| 1 | M | 53.8 | Low | 56.8 | Low | 204 Ų | 204 | 137.4 Ų | 137.4 | 100% | 1.005 | 69% | 0.694 | S | S | * | * | | | | 0 | -42 | 0 | -84.1 | -166.5 | -81.2 | 0 | 0 | 113.3 | Q3 R4 | M1-Q3 VanDerWaalsContact C-N 3.35Å; M1-Q3 PolarHBondContact O-N 3.16Å; M1-R4 PolarHBondContact O-N 3.02Å |
| 2 | F | 53.8 | Low | 56.4 | Low | 189 Ų | 189 | 136.8 Ų | 136.8 | 83% | 0.829 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.1 | -35.2 | -175.9 | -65.1 | -77.2 | 0 | 0 | 0 | 116 | R4 F5 | F2-R4 PolarHBondContact O-N 3.16Å; F2-R4 VanDerWaalsContact O-N 3.13Å; F2-F5 PolarHBondContact O-N 2.87Å; F2-F5 VanDerWaalsContact O-N 3.09Å |
| 3 | Q | 55.1 | Low | 56 | Low | 173 Ų | 173 | 137 Ų | 137 | 81% | 0.808 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -53 | -34.1 | 175.5 | -80.8 | 171.1 | -25.4 | 0 | 0 | 113.9 | M1 F5 A6 | M1-Q3 VanDerWaalsContact C-N 3.35Å; M1-Q3 PolarHBondContact O-N 3.16Å; Q3-F5 VanDerWaalsContact C-N 3.3Å; Q3-F5 PolarHBondContact O-N 2.94Å; Q3-A6 PolarHBondContact O-N 3.46Å |
| 4 | R | 58.8 | Low | 55.9 | Low | 216 Ų | 216 | 132.3 Ų | 132.3 | 82% | 0.815 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -73.5 | -16.4 | -178.3 | -76.1 | -171.5 | 172.5 | 175.7 | -2.9 | 114.7 | M1 F2 | M1-R4 PolarHBondContact O-N 3.02Å; F2-R4 PolarHBondContact O-N 3.16Å; F2-R4 VanDerWaalsContact O-N 3.13Å |
| 5 | F | 57 | Low | 55.3 | Low | 149 Ų | 149 | 131.5 Ų | 131.5 | 65% | 0.654 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -84.9 | -29 | 176.4 | -73.9 | -78.6 | 0 | 0 | 0 | 112.4 | F2 Q3 T8 L9 | F2-F5 PolarHBondContact O-N 2.87Å; F2-F5 VanDerWaalsContact O-N 3.09Å; Q3-F5 VanDerWaalsContact C-N 3.3Å; Q3-F5 PolarHBondContact O-N 2.94Å; F5-T8 PolarHBondContact O-OG1 2.84Å; F5-L9 PolarHBondContact O-N 2.88Å |
| 6 | A | 58.8 | Low | 55.4 | Low | 49 Ų | 49 | 134.4 Ų | 134.4 | 41% | 0.405 | 71% | 0.705 | S | S | . | * | H | α-helix | trans | -67.6 | -47.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q3 T8 L9 F10 | Q3-A6 PolarHBondContact O-N 3.46Å; A6-T8 PolarHBondContact O-N 3.41Å; A6-L9 PolarHBondContact O-N 3.37Å; A6-F10 PolarHBondContact O-N 2.79Å |
| 7 | S | 56.6 | Low | 54.8 | Low | 55 Ų | 55 | 132.9 Ų | 132.9 | 39% | 0.385 | 71% | 0.705 | S | S | . | * | H | α-helix | trans | -58.3 | -32.2 | 180 | -51.6 | 0 | 0 | 0 | 0 | 113.6 | G11 | S7-G11 PolarHBondContact O-N 2.8Å |
| 8 | T | 58.6 | Low | 54.2 | Low | 116 Ų | 116 | 130.8 Ų | 130.8 | 71% | 0.712 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -81.6 | -17.1 | 175.3 | 47.6 | 0 | 0 | 0 | 0 | 114.5 | F5 A6 | F5-T8 PolarHBondContact O-OG1 2.84Å; A6-T8 PolarHBondContact O-N 3.41Å |
| 9 | L | 61.1 | Low | 53.6 | Low | 130 Ų | 130 | 136.8 Ų | 136.8 | 68% | 0.681 | 72% | 0.715 | S | S | * | * | H | α-helix | trans | -95.7 | -34.7 | -178 | -175.5 | 63.2 | 0 | 0 | 0 | 112.2 | F5 A6 | F5-L9 PolarHBondContact O-N 2.88Å; A6-L9 PolarHBondContact O-N 3.37Å |
| 10 | F | 64.9 | Low | 52.6 | Low | 174 Ų | 174 | 134 Ų | 134 | 76% | 0.763 | 72% | 0.721 | S | S | * | * | H | α-helix | trans | -109.4 | -12.5 | -173.8 | -69.1 | -72.5 | 0 | 0 | 0 | 115.2 | A6 | A6-F10 PolarHBondContact O-N 2.79Å |
| 11 | G | 46.5 | Very low | 52.2 | Low | 56 Ų | 56 | 133.7 Ų | 133.7 | 58% | 0.577 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 77.2 | 104.6 | -173.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | S7 D13 | S7-G11 PolarHBondContact O-N 2.8Å; G11-D13 VanDerWaalsContact C-N 3.32Å; G11-D13 PolarHBondContact O-N 3.07Å |
| 12 | D | 52.4 | Low | 51.4 | Low | 131 Ų | 131 | 132.8 Ų | 132.8 | 70% | 0.701 | 72% | 0.722 | S | S | * | * | | | trans | -74.2 | 85.5 | 172.3 | -167.9 | 42.4 | 0 | 0 | 0 | 108.9 | G14 | D12-G14 PolarHBondContact O-N 2.81Š|
| 13 | D | 50.8 | Low | 51 | Low | 139 Ų | 139 | 129.8 Ų | 129.8 | 74% | 0.743 | 72% | 0.722 | S | S | * | * | | | trans | -72.8 | 81.9 | 173.3 | -169.1 | -110.2 | 0 | 0 | 0 | 109.6 | G11 N15 | G11-D13 VanDerWaalsContact C-N 3.32Å; G11-D13 PolarHBondContact O-N 3.07Å; D13-N15 PolarHBondContact O-N 2.96Å |
| 14 | G | 55.1 | Low | 50.1 | Low | 71 Ų | 71 | 124.9 Ų | 124.9 | 73% | 0.732 | 72% | 0.718 | S | S | * | * | | | trans | -72.7 | 64.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | D12 E16 | D12-G14 PolarHBondContact O-N 2.81Å; G14-E16 PolarHBondContact O-N 3.03Å; G14-E16 VanDerWaalsContact O-N 3.08Å |
| 15 | N | 45.6 | Very low | 49 | Very low | 121 Ų | 121 | 122.9 Ų | 122.9 | 65% | 0.647 | 72% | 0.723 | S | S | * | * | | | trans | -79.6 | 82.5 | 174.1 | -172.2 | 19.9 | 0 | 0 | 0 | 111.3 | D13 P17 | D13-N15 PolarHBondContact O-N 2.96Å; N15-P17 WeakPolarHBondContact O-CD 3.44Å |
| 16 | E | 57.5 | Low | 48.1 | Very low | 177 Ų | 177 | 119 Ų | 119 | 83% | 0.827 | 73% | 0.726 | S | S | * | * | | | trans | -87.2 | 108.9 | 153.7 | -93.3 | -147.8 | 118 | 0 | 0 | 110.1 | G14 S18 | G14-E16 PolarHBondContact O-N 3.03Å; G14-E16 VanDerWaalsContact O-N 3.08Å; E16-S18 PolarHBondContact O-N 2.81Å |
| 17 | P | 45 | Very low | 47.2 | Very low | 109 Ų | 109 | 125.4 Ų | 125.4 | 71% | 0.708 | 75% | 0.747 | S | S | * | * | | | trans | -92.9 | 81.8 | 164.4 | 33.8 | -32.6 | 0 | 0 | 0 | 110.8 | N15 R19 | N15-P17 WeakPolarHBondContact O-CD 3.44Å; P17-R19 PolarHBondContact O-N 3.06Å |
| 18 | S | 43.9 | Very low | 46.7 | Very low | 95 Ų | 95 | 131.1 Ų | 131.1 | 66% | 0.664 | 77% | 0.768 | S | S | * | * | | | trans | -78.5 | 113.6 | 168.1 | -162.1 | 0 | 0 | 0 | 0 | 111 | E16 | E16-S18 PolarHBondContact O-N 2.81Š|
| 19 | R | 43.5 | Very low | 46 | Very low | 245 Ų | 245 | 130.3 Ų | 130.3 | 93% | 0.925 | 77% | 0.773 | S | S | * | * | | | trans | 58.7 | 121.7 | 164.7 | -70.9 | 176 | 147.3 | -162.3 | -5.4 | 118.9 | P17 | P17-R19 PolarHBondContact O-N 3.06Š|
| 20 | G | 33.9 | Very low | 45.5 | Very low | 81 Ų | 81 | 132.1 Ų | 132.1 | 84% | 0.835 | 78% | 0.778 | S | S | * | * | | | trans | 171 | 97.2 | 152.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | | |
| 21 | S | 44.4 | Very low | 44.9 | Very low | 127 Ų | 127 | 132.8 Ų | 132.8 | 89% | 0.888 | 78% | 0.783 | S | S | * | * | | | trans | -75.4 | 135.3 | 171.2 | -45.3 | 0 | 0 | 0 | 0 | 111.2 | | |
| 22 | Q | 36.3 | Very low | 45.2 | Very low | 185 Ų | 185 | 138.2 Ų | 138.2 | 86% | 0.864 | 79% | 0.794 | S | S | * | * | | | | 163.5 | 137.9 | 128.8 | -171.2 | 166.2 | -27.3 | 0 | 0 | 110.4 | | |
| 23 | P | 44.3 | Very low | 45.3 | Very low | 126 Ų | 126 | 139 Ų | 139 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | | | trans | -87.6 | 151.8 | -176.9 | 34.9 | -34.8 | 0 | 0 | 0 | 112.8 | | |
| 24 | G | 36.5 | Very low | 45.9 | Very low | 71 Ų | 71 | 140.7 Ų | 140.7 | 73% | 0.732 | 80% | 0.801 | S | S | * | * | | | trans | -175.5 | 116.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 25 | D | 36.3 | Very low | 46.2 | Very low | 173 Ų | 173 | 143.9 Ų | 143.9 | 93% | 0.925 | 80% | 0.797 | S | S | * | * | | | trans | 41.5 | 116.1 | 159.8 | -64.1 | -31.3 | 0 | 0 | 0 | 120.8 | | |
| 26 | G | 38.8 | Very low | 47.4 | Very low | 69 Ų | 69 | 145.3 Ų | 145.3 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | | | | 128.8 | 118.2 | 117.4 | 0 | 0 | 0 | 0 | 0 | 118.1 | | |
| 27 | Q | 39.1 | Very low | 48 | Very low | 182 Ų | 182 | 147.4 Ų | 147.4 | 85% | 0.85 | 81% | 0.805 | S | S | * | * | | | trans | 80.2 | 125.3 | 149.1 | -55 | 179 | 2.5 | 0 | 0 | 118.6 | | |
| 28 | Q | 46.4 | Very low | 49.5 | Very low | 175 Ų | 175 | 149.2 Ų | 149.2 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | | | trans | 57.3 | 88.7 | 149.7 | -64.7 | 170.9 | 1.2 | 0 | 0 | 116.7 | | |
| 29 | A | 43.2 | Very low | 50.9 | Low | 99 Ų | 99 | 152.5 Ų | 152.5 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | | | trans | -91.9 | 121.8 | 131.4 | 0 | 0 | 0 | 0 | 0 | 106.5 | | |
| 30 | E | 50.1 | Low | 52.3 | Low | 169 Ų | 169 | 144.3 Ų | 144.3 | 79% | 0.79 | 79% | 0.794 | S | S | * | * | | | trans | -66.8 | 135.2 | 154.2 | -62.8 | -174.6 | 153.4 | 0 | 0 | 105.6 | E32 | E30-E32 PolarHBondContact O-N 3.31Š|
| 31 | E | 54.1 | Low | 54.2 | Low | 187 Ų | 187 | 144.9 Ų | 144.9 | 87% | 0.874 | 78% | 0.778 | S | S | * | * | | | trans | -70.1 | 89.3 | 171.9 | -70.4 | 175.3 | 170.4 | 0 | 0 | 106.3 | D33 | E31-D33 PolarHBondContact O-N 2.99Å; E31-D33 VanDerWaalsContact O-N 3.16Å |
| 32 | E | 51.6 | Low | 55.1 | Low | 170 Ų | 170 | 147 Ų | 147 | 79% | 0.794 | 77% | 0.768 | S | S | * | * | | | trans | -60.2 | 113 | 160.4 | -70.1 | -173 | 167.3 | 0 | 0 | 105.6 | E30 E34 | E30-E32 PolarHBondContact O-N 3.31Å; E32-E34 VanDerWaalsContact C-N 3.27Å; E32-E34 PolarHBondContact O-N 2.79Å |
| 33 | D | 55.8 | Low | 56.4 | Low | 149 Ų | 149 | 144.5 Ų | 144.5 | 80% | 0.797 | 76% | 0.759 | S | S | * | * | | | trans | -60.3 | 94.4 | 172.2 | -73.3 | -56 | 0 | 0 | 0 | 107.5 | E31 E35 | E31-D33 PolarHBondContact O-N 2.99Å; E31-D33 VanDerWaalsContact O-N 3.16Å; D33-E35 PolarHBondContact O-N 3.4Å |
| 34 | E | 63 | Low | 57.2 | Low | 174 Ų | 174 | 141.1 Ų | 141.1 | 81% | 0.813 | 74% | 0.742 | S | S | * | * | | | trans | -65.1 | 85.1 | 170.3 | -72.5 | -177.6 | 171.7 | 0 | 0 | 107.4 | E32 D36 | E32-E34 VanDerWaalsContact C-N 3.27Å; E32-E34 PolarHBondContact O-N 2.79Å; E34-D36 PolarHBondContact O-N 2.77Å |
| 35 | E | 60.3 | Low | 58.1 | Low | 137 Ų | 137 | 144.7 Ų | 144.7 | 64% | 0.64 | 74% | 0.74 | S | S | * | * | | | trans | -58.3 | 101.7 | 175.9 | -70.2 | 179.6 | 150.1 | 0 | 0 | 108.5 | D33 W37 | D33-E35 PolarHBondContact O-N 3.4Å; E35-W37 VanDerWaalsContact C-N 3.34Å; E35-W37 PolarHBondContact O-N 3.25Å; E35-W37 PolarHBondContact O-NE1 2.82Å |
| 36 | D | 71.8 | Confident | 59.1 | Low | 151 Ų | 151 | 139.7 Ų | 139.7 | 81% | 0.807 | 72% | 0.723 | S | S | * | * | | | trans | -60.3 | 89.8 | 179.8 | -83.6 | -47 | 0 | 0 | 0 | 110.9 | E34 I38 | E34-D36 PolarHBondContact O-N 2.77Å; D36-I38 VanDerWaalsContact C-N 3.31Å; D36-I38 PolarHBondContact O-N 2.89Å |
| 37 | W | 70.8 | Confident | 59.8 | Low | 222 Ų | 222 | 141.5 Ų | 141.5 | 84% | 0.841 | 72% | 0.723 | S | S | * | * | | | trans | -68.8 | 86.6 | 175 | -67 | 92.1 | 0 | 0 | 0 | 110.3 | E35 L39 | E35-W37 VanDerWaalsContact C-N 3.34Å; E35-W37 PolarHBondContact O-N 3.25Å; E35-W37 PolarHBondContact O-NE1 2.82Å; W37-L39 PolarHBondContact O-N 2.81Å |
