| 1 | M | 68.8 | Low | 70 | Confident | 239 Ų | 239 | 147.3 Ų | 147.3 | 100% | 1.177 | 79% | 0.785 | S | S | * | * | | | | 0 | 102.4 | 0 | -166.7 | 169.8 | -168.6 | 0 | 0 | 104.9 | | |
| 2 | E | 71.4 | Confident | 69.5 | Low | 179 Ų | 179 | 148.4 Ų | 148.4 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 137.6 | -179.3 | -64.3 | -80.1 | 112.4 | 0 | 0 | 108.4 | | |
| 3 | P | 71.2 | Confident | 69.4 | Low | 111 Ų | 111 | 149.5 Ų | 149.5 | 72% | 0.721 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 129.6 | 176.6 | 28.9 | -31.5 | 0 | 0 | 0 | 110 | T5 | P3-T5 VanDerWaalsContact O-N 3.16Å; P3-T5 PolarHBondContact O-N 2.8Å |
| 4 | E | 71.8 | Confident | 69.6 | Low | 184 Ų | 184 | 142.6 Ų | 142.6 | 86% | 0.86 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 116.7 | 173 | -63.3 | 179.6 | 129.8 | 0 | 0 | 108.9 | V6 | E4-V6 PolarHBondContact O-N 3Š|
| 5 | T | 67.8 | Low | 69.4 | Low | 124 Ų | 124 | 141.8 Ų | 141.8 | 76% | 0.761 | 78% | 0.775 | S | S | * | * | | | trans | -77 | 93.7 | 176.4 | 47.5 | 0 | 0 | 0 | 0 | 108.2 | P3 L7 | P3-T5 VanDerWaalsContact O-N 3.16Å; P3-T5 PolarHBondContact O-N 2.8Å; T5-L7 PolarHBondContact O-N 2.96Å |
| 6 | V | 69.3 | Low | 69.3 | Low | 96 Ų | 96 | 145.3 Ų | 145.3 | 58% | 0.582 | 79% | 0.785 | S | S | * | * | | | trans | -67.8 | 101 | 172.3 | -172 | 0 | 0 | 0 | 0 | 107.8 | E4 W8 | E4-V6 PolarHBondContact O-N 3Å; V6-W8 HydrophobicContact CG1-CD2 4.01Å; V6-W8 VanDerWaalsContact CG1-CE2 3.44Å; V6-W8 HydrophobicContact CG1-CG 4.11Å; V6-W8 HydrophobicContact CG1-CZ2 3.91Å; V6-W8 VanDerWaalsContact O-CD1 3.29Å; V6-W8 PolarHBondContact O-N 2.96Å |
| 7 | L | 66.2 | Low | 68.8 | Low | 165 Ų | 165 | 147.4 Ų | 147.4 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | | | trans | -69.8 | 79.7 | 170.8 | -78.4 | 158.3 | 0 | 0 | 0 | 108.4 | T5 G9 | T5-L7 PolarHBondContact O-N 2.96Å; L7-G9 PolarHBondContact O-N 2.98Å |
| 8 | W | 69.4 | Low | 68.6 | Low | 228 Ų | 228 | 144.7 Ų | 144.7 | 86% | 0.864 | 78% | 0.783 | S | S | * | * | | | trans | -67.4 | 87.9 | 160.8 | -58.8 | 95.2 | 0 | 0 | 0 | 106.6 | V6 | V6-W8 HydrophobicContact CG1-CD2 4.01Å; V6-W8 VanDerWaalsContact CG1-CE2 3.44Å; V6-W8 HydrophobicContact CG1-CG 4.11Å; V6-W8 HydrophobicContact CG1-CZ2 3.91Å; V6-W8 VanDerWaalsContact O-CD1 3.29Å; V6-W8 PolarHBondContact O-N 2.96Å |
| 9 | G | 75.8 | Confident | 68.3 | Low | 53 Ų | 53 | 147.3 Ų | 147.3 | 55% | 0.546 | 79% | 0.79 | S | S | . | * | | | trans | -54.1 | 156.8 | 167.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | L7 D11 | L7-G9 PolarHBondContact O-N 2.98Å; G9-D11 PolarHBondContact O-N 2.86Å; G9-D11 VanDerWaalsContact O-N 3.14Å |
| 10 | P | 67.4 | Low | 67.8 | Low | 117 Ų | 117 | 145.6 Ų | 145.6 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | | | trans | -53.2 | 126 | -176.9 | 22.6 | -32.5 | 0 | 0 | 0 | 109.5 | L12 | P10-L12 PolarHBondContact O-N 3.38Š|
| 11 | D | 71.2 | Confident | 67.3 | Low | 124 Ų | 124 | 147.6 Ų | 147.6 | 66% | 0.663 | 79% | 0.785 | S | S | * | * | | | trans | -55.8 | 104.6 | 177.6 | -169.6 | 28.4 | 0 | 0 | 0 | 107.9 | G9 Q13 | G9-D11 PolarHBondContact O-N 2.86Å; G9-D11 VanDerWaalsContact O-N 3.14Å; D11-Q13 PolarHBondContact O-N 3.07Å; D11-Q13 WeakPolarHBondContact OD2-CG 3.33Å; D11-Q13 PolarHBondContact OD2-NE2 3.32Å |
| 12 | L | 63.6 | Low | 66.8 | Low | 161 Ų | 161 | 140.4 Ų | 140.4 | 84% | 0.843 | 76% | 0.764 | S | S | * | * | | | trans | -79.2 | 59.5 | 174.3 | -65.6 | 179.5 | 0 | 0 | 0 | 107.9 | P10 G14 | P10-L12 PolarHBondContact O-N 3.38Å; L12-G14 PolarHBondContact O-N 2.98Å |
