| 1 | M | 40.4 | Very low | 41.4 | Very low | 228 Ų | 228 | 159.9 Ų | 159.9 | 100% | 1.123 | 85% | 0.845 | S | S | * | * | | | | 0 | 147.3 | 0 | -63.5 | 172.3 | -144.6 | 0 | 0 | 108 | | |
| 2 | K | 43.3 | Very low | 40.8 | Very low | 190 Ų | 190 | 151.5 Ų | 151.5 | 83% | 0.826 | 83% | 0.825 | S | S | * | * | | | trans | -94 | 132.8 | 174 | -61.6 | 175.1 | -179.6 | 178.4 | 0 | 108.1 | L4 | K2-L4 HydrophobicContact CB-CD1 4.36Š|
| 3 | F | 43.4 | Very low | 40.8 | Very low | 200 Ų | 200 | 159.6 Ų | 159.6 | 88% | 0.877 | 84% | 0.836 | S | S | * | * | | | trans | -121.3 | 129.5 | 157.4 | -80.7 | -75.9 | 0 | 0 | 0 | 108.2 | | |
| 4 | L | 43.2 | Very low | 40.4 | Very low | 155 Ų | 155 | 154.4 Ų | 154.4 | 81% | 0.812 | 84% | 0.841 | S | S | * | * | | | trans | -92.4 | 143.3 | -176.8 | -84.6 | 63.1 | 0 | 0 | 0 | 110 | K2 | K2-L4 HydrophobicContact CB-CD1 4.36Š|
| 5 | G | 35.4 | Very low | 39.8 | Very low | 83 Ų | 83 | 149.3 Ų | 149.3 | 86% | 0.856 | 84% | 0.838 | S | S | * | * | | | trans | 86.5 | 142.3 | 137 | 0 | 0 | 0 | 0 | 0 | 118.1 | | |
| 6 | G | 35.8 | Very low | 40.1 | Very low | 72 Ų | 72 | 149.9 Ų | 149.9 | 74% | 0.742 | 85% | 0.846 | S | S | * | * | | | trans | 121.5 | 66.5 | 159.3 | 0 | 0 | 0 | 0 | 0 | 116.5 | | |
| 7 | N | 38.7 | Very low | 39.5 | Very low | 143 Ų | 143 | 145.4 Ų | 145.4 | 77% | 0.765 | 84% | 0.84 | S | S | * | * | | | trans | 31.1 | 138.4 | 134.1 | -85.9 | 56.6 | 0 | 0 | 0 | 123.7 | | |
| 8 | D | 41.8 | Very low | 39.4 | Very low | 133 Ų | 133 | 145.7 Ų | 145.7 | 71% | 0.711 | 84% | 0.844 | S | S | * | * | | | trans | 81.7 | 155.2 | 141.4 | -71.4 | -53.7 | 0 | 0 | 0 | 122 | | |
| 9 | D | 47.4 | Very low | 38.9 | Very low | 142 Ų | 142 | 141.3 Ų | 141.3 | 76% | 0.759 | 83% | 0.833 | S | S | * | * | | | trans | 64.4 | 77.7 | 165.5 | -61.7 | -33.4 | 0 | 0 | 0 | 119.6 | | |
| 10 | R | 47.5 | Very low | 38.7 | Very low | 246 Ų | 246 | 140.5 Ų | 140.5 | 93% | 0.928 | 83% | 0.83 | S | S | * | * | | | | 171.1 | 104.6 | 117.4 | -87.6 | 154.9 | -155.1 | 178.1 | 8.6 | 112.1 | | |
| 11 | N | 38.1 | Very low | 38.4 | Very low | 167 Ų | 167 | 141 Ų | 141 | 89% | 0.893 | 83% | 0.829 | S | S | * | * | | | trans | -146.2 | 70.9 | 138.2 | -156.8 | 16.4 | 0 | 0 | 0 | 111 | | |
| 12 | G | 34.3 | Very low | 37.9 | Very low | 59 Ų | 59 | 135.1 Ų | 135.1 | 61% | 0.608 | 82% | 0.817 | S | S | * | * | | | trans | -85.5 | 151.9 | 165.9 | 0 | 0 | 0 | 0 | 0 | 111 | | |
| 13 | R | 41.3 | Very low | 37.7 | Very low | 257 Ų | 257 | 134.1 Ų | 134.1 | 97% | 0.97 | 82% | 0.819 | S | S | * | * | | | trans | 89.9 | 117.5 | 167.8 | -53.3 | 172.8 | -179.8 | -178.7 | -0.5 | 117 | | |
| 14 | G | 34.8 | Very low | 37.1 | Very low | 87 Ų | 87 | 131.5 Ų | 131.5 | 90% | 0.897 | 82% | 0.819 | S | S | * | * | | | trans | 109.9 | 88.7 | 141.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 15 | G | 32.3 | Very low | 36.5 | Very low | 78 Ų | 78 | 127.5 Ų | 127.5 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | | | trans | -160.6 | 88.4 | 171 | 0 | 0 | 0 | 0 | 0 | 111.1 | G17 | G15-G17 PolarHBondContact O-N 3.11Š|
| 16 | V | 43.3 | Very low | 36.9 | Very low | 158 Ų | 158 | 129.3 Ų | 129.3 | 96% | 0.958 | 82% | 0.815 | S | S | * | * | | | trans | -75.6 | 120 | 171.3 | 179.1 | 0 | 0 | 0 | 0 | 107.7 | | |
| 17 | G | 31 | Very low | 37 | Very low | 73 Ų | 73 | 138 Ų | 138 | 75% | 0.753 | 83% | 0.825 | S | S | * | * | | | trans | -144.6 | 127.5 | -178.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | G15 | G15-G17 PolarHBondContact O-N 3.11Š|
| 18 | V | 37.1 | Very low | 36.9 | Very low | 151 Ų | 151 | 135.3 Ų | 135.3 | 92% | 0.915 | 83% | 0.831 | S | S | * | * | | | trans | -96.6 | 130.6 | 178.8 | -178.4 | 0 | 0 | 0 | 0 | 108.6 | | |
| 19 | G | 30.5 | Very low | 36.6 | Very low | 62 Ų | 62 | 130.9 Ų | 130.9 | 64% | 0.639 | 82% | 0.818 | S | S | * | * | | | trans | 128.3 | 114.3 | 165.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | | |
| 20 | T | 35.3 | Very low | 36.5 | Very low | 125 Ų | 125 | 131.2 Ų | 131.2 | 77% | 0.767 | 82% | 0.824 | S | S | * | * | | | trans | 43.9 | 117 | 133.5 | -39.4 | 0 | 0 | 0 | 0 | 120.3 | | |
| 21 | D | 32.1 | Very low | 36.2 | Very low | 152 Ų | 152 | 123.7 Ų | 123.7 | 81% | 0.813 | 81% | 0.81 | S | S | * | * | | | trans | 53.2 | 98.3 | 150.3 | -53.2 | -15.9 | 0 | 0 | 0 | 120.3 | | |
| 22 | A | 28.6 | Very low | 36.3 | Very low | 105 Ų | 105 | 122.1 Ų | 122.1 | 87% | 0.868 | 80% | 0.797 | S | S | * | * | | | trans | -163.2 | 141.6 | 131.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | | |
| 23 | I | 38.9 | Very low | 36.5 | Very low | 168 Ų | 168 | 125.2 Ų | 125.2 | 86% | 0.862 | 80% | 0.799 | S | S | * | * | | | trans | -78.5 | 137.2 | 176.6 | -64.8 | 156.2 | 0 | 0 | 0 | 110.4 | | |
| 24 | V | 32.7 | Very low | 36.3 | Very low | 145 Ų | 145 | 116.4 Ų | 116.4 | 88% | 0.879 | 78% | 0.782 | S | S | * | * | | | trans | 169.4 | 135.7 | 139.9 | 148.9 | 0 | 0 | 0 | 0 | 109.8 | | |
| 25 | G | 30.2 | Very low | 36.5 | Very low | 71 Ų | 71 | 115.3 Ų | 115.3 | 73% | 0.732 | 76% | 0.764 | S | S | * | * | | | trans | 137.4 | 54.1 | 160.6 | 0 | 0 | 0 | 0 | 0 | 117.9 | R27 | G25-R27 PolarHBondContact O-N 3.41Š|
| 26 | S | 43.1 | Very low | 36.9 | Very low | 122 Ų | 122 | 117.2 Ų | 117.2 | 85% | 0.853 | 76% | 0.756 | S | S | * | * | | | trans | -55.6 | 132.2 | 177.9 | -43.1 | 0 | 0 | 0 | 0 | 114 | | |
| 27 | R | 39 | Very low | 36.8 | Very low | 253 Ų | 253 | 112.6 Ų | 112.6 | 96% | 0.955 | 74% | 0.735 | S | S | * | * | | | trans | -164.7 | 98.8 | 151.2 | -106.1 | 166.7 | -151.1 | -162.9 | 6.9 | 111.7 | G25 | G25-R27 PolarHBondContact O-N 3.41Š|
| 28 | G | 36 | Very low | 37.2 | Very low | 87 Ų | 87 | 111.9 Ų | 111.9 | 90% | 0.897 | 72% | 0.722 | S | S | * | * | S | Bend | trans | 97.2 | 102.8 | 162.5 | 0 | 0 | 0 | 0 | 0 | 116 | | |
| 29 | G | 35.5 | Very low | 37.3 | Very low | 41 Ų | 41 | 106.8 Ų | 106.8 | 42% | 0.423 | 70% | 0.7 | S | S | . | * | | | trans | 158.3 | 64.6 | 171.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | S31 Q32 | G29-S31 PolarHBondContact O-N 3.3Å; G29-Q32 PolarHBondContact O-N 3.43Å |
| 30 | V | 44.7 | Very low | 37.8 | Very low | 148 Ų | 148 | 107 Ų | 107 | 90% | 0.897 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.9 | 40.2 | 173.4 | -73 | 0 | 0 | 0 | 0 | 113.1 | | |
| 31 | S | 41.7 | Very low | 38.1 | Very low | 89 Ų | 89 | 104 Ų | 104 | 62% | 0.622 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -146.7 | -14.1 | -172.6 | -53.3 | 0 | 0 | 0 | 0 | 113.9 | G29 | G29-S31 PolarHBondContact O-N 3.3Š|
| 32 | Q | 39.4 | Very low | 38.4 | Very low | 133 Ų | 133 | 99.5 Ų | 99.5 | 62% | 0.621 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -48.3 | 170.5 | -113.1 | 87.4 | 7.5 | 0 | 0 | 111.3 | G29 A34 A35 D36 | G29-Q32 PolarHBondContact O-N 3.43Å; Q32-A34 PolarHBondContact O-N 2.96Å; Q32-A34 VanDerWaalsContact O-N 3.11Å; Q32-A35 WeakPolarHBondContact O-CB 3.35Å; Q32-A35 PolarHBondContact O-N 3.47Å; Q32-D36 PolarHBondContact O-N 3Å |
| 33 | D | 38.3 | Very low | 38.8 | Very low | 124 Ų | 124 | 97.9 Ų | 97.9 | 66% | 0.663 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -58.9 | -31.5 | -173 | -58 | -65.1 | 0 | 0 | 0 | 113.6 | A37 | D33-A37 WeakPolarHBondContact O-CB 3.48Å; D33-A37 PolarHBondContact O-N 3.11Å |
| 34 | A | 38.8 | Very low | 39 | Very low | 73 Ų | 73 | 94 Ų | 94 | 60% | 0.603 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -71 | -28.7 | 177 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q32 A38 | Q32-A34 PolarHBondContact O-N 2.96Å; Q32-A34 VanDerWaalsContact O-N 3.11Å; A34-A38 WeakPolarHBondContact O-CB 3.3Å; A34-A38 PolarHBondContact O-N 3.39Å |
| 35 | A | 39.1 | Very low | 39.3 | Very low | 64 Ų | 64 | 91.2 Ų | 91.2 | 53% | 0.529 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -79.1 | -43.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q32 A38 G39 | Q32-A35 WeakPolarHBondContact O-CB 3.35Å; Q32-A35 PolarHBondContact O-N 3.47Å; A35-A38 PolarHBondContact O-N 2.79Å; A35-G39 PolarHBondContact O-N 3.27Å |
| 36 | D | 40 | Very low | 39.7 | Very low | 118 Ų | 118 | 92.3 Ų | 92.3 | 63% | 0.631 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -70.2 | -35.9 | 176.8 | -72.4 | -41.6 | 0 | 0 | 0 | 112 | Q32 A38 G39 A40 | Q32-D36 PolarHBondContact O-N 3Å; D36-A38 VanDerWaalsContact C-N 3.35Å; D36-A38 PolarHBondContact O-N 3.23Å; D36-G39 PolarHBondContact O-N 2.66Å; D36-A40 WeakPolarHBondContact O-CB 3.47Å; D36-A40 PolarHBondContact O-N 3.03Å |
| 37 | A | 39.9 | Very low | 39.3 | Very low | 61 Ų | 61 | 90 Ų | 90 | 50% | 0.504 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -63.6 | -38.1 | 170.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | D33 A41 | D33-A37 WeakPolarHBondContact O-CB 3.48Å; D33-A37 PolarHBondContact O-N 3.11Å; A37-A41 VanDerWaalsContact O-CB 3.3Å; A37-A41 WeakPolarHBondContact O-CB 3.49Å; A37-A41 PolarHBondContact O-N 2.84Å |
| 38 | A | 39.6 | Very low | 38.9 | Very low | 58 Ų | 58 | 87.3 Ų | 87.3 | 48% | 0.479 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -68.2 | -37.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | A34 A35 D36 A41 A42 | A34-A38 WeakPolarHBondContact O-CB 3.3Å; A34-A38 PolarHBondContact O-N 3.39Å; A35-A38 PolarHBondContact O-N 2.79Å; D36-A38 VanDerWaalsContact C-N 3.35Å; D36-A38 PolarHBondContact O-N 3.23Å; A38-A41 PolarHBondContact O-N 3.34Å; A38-A42 VanDerWaalsContact O-CB 3.31Å; A38-A42 WeakPolarHBondContact O-CB 3.15Å; A38-A42 PolarHBondContact O-N 3.08Å |
| 39 | G | 40.7 | Very low | 38.9 | Very low | 44 Ų | 44 | 89.2 Ų | 89.2 | 45% | 0.454 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -63.5 | -45 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | A35 D36 A42 A43 | A35-G39 PolarHBondContact O-N 3.27Å; D36-G39 PolarHBondContact O-N 2.66Å; G39-A42 PolarHBondContact O-N 3.47Å; G39-A43 PolarHBondContact O-N 3.17Å |
| 40 | A | 41.4 | Very low | 38.6 | Very low | 66 Ų | 66 | 96 Ų | 96 | 55% | 0.545 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -65.6 | -40.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | D36 A43 A44 | D36-A40 WeakPolarHBondContact O-CB 3.47Å; D36-A40 PolarHBondContact O-N 3.03Å; A40-A43 PolarHBondContact O-N 2.84Å; A40-A44 PolarHBondContact O-N 3.36Å; A40-A44 VanDerWaalsContact O-N 3.12Å |
| 41 | A | 39.8 | Very low | 37.9 | Very low | 61 Ų | 61 | 97.5 Ų | 97.5 | 50% | 0.504 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -67.2 | -37.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | A37 A38 A43 A44 A45 | A37-A41 VanDerWaalsContact O-CB 3.3Å; A37-A41 WeakPolarHBondContact O-CB 3.49Å; A37-A41 PolarHBondContact O-N 2.84Å; A38-A41 PolarHBondContact O-N 3.34Å; A41-A43 VanDerWaalsContact C-N 3.34Å; A41-A44 PolarHBondContact O-N 2.78Å; A41-A45 PolarHBondContact O-N 3.08Å; A41-A45 VanDerWaalsContact O-N 3.11Å |
| 42 | A | 38.3 | Very low | 37.4 | Very low | 58 Ų | 58 | 102 Ų | 102 | 48% | 0.479 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -65.9 | -35.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A38 G39 A44 A45 V46 | A38-A42 VanDerWaalsContact O-CB 3.31Å; A38-A42 WeakPolarHBondContact O-CB 3.15Å; A38-A42 PolarHBondContact O-N 3.08Å; G39-A42 PolarHBondContact O-N 3.47Å; A42-A44 VanDerWaalsContact C-N 3.34Å; A42-A45 PolarHBondContact O-N 3.47Å; A42-V46 PolarHBondContact O-N 3.5Å |
| 43 | A | 38.8 | Very low | 36.9 | Very low | 71 Ų | 71 | 106.7 Ų | 106.7 | 59% | 0.587 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -67.7 | -31.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | G39 A40 A41 A45 | G39-A43 PolarHBondContact O-N 3.17Å; A40-A43 PolarHBondContact O-N 2.84Å; A41-A43 VanDerWaalsContact C-N 3.34Å; A43-A45 VanDerWaalsContact C-N 3.35Å |
| 44 | A | 41.8 | Very low | 36.8 | Very low | 88 Ų | 88 | 107 Ų | 107 | 73% | 0.727 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -73.7 | -23.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | A40 A41 A42 | A40-A44 PolarHBondContact O-N 3.36Å; A40-A44 VanDerWaalsContact O-N 3.12Å; A41-A44 PolarHBondContact O-N 2.78Å; A42-A44 VanDerWaalsContact C-N 3.34Å |