| 38 | I | 76.2 | Confident | 60.5 | Low | 146 Ų | 146 | 137.1 Ų | 137.1 | 75% | 0.749 | 71% | 0.713 | S | S | * | * | | | trans | -62.3 | 106.3 | 175.4 | -59.5 | 174.6 | 0 | 0 | 0 | 109.2 | D36 V40 | D36-I38 VanDerWaalsContact C-N 3.31Å; D36-I38 PolarHBondContact O-N 2.89Å; I38-V40 HydrophobicContact CG2-CG2 4.34Å; I38-V40 PolarHBondContact O-N 3Å |
| 39 | L | 72.8 | Confident | 60.6 | Low | 164 Ų | 164 | 133.9 Ų | 133.9 | 86% | 0.859 | 71% | 0.709 | S | S | * | * | | | trans | -71.8 | 91.2 | 174 | -177.1 | 63.6 | 0 | 0 | 0 | 110.1 | W37 N41 | W37-L39 PolarHBondContact O-N 2.81Å; L39-N41 PolarHBondContact O-N 2.94Å |
| 40 | V | 72.7 | Confident | 60.9 | Low | 74 Ų | 74 | 137 Ų | 137 | 45% | 0.448 | 71% | 0.706 | S | S | . | * | | | trans | -67.7 | 99.3 | 173.7 | -177.4 | 0 | 0 | 0 | 0 | 109.4 | I38 Y42 | I38-V40 HydrophobicContact CG2-CG2 4.34Å; I38-V40 PolarHBondContact O-N 3Å; V40-Y42 HydrophobicContact CB-CE2 4.09Å; V40-Y42 HydrophobicContact CG1-CD1 4.01Å; V40-Y42 HydrophobicContact CG1-CD2 4.31Å; V40-Y42 HydrophobicContact CG1-CE1 3.64Å; V40-Y42 HydrophobicContact CG1-CE2 3.95Å; V40-Y42 HydrophobicContact CG1-CG 4.34Å; V40-Y42 VanDerWaalsContact O-CD2 3.23Å; V40-Y42 WeakPolarHBondContact O-CD2 3.18Å; V40-Y42 WeakPolarHBondContact O-CE2 3.46Å; V40-Y42 PolarHBondContact O-N 3.2Å; V40-Y42 VanDerWaalsContact O-N 3.11Å |
| 41 | N | 74.2 | Confident | 60.7 | Low | 93 Ų | 93 | 134.9 Ų | 134.9 | 50% | 0.497 | 71% | 0.709 | S | S | . | * | | | trans | -81 | 86.1 | 176.4 | -176.6 | 14.6 | 0 | 0 | 0 | 111.2 | L39 L43 A44 | L39-N41 PolarHBondContact O-N 2.94Å; N41-L43 PolarHBondContact O-N 2.97Å; N41-L43 WeakPolarHBondContact OD1-CB 3.41Å; N41-L43 PolarHBondContact OD1-N 3.39Å; N41-A44 WeakPolarHBondContact O-CB 3.43Å; N41-A44 PolarHBondContact O-N 3.29Å |
| 42 | Y | 63 | Low | 60.1 | Low | 172 Ų | 172 | 128.5 Ų | 128.5 | 68% | 0.675 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -56.1 | -20 | 178.4 | -61.1 | -79.5 | 0 | 0 | 0 | 114.6 | V40 A46 | V40-Y42 HydrophobicContact CB-CE2 4.09Å; V40-Y42 HydrophobicContact CG1-CD1 4.01Å; V40-Y42 HydrophobicContact CG1-CD2 4.31Å; V40-Y42 HydrophobicContact CG1-CE1 3.64Å; V40-Y42 HydrophobicContact CG1-CE2 3.95Å; V40-Y42 HydrophobicContact CG1-CG 4.34Å; V40-Y42 VanDerWaalsContact O-CD2 3.23Å; V40-Y42 WeakPolarHBondContact O-CD2 3.18Å; V40-Y42 WeakPolarHBondContact O-CE2 3.46Å; V40-Y42 PolarHBondContact O-N 3.2Å; V40-Y42 VanDerWaalsContact O-N 3.11Å; Y42-A46 PolarHBondContact O-N 3.21Å |
| 43 | L | 64 | Low | 60.1 | Low | 131 Ų | 131 | 128.4 Ų | 128.4 | 69% | 0.686 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -69.8 | -32.7 | 174.5 | -60.8 | 172.2 | 0 | 0 | 0 | 112.1 | N41 E45 C47 | N41-L43 PolarHBondContact O-N 2.97Å; N41-L43 WeakPolarHBondContact OD1-CB 3.41Å; N41-L43 PolarHBondContact OD1-N 3.39Å; L43-E45 VanDerWaalsContact C-N 3.35Å; L43-C47 PolarHBondContact O-N 3.49Å; L43-C47 PolarHBondContact O-SG 3.46Å |
| 44 | A | 61.1 | Low | 59.3 | Low | 56 Ų | 56 | 124.6 Ų | 124.6 | 46% | 0.463 | 69% | 0.694 | S | S | . | * | H | α-helix | trans | -67.8 | -36.5 | 179 | 0 | 0 | 0 | 0 | 0 | 112 | N41 C47 S48 | N41-A44 WeakPolarHBondContact O-CB 3.43Å; N41-A44 PolarHBondContact O-N 3.29Å; A44-C47 PolarHBondContact O-N 3.43Å; A44-S48 PolarHBondContact O-N 3.11Å |
| 45 | E | 55.8 | Low | 58.4 | Low | 145 Ų | 145 | 124 Ų | 124 | 68% | 0.678 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -73 | -37.1 | -179.7 | -165 | 163 | -168.3 | 0 | 0 | 111.9 | L43 C47 S48 | L43-E45 VanDerWaalsContact C-N 3.35Å; E45-C47 PolarHBondContact O-N 3.39Å; E45-S48 PolarHBondContact O-N 2.96Å |
| 46 | A | 57 | Low | 57.6 | Low | 69 Ų | 69 | 122.6 Ų | 122.6 | 57% | 0.57 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -60.6 | -43.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y42 S48 S49 | Y42-A46 PolarHBondContact O-N 3.21Å; A46-S48 VanDerWaalsContact C-N 3.34Å; A46-S48 PolarHBondContact O-N 3.03Å; A46-S49 PolarHBondContact O-OG 2.95Å |
| 47 | C | 52.6 | Low | 56.2 | Low | 106 Ų | 106 | 122.4 Ų | 122.4 | 72% | 0.716 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -74.3 | -16.6 | -178.7 | -67.4 | 0 | 0 | 0 | 0 | 114.6 | L43 A44 E45 | L43-C47 PolarHBondContact O-N 3.49Å; L43-C47 PolarHBondContact O-SG 3.46Å; A44-C47 PolarHBondContact O-N 3.43Å; E45-C47 PolarHBondContact O-N 3.39Å |
| 48 | S | 54.2 | Low | 54.7 | Low | 91 Ų | 91 | 117.2 Ų | 117.2 | 64% | 0.636 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -81.1 | -19.2 | -176.7 | -164.1 | 0 | 0 | 0 | 0 | 113.6 | A44 E45 A46 H50 | A44-S48 PolarHBondContact O-N 3.11Å; E45-S48 PolarHBondContact O-N 2.96Å; A46-S48 VanDerWaalsContact C-N 3.34Å; A46-S48 PolarHBondContact O-N 3.03Å; S48-H50 VanDerWaalsContact C-N 3.35Å; S48-H50 PolarHBondContact O-N 2.99Å |
| 49 | S | 49.4 | Very low | 52.8 | Low | 106 Ų | 106 | 115.4 Ų | 115.4 | 74% | 0.741 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | -4.3 | -173.7 | 68.7 | 0 | 0 | 0 | 0 | 115.8 | A46 | A46-S49 PolarHBondContact O-OG 2.95Š|
| 50 | H | 48.8 | Very low | 51.4 | Low | 164 Ų | 164 | 114.6 Ų | 114.6 | 76% | 0.759 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133.5 | 55.1 | -177.1 | -157.9 | 70.9 | 0 | 0 | 0 | 114 | S48 G52 | S48-H50 VanDerWaalsContact C-N 3.35Å; S48-H50 PolarHBondContact O-N 2.99Å; H50-G52 PolarHBondContact O-N 3.04Å |
| 51 | C | 44.8 | Very low | 49.6 | Very low | 125 Ų | 125 | 118.3 Ų | 118.3 | 85% | 0.845 | 70% | 0.704 | S | S | * | * | | | trans | -76.5 | 69 | 158.8 | 44.9 | 0 | 0 | 0 | 0 | 110.6 | | |
| 52 | G | 41.7 | Very low | 48.3 | Very low | 53 Ų | 53 | 119.5 Ų | 119.5 | 55% | 0.546 | 72% | 0.717 | S | S | . | * | | | trans | -74.4 | 125.6 | 163.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | H50 G54 | H50-G52 PolarHBondContact O-N 3.04Å; G52-G54 PolarHBondContact O-N 3.13Å |
| 53 | D | 53.2 | Low | 47 | Very low | 169 Ų | 169 | 119.3 Ų | 119.3 | 90% | 0.904 | 72% | 0.722 | S | S | * | * | | | trans | -50 | 128.8 | 178.3 | -177.1 | 25.3 | 0 | 0 | 0 | 113.1 | | |
| 54 | G | 37.8 | Very low | 46.2 | Very low | 68 Ų | 68 | 121 Ų | 121 | 70% | 0.701 | 73% | 0.727 | S | S | * | * | | | trans | 179.9 | 78 | -168.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | G52 | G52-G54 PolarHBondContact O-N 3.13Š|
| 55 | L | 44.7 | Very low | 45 | Very low | 163 Ų | 163 | 125.2 Ų | 125.2 | 85% | 0.853 | 74% | 0.741 | S | S | * | * | | | trans | -30.3 | 141.8 | 159.1 | -52.8 | 158.3 | 0 | 0 | 0 | 113.1 | | |
| 56 | S | 43.5 | Very low | 44.8 | Very low | 107 Ų | 107 | 127.4 Ų | 127.4 | 75% | 0.748 | 75% | 0.751 | S | S | * | * | | | cis | -159.1 | 145.8 | 31.8 | -49.5 | 0 | 0 | 0 | 0 | 113.6 | | |
| 57 | D | 42.3 | Very low | 44 | Very low | 146 Ų | 146 | 133.4 Ų | 133.4 | 78% | 0.781 | 77% | 0.767 | S | S | * | * | | | trans | 4.3 | 119.8 | 132.1 | -171.5 | 24 | 0 | 0 | 0 | 119.8 | | |
| 58 | S | 39.9 | Very low | 43.9 | Very low | 114 Ų | 114 | 137.8 Ų | 137.8 | 80% | 0.797 | 78% | 0.778 | S | S | * | * | | | | -166.4 | 109.1 | 127.9 | -158.9 | 0 | 0 | 0 | 0 | 115.1 | | |
| 59 | T | 36 | Very low | 43.4 | Very low | 108 Ų | 108 | 141.7 Ų | 141.7 | 66% | 0.663 | 79% | 0.786 | S | S | * | * | | | trans | 1.6 | 114.7 | 145.1 | -51.6 | 0 | 0 | 0 | 0 | 121.9 | | |
| 60 | I | 41.9 | Very low | 43.3 | Very low | 147 Ų | 147 | 146 Ų | 146 | 75% | 0.754 | 79% | 0.794 | S | S | * | * | | | trans | 19.9 | 126.4 | 130.4 | -45.4 | 162.2 | 0 | 0 | 0 | 119.9 | | |
| 61 | I | 36 | Very low | 43.4 | Very low | 151 Ų | 151 | 146.4 Ų | 146.4 | 77% | 0.774 | 80% | 0.797 | S | S | * | * | | | | 177.4 | 141.2 | 124.4 | -91.9 | 158.2 | 0 | 0 | 0 | 109.6 | | |
| 62 | P | 47.7 | Very low | 43.6 | Very low | 118 Ų | 118 | 149.7 Ų | 149.7 | 77% | 0.766 | 80% | 0.799 | S | S | * | * | | | trans | -83 | 144.6 | 173 | 33.9 | -34.2 | 0 | 0 | 0 | 112.2 | | |
| 63 | H | 35.5 | Very low | 44.2 | Very low | 169 Ų | 169 | 155.2 Ų | 155.2 | 78% | 0.782 | 81% | 0.811 | S | S | * | * | | | trans | -136.4 | 140.4 | 165.3 | -156.3 | -82.2 | 0 | 0 | 0 | 109.3 | | |
| 64 | E | 47 | Very low | 44.5 | Very low | 167 Ų | 167 | 154.1 Ų | 154.1 | 78% | 0.78 | 81% | 0.805 | S | S | * | * | | | trans | -85.3 | -173.5 | 174.5 | -61.1 | 177.3 | 164.6 | 0 | 0 | 109.3 | | |
| 65 | D | 36.1 | Very low | 45.5 | Very low | 144 Ų | 144 | 157.4 Ų | 157.4 | 77% | 0.77 | 81% | 0.806 | S | S | * | * | | | trans | 85 | 118.5 | 172.2 | -51.1 | -36.3 | 0 | 0 | 0 | 118.3 | | |
| 66 | E | 50.1 | Low | 46.3 | Very low | 190 Ų | 190 | 155 Ų | 155 | 89% | 0.888 | 80% | 0.798 | S | S | * | * | | | trans | -38.1 | 133.4 | 166.6 | -54 | 165.9 | 171 | 0 | 0 | 115.5 | | |
| 67 | E | 40.3 | Very low | 47.2 | Very low | 195 Ų | 195 | 157.9 Ų | 157.9 | 91% | 0.911 | 80% | 0.801 | S | S | * | * | | | | -149.8 | 151.8 | 127.6 | -72.2 | -151.1 | 156.9 | 0 | 0 | 109.3 | | |
| 68 | E | 50 | Low | 48 | Very low | 199 Ų | 199 | 157.5 Ų | 157.5 | 93% | 0.93 | 80% | 0.798 | S | S | * | * | | | trans | -87.6 | 112.8 | -179 | -63.7 | 176.7 | 154.7 | 0 | 0 | 110.9 | | |
| 69 | E | 45 | Very low | 49.1 | Very low | 173 Ų | 173 | 157.5 Ų | 157.5 | 81% | 0.808 | 80% | 0.795 | S | S | * | * | | | trans | -126.3 | 121.4 | 158.4 | -68.2 | -160.7 | 164.8 | 0 | 0 | 109.9 | E71 | E69-E71 VanDerWaalsContact C-N 3.3Å; E69-E71 PolarHBondContact O-N 3.38Å |
| 70 | E | 46.9 | Very low | 50.2 | Low | 197 Ų | 197 | 157.6 Ų | 157.6 | 92% | 0.921 | 80% | 0.8 | S | S | * | * | | | trans | -73.1 | 84.3 | 170.8 | -67.9 | -176.7 | 153.6 | 0 | 0 | 108.4 | E72 | E70-E72 PolarHBondContact O-N 3.2Š|
| 71 | E | 51 | Low | 50.8 | Low | 172 Ų | 172 | 156.4 Ų | 156.4 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | | | trans | -63.8 | 106.9 | 167.4 | -74.2 | -166.1 | 163.7 | 0 | 0 | 108.9 | E69 E73 | E69-E71 VanDerWaalsContact C-N 3.3Å; E69-E71 PolarHBondContact O-N 3.38Å; E71-E73 PolarHBondContact O-N 3.08Å |
| 72 | E | 48.3 | Very low | 51.7 | Low | 194 Ų | 194 | 157 Ų | 157 | 91% | 0.907 | 81% | 0.805 | S | S | * | * | | | trans | -62.7 | 99.7 | 179 | -59.4 | -171.5 | -121.8 | 0 | 0 | 109.4 | E70 D74 | E70-E72 PolarHBondContact O-N 3.2Å; E72-D74 PolarHBondContact O-N 3.32Å |
| 73 | E | 54.5 | Low | 51.9 | Low | 168 Ų | 168 | 155.7 Ų | 155.7 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | | | trans | -50.1 | 108.5 | -178.7 | -62.2 | 177.2 | -133.2 | 0 | 0 | 110.5 | E71 L75 | E71-E73 PolarHBondContact O-N 3.08Å; E73-L75 VanDerWaalsContact C-N 3.29Å; E73-L75 PolarHBondContact O-N 2.87Å |
