.1 | 0 | 0 | 119 | | |
| 321 | A | 41.8 | Very low | 43.5 | Very low | 80 Ų | 80 | 128.4 Ų | 128.4 | 66% | 0.661 | 79% | 0.794 | S | S | * | * | | | cis | -166.5 | 165.1 | 1.1 | 0 | 0 | 0 | 0 | 0 | 106.6 | | |
| 322 | P | 46.4 | Very low | 43.9 | Very low | 127 Ų | 127 | 132.1 Ų | 132.1 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | | | trans | -88.9 | 134.2 | 176.5 | 34 | -28.1 | 0 | 0 | 0 | 111.1 | | |
| 323 | L | 48 | Very low | 44 | Very low | 165 Ų | 165 | 129.3 Ų | 129.3 | 86% | 0.864 | 80% | 0.795 | S | S | * | * | | | trans | -119.9 | 112.7 | 170.2 | -87.2 | 166.5 | 0 | 0 | 0 | 110.7 | | |
| 324 | Q | 46.4 | Very low | 44.2 | Very low | 169 Ų | 169 | 134.3 Ų | 134.3 | 79% | 0.79 | 79% | 0.794 | S | S | * | * | | | trans | -65 | 136.4 | 159.8 | -70.2 | -85.5 | -30.1 | 0 | 0 | 109.1 | | |
| 325 | F | 51 | Low | 44.5 | Very low | 197 Ų | 197 | 135.4 Ų | 135.4 | 86% | 0.864 | 79% | 0.785 | S | S | * | * | | | trans | -123.3 | 104.8 | 163 | -123.6 | -92.9 | 0 | 0 | 0 | 108.6 | | |
| 326 | M | 43.6 | Very low | 44.7 | Very low | 159 Ų | 159 | 136.8 Ų | 136.8 | 78% | 0.783 | 79% | 0.789 | S | S | * | * | | | trans | -84.1 | 136.3 | 160.5 | -77.8 | 148.9 | 60.7 | 0 | 0 | 108.5 | | |
| 327 | S | 45.3 | Very low | 44.7 | Very low | 105 Ų | 105 | 136.8 Ų | 136.8 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | | | trans | 165.4 | 139.9 | 150.9 | -78.4 | 0 | 0 | 0 | 0 | 107.6 | | |
| 328 | T | 53.3 | Low | 45 | Very low | 133 Ų | 133 | 138.5 Ų | 138.5 | 82% | 0.816 | 80% | 0.796 | S | S | * | * | | | cis | -165.8 | 142.3 | -9.7 | 25.2 | 0 | 0 | 0 | 0 | 104.9 | | |
| 329 | R | 38.7 | Very low | 45.2 | Very low | 242 Ų | 242 | 138.9 Ų | 138.9 | 91% | 0.913 | 80% | 0.798 | S | S | * | * | | | trans | -47.9 | 138.2 | 168.7 | 176.6 | -173.4 | -89.5 | -170.8 | -9.3 | 112.7 | | |
| 330 | S | 44.2 | Very low | 45.2 | Very low | 125 Ų | 125 | 142.4 Ų | 142.4 | 87% | 0.874 | 81% | 0.809 | S | S | * | * | | | trans | -145.8 | 135.6 | 146 | -159 | 0 | 0 | 0 | 0 | 110.2 | | |
| 331 | A | 43.3 | Very low | 45 | Very low | 79 Ų | 79 | 141.6 Ų | 141.6 | 65% | 0.653 | 81% | 0.81 | S | S | * | * | | | trans | -86.6 | 145.3 | -163.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | | |
| 332 | N | 50.3 | Low | 45.5 | Very low | 170 Ų | 170 | 141.5 Ų | 141.5 | 91% | 0.909 | 81% | 0.81 | S | S | * | * | | | | -158.4 | 140.7 | 121.8 | -95.9 | -13.2 | 0 | 0 | 0 | 111.2 | | |
| 333 | N | 44.9 | Very low | 45.5 | Very low | 127 Ų | 127 | 143.1 Ų | 143.1 | 68% | 0.679 | 81% | 0.811 | S | S | * | * | | | trans | -70.4 | 136.2 | -166.7 | -147.9 | 25.8 | 0 | 0 | 0 | 111.4 | | |