| 45 | A | 39.9 | Very low | 36.4 | Very low | 85 Ų | 85 | 108.9 Ų | 108.9 | 70% | 0.702 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -83.1 | -17 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | A41 A42 A43 | A41-A45 PolarHBondContact O-N 3.08Å; A41-A45 VanDerWaalsContact O-N 3.11Å; A42-A45 PolarHBondContact O-N 3.47Å; A43-A45 VanDerWaalsContact C-N 3.35Å |
| 46 | V | 38.9 | Very low | 36.3 | Very low | 94 Ų | 94 | 112.1 Ų | 112.1 | 57% | 0.57 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -101.9 | 91.1 | 174.8 | -178 | 0 | 0 | 0 | 0 | 108.8 | A42 Y48 | A42-V46 PolarHBondContact O-N 3.5Å; V46-Y48 VanDerWaalsContact C-N 3.26Å; V46-Y48 HydrophobicContact CG1-CD2 3.98Å; V46-Y48 HydrophobicContact CG1-CE2 4.48Å; V46-Y48 PolarHBondContact O-N 3.28Å |
| 47 | G | 34.1 | Very low | 36 | Very low | 74 Ų | 74 | 110.4 Ų | 110.4 | 76% | 0.763 | 69% | 0.694 | S | S | * | * | | | trans | -68.2 | 70.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | | |
| 48 | Y | 30.1 | Very low | 35.6 | Very low | 196 Ų | 196 | 111.3 Ų | 111.3 | 77% | 0.769 | 71% | 0.709 | S | S | * | * | | | trans | -96.3 | 99.4 | 154.9 | -83.8 | -75.5 | 0 | 0 | 0 | 109.2 | V46 F50 | V46-Y48 VanDerWaalsContact C-N 3.26Å; V46-Y48 HydrophobicContact CG1-CD2 3.98Å; V46-Y48 HydrophobicContact CG1-CE2 4.48Å; V46-Y48 PolarHBondContact O-N 3.28Å; Y48-F50 VanDerWaalsContact C-N 3.26Å; Y48-F50 PolarHBondContact O-N 3.47Å |
| 49 | V | 35.3 | Very low | 35.4 | Very low | 128 Ų | 128 | 115.4 Ų | 115.4 | 78% | 0.776 | 73% | 0.727 | S | S | * | * | | | trans | -66.1 | 88.6 | 168.5 | -179.8 | 0 | 0 | 0 | 0 | 108.6 | Q51 | V49-Q51 VanDerWaalsContact C-N 3.33Å; V49-Q51 HydrophobicContact CG1-CG 4.12Å; V49-Q51 PolarHBondContact O-N 3.47Å |
| 50 | F | 30 | Very low | 34.9 | Very low | 183 Ų | 183 | 116.9 Ų | 116.9 | 80% | 0.803 | 74% | 0.743 | S | S | * | * | | | trans | -65.1 | 101.7 | 154.2 | -85.1 | -83.5 | 0 | 0 | 0 | 107.1 | Y48 Q52 | Y48-F50 VanDerWaalsContact C-N 3.26Å; Y48-F50 PolarHBondContact O-N 3.47Å; F50-Q52 PolarHBondContact O-N 3.45Å |
| 51 | Q | 30.7 | Very low | 34.4 | Very low | 179 Ų | 179 | 120.1 Ų | 120.1 | 84% | 0.836 | 76% | 0.756 | S | S | * | * | | | trans | -61.9 | 88.6 | 165.3 | -75.3 | -174.2 | 78.6 | 0 | 0 | 108.5 | V49 R53 | V49-Q51 VanDerWaalsContact C-N 3.33Å; V49-Q51 HydrophobicContact CG1-CG 4.12Å; V49-Q51 PolarHBondContact O-N 3.47Å; Q51-R53 PolarHBondContact O-N 3.49Å |
| 52 | Q | 31.6 | Very low | 33.9 | Very low | 183 Ų | 183 | 120.5 Ų | 120.5 | 86% | 0.855 | 77% | 0.766 | S | S | * | * | | | trans | -63.5 | 102.1 | 164 | -74.8 | -172.7 | -5.3 | 0 | 0 | 107.3 | F50 P54 | F50-Q52 PolarHBondContact O-N 3.45Å; Q52-P54 WeakPolarHBondContact O-CD 3.47Å |
| 53 | R | 28.9 | Very low | 33.6 | Very low | 233 Ų | 233 | 124.7 Ų | 124.7 | 88% | 0.879 | 79% | 0.785 | S | S | * | * | | | trans | -52 | 124.9 | 166.5 | -89.9 | -177.9 | 161.3 | -143.5 | -1.4 | 108.6 | Q51 S55 | Q51-R53 PolarHBondContact O-N 3.49Å; R53-S55 PolarHBondContact O-N 3.3Å; R53-S55 VanDerWaalsContact O-N 3.11Å |
| 54 | P | 35.6 | Very low | 33.2 | Very low | 129 Ų | 129 | 125.1 Ų | 125.1 | 84% | 0.838 | 80% | 0.796 | S | S | * | * | | | trans | -62.9 | 114.1 | 162.8 | -17.4 | 31.4 | 0 | 0 | 0 | 108.2 | Q52 | Q52-P54 WeakPolarHBondContact O-CD 3.47Š|
| 55 | S | 29.3 | Very low | 32.6 | Very low | 114 Ų | 114 | 124.2 Ų | 124.2 | 80% | 0.797 | 80% | 0.796 | S | S | * | * | | | trans | -90.8 | 122.9 | 170.7 | -156.9 | 0 | 0 | 0 | 0 | 108.4 | R53 G57 | R53-S55 PolarHBondContact O-N 3.3Å; R53-S55 VanDerWaalsContact O-N 3.11Å; S55-G57 PolarHBondContact O-N 2.94Å |
| 56 | P | 38 | Very low | 32.4 | Very low | 132 Ų | 132 | 127.8 Ų | 127.8 | 86% | 0.857 | 81% | 0.808 | S | S | * | * | | | trans | -78.3 | 122.8 | -175.6 | -9.9 | 26 | 0 | 0 | 0 | 111.8 | | |
| 57 | G | 32.9 | Very low | 32 | Very low | 82 Ų | 82 | 127 Ų | 127 | 85% | 0.845 | 82% | 0.819 | S | S | * | * | | | trans | 169.6 | 114.8 | 168.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | S55 | S55-G57 PolarHBondContact O-N 2.94Š|
| 58 | G | 32.7 | Very low | 31.9 | Very low | 79 Ų | 79 | 127.7 Ų | 127.7 | 81% | 0.814 | 83% | 0.826 | S | S | * | * | | | trans | 148.6 | 48.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | G60 | G58-G60 PolarHBondContact O-N 2.95Š|
| 59 | V | 35.1 | Very low | 31.9 | Very low | 144 Ų | 144 | 121.8 Ų | 121.8 | 87% | 0.873 | 83% | 0.825 | S | S | * | * | | | trans | -83.7 | 107.6 | 169.9 | -175.9 | 0 | 0 | 0 | 0 | 108.7 | V61 | V59-V61 HydrophobicContact CG1-CG2 4.24Š|
| 60 | G | 29.8 | Very low | 31.9 | Very low | 76 Ų | 76 | 122.4 Ų | 122.4 | 78% | 0.784 | 83% | 0.829 | S | S | * | * | | | trans | -126.1 | 111.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | G58 | G58-G60 PolarHBondContact O-N 2.95Š|
| 61 | V | 31.9 | Very low | 32.3 | Very low | 134 Ų | 134 | 119.1 Ų | 119.1 | 81% | 0.812 | 83% | 0.826 | S | S | * | * | | | trans | -101.8 | 125.5 | -172.6 | 172.4 | 0 | 0 | 0 | 0 | 111.6 | V59 | V59-V61 HydrophobicContact CG1-CG2 4.24Š|
| 62 | G | 28.8 | Very low | 32.6 | Very low | 69 Ų | 69 | 114.3 Ų | 114.3 | 71% | 0.711 | 82% | 0.824 | S | S | * | * | | | trans | 75.5 | 171.3 | 158.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | | |
| 63 | V | 32.5 | Very low | 32.8 | Very low | 145 Ų | 145 | 112.6 Ų | 112.6 | 88% | 0.879 | 83% | 0.826 | S | S | * | * | | | cis | -149.9 | 129.9 | -4.2 | 171.7 | 0 | 0 | 0 | 0 | 108.5 | | |
| 64 | G | 29.1 | Very low | 33 | Very low | 81 Ų | 81 | 104.6 Ų | 104.6 | 84% | 0.835 | 82% | 0.816 | S | S | * | * | | | trans | 68.5 | 151.5 | 166.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | | |
| 65 | G | 29.6 | Very low | 32.9 | Very low | 69 Ų | 69 | 102.6 Ų | 102.6 | 71% | 0.711 | 81% | 0.811 | S | S | * | * | | | cis | 173 | 143.3 | -5.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 66 | V | 35 | Very low | 33.6 | Very low | 160 Ų | 160 | 104.4 Ų | 104.4 | 97% | 0.97 | 82% | 0.817 | S | S | * | * | | | trans | 69.6 | 105.6 | 173.7 | -165.1 | 0 | 0 | 0 | 0 | 116.9 | | |
| 67 | G | 30.5 | Very low | 33.7 | Very low | 77 Ų | 77 | 101.7 Ų | 101.7 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | | | trans | 125.7 | 72.8 | 135.5 | 0 | 0 | 0 | 0 | 0 | 120.3 | | |
| 68 | G | 32.3 | Very low | 33.6 | Very low | 89 Ų | 89 | 102.9 Ų | 102.9 | 92% | 0.918 | 81% | 0.808 | S | S | * | * | | | trans | 93.6 | 117.2 | 143.7 | 0 | 0 | 0 | 0 | 0 | 118.6 | | |
| 69 | G | 29.8 | Very low | 34.1 | Very low | 72 Ų | 72 | 104.2 Ų | 104.2 | 74% | 0.742 | 80% | 0.8 | S | S | * | * | | | trans | 135.6 | 113.3 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | | |
| 70 | V | 35.7 | Very low | 34.3 | Very low | 141 Ų | 141 | 105.4 Ų | 105.4 | 86% | 0.855 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 125.2 | -172.4 | -179 | 0 | 0 | 0 | 0 | 112.4 | | |
| 71 | P | 37.5 | Very low | 34.8 | Very low | 113 Ų | 113 | 109.8 Ų | 109.8 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -73 | 149.4 | 170.1 | -11.9 | 27.8 | 0 | 0 | 0 | 111.7 | | |
| 72 | G | 37.5 | Very low | 35.1 | Very low | 78 Ų | 78 | 111.3 Ų | 111.3 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 141 | -178 | 0 | 0 | 0 | 0 | 0 | 114.1 | G74 | G72-G74 PolarHBondContact O-N 3.21Š|
| 73 | V | 36.4 | Very low | 35.5 | Very low | 147 Ų | 147 | 110.9 Ų | 110.9 | 89% | 0.891 | 79% | 0.789 | S | S | * | * | | | trans | -76.7 | 87.7 | 172.8 | -178.6 | 0 | 0 | 0 | 0 | 109.4 | | |
| 74 | G | 32.7 | Very low | 35.8 | Very low | 65 Ų | 65 | 107 Ų | 107 | 67% | 0.67 | 77% | 0.771 | S | S | * | * | | | trans | -81.9 | 142.5 | 154.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | G72 | G72-G74 PolarHBondContact O-N 3.21Š|
| 75 | A | 34 | Very low | 36.2 | Very low | 88 Ų | 88 | 106.4 Ų | 106.4 | 73% | 0.727 | 76% | 0.759 | S | S | * | * | S | Bend | trans | 75.5 | 114.8 | 168.6 | 0 | 0 | 0 | 0 | 0 | 119.2 | | |
| 76 | V | 44.4 | Very low | 36.8 | Very low | 152 Ų | 152 | 106.2 Ų | 106.2 | 92% | 0.921 | 75% | 0.751 | S | S | * | * | | | | 46.2 | 104.2 | 127.6 | -170.2 | 0 | 0 | 0 | 0 | 117.9 | | |
| 77 | G | 38.8 | Very low | 37.2 | Very low | 75 Ų | 75 | 105.4 Ų | 105.4 | 77% | 0.773 | 74% | 0.736 | S | S | * | * | | | trans | 118.5 | 59.6 | 135.1 | 0 | 0 | 0 | 0 | 0 | 119.8 | | |
| 78 | S | 32.1 | Very low | 37.6 | Very low | 106 Ų | 106 | 109.7 Ų | 109.7 | 74% | 0.741 | 73% | 0.73 | S | S | * | * | | | trans | -177.3 | 145.1 | 157.4 | 50.3 | 0 | 0 | 0 | 0 | 110.7 | | |
| 79 | T | 42 | Very low | 38.1 | Very low | 108 Ų | 108 | 108.6 Ų | 108.6 | 66% | 0.663 | 71% | 0.712 | S | S | * | * | | | cis | -166.9 | 111.8 | -15.5 | 26.4 | 0 | 0 | 0 | 0 | 107.7 | H81 | T79-H81 PolarHBondContact O-N 3.4Š|
| 80 | L | 40.5 | Very low | 38.8 | Very low | 168 Ų | 168 | 108 Ų | 108 | 88% | 0.88 | 70% | 0.7 | S | S | * | * | S | Bend | trans | 43.2 | -4.1 | 149.7 | -73.7 | 157.3 | 0 | 0 | 0 | 123 | | |
| 81 | H | 39 | Very low | 39.1 | Very low | 169 Ų | 169 | 106.9 Ų | 106.9 | 78% | 0.782 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -97.7 | -28.4 | -169.3 | -142.7 | 83.2 | 0 | 0 | 0 | 113.5 | T79 | T79-H81 PolarHBondContact O-N 3.4Š|
| 82 | E | 39.6 | Very low | 39.5 | Very low | 166 Ų | 166 | 107.4 Ų | 107.4 | 78% | 0.776 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -85 | -20.5 | -179 | -70.3 | 155.8 | 145.1 | 0 | 0 | 112.8 | | |
| 83 | A | 35.8 | Very low | 39.9 | Very low | 60 Ų | 60 | 106.4 Ų | 106.4 | 50% | 0.496 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -65.7 | -40.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112.5 | A85 A86 E87 | A83-A85 VanDerWaalsContact C-N 3.3Å; A83-A85 PolarHBondContact O-N 3.49Å; A83-A86 PolarHBondContact O-N 3.12Å; A83-E87 PolarHBondContact O-N 2.91Å |
| 84 | A | 39.8 | Very low | 40.3 | Very low | 62 Ų | 62 | 104.7 Ų | 104.7 | 51% | 0.512 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -67.4 | -28.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y88 | A84-Y88 PolarHBondContact O-N 3.11Å |
| 85 | A | 38 | Very low | 40.8 | Very low | 70 Ų | 70 | 107.7 Ų | 107.7 | 58% | 0.579 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -71.3 | -35.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A83 A89 | A83-A85 VanDerWaalsContact C-N 3.3Å; A83-A85 PolarHBondContact O-N 3.49Å; A85-A89 PolarHBondContact O-N 3.35Å |
| 86 | A | 41.7 | Very low | 41.4 | Very low | 65 Ų | 65 | 109.8 Ų | 109.8 | 54% | 0.537 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -68.3 | -39.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | A83 Y88 A89 A90 | A83-A86 PolarHBondContact O-N 3.12Å; A86-Y88 VanDerWaalsContact C-N 3.35Å; A86-Y88 PolarHBondContact O-N 3.25Å; A86-A89 PolarHBondContact O-N 3.25Å; A86-A90 PolarHBondContact O-N 3.07Å |
| 87 | E | 43.9 | Very low | 41.6 | Very low | 142 Ų | 142 | 109.5 Ų | 109.5 | 66% | 0.664 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -64.4 | -37 | 178.9 | -69.1 | -179.3 | 165.5 | 0 | 0 | 112.5 | A83 A90 H91 | A83-E87 PolarHBondContact O-N 2.91Å; E87-A90 PolarHBondContact O-N 3.42Å; E87-H91 PolarHBondContact O-N 3.06Å; E87-H91 VanDerWaalsContact O-N 3.15Å |
| 88 | Y | 38.7 | Very low | 41.9 | Very low | 168 Ų | 168 | 112.1 Ų | 112.1 | 66% | 0.659 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -67.6 | -38.1 | 177.8 | -161.8 | -96.2 | 0 | 0 | 0 | 112.7 | A84 A86 H91 F92 | A84-Y88 PolarHBondContact O-N 3.11Å; A86-Y88 VanDerWaalsContact C-N 3.35Å; A86-Y88 PolarHBondContact O-N 3.25Å; Y88-H91 PolarHBondContact O-N 3.35Å; Y88-F92 HydrophobicContact CE1-CD2 4.29Å; Y88-F92 PolarHBondContact O-N 3.28Å |
| 89 | A | 43 | Very low | 42.5 | Very low | 65 Ų | 65 | 111 Ų | 111 | 54% | 0.537 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -65.9 | -41.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | A85 A86 H91 F92 A93 | A85-A89 PolarHBondContact O-N 3.35Å; A86-A89 PolarHBondContact O-N 3.25Å; A89-H91 PolarHBondContact O-N 3.39Å; A89-F92 PolarHBondContact O-N 3.36Å; A89-A93 PolarHBondContact O-N 3.41Å |
| 90 | A | 44.5 | Very low | 42.3 | Very low | 61 Ų | 61 | 116.1 Ų | 116.1 | 50% | 0.504 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -61.7 | -42.6 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | A86 E87 F92 A93 Q94 | A86-A90 PolarHBondContact O-N 3.07Å; E87-A90 PolarHBondContact O-N 3.42Å; A90-F92 VanDerWaalsContact C-N 3.31Å; A90-F92 PolarHBondContact O-N 2.77Å; A90-A93 PolarHBondContact O-N 3.45Å; A90-Q94 PolarHBondContact O-N 3.42Å |