| 13 | Q | 69 | Low | 66.1 | Low | 163 Ų | 163 | 138.2 Ų | 138.2 | 76% | 0.762 | 75% | 0.753 | S | S | * | * | | | trans | -61.1 | 83 | 153.4 | -87.9 | -179.6 | 1.4 | 0 | 0 | 106.7 | D11 | D11-Q13 PolarHBondContact O-N 3.07Å; D11-Q13 WeakPolarHBondContact OD2-CG 3.33Å; D11-Q13 PolarHBondContact OD2-NE2 3.32Å |
| 14 | G | 71.3 | Confident | 65.3 | Low | 53 Ų | 53 | 143.9 Ų | 143.9 | 55% | 0.546 | 76% | 0.76 | S | S | . | * | | | trans | -58 | 144.1 | 165.5 | 0 | 0 | 0 | 0 | 0 | 108.1 | L12 E16 | L12-G14 PolarHBondContact O-N 2.98Å; G14-E16 PolarHBondContact O-N 3.08Å |
| 15 | P | 67.1 | Low | 64.5 | Low | 130 Ų | 130 | 141.5 Ų | 141.5 | 84% | 0.844 | 75% | 0.753 | S | S | * | * | | | trans | -57.6 | 115.7 | 171.1 | 23.4 | -30.5 | 0 | 0 | 0 | 108.4 | E17 | P15-E17 PolarHBondContact O-N 3.05Å; P15-E17 VanDerWaalsContact O-N 3.1Å |
| 16 | E | 67 | Low | 63.8 | Low | 198 Ų | 198 | 139.2 Ų | 139.2 | 93% | 0.925 | 74% | 0.742 | S | S | * | * | | | trans | -54.6 | 110.3 | 158.4 | -86.9 | -171.1 | 81 | 0 | 0 | 107.8 | G14 | G14-E16 PolarHBondContact O-N 3.08Š|
| 17 | E | 62.2 | Low | 63.2 | Low | 180 Ų | 180 | 142 Ų | 142 | 84% | 0.841 | 75% | 0.753 | S | S | * | * | | | trans | -149.1 | 105.7 | 148.8 | -135.7 | -179 | 90.5 | 0 | 0 | 109.3 | P15 Q19 | P15-E17 PolarHBondContact O-N 3.05Å; P15-E17 VanDerWaalsContact O-N 3.1Å; E17-Q19 PolarHBondContact O-N 2.93Å |
| 18 | S | 64.6 | Low | 62.6 | Low | 100 Ų | 100 | 137.7 Ų | 137.7 | 70% | 0.699 | 74% | 0.736 | S | S | * | * | | | trans | -66.7 | 107.4 | 175.4 | 153.2 | 0 | 0 | 0 | 0 | 109.8 | N20 | S18-N20 PolarHBondContact O-N 2.76Š|
| 19 | Q | 61.9 | Low | 62.1 | Low | 194 Ų | 194 | 132.3 Ų | 132.3 | 91% | 0.907 | 73% | 0.729 | S | S | * | * | | | trans | -75.2 | 48 | 169 | -69.5 | -164.7 | -45.7 | 0 | 0 | 112.8 | E17 | E17-Q19 PolarHBondContact O-N 2.93Š|
| 20 | N | 59.4 | Low | 61 | Low | 113 Ų | 113 | 136.2 Ų | 136.2 | 60% | 0.604 | 75% | 0.746 | S | S | * | * | | | trans | -125.1 | 47.1 | 171.3 | -169.3 | 18.9 | 0 | 0 | 0 | 112.4 | S18 | S18-N20 PolarHBondContact O-N 2.76Š|
| 21 | E | 57.5 | Low | 60.3 | Low | 188 Ų | 188 | 140.1 Ų | 140.1 | 88% | 0.879 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -119.9 | 17.3 | 164.8 | -152.8 | 164.9 | 157 | 0 | 0 | 112.3 | | |
| 22 | A | 57.7 | Low | 59.5 | Low | 88 Ų | 88 | 140.1 Ų | 140.1 | 73% | 0.727 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -109.6 | -3.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | | |
| 23 | H | 57.3 | Low | 59 | Low | 132 Ų | 132 | 142.9 Ų | 142.9 | 61% | 0.611 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -113.4 | 41.2 | -178 | -158.5 | -64.2 | 0 | 0 | 0 | 112.7 | | |
| 24 | R | 54.7 | Low | 58.3 | Low | 230 Ų | 230 | 143.2 Ų | 143.2 | 87% | 0.868 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -119.3 | -16.2 | 161.1 | -85.4 | -156.1 | 165.6 | 158.2 | 0.2 | 115.3 | | |
| 25 | D | 54 | Low | 57.4 | Low | 135 Ų | 135 | 150.9 Ų | 150.9 | 72% | 0.722 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -101.8 | -3 | -175.6 | -67.3 | -29.2 | 0 | 0 | 0 | 114.9 | L27 | D25-L27 PolarHBondContact O-N 3.2Š|
| 26 | S | 53.3 | Low | 56.7 | Low | 76 Ų | 76 | 151.6 Ų | 151.6 | 53% | 0.531 | 76% | 0.757 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87 | 4.4 | -179.1 | 53.3 | 0 | 0 | 0 | 0 | 115.2 | | |
| 27 | L | 56.2 | Low | 55.8 | Low | 154 Ų | 154 | 152.9 Ų | 152.9 | 81% | 0.806 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.6 | 40.4 | 177.5 | -72.4 | 177.9 | 0 | 0 | 0 | 115.5 | D25 | D25-L27 PolarHBondContact O-N 3.2Š|