| 334 | F | 43.7 | Very low | 45.5 | Very low | 186 Ų | 186 | 143.5 Ų | 143.5 | 82% | 0.816 | 81% | 0.813 | S | S | * | * | | | | 166.3 | 146.7 | 115 | -89.3 | -75.6 | 0 | 0 | 0 | 111 | | |
| 335 | P | 42.8 | Very low | 45.4 | Very low | 111 Ų | 111 | 139.1 Ų | 139.1 | 72% | 0.721 | 81% | 0.813 | S | S | * | * | | | trans | -112.7 | 174.4 | -147.8 | 42.1 | -34.9 | 0 | 0 | 0 | 115.1 | | |
| 336 | A | 40.6 | Very low | 45.7 | Very low | 108 Ų | 108 | 138.6 Ų | 138.6 | 89% | 0.893 | 82% | 0.815 | S | S | * | * | | | trans | 91.8 | 118.6 | 156.6 | 0 | 0 | 0 | 0 | 0 | 117.1 | | |
| 337 | G | 38.6 | Very low | 45.8 | Very low | 82 Ų | 82 | 139.7 Ų | 139.7 | 85% | 0.845 | 82% | 0.823 | S | S | * | * | | | trans | 139.3 | 103.8 | 166.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 338 | T | 48.2 | Very low | 46.1 | Very low | 136 Ų | 136 | 139.6 Ų | 139.6 | 83% | 0.834 | 83% | 0.829 | S | S | * | * | | | trans | -73.8 | 146.7 | -173.7 | 45.5 | 0 | 0 | 0 | 0 | 114.5 | | |
| 339 | T | 50.3 | Low | 45.8 | Very low | 124 Ų | 124 | 137.4 Ų | 137.4 | 76% | 0.761 | 82% | 0.824 | S | S | * | * | | | trans | 89.7 | 86.2 | 149.9 | -41.3 | 0 | 0 | 0 | 0 | 118.8 | | |
| 340 | M | 49.1 | Very low | 46.3 | Very low | 186 Ų | 186 | 134.4 Ų | 134.4 | 92% | 0.916 | 83% | 0.825 | S | S | * | * | | | trans | 24.1 | 94.6 | 138 | -58.4 | -157.1 | -178.4 | 0 | 0 | 119 | | |
| 341 | D | 35 | Very low | 46.7 | Very low | 162 Ų | 162 | 136.7 Ų | 136.7 | 87% | 0.866 | 83% | 0.828 | S | S | * | * | | | trans | -62.8 | 122.3 | 153.4 | -66.9 | -84.9 | 0 | 0 | 0 | 112.5 | | |
| 342 | A | 52 | Low | 46.9 | Very low | 79 Ų | 79 | 138 Ų | 138 | 65% | 0.653 | 84% | 0.838 | S | S | * | * | | | trans | -148.7 | 110.7 | 152.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | | |
| 343 | N | 46.8 | Very low | 46.6 | Very low | 160 Ų | 160 | 135.8 Ų | 135.8 | 86% | 0.856 | 84% | 0.837 | S | S | * | * | S | Bend | trans | 89.2 | 29.1 | 161.1 | -50.4 | -67.7 | 0 | 0 | 0 | 120.5 | | |
| 344 | I | 48 | Very low | 46.4 | Very low | 173 Ų | 173 | 133.9 Ų | 133.9 | 89% | 0.887 | 85% | 0.847 | S | S | * | * | | | trans | -131.7 | 86.9 | 167.2 | -52.1 | -179.5 | 0 | 0 | 0 | 109.5 | | |
| 345 | G | 44 | Very low | 46.3 | Very low | 77 Ų | 77 | 128.7 Ų | 128.7 | 79% | 0.794 | 85% | 0.846 | S | S | * | * | | | trans | -163.4 | 14.8 | -177.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | | |
| 346 | M | 56.1 | Low | 46.4 | Very low | 187 Ų | 187 | 130.1 Ų | 130.1 | 92% | 0.921 | 85% | 0.852 | S | S | * | * | S | Bend | trans | -131.9 | 26.8 | -177 | -140.6 | -172.6 | -63 | 0 | 0 | 114.4 | | |