| 91 | H | 40.8 | Very low | 42.3 | Very low | 117 Ų | 117 | 118.6 Ų | 118.6 | 54% | 0.542 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -66 | -31.2 | 179.8 | -125.7 | -60.4 | 0 | 0 | 0 | 113.3 | E87 Y88 A89 K95 | E87-H91 PolarHBondContact O-N 3.06Å; E87-H91 VanDerWaalsContact O-N 3.15Å; Y88-H91 PolarHBondContact O-N 3.35Å; A89-H91 PolarHBondContact O-N 3.39Å; H91-K95 PolarHBondContact O-N 2.99Å |
| 92 | F | 45.8 | Very low | 42.4 | Very low | 123 Ų | 123 | 114.2 Ų | 114.2 | 54% | 0.539 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -72.9 | -40.5 | 176.3 | -139.6 | -87.2 | 0 | 0 | 0 | 112.1 | Y88 A89 A90 Q94 K95 Q96 | Y88-F92 HydrophobicContact CE1-CD2 4.29Å; Y88-F92 PolarHBondContact O-N 3.28Å; A89-F92 PolarHBondContact O-N 3.36Å; A90-F92 VanDerWaalsContact C-N 3.31Å; A90-F92 PolarHBondContact O-N 2.77Å; F92-Q94 VanDerWaalsContact C-N 3.35Å; F92-K95 PolarHBondContact O-N 3.49Å; F92-Q96 WeakPolarHBondContact O-CG 3.33Å; F92-Q96 PolarHBondContact O-N 3.11Å; F92-Q96 VanDerWaalsContact O-N 3.16Å |
| 93 | A | 45.6 | Very low | 42.2 | Very low | 58 Ų | 58 | 111.3 Ų | 111.3 | 48% | 0.479 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -64.1 | -38.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A89 A90 Q96 Q97 | A89-A93 PolarHBondContact O-N 3.41Å; A90-A93 PolarHBondContact O-N 3.45Å; A93-Q96 PolarHBondContact O-N 2.98Å; A93-Q97 PolarHBondContact O-N 3.22Å |
| 94 | Q | 45.9 | Very low | 42.5 | Very low | 111 Ų | 111 | 111.8 Ų | 111.8 | 52% | 0.519 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -68 | -37.6 | 177.4 | -156.1 | 177.5 | 32.7 | 0 | 0 | 112.3 | A90 F92 Q97 Q98 | A90-Q94 PolarHBondContact O-N 3.42Å; F92-Q94 VanDerWaalsContact C-N 3.35Å; Q94-Q97 PolarHBondContact O-N 3.35Å; Q94-Q98 PolarHBondContact O-N 3.37Å; Q94-Q98 VanDerWaalsContact O-N 3.12Å |
| 95 | K | 43.4 | Very low | 42.5 | Very low | 128 Ų | 128 | 114.9 Ų | 114.9 | 56% | 0.557 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -64.7 | -41.6 | 173.7 | -77.5 | -172.4 | 178.4 | -174.3 | 0 | 112.7 | H91 F92 Q97 Q98 T99 | H91-K95 PolarHBondContact O-N 2.99Å; F92-K95 PolarHBondContact O-N 3.49Å; K95-Q97 VanDerWaalsContact C-N 3.25Å; K95-Q97 PolarHBondContact O-N 3.49Å; K95-Q98 PolarHBondContact O-N 3.19Å; K95-T99 PolarHBondContact O-N 2.92Å; K95-T99 PolarHBondContact O-OG1 3.28Å; K95-T99 VanDerWaalsContact O-OG1 3.13Å |
| 96 | Q | 46.9 | Very low | 42.7 | Very low | 132 Ų | 132 | 119.9 Ų | 119.9 | 62% | 0.617 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -56.4 | -40.1 | 173.9 | -73.3 | -91 | -19.5 | 0 | 0 | 112 | F92 A93 R100 | F92-Q96 WeakPolarHBondContact O-CG 3.33Å; F92-Q96 PolarHBondContact O-N 3.11Å; F92-Q96 VanDerWaalsContact O-N 3.16Å; A93-Q96 PolarHBondContact O-N 2.98Å; Q96-R100 WeakPolarHBondContact O-CB 3.31Å; Q96-R100 PolarHBondContact O-N 3.21Å; Q96-R100 VanDerWaalsContact O-N 3.11Å |
| 97 | Q | 47 | Very low | 42.9 | Very low | 145 Ų | 145 | 119.1 Ų | 119.1 | 68% | 0.678 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -70.6 | -30.1 | 175.9 | -67.9 | -170.9 | 7.2 | 0 | 0 | 113.4 | A93 Q94 K95 | A93-Q97 PolarHBondContact O-N 3.22Å; Q94-Q97 PolarHBondContact O-N 3.35Å; K95-Q97 VanDerWaalsContact C-N 3.25Å; K95-Q97 PolarHBondContact O-N 3.49Å |
| 98 | Q | 45.9 | Very low | 42.6 | Very low | 131 Ų | 131 | 120.7 Ų | 120.7 | 61% | 0.612 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -75.9 | -42.2 | 173.4 | -70.4 | 176.5 | -8.3 | 0 | 0 | 112.1 | Q94 K95 R100 W101 A102 | Q94-Q98 PolarHBondContact O-N 3.37Å; Q94-Q98 VanDerWaalsContact O-N 3.12Å; K95-Q98 PolarHBondContact O-N 3.19Å; Q98-R100 PolarHBondContact O-N 3.2Å; Q98-W101 PolarHBondContact O-N 3.48Å; Q98-W101 VanDerWaalsContact O-N 3.15Å; Q98-A102 PolarHBondContact O-N 3.04Å |
| 99 | T | 44.4 | Very low | 42.5 | Very low | 83 Ų | 83 | 115.5 Ų | 115.5 | 51% | 0.509 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -67.7 | -33.4 | -179.7 | -53.2 | 0 | 0 | 0 | 0 | 112.6 | K95 W101 A102 C103 | K95-T99 PolarHBondContact O-N 2.92Å; K95-T99 PolarHBondContact O-OG1 3.28Å; K95-T99 VanDerWaalsContact O-OG1 3.13Å; T99-W101 PolarHBondContact O-N 3.15Å; T99-W101 VanDerWaalsContact O-N 3.14Å; T99-A102 PolarHBondContact O-N 3.4Å; T99-C103 PolarHBondContact O-N 2.92Å |
| 100 | R | 38.4 | Very low | 42.9 | Very low | 215 Ų | 215 | 121 Ų | 121 | 81% | 0.811 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.1 | -13.7 | 174.3 | -175.1 | 164.8 | 173 | -95.5 | -1.9 | 114 | Q96 Q98 | Q96-R100 WeakPolarHBondContact O-CB 3.31Å; Q96-R100 PolarHBondContact O-N 3.21Å; Q96-R100 VanDerWaalsContact O-N 3.11Å; Q98-R100 PolarHBondContact O-N 3.2Å |
| 101 | W | 39.8 | Very low | 42.6 | Very low | 219 Ų | 219 | 125 Ų | 125 | 83% | 0.83 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.2 | -4.8 | 172.3 | -69.8 | 65.5 | 0 | 0 | 0 | 113 | Q98 T99 | Q98-W101 PolarHBondContact O-N 3.48Å; Q98-W101 VanDerWaalsContact O-N 3.15Å; T99-W101 PolarHBondContact O-N 3.15Å; T99-W101 VanDerWaalsContact O-N 3.14Å |
| 102 | A | 40.5 | Very low | 42.5 | Very low | 77 Ų | 77 | 123.5 Ų | 123.5 | 64% | 0.636 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.8 | 1 | -177 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q98 T99 | Q98-A102 PolarHBondContact O-N 3.04Å; T99-A102 PolarHBondContact O-N 3.4Å |
| 103 | C | 36.9 | Very low | 42.5 | Very low | 105 Ų | 105 | 122.7 Ų | 122.7 | 71% | 0.709 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -132.7 | 70.9 | -179 | -58.5 | 0 | 0 | 0 | 0 | 110 | T99 | T99-C103 PolarHBondContact O-N 2.92Š|
| 104 | G | 40.8 | Very low | 42.6 | Very low | 70 Ų | 70 | 124.8 Ų | 124.8 | 72% | 0.722 | 67% | 0.673 | S | S | * | * | S | Bend | trans | 162.3 | 31.4 | -179.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | | |
| 105 | D | 39.5 | Very low | 42.5 | Very low | 128 Ų | 128 | 127.6 Ų | 127.6 | 68% | 0.684 | 68% | 0.684 | S | S | * | * | | | trans | -152.2 | 63.4 | 167.3 | -163.2 | 24.8 | 0 | 0 | 0 | 110.8 | G107 | D105-G107 PolarHBondContact O-N 3.33Š|
| 106 | D | 43.3 | Very low | 42.5 | Very low | 174 Ų | 174 | 131.4 Ų | 131.4 | 93% | 0.93 | 70% | 0.695 | S | S | * | * | | | trans | -73.3 | 74.9 | 173 | -72.3 | -54.9 | 0 | 0 | 0 | 110.4 | | |
| 107 | G | 45 | Very low | 42.4 | Very low | 50 Ų | 50 | 132.7 Ų | 132.7 | 52% | 0.515 | 70% | 0.698 | S | S | . | * | S | Bend | trans | 84.7 | 101.3 | 169.6 | 0 | 0 | 0 | 0 | 0 | 115 | D105 | D105-G107 PolarHBondContact O-N 3.33Š|
| 108 | H | 37.7 | Very low | 42.2 | Very low | 174 Ų | 174 | 136 Ų | 136 | 81% | 0.806 | 71% | 0.706 | S | S | * | * | | | | -152.6 | 153.7 | 93 | -83.8 | -64.7 | 0 | 0 | 0 | 110 | | |
| 109 | G | 37.8 | Very low | 42 | Very low | 59 Ų | 59 | 135.4 Ų | 135.4 | 61% | 0.608 | 71% | 0.707 | S | S | * | * | | | trans | -59 | 156.2 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113 | D111 | G109-D111 VanDerWaalsContact C-N 3.26Å; G109-D111 PolarHBondContact O-N 3.32Å |
| 110 | I | 50.7 | Low | 41.8 | Very low | 182 Ų | 182 | 136 Ų | 136 | 93% | 0.933 | 71% | 0.713 | S | S | * | * | | | trans | -64.6 | 83.5 | 179.5 | -56.1 | 174 | 0 | 0 | 0 | 109.8 | | |
| 111 | D | 38.8 | Very low | 42.1 | Very low | 144 Ų | 144 | 132 Ų | 132 | 77% | 0.77 | 71% | 0.714 | S | S | * | * | | | trans | -107.3 | 102.8 | -178.5 | -102.6 | -41.7 | 0 | 0 | 0 | 112.2 | G109 | G109-D111 VanDerWaalsContact C-N 3.26Å; G109-D111 PolarHBondContact O-N 3.32Å |
| 112 | N | 37.7 | Very low | 42 | Very low | 85 Ų | 85 | 129.2 Ų | 129.2 | 46% | 0.455 | 71% | 0.712 | S | S | . | * | | | trans | 69.2 | 106.1 | 157.4 | -153.3 | 76 | 0 | 0 | 0 | 118.9 | D114 | N112-D114 WeakPolarHBondContact ND2-CB 3.36Å; N112-D114 PolarHBondContact ND2-N 3.43Å; N112-D114 PolarHBondContact ND2-OD2 3.24Å; N112-D114 PolarHBondContact O-N 2.96Å |
| 113 | P | 47.3 | Very low | 42 | Very low | 107 Ų | 107 | 131.6 Ų | 131.6 | 70% | 0.695 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75 | 20.2 | -177.8 | 34.9 | -38.3 | 0 | 0 | 0 | 115.3 | W116 | P113-W116 PolarHBondContact O-NE1 3.21Š|
| 114 | D | 46.2 | Very low | 42.2 | Very low | 102 Ų | 102 | 132.3 Ų | 132.3 | 55% | 0.545 | 72% | 0.718 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -103.6 | -7.8 | 174.9 | -57.7 | -62.9 | 0 | 0 | 0 | 114.4 | N112 W116 K117 | N112-D114 WeakPolarHBondContact ND2-CB 3.36Å; N112-D114 PolarHBondContact ND2-N 3.43Å; N112-D114 PolarHBondContact ND2-OD2 3.24Å; N112-D114 PolarHBondContact O-N 2.96Å; D114-W116 VanDerWaalsContact C-N 3.27Å; D114-W116 PolarHBondContact O-N 3.49Å; D114-K117 PolarHBondContact O-N 3Å |
| 115 | K | 45.3 | Very low | 42.3 | Very low | 169 Ų | 169 | 132.9 Ų | 132.9 | 74% | 0.735 | 72% | 0.716 | S | S | * | * | G | 310 helix | trans | -65.9 | -26.6 | -176 | -64.8 | -80.2 | -174.3 | 166.8 | 0 | 113.4 | K117 Y118 | K115-K117 PolarHBondContact O-N 3.05Å; K115-Y118 PolarHBondContact O-N 3.27Å |
| 116 | W | 43.3 | Very low | 42.6 | Very low | 209 Ų | 209 | 134.1 Ų | 134.1 | 79% | 0.792 | 72% | 0.723 | S | S | * | * | G | 310 helix | trans | -65.6 | -14.4 | 179.5 | 67.7 | -59.9 | 0 | 0 | 0 | 115.4 | P113 D114 Y118 | P113-W116 PolarHBondContact O-NE1 3.21Å; D114-W116 VanDerWaalsContact C-N 3.27Å; D114-W116 PolarHBondContact O-N 3.49Å; W116-Y118 PolarHBondContact O-N 3.32Å |
| 117 | K | 44.7 | Very low | 42.4 | Very low | 159 Ų | 159 | 130.5 Ų | 130.5 | 69% | 0.691 | 72% | 0.716 | S | S | * | * | G | 310 helix | trans | -76.4 | -2 | 178.9 | -91 | 172.4 | 62.8 | -177.6 | 0 | 115.1 | D114 K115 | D114-K117 PolarHBondContact O-N 3Å; K115-K117 PolarHBondContact O-N 3.05Å |
| 118 | Y | 41.9 | Very low | 42 | Very low | 214 Ų | 214 | 132 Ų | 132 | 84% | 0.839 | 72% | 0.724 | S | S | * | * | | | trans | -131.4 | 73.5 | 173.5 | -71 | -77 | 0 | 0 | 0 | 112 | K115 W116 | K115-Y118 PolarHBondContact O-N 3.27Å; W116-Y118 PolarHBondContact O-N 3.32Å |
| 119 | N | 41.8 | Very low | 41.9 | Very low | 119 Ų | 119 | 129.9 Ų | 129.9 | 64% | 0.636 | 73% | 0.726 | S | S | * | * | | | trans | -115.3 | 122.2 | 154.7 | -164 | 53.4 | 0 | 0 | 0 | 108 | | |
| 120 | P | 40.5 | Very low | 41.8 | Very low | 96 Ų | 96 | 131 Ų | 131 | 62% | 0.623 | 74% | 0.738 | S | S | * | * | | | trans | -63.9 | 157 | 172.7 | 29.6 | -34.3 | 0 | 0 | 0 | 109.7 | M122 | P120-M122 PolarHBondContact O-N 3.3Š|
| 121 | P | 43.8 | Very low | 41.3 | Very low | 130 Ų | 130 | 125.6 Ų | 125.6 | 84% | 0.844 | 73% | 0.726 | S | S | * | * | | | trans | -64.3 | 105.2 | -178.9 | 26.3 | -33.9 | 0 | 0 | 0 | 110.3 | N123 | P121-N123 PolarHBondContact O-N 3.47Å; P121-N123 VanDerWaalsContact O-N 3.11Å |
| 122 | M | 38.7 | Very low | 41.4 | Very low | 160 Ų | 160 | 124.6 Ų | 124.6 | 79% | 0.788 | 73% | 0.728 | S | S | * | * | | | trans | -65 | 112.3 | 167.1 | -78.8 | -140.9 | -67.6 | 0 | 0 | 108.7 | P120 | P120-M122 PolarHBondContact O-N 3.3Š|
| 123 | N | 39.9 | Very low | 41.6 | Very low | 127 Ų | 127 | 127.2 Ų | 127.2 | 68% | 0.679 | 75% | 0.749 | S | S | * | * | | | trans | -60.1 | 125.7 | 173.6 | -176.1 | 2.1 | 0 | 0 | 0 | 109.5 | P121 A125 | P121-N123 PolarHBondContact O-N 3.47Å; P121-N123 VanDerWaalsContact O-N 3.11Å; N123-A125 PolarHBondContact O-N 3.12Å |
| 124 | P | 42.3 | Very low | 41 | Very low | 121 Ų | 121 | 125.6 Ų | 125.6 | 79% | 0.786 | 75% | 0.752 | S | S | * | * | G | 310 helix | trans | -60.6 | -8.5 | -176.6 | -26.4 | 35.5 | 0 | 0 | 0 | 116 | N126 | P124-N126 VanDerWaalsContact C-N 3.29Å; P124-N126 PolarHBondContact O-N 3.06Å |
| 125 | A | 42.9 | Very low | 40.5 | Very low | 82 Ų | 82 | 128.9 Ų | 128.9 | 68% | 0.678 | 77% | 0.77 | S | S | * | * | G | 310 helix | trans | -70.5 | -8.7 | -171.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | N123 | N123-A125 PolarHBondContact O-N 3.12Š|
| 126 | N | 44.1 | Very low | 40.1 | Very low | 154 Ų | 154 | 123.6 Ų | 123.6 | 82% | 0.824 | 76% | 0.763 | S | S | * | * | G | 310 helix | trans | -126.3 | 24.2 | -170 | -150 | 86.4 | 0 | 0 | 0 | 115.5 | P124 | P124-N126 VanDerWaalsContact C-N 3.29Å; P124-N126 PolarHBondContact O-N 3.06Å |
| 127 | A | 40.4 | Very low | 39.9 | Very low | 97 Ų | 97 | 119.8 Ų | 119.8 | 80% | 0.802 | 77% | 0.769 | S | S | * | * | | | trans | -103.6 | 28.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | | |
| 128 | A | 36.5 | Very low | 39.8 | Very low | 82 Ų | 82 | 120.5 Ų | 120.5 | 68% | 0.678 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -85.1 | 139.9 | 173 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 129 | P | 35.9 | Very low | 39.4 | Very low | 130 Ų | 130 | 113.9 Ų | 113.9 | 84% | 0.844 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -56 | 142.2 | 173 | -24.9 | 34.8 | 0 | 0 | 0 | 112.1 | G131 | P129-G131 PolarHBondContact O-N 3.5Š|
| 130 | G | 36 | Very low | 38.9 | Very low | 83 Ų | 83 | 111.9 Ų | 111.9 | 86% | 0.856 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 127.7 | -164.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 131 | G | 39.3 | Very low | 39.2 | Very low | 67 Ų | 67 | 113.9 Ų | 113.9 | 69% | 0.691 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 162.9 | 161.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | P129 | P129-G131 PolarHBondContact O-N 3.5Š|
| 132 | P | 41.1 | Very low | 38.8 | Very low | 124 Ų | 124 | 110.8 Ų | 110.8 | 81% | 0.805 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 154.9 | -177.9 | 27.8 | -35.1 | 0 | 0 | 0 | 112.4 | G134 | P132-G134 PolarHBondContact O-N 3.16Š|
| 133 | P | 41.3 | Very low | 39.3 | Very low | 139 Ų | 139 | 108.7 Ų | 108.7 | 90% | 0.903 | 80% | 0.796 | S | S | * | * | | | trans | -67.5 | 103.6 | -168.9 | 26.3 | -34.7 | 0 | 0 | 0 | 112.6 | | |
| 134 | G | 34.6 | Very low | 39.5 | Very low | 73 Ų | 73 | 109.7 Ų | 109.7 | 75% | 0.753 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 125.1 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | P132 | P132-G134 PolarHBondContact O-N 3.16Š|
| 135 | N | 37.2 | Very low | 39.2 | Very low | 171 Ų | 171 | 106.7 Ų | 106.7 | 91% | 0.914 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 134.6 | -178.1 | -159.8 | 52.7 | 0 | 0 | 0 | 112 | | |
| 136 | G | 36.1 | Very low | 39.3 | Very low | 58 Ų | 58 | 109.9 Ų | 109.9 | 60% | 0.598 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 152.1 | -170.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | | |
| 137 | S | 39.1 | Very low | 39.3 | Very low | 130 Ų | 130 | 109.5 Ų | 109.5 | 91% | 0.909 | 80% | 0.799 | S | S | * | * | | | trans | -165.8 | 153.7 | 148.4 | -84.3 | 0 | 0 | 0 | 0 | 111 | | |
| 138 | N | 42.8 | Very low | 39.1 | Very low | 174 Ų | 174 | 108.3 Ų | 108.3 | 93% | 0.93 | 80% | 0.797 | S | S | * | * | | | trans | -63.6 | 150.6 | -173.8 | -69.8 | -40.9 | 0 | 0 | 0 | 114.4 | | |
| 139 | G | 33 | Very low | 39.5 | Very low | 75 Ų | 75 | 113.5 Ų | 113.5 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | | | trans | 114.4 | 113.5 | 149.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | | |
| 140 | G | 31.6 | Very low | 39.7 | Very low | 76 Ų | 76 | 111 Ų | 111 | 78% | 0.784 | 81% | 0.808 | S | S | * | * | | | trans | -79.8 | 176.9 | 139.4 | 0 | 0 | 0 | 0 | 0 | 110 | | |
| 141 | P | 47.2 | Very low | 39.8 | Very low | 139 Ų | 139 | 113.4 Ų | 113.4 | 90% | 0.903 | 81% | 0.811 | S | S | * | * | | | cis | -117.3 | 168 | 5.4 | 40.1 | -28.9 | 0 | 0 | 0 | 113.4 | | |
| 142 | G | 34.5 | Very low | 39.6 | Very low | 64 Ų | 64 | 113 Ų | 113 | 66% | 0.66 | 81% | 0.806 | S | S | * | * | | | trans | -177.9 | 88.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | I144 | G142-I144 VanDerWaalsContact C-N 3.29Å; G142-I144 PolarHBondContact O-N 3.39Å |
| 143 | A | 50.1 | Low | 39.5 | Very low | 116 Ų | 116 | 115.5 Ų | 115.5 | 96% | 0.959 | 81% | 0.812 | S | S | * | * | | | trans | -80.3 | 83.1 | 153.3 | 0 | 0 | 0 | 0 | 0 | 108 | | |
| 144 | I | 42.9 | Very low | 39.1 | Very low | 148 Ų | 148 | 112.9 Ų | 112.9 | 76% | 0.759 | 81% | 0.811 | S | S | * | * | | | trans | -95.6 | 124.4 | 172.1 | -62 | -177.7 | 0 | 0 | 0 | 107.4 | G142 | G142-I144 VanDerWaalsContact C-N 3.29Å; G142-I144 PolarHBondContact O-N 3.39Å |
| 145 | G | 36.6 | Very low | 39.3 | Very low | 58 Ų | 58 | 113.5 Ų | 113.5 | 60% | 0.598 | 82% | 0.817 | S | S | * | * | | | trans | -65.2 | 169.6 | -168.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | I147 | G145-I147 PolarHBondContact O-N 3.38Š|
| 146 | T | 45.4 | Very low | 39.2 | Very low | 149 Ų | 149 | 109.2 Ų | 109.2 | 91% | 0.914 | 81% | 0.813 | S | S | * | * | | | trans | -49.7 | 105.9 | 173.5 | 42.9 | 0 | 0 | 0 | 0 | 111.3 | G148 | T146-G148 PolarHBondContact O-N 3.21Š|
| 147 | I | 42.6 | Very low | 39.3 | Very low | 146 Ų | 146 | 110.5 Ų | 110.5 | 75% | 0.749 | 83% | 0.827 | S | S | * | * | | | trans | -69.1 | 99.9 | 170.7 | -62.2 | 176.5 | 0 | 0 | 0 | 107.2 | G145 M149 | G145-I147 PolarHBondContact O-N 3.38Å; I147-M149 PolarHBondContact O-N 3.26Å; I147-M149 VanDerWaalsContact O-N 3.17Å |
| 148 | G | 37.2 | Very low | 39 | Very low | 73 Ų | 73 | 108.2 Ų | 108.2 | 75% | 0.753 | 82% | 0.824 | S | S | * | * | | | trans | -68 | 108.3 | 177 | 0 | 0 | 0 | 0 | 0 | 111.2 | T146 | T146-G148 PolarHBondContact O-N 3.21Š|
| 149 | M | 44.1 | Very low | 38.8 | Very low | 190 Ų | 190 | 104.2 Ų | 104.2 | 94% | 0.936 | 82% | 0.823 | S | S | * | * | | | trans | -84.1 | 110.5 | 158.2 | -69.6 | -174.1 | 178 | 0 | 0 | 108.2 | I147 | I147-M149 PolarHBondContact O-N 3.26Å; I147-M149 VanDerWaalsContact O-N 3.17Å |
| 150 | G | 40.2 | Very low | 38.9 | Very low | 79 Ų | 79 | 104.5 Ų | 104.5 | 81% | 0.814 | 83% | 0.826 | S | S | * | * | | | trans | 167.5 | 74.5 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | | |
| 151 | S | 39.1 | Very low | 39.1 | Very low | 133 Ų | 133 | 106.3 Ų | 106.3 | 93% | 0.93 | 83% | 0.834 | S | S | * | * | | | trans | -82.2 | 135.8 | 173.5 | -172.6 | 0 | 0 | 0 | 0 | 110.9 | | |
| 152 | G | 35.7 | Very low | 38.6 | Very low | 57 Ų | 57 | 103.4 Ų | 103.4 | 59% | 0.588 | 83% | 0.829 | S | S | * | * | | | trans | 123 | 109.5 | 148.1 | 0 | 0 | 0 | 0 | 0 | 119.1 | | |
| 153 | L | 37.6 | Very low | 38.7 | Very low | 177 Ų | 177 | 104.6 Ų | 104.6 | 93% | 0.927 | 84% | 0.841 | S | S | * | * | | | trans | 57 | 127.4 | 135.5 | -76.9 | 72.7 | 0 | 0 | 0 | 121.7 | | |
| 154 | G | 34.3 | Very low | 38 | Very low | 85 Ų | 85 | 102.5 Ų | 102.5 | 88% | 0.876 | 83% | 0.831 | S | S | * | * | | | trans | 85.9 | 133.4 | 160.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 155 | G | 37.8 | Very low | 38.3 | Very low | 85 Ų | 85 | 103.2 Ų | 103.2 | 88% | 0.876 | 84% | 0.836 | S | S | * | * | | | cis | 136.3 | 116.1 | 10.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | | |
| 156 | G | 34.5 | Very low | 38.7 | Very low | 81 Ų | 81 | 108.4 Ų | 108.4 | 84% | 0.835 | 85% | 0.85 | S | S | * | * | | | trans | 140.1 | 113.2 | -179 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 157 | G | 38 | Very low | 38.2 | Very low | 86 Ų | 86 | 105 Ų | 105 | 89% | 0.887 | 84% | 0.844 | S | S | * | * | | | trans | -89.7 | 170.9 | 163.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 158 | G | 34.3 | Very low | 38.1 | Very low | 82 Ų | 82 | 102.1 Ų | 102.1 | 85% | 0.845 | 85% | 0.851 | S | S | * | * | | | trans | 111.3 | 120 | -170.3 | 0 | 0 | 0 | 0 | 0 | 109 | | |
| 159 | G | 37.3 | Very low | 38.1 | Very low | 89 Ų | 89 | 103.9 Ų | 103.9 | 92% | 0.918 | 85% | 0.852 | S | S | * | * | | | cis | 93.1 | 93.1 | 27 | 0 | 0 | 0 | 0 | 0 | 108.3 | | |
| 160 | G | 35.1 | Very low | 38.3 | Very low | 81 Ų | 81 | 98.6 Ų | 98.6 | 84% | 0.835 | 85% | 0.846 | S | S | * | * | | | trans | -179.8 | 115.1 | -175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | | |
| 161 | A | 37.2 | Very low | 38.4 | Very low | 115 Ų | 115 | 100.9 Ų | 100.9 | 95% | 0.95 | 84% | 0.844 | S | S | * | * | | | trans | -66.9 | 163.8 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 162 | G | 35.3 | Very low | 38.8 | Very low | 77 Ų | 77 | 102.9 Ų | 102.9 | 79% | 0.794 | 85% | 0.845 | S | S | * | * | | | trans | 156.2 | 107.5 | 164.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | | |
| 163 | G | 37.2 | Very low | 38.9 | Very low | 89 Ų | 89 | 103.3 Ų | 103.3 | 92% | 0.918 | 85% | 0.849 | S | S | * | * | | | trans | -75.8 | 164.5 | 169.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 164 | G | 36.1 | Very low | 39.2 | Very low | 72 Ų | 72 | 97.5 Ų | 97.5 | 74% | 0.742 | 83% | 0.832 | S | S | * | * | | | trans | 176.7 | 84.6 | 178 | 0 | 0 | 0 | 0 | 0 | 113.1 | N166 | G164-N166 VanDerWaalsContact C-N 3.29Å; G164-N166 PolarHBondContact O-N 3.43Å |
| 165 | N | 49 | Very low | 39.8 | Very low | 163 Ų | 163 | 101.9 Ų | 101.9 | 87% | 0.872 | 83% | 0.834 | S | S | * | * | | | trans | -67.6 | 92 | 160.6 | -75.4 | 21.5 | 0 | 0 | 0 | 108.5 | | |
| 166 | N | 45.7 | Very low | 40.2 | Very low | 167 Ų | 167 | 105.1 Ų | 105.1 | 89% | 0.893 | 83% | 0.826 | S | S | * | * | | | trans | 172.9 | 122.8 | 140.8 | -90.8 | -14 | 0 | 0 | 0 | 110.4 | G164 | G164-N166 VanDerWaalsContact C-N 3.29Å; G164-N166 PolarHBondContact O-N 3.43Å |
| 167 | G | 33.7 | Very low | 40.6 | Very low | 77 Ų | 77 | 108.7 Ų | 108.7 | 79% | 0.794 | 82% | 0.821 | S | S | * | * | | | trans | -142.5 | 67.5 | 174 | 0 | 0 | 0 | 0 | 0 | 109.7 | S169 | G167-S169 PolarHBondContact O-N 3.01Š|
| 168 | G | 40.8 | Very low | 40.9 | Very low | 86 Ų | 86 | 113.1 Ų | 113.1 | 89% | 0.887 | 82% | 0.818 | S | S | * | * | | | trans | -66.3 | 117.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 169 | S | 37.6 | Very low | 41.2 | Very low | 110 Ų | 110 | 113.1 Ų | 113.1 | 77% | 0.769 | 81% | 0.806 | S | S | * | * | | | trans | -107.1 | 101 | 164.9 | -168.8 | 0 | 0 | 0 | 0 | 108.1 | G167 T171 | G167-S169 PolarHBondContact O-N 3.01Å; S169-T171 PolarHBondContact O-N 3.42Å |
| 170 | G | 48.7 | Very low | 41.5 | Very low | 80 Ų | 80 | 115.6 Ų | 115.6 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | | | trans | -79.6 | 114.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | | |
| 171 | T | 42.2 | Very low | 41.9 | Very low | 126 Ų | 126 | 115.1 Ų | 115.1 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | | | trans | -116.5 | 115.9 | 160 | -47.2 | 0 | 0 | 0 | 0 | 107.7 | S169 G173 | S169-T171 PolarHBondContact O-N 3.42Å; T171-G173 PolarHBondContact O-N 3.48Å |
| 172 | N | 45.9 | Very low | 42.1 | Very low | 176 Ų | 176 | 112.7 Ų | 112.7 | 94% | 0.941 | 76% | 0.763 | S | S | * | * | | | trans | -64 | 96 | 175.8 | -76.7 | -36.6 | 0 | 0 | 0 | 110.3 | | |
| 173 | G | 37.8 | Very low | 42.4 | Very low | 66 Ų | 66 | 111.3 Ų | 111.3 | 68% | 0.68 | 74% | 0.744 | S | S | * | * | | | trans | -121.1 | 80.2 | 170 | 0 | 0 | 0 | 0 | 0 | 109.4 | T171 | T171-G173 PolarHBondContact O-N 3.48Š|
| 174 | G | 45 | Very low | 42.6 | Very low | 54 Ų | 54 | 110 Ų | 110 | 56% | 0.557 | 73% | 0.725 | S | S | * | * | | | trans | -67.4 | 159.3 | -168.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | H176 | G174-H176 PolarHBondContact O-CD2 3.5Å; G174-H176 PolarHBondContact O-N 2.89Å; G174-H176 VanDerWaalsContact O-N 3.12Å |
| 175 | L | 46.8 | Very low | 43 | Very low | 178 Ų | 178 | 109.7 Ų | 109.7 | 93% | 0.932 | 72% | 0.715 | S | S | * | * | S | Bend | trans | 70.4 | -1.8 | 152.5 | -54 | 176 | 0 | 0 | 0 | 120.1 | | |
| 176 | H | 45.4 | Very low | 42.8 | Very low | 152 Ų | 152 | 106.8 Ų | 106.8 | 70% | 0.704 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -106.7 | 8.3 | -175.7 | -75.9 | -84.2 | 0 | 0 | 0 | 117.5 | G174 | G174-H176 PolarHBondContact O-CD2 3.5Å; G174-H176 PolarHBondContact O-N 2.89Å; G174-H176 VanDerWaalsContact O-N 3.12Å |
| 177 | H | 42.9 | Very low | 42.5 | Very low | 157 Ų | 157 | 104.6 Ų | 104.6 | 73% | 0.727 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -117.5 | -0.2 | -176 | -83.1 | -85.6 | 0 | 0 | 0 | 117.3 | | |
| 178 | Q | 44 | Very low | 42.8 | Very low | 178 Ų | 178 | 103.5 Ų | 103.5 | 83% | 0.832 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -81 | -26.7 | 173.4 | -79.2 | -175.2 | -11.6 | 0 | 0 | 113.7 | A182 | Q178-A182 PolarHBondContact O-N 2.97Å |
| 179 | S | 41.8 | Very low | 42.9 | Very low | 83 Ų | 83 | 101.8 Ų | 101.8 | 58% | 0.58 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -72.2 | -37.6 | -175.7 | 53.7 | 0 | 0 | 0 | 0 | 114.1 | A183 | S179-A183 WeakPolarHBondContact O-CB 3.45Å; S179-A183 PolarHBondContact O-N 3.25Å |
| 180 | M | 42.9 | Very low | 43.1 | Very low | 140 Ų | 140 | 102.7 Ų | 102.7 | 69% | 0.69 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -71.3 | -36.3 | 179.8 | -72.6 | -166.8 | -175.2 | 0 | 0 | 113.2 | A183 A184 | M180-A183 PolarHBondContact O-N 3.44Å; M180-A184 PolarHBondContact O-N 3.37Å |