| 74 | D | 59.3 | Low | 52.9 | Low | 146 Ų | 146 | 152.7 Ų | 152.7 | 78% | 0.781 | 80% | 0.802 | S | S | * | * | | | trans | -65.8 | 92.6 | 172.8 | -176.4 | 33.7 | 0 | 0 | 0 | 108.3 | E72 V76 | E72-D74 PolarHBondContact O-N 3.32Å; D74-V76 PolarHBondContact O-N 2.92Å |
| 75 | L | 59.9 | Low | 53.5 | Low | 138 Ų | 138 | 150.2 Ų | 150.2 | 72% | 0.723 | 80% | 0.801 | S | S | * | * | | | trans | -66.4 | 80.7 | -178.9 | -69.9 | 176.1 | 0 | 0 | 0 | 109.6 | E73 M77 | E73-L75 VanDerWaalsContact C-N 3.29Å; E73-L75 PolarHBondContact O-N 2.87Å; L75-M77 PolarHBondContact O-N 3.47Å |
| 76 | V | 61.6 | Low | 54.5 | Low | 112 Ų | 112 | 147.7 Ų | 147.7 | 68% | 0.679 | 80% | 0.8 | S | S | * | * | | | trans | -49.8 | 110.1 | 174.7 | -73.7 | 0 | 0 | 0 | 0 | 109 | D74 I78 | D74-V76 PolarHBondContact O-N 2.92Å; V76-I78 VanDerWaalsContact C-N 3.32Å; V76-I78 PolarHBondContact O-N 2.9Å |
| 77 | M | 61.5 | Low | 54.9 | Low | 168 Ų | 168 | 145 Ų | 145 | 83% | 0.828 | 79% | 0.79 | S | S | * | * | | | trans | -68.9 | 91.4 | -175.9 | -85.1 | -96.5 | 59.3 | 0 | 0 | 109.6 | L75 P79 | L75-M77 PolarHBondContact O-N 3.47Å; M77-P79 WeakPolarHBondContact O-CD 3.23Å; M77-P79 VanDerWaalsContact O-N 3.08Å |
| 78 | I | 58.7 | Low | 55.8 | Low | 137 Ų | 137 | 146.8 Ų | 146.8 | 70% | 0.703 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 116.2 | 172.8 | -56.2 | 177.7 | 0 | 0 | 0 | 107.2 | V76 S80 | V76-I78 VanDerWaalsContact C-N 3.32Å; V76-I78 PolarHBondContact O-N 2.9Å; I78-S80 PolarHBondContact O-N 3.22Å; I78-S80 VanDerWaalsContact O-N 3.14Å |
| 79 | P | 63.8 | Low | 55.8 | Low | 115 Ų | 115 | 146.6 Ų | 146.6 | 75% | 0.747 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 122.5 | 176.1 | -21.5 | 33.5 | 0 | 0 | 0 | 108.4 | M77 | M77-P79 WeakPolarHBondContact O-CD 3.23Å; M77-P79 VanDerWaalsContact O-N 3.08Å |
| 80 | S | 58.4 | Low | 56.4 | Low | 109 Ų | 109 | 143.5 Ų | 143.5 | 76% | 0.762 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 131.5 | 173.2 | -63.6 | 0 | 0 | 0 | 0 | 109 | I78 I82 | I78-S80 PolarHBondContact O-N 3.22Å; I78-S80 VanDerWaalsContact O-N 3.14Å; S80-I82 PolarHBondContact O-N 3.5Å; S80-I82 VanDerWaalsContact O-N 3.15Å |
| 81 | P | 54.7 | Low | 56.6 | Low | 122 Ų | 122 | 138.6 Ų | 138.6 | 79% | 0.792 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 127.6 | 179.1 | 23.2 | -33 | 0 | 0 | 0 | 108.4 | A83 | P81-A83 PolarHBondContact O-N 3.22Š|
| 82 | I | 54.7 | Low | 56.7 | Low | 164 Ų | 164 | 136.5 Ų | 136.5 | 84% | 0.841 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 118.7 | 180 | -176.2 | 166.1 | 0 | 0 | 0 | 108.3 | S80 S84 | S80-I82 PolarHBondContact O-N 3.5Å; S80-I82 VanDerWaalsContact O-N 3.15Å; I82-S84 PolarHBondContact O-N 3Å |
| 83 | A | 53.1 | Low | 56.8 | Low | 90 Ų | 90 | 132.7 Ų | 132.7 | 74% | 0.744 | 76% | 0.756 | S | S | * | * | | | trans | -61.4 | 111.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | P81 | P81-A83 PolarHBondContact O-N 3.22Š|
| 84 | S | 56.7 | Low | 56.7 | Low | 106 Ų | 106 | 129.1 Ų | 129.1 | 74% | 0.741 | 75% | 0.75 | S | S | * | * | | | trans | -47.7 | 131 | 172.8 | -59.6 | 0 | 0 | 0 | 0 | 108.6 | I82 A86 | I82-S84 PolarHBondContact O-N 3Å; S84-A86 PolarHBondContact O-N 3.32Å; S84-A86 VanDerWaalsContact O-N 3.14Å |
| 85 | P | 58.3 | Low | 56.4 | Low | 116 Ų | 116 | 131 Ų | 131 | 75% | 0.753 | 76% | 0.758 | S | S | * | * | | | trans | -56.1 | 127 | -175.2 | 22.9 | -33.3 | 0 | 0 | 0 | 108.8 | I87 | P85-I87 PolarHBondContact O-N 3.37Š|
| 86 | A | 57.8 | Low | 56.2 | Low | 91 Ų | 91 | 130.6 Ų | 130.6 | 75% | 0.752 | 76% | 0.757 | S | S | * | * | | | trans | -59 | 103.5 | -176.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | S84 R88 | S84-A86 PolarHBondContact O-N 3.32Å; S84-A86 VanDerWaalsContact O-N 3.14Å; A86-R88 VanDerWaalsContact C-N 3.34Å; A86-R88 PolarHBondContact O-N 3.3Å |
| 87 | I | 58 | Low | 55.7 | Low | 133 Ų | 133 | 130.9 Ų | 130.9 | 68% | 0.682 | 76% | 0.764 | S | S | * | * | | | trans | -64 | 99.2 | 176.2 | -59.7 | 176.9 | 0 | 0 | 0 | 106.5 | P85 Y89 | P85-I87 PolarHBondContact O-N 3.37Å; I87-Y89 VanDerWaalsContact C-N 3.34Å; I87-Y89 HydrophobicContact CG2-CD2 4.39Å; I87-Y89 HydrophobicContact CG2-CE2 4.19Å; I87-Y89 WeakPolarHBondContact O-CD2 3.04Å; I87-Y89 PolarHBondContact O-N 3.22Å |
| 88 | R | 58.8 | Low | 55.4 | Low | 232 Ų | 232 | 129.2 Ų | 129.2 | 88% | 0.875 | 76% | 0.764 | S | S | * | * | | | trans | -72.5 | 94.4 | 172.6 | -62.9 | -171.6 | -167.9 | -178.7 | 5.5 | 107.3 | A86 P90 | A86-R88 VanDerWaalsContact C-N 3.34Å; A86-R88 PolarHBondContact O-N 3.3Å; R88-P90 WeakPolarHBondContact O-CD 3.1Å |
| 89 | Y | 51.7 | Low | 55 | Low | 196 Ų | 196 | 126.8 Ų | 126.8 | 77% | 0.769 | 76% | 0.764 | S | S | * | * | | | trans | -56.2 | 122.9 | 164.3 | -71.6 | -89 | 0 | 0 | 0 | 108.4 | I87 S91 | I87-Y89 VanDerWaalsContact C-N 3.34Å; I87-Y89 HydrophobicContact CG2-CD2 4.39Å; I87-Y89 HydrophobicContact CG2-CE2 4.19Å; I87-Y89 WeakPolarHBondContact O-CD2 3.04Å; I87-Y89 PolarHBondContact O-N 3.22Å; Y89-S91 PolarHBondContact O-N 3.02Å |
| 90 | P | 56.7 | Low | 54.4 | Low | 107 Ų | 107 | 128.3 Ų | 128.3 | 70% | 0.695 | 77% | 0.766 | S | S | * | * | | | trans | -62.8 | 129.1 | 167.1 | 27.1 | -32 | 0 | 0 | 0 | 107.8 | R88 C92 | R88-P90 WeakPolarHBondContact O-CD 3.1Å; P90-C92 PolarHBondContact O-N 2.86Å |
| 91 | S | 51.3 | Low | 54.3 | Low | 95 Ų | 95 | 129.2 Ų | 129.2 | 66% | 0.664 | 77% | 0.767 | S | S | * | * | | | trans | -67.6 | 104.8 | 176.4 | -179.4 | 0 | 0 | 0 | 0 | 108.9 | Y89 T93 | Y89-S91 PolarHBondContact O-N 3.02Å; S91-T93 PolarHBondContact O-N 3.11Å; S91-T93 PolarHBondContact OG-OG1 3.45Å |
| 92 | C | 52.6 | Low | 54.2 | Low | 128 Ų | 128 | 129.7 Ų | 129.7 | 87% | 0.865 | 76% | 0.763 | S | S | * | * | | | trans | -71.8 | 69.9 | 179 | -61.4 | 0 | 0 | 0 | 0 | 111.3 | P90 | P90-C92 PolarHBondContact O-N 2.86Š|
| 93 | T | 50.8 | Low | 54.6 | Low | 114 Ų | 114 | 127.9 Ų | 127.9 | 70% | 0.699 | 76% | 0.762 | S | S | * | * | | | trans | -124 | 65.6 | 178.6 | 53.4 | 0 | 0 | 0 | 0 | 111 | S91 | S91-T93 PolarHBondContact O-N 3.11Å; S91-T93 PolarHBondContact OG-OG1 3.45Å |
| 94 | S | 53 | Low | 54.5 | Low | 93 Ų | 93 | 130.6 Ų | 130.6 | 65% | 0.65 | 76% | 0.764 | S | S | * | * | | | trans | -170.6 | 115.2 | 147.8 | -167.9 | 0 | 0 | 0 | 0 | 110.2 | | |
| 95 | L | 52.8 | Low | 54.4 | Low | 184 Ų | 184 | 129.1 Ų | 129.1 | 96% | 0.963 | 77% | 0.765 | S | S | * | * | | | trans | -142.5 | 81.4 | 165.3 | -79.1 | -177.7 | 0 | 0 | 0 | 109 | | |
| 96 | N | 55.5 | Low | 53.7 | Low | 130 Ų | 130 | 127.4 Ų | 127.4 | 70% | 0.695 | 77% | 0.769 | S | S | * | * | | | trans | -154.8 | 42.7 | 163.9 | 66 | -18.1 | 0 | 0 | 0 | 112.8 | T98 | N96-T98 PolarHBondContact O-N 3.07Š|
| 97 | S | 51.4 | Low | 53.5 | Low | 119 Ų | 119 | 127.4 Ų | 127.4 | 83% | 0.832 | 77% | 0.769 | S | S | * | * | | | trans | -77.6 | 94.9 | 161.6 | -70.8 | 0 | 0 | 0 | 0 | 109.4 | A99 | S97-A99 VanDerWaalsContact C-N 3.27Å; S97-A99 PolarHBondContact O-N 3.35Å; S97-A99 VanDerWaalsContact O-N 3.11Å |
| 98 | T | 53.7 | Low | 52.9 | Low | 132 Ų | 132 | 129.5 Ų | 129.5 | 81% | 0.81 | 78% | 0.776 | S | S | * | * | | | trans | -80.8 | 76.8 | 167.6 | 56.2 | 0 | 0 | 0 | 0 | 109.1 | N96 D100 | N96-T98 PolarHBondContact O-N 3.07Å; T98-D100 VanDerWaalsContact C-N 3.28Å; T98-D100 PolarHBondContact O-N 3.05Å |
| 99 | A | 51.8 | Low | 52.4 | Low | 87 Ų | 87 | 125.2 Ų | 125.2 | 72% | 0.719 | 77% | 0.77 | S | S | * | * | | | trans | -84.1 | 79 | 167.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | S97 T101 | S97-A99 VanDerWaalsContact C-N 3.27Å; S97-A99 PolarHBondContact O-N 3.35Å; S97-A99 VanDerWaalsContact O-N 3.11Å; A99-T101 PolarHBondContact O-N 3Å |
| 100 | D | 50.5 | Low | 52.2 | Low | 146 Ų | 146 | 123 Ų | 123 | 78% | 0.781 | 77% | 0.772 | S | S | * | * | | | trans | -91.2 | 86.9 | 172.2 | -163.5 | 26.3 | 0 | 0 | 0 | 107.6 | T98 | T98-D100 VanDerWaalsContact C-N 3.28Å; T98-D100 PolarHBondContact O-N 3.05Å |
| 101 | T | 56.5 | Low | 51.9 | Low | 128 Ų | 128 | 126.1 Ų | 126.1 | 79% | 0.785 | 78% | 0.777 | S | S | * | * | | | trans | -96.3 | 95.3 | 173.2 | 53.6 | 0 | 0 | 0 | 0 | 107.9 | A99 P103 | A99-T101 PolarHBondContact O-N 3Å; T101-P103 VanDerWaalsContact O-CD 3.27Å; T101-P103 WeakPolarHBondContact O-CD 3.32Å |
| 102 | D | 53.3 | Low | 51.8 | Low | 132 Ų | 132 | 129.3 Ų | 129.3 | 71% | 0.706 | 79% | 0.787 | S | S | * | * | | | trans | -95.1 | 105.7 | 177.8 | -153 | 4.4 | 0 | 0 | 0 | 108.8 | D104 | D102-D104 PolarHBondContact O-N 3.34Å; D102-D104 VanDerWaalsContact O-N 3.12Å |
| 103 | P | 61.4 | Low | 51.6 | Low | 127 Ų | 127 | 127 Ų | 127 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | | | trans | -85.7 | 63.6 | 177.2 | 36.5 | -35.1 | 0 | 0 | 0 | 110.2 | T101 | T101-P103 VanDerWaalsContact O-CD 3.27Å; T101-P103 WeakPolarHBondContact O-CD 3.32Å |
| 104 | D | 51 | Low | 51.2 | Low | 146 Ų | 146 | 128.6 Ų | 128.6 | 78% | 0.781 | 79% | 0.789 | S | S | * | * | | | trans | -78.4 | 126 | 172.4 | -166.2 | 23.5 | 0 | 0 | 0 | 110.8 | D102 G106 | D102-D104 PolarHBondContact O-N 3.34Å; D102-D104 VanDerWaalsContact O-N 3.12Å; D104-G106 PolarHBondContact O-N 3.01Å; D104-G106 VanDerWaalsContact O-N 3.16Å |
| 105 | G | 55.5 | Low | 50.9 | Low | 75 Ų | 75 | 132 Ų | 132 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | | | trans | -82.4 | 93.6 | -168.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 106 | G | 43.9 | Very low | 50.5 | Low | 80 Ų | 80 | 131.6 Ų | 131.6 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | | | trans | -91.8 | 105.5 | 167 | 0 | 0 | 0 | 0 | 0 | 111.7 | D104 | D104-G106 PolarHBondContact O-N 3.01Å; D104-G106 VanDerWaalsContact O-N 3.16Å |
| 107 | A | 52.4 | Low | 49.9 | Very low | 91 Ų | 91 | 134 Ų | 134 | 75% | 0.752 | 80% | 0.795 | S | S | * | * | | | trans | -89.1 | 129.5 | 169.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | | |
| 108 | E | 46.6 | Very low | 49.5 | Very low | 178 Ų | 178 | 136.6 Ų | 136.6 | 83% | 0.832 | 79% | 0.794 | S | S | * | * | | | | 174 | 134.5 | 123.9 | 56 | -154.5 | 167.9 | 0 | 0 | 112.1 | | |