| 347 | L | 47.4 | Very low | 46.5 | Very low | 181 Ų | 181 | 133 Ų | 133 | 95% | 0.948 | 85% | 0.847 | S | S | * | * | S | Bend | trans | -142.1 | 54.3 | 172.5 | -90 | 162.6 | 0 | 0 | 0 | 109.6 | | |
| 348 | A | 50.6 | Low | 46.7 | Very low | 103 Ų | 103 | 137.1 Ų | 137.1 | 85% | 0.851 | 85% | 0.845 | S | S | * | * | S | Bend | trans | -152.9 | 48.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | | |
| 349 | A | 47 | Very low | 46.1 | Very low | 87 Ų | 87 | 139.6 Ų | 139.6 | 72% | 0.719 | 85% | 0.847 | S | S | * | * | | | trans | -158.1 | 118.2 | 168.5 | 0 | 0 | 0 | 0 | 0 | 105.8 | | |
| 350 | L | 49.5 | Very low | 45.7 | Very low | 179 Ų | 179 | 140 Ų | 140 | 94% | 0.937 | 84% | 0.844 | S | S | * | * | S | Bend | trans | 158.7 | 4.5 | 158.1 | -83.9 | 160.5 | 0 | 0 | 0 | 114.3 | | |
| 351 | N | 51.7 | Low | 45.3 | Very low | 173 Ų | 173 | 139.5 Ų | 139.5 | 93% | 0.925 | 84% | 0.84 | S | S | * | * | S | Bend | trans | -121.9 | 28 | 173.6 | -140.3 | 6 | 0 | 0 | 0 | 114.8 | | |
| 352 | A | 48.1 | Very low | 45.6 | Very low | 106 Ų | 106 | 135 Ų | 135 | 88% | 0.876 | 83% | 0.831 | S | S | * | * | | | trans | -128 | 77.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | | |
| 353 | S | 43.1 | Very low | 45.2 | Very low | 125 Ų | 125 | 139.8 Ų | 139.8 | 87% | 0.874 | 84% | 0.84 | S | S | * | * | | | trans | -144 | 100.7 | 176.2 | 155.4 | 0 | 0 | 0 | 0 | 107.6 | | |
| 354 | G | 41.7 | Very low | 45.2 | Very low | 87 Ų | 87 | 137.1 Ų | 137.1 | 90% | 0.897 | 83% | 0.83 | S | S | * | * | | | trans | 139 | 74.8 | 171 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 355 | G | 40.9 | Very low | 45.2 | Very low | 77 Ų | 77 | 138.7 Ų | 138.7 | 79% | 0.794 | 82% | 0.824 | S | S | * | * | | | trans | 174.3 | 62.7 | 175 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 356 | V | 45.2 | Very low | 44.9 | Very low | 140 Ų | 140 | 141.2 Ų | 141.2 | 85% | 0.848 | 82% | 0.815 | S | S | * | * | | | trans | -137.5 | 141.8 | 167.6 | 178.3 | 0 | 0 | 0 | 0 | 107.4 | | |
| 357 | Q | 43.1 | Very low | 44.3 | Very low | 169 Ų | 169 | 139.5 Ų | 139.5 | 79% | 0.79 | 81% | 0.807 | S | S | * | * | | | trans | 94.5 | 117.9 | 169.4 | -141.7 | 157.1 | 71.2 | 0 | 0 | 112.7 | | |
| 358 | Q | 42.5 | Very low | 44 | Very low | 169 Ų | 169 | 134.3 Ų | 134.3 | 79% | 0.79 | 79% | 0.79 | S | S | * | * | | | cis | -166.4 | 127.1 | 9.9 | -156.8 | 154.4 | 8.6 | 0 | 0 | 107.2 | | |
| 359 | Q | 36.7 | Very low | 43.7 | Very low | 187 Ų | 187 | 137.2 Ų | 137.2 | 87% | 0.874 | 79% | 0.786 | S | S | * | * | | | trans | -81.5 | 126.1 | 157.7 | -89.9 | 172.1 | -9 | 0 | 0 | 106.6 | | |
| 360 | D | 41.7 | Very low | 43.6 | Very low | 132 Ų | 132 | 142.1 Ų | 142.1 | 71% | 0.706 | 79% | 0.786 | S | S | * | * | | | trans | -174.2 | 132.8 | 134.3 | -119.7 | -155.6 | 0 | 0 | 0 | 112.7 | | |