| 181 | A | 43.2 | Very low | 43.1 | Very low | 71 Ų | 71 | 105.9 Ų | 105.9 | 59% | 0.587 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -64.3 | -42.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | A185 | A181-A185 PolarHBondContact O-N 2.97Å |
| 182 | A | 41.5 | Very low | 43.4 | Very low | 64 Ų | 64 | 106.5 Ų | 106.5 | 53% | 0.529 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -66.4 | -39.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q178 A185 N186 | Q178-A182 PolarHBondContact O-N 2.97Å; A182-A185 PolarHBondContact O-N 3.44Å; A182-N186 WeakPolarHBondContact O-CB 3.47Å; A182-N186 PolarHBondContact O-N 3.12Å |
| 183 | A | 43.3 | Very low | 43.2 | Very low | 48 Ų | 48 | 100.9 Ų | 100.9 | 40% | 0.397 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -65.4 | -38.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113 | S179 M180 N186 M187 | S179-A183 WeakPolarHBondContact O-CB 3.45Å; S179-A183 PolarHBondContact O-N 3.25Å; M180-A183 PolarHBondContact O-N 3.44Å; A183-N186 PolarHBondContact O-N 3.32Å; A183-M187 WeakPolarHBondContact O-CE 3.47Å; A183-M187 PolarHBondContact O-N 3.07Å |
| 184 | A | 40.4 | Very low | 43.4 | Very low | 62 Ų | 62 | 100.8 Ų | 100.8 | 51% | 0.512 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -66 | -42.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | M180 N186 M187 A188 | M180-A184 PolarHBondContact O-N 3.37Å; A184-N186 VanDerWaalsContact C-N 3.35Å; A184-N186 PolarHBondContact O-N 3.29Å; A184-M187 PolarHBondContact O-N 3.37Å; A184-A188 PolarHBondContact O-N 3.47Å |
| 185 | A | 44.4 | Very low | 43.2 | Very low | 65 Ų | 65 | 101.2 Ų | 101.2 | 54% | 0.537 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -62.6 | -40.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | A181 A182 M187 A188 A189 | A181-A185 PolarHBondContact O-N 2.97Å; A182-A185 PolarHBondContact O-N 3.44Å; A185-M187 PolarHBondContact O-N 3.4Å; A185-A188 PolarHBondContact O-N 3.13Å; A185-A189 PolarHBondContact O-N 3.07Å; A185-A189 VanDerWaalsContact O-N 3.12Å |
| 186 | N | 44.1 | Very low | 43.1 | Very low | 103 Ų | 103 | 97.9 Ų | 97.9 | 55% | 0.551 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -67.2 | -34.8 | -179.8 | -159.2 | 13.9 | 0 | 0 | 0 | 112.6 | A182 A183 A184 M190 | A182-N186 WeakPolarHBondContact O-CB 3.47Å; A182-N186 PolarHBondContact O-N 3.12Å; A183-N186 PolarHBondContact O-N 3.32Å; A184-N186 VanDerWaalsContact C-N 3.35Å; A184-N186 PolarHBondContact O-N 3.29Å; N186-M190 PolarHBondContact O-N 3.36Å; N186-M190 VanDerWaalsContact O-N 3.12Å |
| 187 | M | 40 | Very low | 43.1 | Very low | 121 Ų | 121 | 93.4 Ų | 93.4 | 60% | 0.596 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -69.4 | -37.1 | 173.5 | -83.9 | -178 | -81.8 | 0 | 0 | 113.2 | A183 A184 A185 M190 Q191 | A183-M187 WeakPolarHBondContact O-CE 3.47Å; A183-M187 PolarHBondContact O-N 3.07Å; A184-M187 PolarHBondContact O-N 3.37Å; A185-M187 PolarHBondContact O-N 3.4Å; M187-M190 PolarHBondContact O-N 3.12Å; M187-Q191 PolarHBondContact O-N 3.11Å; M187-Q191 VanDerWaalsContact O-N 3.14Å |
| 188 | A | 40.4 | Very low | 43.1 | Very low | 53 Ų | 53 | 93.5 Ų | 93.5 | 44% | 0.438 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63.7 | -41.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | A184 A185 Q191 Q192 | A184-A188 PolarHBondContact O-N 3.47Å; A185-A188 PolarHBondContact O-N 3.13Å; A188-Q191 PolarHBondContact O-N 2.86Å; A188-Q192 PolarHBondContact O-N 3.46Å |
| 189 | A | 43.4 | Very low | 42.8 | Very low | 51 Ų | 51 | 90.3 Ų | 90.3 | 42% | 0.421 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.3 | -41 | 175 | 0 | 0 | 0 | 0 | 0 | 112.6 | A185 Q191 Q192 A193 | A185-A189 PolarHBondContact O-N 3.07Å; A185-A189 VanDerWaalsContact O-N 3.12Å; A189-Q191 PolarHBondContact O-N 3.31Å; A189-Q192 PolarHBondContact O-N 3.48Å; A189-A193 PolarHBondContact O-N 3.12Å |
| 190 | M | 40.3 | Very low | 42.9 | Very low | 128 Ų | 128 | 91.2 Ų | 91.2 | 63% | 0.631 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -63.6 | -36.7 | 175.6 | -80.4 | -167.8 | 174.3 | 0 | 0 | 113.3 | N186 M187 A193 A194 | N186-M190 PolarHBondContact O-N 3.36Å; N186-M190 VanDerWaalsContact O-N 3.12Å; M187-M190 PolarHBondContact O-N 3.12Å; M190-A193 PolarHBondContact O-N 3.34Å; M190-A194 WeakPolarHBondContact O-CB 3.5Å; M190-A194 PolarHBondContact O-N 3.02Å |
| 191 | Q | 49.3 | Very low | 43 | Very low | 147 Ų | 147 | 90.6 Ų | 90.6 | 69% | 0.687 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -68.4 | -36.3 | 176.9 | -73.1 | -177.8 | -3.9 | 0 | 0 | 112.4 | M187 A188 A189 A194 A195 | M187-Q191 PolarHBondContact O-N 3.11Å; M187-Q191 VanDerWaalsContact O-N 3.14Å; A188-Q191 PolarHBondContact O-N 2.86Å; A189-Q191 PolarHBondContact O-N 3.31Å; Q191-A194 PolarHBondContact O-N 2.95Å; Q191-A195 WeakPolarHBondContact O-CB 3.45Å; Q191-A195 PolarHBondContact O-N 3.23Å |
| 192 | Q | 48 | Very low | 42.8 | Very low | 139 Ų | 139 | 93 Ų | 93 | 65% | 0.65 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.9 | -40.5 | 173 | -70.7 | 179.1 | -22.7 | 0 | 0 | 112 | A188 A189 A195 L196 | A188-Q192 PolarHBondContact O-N 3.46Å; A189-Q192 PolarHBondContact O-N 3.48Å; Q192-A195 PolarHBondContact O-N 3.34Å; Q192-L196 WeakPolarHBondContact O-CG 3.5Å; Q192-L196 PolarHBondContact O-N 3.35Å |
| 193 | A | 42.5 | Very low | 43 | Very low | 59 Ų | 59 | 94.2 Ų | 94.2 | 49% | 0.488 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62.8 | -40.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | A189 M190 L196 A197 | A189-A193 PolarHBondContact O-N 3.12Å; M190-A193 PolarHBondContact O-N 3.34Å; A193-L196 PolarHBondContact O-N 3.02Å; A193-A197 WeakPolarHBondContact O-CB 3.45Å; A193-A197 PolarHBondContact O-N 3.49Å |
| 194 | A | 41.3 | Very low | 43 | Very low | 63 Ų | 63 | 95.5 Ų | 95.5 | 52% | 0.521 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -67.2 | -37 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | M190 Q191 A197 K198 | M190-A194 WeakPolarHBondContact O-CB 3.5Å; M190-A194 PolarHBondContact O-N 3.02Å; Q191-A194 PolarHBondContact O-N 2.95Å; A194-A197 PolarHBondContact O-N 3.14Å; A194-K198 PolarHBondContact O-N 3.39Å; A194-K198 VanDerWaalsContact O-N 3.09Å |
| 195 | A | 40.5 | Very low | 43.3 | Very low | 63 Ų | 63 | 98.6 Ų | 98.6 | 52% | 0.521 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -65.5 | -43 | 174 | 0 | 0 | 0 | 0 | 0 | 112 | Q191 Q192 K198 H199 | Q191-A195 WeakPolarHBondContact O-CB 3.45Å; Q191-A195 PolarHBondContact O-N 3.23Å; Q192-A195 PolarHBondContact O-N 3.34Å; A195-K198 PolarHBondContact O-N 2.98Å; A195-H199 PolarHBondContact O-N 3.33Å |
| 196 | L | 45.8 | Very low | 43.5 | Very low | 109 Ų | 109 | 98.5 Ų | 98.5 | 57% | 0.571 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -67 | -36.7 | 175.3 | -76.3 | 163.5 | 0 | 0 | 0 | 112.7 | Q192 A193 K198 H199 N200 | Q192-L196 WeakPolarHBondContact O-CG 3.5Å; Q192-L196 PolarHBondContact O-N 3.35Å; A193-L196 PolarHBondContact O-N 3.02Å; L196-K198 VanDerWaalsContact C-N 3.35Å; L196-K198 PolarHBondContact O-N 3.43Å; L196-H199 PolarHBondContact O-N 3.09Å; L196-N200 PolarHBondContact O-N 3.31Å |
| 197 | A | 45.8 | Very low | 43.6 | Very low | 58 Ų | 58 | 96.8 Ų | 96.8 | 48% | 0.479 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.4 | -42.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | A193 A194 H199 N200 H201 | A193-A197 WeakPolarHBondContact O-CB 3.45Å; A193-A197 PolarHBondContact O-N 3.49Å; A194-A197 PolarHBondContact O-N 3.14Å; A197-H199 VanDerWaalsContact C-N 3.31Å; A197-H199 PolarHBondContact O-N 3.15Å; A197-N200 PolarHBondContact O-N 3.44Å; A197-H201 WeakPolarHBondContact O-CB 3.46Å; A197-H201 PolarHBondContact O-N 3.45Å |
| 198 | K | 41.7 | Very low | 43.9 | Very low | 158 Ų | 158 | 93.9 Ų | 93.9 | 69% | 0.687 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66.4 | -31.8 | 176 | -160.3 | 176.9 | -175.5 | -177.8 | 0 | 112.8 | A194 A195 L196 M202 | A194-K198 PolarHBondContact O-N 3.39Å; A194-K198 VanDerWaalsContact O-N 3.09Å; A195-K198 PolarHBondContact O-N 2.98Å; L196-K198 VanDerWaalsContact C-N 3.35Å; L196-K198 PolarHBondContact O-N 3.43Å; K198-M202 PolarHBondContact O-N 3.44Å |
| 199 | H | 38.8 | Very low | 44.2 | Very low | 112 Ų | 112 | 94.2 Ų | 94.2 | 52% | 0.519 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -69.4 | -48 | 174.6 | -167.4 | -123.5 | 0 | 0 | 0 | 112 | A195 L196 A197 H201 M202 I203 | A195-H199 PolarHBondContact O-N 3.33Å; L196-H199 PolarHBondContact O-N 3.09Å; A197-H199 VanDerWaalsContact C-N 3.31Å; A197-H199 PolarHBondContact O-N 3.15Å; H199-H201 VanDerWaalsContact C-N 3.32Å; H199-H201 PolarHBondContact O-N 3.21Å; H199-M202 PolarHBondContact O-N 3.02Å; H199-I203 PolarHBondContact O-N 3.01Å |
| 200 | N | 44.3 | Very low | 44.5 | Very low | 101 Ų | 101 | 96.7 Ų | 96.7 | 54% | 0.54 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.1 | -37.1 | 175 | -83.3 | -39.5 | 0 | 0 | 0 | 112.5 | L196 A197 M202 I203 S204 | L196-N200 PolarHBondContact O-N 3.31Å; A197-N200 PolarHBondContact O-N 3.44Å; N200-M202 VanDerWaalsContact C-N 3.32Å; N200-M202 PolarHBondContact O-N 3.48Å; N200-I203 PolarHBondContact O-N 3.19Å; N200-S204 PolarHBondContact O-N 3.24Å; N200-S204 PolarHBondContact O-OG 3.12Å |
| 201 | H | 43.6 | Very low | 44.8 | Very low | 127 Ų | 127 | 93.6 Ų | 93.6 | 59% | 0.588 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -66.7 | -31.7 | -178.1 | -148.3 | -23.9 | 0 | 0 | 0 | 113.3 | A197 H199 Q205 | A197-H201 WeakPolarHBondContact O-CB 3.46Å; A197-H201 PolarHBondContact O-N 3.45Å; H199-H201 VanDerWaalsContact C-N 3.32Å; H199-H201 PolarHBondContact O-N 3.21Å; H201-Q205 WeakPolarHBondContact O-CG 3.46Å; H201-Q205 PolarHBondContact O-N 3.05Å |
| 202 | M | 39.9 | Very low | 44.7 | Very low | 121 Ų | 121 | 89.8 Ų | 89.8 | 60% | 0.596 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -71.3 | -43 | 171.3 | -92.9 | -175.1 | -69.9 | 0 | 0 | 112.4 | K198 H199 N200 S204 Q205 A206 | K198-M202 PolarHBondContact O-N 3.44Å; H199-M202 PolarHBondContact O-N 3.02Å; N200-M202 VanDerWaalsContact C-N 3.32Å; N200-M202 PolarHBondContact O-N 3.48Å; M202-S204 VanDerWaalsContact C-N 3.32Å; M202-S204 PolarHBondContact O-N 3.42Å; M202-Q205 PolarHBondContact O-N 2.94Å; M202-A206 PolarHBondContact O-N 3.41Å; M202-A206 VanDerWaalsContact O-N 3.12Å |
| 203 | I | 44.9 | Very low | 44.7 | Very low | 91 Ų | 91 | 91.1 Ų | 91.1 | 47% | 0.467 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -62 | -40.7 | 178.7 | -69.8 | 171.3 | 0 | 0 | 0 | 110.9 | H199 N200 Q205 A206 A207 | H199-I203 PolarHBondContact O-N 3.01Å; N200-I203 PolarHBondContact O-N 3.19Å; I203-Q205 PolarHBondContact O-N 3.43Å; I203-A206 PolarHBondContact O-N 3.34Å; I203-A207 PolarHBondContact O-N 3.43Å |
| 204 | S | 44.3 | Very low | 44.9 | Very low | 74 Ų | 74 | 96.2 Ų | 96.2 | 52% | 0.517 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -69.3 | -29.7 | 176.5 | -64.1 | 0 | 0 | 0 | 0 | 113.9 | N200 M202 A208 | N200-S204 PolarHBondContact O-N 3.24Å; N200-S204 PolarHBondContact O-OG 3.12Å; M202-S204 VanDerWaalsContact C-N 3.32Å; M202-S204 PolarHBondContact O-N 3.42Å; S204-A208 WeakPolarHBondContact O-CB 3.5Å; S204-A208 PolarHBondContact O-N 3.14Å |
| 205 | Q | 46.9 | Very low | 45.1 | Very low | 127 Ų | 127 | 101.2 Ų | 101.2 | 59% | 0.593 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -69.8 | -37.4 | 172.1 | -75.9 | -175.5 | 15.2 | 0 | 0 | 111.8 | H201 M202 I203 A208 A209 | H201-Q205 WeakPolarHBondContact O-CG 3.46Å; H201-Q205 PolarHBondContact O-N 3.05Å; M202-Q205 PolarHBondContact O-N 2.94Å; I203-Q205 PolarHBondContact O-N 3.43Å; Q205-A208 PolarHBondContact O-N 3.47Å; Q205-A209 WeakPolarHBondContact O-CB 3.4Å; Q205-A209 PolarHBondContact O-N 2.9Å |
| 206 | A | 47.1 | Very low | 45 | Very low | 63 Ų | 63 | 105.7 Ų | 105.7 | 52% | 0.521 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.1 | -40.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | M202 I203 | M202-A206 PolarHBondContact O-N 3.41Å; M202-A206 VanDerWaalsContact O-N 3.12Å; I203-A206 PolarHBondContact O-N 3.34Å |