| 28 | S | 55 | Low | 55.5 | Low | 74 Ų | 74 | 155.7 Ų | 155.7 | 52% | 0.517 | 76% | 0.757 | S | S | . | * | | | trans | -146.1 | 22.1 | 164.1 | 74.7 | 0 | 0 | 0 | 0 | 117.6 | | |
| 29 | V | 57 | Low | 54.6 | Low | 115 Ų | 115 | 154.3 Ų | 154.3 | 70% | 0.697 | 76% | 0.758 | S | S | * | * | | | trans | -108.1 | 57.6 | 172.3 | -158.9 | 0 | 0 | 0 | 0 | 111.9 | | |
| 30 | C | 54 | Low | 53.6 | Low | 136 Ų | 136 | 154.3 Ų | 154.3 | 92% | 0.919 | 76% | 0.758 | S | S | * | * | | | trans | -112.6 | 56.8 | 140.7 | -88.9 | 0 | 0 | 0 | 0 | 108.5 | | |
| 31 | R | 52.9 | Low | 53.5 | Low | 198 Ų | 198 | 154.4 Ų | 154.4 | 75% | 0.747 | 77% | 0.765 | S | S | * | * | | | trans | -95.3 | 106.6 | 154.2 | -72.7 | -172.5 | -171 | 178.9 | 4.7 | 106.2 | W33 | R31-W33 PolarHBondContact O-N 3.4Š|
| 32 | C | 54.8 | Low | 53 | Low | 125 Ų | 125 | 151.2 Ų | 151.2 | 85% | 0.845 | 76% | 0.763 | S | S | * | * | | | trans | -50.8 | 112.8 | 160.2 | -66.3 | 0 | 0 | 0 | 0 | 107 | K34 | C32-K34 PolarHBondContact O-N 3.05Š|
| 33 | W | 51.4 | Low | 52.7 | Low | 218 Ų | 218 | 152 Ų | 152 | 83% | 0.826 | 77% | 0.77 | S | S | * | * | | | trans | -70.5 | 80.6 | 170.6 | -73 | 59.8 | 0 | 0 | 0 | 106.9 | R31 W35 | R31-W33 PolarHBondContact O-N 3.4Å; W33-W35 PolarHBondContact O-N 3.1Å; W33-W35 VanDerWaalsContact O-N 3.15Å |
| 34 | K | 55.1 | Low | 51.9 | Low | 171 Ų | 171 | 149.3 Ų | 149.3 | 74% | 0.743 | 78% | 0.778 | S | S | * | * | | | trans | -70.2 | 105.4 | 164 | -169.8 | 178.2 | -178.9 | -174.8 | 0 | 105.2 | C32 E36 | C32-K34 PolarHBondContact O-N 3.05Å; K34-E36 PolarHBondContact O-N 2.95Å |
| 35 | W | 51.3 | Low | 51.6 | Low | 213 Ų | 213 | 147.7 Ų | 147.7 | 81% | 0.807 | 78% | 0.777 | S | S | * | * | | | trans | -67.8 | 80.7 | 174 | -153.8 | -74.4 | 0 | 0 | 0 | 108.6 | W33 R37 | W33-W35 PolarHBondContact O-N 3.1Å; W33-W35 VanDerWaalsContact O-N 3.15Å; W35-R37 PolarHBondContact O-N 3.16Å; W35-R37 VanDerWaalsContact O-N 3.14Å |
| 36 | E | 53.6 | Low | 51.2 | Low | 145 Ų | 145 | 150.9 Ų | 150.9 | 68% | 0.678 | 79% | 0.785 | S | S | * | * | | | trans | -79.1 | 95.4 | 172.8 | -164.9 | 162.9 | -139.4 | 0 | 0 | 107.3 | K34 R38 | K34-E36 PolarHBondContact O-N 2.95Å; E36-R38 PolarHBondContact O-N 3.02Å |
| 37 | R | 48.8 | Very low | 51 | Low | 225 Ų | 225 | 157.8 Ų | 157.8 | 85% | 0.849 | 80% | 0.799 | S | S | * | * | | | trans | -57.1 | 103.2 | 166.2 | -84.6 | -168.8 | -81.4 | 167.7 | -5.8 | 107.4 | W35 G39 | W35-R37 PolarHBondContact O-N 3.16Å; W35-R37 VanDerWaalsContact O-N 3.14Å; R37-G39 PolarHBondContact O-N 3.25Å |
| 38 | R | 54.7 | Low | 50.7 | Low | 240 Ų | 240 | 154.4 Ų | 154.4 | 91% | 0.906 | 80% | 0.802 | S | S | * | * | | | trans | -66.1 | 117.5 | 170.4 | -75.4 | -174.8 | -177.2 | -108.2 | -0.3 | 108.9 | E36 | E36-R38 PolarHBondContact O-N 3.02Š|
| 39 | G | 45.2 | Very low | 49.8 | Very low | 71 Ų | 71 | 154.3 Ų | 154.3 | 73% | 0.732 | 81% | 0.813 | S | S | * | * | | | trans | 82.5 | 97.9 | 145.9 | 0 | 0 | 0 | 0 | 0 | 117 | R37 | R37-G39 PolarHBondContact O-N 3.25Š|
| 40 | E | 42.1 | Very low | 49.3 | Very low | 193 Ų | 193 | 156.4 Ų | 156.4 | 90% | 0.902 | 82% | 0.82 | S | S | * | * | | | | -130.9 | 134 | 124.1 | -93.8 | -141.6 | 102.7 | 0 | 0 | 109 | | |
| 41 | P | 57.1 | Low | 48.9 | Very low | 116 Ų | 116 | 158.7 Ų | 158.7 | 75% | 0.753 | 82% | 0.817 | S | S | * | * | | | trans | -90.2 | 110.7 | 177 | 33.8 | -25.1 | 0 | 0 | 0 | 108.6 | | |
| 42 | S | 46.5 | Very low | 48.8 | Very low | 120 Ų | 120 | 155.3 Ų | 155.3 | 84% | 0.839 | 82% | 0.821 | S | S | * | * | | | trans | -159.1 | 116.6 | 155 | -102.4 | 0 | 0 | 0 | 0 | 113.8 | | |