| 361 | E | 40.2 | Very low | 43.5 | Very low | 177 Ų | 177 | 140.2 Ų | 140.2 | 83% | 0.827 | 77% | 0.772 | S | S | * | * | | | trans | 70.2 | 136.3 | 140.2 | -66.1 | -173.1 | 124.9 | 0 | 0 | 123.4 | | |
| 362 | G | 40.4 | Very low | 43.3 | Very low | 66 Ų | 66 | 142.4 Ų | 142.4 | 68% | 0.68 | 77% | 0.767 | S | S | * | * | | | trans | 97 | 75.4 | 152.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 363 | Q | 44.3 | Very low | 43.1 | Very low | 181 Ų | 181 | 140.3 Ų | 140.3 | 85% | 0.846 | 76% | 0.756 | S | S | * | * | | | | 51.9 | 139.1 | 88.1 | -61.4 | -174.8 | 2.2 | 0 | 0 | 115.1 | | |
| 364 | T | 47.8 | Very low | 43.9 | Very low | 104 Ų | 104 | 139.3 Ų | 139.3 | 64% | 0.638 | 76% | 0.755 | S | S | * | * | | | trans | 82.8 | 99.8 | 150.8 | -1.2 | 0 | 0 | 0 | 0 | 114.4 | | |
| 365 | R | 46.6 | Very low | 44.4 | Very low | 206 Ų | 206 | 142.9 Ų | 142.9 | 78% | 0.777 | 75% | 0.754 | S | S | * | * | | | | 85.1 | 114.1 | 93.6 | -86.7 | -167.9 | 175.6 | 160.2 | 0.5 | 110.7 | | |
| 366 | E | 38.7 | Very low | 44.9 | Very low | 129 Ų | 129 | 142.8 Ų | 142.8 | 60% | 0.603 | 75% | 0.753 | S | S | * | * | | | | 104 | 148.1 | 82.2 | -173.4 | 174.7 | 124.9 | 0 | 0 | 108.5 | | |
| 367 | M | 44.1 | Very low | 45.2 | Very low | 151 Ų | 151 | 139.4 Ų | 139.4 | 74% | 0.744 | 75% | 0.747 | S | S | * | * | | | trans | 70.9 | 104.1 | 164.5 | -94.7 | -177.1 | -93.7 | 0 | 0 | 115.7 | | |
| 368 | A | 40.7 | Very low | 45.7 | Very low | 72 Ų | 72 | 139.1 Ų | 139.1 | 60% | 0.595 | 75% | 0.751 | S | S | * | * | | | | 97.4 | 109.9 | 87.2 | 0 | 0 | 0 | 0 | 0 | 107.7 | | |
| 369 | Q | 44.6 | Very low | 46.4 | Very low | 164 Ų | 164 | 135.1 Ų | 135.1 | 77% | 0.766 | 75% | 0.746 | S | S | * | * | | | | 65.1 | 131.9 | 89.5 | -154 | 173.3 | 46.8 | 0 | 0 | 109.4 | | |
| 370 | R | 44.7 | Very low | 47.2 | Very low | 191 Ų | 191 | 129.4 Ų | 129.4 | 72% | 0.721 | 74% | 0.738 | S | S | * | * | | | trans | 110.8 | 113.5 | 154.2 | -60 | -162.8 | 174.3 | -126.9 | -4.1 | 114.4 | | |
| 371 | H | 47.8 | Very low | 47.9 | Very low | 139 Ų | 139 | 135.5 Ų | 135.5 | 64% | 0.644 | 75% | 0.751 | S | S | * | * | | | | 69.8 | 139 | 127.8 | -74.2 | -96.4 | 0 | 0 | 0 | 114.1 | | |
| 372 | R | 45.8 | Very low | 48.7 | Very low | 218 Ų | 218 | 130.8 Ų | 130.8 | 82% | 0.823 | 75% | 0.75 | S | S | * | * | | | cis | 159.6 | 149.8 | 20.5 | 154.7 | -172.5 | -84.4 | -178.9 | -5.6 | 102.5 | | |
| 373 | G | 45.5 | Very low | 49.3 | Very low | 63 Ų | 63 | 132.8 Ų | 132.8 | 65% | 0.649 | 76% | 0.76 | S | S | * | * | | | trans | 105.6 | 95.6 | 153.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | | |
| 374 | A | 58.3 | Low | 50.2 | Low | 103 Ų | 103 | 129.1 Ų | 129.1 | 85% | 0.851 | 76% | 0.76 | S | S | * | * | | | | 74.2 | 122.7 | 70 | 0 | 0 | 0 | 0 | 0 | 112.2 | | |
| 375 | N | 53.6 | Low | 50.9 | Low | 163 Ų | 163 | 129.6 Ų | 129.6 | 87% | 0.872 | 77% | 0.768 | S | S | * | * | | | | 145.6 | 101 | 119.9 | -155.7 | 9 | 0 | 0 | 0 | 107 | | |
| 376 | G | 50.7 | Low | 52.2 | Low | 74 Ų | 74 | 125.8 Ų | 125.8 | 76% | 0.763 | 77% | 0.77 | S | S | * | * | | | | 104.2 | 146.3 | 81.3 | 0 | 0 | 0 | 0 | 0 | 107.1 | | |
| 377 | G | 50.5 | Low | 53.1 | Low | 70 Ų | 70 | 132.4 Ų | 132.4 | 72% | 0.722 | 80% | 0.801 | S | S | * | * | | | cis | -160.6 | 140.3 | -4.2 | 0 | 0 | 0 | 0 | 0 | 103.8 | | |
| 378 | D | 55.3 | Low | 53.5 | Low | 163 Ų | 163 | 131.5 Ų | 131.5 | 87% | 0.872 | 80% | 0.804 | S | S | * | * | | | | 78.9 | 133.1 | 85.8 | -169 | 45.1 | 0 | 0 | 0 | 115.4 | | |
| 379 | A | 56 | Low | 54.2 | Low | 85 Ų | 85 | 134.6 Ų | 134.6 | 70% | 0.702 | 82% | 0.815 | S | S | * | * | | | trans | 76.4 | 124.7 | 152.2 | 0 | 0 | 0 | 0 | 0 | 122.2 | | |
| 380 | G | 54.8 | Low | 54.7 | Low | 67 Ų | 67 | 133 Ų | 133 | 69% | 0.691 | 82% | 0.818 | S | S | * | * | | | trans | 128.5 | 87.1 | 130.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 381 | R | 55 | Low | 55.3 | Low | 259 Ų | 259 | 129.6 Ų | 129.6 | 98% | 0.977 | 82% | 0.823 | S | S | * | * | | | | 64.5 | 127.6 | 96.1 | -81.7 | -175.2 | 169.8 | -162.4 | -2.1 | 114.5 | | |
| 382 | G | 56.9 | Low | 55.8 | Low | 78 Ų | 78 | 129 Ų | 129 | 80% | 0.804 | 83% | 0.834 | S | S | * | * | | | trans | 133.8 | 104.6 | 136 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 383 | A | 54.4 | Low | 56.5 | Low | 108 Ų | 108 | 123.1 Ų | 123.1 | 89% | 0.893 | 84% | 0.835 | S | S | * | * | | | trans | -52.3 | 145.1 | 168.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 384 | A | 63.1 | Low | 57.2 | Low | 104 Ų | 104 | 127.4 Ų | 127.4 | 86% | 0.86 | 85% | 0.848 | S | S | * | * | | | trans | -151 | 103.4 | 153.8 | 0 | 0 | 0 | 0 | 0 | 109 | | |
| 385 | S | 62.2 | Low | 57.2 | Low | 115 Ų | 115 | 129.2 Ų | 129.2 | 80% | 0.804 | 85% | 0.848 | S | S | * | * | | | trans | -80.6 | 159.8 | 162.6 | -78.6 | 0 | 0 | 0 | 0 | 110.2 | | |
| 386 | P | 73.3 | Confident | 57.5 | Low | 125 Ų | 125 | 126.4 Ų | 126.4 | 81% | 0.812 | 85% | 0.846 | S | S | * | * | | | trans | -87.1 | 176.2 | -170.4 | 36.9 | -34.7 | 0 | 0 | 0 | 113.6 | | |
| 387 | Q | 57.5 | Low | 58.1 | Low | 269 Ų | 269 | 131.2 Ų | 131.2 | 100% | 1.257 | 85% | 0.854 | S | S | * | * | | | trans | -43.1 | 0 | 179.2 | -72.5 | -165.9 | 5.4 | 0 | 0 | 116.9 | | |