| 207 | A | 46.6 | Very low | 44.6 | Very low | 67 Ų | 67 | 108.8 Ų | 108.8 | 55% | 0.554 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -67.3 | -41 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113 | I203 V210 A211 | I203-A207 PolarHBondContact O-N 3.43Å; A207-V210 PolarHBondContact O-N 2.87Å; A207-A211 PolarHBondContact O-N 2.76Å |
| 208 | A | 45.9 | Very low | 44.4 | Very low | 61 Ų | 61 | 111.4 Ų | 111.4 | 50% | 0.504 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -67.6 | -34.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | S204 Q205 V210 A211 A212 | S204-A208 WeakPolarHBondContact O-CB 3.5Å; S204-A208 PolarHBondContact O-N 3.14Å; Q205-A208 PolarHBondContact O-N 3.47Å; A208-V210 VanDerWaalsContact C-N 3.33Å; A208-V210 PolarHBondContact O-N 3.27Å; A208-A211 PolarHBondContact O-N 3.41Å; A208-A212 WeakPolarHBondContact O-CB 3.42Å; A208-A212 PolarHBondContact O-N 3.04Å |
| 209 | A | 47.3 | Very low | 44.3 | Very low | 60 Ų | 60 | 111.4 Ų | 111.4 | 50% | 0.496 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -64.5 | -34.9 | 177 | 0 | 0 | 0 | 0 | 0 | 113 | Q205 | Q205-A209 WeakPolarHBondContact O-CB 3.4Å; Q205-A209 PolarHBondContact O-N 2.9Å |
| 210 | V | 50 | Low | 44.4 | Very low | 103 Ų | 103 | 114.3 Ų | 114.3 | 62% | 0.624 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -74.9 | -39.1 | 176.6 | 179.2 | 0 | 0 | 0 | 0 | 111.3 | A207 A208 A212 Q213 | A207-V210 PolarHBondContact O-N 2.87Å; A208-V210 VanDerWaalsContact C-N 3.33Å; A208-V210 PolarHBondContact O-N 3.27Å; V210-A212 VanDerWaalsContact C-N 3.3Å; V210-A212 PolarHBondContact O-N 2.75Å; V210-Q213 PolarHBondContact O-N 2.94Å |
| 211 | A | 46.9 | Very low | 44 | Very low | 62 Ų | 62 | 116.7 Ų | 116.7 | 51% | 0.512 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -64.8 | -32.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | A207 A208 Q213 | A207-A211 PolarHBondContact O-N 2.76Å; A208-A211 PolarHBondContact O-N 3.41Å; A211-Q213 VanDerWaalsContact C-N 3.32Å; A211-Q213 PolarHBondContact O-N 3.22Å |
| 212 | A | 46.3 | Very low | 43.7 | Very low | 68 Ų | 68 | 118.6 Ų | 118.6 | 56% | 0.562 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -69.9 | -22.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | A208 V210 | A208-A212 WeakPolarHBondContact O-CB 3.42Å; A208-A212 PolarHBondContact O-N 3.04Å; V210-A212 VanDerWaalsContact C-N 3.3Å; V210-A212 PolarHBondContact O-N 2.75Å |
| 213 | Q | 47.3 | Very low | 43.8 | Very low | 166 Ų | 166 | 118.9 Ų | 118.9 | 78% | 0.776 | 66% | 0.657 | S | S | * | * | G | 310 helix | trans | -81.6 | -15.4 | -178.8 | -76.8 | -171 | -18.4 | 0 | 0 | 114.6 | V210 A211 | V210-Q213 PolarHBondContact O-N 2.94Å; A211-Q213 VanDerWaalsContact C-N 3.32Å; A211-Q213 PolarHBondContact O-N 3.22Å |
| 214 | Q | 48.6 | Very low | 43.7 | Very low | 167 Ų | 167 | 123 Ų | 123 | 78% | 0.78 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -85.2 | -7.7 | -178.6 | -79.7 | -167.4 | -18.5 | 0 | 0 | 115.5 | | |
| 215 | H | 44.4 | Very low | 43.5 | Very low | 168 Ų | 168 | 128.9 Ų | 128.9 | 78% | 0.778 | 69% | 0.694 | S | S | * | * | G | 310 helix | trans | -101.2 | 13.2 | -172 | -83.2 | 84.4 | 0 | 0 | 0 | 115.7 | | |
| 216 | Q | 39.1 | Very low | 43.3 | Very low | 156 Ų | 156 | 132.5 Ų | 132.5 | 73% | 0.729 | 71% | 0.711 | S | S | * | * | | | trans | -111.6 | 46.1 | -174.7 | -78.6 | -76.2 | -7.8 | 0 | 0 | 114.3 | | |
| 217 | H | 36.5 | Very low | 43.2 | Very low | 175 Ų | 175 | 138.3 Ų | 138.3 | 81% | 0.81 | 73% | 0.727 | S | S | * | * | | | trans | -116.1 | 91.8 | 165.2 | -76.2 | -65.3 | 0 | 0 | 0 | 110.8 | H219 | H217-H219 PolarHBondContact O-N 3.4Å; H217-H219 VanDerWaalsContact O-N 3.08Å |
| 218 | P | 41.8 | Very low | 43.1 | Very low | 113 Ų | 113 | 144.4 Ų | 144.4 | 73% | 0.734 | 74% | 0.744 | S | S | * | * | | | trans | -71.5 | 103.4 | 174.7 | 28.7 | -32.9 | 0 | 0 | 0 | 110.2 | Q220 | P218-Q220 PolarHBondContact O-N 3.31Å; P218-Q220 VanDerWaalsContact O-N 3.08Å |
| 219 | H | 39.4 | Very low | 42.9 | Very low | 157 Ų | 157 | 151 Ų | 151 | 73% | 0.727 | 76% | 0.764 | S | S | * | * | | | trans | -80.3 | 86.6 | 176 | -139.9 | 67.9 | 0 | 0 | 0 | 109.7 | H217 Q221 | H217-H219 PolarHBondContact O-N 3.4Å; H217-H219 VanDerWaalsContact O-N 3.08Å; H219-Q221 PolarHBondContact CD2-NE2 3.49Å; H219-Q221 PolarHBondContact NE2-NE2 3.4Å; H219-Q221 PolarHBondContact O-N 3.29Å |
| 220 | Q | 40.6 | Very low | 42.8 | Very low | 174 Ų | 174 | 157 Ų | 157 | 81% | 0.813 | 78% | 0.782 | S | S | * | * | | | trans | -67.2 | 108.3 | 167.5 | -77.9 | -175.1 | -4 | 0 | 0 | 109.3 | P218 | P218-Q220 PolarHBondContact O-N 3.31Å; P218-Q220 VanDerWaalsContact O-N 3.08Å |
| 221 | Q | 37 | Very low | 42.6 | Very low | 150 Ų | 150 | 161.7 Ų | 161.7 | 70% | 0.701 | 80% | 0.797 | S | S | * | * | | | trans | -110.8 | 121.1 | 166.4 | -71.7 | -168.9 | -5.7 | 0 | 0 | 110 | H219 P223 | H219-Q221 PolarHBondContact CD2-NE2 3.49Å; H219-Q221 PolarHBondContact NE2-NE2 3.4Å; H219-Q221 PolarHBondContact O-N 3.29Å; Q221-P223 WeakPolarHBondContact O-CD 3.41Å |
| 222 | H | 37.2 | Very low | 42.2 | Very low | 167 Ų | 167 | 163 Ų | 163 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | | | trans | -72.9 | 126.8 | 178.5 | -73 | -113.2 | 0 | 0 | 0 | 111.1 | Q224 | H222-Q224 PolarHBondContact O-N 3.23Š|
| 223 | P | 41.4 | Very low | 41.9 | Very low | 128 Ų | 128 | 168.5 Ų | 168.5 | 83% | 0.831 | 82% | 0.823 | S | S | * | * | | | trans | -96 | 64.9 | 171.3 | 36.9 | -32.1 | 0 | 0 | 0 | 111 | Q221 | Q221-P223 WeakPolarHBondContact O-CD 3.41Š|
| 224 | Q | 42.4 | Very low | 41.5 | Very low | 177 Ų | 177 | 168 Ų | 168 | 83% | 0.827 | 83% | 0.825 | S | S | * | * | | | trans | -156.4 | 89.2 | 175.8 | -137.2 | 161.5 | 11.7 | 0 | 0 | 114.7 | H222 | H222-Q224 PolarHBondContact O-N 3.23Š|
| 225 | Q | 40.3 | Very low | 41.3 | Very low | 198 Ų | 198 | 169.6 Ų | 169.6 | 93% | 0.925 | 83% | 0.832 | S | S | * | * | | | trans | 169.7 | 89.4 | 140 | -95 | 173 | 32.1 | 0 | 0 | 109.8 | | |
| 226 | Q | 43.1 | Very low | 40.8 | Very low | 202 Ų | 202 | 164.8 Ų | 164.8 | 94% | 0.944 | 83% | 0.829 | S | S | * | * | | | trans | -137.5 | 48.5 | 168.5 | -156.5 | 176.7 | 46.5 | 0 | 0 | 110.8 | | |
| 227 | Q | 44.3 | Very low | 40.8 | Very low | 186 Ų | 186 | 165.6 Ų | 165.6 | 87% | 0.869 | 83% | 0.832 | S | S | * | * | S | Bend | trans | -153 | 51.4 | 178.8 | -153.3 | 175.6 | 40.1 | 0 | 0 | 113.9 | | |
| 228 | Q | 45 | Very low | 41.4 | Very low | 195 Ų | 195 | 162.9 Ų | 162.9 | 91% | 0.911 | 83% | 0.83 | S | S | * | * | | | trans | -165.8 | 78.7 | 158.3 | -115.1 | 169 | 36.3 | 0 | 0 | 112.9 | | |
| 229 | Q | 41.6 | Very low | 41.5 | Very low | 198 Ų | 198 | 165 Ų | 165 | 93% | 0.925 | 83% | 0.83 | S | S | * | * | | | trans | -155.4 | 51.8 | 157.4 | -122.9 | 173.6 | 29.9 | 0 | 0 | 112.5 | | |
| 230 | Q | 44.7 | Very low | 41.7 | Very low | 188 Ų | 188 | 166.8 Ų | 166.8 | 88% | 0.879 | 84% | 0.838 | S | S | * | * | | | trans | -135.9 | 72 | 168.8 | -83.5 | -176.1 | -2.2 | 0 | 0 | 110.3 | | |
| 231 | Q | 46.2 | Very low | 41.7 | Very low | 200 Ų | 200 | 166.3 Ų | 166.3 | 94% | 0.935 | 84% | 0.84 | S | S | * | * | | | trans | -176.9 | 79.1 | 155 | -108.3 | 173.7 | -2.6 | 0 | 0 | 111 | | |
| 232 | A | 38.9 | Very low | 42 | Very low | 91 Ų | 91 | 168 Ų | 168 | 75% | 0.752 | 85% | 0.85 | S | S | * | * | | | trans | -160 | 123.3 | 157 | 0 | 0 | 0 | 0 | 0 | 111.6 | | |
| 233 | Q | 39.8 | Very low | 42.1 | Very low | 183 Ų | 183 | 163.7 Ų | 163.7 | 86% | 0.855 | 85% | 0.851 | S | S | * | * | | | trans | 78.4 | 130.3 | 156.5 | -63.4 | 178.7 | -27 | 0 | 0 | 121.3 | | |
| 234 | N | 39 | Very low | 42 | Very low | 155 Ų | 155 | 161.7 Ų | 161.7 | 83% | 0.829 | 85% | 0.854 | S | S | * | * | | | trans | 70.5 | 83.9 | 157.3 | -70.5 | 11.1 | 0 | 0 | 0 | 121.1 | | |
| 235 | Q | 44.5 | Very low | 42.1 | Very low | 200 Ų | 200 | 157 Ų | 157 | 94% | 0.935 | 85% | 0.853 | S | S | * | * | | | trans | -21 | 130.9 | 130.9 | -56.1 | 174.4 | 10.7 | 0 | 0 | 115 | | |
| 236 | G | 33.8 | Very low | 42.3 | Very low | 68 Ų | 68 | 156 Ų | 156 | 70% | 0.701 | 85% | 0.854 | S | S | * | * | | | trans | 163.8 | 115 | 168.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | | |
| 237 | H | 38.5 | Very low | 42.3 | Very low | 172 Ų | 172 | 150.1 Ų | 150.1 | 80% | 0.796 | 85% | 0.847 | S | S | * | * | | | trans | -81.1 | 151.3 | -169.4 | -65.5 | 0.8 | 0 | 0 | 0 | 113.7 | | |
| 238 | P | 49.4 | Very low | 42.5 | Very low | 118 Ų | 118 | 150.2 Ų | 150.2 | 77% | 0.766 | 85% | 0.853 | S | S | * | * | | | trans | -91.3 | 115.8 | 175 | 34.4 | -30.7 | 0 | 0 | 0 | 112.3 | | |
| 239 | H | 44.9 | Very low | 42.5 | Very low | 159 Ų | 159 | 144.5 Ų | 144.5 | 74% | 0.736 | 85% | 0.846 | S | S | * | * | | | trans | -149.1 | 112.8 | 164.4 | -71.5 | -72 | 0 | 0 | 0 | 110.5 | | |
| 240 | H | 42.6 | Very low | 42.7 | Very low | 194 Ų | 194 | 142.8 Ų | 142.8 | 90% | 0.898 | 84% | 0.843 | S | S | * | * | | | trans | -176.5 | 96.2 | 145.8 | -72.6 | -43.2 | 0 | 0 | 0 | 105.5 | | |
| 241 | L | 41.1 | Very low | 42.7 | Very low | 164 Ų | 164 | 137 Ų | 137 | 86% | 0.859 | 83% | 0.834 | S | S | * | * | | | | 95.4 | 110.1 | 75.1 | -174.2 | 64.1 | 0 | 0 | 0 | 112.5 | | |
| 242 | M | 43.8 | Very low | 42.7 | Very low | 185 Ų | 185 | 135.5 Ų | 135.5 | 91% | 0.911 | 83% | 0.832 | S | S | * | * | | | trans | -32.2 | 141.5 | 163.8 | -179.5 | -174.9 | -64.9 | 0 | 0 | 117.4 | | |
| 243 | G | 38.9 | Very low | 42.8 | Very low | 76 Ų | 76 | 134.7 Ų | 134.7 | 78% | 0.784 | 83% | 0.833 | S | S | * | * | | | trans | 149.2 | 127.1 | 165.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | | |
| 244 | G | 40.1 | Very low | 43.2 | Very low | 87 Ų | 87 | 134.5 Ų | 134.5 | 90% | 0.897 | 84% | 0.837 | S | S | * | * | | | cis | 111.8 | 96.9 | 16.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | | |
| 245 | G | 43.3 | Very low | 43.1 | Very low | 78 Ų | 78 | 131 Ų | 131 | 80% | 0.804 | 84% | 0.837 | S | S | * | * | | | trans | 179.5 | 101.7 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | | |
| 246 | N | 44.1 | Very low | 43.1 | Very low | 178 Ų | 178 | 128.6 Ų | 128.6 | 95% | 0.952 | 83% | 0.829 | S | S | * | * | | | trans | -68.9 | 140.8 | 165.5 | -76.1 | -32.8 | 0 | 0 | 0 | 110.2 | | |
| 247 | G | 42.9 | Very low | 43.2 | Very low | 77 Ų | 77 | 133.3 Ų | 133.3 | 79% | 0.794 | 83% | 0.833 | S | S | * | * | | | trans | -140.7 | 79.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | G249 | G247-G249 PolarHBondContact O-N 2.92Å; G247-G249 VanDerWaalsContact O-N 3.11Å |
| 248 | L | 48.9 | Very low | 43.3 | Very low | 188 Ų | 188 | 133 Ų | 133 | 98% | 0.984 | 83% | 0.832 | S | S | * | * | | | trans | -69.6 | 100.9 | 168.4 | -77.1 | 163.1 | 0 | 0 | 0 | 109.1 | | |
| 249 | G | 45.1 | Very low | 43.2 | Very low | 75 Ų | 75 | 133.8 Ų | 133.8 | 77% | 0.773 | 84% | 0.837 | S | S | * | * | | | trans | -122 | 87.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | G247 | G247-G249 PolarHBondContact O-N 2.92Å; G247-G249 VanDerWaalsContact O-N 3.11Å |
| 250 | N | 47.1 | Very low | 42.7 | Very low | 163 Ų | 163 | 129.5 Ų | 129.5 | 87% | 0.872 | 84% | 0.836 | S | S | * | * | | | trans | -77.4 | 123.5 | 172.3 | -169.8 | -8.3 | 0 | 0 | 0 | 109.1 | | |
| 251 | G | 43.8 | Very low | 42.6 | Very low | 66 Ų | 66 | 129.3 Ų | 129.3 | 68% | 0.68 | 84% | 0.835 | S | S | * | * | | | trans | -167.3 | 93.2 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | G253 | G251-G253 PolarHBondContact O-N 3.11Š|
| 252 | N | 46.7 | Very low | 42.7 | Very low | 169 Ų | 169 | 131.1 Ų | 131.1 | 90% | 0.904 | 84% | 0.839 | S | S | * | * | | | trans | -65.8 | 123.8 | 166.3 | -72.7 | -55.2 | 0 | 0 | 0 | 109.7 | | |
| 253 | G | 40.1 | Very low | 42.8 | Very low | 74 Ų | 74 | 131.3 Ų | 131.3 | 76% | 0.763 | 84% | 0.838 | S | S | * | * | | | trans | -142.6 | 106.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | G251 G255 | G251-G253 PolarHBondContact O-N 3.11Å; G253-G255 PolarHBondContact O-N 2.91Å |
| 254 | L | 47.7 | Very low | 42.9 | Very low | 178 Ų | 178 | 136.5 Ų | 136.5 | 93% | 0.932 | 84% | 0.842 | S | S | * | * | | | trans | -70.8 | 111.8 | 178.8 | -69.4 | 160.9 | 0 | 0 | 0 | 110.8 | | |
| 255 | G | 38.5 | Very low | 42.9 | Very low | 81 Ų | 81 | 141.3 Ų | 141.3 | 84% | 0.835 | 84% | 0.841 | S | S | * | * | | | trans | -97.2 | 93.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | G253 | G253-G255 PolarHBondContact O-N 2.91Š|