| 43 | A | 51.3 | Low | 48.1 | Very low | 105 Ų | 105 | 152.8 Ų | 152.8 | 87% | 0.868 | 82% | 0.816 | S | S | * | * | | | trans | 48.9 | 107.4 | 137.4 | 0 | 0 | 0 | 0 | 0 | 117.7 | | |
| 44 | G | 40.1 | Very low | 47.7 | Very low | 75 Ų | 75 | 154.3 Ų | 154.3 | 77% | 0.773 | 82% | 0.821 | S | S | * | * | | | trans | 167 | 70.2 | 157.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | F46 | G44-F46 PolarHBondContact O-N 3.2Š|
| 45 | K | 50.3 | Low | 47 | Very low | 196 Ų | 196 | 152.5 Ų | 152.5 | 85% | 0.852 | 83% | 0.83 | S | S | * | * | | | trans | -66.1 | 111.9 | 150.1 | -69.6 | 169.3 | 176.4 | -175 | 0 | 106.1 | | |
| 46 | F | 44.4 | Very low | 46.7 | Very low | 202 Ų | 202 | 145.8 Ų | 145.8 | 89% | 0.886 | 83% | 0.827 | S | S | * | * | | | trans | -130.3 | 129.5 | 154.9 | -150.6 | -99.3 | 0 | 0 | 0 | 109.4 | G44 | G44-F46 PolarHBondContact O-N 3.2Š|
| 47 | W | 50.1 | Low | 46.5 | Very low | 221 Ų | 221 | 144.1 Ų | 144.1 | 84% | 0.837 | 83% | 0.831 | S | S | * | * | | | trans | -74.8 | 166.1 | -162.7 | -70.9 | 73.8 | 0 | 0 | 0 | 111.6 | | |
| 48 | G | 48.6 | Very low | 46.5 | Very low | 84 Ų | 84 | 143 Ų | 143 | 87% | 0.866 | 84% | 0.836 | S | S | * | * | | | trans | -50.6 | 154.1 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 49 | G | 36 | Very low | 46.2 | Very low | 72 Ų | 72 | 136.1 Ų | 136.1 | 74% | 0.742 | 83% | 0.825 | S | S | * | * | | | trans | -160 | 122.8 | 170.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 50 | D | 46.6 | Very low | 46.2 | Very low | 159 Ų | 159 | 144 Ų | 144 | 85% | 0.85 | 83% | 0.832 | S | S | * | * | | | trans | -34.8 | 152.4 | 173.7 | -73.3 | -106 | 0 | 0 | 0 | 118.5 | | |
| 51 | H | 46.3 | Very low | 46.7 | Very low | 183 Ų | 183 | 142.7 Ų | 142.7 | 85% | 0.847 | 83% | 0.83 | S | S | * | * | | | trans | -36.7 | 150.9 | 164.8 | -63.6 | -84.8 | 0 | 0 | 0 | 114.4 | | |
| 52 | P | 50.6 | Low | 46.2 | Very low | 128 Ų | 128 | 146.1 Ų | 146.1 | 83% | 0.831 | 84% | 0.836 | S | S | * | * | | | | -151.9 | 173.4 | 77.3 | 35.4 | -12.8 | 0 | 0 | 0 | 115.5 | | |
| 53 | G | 41.1 | Very low | 45.8 | Very low | 72 Ų | 72 | 143.5 Ų | 143.5 | 74% | 0.742 | 83% | 0.828 | S | S | * | * | | | trans | -71.7 | 171.3 | -174.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | | |
| 54 | R | 43.1 | Very low | 45.6 | Very low | 250 Ų | 250 | 144.2 Ų | 144.2 | 94% | 0.943 | 82% | 0.824 | S | S | * | * | | | trans | 79.8 | 99.9 | 146.5 | -150.2 | 176.7 | -168.7 | -118.4 | 1.7 | 116.8 | | |
| 55 | S | 40.2 | Very low | 46.2 | Very low | 132 Ų | 132 | 147.9 Ų | 147.9 | 92% | 0.923 | 82% | 0.824 | S | S | * | * | | | trans | 165.5 | 131.9 | 131.8 | -147.7 | 0 | 0 | 0 | 0 | 108.7 | | |
| 56 | G | 44 | Very low | 45.7 | Very low | 73 Ų | 73 | 149.6 Ų | 149.6 | 75% | 0.753 | 83% | 0.825 | S | S | * | * | | | cis | -167.2 | 140.5 | -6 | 0 | 0 | 0 | 0 | 0 | 106 | | |
| 57 | S | 50.1 | Low | 46.2 | Very low | 109 Ų | 109 | 148.2 Ų | 148.2 | 76% | 0.762 | 83% | 0.827 | S | S | * | * | | | trans | -120.7 | 92 | 161.9 | 33.5 | 0 | 0 | 0 | 0 | 106 | S59 | S57-S59 PolarHBondContact O-N 3.14Š|
| 58 | E | 48.5 | Very low | 45.9 | Very low | 203 Ų | 203 | 141.6 Ų | 141.6 | 95% | 0.949 | 82% | 0.82 | S | S | * | * | | | trans | -60.2 | 84.4 | 158.9 | -80.5 | -176.7 | 78.5 | 0 | 0 | 108.4 | | |
| 59 | S | 49.1 | Very low | 46.2 | Very low | 95 Ų | 95 | 144 Ų | 144 | 66% | 0.664 | 82% | 0.82 | S | S | * | * | | | trans | -100.4 | 89.4 | 156.5 | -40.6 | 0 | 0 | 0 | 0 | 106.1 | S57 I61 | S57-S59 PolarHBondContact O-N 3.14Å; S59-I61 PolarHBondContact O-N 2.88Å |