| 109 | D | 47.7 | Very low | 49 | Very low | 141 Ų | 141 | 139.5 Ų | 139.5 | 75% | 0.754 | 80% | 0.798 | S | S | * | * | | | trans | 41.8 | 121 | 150.6 | -48.9 | -17.9 | 0 | 0 | 0 | 119.1 | | |
| 110 | D | 47.1 | Very low | 48.7 | Very low | 150 Ų | 150 | 144.2 Ų | 144.2 | 80% | 0.802 | 81% | 0.805 | S | S | * | * | | | | -178.8 | 161.1 | 66 | -98.7 | -41.6 | 0 | 0 | 0 | 113.2 | | |
| 111 | E | 51.8 | Low | 48.6 | Very low | 172 Ų | 172 | 146.8 Ų | 146.8 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | | | trans | 60 | 108.6 | 155 | -67.1 | -177.2 | 147.9 | 0 | 0 | 123.1 | | |
| 112 | D | 48.4 | Very low | 48.1 | Very low | 162 Ų | 162 | 149.9 Ų | 149.9 | 87% | 0.866 | 82% | 0.818 | S | S | * | * | | | trans | 40.3 | 116.1 | 132.5 | -57.3 | -27.9 | 0 | 0 | 0 | 121.9 | | |
| 113 | G | 47.8 | Very low | 47.8 | Very low | 79 Ų | 79 | 152.9 Ų | 152.9 | 81% | 0.814 | 83% | 0.828 | S | S | * | * | | | trans | -178.3 | 115.4 | 166 | 0 | 0 | 0 | 0 | 0 | 114.6 | | |
| 114 | D | 42.3 | Very low | 46.8 | Very low | 149 Ų | 149 | 150.4 Ų | 150.4 | 80% | 0.797 | 83% | 0.825 | S | S | * | * | | | trans | -62.2 | 153.9 | -170 | -58.6 | -59.2 | 0 | 0 | 0 | 118.3 | | |
| 115 | E | 46.7 | Very low | 46.8 | Very low | 164 Ų | 164 | 147.5 Ų | 147.5 | 77% | 0.766 | 83% | 0.83 | S | S | * | * | | | trans | 65.4 | 128.2 | 140.4 | -71.5 | 169.2 | -170.8 | 0 | 0 | 122.7 | | |
| 116 | E | 44.8 | Very low | 46.3 | Very low | 175 Ų | 175 | 152.6 Ų | 152.6 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | | | trans | 48.4 | 129.9 | 143.4 | -50.8 | -175 | -169.7 | 0 | 0 | 118.8 | | |
| 117 | E | 44.1 | Very low | 46.9 | Very low | 181 Ų | 181 | 154.5 Ų | 154.5 | 85% | 0.846 | 82% | 0.822 | S | S | * | * | | | | -174.8 | 154.8 | 71.8 | -71.1 | 170.5 | 158.6 | 0 | 0 | 105.6 | | |
| 118 | E | 42.1 | Very low | 47.1 | Very low | 173 Ų | 173 | 161.4 Ų | 161.4 | 81% | 0.808 | 83% | 0.828 | S | S | * | * | | | cis | -155.7 | 170.6 | -17.5 | -111.3 | -168.2 | 132.5 | 0 | 0 | 107.1 | | |
| 119 | E | 44.2 | Very low | 47.4 | Very low | 193 Ų | 193 | 159.4 Ų | 159.4 | 90% | 0.902 | 82% | 0.823 | S | S | * | * | | | trans | -93.5 | 118.6 | 171.7 | -68.7 | 178.4 | 164.2 | 0 | 0 | 110.7 | | |
| 120 | E | 45.3 | Very low | 47.5 | Very low | 186 Ų | 186 | 157.1 Ų | 157.1 | 87% | 0.869 | 81% | 0.811 | S | S | * | * | | | trans | -127.5 | 78.8 | 165.6 | -74.1 | -159.2 | 158.4 | 0 | 0 | 112.1 | | |
| 121 | E | 47.6 | Very low | 47.8 | Very low | 201 Ų | 201 | 153.7 Ų | 153.7 | 94% | 0.939 | 80% | 0.803 | S | S | * | * | | | trans | -84.7 | 95.7 | 151 | -70.3 | -168.8 | 166.4 | 0 | 0 | 109.1 | | |
| 122 | E | 45.4 | Very low | 47.7 | Very low | 193 Ų | 193 | 148.6 Ų | 148.6 | 90% | 0.902 | 79% | 0.785 | S | S | * | * | | | trans | -137.8 | 124.7 | 155.2 | -150.7 | 172.1 | -158.5 | 0 | 0 | 114.9 | | |
| 123 | E | 47.4 | Very low | 47.9 | Very low | 195 Ų | 195 | 144.5 Ų | 144.5 | 91% | 0.911 | 77% | 0.769 | S | S | * | * | | | trans | -56.7 | 120.3 | 177.4 | -179.2 | 176.4 | -164.7 | 0 | 0 | 113.7 | | |
| 124 | G | 40.7 | Very low | 48.2 | Very low | 75 Ų | 75 | 147.2 Ų | 147.2 | 77% | 0.773 | 76% | 0.764 | S | S | * | * | | | trans | -141.5 | 78.6 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | F126 | G124-F126 PolarHBondContact O-N 3.04Š|
| 125 | G | 51.2 | Low | 48.9 | Very low | 85 Ų | 85 | 145.8 Ų | 145.8 | 88% | 0.876 | 75% | 0.753 | S | S | * | * | | | trans | -64.6 | 121 | -166.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | | |
| 126 | F | 45.6 | Very low | 49.3 | Very low | 182 Ų | 182 | 145.2 Ų | 145.2 | 80% | 0.798 | 75% | 0.751 | S | S | * | * | S | Bend | trans | -136.1 | 97.8 | 149.5 | -171.2 | -100.5 | 0 | 0 | 0 | 110.7 | G124 R128 | G124-F126 PolarHBondContact O-N 3.04Å; F126-R128 PolarHBondContact O-N 3.29Å |
| 127 | L | 56.6 | Low | 50.3 | Low | 120 Ų | 120 | 142 Ų | 142 | 63% | 0.628 | 75% | 0.747 | S | S | * | * | | | trans | 48.1 | 66.1 | 160.9 | -51.2 | -177.8 | 0 | 0 | 0 | 115.3 | L129 | L127-L129 HydrophobicContact CB-CG 4.49Å; L127-L129 PolarHBondContact O-N 3.02Å |
| 128 | R | 55.2 | Low | 51.1 | Low | 236 Ų | 236 | 142 Ų | 142 | 89% | 0.891 | 74% | 0.739 | S | S | * | * | | | trans | -64.9 | 78.9 | 148 | -177.3 | 177.7 | 168.7 | -178.6 | -3.9 | 107.5 | F126 D130 | F126-R128 PolarHBondContact O-N 3.29Å; R128-D130 PolarHBondContact O-N 3.44Å; R128-D130 VanDerWaalsContact O-N 3.11Å |
| 129 | L | 54.2 | Low | 51.9 | Low | 136 Ų | 136 | 140 Ų | 140 | 71% | 0.712 | 73% | 0.729 | S | S | * | * | | | trans | -53.9 | 114.8 | 164.2 | -76.2 | 158.8 | 0 | 0 | 0 | 105.8 | L127 A131 | L127-L129 HydrophobicContact CB-CG 4.49Å; L127-L129 PolarHBondContact O-N 3.02Å; L129-A131 PolarHBondContact O-N 3.03Å |
| 130 | D | 48.3 | Very low | 53 | Low | 93 Ų | 93 | 136.5 Ų | 136.5 | 50% | 0.497 | 72% | 0.72 | S | S | . | * | | | trans | -62.4 | 114.1 | 179.4 | -170 | 30.7 | 0 | 0 | 0 | 107.4 | R128 C132 S133 | R128-D130 PolarHBondContact O-N 3.44Å; R128-D130 VanDerWaalsContact O-N 3.11Å; D130-C132 PolarHBondContact O-N 3.32Å; D130-S133 WeakPolarHBondContact O-CB 3.4Å; D130-S133 PolarHBondContact O-N 2.86Å; D130-S133 PolarHBondContact O-OG 3.25Å |
| 131 | A | 54.9 | Low | 54.1 | Low | 77 Ų | 77 | 133.3 Ų | 133.3 | 64% | 0.636 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -59.5 | -28.8 | -170.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | L129 S133 L134 | L129-A131 PolarHBondContact O-N 3.03Å; A131-S133 VanDerWaalsContact C-N 3.34Å; A131-S133 PolarHBondContact O-N 2.9Å; A131-L134 PolarHBondContact O-N 2.83Å |
| 132 | C | 48.1 | Very low | 55.1 | Low | 65 Ų | 65 | 127.9 Ų | 127.9 | 44% | 0.439 | 70% | 0.696 | S | S | . | * | G | 310 helix | trans | -66 | -27.5 | 174.5 | -60.2 | 0 | 0 | 0 | 0 | 113.6 | D130 L134 E135 | D130-C132 PolarHBondContact O-N 3.32Å; C132-L134 PolarHBondContact O-N 2.89Å; C132-L134 VanDerWaalsContact O-N 3.13Å; C132-E135 PolarHBondContact O-N 3.39Å |
| 133 | S | 54.2 | Low | 56.2 | Low | 76 Ų | 76 | 123.6 Ų | 123.6 | 53% | 0.531 | 69% | 0.685 | S | S | . | * | G | 310 helix | trans | -69.8 | -10.3 | 178.2 | 81 | 0 | 0 | 0 | 0 | 113.7 | D130 A131 | D130-S133 WeakPolarHBondContact O-CB 3.4Å; D130-S133 PolarHBondContact O-N 2.86Å; D130-S133 PolarHBondContact O-OG 3.25Å; A131-S133 VanDerWaalsContact C-N 3.34Å; A131-S133 PolarHBondContact O-N 2.9Å |
| 134 | L | 53.5 | Low | 57.2 | Low | 136 Ų | 136 | 119.1 Ų | 119.1 | 71% | 0.712 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -100.8 | -11.1 | 172.9 | -138.5 | 79.8 | 0 | 0 | 0 | 112.7 | A131 C132 E136 | A131-L134 PolarHBondContact O-N 2.83Å; C132-L134 PolarHBondContact O-N 2.89Å; C132-L134 VanDerWaalsContact O-N 3.13Å; L134-E136 VanDerWaalsContact C-N 3.3Å; L134-E136 PolarHBondContact O-N 2.77Å |
| 135 | E | 56.4 | Low | 58.2 | Low | 119 Ų | 119 | 120.2 Ų | 120.2 | 56% | 0.556 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -77.3 | -10.7 | -174.4 | -72.9 | -169.9 | 128.1 | 0 | 0 | 113.6 | C132 F139 | C132-E135 PolarHBondContact O-N 3.39Å; E135-F139 WeakPolarHBondContact O-CD2 3.49Å; E135-F139 WeakPolarHBondContact O-CE2 3.26Å |
| 136 | E | 55.6 | Low | 58.7 | Low | 153 Ų | 153 | 125.5 Ų | 125.5 | 72% | 0.715 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -110.8 | -24.1 | -173.3 | -68.5 | 148.4 | 171.7 | 0 | 0 | 114.3 | L134 W138 | L134-E136 VanDerWaalsContact C-N 3.3Å; L134-E136 PolarHBondContact O-N 2.77Å; E136-W138 VanDerWaalsContact C-N 3.29Å; E136-W138 PolarHBondContact O-N 3.44Å |
| 137 | S | 65.7 | Low | 59.2 | Low | 107 Ų | 107 | 122.1 Ų | 122.1 | 75% | 0.748 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | -2.9 | -168.2 | -168.1 | 0 | 0 | 0 | 0 | 115.4 | | |
| 138 | W | 61.9 | Low | 59.2 | Low | 180 Ų | 180 | 119.8 Ų | 119.8 | 68% | 0.682 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.7 | 1.1 | -179.9 | 64.5 | -78.9 | 0 | 0 | 0 | 114.1 | E136 V140 | E136-W138 VanDerWaalsContact C-N 3.29Å; E136-W138 PolarHBondContact O-N 3.44Å; W138-V140 PolarHBondContact O-N 2.98Å |
| 139 | F | 57.9 | Low | 59.2 | Low | 133 Ų | 133 | 117.5 Ų | 117.5 | 58% | 0.583 | 67% | 0.665 | S | S | * | * | | | trans | -85.1 | 17.2 | 177.5 | -77 | -69.9 | 0 | 0 | 0 | 114.7 | E135 T141 | E135-F139 WeakPolarHBondContact O-CD2 3.49Å; E135-F139 WeakPolarHBondContact O-CE2 3.26Å; F139-T141 PolarHBondContact O-N 2.94Å |
| 140 | V | 67 | Low | 59.3 | Low | 119 Ų | 119 | 114.7 Ų | 114.7 | 72% | 0.721 | 67% | 0.668 | S | S | * | * | | | trans | -69.6 | 87.2 | 163.2 | -173.3 | 0 | 0 | 0 | 0 | 107.8 | W138 P142 | W138-V140 PolarHBondContact O-N 2.98Å; V140-P142 VanDerWaalsContact O-CD 3.32Å; V140-P142 WeakPolarHBondContact O-CD 3.07Å; V140-P142 VanDerWaalsContact O-N 3.09Å |
| 141 | T | 69.3 | Low | 60 | Low | 119 Ų | 119 | 113.1 Ų | 113.1 | 73% | 0.73 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -56 | 116 | 162.6 | -60.4 | 0 | 0 | 0 | 0 | 105.9 | F139 | F139-T141 PolarHBondContact O-N 2.94Š|
| 142 | P | 67.5 | Low | 60.4 | Low | 87 Ų | 87 | 117.8 Ų | 117.8 | 57% | 0.565 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 140.3 | -179.9 | 23.3 | -32.6 | 0 | 0 | 0 | 108.2 | V140 | V140-P142 VanDerWaalsContact O-CD 3.32Å; V140-P142 WeakPolarHBondContact O-CD 3.07Å; V140-P142 VanDerWaalsContact O-N 3.09Å |
| 143 | P | 69.1 | Low | 61 | Low | 103 Ų | 103 | 120.4 Ų | 120.4 | 67% | 0.669 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 134.8 | 178 | 22.9 | -33.3 | 0 | 0 | 0 | 108.1 | C145 | P143-C145 PolarHBondContact O-N 3.36Å; P143-C145 PolarHBondContact O-SG 3.39Å |
| 144 | P | 68.8 | Low | 61.4 | Low | 100 Ų | 100 | 122.3 Ų | 122.3 | 65% | 0.649 | 71% | 0.707 | S | S | * | * | | | trans | -61 | 99.7 | -167.9 | 23.1 | -34 | 0 | 0 | 0 | 110.4 | F146 T147 | P144-F146 PolarHBondContact O-N 3.19Å; P144-T147 HydrophobicContact CB-CG2 4.39Å; P144-T147 HydrophobicContact CG-CG2 4.33Å |
| 145 | C | 60.3 | Low | 61.8 | Low | 98 Ų | 98 | 122.6 Ų | 122.6 | 66% | 0.662 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.9 | -12.1 | -165.3 | -58.3 | 0 | 0 | 0 | 0 | 114.5 | P143 | P143-C145 PolarHBondContact O-N 3.36Å; P143-C145 PolarHBondContact O-SG 3.39Å |
| 146 | F | 62.3 | Low | 62.1 | Low | 196 Ų | 196 | 123.6 Ų | 123.6 | 86% | 0.86 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -143.3 | 64.8 | -178.9 | -65.9 | -79.3 | 0 | 0 | 0 | 112.6 | P144 G148 | P144-F146 PolarHBondContact O-N 3.19Å; F146-G148 PolarHBondContact O-N 3.48Å; F146-G148 VanDerWaalsContact O-N 3.07Å |
| 147 | T | 55.4 | Low | 62.7 | Low | 111 Ų | 111 | 124.7 Ų | 124.7 | 68% | 0.681 | 72% | 0.722 | S | S | * | * | | | trans | -76.6 | 74.1 | 149.2 | 54 | 0 | 0 | 0 | 0 | 108.9 | P144 H149 | P144-T147 HydrophobicContact CB-CG2 4.39Å; P144-T147 HydrophobicContact CG-CG2 4.33Å; T147-H149 PolarHBondContact O-N 3.23Å |
| 148 | G | 57.1 | Low | 62.8 | Low | 72 Ų | 72 | 124.4 Ų | 124.4 | 74% | 0.742 | 72% | 0.716 | S | S | * | * | | | trans | -59.1 | 103.9 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | F146 G150 | F146-G148 PolarHBondContact O-N 3.48Å; F146-G148 VanDerWaalsContact O-N 3.07Å; G148-G150 PolarHBondContact O-N 3.12Å; G148-G150 VanDerWaalsContact O-N 3.16Å |
| 149 | H | 55.2 | Low | 63.2 | Low | 188 Ų | 188 | 118.5 Ų | 118.5 | 87% | 0.87 | 70% | 0.702 | S | S | * | * | | | trans | -80.1 | 102.5 | -164.5 | -164.9 | -66.5 | 0 | 0 | 0 | 111.2 | T147 G151 | T147-H149 PolarHBondContact O-N 3.23Å; H149-G151 PolarHBondContact O-N 3.16Å |
| 150 | G | 57.3 | Low | 63.6 | Low | 76 Ų | 76 | 117.9 Ų | 117.9 | 78% | 0.784 | 71% | 0.712 | S | S | * | * | S | Bend | trans | 73.1 | -12.8 | 160.8 | 0 | 0 | 0 | 0 | 0 | 117.9 | G148 Q152 | G148-G150 PolarHBondContact O-N 3.12Å; G148-G150 VanDerWaalsContact O-N 3.16Å; G150-Q152 PolarHBondContact O-N 2.92Å |
| 151 | G | 63.1 | Low | 63.3 | Low | 61 Ų | 61 | 117.8 Ų | 117.8 | 63% | 0.629 | 71% | 0.707 | S | S | * | * | | | trans | -61.5 | 132.6 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | H149 | H149-G151 PolarHBondContact O-N 3.16Š|
| 152 | Q | 63.2 | Low | 63.1 | Low | 174 Ų | 174 | 116.1 Ų | 116.1 | 81% | 0.813 | 69% | 0.691 | S | S | * | * | | | trans | -49.6 | 134.9 | 166 | -175.9 | -178.3 | 6 | 0 | 0 | 107.9 | G150 V154 | G150-Q152 PolarHBondContact O-N 2.92Å; Q152-V154 PolarHBondContact O-N 2.84Å |
| 153 | P | 60.8 | Low | 62.8 | Low | 120 Ų | 120 | 116.5 Ų | 116.5 | 78% | 0.779 | 69% | 0.688 | S | S | * | * | | | trans | -53.8 | 109.1 | -175.9 | 20.1 | -33.2 | 0 | 0 | 0 | 109.2 | L155 | P153-L155 PolarHBondContact O-N 3.1Š|
| 154 | V | 61.2 | Low | 62.6 | Low | 116 Ų | 116 | 117.7 Ų | 117.7 | 70% | 0.703 | 69% | 0.688 | S | S | * | * | | | trans | -59.9 | 116 | -177.2 | 179.6 | 0 | 0 | 0 | 0 | 105.6 | Q152 L156 | Q152-V154 PolarHBondContact O-N 2.84Å; V154-L156 HydrophobicContact CB-CD1 3.97Å; V154-L156 HydrophobicContact CG1-CD1 3.86Å; V154-L156 WeakPolarHBondContact O-CD1 3.26Å; V154-L156 PolarHBondContact O-N 3.11Å |
| 155 | L | 62 | Low | 62.1 | Low | 143 Ų | 143 | 120.6 Ų | 120.6 | 75% | 0.749 | 70% | 0.697 | S | S | * | * | | | trans | -73 | 82.1 | 172.1 | -165.9 | 161.8 | 0 | 0 | 0 | 105.3 | P153 E157 | P153-L155 PolarHBondContact O-N 3.1Å; L155-E157 HydrophobicContact CD2-CG 4.03Å; L155-E157 PolarHBondContact O-N 3.22Å |
| 156 | L | 64.2 | Low | 62.4 | Low | 140 Ų | 140 | 121.6 Ų | 121.6 | 73% | 0.733 | 70% | 0.695 | S | S | * | * | | | trans | -56.2 | 109.3 | 167.2 | -85.9 | 82.4 | 0 | 0 | 0 | 105.4 | V154 T158 | V154-L156 HydrophobicContact CB-CD1 3.97Å; V154-L156 HydrophobicContact CG1-CD1 3.86Å; V154-L156 WeakPolarHBondContact O-CD1 3.26Å; V154-L156 PolarHBondContact O-N 3.11Å; L156-T158 PolarHBondContact O-N 2.88Å |
| 157 | E | 68.3 | Low | 62.2 | Low | 175 Ų | 175 | 120.2 Ų | 120.2 | 82% | 0.818 | 69% | 0.691 | S | S | * | * | | | trans | -64.4 | 103.9 | 174.1 | -72.1 | -156.1 | 152.9 | 0 | 0 | 107.6 | L155 S159 | L155-E157 HydrophobicContact CD2-CG 4.03Å; L155-E157 PolarHBondContact O-N 3.22Å; E157-S159 PolarHBondContact O-N 3.02Å |
| 158 | T | 67.5 | Low | 62 | Low | 101 Ų | 101 | 123 Ų | 123 | 62% | 0.62 | 70% | 0.696 | S | S | * | * | | | trans | -46.2 | 112.5 | 171.8 | 45.7 | 0 | 0 | 0 | 0 | 109.4 | L156 E162 | L156-T158 PolarHBondContact O-N 2.88Å; T158-E162 VanDerWaalsContact C-OE2 3.28Å; T158-E162 WeakPolarHBondContact CA-OE2 3.24Å; T158-E162 VanDerWaalsContact CB-CD 3.49Å; T158-E162 WeakPolarHBondContact CB-OE1 3.48Å; T158-E162 VanDerWaalsContact CB-OE2 3.26Å; T158-E162 WeakPolarHBondContact CB-OE2 3.34Å; T158-E162 VanDerWaalsContact CG2-OE1 3.26Å; T158-E162 WeakPolarHBondContact CG2-OE1 3.15Å |
| 159 | S | 70.7 | Confident | 62.2 | Low | 56 Ų | 56 | 125.1 Ų | 125.1 | 39% | 0.392 | 70% | 0.696 | S | S | . | * | | | trans | -63.4 | 133.7 | -175.3 | 175 | 0 | 0 | 0 | 0 | 108.5 | E157 L161 E162 | E157-S159 PolarHBondContact O-N 3.02Å; S159-L161 PolarHBondContact O-N 3.09Å; S159-L161 PolarHBondContact OG-N 3.34Å; S159-E162 PolarHBondContact N-OE2 2.93Å; S159-E162 WeakPolarHBondContact O-CB 3.43Å; S159-E162 VanDerWaalsContact O-CG 3.24Å; S159-E162 WeakPolarHBondContact O-CG 3.27Å; S159-E162 PolarHBondContact O-N 3.36Å |
| 160 | P | 65.6 | Low | 62.6 | Low | 121 Ų | 121 | 120.9 Ų | 120.9 | 79% | 0.786 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.3 | -15.9 | 177.2 | -26.7 | 34.8 | 0 | 0 | 0 | 114.4 | | |
| 161 | L | 60.3 | Low | 62.5 | Low | 116 Ų | 116 | 125.4 Ų | 125.4 | 61% | 0.607 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.1 | -15.5 | 179.4 | -55.4 | 176.5 | 0 | 0 | 0 | 113.9 | S159 N163 L164 | S159-L161 PolarHBondContact O-N 3.09Å; S159-L161 PolarHBondContact OG-N 3.34Å; L161-N163 PolarHBondContact O-N 3.13Å; L161-L164 HydrophobicContact CB-CD1 4.27Å; L161-L164 HydrophobicContact CD2-CD1 3.62Å; L161-L164 VanDerWaalsContact O-CB 3.31Å; L161-L164 WeakPolarHBondContact O-CB 3.16Å; L161-L164 PolarHBondContact O-N 3.17Å |
| 162 | E | 65.4 | Low | 61.8 | Low | 85 Ų | 85 | 127.4 Ų | 127.4 | 40% | 0.397 | 70% | 0.695 | S | S | . | * | G | 310 helix | trans | -62.3 | -34.8 | -177.6 | 79.3 | -169.2 | -160.5 | 0 | 0 | 111.8 | T158 S159 L164 L165 | T158-E162 VanDerWaalsContact C-OE2 3.28Å; T158-E162 WeakPolarHBondContact CA-OE2 3.24Å; T158-E162 VanDerWaalsContact CB-CD 3.49Å; T158-E162 WeakPolarHBondContact CB-OE1 3.48Å; T158-E162 VanDerWaalsContact CB-OE2 3.26Å; T158-E162 WeakPolarHBondContact CB-OE2 3.34Å; T158-E162 VanDerWaalsContact CG2-OE1 3.26Å; T158-E162 WeakPolarHBondContact CG2-OE1 3.15Å; S159-E162 PolarHBondContact N-OE2 2.93Å; S159-E162 WeakPolarHBondContact O-CB 3.43Å; S159-E162 VanDerWaalsContact O-CG 3.24Å; S159-E162 WeakPolarHBondContact O-CG 3.27Å; S159-E162 PolarHBondContact O-N 3.36Å; E162-L164 PolarHBondContact O-N 3.43Å; E162-L165 PolarHBondContact O-N 3.26Å |
| 163 | N | 61 | Low | 61.4 | Low | 94 Ų | 94 | 125.4 Ų | 125.4 | 50% | 0.503 | 70% | 0.695 | S | S | . | * | G | 310 helix | trans | -77.4 | 1.6 | 178.8 | -73.7 | -67.6 | 0 | 0 | 0 | 113.2 | L161 L165 I166 | L161-N163 PolarHBondContact O-N 3.13Å; N163-L165 VanDerWaalsContact C-N 3.31Å; N163-I166 HydrophobicContact CB-CD1 4.31Å; N163-I166 HydrophobicContact CB-CG1 4.34Å; N163-I166 WeakPolarHBondContact O-CG1 3.43Å; N163-I166 WeakPolarHBondContact OD1-CD1 3.31Å |
| 164 | L | 63.9 | Low | 60.8 | Low | 128 Ų | 128 | 128.9 Ų | 128.9 | 67% | 0.67 | 69% | 0.693 | S | S | * | * | G | 310 helix | trans | -84 | -7.4 | 171.9 | -58.7 | 177.4 | 0 | 0 | 0 | 112.8 | L161 E162 | L161-L164 HydrophobicContact CB-CD1 4.27Å; L161-L164 HydrophobicContact CD2-CD1 3.62Å; L161-L164 VanDerWaalsContact O-CB 3.31Å; L161-L164 WeakPolarHBondContact O-CB 3.16Å; L161-L164 PolarHBondContact O-N 3.17Å; E162-L164 PolarHBondContact O-N 3.43Å |
| 165 | L | 59.1 | Low | 60.3 | Low | 161 Ų | 161 | 127 Ų | 127 | 84% | 0.843 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -101.4 | -9.1 | 176.3 | -62.2 | 179.5 | 0 | 0 | 0 | 113.6 | E162 N163 | E162-L165 PolarHBondContact O-N 3.26Å; N163-L165 VanDerWaalsContact C-N 3.31Å |
| 166 | I | 67.2 | Low | 59.5 | Low | 119 Ų | 119 | 128.5 Ų | 128.5 | 61% | 0.61 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -87 | 118.9 | 172.3 | 57.2 | 172.6 | 0 | 0 | 0 | 110.7 | N163 | N163-I166 HydrophobicContact CB-CD1 4.31Å; N163-I166 HydrophobicContact CB-CG1 4.34Å; N163-I166 WeakPolarHBondContact O-CG1 3.43Å; N163-I166 WeakPolarHBondContact OD1-CD1 3.31Å |
| 167 | E | 57.8 | Low | 59 | Low | 167 Ų | 167 | 130.3 Ų | 130.3 | 78% | 0.78 | 70% | 0.697 | S | S | * | * | | | trans | 64.4 | 75.5 | 168 | -155.1 | 170.3 | -165.9 | 0 | 0 | 116 | P169 | E167-P169 VanDerWaalsContact O-CD 3.28Å; E167-P169 WeakPolarHBondContact O-CD 3.41Å |
| 168 | H | 51.1 | Low | 58.4 | Low | 170 Ų | 170 | 126.7 Ų | 126.7 | 79% | 0.787 | 69% | 0.692 | S | S | * | * | | | trans | -57.7 | 121.9 | 134.4 | -86.3 | -64.6 | 0 | 0 | 0 | 108 | S170 | H168-S170 PolarHBondContact O-N 3.21Š|
| 169 | P | 62.1 | Low | 57.9 | Low | 116 Ų | 116 | 126.8 Ų | 126.8 | 75% | 0.753 | 69% | 0.694 | S | S | * | * | | | trans | -75.1 | 67.4 | 170.4 | 32.8 | -35.4 | 0 | 0 | 0 | 109.1 | E167 M171 | E167-P169 VanDerWaalsContact O-CD 3.28Å; E167-P169 WeakPolarHBondContact O-CD 3.41Å; P169-M171 PolarHBondContact O-N 3.43Å; P169-M171 VanDerWaalsContact O-N 3.14Å |
| 170 | S | 62.5 | Low | 57.2 | Low | 100 Ų | 100 | 130 Ų | 130 | 70% | 0.699 | 71% | 0.714 | S | S | * | * | | | trans | -66.9 | 110.9 | 174 | -64 | 0 | 0 | 0 | 0 | 108.5 | H168 | H168-S170 PolarHBondContact O-N 3.21Š|
| 171 | M | 56.4 | Low | 56.7 | Low | 171 Ų | 171 | 135.9 Ų | 135.9 | 84% | 0.842 | 72% | 0.72 | S | S | * | * | | | trans | 74.8 | 68.9 | 153 | -160.5 | 164.1 | 66.8 | 0 | 0 | 117.1 | P169 | P169-M171 PolarHBondContact O-N 3.43Å; P169-M171 VanDerWaalsContact O-N 3.14Å |
| 172 | S | 48.5 | Very low | 56.5 | Low | 102 Ų | 102 | 138.3 Ų | 138.3 | 71% | 0.713 | 73% | 0.733 | S | S | * | * | | | trans | -112 | 95 | 142.6 | 62.1 | 0 | 0 | 0 | 0 | 110.4 | Y174 | S172-Y174 VanDerWaalsContact C-N 3.28Å; S172-Y174 PolarHBondContact O-N 3.11Å |
| 173 | V | 53.7 | Low | 55.5 | Low | 132 Ų | 132 | 139.2 Ų | 139.2 | 80% | 0.8 | 75% | 0.754 | S | S | * | * | | | trans | -77.2 | 81.4 | 173.3 | -178.2 | 0 | 0 | 0 | 0 | 108.8 | | |
| 174 | Y | 48.2 | Very low | 54.8 | Low | 193 Ų | 193 | 145.9 Ų | 145.9 | 76% | 0.757 | 77% | 0.773 | S | S | * | * | | | trans | -120.1 | 109.9 | 161.1 | -71.2 | -67.4 | 0 | 0 | 0 | 109.4 | S172 H176 | S172-Y174 VanDerWaalsContact C-N 3.28Å; S172-Y174 PolarHBondContact O-N 3.11Å; Y174-H176 PolarHBondContact O-N 3.04Å |
| 175 | A | 51.8 | Low | 53.7 | Low | 76 Ų | 76 | 147.3 Ų | 147.3 | 63% | 0.628 | 78% | 0.781 | S | S | * | * | | | trans | -66.2 | 105.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | H177 | A175-H177 PolarHBondContact O-N 2.92Š|
| 176 | H | 45.4 | Very low | 53.2 | Low | 175 Ų | 175 | 144.6 Ų | 144.6 | 81% | 0.81 | 77% | 0.773 | S | S | * | * | | | trans | -72.2 | 75.2 | 172.3 | -75.3 | -79.5 | 0 | 0 | 0 | 111.3 | Y174 S178 | Y174-H176 PolarHBondContact O-N 3.04Å; H176-S178 VanDerWaalsContact C-N 3.28Å; H176-S178 PolarHBondContact O-N 3.29Å |
| 177 | H | 52.2 | Low | 52.1 | Low | 178 Ų | 178 | 145.3 Ų | 145.3 | 82% | 0.824 | 78% | 0.777 | S | S | * | * | | | trans | -77.5 | 77.1 | 165.3 | -67.3 | -55.4 | 0 | 0 | 0 | 110.6 | A175 | A175-H177 PolarHBondContact O-N 2.92Š|
| 178 | S | 56.8 | Low | 51.6 | Low | 100 Ų | 100 | 143.3 Ų | 143.3 | 70% | 0.699 | 78% | 0.778 | S | S | * | * | | | trans | -95 | 117 | 164.3 | 60.4 | 0 | 0 | 0 | 0 | 110 | H176 | H176-S178 VanDerWaalsContact C-N 3.28Å; H176-S178 PolarHBondContact O-N 3.29Å |
| 179 | P | 56.3 | Low | 51.7 | Low | 102 Ų | 102 | 142.4 Ų | 142.4 | 66% | 0.662 | 77% | 0.774 | S | S | * | * | | | trans | -70.9 | 149 | -179.2 | 28.9 | -34.8 | 0 | 0 | 0 | 111.8 | R181 | P179-R181 PolarHBondContact O-N 3.04Š|
| 180 | P | 56 | Low | 51.4 | Low | 125 Ų | 125 | 145.8 Ų | 145.8 | 81% | 0.812 | 78% | 0.779 | S | S | * | * | | | trans | -67.3 | 108.2 | -179 | 27.2 | -34.1 | 0 | 0 | 0 | 111.3 | L182 | P180-L182 PolarHBondContact O-N 3.15Š|
| 181 | R | 54.3 | Low | 50.8 | Low | 244 Ų | 244 | 147 Ų | 147 | 92% | 0.921 | 78% | 0.783 | S | S | * | * | | | trans | -83.2 | 87.2 | 171.1 | -74.2 | -169.3 | 172 | -179.6 | -0.4 | 110.7 | P179 | P179-R181 PolarHBondContact O-N 3.04Š|
| 182 | L | 57.1 | Low | 50.3 | Low | 167 Ų | 167 | 147.6 Ų | 147.6 | 87% | 0.874 | 79% | 0.788 | S | S | * | * | | | trans | -86.9 | 131.4 | 160.8 | -66.9 | -180 | 0 | 0 | 0 | 109.9 | P180 R184 | P180-L182 PolarHBondContact O-N 3.15Å; L182-R184 PolarHBondContact O-N 2.96Å |
| 183 | A | 44.3 | Very low | 50.4 | Low | 103 Ų | 103 | 150.2 Ų | 150.2 | 85% | 0.851 | 79% | 0.794 | S | S | * | * | | | trans | -79.8 | 103.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | | |
| 184 | R | 46.2 | Very low | 50.1 | Low | 235 Ų | 235 | 155.4 Ų | 155.4 | 89% | 0.887 | 80% | 0.799 | S | S | * | * | | | trans | 40.6 | 107.6 | 134.5 | -163.9 | 172.9 | -165.1 | 136.9 | 1.2 | 118.3 | L182 | L182-R184 PolarHBondContact O-N 2.96Š|
| 185 | D | 40.8 | Very low | 50.3 | Low | 158 Ų | 158 | 154.1 Ų | 154.1 | 85% | 0.845 | 80% | 0.8 | S | S | * | * | | | trans | -125.9 | 152.9 | 143.3 | -105.6 | -31.7 | 0 | 0 | 0 | 109.5 | | |
| 186 | P | 48.8 | Very low | 50.1 | Low | 103 Ų | 103 | 158.8 Ų | 158.8 | 67% | 0.669 | 81% | 0.811 | S | S | * | * | | | trans | -95.2 | 126.8 | -167.8 | 34.3 | -32.5 | 0 | 0 | 0 | 115.5 | | |
| 187 | I | 44.5 | Very low | 50.1 | Low | 135 Ų | 135 | 157.3 Ų | 157.3 | 69% | 0.692 | 81% | 0.809 | S | S | * | * | | | trans | 47.1 | 120.2 | 133.2 | -65.1 | 179.1 | 0 | 0 | 0 | 117.3 | | |
| 188 | P | 46.7 | Very low | 49.7 | Very low | 125 Ų | 125 | 158.4 Ų | 158.4 | 81% | 0.812 | 81% | 0.812 | S | S | * | * | | | | -128.5 | 141.1 | 78.9 | 8.3 | 14.1 | 0 | 0 | 0 | 116.7 | | |
| 189 | H | 53.1 | Low | 49.4 | Very low | 151 Ų | 151 | 162 Ų | 162 | 70% | 0.699 | 82% | 0.822 | S | S | * | * | | | trans | -69.9 | 131.5 | 160.9 | -62.8 | -106.8 | 0 | 0 | 0 | 109.9 | | |
| 190 | H | 55 | Low | 48.9 | Very low | 187 Ų | 187 | 162.8 Ų | 162.8 | 87% | 0.866 | 83% | 0.831 | S | S | * | * | | | trans | 179.8 | 154.3 | 139.7 | -93.3 | -62.4 | 0 | 0 | 0 | 108.6 | | |
| 191 | T | 51.8 | Low | 47.8 | Very low | 126 Ų | 126 | 160.2 Ų | 160.2 | 77% | 0.773 | 83% | 0.827 | S | S | * | * | S | Bend | trans | 89.1 | 40.9 | 170.1 | -25.4 | 0 | 0 | 0 | 0 | 118.5 | | |
| 192 | L | 45.7 | Very low | 47.2 | Very low | 183 Ų | 183 | 156.5 Ų | 156.5 | 96% | 0.958 | 83% | 0.825 | S | S | * | * | | | trans | -144.7 | 53.7 | 149.7 | -80.1 | -172.6 | 0 | 0 | 0 | 111 | | |
| 193 | D | 49.2 | Very low | 46.7 | Very low | 157 Ų | 157 | 154 Ų | 154 | 84% | 0.84 | 82% | 0.819 | S | S | * | * | | | trans | -122.6 | 49.5 | 179.8 | -158.5 | 25.1 | 0 | 0 | 0 | 110.4 | | |
| 194 | R | 49 | Very low | 46.1 | Very low | 240 Ų | 240 | 154.7 Ų | 154.7 | 91% | 0.906 | 82% | 0.818 | S | S | * | * | S | Bend | trans | -151.9 | 25.4 | -174.5 | -166.9 | 144.7 | -179.2 | 137 | 5.8 | 116.1 | | |
| 195 | E | 51.2 | Low | 45.5 | Very low | 166 Ų | 166 | 147.6 Ų | 147.6 | 78% | 0.776 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -140 | 4.5 | 174.9 | -137.7 | -171.2 | 154.8 | 0 | 0 | 117 | | |
| 196 | M | 48.1 | Very low | 45.3 | Very low | 175 Ų | 175 | 149.4 Ų | 149.4 | 86% | 0.862 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -118.7 | 16.1 | -176.1 | -70.5 | -77.5 | 99.6 | 0 | 0 | 115.5 | | |
| 197 | D | 46 | Very low | 44.8 | Very low | 144 Ų | 144 | 153.2 Ų | 153.2 | 77% | 0.77 | 82% | 0.819 | S | S | * | * | S | Bend | trans | -97.5 | -1.7 | 177.3 | -80.2 | -31.3 | 0 | 0 | 0 | 114.9 | | |
| 198 | F | 42.9 | Very low | 44.4 | Very low | 200 Ų | 200 | 153 Ų | 153 | 88% | 0.877 | 82% | 0.824 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | 10.5 | -171.2 | -93.7 | -77.5 | 0 | 0 | 0 | 116.3 | | |
| 199 | L | 49.5 | Very low | 44.3 | Very low | 175 Ų | 175 | 152.9 Ų | 152.9 | 92% | 0.916 | 82% | 0.823 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129.3 | 32.1 | 178.2 | -68.3 | 177.2 | 0 | 0 | 0 | 114.3 | | |
| 200 | S | 47.6 | Very low | 43.3 | Very low | 120 Ų | 120 | 150.7 Ų | 150.7 | 84% | 0.839 | 83% | 0.831 | S | S | * | * | | | trans | -153.5 | 106.4 | 163.1 | -168.2 | 0 | 0 | 0 | 0 | 111.5 | | |
| 201 | G | 32.9 | Very low | 42.2 | Very low | 71 Ų | 71 | 145.9 Ų | 145.9 | 73% | 0.732 | 83% | 0.832 | S | S | * | * | | | trans | 168.1 | 80.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114 | P203 | G201-P203 VanDerWaalsContact O-CD 3.31Å; G201-P203 WeakPolarHBondContact O-CD 3.46Å |
| 202 | N | 41.6 | Very low | 41.3 | Very low | 165 Ų | 165 | 143.9 Ų | 143.9 | 88% | 0.882 | 84% | 0.836 | S | S | * | * | | | trans | -74.4 | 118.4 | 174.3 | -168 | 13.4 | 0 | 0 | 0 | 110.5 | | |
| 203 | P | 44.9 | Very low | 41.1 | Very low | 115 Ų | 115 | 145 Ų | 145 | 75% | 0.747 | 83% | 0.833 | S | S | * | * | | | trans | -101.8 | 112.6 | 174 | 24.1 | -6.8 | 0 | 0 | 0 | 111.3 | G201 | G201-P203 VanDerWaalsContact O-CD 3.31Å; G201-P203 WeakPolarHBondContact O-CD 3.46Å |
| 204 | S | 32.6 | Very low | 40.6 | Very low | 118 Ų | 118 | 146.4 Ų | 146.4 | 83% | 0.825 | 84% | 0.835 | S | S | * | * | | | trans | -62.1 | 156.3 | 170.7 | -172 | 0 | 0 | 0 | 0 | 112.4 | | |
| 205 | A | 34.1 | Very low | 40.6 | Very low | 86 Ų | 86 | 144.4 Ų | 144.4 | 71% | 0.711 | 83% | 0.833 | S | S | * | * | | | trans | -52 | 145.5 | -171.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | | |
| 206 | K | 35.6 | Very low | 39.9 | Very low | 196 Ų | 196 | 141.5 Ų | 141.5 | 85% | 0.852 | 84% | 0.837 | S | S | * | * | | | trans | -163 | 107.8 | 140.8 | -108.6 | 156.9 | -171.3 | 178.4 | 0 | 114.2 | | |
| 207 | Q | 39.2 | Very low | 39.8 | Very low | 183 Ų | 183 | 144.8 Ų | 144.8 | 86% | 0.855 | 84% | 0.84 | S | S | * | * | | | trans | 40.8 | 122.8 | 139.9 | -63.7 | 177.6 | 19.1 | 0 | 0 | 121.3 | | |
| 208 | T | 35.9 | Very low | 39.7 | Very low | 131 Ų | 131 | 143 Ų | 143 | 80% | 0.804 | 84% | 0.837 | S | S | * | * | | | trans | -63.1 | 161.1 | 149.7 | 51.3 | 0 | 0 | 0 | 0 | 111.5 | | |
| 209 | P | 43.9 | Very low | 39.3 | Very low | 121 Ų | 121 | 139 Ų | 139 | 79% | 0.786 | 83% | 0.829 | S | S | * | * | | | | -146.5 | 146.7 | 103.7 | 36.9 | -21.9 | 0 | 0 | 0 | 116.9 | | |
| 210 | A | 32.4 | Very low | 38.9 | Very low | 106 Ų | 106 | 138 Ų | 138 | 88% | 0.876 | 82% | 0.823 | S | S | * | * | | | trans | 45.7 | 129.1 | 138.8 | 0 | 0 | 0 | 0 | 0 | 122.7 | | |
| 211 | G | 31.3 | Very low | 38 | Very low | 85 Ų | 85 | 140.7 Ų | 140.7 | 88% | 0.876 | 82% | 0.822 | S | S | * | * | | | trans | 151.7 | 119.7 | 144.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 212 | G | 33.3 | Very low | 38.2 | Very low | 85 Ų | 85 | 140.6 Ų | 140.6 | 88% | 0.876 | 82% | 0.822 | S | S | * | * | | | trans | 130.8 | 110.6 | 165.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | | |
| 213 | K | 41.1 | Very low | 38.4 | Very low | 205 Ų | 205 | 138.2 Ų | 138.2 | 89% | 0.891 | 82% | 0.815 | S | S | * | * | | | trans | -97.1 | 150.9 | 167.9 | -61.4 | 172.7 | 178.4 | 174.9 | 0 | 108.5 | | |
| 214 | E | 40.4 | Very low | 38 | Very low | 188 Ų | 188 | 144.4 Ų | 144.4 | 88% | 0.879 | 82% | 0.824 | S | S | * | * | | | | 162.4 | 157 | 116 | -168.5 | 154.8 | 161.2 | 0 | 0 | 113.3 | | |
| 215 | K | 47.3 | Very low | 38.1 | Very low | 197 Ų | 197 | 147.2 Ų | 147.2 | 86% | 0.857 | 82% | 0.824 | S | S | * | * | | | trans | -65.5 | 141.9 | 178.1 | -70.9 | 160.2 | 157.8 | 172.6 | 0 | 113.4 | | |
| 216 | A | 37.8 | Very low | 38.5 | Very low | 105 Ų | 105 | 151.7 Ų | 151.7 | 87% | 0.868 | 82% | 0.822 | S | S | * | * | | | trans | -155.6 | 142.7 | 135.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 217 | R | 44.6 | Very low | 39.2 | Very low | 245 Ų | 245 | 147.8 Ų | 147.8 | 93% | 0.925 | 82% | 0.817 | S | S | * | * | | | trans | -118.4 | 177.1 | 166.1 | -101.8 | -173.1 | 179.9 | -172.7 | 0.8 | 106.2 | | |
| 218 | P | 45.5 | Very low | 39.4 | Very low | 107 Ų | 107 | 145.9 Ų | 145.9 | 70% | 0.695 | 81% | 0.808 | S | S | * | * | | | cis | -135.1 | -165 | -18 | 27.4 | -2.7 | 0 | 0 | 0 | 113 | | |
| 219 | T | 34.5 | Very low | 39.5 | Very low | 116 Ų | 116 | 145.9 Ų | 145.9 | 71% | 0.712 | 81% | 0.807 | S | S | * | * | | | trans | 119.8 | 124.9 | 136.9 | -53 | 0 | 0 | 0 | 0 | 118 | | |
| 220 | L | 39.6 | Very low | 39.5 | Very low | 154 Ų | 154 | 146.2 Ų | 146.2 | 81% | 0.806 | 81% | 0.807 | S | S | * | * | | | trans | 7.3 | 150 | 146.6 | -78.5 | 152.4 | 0 | 0 | 0 | 119.7 | | |
| 221 | E | 30 | Very low | 40 | Very low | 175 Ų | 175 | 148.2 Ų | 148.2 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | | | cis | -162.3 | 162.5 | 17 | -165.6 | 170.2 | -170.6 | 0 | 0 | 110.2 | | |
| 222 | G | 36.4 | Very low | 40.6 | Very low | 70 Ų | 70 | 153.9 Ų | 153.9 | 72% | 0.722 | 79% | 0.793 | S | S | * | * | | | trans | 157.8 | 97.7 | 166.1 | 0 | 0 | 0 | 0 | 0 | 116 | | |
| 223 | P | 45.2 | Very low | 41.4 | Very low | 114 Ų | 114 | 162.1 Ų | 162.1 | 74% | 0.74 | 80% | 0.798 | S | S | * | * | | | trans | -95 | 150.6 | -179.4 | 35.4 | -32.7 | 0 | 0 | 0 | 113.3 | | |
| 224 | R | 37.7 | Very low | 41.6 | Very low | 246 Ų | 246 | 156.9 Ų | 156.9 | 93% | 0.928 | 79% | 0.787 | S | S | * | * | | | trans | -167.9 | 100 | 143 | -90.8 | -120.9 | -89.6 | -101.1 | 2.5 | 114.5 | | |
| 225 | H | 35.1 | Very low | 41.8 | Very low | 177 Ų | 177 | 153 Ų | 153 | 82% | 0.819 | 78% | 0.78 | S | S | * | * | | | trans | 35.3 | 114.3 | 133.1 | -127.8 | -35 | 0 | 0 | 0 | 121 | | |
| 226 | R | 41.2 | Very low | 41.9 | Very low | 179 Ų | 179 | 152.4 Ų | 152.4 | 68% | 0.675 | 79% | 0.786 | S | S | * | * | | | trans | -77.6 | 145.5 | 148.8 | -172 | -165.8 | 176.9 | 161 | -3.4 | 108.7 | E228 | R226-E228 IonicContact CZ-OE1 3.82Å; R226-E228 IonicContact CZ-OE2 3.89Å; R226-E228 IonicContact NH2-OE1 2.7Å; R226-E228 PolarHBondContact NH2-OE1 3.14Å; R226-E228 IonicContact NH2-OE2 3.14Å; R226-E228 PolarHBondContact NH2-OE2 2.84Å; R226-E228 VanDerWaalsContact NH2-OE2 3.14Å |
| 227 | P | 50.4 | Low | 42.5 | Very low | 114 Ų | 114 | 155.1 Ų | 155.1 | 74% | 0.74 | 78% | 0.78 | S | S | * | * | | | | -138.7 | 171.9 | 114.9 | 35.3 | -21.7 | 0 | 0 | 0 | 113.5 | | |
| 228 | E | 43.4 | Very low | 43.2 | Very low | 144 Ų | 144 | 148.6 Ų | 148.6 | 67% | 0.673 | 77% | 0.772 | S | S | * | * | | | trans | -122.3 | 133.3 | -169.5 | 163.5 | 175.4 | -104 | 0 | 0 | 108.2 | R226 | R226-E228 IonicContact CZ-OE1 3.82Å; R226-E228 IonicContact CZ-OE2 3.89Å; R226-E228 IonicContact NH2-OE1 2.7Å; R226-E228 PolarHBondContact NH2-OE1 3.14Å; R226-E228 IonicContact NH2-OE2 3.14Å; R226-E228 PolarHBondContact NH2-OE2 2.84Å; R226-E228 VanDerWaalsContact NH2-OE2 3.14Å |
| 229 | V | 38.1 | Very low | 43.3 | Very low | 131 Ų | 131 | 149.5 Ų | 149.5 | 79% | 0.794 | 78% | 0.775 | S | S | * | * | | | trans | -142 | 122.3 | 178.2 | -175.9 | 0 | 0 | 0 | 0 | 111.6 | | |
| 230 | V | 44.3 | Very low | 44.1 | Very low | 128 Ų | 128 | 149.6 Ų | 149.6 | 78% | 0.776 | 78% | 0.78 | S | S | * | * | | | trans | -80.3 | 131.4 | 165.2 | 170 | 0 | 0 | 0 | 0 | 109.1 | | |
| 231 | Q | 42.4 | Very low | 44.7 | Very low | 147 Ų | 147 | 153.2 Ų | 153.2 | 69% | 0.687 | 78% | 0.784 | S | S | * | * | | | trans | -157.6 | 107.3 | 160.1 | -158.1 | 73.6 | -51.6 | 0 | 0 | 113.8 | | |
| 232 | R | 44 | Very low | 45.8 | Very low | 205 Ų | 205 | 149.8 Ų | 149.8 | 77% | 0.774 | 79% | 0.786 | S | S | * | * | | | trans | 51.5 | 113.1 | 144.1 | -59 | 174 | -175.3 | -118.2 | -4.6 | 120.1 | | |
| 233 | R | 50.7 | Low | 46.2 | Very low | 258 Ų | 258 | 151.6 Ų | 151.6 | 97% | 0.974 | 79% | 0.794 | S | S | * | * | | | trans | -79.2 | 117.3 | 148.5 | -66.4 | 171.1 | 67.4 | -164.8 | 1.2 | 108.4 | | |
| 234 | S | 44.8 | Very low | 46.7 | Very low | 95 Ų | 95 | 150.6 Ų | 150.6 | 66% | 0.664 | 80% | 0.796 | S | S | * | * | | | trans | -124.7 | 118.7 | 171.8 | 54 | 0 | 0 | 0 | 0 | 111 | | |
| 235 | S | 44.3 | Very low | 47.3 | Very low | 106 Ų | 106 | 147.1 Ų | 147.1 | 74% | 0.741 | 79% | 0.794 | S | S | * | * | | | trans | 18.8 | 105 | 153.5 | 56.8 | 0 | 0 | 0 | 0 | 118.2 | H237 | S235-H237 PolarHBondContact O-N 2.86Š|
| 236 | L | 49.7 | Very low | 47.7 | Very low | 185 Ų | 185 | 144.5 Ų | 144.5 | 97% | 0.969 | 79% | 0.791 | S | S | * | * | | | trans | -84.7 | 94.7 | 152.5 | -69.6 | 177.5 | 0 | 0 | 0 | 108 | | |
| 237 | H | 51.8 | Low | 47.9 | Very low | 162 Ų | 162 | 142.2 Ų | 142.2 | 75% | 0.75 | 80% | 0.797 | S | S | * | * | | | trans | -76.8 | 148.8 | 175 | -146.5 | -94.1 | 0 | 0 | 0 | 110.1 | S235 T239 | S235-H237 PolarHBondContact O-N 2.86Å; H237-T239 PolarHBondContact O-N 2.99Å |
| 238 | S | 57.7 | Low | 47.8 | Very low | 108 Ų | 108 | 145.3 Ų | 145.3 | 76% | 0.755 | 80% | 0.799 | S | S | * | * | | | trans | -66.7 | 117.5 | -180 | -177.6 | 0 | 0 | 0 | 0 | 111.7 | | |
| 239 | T | 48.1 | Very low | 48.1 | Very low | 125 Ų | 125 | 145 Ų | 145 | 77% | 0.767 | 81% | 0.809 | S | S | * | * | | | trans | -144.4 | 65.9 | 170.7 | 61.4 | 0 | 0 | 0 | 0 | 111.4 | H237 | H237-T239 PolarHBondContact O-N 2.99Š|
| 240 | C | 52.4 | Low | 48.3 | Very low | 118 Ų | 118 | 141.6 Ų | 141.6 | 80% | 0.797 | 80% | 0.801 | S | S | * | * | | | trans | -106.6 | 62.8 | 174.2 | -65.9 | 0 | 0 | 0 | 0 | 111.8 | | |
| 241 | Y | 50.5 | Low | 48.7 | Very low | 230 Ų | 230 | 143.9 Ų | 143.9 | 90% | 0.902 | 81% | 0.808 | S | S | * | * | | | trans | -135 | 147 | 170.4 | -92.2 | -88.5 | 0 | 0 | 0 | 111.8 | | |
| 242 | A | 52.8 | Low | 49.1 | Very low | 104 Ų | 104 | 144.7 Ų | 144.7 | 86% | 0.86 | 82% | 0.816 | S | S | * | * | | | trans | 67.3 | 89.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 118.4 | | |
| 243 | A | 45.9 | Very low | 49.5 | Very low | 108 Ų | 108 | 144 Ų | 144 | 89% | 0.893 | 82% | 0.822 | S | S | * | * | | | trans | -153.6 | 70 | 155.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 244 | A | 55.6 | Low | 49.1 | Very low | 93 Ų | 93 | 140.7 Ų | 140.7 | 77% | 0.769 | 82% | 0.817 | S | S | * | * | | | trans | -150.3 | 43.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | | |
| 245 | L | 49.3 | Very low | 49.1 | Very low | 172 Ų | 172 | 147.2 Ų | 147.2 | 90% | 0.901 | 83% | 0.827 | S | S | * | * | | | trans | -136.6 | 79.8 | 164 | -73 | 179.6 | 0 | 0 | 0 | 110.8 | | |
| 246 | T | 44.1 | Very low | 49.2 | Very low | 122 Ų | 122 | 148.6 Ų | 148.6 | 75% | 0.748 | 83% | 0.834 | S | S | * | * | | | trans | -121.7 | 88.9 | 166 | -171.2 | 0 | 0 | 0 | 0 | 110.1 | K248 | T246-K248 PolarHBondContact O-N 3.34Å; T246-K248 VanDerWaalsContact O-N 3.11Å |
| 247 | T | 46.7 | Very low | 49.1 | Very low | 132 Ų | 132 | 142.3 Ų | 142.3 | 81% | 0.81 | 81% | 0.814 | S | S | * | * | | | trans | -80 | 87.3 | 176.2 | 50.7 | 0 | 0 | 0 | 0 | 110.1 | | |
| 248 | K | 46.6 | Very low | 49.2 | Very low | 178 Ų | 178 | 141.5 Ų | 141.5 | 77% | 0.774 | 82% | 0.815 | S | S | * | * | | | trans | -95.5 | 117.8 | 163.4 | -72.2 | -172.4 | 178.5 | -179.9 | 0 | 109.5 | T246 G250 | T246-K248 PolarHBondContact O-N 3.34Å; T246-K248 VanDerWaalsContact O-N 3.11Å; K248-G250 PolarHBondContact O-N 3.03Å |
| 249 | P | 49.5 | Very low | 49 | Very low | 138 Ų | 138 | 142 Ų | 142 | 90% | 0.896 | 81% | 0.813 | S | S | * | * | | | trans | -74.7 | 79.7 | 171.1 | 31 | -32.9 | 0 | 0 | 0 | 109.5 | | |
| 250 | G | 42.7 | Very low | 49.1 | Very low | 60 Ų | 60 | 141.9 Ų | 141.9 | 62% | 0.619 | 81% | 0.812 | S | S | * | * | | | trans | -80.6 | 114.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | K248 L252 | K248-G250 PolarHBondContact O-N 3.03Å; G250-L252 VanDerWaalsContact C-N 3.32Å; G250-L252 PolarHBondContact O-N 2.79Å |
| 251 | L | 54 | Low | 49.2 | Very low | 176 Ų | 176 | 144 Ų | 144 | 92% | 0.921 | 81% | 0.811 | S | S | * | * | | | trans | -64.3 | 85.1 | 174 | -178.3 | 74.5 | 0 | 0 | 0 | 110.8 | | |
| 252 | L | 49.2 | Very low | 49.5 | Very low | 163 Ų | 163 | 144.1 Ų | 144.1 | 85% | 0.853 | 81% | 0.809 | S | S | * | * | | | trans | -94.6 | 110.2 | 167.7 | -72.7 | -173.9 | 0 | 0 | 0 | 111 | G250 Q254 | G250-L252 VanDerWaalsContact C-N 3.32Å; G250-L252 PolarHBondContact O-N 2.79Å; L252-Q254 PolarHBondContact O-N 3.35Å |
| 253 | Q | 52.6 | Low | 49.5 | Very low | 192 Ų | 192 | 144.7 Ų | 144.7 | 90% | 0.897 | 80% | 0.802 | S | S | * | * | | | trans | -34.8 | 109.6 | 173.9 | -161.4 | 164.4 | 51.2 | 0 | 0 | 113.4 | R255 | Q253-R255 PolarHBondContact O-N 3.19Š|
| 254 | Q | 42.8 | Very low | 50 | Low | 187 Ų | 187 | 146.8 Ų | 146.8 | 87% | 0.874 | 79% | 0.794 | S | S | * | * | | | trans | -69.1 | 122 | 175.6 | -74.5 | -171.2 | -5.4 | 0 | 0 | 110.9 | L252 | L252-Q254 PolarHBondContact O-N 3.35Š|
| 255 | R | 43.8 | Very low | 50.2 | Low | 232 Ų | 232 | 150.5 Ų | 150.5 | 88% | 0.875 | 80% | 0.8 | S | S | * | * | | | trans | -74.5 | 130.7 | 164.8 | -175.5 | 176.3 | -178.2 | 130.3 | -2.8 | 108.6 | Q253 G257 | Q253-R255 PolarHBondContact O-N 3.19Å; R255-G257 VanDerWaalsContact C-N 3.33Å; R255-G257 PolarHBondContact O-N 3.21Å |
| 256 | P | 48.5 | Very low | 50.7 | Low | 135 Ų | 135 | 149 Ų | 149 | 88% | 0.877 | 79% | 0.792 | S | S | * | * | | | trans | -73.8 | 86.5 | 179.4 | 29.7 | -34.1 | 0 | 0 | 0 | 110.5 | | |
| 257 | G | 47.3 | Very low | 51.6 | Low | 54 Ų | 54 | 146.6 Ų | 146.6 | 56% | 0.557 | 78% | 0.78 | S | S | * | * | | | trans | -111.1 | 124.9 | 169 | 0 | 0 | 0 | 0 | 0 | 109.8 | R255 V259 | R255-G257 VanDerWaalsContact C-N 3.33Å; R255-G257 PolarHBondContact O-N 3.21Å; G257-V259 PolarHBondContact O-N 3.03Å |
| 258 | N | 53.9 | Low | 52.3 | Low | 144 Ų | 144 | 152.3 Ų | 152.3 | 77% | 0.77 | 79% | 0.787 | S | S | * | * | | | trans | -38 | 104 | -172.5 | -59.9 | -29.6 | 0 | 0 | 0 | 114.7 | T260 | N258-T260 PolarHBondContact O-N 2.99Š|
| 259 | V | 52.8 | Low | 52.9 | Low | 119 Ų | 119 | 152 Ų | 152 | 72% | 0.721 | 79% | 0.785 | S | S | * | * | G | 310 helix | trans | -65.4 | -22 | -177.3 | -176.6 | 0 | 0 | 0 | 0 | 112.4 | G257 Q261 R262 | G257-V259 PolarHBondContact O-N 3.03Å; V259-Q261 PolarHBondContact O-N 3.19Å; V259-R262 PolarHBondContact O-N 2.92Å |
| 260 | T | 51 | Low | 53.3 | Low | 122 Ų | 122 | 148.8 Ų | 148.8 | 75% | 0.748 | 77% | 0.77 | S | S | * | * | G | 310 helix | trans | -63.1 | -11.5 | -172.9 | -31.7 | 0 | 0 | 0 | 0 | 115.5 | N258 | N258-T260 PolarHBondContact O-N 2.99Š|
| 261 | Q | 54.1 | Low | 54.1 | Low | 162 Ų | 162 | 152.9 Ų | 152.9 | 76% | 0.757 | 78% | 0.777 | S | S | * | * | G | 310 helix | trans | -97.9 | -13.1 | 178.4 | -67.5 | -168.2 | -1.2 | 0 | 0 | 114.5 | V259 T263 | V259-Q261 PolarHBondContact O-N 3.19Å; Q261-T263 VanDerWaalsContact C-N 3.31Å; Q261-T263 PolarHBondContact O-N 2.79Å |
| 262 | R | 56.1 | Low | 54.6 | Low | 233 Ų | 233 | 154.4 Ų | 154.4 | 88% | 0.879 | 77% | 0.771 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.2 | 3 | -173 | -140.2 | -178.2 | 87 | 169.6 | 6.4 | 115.1 | V259 | V259-R262 PolarHBondContact O-N 2.92Š|
| 263 | T | 53.5 | Low | 55.3 | Low | 116 Ų | 116 | 156.6 Ų | 156.6 | 71% | 0.712 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133 | 25.4 | -177.2 | 50.4 | 0 | 0 | 0 | 0 | 113.1 | Q261 L265 | Q261-T263 VanDerWaalsContact C-N 3.31Å; Q261-T263 PolarHBondContact O-N 2.79Å; T263-L265 VanDerWaalsContact C-N 3.29Å; T263-L265 PolarHBondContact O-N 2.73Å |
| 264 | Q | 56.3 | Low | 55.7 | Low | 153 Ų | 153 | 154.9 Ų | 154.9 | 72% | 0.715 | 76% | 0.764 | S | S | * | * | | | trans | -71.1 | 91.3 | 163.4 | -70.1 | -151.2 | -4.5 | 0 | 0 | 109.8 | L266 | Q264-L266 PolarHBondContact O-N 2.8Š|
| 265 | L | 59.6 | Low | 56.6 | Low | 170 Ų | 170 | 151.9 Ų | 151.9 | 89% | 0.89 | 75% | 0.754 | S | S | * | * | | | trans | -54.8 | 108.4 | 161.4 | -74.2 | 165.5 | 0 | 0 | 0 | 107.7 | T263 S267 | T263-L265 VanDerWaalsContact C-N 3.29Å; T263-L265 PolarHBondContact O-N 2.73Å; L265-S267 PolarHBondContact O-N 2.91Å |
| 266 | L | 59.3 | Low | 57.3 | Low | 142 Ų | 142 | 147.8 Ų | 147.8 | 74% | 0.743 | 75% | 0.749 | S | S | * | * | | | trans | -62.8 | 101.5 | 175.2 | -67.4 | 174.6 | 0 | 0 | 0 | 108 | Q264 R268 | Q264-L266 PolarHBondContact O-N 2.8Å; L266-R268 PolarHBondContact O-N 3.14Å |
| 267 | S | 64.4 | Low | 57.9 | Low | 70 Ų | 70 | 149.1 Ų | 149.1 | 49% | 0.49 | 75% | 0.748 | S | S | . | * | | | trans | -51 | 135.8 | 177.1 | 171.6 | 0 | 0 | 0 | 0 | 109.8 | L265 K269 A270 | L265-S267 PolarHBondContact O-N 2.91Å; S267-K269 PolarHBondContact O-N 3.44Å; S267-K269 PolarHBondContact OG-N 2.78Å; S267-A270 WeakPolarHBondContact O-CB 3.28Å; S267-A270 PolarHBondContact O-N 3.14Å |
| 268 | R | 59.9 | Low | 58.4 | Low | 253 Ų | 253 | 157.7 Ų | 157.7 | 96% | 0.955 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.6 | -18.8 | 175 | -69.9 | -174.2 | 178.7 | -174.8 | -0.5 | 112.9 | L266 | L266-R268 PolarHBondContact O-N 3.14Š|
| 269 | K | 58.7 | Low | 58.3 | Low | 170 Ų | 170 | 156.7 Ų | 156.7 | 74% | 0.739 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.3 | -4.8 | 176.8 | -60.3 | -175.8 | 179.8 | -179.7 | 0 | 114.7 | S267 R272 | S267-K269 PolarHBondContact O-N 3.44Å; S267-K269 PolarHBondContact OG-N 2.78Å; K269-R272 WeakPolarHBondContact O-CG 3.21Å |
| 270 | A | 59.7 | Low | 58.4 | Low | 71 Ų | 71 | 157.4 Ų | 157.4 | 59% | 0.587 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85 | -30.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | S267 R272 | S267-A270 WeakPolarHBondContact O-CB 3.28Å; S267-A270 PolarHBondContact O-N 3.14Å; A270-R272 PolarHBondContact O-N 3.04Å |
| 271 | L | 58.8 | Low | 58.5 | Low | 146 Ų | 146 | 160.9 Ų | 160.9 | 76% | 0.764 | 77% | 0.774 | S | S | * | * | | | trans | -83.4 | 52.5 | 176.7 | -104.1 | 163.6 | 0 | 0 | 0 | 112.3 | R273 | L271-R273 PolarHBondContact O-N 2.97Š|
| 272 | R | 65.1 | Low | 58.4 | Low | 208 Ų | 208 | 159.8 Ų | 159.8 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | | | trans | -86 | 105.7 | 170.9 | -66.7 | 178.5 | 106.1 | 167.4 | 3.9 | 108.8 | K269 A270 L274 | K269-R272 WeakPolarHBondContact O-CG 3.21Å; A270-R272 PolarHBondContact O-N 3.04Å; R272-L274 PolarHBondContact O-N 3.03Å |
| 273 | R | 62.8 | Low | 58.1 | Low | 209 Ų | 209 | 151.4 Ų | 151.4 | 79% | 0.789 | 77% | 0.767 | S | S | * | * | | | trans | -58.3 | 123.7 | 173.6 | -65.4 | 176.6 | 76.7 | 179.3 | 5.2 | 108.7 | L271 N275 | L271-R273 PolarHBondContact O-N 2.97Å; R273-N275 PolarHBondContact O-N 2.97Å |
| 274 | L | 60.8 | Low | 57.8 | Low | 156 Ų | 156 | 152.2 Ų | 152.2 | 82% | 0.817 | 77% | 0.772 | S | S | * | * | | | trans | -72.2 | 23.5 | -179.9 | -88.7 | 162.3 | 0 | 0 | 0 | 114.3 | R272 L276 | R272-L274 PolarHBondContact O-N 3.03Å; L274-L276 HydrophobicContact CD2-CD1 4.17Å; L274-L276 PolarHBondContact O-N 3.04Å |
| 275 | N | 61.7 | Low | 57.7 | Low | 124 Ų | 124 | 153.4 Ų | 153.4 | 66% | 0.663 | 78% | 0.782 | S | S | * | * | | | trans | -74.7 | 71 | 166.6 | -78.1 | -22.7 | 0 | 0 | 0 | 109.2 | R273 L277 | R273-N275 PolarHBondContact O-N 2.97Å; N275-L277 PolarHBondContact O-N 2.86Å |
| 276 | L | 59.1 | Low | 57.2 | Low | 147 Ų | 147 | 152.9 Ų | 152.9 | 77% | 0.77 | 78% | 0.775 | S | S | * | * | | | trans | -60.9 | 107.4 | 157.5 | -89.3 | 71.6 | 0 | 0 | 0 | 106.6 | L274 R278 | L274-L276 HydrophobicContact CD2-CD1 4.17Å; L274-L276 PolarHBondContact O-N 3.04Å; L276-R278 PolarHBondContact O-N 3.11Å |
| 277 | L | 60.6 | Low | 56.9 | Low | 163 Ų | 163 | 155.8 Ų | 155.8 | 85% | 0.853 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -47.8 | 125.7 | 163.9 | -72.6 | 156.3 | 0 | 0 | 0 | 107.7 | N275 | N275-L277 PolarHBondContact O-N 2.86Š|
| 278 | R | 59.3 | Low | 56.3 | Low | 234 Ų | 234 | 160.4 Ų | 160.4 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 128.7 | 173.6 | -80.5 | 179.3 | -81.2 | 162.4 | -5.1 | 107.4 | L276 T280 | L276-R278 PolarHBondContact O-N 3.11Å; R278-T280 PolarHBondContact O-N 2.87Å |
| 279 | P | 51.7 | Low | 56 | Low | 122 Ų | 122 | 155.4 Ų | 155.4 | 79% | 0.792 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 126.7 | -179.1 | 23.9 | -33 | 0 | 0 | 0 | 109.2 | K281 | P279-K281 PolarHBondContact O-N 2.85Š|
| 280 | T | 53.5 | Low | 55.6 | Low | 134 Ų | 134 | 155.4 Ų | 155.4 | 82% | 0.822 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 123.7 | 170.6 | 42.6 | 0 | 0 | 0 | 0 | 107.9 | R278 P282 | R278-T280 PolarHBondContact O-N 2.87Å; T280-P282 WeakPolarHBondContact O-CD 3.31Å |
| 281 | K | 54.3 | Low | 55.7 | Low | 196 Ų | 196 | 159.6 Ų | 159.6 | 85% | 0.852 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 127 | 174.9 | -83.6 | 179.3 | 172.6 | 176.6 | 0 | 108.5 | P279 G283 | P279-K281 PolarHBondContact O-N 2.85Å; K281-G283 PolarHBondContact O-N 3.24Å |
| 282 | P | 51 | Low | 55.3 | Low | 139 Ų | 139 | 158 Ų | 158 | 90% | 0.903 | 80% | 0.795 | S | S | * | * | | | trans | -74.5 | 95.8 | 169.4 | 30.4 | -31.3 | 0 | 0 | 0 | 107.9 | T280 | T280-P282 WeakPolarHBondContact O-CD 3.31Š|
| 283 | G | 50.2 | Low | 54.7 | Low | 57 Ų | 57 | 154.4 Ų | 154.4 | 59% | 0.588 | 80% | 0.796 | S | S | * | * | | | trans | -171.7 | 106.3 | -176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | K281 | K281-G283 PolarHBondContact O-N 3.24Š|
| 284 | T | 47.9 | Very low | 54.3 | Low | 132 Ų | 132 | 152.2 Ų | 152.2 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | | | trans | 71.2 | 109.1 | 169.2 | -48.1 | 0 | 0 | 0 | 0 | 115.9 | H286 | T284-H286 PolarHBondContact O-N 3.33Š|
| 285 | L | 53.3 | Low | 54.2 | Low | 178 Ų | 178 | 155.8 Ų | 155.8 | 93% | 0.932 | 80% | 0.798 | S | S | * | * | | | trans | -62.8 | 102.4 | 161.3 | -67.8 | 166.6 | 0 | 0 | 0 | 108.9 | | |
| 286 | H | 49.6 | Very low | 53.9 | Low | 160 Ų | 160 | 157.4 Ų | 157.4 | 74% | 0.741 | 80% | 0.801 | S | S | * | * | | | trans | -134.4 | 123.4 | 163.6 | -150.6 | -92.2 | 0 | 0 | 0 | 107.9 | T284 H288 | T284-H286 PolarHBondContact O-N 3.33Å; H286-H288 VanDerWaalsContact C-N 3.26Å; H286-H288 PolarHBondContact O-N 3.05Å |
| 287 | F | 52.7 | Low | 53.8 | Low | 202 Ų | 202 | 157.3 Ų | 157.3 | 89% | 0.886 | 80% | 0.8 | S | S | * | * | | | trans | -68.3 | 84.9 | 178.2 | -74.9 | -93 | 0 | 0 | 0 | 109.4 | L289 | F287-L289 VanDerWaalsContact C-N 3.33Å; F287-L289 PolarHBondContact O-N 2.85Å |
| 288 | H | 52.6 | Low | 53.2 | Low | 168 Ų | 168 | 157 Ų | 157 | 78% | 0.778 | 80% | 0.799 | S | S | * | * | | | trans | -81.3 | 86.3 | 175.9 | -151.1 | -30.2 | 0 | 0 | 0 | 109.2 | H286 H290 | H286-H288 VanDerWaalsContact C-N 3.26Å; H286-H288 PolarHBondContact O-N 3.05Å; H288-H290 PolarHBondContact O-N 3.06Å |
| 289 | L | 51.8 | Low | 52.8 | Low | 148 Ų | 148 | 158.5 Ų | 158.5 | 78% | 0.775 | 81% | 0.813 | S | S | * | * | | | trans | -49.1 | 128.7 | 158.9 | -85 | 159.2 | 0 | 0 | 0 | 108.3 | F287 Q291 | F287-L289 VanDerWaalsContact C-N 3.33Å; F287-L289 PolarHBondContact O-N 2.85Å; L289-Q291 VanDerWaalsContact C-N 3.34Å; L289-Q291 PolarHBondContact O-N 3.26Å |
| 290 | H | 51.8 | Low | 52.8 | Low | 170 Ų | 170 | 160.4 Ų | 160.4 | 79% | 0.787 | 81% | 0.814 | S | S | * | * | | | trans | -75.4 | 86.7 | 178.8 | 177.2 | -74.1 | 0 | 0 | 0 | 108.9 | H288 | H288-H290 PolarHBondContact O-N 3.06Š|
| 291 | Q | 60.2 | Low | 52.8 | Low | 159 Ų | 159 | 161.7 Ų | 161.7 | 74% | 0.743 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 128.3 | 170 | -77.2 | -169.9 | -30.3 | 0 | 0 | 109.4 | L289 T293 | L289-Q291 VanDerWaalsContact C-N 3.34Å; L289-Q291 PolarHBondContact O-N 3.26Å; Q291-T293 PolarHBondContact O-N 3.37Å |
| 292 | P | 51.1 | Low | 52.7 | Low | 112 Ų | 112 | 159.8 Ų | 159.8 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 134 | 174.2 | 27.4 | -33.1 | 0 | 0 | 0 | 109.9 | Q294 | P292-Q294 PolarHBondContact O-N 3.2Š|
| 293 | T | 52.2 | Low | 52.8 | Low | 132 Ų | 132 | 161.1 Ų | 161.1 | 81% | 0.81 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 124.2 | -169.9 | -35.5 | 0 | 0 | 0 | 0 | 112.2 | Q291 R295 | Q291-T293 PolarHBondContact O-N 3.37Å; T293-R295 PolarHBondContact O-N 3.23Å; T293-R295 VanDerWaalsContact O-N 3.11Å |
| 294 | Q | 54.1 | Low | 53 | Low | 163 Ų | 163 | 167.6 Ų | 167.6 | 76% | 0.762 | 82% | 0.82 | S | S | * | * | | | trans | -55.7 | 114.8 | 173.6 | -174.4 | 175.5 | -3.7 | 0 | 0 | 110 | P292 H296 | P292-Q294 PolarHBondContact O-N 3.2Å; Q294-H296 PolarHBondContact O-N 2.7Å |
| 295 | R | 59.7 | Low | 53.3 | Low | 232 Ų | 232 | 169.9 Ų | 169.9 | 88% | 0.875 | 82% | 0.82 | S | S | * | * | | | trans | -74 | 109.3 | 175.8 | -80.9 | -178.5 | 157.8 | 171.3 | -5.9 | 109.1 | T293 L297 | T293-R295 PolarHBondContact O-N 3.23Å; T293-R295 VanDerWaalsContact O-N 3.11Å; R295-L297 PolarHBondContact O-N 3.14Å; R295-L297 VanDerWaalsContact O-N 3.1Å |
| 296 | H | 54.2 | Low | 53.3 | Low | 157 Ų | 157 | 169.4 Ų | 169.4 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | | | trans | -66.2 | 107 | 167.3 | -78.4 | -102.1 | 0 | 0 | 0 | 109.5 | Q294 | Q294-H296 PolarHBondContact O-N 2.7Š|
| 297 | L | 57.4 | Low | 53.6 | Low | 145 Ų | 145 | 170.1 Ų | 170.1 | 76% | 0.759 | 82% | 0.818 | S | S | * | * | | | trans | -73 | 125.6 | 160.7 | -66.2 | 168.5 | 0 | 0 | 0 | 107.2 | R295 | R295-L297 PolarHBondContact O-N 3.14Å; R295-L297 VanDerWaalsContact O-N 3.1Å |
| 298 | N | 49.4 | Very low | 53.7 | Low | 156 Ų | 156 | 167.4 Ų | 167.4 | 83% | 0.834 | 81% | 0.812 | S | S | * | * | | | trans | -90.2 | 124.5 | 167.6 | -65.3 | -91.8 | 0 | 0 | 0 | 106.6 | | |
| 299 | F | 49.5 | Very low | 53.8 | Low | 267 Ų | 267 | 167.4 Ų | 167.4 | 100% | 1.171 | 82% | 0.815 | S | S | * | * | | | trans | -87.6 | 0 | 164.1 | -67.6 | -84.8 | 0 | 0 | 0 | 108.9 | | |