| 256 | I | 44.6 | Very low | 42.8 | Very low | 150 Ų | 150 | 146.3 Ų | 146.3 | 77% | 0.769 | 84% | 0.843 | S | S | * | * | | | trans | -83.6 | 130.9 | 163.9 | -64.5 | 160.4 | 0 | 0 | 0 | 108.8 | | |
| 257 | Q | 35.9 | Very low | 42.7 | Very low | 168 Ų | 168 | 147 Ų | 147 | 79% | 0.785 | 84% | 0.84 | S | S | * | * | | | trans | 159.4 | 151.3 | 159.8 | -89.9 | 154.5 | 86 | 0 | 0 | 108.1 | | |
| 258 | H | 39.5 | Very low | 42.6 | Very low | 166 Ų | 166 | 152.1 Ų | 152.1 | 77% | 0.769 | 84% | 0.844 | S | S | * | * | | | cis | -154.4 | 135.1 | -16.2 | -110.6 | -38.9 | 0 | 0 | 0 | 106.9 | | |
| 259 | P | 48.1 | Very low | 42.1 | Very low | 134 Ų | 134 | 152.7 Ų | 152.7 | 87% | 0.87 | 84% | 0.841 | S | S | * | * | | | trans | -96.5 | 120.6 | 174.3 | 34 | -28.8 | 0 | 0 | 0 | 112.2 | | |
| 260 | G | 35.1 | Very low | 41.8 | Very low | 69 Ų | 69 | 157.9 Ų | 157.9 | 71% | 0.711 | 85% | 0.846 | S | S | * | * | | | trans | 151.4 | 157.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 261 | Q | 39.2 | Very low | 41.3 | Very low | 189 Ų | 189 | 158.6 Ų | 158.6 | 88% | 0.883 | 84% | 0.844 | S | S | * | * | | | trans | 73.5 | 74.2 | 178.9 | -52.6 | -71 | 10.2 | 0 | 0 | 117.2 | | |
| 262 | Q | 43.9 | Very low | 40.9 | Very low | 203 Ų | 203 | 164.2 Ų | 164.2 | 95% | 0.949 | 85% | 0.852 | S | S | * | * | | | trans | -163.1 | 40.2 | 144.7 | -115.5 | 168.7 | 51 | 0 | 0 | 114 | | |
| 263 | Q | 46.3 | Very low | 40.4 | Very low | 189 Ų | 189 | 163.9 Ų | 163.9 | 88% | 0.883 | 85% | 0.845 | S | S | * | * | | | trans | -126 | 61.7 | 180 | -153.4 | 179.7 | 33.3 | 0 | 0 | 111.7 | | |
| 264 | Q | 39.6 | Very low | 40.4 | Very low | 185 Ų | 185 | 169.3 Ų | 169.3 | 86% | 0.864 | 85% | 0.85 | S | S | * | * | | | trans | -174.3 | 137.1 | 162 | -105.8 | 162.7 | 25.7 | 0 | 0 | 109.8 | | |
| 265 | Q | 40.5 | Very low | 40.4 | Very low | 187 Ų | 187 | 166.1 Ų | 166.1 | 87% | 0.874 | 84% | 0.84 | S | S | * | * | | | trans | 89.3 | 121.9 | -167.6 | -56.3 | 178.9 | 28.9 | 0 | 0 | 113.3 | | |
| 266 | Q | 41.6 | Very low | 40.2 | Very low | 184 Ų | 184 | 165.8 Ų | 165.8 | 86% | 0.86 | 84% | 0.836 | S | S | * | * | | | cis | -127.7 | 118 | 8.6 | -67.5 | 174.6 | -8.8 | 0 | 0 | 111.7 | | |
| 267 | Q | 42.6 | Very low | 39.8 | Very low | 191 Ų | 191 | 167.5 Ų | 167.5 | 89% | 0.893 | 84% | 0.841 | S | S | * | * | | | trans | -120.6 | 76 | 165.6 | -166.5 | -174.8 | 88.1 | 0 | 0 | 107.6 | | |
| 268 | Q | 39.5 | Very low | 40 | Very low | 185 Ų | 185 | 170 Ų | 170 | 86% | 0.864 | 85% | 0.845 | S | S | * | * | | | trans | -176.5 | 92 | 163.6 | -109.6 | 169.6 | 69 | 0 | 0 | 112 | | |
| 269 | Q | 38.8 | Very low | 40.2 | Very low | 200 Ų | 200 | 169.9 Ų | 169.9 | 94% | 0.935 | 85% | 0.85 | S | S | * | * | | | trans | -164.5 | 86.1 | 133.3 | -111.4 | 174.5 | 72.7 | 0 | 0 | 109.8 | | |
| 270 | Q | 39.6 | Very low | 40 | Very low | 185 Ų | 185 | 167.4 Ų | 167.4 | 86% | 0.864 | 84% | 0.841 | S | S | * | * | | | trans | -81.7 | 124 | 154.6 | -70.4 | -179.3 | 8.1 | 0 | 0 | 107.7 | | |
| 271 | Q | 36.3 | Very low | 40.2 | Very low | 178 Ų | 178 | 168.9 Ų | 168.9 | 83% | 0.832 | 83% | 0.832 | S | S | * | * | | | | 166.9 | 87.3 | 129.5 | -92 | 179 | 55.4 | 0 | 0 | 111.2 | | |
| 272 | Q | 35.7 | Very low | 40.7 | Very low | 183 Ų | 183 | 168 Ų | 168 | 86% | 0.855 | 83% | 0.833 | S | S | * | * | | | trans | -162.6 | 94 | 138.6 | -110.2 | 151.5 | 98.4 | 0 | 0 | 111.9 | | |
| 273 | Q | 35.3 | Very low | 41 | Very low | 162 Ų | 162 | 166.5 Ų | 166.5 | 76% | 0.757 | 83% | 0.831 | S | S | * | * | | | trans | 56.7 | 122.2 | 131.9 | -60.5 | -174.7 | 12.2 | 0 | 0 | 121.4 | | |
| 274 | H | 39.8 | Very low | 40.7 | Very low | 189 Ų | 189 | 162.7 Ų | 162.7 | 88% | 0.875 | 82% | 0.816 | S | S | * | * | | | trans | 96.7 | 146.6 | 149.4 | -61.1 | -43.4 | 0 | 0 | 0 | 120.5 | | |
| 275 | P | 47.6 | Very low | 40.6 | Very low | 111 Ų | 111 | 162.7 Ų | 162.7 | 72% | 0.721 | 82% | 0.816 | S | S | * | * | | | trans | -131.2 | 164.7 | -132.7 | 43 | -29.1 | 0 | 0 | 0 | 117.5 | | |
| 276 | G | 35.1 | Very low | 40.5 | Very low | 73 Ų | 73 | 158.6 Ų | 158.6 | 75% | 0.753 | 81% | 0.814 | S | S | * | * | | | trans | 74.9 | 135.4 | 153.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | | |
| 277 | Q | 35.7 | Very low | 40.6 | Very low | 186 Ų | 186 | 154.2 Ų | 154.2 | 87% | 0.869 | 81% | 0.809 | S | S | * | * | | | cis | -149 | 147.6 | 33 | -69.5 | -174.5 | -2.6 | 0 | 0 | 111.7 | | |
| 278 | Y | 40 | Very low | 40.7 | Very low | 222 Ų | 222 | 149.6 Ų | 149.6 | 87% | 0.871 | 80% | 0.803 | S | S | * | * | | | trans | -76.2 | 139.1 | 166.6 | -71.5 | -93 | 0 | 0 | 0 | 110.3 | A280 | Y278-A280 VanDerWaalsContact C-N 3.26Å; Y278-A280 PolarHBondContact O-N 2.99Å |
| 279 | N | 44.7 | Very low | 40.8 | Very low | 163 Ų | 163 | 149.7 Ų | 149.7 | 87% | 0.872 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -73.2 | 76.5 | 177.8 | -172.3 | 17.6 | 0 | 0 | 0 | 111.4 | | |
| 280 | A | 42.7 | Very low | 41.1 | Very low | 81 Ų | 81 | 143.2 Ų | 143.2 | 67% | 0.669 | 80% | 0.796 | S | S | * | * | | | trans | -136.8 | 53.3 | -176.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y278 | Y278-A280 VanDerWaalsContact C-N 3.26Å; Y278-A280 PolarHBondContact O-N 2.99Å |
| 281 | N | 40.3 | Very low | 41.1 | Very low | 101 Ų | 101 | 143.5 Ų | 143.5 | 54% | 0.54 | 80% | 0.797 | S | S | . | * | | | trans | -143.9 | 21.9 | 179 | -103 | -36.2 | 0 | 0 | 0 | 116 | L283 N284 | N281-L283 VanDerWaalsContact C-N 3.26Å; N281-L283 PolarHBondContact O-N 3.17Å; N281-N284 WeakPolarHBondContact OD1-CB 3.4Å |
| 282 | L | 48.3 | Very low | 41.4 | Very low | 171 Ų | 171 | 144 Ų | 144 | 90% | 0.895 | 80% | 0.802 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.1 | -2.9 | 169 | -117.6 | 70.8 | 0 | 0 | 0 | 114.2 | | |
| 283 | L | 51.7 | Low | 41.3 | Very low | 171 Ų | 171 | 140.9 Ų | 140.9 | 90% | 0.895 | 80% | 0.8 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.4 | 2.3 | -178.7 | -157 | 63.1 | 0 | 0 | 0 | 113.9 | N281 | N281-L283 VanDerWaalsContact C-N 3.26Å; N281-L283 PolarHBondContact O-N 3.17Å |
| 284 | N | 38.9 | Very low | 41 | Very low | 109 Ų | 109 | 137.5 Ų | 137.5 | 58% | 0.583 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -121.7 | 39.5 | -176 | -156.7 | 0.2 | 0 | 0 | 0 | 113.5 | N281 | N281-N284 WeakPolarHBondContact OD1-CB 3.4Š|
| 285 | H | 37.5 | Very low | 40.8 | Very low | 185 Ų | 185 | 139.2 Ų | 139.2 | 86% | 0.856 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -129.7 | 9.3 | 169.6 | -104.6 | 50.6 | 0 | 0 | 0 | 113.5 | | |
| 286 | A | 39.4 | Very low | 40.2 | Very low | 101 Ų | 101 | 138.2 Ų | 138.2 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -98.2 | 1.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | | |
| 287 | A | 44.3 | Very low | 40.5 | Very low | 92 Ų | 92 | 144.4 Ų | 144.4 | 76% | 0.76 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -123.1 | 21.3 | -166.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | | |
| 288 | A | 44.3 | Very low | 40.4 | Very low | 93 Ų | 93 | 141.4 Ų | 141.4 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | S | Bend | trans | -132.8 | 16.6 | -175.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | | |
| 289 | L | 41.3 | Very low | 40.2 | Very low | 187 Ų | 187 | 134.6 Ų | 134.6 | 98% | 0.979 | 80% | 0.801 | S | S | * | * | | | trans | -117.5 | 66.4 | 172.3 | -84.9 | 163.6 | 0 | 0 | 0 | 110.3 | | |
| 290 | G | 45.9 | Very low | 39.6 | Very low | 64 Ų | 64 | 130.6 Ų | 130.6 | 66% | 0.66 | 80% | 0.799 | S | S | * | * | | | trans | -145.9 | 35.2 | -170.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | | |
| 291 | H | 38.8 | Very low | 39.4 | Very low | 191 Ų | 191 | 132.2 Ų | 132.2 | 88% | 0.884 | 81% | 0.805 | S | S | * | * | | | trans | -139.6 | 89.6 | 169.5 | -80.6 | -62.9 | 0 | 0 | 0 | 112.3 | | |
| 292 | M | 42.8 | Very low | 39.3 | Very low | 190 Ų | 190 | 135.6 Ų | 135.6 | 94% | 0.936 | 82% | 0.82 | S | S | * | * | | | trans | -79.3 | 124.3 | 149.6 | -73.3 | -178.2 | -82.1 | 0 | 0 | 108 | | |
| 293 | S | 33.5 | Very low | 38.6 | Very low | 117 Ų | 117 | 139.1 Ų | 139.1 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | | | trans | -163.4 | 136.9 | 149.2 | -146.6 | 0 | 0 | 0 | 0 | 114.3 | | |
| 294 | S | 29.6 | Very low | 38.2 | Very low | 90 Ų | 90 | 137.1 Ų | 137.1 | 63% | 0.629 | 81% | 0.813 | S | S | * | * | | | trans | 48.5 | 108.4 | 158.3 | -142 | 0 | 0 | 0 | 0 | 119.9 | | |
| 295 | Y | 35.4 | Very low | 38.2 | Very low | 225 Ų | 225 | 138.9 Ų | 138.9 | 88% | 0.882 | 82% | 0.818 | S | S | * | * | | | trans | -54.3 | 134.4 | 138.1 | 46 | -87.2 | 0 | 0 | 0 | 109.1 | | |
| 296 | A | 34.8 | Very low | 38.4 | Very low | 90 Ų | 90 | 139.9 Ų | 139.9 | 74% | 0.744 | 82% | 0.822 | S | S | * | * | | | trans | -137.1 | 128.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | | |
| 297 | Q | 41.1 | Very low | 38.2 | Very low | 204 Ų | 204 | 138.9 Ų | 138.9 | 95% | 0.953 | 82% | 0.822 | S | S | * | * | | | trans | -66 | 136.5 | 173.8 | -67.8 | 163.7 | -98.7 | 0 | 0 | 110.3 | | |
| 298 | S | 33.9 | Very low | 37.7 | Very low | 123 Ų | 123 | 138.5 Ų | 138.5 | 86% | 0.86 | 83% | 0.827 | S | S | * | * | | | trans | -148 | 125.3 | 153.7 | -169.9 | 0 | 0 | 0 | 0 | 108.7 | | |
| 299 | G | 35.2 | Very low | 37.3 | Very low | 78 Ų | 78 | 139 Ų | 139 | 80% | 0.804 | 83% | 0.831 | S | S | * | * | | | trans | -91.2 | 167.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | | |
| 300 | G | 32.7 | Very low | 37.5 | Very low | 80 Ų | 80 | 139.1 Ų | 139.1 | 83% | 0.825 | 83% | 0.829 | S | S | * | * | | | trans | 166.6 | 89.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113 | | |
| 301 | S | 37.7 | Very low | 37.5 | Very low | 115 Ų | 115 | 145 Ų | 145 | 80% | 0.804 | 84% | 0.839 | S | S | * | * | | | trans | -68.7 | 157.7 | 163.9 | -61.8 | 0 | 0 | 0 | 0 | 111.2 | | |
| 302 | M | 38.5 | Very low | 37.8 | Very low | 171 Ų | 171 | 142 Ų | 142 | 84% | 0.842 | 84% | 0.836 | S | S | * | * | | | trans | 140.4 | 92.7 | 139.1 | -76.5 | -166.9 | -54.9 | 0 | 0 | 111.6 | | |
| 303 | Y | 33.9 | Very low | 37.5 | Very low | 245 Ų | 245 | 136.4 Ų | 136.4 | 96% | 0.961 | 83% | 0.827 | S | S | * | * | | | trans | -153.5 | 92 | 140.9 | -99.6 | -70.2 | 0 | 0 | 0 | 108 | | |
| 304 | D | 42.6 | Very low | 37.8 | Very low | 129 Ų | 129 | 140.6 Ų | 140.6 | 69% | 0.69 | 84% | 0.836 | S | S | * | * | | | trans | -99.7 | 171.2 | 168.2 | -176.6 | 26.6 | 0 | 0 | 0 | 109.2 | | |
| 305 | H | 39.9 | Very low | 38.5 | Very low | 147 Ų | 147 | 144.4 Ų | 144.4 | 68% | 0.681 | 85% | 0.85 | S | S | * | * | | | trans | 86.4 | 91.2 | 172.2 | -47.6 | -36.1 | 0 | 0 | 0 | 116.8 | | |
| 306 | H | 40.9 | Very low | 38.4 | Very low | 205 Ų | 205 | 137.1 Ų | 137.1 | 95% | 0.949 | 84% | 0.843 | S | S | * | * | | | | -144.2 | 96.4 | 114.8 | -86.5 | -60.6 | 0 | 0 | 0 | 109.8 | | |
| 307 | G | 34.8 | Very low | 38.5 | Very low | 81 Ų | 81 | 136.6 Ų | 136.6 | 84% | 0.835 | 85% | 0.846 | S | S | * | * | | | trans | -93.6 | 150.8 | 169.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | | |
| 308 | G | 34.9 | Very low | 38.4 | Very low | 83 Ų | 83 | 135.9 Ų | 135.9 | 86% | 0.856 | 85% | 0.845 | S | S | * | * | | | trans | 123.5 | 85.3 | 158.2 | 0 | 0 | 0 | 0 | 0 | 117.1 | | |
| 309 | A | 35.6 | Very low | 39.1 | Very low | 105 Ų | 105 | 135.9 Ų | 135.9 | 87% | 0.868 | 84% | 0.843 | S | S | * | * | | | trans | -163.6 | 123.9 | 139.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | | |
| 310 | M | 45.3 | Very low | 39.4 | Very low | 188 Ų | 188 | 141.9 Ų | 141.9 | 93% | 0.926 | 85% | 0.847 | S | S | * | * | | | trans | -89.2 | 144.6 | 178.1 | -66.1 | -169.6 | -87.7 | 0 | 0 | 111.1 | | |
| 311 | H | 44.6 | Very low | 39.7 | Very low | 189 Ų | 189 | 147 Ų | 147 | 88% | 0.875 | 85% | 0.849 | S | S | * | * | | | trans | -54.2 | 145.1 | 166.9 | -97.1 | 177.4 | 0 | 0 | 0 | 111.2 | | |
| 312 | P | 45.8 | Very low | 40.1 | Very low | 126 Ų | 126 | 149.5 Ų | 149.5 | 82% | 0.818 | 85% | 0.848 | S | S | * | * | | | | -148 | 133.5 | 107.2 | 31 | -12.3 | 0 | 0 | 0 | 116.5 | | |
| 313 | G | 37.1 | Very low | 40.6 | Very low | 73 Ų | 73 | 147.6 Ų | 147.6 | 75% | 0.753 | 85% | 0.848 | S | S | * | * | | | trans | 70.2 | 106.3 | 135 | 0 | 0 | 0 | 0 | 0 | 120.7 | | |