| 60 | R | 44.5 | Very low | 46.9 | Very low | 235 Ų | 235 | 143.6 Ų | 143.6 | 89% | 0.887 | 82% | 0.816 | S | S | * | * | | | trans | -41 | 92 | 172.1 | -171.2 | -174.1 | -148.1 | -179.7 | 5.9 | 112.4 | | |
| 61 | I | 52.6 | Low | 46.8 | Very low | 167 Ų | 167 | 144.6 Ų | 144.6 | 86% | 0.856 | 82% | 0.815 | S | S | * | * | | | trans | -100.9 | 96.4 | 162 | -50.8 | 175.4 | 0 | 0 | 0 | 106.1 | S59 | S59-I61 PolarHBondContact O-N 2.88Š|
| 62 | Q | 46.3 | Very low | 46.9 | Very low | 187 Ų | 187 | 141.4 Ų | 141.4 | 87% | 0.874 | 81% | 0.81 | S | S | * | * | | | trans | -137 | 101.5 | 174.3 | -149.1 | 173.6 | 81.6 | 0 | 0 | 108.5 | | |
| 63 | G | 38.6 | Very low | 46.9 | Very low | 66 Ų | 66 | 142.8 Ų | 142.8 | 68% | 0.68 | 81% | 0.81 | S | S | * | * | | | trans | -171.1 | 133.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | | |
| 64 | P | 46.3 | Very low | 47.2 | Very low | 120 Ų | 120 | 145.5 Ų | 145.5 | 78% | 0.779 | 82% | 0.815 | S | S | * | * | | | trans | -92.7 | 143.1 | -163.3 | 35.6 | -32.8 | 0 | 0 | 0 | 114 | | |
| 65 | I | 52.3 | Low | 47.4 | Very low | 152 Ų | 152 | 136.5 Ų | 136.5 | 78% | 0.779 | 80% | 0.8 | S | S | * | * | | | trans | 26.4 | 121.7 | 141.2 | -45.3 | 173.2 | 0 | 0 | 0 | 117.1 | | |
| 66 | R | 41.2 | Very low | 47.6 | Very low | 232 Ų | 232 | 136.1 Ų | 136.1 | 88% | 0.875 | 80% | 0.795 | S | S | * | * | | | | 179.1 | 116.3 | 125.3 | -96.2 | 156.7 | 177.7 | -149.4 | -5.2 | 111.5 | A68 | R66-A68 PolarHBondContact O-N 2.9Š|
| 67 | D | 54.3 | Low | 47.7 | Very low | 172 Ų | 172 | 140.6 Ų | 140.6 | 92% | 0.92 | 80% | 0.801 | S | S | * | * | | | trans | -53 | 117.5 | 155.1 | -66.2 | -82.6 | 0 | 0 | 0 | 109.1 | | |
| 68 | A | 43.8 | Very low | 47.6 | Very low | 83 Ų | 83 | 139.7 Ų | 139.7 | 69% | 0.686 | 80% | 0.795 | S | S | * | * | | | trans | -125.4 | 132.3 | 171.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | R66 G70 | R66-A68 PolarHBondContact O-N 2.9Å; A68-G70 PolarHBondContact O-N 3.12Å |
| 69 | P | 54 | Low | 47.5 | Very low | 135 Ų | 135 | 135.3 Ų | 135.3 | 88% | 0.877 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -80.4 | 117.3 | 178.3 | 31.7 | -28.7 | 0 | 0 | 0 | 109.3 | | |
| 70 | G | 51.2 | Low | 47.6 | Very low | 63 Ų | 63 | 136.1 Ų | 136.1 | 65% | 0.649 | 79% | 0.79 | S | S | * | * | | | trans | 94.9 | 115.5 | 167.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | A68 | A68-G70 PolarHBondContact O-N 3.12Š|
| 71 | E | 44.1 | Very low | 47.8 | Very low | 180 Ų | 180 | 128.4 Ų | 128.4 | 84% | 0.841 | 78% | 0.783 | S | S | * | * | | | trans | -166.1 | 112.7 | 142.1 | -89 | -60.6 | 90.8 | 0 | 0 | 105.9 | | |
| 72 | P | 49.8 | Very low | 47.7 | Very low | 115 Ų | 115 | 128.3 Ų | 128.3 | 75% | 0.747 | 78% | 0.777 | S | S | * | * | | | trans | -66 | 136.2 | 169.7 | 26.6 | -30.2 | 0 | 0 | 0 | 109.5 | | |
| 73 | L | 49.9 | Very low | 48.1 | Very low | 158 Ų | 158 | 125.1 Ų | 125.1 | 83% | 0.827 | 77% | 0.773 | S | S | * | * | | | trans | -46 | 137 | 179.2 | -70.3 | 168.9 | 0 | 0 | 0 | 111.8 | G75 | L73-G75 PolarHBondContact O-N 2.91Å; L73-G75 VanDerWaalsContact O-N 3.12Å |
| 74 | P | 47.8 | Very low | 48.8 | Very low | 129 Ų | 129 | 127.1 Ų | 127.1 | 84% | 0.838 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -70.1 | 113.1 | -178.3 | 28 | -31.7 | 0 | 0 | 0 | 109.7 | | |
| 75 | G | 46.8 | Very low | 48.9 | Very low | 61 Ų | 61 | 125.3 Ų | 125.3 | 63% | 0.629 | 76% | 0.756 | S | S | * | * | | | trans | 73.6 | 66.3 | 155.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | L73 L77 | L73-G75 PolarHBondContact O-N 2.91Å; L73-G75 VanDerWaalsContact O-N 3.12Å; G75-L77 PolarHBondContact O-N 2.74Å |
| 76 | C | 43.5 | Very low | 48.6 | Very low | 123 Ų | 123 | 124.8 Ų | 124.8 | 83% | 0.831 | 76% | 0.762 | S | S | * | * | | | trans | -59.6 | 98.1 | 139.4 | -66.6 | 0 | 0 | 0 | 0 | 106.2 | S78 | C76-S78 PolarHBondContact O-N 2.87Š|
| 77 | L | 46.1 | Very low | 49.2 | Very low | 168 Ų | 168 | 116.9 Ų | 116.9 | 88% | 0.88 | 75% | 0.753 | S | S | * | * | | | trans | -51 | 107.1 | 171.8 | -73.8 | 165.7 | 0 | 0 | 0 | 107.1 | G75 | G75-L77 PolarHBondContact O-N 2.74Š|
| 78 | S | 47.9 | Very low | 49 | Very low | 90 Ų | 90 | 115 Ų | 115 | 63% | 0.629 | 74% | 0.737 | S | S | * | * | | | trans | -53.8 | 136.8 | 169.2 | -67.9 | 0 | 0 | 0 | 0 | 107.5 | C76 S80 | C76-S78 PolarHBondContact O-N 2.87Å; S78-S80 PolarHBondContact O-N 3.41Å |
| 79 | P | 46.5 | Very low | 49.7 | Very low | 111 Ų | 111 | 119.6 Ų | 119.6 | 72% | 0.721 | 74% | 0.742 | S | S | * | * | | | trans | -75.7 | 61.7 | 177.8 | 32.5 | -33.8 | 0 | 0 | 0 | 109.3 | G81 | P79-G81 PolarHBondContact O-N 2.89Š|
| 80 | S | 51.9 | Low | 49.5 | Very low | 111 Ų | 111 | 118.1 Ų | 118.1 | 78% | 0.776 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.4 | 17.1 | 175.6 | 56.2 | 0 | 0 | 0 | 0 | 112.5 | S78 | S78-S80 PolarHBondContact O-N 3.41Š|
| 81 | G | 48.8 | Very low | 49.8 | Very low | 73 Ų | 73 | 122.7 Ų | 122.7 | 75% | 0.753 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.5 | 3.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | P79 | P79-G81 PolarHBondContact O-N 2.89Š|
| 82 | F | 51.2 | Low | 50.1 | Low | 165 Ų | 165 | 125.5 Ų | 125.5 | 72% | 0.724 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -85.3 | 128.5 | 172.3 | -77.9 | -85.9 | 0 | 0 | 0 | 109.7 | N84 | F82-N84 PolarHBondContact O-N 2.78Š|
| 83 | P | 53.7 | Low | 50.2 | Low | 121 Ų | 121 | 125.2 Ų | 125.2 | 79% | 0.786 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 121.8 | 172.6 | 26 | -31 | 0 | 0 | 0 | 108.6 | | |
| 84 | N | 52.9 | Low | 50.3 | Low | 108 Ų | 108 | 123.2 Ų | 123.2 | 58% | 0.578 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 135.1 | 174.8 | -80.4 | -76.4 | 0 | 0 | 0 | 109.3 | F82 F88 | F82-N84 PolarHBondContact O-N 2.78Å; N84-F88 HydrophobicContact CB-CB 4.02Å |
| 85 | P | 49.8 | Very low | 50.3 | Low | 81 Ų | 81 | 122.9 Ų | 122.9 | 53% | 0.526 | 73% | 0.732 | S | S | . | * | P | Polyproline II helix | trans | -61.5 | 147.6 | 172.3 | 26.2 | -32.4 | 0 | 0 | 0 | 110 | G87 F88 | P85-G87 PolarHBondContact O-N 2.9Å; P85-F88 HydrophobicContact CG-CD2 4.35Å; P85-F88 PolarHBondContact O-N 3.22Å; P85-F88 VanDerWaalsContact O-N 3.1Å |
| 86 | P | 44.4 | Very low | 50.6 | Low | 141 Ų | 141 | 125.2 Ų | 125.2 | 92% | 0.916 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.4 | 116.6 | -179.9 | 24.6 | -32 | 0 | 0 | 0 | 109.4 | | |
| 87 | G | 54.2 | Low | 51.2 | Low | 66 Ų | 66 | 129.8 Ų | 129.8 | 68% | 0.68 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 121.1 | -10.9 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | P85 F89 | P85-G87 PolarHBondContact O-N 2.9Å; G87-F89 PolarHBondContact O-N 3.1Å |
| 88 | F | 51.5 | Low | 51.3 | Low | 133 Ų | 133 | 123.6 Ų | 123.6 | 58% | 0.583 | 71% | 0.714 | S | S | * | * | | | trans | -82.3 | 93.3 | 169.5 | -123.6 | -94.4 | 0 | 0 | 0 | 109.8 | N84 P85 | N84-F88 HydrophobicContact CB-CB 4.02Å; P85-F88 HydrophobicContact CG-CD2 4.35Å; P85-F88 PolarHBondContact O-N 3.22Å; P85-F88 VanDerWaalsContact O-N 3.1Å |
| 89 | F | 57.5 | Low | 51.2 | Low | 179 Ų | 179 | 125.2 Ų | 125.2 | 79% | 0.785 | 72% | 0.723 | S | S | * | * | | | trans | -68.5 | 126.1 | 159.1 | -63 | -79.8 | 0 | 0 | 0 | 106.8 | G87 L91 | G87-F89 PolarHBondContact O-N 3.1Å; F89-L91 PolarHBondContact O-N 2.98Å |
| 90 | P | 51 | Low | 51.5 | Low | 104 Ų | 104 | 127.1 Ų | 127.1 | 68% | 0.675 | 73% | 0.725 | S | S | * | * | | | trans | -59 | 114.5 | 173.1 | 21.7 | -28.4 | 0 | 0 | 0 | 107 | R92 | P90-R92 PolarHBondContact O-N 3.45Š|
| 91 | L | 55.6 | Low | 51.3 | Low | 160 Ų | 160 | 126.3 Ų | 126.3 | 84% | 0.838 | 72% | 0.72 | S | S | * | * | | | trans | -54.6 | 98.1 | 163.4 | -85.1 | 154.1 | 0 | 0 | 0 | 105.3 | F89 S93 | F89-L91 PolarHBondContact O-N 2.98Å; L91-S93 PolarHBondContact O-N 2.9Å |
| 92 | R | 51.8 | Low | 51.5 | Low | 238 Ų | 238 | 128.8 Ų | 128.8 | 90% | 0.898 | 72% | 0.723 | S | S | * | * | | | trans | -49 | 120.2 | 168.5 | -105.2 | -175.4 | 166.6 | -159.2 | -3.3 | 105.5 | P90 | P90-R92 PolarHBondContact O-N 3.45Š|
| 93 | S | 51.4 | Low | 51.6 | Low | 109 Ų | 109 | 132.7 Ų | 132.7 | 76% | 0.762 | 73% | 0.732 | S | S | * | * | | | trans | -42 | 126.2 | 175.8 | -53.5 | 0 | 0 | 0 | 0 | 109.1 | L91 D95 | L91-S93 PolarHBondContact O-N 2.9Å; S93-D95 VanDerWaalsContact O-N 3.08Å; S93-D95 PolarHBondContact O-N 3.46Å |
| 94 | P | 51.2 | Low | 51.4 | Low | 116 Ų | 116 | 130.2 Ų | 130.2 | 75% | 0.753 | 73% | 0.728 | S | S | * | * | | | trans | -63.7 | 119 | 178 | 24.4 | -29.8 | 0 | 0 | 0 | 107.8 | | |
| 95 | D | 49.1 | Very low | 50.9 | Low | 123 Ų | 123 | 129 Ų | 129 | 66% | 0.658 | 73% | 0.729 | S | S | * | * | | | trans | -59.3 | 123.7 | 173.7 | -160.5 | -32.6 | 0 | 0 | 0 | 108.4 | S93 Y97 G98 | S93-D95 VanDerWaalsContact O-N 3.08Å; S93-D95 PolarHBondContact O-N 3.46Å; D95-Y97 PolarHBondContact O-N 2.89Å; D95-G98 PolarHBondContact O-N 2.84Å |
| 96 | P | 53.4 | Low | 50.9 | Low | 109 Ų | 109 | 131 Ų | 131 | 71% | 0.708 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | -5.3 | -170 | 22.2 | -32.3 | 0 | 0 | 0 | 115.1 | | |
| 97 | Y | 55.8 | Low | 50.9 | Low | 219 Ų | 219 | 131.8 Ų | 131.8 | 86% | 0.859 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.1 | 10.6 | -177.6 | -64.6 | -78 | 0 | 0 | 0 | 115.1 | D95 | D95-Y97 PolarHBondContact O-N 2.89Š|
| 98 | G | 48.3 | Very low | 50.7 | Low | 38 Ų | 38 | 134.1 Ų | 134.1 | 39% | 0.392 | 73% | 0.734 | S | S | . | * | S | Bend | trans | -89.5 | 141.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112 | D95 I100 | D95-G98 PolarHBondContact O-N 2.84Å; G98-I100 PolarHBondContact O-N 2.78Å |
| 99 | P | 45.2 | Very low | 50.8 | Low | 124 Ų | 124 | 133.8 Ų | 133.8 | 81% | 0.805 | 74% | 0.742 | S | S | * | * | | | trans | -60.9 | 114.6 | 169.1 | 25.6 | -31.2 | 0 | 0 | 0 | 108.2 | S101 | P99-S101 VanDerWaalsContact C-N 3.26Å; P99-S101 PolarHBondContact O-N 3.01Å |
| 100 | I | 53.6 | Low | 50.6 | Low | 152 Ų | 152 | 136.1 Ų | 136.1 | 78% | 0.779 | 75% | 0.746 | S | S | * | * | | | trans | -67.3 | 90.4 | 177.2 | -48.9 | 168.3 | 0 | 0 | 0 | 106.6 | G98 P102 | G98-I100 PolarHBondContact O-N 2.78Å; I100-P102 WeakPolarHBondContact O-CD 3.13Å |
| 101 | S | 47.1 | Very low | 50.9 | Low | 94 Ų | 94 | 137.6 Ų | 137.6 | 66% | 0.657 | 75% | 0.753 | S | S | * | * | | | trans | -68.8 | 118.2 | 166.4 | -74 | 0 | 0 | 0 | 0 | 107.6 | P99 R103 | P99-S101 VanDerWaalsContact C-N 3.26Å; P99-S101 PolarHBondContact O-N 3.01Å; S101-R103 VanDerWaalsContact C-N 3.26Å; S101-R103 PolarHBondContact O-N 3.15Å |
| 102 | P | 52.1 | Low | 50.9 | Low | 125 Ų | 125 | 136.5 Ų | 136.5 | 81% | 0.812 | 75% | 0.748 | S | S | * | * | | | trans | -82.5 | 81.2 | 176.1 | 33.6 | -28.7 | 0 | 0 | 0 | 107 | I100 | I100-P102 WeakPolarHBondContact O-CD 3.13Š|
| 103 | R | 53.6 | Low | 50.4 | Low | 247 Ų | 247 | 133.9 Ų | 133.9 | 93% | 0.932 | 75% | 0.746 | S | S | * | * | | | trans | -131.8 | 86.2 | 170.3 | -89.4 | -167.9 | 153.7 | -143.2 | -4.3 | 110.6 | S101 | S101-R103 VanDerWaalsContact C-N 3.26Å; S101-R103 PolarHBondContact O-N 3.15Å |
| 104 | G | 49.6 | Very low | 50.6 | Low | 68 Ų | 68 | 131.8 Ų | 131.8 | 70% | 0.701 | 74% | 0.742 | S | S | * | * | | | trans | 178 | 54 | 167.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 105 | S | 42.5 | Very low | 50.3 | Low | 84 Ų | 84 | 138.3 Ų | 138.3 | 59% | 0.587 | 77% | 0.769 | S | S | * | * | | | trans | -57.1 | 129.6 | 167.6 | -176.4 | 0 | 0 | 0 | 0 | 108.4 | F107 | S105-F107 PolarHBondContact O-N 2.78Å; S105-F107 WeakPolarHBondContact OG-CD2 3.38Å |
| 106 | P | 49.9 | Very low | 50.4 | Low | 121 Ų | 121 | 139.1 Ų | 139.1 | 79% | 0.786 | 77% | 0.774 | S | S | * | * | | | trans | -80.9 | 4.5 | 179.7 | 33.5 | -34.3 | 0 | 0 | 0 | 112.5 | | |
| 107 | F | 45.6 | Very low | 50.2 | Low | 159 Ų | 159 | 140.6 Ų | 140.6 | 70% | 0.697 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -72.2 | 134.6 | 175.1 | -62.2 | -63.5 | 0 | 0 | 0 | 109.6 | S105 V109 | S105-F107 PolarHBondContact O-N 2.78Å; S105-F107 WeakPolarHBondContact OG-CD2 3.38Å; F107-V109 PolarHBondContact O-N 3.14Å |
| 108 | P | 48.6 | Very low | 49.9 | Very low | 114 Ų | 114 | 136.3 Ų | 136.3 | 74% | 0.74 | 77% | 0.773 | S | S | * | * | | | trans | -59.7 | 118.7 | 163.3 | 26.1 | -30.5 | 0 | 0 | 0 | 106.7 | R110 | P108-R110 VanDerWaalsContact C-N 3.28Å; P108-R110 PolarHBondContact O-N 2.93Å |
| 109 | V | 53.4 | Low | 50 | Low | 126 Ų | 126 | 142.1 Ų | 142.1 | 76% | 0.764 | 80% | 0.796 | S | S | * | * | | | trans | -61.8 | 101.3 | 164.2 | -179.1 | 0 | 0 | 0 | 0 | 105.1 | F107 V111 | F107-V109 PolarHBondContact O-N 3.14Å; V109-V111 VanDerWaalsContact C-N 3.29Å; V109-V111 HydrophobicContact CG1-CG2 4.08Å; V109-V111 PolarHBondContact O-N 3.26Å |
| 110 | R | 54.9 | Low | 50.3 | Low | 229 Ų | 229 | 143.2 Ų | 143.2 | 86% | 0.864 | 80% | 0.795 | S | S | * | * | | | trans | -61.4 | 103.7 | 156.8 | -84.9 | -173.9 | 167 | 165.9 | -3.5 | 105.2 | P108 D112 | P108-R110 VanDerWaalsContact C-N 3.28Å; P108-R110 PolarHBondContact O-N 2.93Å; R110-D112 PolarHBondContact O-N 3.27Å |
| 111 | V | 55.6 | Low | 50.1 | Low | 135 Ų | 135 | 142.6 Ų | 142.6 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | | | trans | -73.5 | 78.4 | 154.8 | -178.4 | 0 | 0 | 0 | 0 | 105 | V109 | V109-V111 VanDerWaalsContact C-N 3.29Å; V109-V111 HydrophobicContact CG1-CG2 4.08Å; V109-V111 PolarHBondContact O-N 3.26Å |
| 112 | D | 56 | Low | 50.3 | Low | 136 Ų | 136 | 146.1 Ų | 146.1 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | | | trans | -96.4 | 97.9 | 157.5 | -168.7 | -85.7 | 0 | 0 | 0 | 105.3 | R110 | R110-D112 PolarHBondContact O-N 3.27Š|
| 113 | Q | 42 | Very low | 50.2 | Low | 183 Ų | 183 | 147.7 Ų | 147.7 | 86% | 0.855 | 81% | 0.806 | S | S | * | * | | | trans | -143.2 | 96.7 | 147 | -70.9 | -162.6 | 3.4 | 0 | 0 | 106.7 | | |
| 114 | G | 54.9 | Low | 49.9 | Very low | 66 Ų | 66 | 139.4 Ų | 139.4 | 68% | 0.68 | 80% | 0.795 | S | S | * | * | | | trans | -68.1 | 137.8 | 152.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 115 | L | 45.4 | Very low | 49.9 | Very low | 252 Ų | 252 | 145.9 Ų | 145.9 | 100% | 1.319 | 80% | 0.804 | S | S | * | * | | | | -166.9 | 0 | 127.7 | -103 | 161.3 | 0 | 0 | 0 | 108.2 | | |