| 314 | M | 38.6 | Very low | 41 | Very low | 205 Ų | 205 | 143 Ų | 143 | 100% | 1.01 | 84% | 0.84 | S | S | * | * | | | trans | -150.9 | 115.1 | 145.6 | -114.1 | 173.3 | 169 | 0 | 0 | 110.6 | | |
| 315 | N | 44.2 | Very low | 40.8 | Very low | 170 Ų | 170 | 140.1 Ų | 140.1 | 91% | 0.909 | 84% | 0.84 | S | S | * | * | | | trans | -119.1 | 128.6 | 174.7 | -176.1 | -9.8 | 0 | 0 | 0 | 107 | | |
| 316 | G | 33.3 | Very low | 41 | Very low | 72 Ų | 72 | 139.5 Ų | 139.5 | 74% | 0.742 | 85% | 0.85 | S | S | * | * | | | trans | 173.4 | 99.9 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113 | | |
| 317 | G | 37.3 | Very low | 41.1 | Very low | 79 Ų | 79 | 135.6 Ų | 135.6 | 81% | 0.814 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 159.1 | -167.9 | 0 | 0 | 0 | 0 | 0 | 117.6 | | |
| 318 | M | 38.7 | Very low | 41.3 | Very low | 189 Ų | 189 | 135.7 Ų | 135.7 | 93% | 0.931 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -96.3 | 140.6 | 163.4 | -61 | -176.8 | -165.6 | 0 | 0 | 110.1 | | |
| 319 | P | 48.8 | Very low | 41.5 | Very low | 124 Ų | 124 | 136.9 Ų | 136.9 | 81% | 0.805 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 145.1 | -178.6 | 30.8 | -34.4 | 0 | 0 | 0 | 112.9 | | |
| 320 | K | 41.5 | Very low | 41.5 | Very low | 204 Ų | 204 | 136 Ų | 136 | 89% | 0.887 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 133.5 | 171.7 | -80.5 | 179 | 172.2 | 176.9 | 0 | 111.2 | | |
| 321 | Q | 39.9 | Very low | 40.9 | Very low | 188 Ų | 188 | 130.6 Ų | 130.6 | 88% | 0.879 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 145.7 | 161.1 | -70.6 | 178.6 | -11.6 | 0 | 0 | 110.5 | | |
| 322 | Q | 45.2 | Very low | 41 | Very low | 166 Ų | 166 | 127 Ų | 127 | 78% | 0.776 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -95.6 | 138.7 | 178.8 | -63.6 | 173 | -22.9 | 0 | 0 | 110.9 | L324 | Q322-L324 HydrophobicContact CB-CD1 4.23Š|
| 323 | P | 49.3 | Very low | 41 | Very low | 131 Ų | 131 | 129.5 Ų | 129.5 | 85% | 0.851 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 127.3 | 158.2 | -9 | 27.2 | 0 | 0 | 0 | 110.5 | | |
| 324 | L | 43.3 | Very low | 41 | Very low | 150 Ų | 150 | 132.4 Ų | 132.4 | 79% | 0.785 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -102.6 | 131.4 | 172.1 | -100.5 | 75 | 0 | 0 | 0 | 111.2 | Q322 | Q322-L324 HydrophobicContact CB-CD1 4.23Š|
| 325 | G | 36.9 | Very low | 41.1 | Very low | 68 Ų | 68 | 133.8 Ų | 133.8 | 70% | 0.701 | 83% | 0.826 | S | S | * | * | | | trans | 84.3 | 146.9 | 165.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | | |
| 326 | P | 45.3 | Very low | 40.7 | Very low | 134 Ų | 134 | 131.4 Ų | 131.4 | 87% | 0.87 | 82% | 0.818 | S | S | * | * | | | cis | -129 | 143.5 | 40.7 | 38 | -24.8 | 0 | 0 | 0 | 116.1 | | |
| 327 | P | 42.7 | Very low | 40.5 | Very low | 122 Ų | 122 | 137.3 Ų | 137.3 | 79% | 0.792 | 82% | 0.819 | S | S | * | * | | | trans | -102.7 | 132.3 | 156.6 | 5.9 | 15.3 | 0 | 0 | 0 | 110.5 | | |
| 328 | G | 38.6 | Very low | 40.4 | Very low | 83 Ų | 83 | 140.7 Ų | 140.7 | 86% | 0.856 | 82% | 0.815 | S | S | * | * | | | trans | -76.6 | 166 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | | |
| 329 | A | 39.2 | Very low | 40.1 | Very low | 109 Ų | 109 | 135.6 Ų | 135.6 | 90% | 0.901 | 81% | 0.811 | S | S | * | * | | | trans | -119.4 | 119.1 | 167.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | | |
| 330 | G | 34.8 | Very low | 39.4 | Very low | 86 Ų | 86 | 133.4 Ų | 133.4 | 89% | 0.887 | 81% | 0.811 | S | S | * | * | | | trans | -98.4 | 170.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 331 | G | 32.8 | Very low | 39.1 | Very low | 74 Ų | 74 | 132.9 Ų | 132.9 | 76% | 0.763 | 81% | 0.812 | S | S | * | * | | | trans | -176.3 | 112 | 173 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 332 | P | 47.2 | Very low | 38.9 | Very low | 113 Ų | 113 | 130.4 Ų | 130.4 | 73% | 0.734 | 81% | 0.81 | S | S | * | * | | | trans | -87.4 | 147 | 171.7 | 34.9 | -31.6 | 0 | 0 | 0 | 110.5 | | |
| 333 | Q | 47 | Very low | 38.3 | Very low | 180 Ų | 180 | 128.6 Ų | 128.6 | 84% | 0.841 | 81% | 0.81 | S | S | * | * | | | trans | -142.9 | 124.3 | 162.1 | -73 | -57.5 | -32.9 | 0 | 0 | 110 | | |
| 334 | D | 35.8 | Very low | 37.8 | Very low | 133 Ų | 133 | 129 Ų | 129 | 71% | 0.711 | 81% | 0.81 | S | S | * | * | | | trans | -76.7 | 139.1 | 179.6 | -61.2 | -72.7 | 0 | 0 | 0 | 111.9 | | |
| 335 | Y | 40.6 | Very low | 37.6 | Very low | 235 Ų | 235 | 127.4 Ų | 127.4 | 92% | 0.922 | 81% | 0.809 | S | S | * | * | | | trans | -130.7 | 114.2 | 150.7 | -85.5 | -81.1 | 0 | 0 | 0 | 108.6 | | |
| 336 | V | 36.2 | Very low | 37.5 | Very low | 119 Ų | 119 | 133.4 Ų | 133.4 | 72% | 0.721 | 82% | 0.821 | S | S | * | * | | | trans | -102.1 | 153.1 | -177 | 175 | 0 | 0 | 0 | 0 | 109.6 | | |
| 337 | Y | 28.7 | Very low | 36.8 | Very low | 197 Ų | 197 | 130.7 Ų | 130.7 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | | | trans | 77.9 | 137.1 | 171.7 | -126 | -140.1 | 0 | 0 | 0 | 113.9 | | |
| 338 | M | 35.9 | Very low | 36.5 | Very low | 149 Ų | 149 | 129.9 Ų | 129.9 | 73% | 0.734 | 82% | 0.82 | S | S | * | * | | | cis | -161.1 | 131.8 | 17.6 | -165.2 | 176.9 | -173.1 | 0 | 0 | 111.2 | | |
| 339 | G | 32.4 | Very low | 36.4 | Very low | 82 Ų | 82 | 130.1 Ų | 130.1 | 85% | 0.845 | 82% | 0.815 | S | S | * | * | | | trans | 82.8 | 117.1 | 155.2 | 0 | 0 | 0 | 0 | 0 | 120.7 | | |
| 340 | G | 34.3 | Very low | 36.4 | Very low | 78 Ų | 78 | 133.7 Ų | 133.7 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | | | trans | 103.5 | 119.3 | 150.4 | 0 | 0 | 0 | 0 | 0 | 117.9 | | |
| 341 | Q | 34.6 | Very low | 36.4 | Very low | 193 Ų | 193 | 138.6 Ų | 138.6 | 90% | 0.902 | 82% | 0.817 | S | S | * | * | | | trans | -62.3 | 143.8 | 158.9 | -61.6 | 157.7 | -75.1 | 0 | 0 | 108.2 | | |
| 342 | T | 34.9 | Very low | 37 | Very low | 136 Ų | 136 | 140.3 Ų | 140.3 | 83% | 0.834 | 82% | 0.815 | S | S | * | * | | | cis | -159.8 | 149.2 | 45.3 | -47.5 | 0 | 0 | 0 | 0 | 110.6 | V344 | T342-V344 PolarHBondContact O-N 3Š|
| 343 | T | 34.3 | Very low | 37.3 | Very low | 129 Ų | 129 | 141 Ų | 141 | 79% | 0.791 | 82% | 0.82 | S | S | * | * | | | trans | -76.1 | 113.2 | -172.9 | -51.6 | 0 | 0 | 0 | 0 | 115.1 | | |
| 344 | V | 37.3 | Very low | 37.1 | Very low | 139 Ų | 139 | 140.8 Ų | 140.8 | 84% | 0.842 | 82% | 0.818 | S | S | * | * | | | trans | -153.1 | 118.6 | 136.6 | -141.4 | 0 | 0 | 0 | 0 | 109.8 | T342 | T342-V344 PolarHBondContact O-N 3Š|
| 345 | P | 39.9 | Very low | 37.3 | Very low | 117 Ų | 117 | 141.2 Ų | 141.2 | 76% | 0.76 | 82% | 0.821 | S | S | * | * | | | trans | -86 | 143.4 | 176.9 | 32.6 | -32.6 | 0 | 0 | 0 | 112.8 | | |
| 346 | M | 35.4 | Very low | 37.5 | Very low | 194 Ų | 194 | 139.4 Ų | 139.4 | 96% | 0.956 | 82% | 0.82 | S | S | * | * | | | trans | -87.5 | 149.3 | 176.3 | -159.9 | 169.6 | -165 | 0 | 0 | 110.4 | | |
| 347 | G | 30.1 | Very low | 37.8 | Very low | 77 Ų | 77 | 144.1 Ų | 144.1 | 79% | 0.794 | 83% | 0.827 | S | S | * | * | | | trans | -173.7 | 50.4 | -176 | 0 | 0 | 0 | 0 | 0 | 115.2 | | |
| 348 | A | 37.2 | Very low | 38.5 | Very low | 104 Ų | 104 | 143.3 Ų | 143.3 | 86% | 0.86 | 83% | 0.832 | S | S | * | * | | | trans | -77.5 | 123.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | | |
| 349 | A | 34.9 | Very low | 38.7 | Very low | 89 Ų | 89 | 142 Ų | 142 | 74% | 0.736 | 83% | 0.828 | S | S | * | * | | | trans | -147.4 | 102.1 | 161.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | | |
| 350 | M | 39 | Very low | 39.1 | Very low | 184 Ų | 184 | 143.2 Ų | 143.2 | 91% | 0.906 | 82% | 0.824 | S | S | * | * | | | trans | 61 | 93.7 | 148.9 | -54.4 | -179.9 | -178.7 | 0 | 0 | 119.7 | | |
| 351 | M | 36.4 | Very low | 39.6 | Very low | 188 Ų | 188 | 144.2 Ų | 144.2 | 93% | 0.926 | 82% | 0.818 | S | S | * | * | | | trans | -143 | 142.8 | 130.6 | -79.6 | -152.3 | 165.2 | 0 | 0 | 110.5 | | |
| 352 | P | 45.5 | Very low | 40 | Very low | 110 Ų | 110 | 138.1 Ų | 138.1 | 71% | 0.714 | 80% | 0.801 | S | S | * | * | | | trans | -77.5 | 158.6 | -172.9 | 31.5 | -35.9 | 0 | 0 | 0 | 113.5 | | |
| 353 | P | 53.1 | Low | 40.5 | Very low | 129 Ų | 129 | 137.3 Ų | 137.3 | 84% | 0.838 | 80% | 0.796 | S | S | * | * | | | trans | -83.9 | 121.2 | -173.2 | 32.4 | -33.3 | 0 | 0 | 0 | 112.1 | | |
| 354 | Q | 42.6 | Very low | 40.8 | Very low | 174 Ų | 174 | 135 Ų | 135 | 81% | 0.813 | 79% | 0.79 | S | S | * | * | | | trans | -126.2 | 116.9 | 166.8 | -85.8 | 170.5 | -33.2 | 0 | 0 | 111.5 | | |
| 355 | N | 39.4 | Very low | 40.9 | Very low | 143 Ų | 143 | 132.5 Ų | 132.5 | 77% | 0.765 | 78% | 0.784 | S | S | * | * | | | trans | 72.3 | 63 | 158.4 | -55.5 | -25 | 0 | 0 | 0 | 119.3 | Y357 | N355-Y357 PolarHBondContact O-N 2.95Š|
| 356 | Q | 44.5 | Very low | 40.9 | Very low | 196 Ų | 196 | 131.3 Ų | 131.3 | 92% | 0.916 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | 34.6 | 158.9 | -67.5 | -169.7 | -8.7 | 0 | 0 | 114.1 | | |
| 357 | Y | 43 | Very low | 41.2 | Very low | 218 Ų | 218 | 129 Ų | 129 | 86% | 0.855 | 78% | 0.775 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.8 | 10.3 | -173.4 | -124.5 | -86.2 | 0 | 0 | 0 | 115.5 | N355 | N355-Y357 PolarHBondContact O-N 2.95Š|
| 358 | M | 43.4 | Very low | 41.6 | Very low | 181 Ų | 181 | 136.4 Ų | 136.4 | 89% | 0.892 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -130.9 | 25.7 | -179.1 | -73.7 | -178.2 | 170.6 | 0 | 0 | 114.2 | | |
| 359 | N | 40.5 | Very low | 41.7 | Very low | 121 Ų | 121 | 139.5 Ų | 139.5 | 65% | 0.647 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -139.2 | 53.7 | 174 | -157.7 | -4.5 | 0 | 0 | 0 | 113.9 | | |
| 360 | S | 40.9 | Very low | 42 | Very low | 107 Ų | 107 | 139.7 Ų | 139.7 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -123.7 | -9.8 | 170.3 | -52.2 | 0 | 0 | 0 | 0 | 113.5 | | |
| 361 | S | 43.7 | Very low | 41.9 | Very low | 99 Ų | 99 | 139.4 Ų | 139.4 | 69% | 0.692 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -91.5 | -20.8 | 178 | 47.1 | 0 | 0 | 0 | 0 | 113.8 | | |
| 362 | A | 43.3 | Very low | 42.2 | Very low | 66 Ų | 66 | 137 Ų | 137 | 55% | 0.545 | 80% | 0.804 | S | S | . | * | S | Bend | trans | -74.1 | -25.8 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | | |
| 363 | V | 45.6 | Very low | 42 | Very low | 118 Ų | 118 | 138.4 Ų | 138.4 | 72% | 0.715 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -85.9 | -17.8 | -174.4 | -176 | 0 | 0 | 0 | 0 | 112.7 | | |
| 364 | A | 40.7 | Very low | 41.4 | Very low | 81 Ų | 81 | 138.9 Ų | 138.9 | 67% | 0.669 | 81% | 0.808 | S | S | * | * | S | Bend | trans | -84 | -14.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | | |
| 365 | A | 39.4 | Very low | 41.3 | Very low | 86 Ų | 86 | 136.9 Ų | 136.9 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | S | Bend | trans | -92.7 | -12.8 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | N367 | A365-N367 PolarHBondContact O-N 3.21Š|
| 366 | A | 39.7 | Very low | 41.4 | Very low | 92 Ų | 92 | 136.5 Ų | 136.5 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -82.9 | -6.8 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | | |
| 367 | N | 42 | Very low | 41.2 | Very low | 146 Ų | 146 | 132.5 Ų | 132.5 | 78% | 0.781 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -125.2 | 50.6 | -168.2 | -155 | 5.2 | 0 | 0 | 0 | 113.3 | A365 | A365-N367 PolarHBondContact O-N 3.21Š|
| 368 | R | 39.3 | Very low | 41.1 | Very low | 232 Ų | 232 | 126.4 Ų | 126.4 | 88% | 0.875 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -143.6 | 26.4 | 174.5 | -145.3 | -165.6 | -68.6 | 175.5 | -1.9 | 114.5 | | |
| 369 | N | 38.8 | Very low | 40.9 | Very low | 169 Ų | 169 | 122.2 Ų | 122.2 | 90% | 0.904 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -129.7 | 43.5 | 176.6 | -151.2 | 15.5 | 0 | 0 | 0 | 111.4 | | |
| 370 | A | 40.8 | Very low | 40.9 | Very low | 94 Ų | 94 | 122.3 Ų | 122.3 | 78% | 0.777 | 80% | 0.804 | S | S | * | * | | | trans | -150.2 | 64.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | | |
| 371 | A | 37.3 | Very low | 40.9 | Very low | 178 Ų | 178 | 123.7 Ų | 123.7 | 100% | 1.471 | 81% | 0.809 | S | S | * | * | | | trans | -156.4 | 0 | 167.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | | |