| 1 | M | 51.8 | Low | 52.6 | Low | 234 Ų | 234 | 116.2 Ų | 116.2 | 100% | 1.153 | 83% | 0.834 | S | S | * | * | | | | 0 | 130.4 | 0 | -78.2 | -79.3 | 111.4 | 0 | 0 | 107.5 | | |
| 2 | P | 54.1 | Low | 52.9 | Low | 124 Ų | 124 | 117.7 Ų | 117.7 | 81% | 0.805 | 83% | 0.833 | S | S | * | * | | | cis | -109.3 | -173.6 | -15.9 | 38.6 | -25.5 | 0 | 0 | 0 | 112.1 | | |
| 3 | G | 49.8 | Very low | 53 | Low | 65 Ų | 65 | 121.5 Ų | 121.5 | 67% | 0.67 | 83% | 0.832 | S | S | * | * | | | trans | -81.8 | -171.8 | 165.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 4 | P | 57.6 | Low | 53.3 | Low | 134 Ų | 134 | 120.9 Ų | 120.9 | 87% | 0.87 | 83% | 0.829 | S | S | * | * | | | | -142.9 | 173.5 | 83.7 | 39.1 | -24.2 | 0 | 0 | 0 | 116.8 | | |
| 5 | Q | 55.4 | Low | 53.6 | Low | 196 Ų | 196 | 123.9 Ų | 123.9 | 92% | 0.916 | 83% | 0.832 | S | S | * | * | | | trans | -62.4 | 154.9 | 177.1 | -62.9 | 139.5 | 41.7 | 0 | 0 | 113.6 | | |
| 6 | G | 48.1 | Very low | 53.3 | Low | 77 Ų | 77 | 119.7 Ų | 119.7 | 79% | 0.794 | 82% | 0.816 | S | S | * | * | | | trans | -165 | 80.2 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | G8 | G6-G8 PolarHBondContact O-N 3.39Š|
| 7 | G | 50.2 | Low | 53.8 | Low | 83 Ų | 83 | 124.6 Ų | 124.6 | 86% | 0.856 | 82% | 0.82 | S | S | * | * | | | trans | -69.9 | 114.8 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | G9 | G7-G9 VanDerWaalsContact C-N 3.33Å; G7-G9 PolarHBondContact O-N 3.36Å |
| 8 | G | 48.8 | Very low | 54 | Low | 84 Ų | 84 | 127 Ų | 127 | 87% | 0.866 | 82% | 0.824 | S | S | * | * | | | trans | -71.5 | 85.5 | 169.8 | 0 | 0 | 0 | 0 | 0 | 111 | G6 | G6-G8 PolarHBondContact O-N 3.39Š|
| 9 | G | 48.9 | Very low | 54.1 | Low | 70 Ų | 70 | 125.6 Ų | 125.6 | 72% | 0.722 | 82% | 0.817 | S | S | * | * | | | trans | -64.2 | 139 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112 | G7 | G7-G9 VanDerWaalsContact C-N 3.33Å; G7-G9 PolarHBondContact O-N 3.36Å |
| 10 | A | 58.5 | Low | 54.2 | Low | 84 Ų | 84 | 125.1 Ų | 125.1 | 69% | 0.694 | 81% | 0.813 | S | S | * | * | | | trans | -61.7 | 148 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | T12 | A10-T12 PolarHBondContact O-N 3.46Š|
| 11 | P | 55.5 | Low | 54.4 | Low | 127 Ų | 127 | 125.9 Ų | 125.9 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | | | trans | -69.2 | 94.8 | 178.8 | 28.8 | -34.7 | 0 | 0 | 0 | 110.7 | M13 | P11-M13 PolarHBondContact O-N 3.4Š|
| 12 | T | 56.2 | Low | 54.4 | Low | 134 Ų | 134 | 120.3 Ų | 120.3 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | | | trans | -67.3 | 101.6 | 169.2 | 55.9 | 0 | 0 | 0 | 0 | 109 | A10 S14 | A10-T12 PolarHBondContact O-N 3.46Å; T12-S14 PolarHBondContact O-N 3.34Å |
| 13 | M | 54.6 | Low | 54.4 | Low | 168 Ų | 168 | 125.5 Ų | 125.5 | 83% | 0.828 | 80% | 0.798 | S | S | * | * | | | trans | -64 | 111.6 | 172.8 | -71.5 | -122.5 | 65.3 | 0 | 0 | 109.2 | P11 L15 | P11-M13 PolarHBondContact O-N 3.4Å; M13-L15 PolarHBondContact O-N 3.44Å |
| 14 | S | 56.1 | Low | 54.1 | Low | 113 Ų | 113 | 125 Ų | 125 | 79% | 0.79 | 79% | 0.793 | S | S | * | * | | | trans | -62.8 | 103.3 | 171.8 | -179.1 | 0 | 0 | 0 | 0 | 108.8 | T12 G16 | T12-S14 PolarHBondContact O-N 3.34Å; S14-G16 VanDerWaalsContact C-N 3.31Å; S14-G16 PolarHBondContact O-N 3.09Å |
| 15 | L | 58.5 | Low | 54.1 | Low | 165 Ų | 165 | 123.4 Ų | 123.4 | 86% | 0.864 | 79% | 0.785 | S | S | * | * | | | trans | -67.2 | 96.4 | 166.5 | -74.4 | 172.9 | 0 | 0 | 0 | 107.5 | M13 K17 | M13-L15 PolarHBondContact O-N 3.44Å; L15-K17 PolarHBondContact O-N 3.28Å |
| 16 | G | 49.2 | Very low | 53.8 | Low | 57 Ų | 57 | 117.8 Ų | 117.8 | 59% | 0.588 | 77% | 0.767 | S | S | * | * | | | trans | -51.4 | 129.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110 | S14 L18 | S14-G16 VanDerWaalsContact C-N 3.31Å; S14-G16 PolarHBondContact O-N 3.09Å; G16-L18 PolarHBondContact O-N 3.4Å |
| 17 | K | 61.5 | Low | 54.3 | Low | 203 Ų | 203 | 119.5 Ų | 119.5 | 88% | 0.883 | 77% | 0.767 | S | S | * | * | | | trans | -57.8 | 106.7 | 178.3 | -66.4 | 172.8 | 179.3 | 175.7 | 0 | 108.6 | L15 S19 | L15-K17 PolarHBondContact O-N 3.28Å; K17-S19 PolarHBondContact O-N 3.4Å |
| 18 | L | 56.6 | Low | 54.7 | Low | 168 Ų | 168 | 121.8 Ų | 121.8 | 88% | 0.88 | 76% | 0.756 | S | S | * | * | | | trans | -65.6 | 104.6 | 166.8 | -67.8 | 177.4 | 0 | 0 | 0 | 107.2 | G16 | G16-L18 PolarHBondContact O-N 3.4Š|
| 19 | S | 56.3 | Low | 55 | Low | 100 Ų | 100 | 120.8 Ų | 120.8 | 70% | 0.699 | 75% | 0.746 | S | S | * | * | | | trans | -52 | 128.6 | 167.8 | -57.6 | 0 | 0 | 0 | 0 | 108.3 | K17 V21 | K17-S19 PolarHBondContact O-N 3.4Å; S19-V21 PolarHBondContact O-N 3.37Å |
| 20 | P | 55.8 | Low | 55.6 | Low | 115 Ų | 115 | 127.4 Ų | 127.4 | 75% | 0.747 | 75% | 0.754 | S | S | * | * | | | trans | -57.9 | 117.6 | 173.8 | -21.8 | 32.5 | 0 | 0 | 0 | 108.4 | V22 | P20-V22 HydrophobicContact CB-CG2 4.4Å; P20-V22 PolarHBondContact O-N 3.05Å |
| 21 | V | 59 | Low | 56 | Low | 143 Ų | 143 | 131.6 Ų | 131.6 | 87% | 0.867 | 75% | 0.752 | S | S | * | * | | | trans | -71.7 | 82.5 | 169.4 | 178 | 0 | 0 | 0 | 0 | 106.6 | S19 W23 | S19-V21 PolarHBondContact O-N 3.37Å; V21-W23 PolarHBondContact O-N 3.34Å |
| 22 | V | 52.5 | Low | 56.7 | Low | 116 Ų | 116 | 136 Ų | 136 | 70% | 0.703 | 75% | 0.752 | S | S | * | * | | | trans | -64.7 | 118.2 | 168 | 176.7 | 0 | 0 | 0 | 0 | 106.2 | P20 G24 | P20-V22 HydrophobicContact CB-CG2 4.4Å; P20-V22 PolarHBondContact O-N 3.05Å; V22-G24 PolarHBondContact O-N 3.14Å |
| 23 | W | 54 | Low | 57.8 | Low | 234 Ų | 234 | 135.9 Ų | 135.9 | 89% | 0.886 | 75% | 0.746 | S | S | * | * | | | trans | -68.8 | 75.8 | 165.9 | -174.1 | -89 | 0 | 0 | 0 | 108.5 | V21 S25 | V21-W23 PolarHBondContact O-N 3.34Å; W23-S25 PolarHBondContact O-N 2.86Å |
| 24 | G | 42.5 | Very low | 58.9 | Low | 54 Ų | 54 | 131 Ų | 131 | 56% | 0.557 | 73% | 0.725 | S | S | * | * | | | trans | -67.2 | 100.6 | 171 | 0 | 0 | 0 | 0 | 0 | 107.7 | V22 S26 | V22-G24 PolarHBondContact O-N 3.14Å; G24-S26 PolarHBondContact O-N 2.98Å |
| 25 | S | 57.1 | Low | 59.8 | Low | 101 Ų | 101 | 129.2 Ų | 129.2 | 71% | 0.706 | 72% | 0.718 | S | S | * | * | | | trans | -62.3 | 87.3 | 165.4 | -171.8 | 0 | 0 | 0 | 0 | 107.8 | W23 S27 | W23-S25 PolarHBondContact O-N 2.86Å; S25-S27 VanDerWaalsContact C-N 3.33Å; S25-S27 PolarHBondContact O-N 3.34Å |
| 26 | S | 49.5 | Very low | 60.6 | Low | 77 Ų | 77 | 128.8 Ų | 128.8 | 54% | 0.538 | 72% | 0.716 | S | S | . | * | | | trans | -76 | 89.1 | -173 | -169 | 0 | 0 | 0 | 0 | 108.4 | G24 Q28 | G24-S26 PolarHBondContact O-N 2.98Å; S26-Q28 PolarHBondContact O-N 2.78Å; S26-Q28 WeakPolarHBondContact OG-CG 3.37Å |
| 27 | S | 59.6 | Low | 62.4 | Low | 114 Ų | 114 | 131.8 Ų | 131.8 | 80% | 0.797 | 72% | 0.717 | S | S | * | * | | | trans | -68.3 | 47.9 | 171.6 | 50 | 0 | 0 | 0 | 0 | 112.1 | S25 G29 | S25-S27 VanDerWaalsContact C-N 3.33Å; S25-S27 PolarHBondContact O-N 3.34Å; S27-G29 PolarHBondContact O-N 3.3Å |
| 28 | Q | 57.4 | Low | 63.2 | Low | 131 Ų | 131 | 127.6 Ų | 127.6 | 61% | 0.612 | 70% | 0.703 | S | S | * | * | | | trans | -65.6 | 103.4 | 164.8 | -74.7 | -66.4 | -17.8 | 0 | 0 | 107.9 | S26 K30 | S26-Q28 PolarHBondContact O-N 2.78Å; S26-Q28 WeakPolarHBondContact OG-CG 3.37Å; Q28-K30 PolarHBondContact O-N 3.16Å |
| 29 | G | 55 | Low | 64.3 | Low | 63 Ų | 63 | 123 Ų | 123 | 65% | 0.649 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.2 | 133.3 | -167.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | S27 R31 | S27-G29 PolarHBondContact O-N 3.3Å; G29-R31 VanDerWaalsContact C-N 3.31Å; G29-R31 PolarHBondContact O-N 3.17Å; G29-R31 VanDerWaalsContact O-N 3.09Å |
| 30 | K | 62.1 | Low | 65.4 | Low | 209 Ų | 209 | 123.1 Ų | 123.1 | 91% | 0.909 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 46.7 | 48.7 | 162.1 | -56.5 | 171.8 | -179.5 | 179.6 | 0 | 113.6 | Q28 R32 | Q28-K30 PolarHBondContact O-N 3.16Å; K30-R32 PolarHBondContact O-N 3.33Å |
| 31 | R | 66.6 | Low | 66.2 | Low | 172 Ų | 172 | 123.3 Ų | 123.3 | 65% | 0.649 | 68% | 0.684 | S | S | * | * | | | trans | -62.5 | 92 | 162.4 | -80 | -171.5 | -79.4 | 168.7 | -5.8 | 108 | G29 L33 | G29-R31 VanDerWaalsContact C-N 3.31Å; G29-R31 PolarHBondContact O-N 3.17Å; G29-R31 VanDerWaalsContact O-N 3.09Å; R31-L33 PolarHBondContact O-N 2.98Å |
| 32 | R | 70.9 | Confident | 67 | Low | 219 Ų | 219 | 122.5 Ų | 122.5 | 83% | 0.826 | 67% | 0.674 | S | S | * | * | | | trans | -57.3 | 107 | -178.5 | -179.4 | 173.4 | 172 | -123.6 | 6 | 108 | K30 T34 | K30-R32 PolarHBondContact O-N 3.33Å; R32-T34 PolarHBondContact O-N 3.43Å; R32-T34 VanDerWaalsContact O-N 3.09Å |
| 33 | L | 79.7 | Confident | 67.8 | Low | 131 Ų | 131 | 120.4 Ų | 120.4 | 69% | 0.686 | 68% | 0.676 | S | S | * | * | | | trans | -56.7 | 114.8 | -179.6 | -62.1 | 172.4 | 0 | 0 | 0 | 108.4 | R31 M37 | R31-L33 PolarHBondContact O-N 2.98Å; L33-M37 HydrophobicContact CD2-CE 4.02Å |
| 34 | T | 76.8 | Confident | 68.6 | Low | 65 Ų | 65 | 114.2 Ų | 114.2 | 40% | 0.399 | 66% | 0.661 | S | S | . | * | | | trans | -84.2 | 152.9 | 170.2 | 55.2 | 0 | 0 | 0 | 0 | 109 | R32 D36 M37 | R32-T34 PolarHBondContact O-N 3.43Å; R32-T34 VanDerWaalsContact O-N 3.09Å; T34-D36 PolarHBondContact O-N 2.84Å; T34-D36 VanDerWaalsContact O-N 3.17Å; T34-M37 WeakPolarHBondContact O-CB 3.36Å; T34-M37 PolarHBondContact O-N 3.12Å; T34-M37 WeakPolarHBondContact OG1-CG 3.39Å |
| 35 | A | 74.3 | Confident | 69.2 | Low | 77 Ų | 77 | 119.1 Ų | 119.1 | 64% | 0.636 | 67% | 0.667 | S | S | * | * | G | 310 helix | trans | -56.2 | -34.7 | -179 | 0 | 0 | 0 | 0 | 0 | 112.1 | M37 I38 | A35-M37 PolarHBondContact O-N 3.01Å; A35-I38 WeakPolarHBondContact O-CB 3.26Å; A35-I38 PolarHBondContact O-N 3.32Å |
| 36 | D | 76.2 | Confident | 69.5 | Low | 155 Ų | 155 | 123.9 Ų | 123.9 | 83% | 0.829 | 67% | 0.669 | S | S | * | * | G | 310 helix | trans | -68.4 | -14.2 | 179.2 | -40.6 | -46.7 | 0 | 0 | 0 | 113.9 | T34 I38 | T34-D36 PolarHBondContact O-N 2.84Å; T34-D36 VanDerWaalsContact O-N 3.17Å; D36-I38 VanDerWaalsContact C-N 3.35Å |
| 37 | M | 86.8 | Confident | 70.3 | Confident | 120 Ų | 120 | 128.5 Ų | 128.5 | 59% | 0.591 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -85.1 | -9.9 | 170.9 | -67 | 176.4 | 57.9 | 0 | 0 | 112.8 | L33 T34 A35 | L33-M37 HydrophobicContact CD2-CE 4.02Å; T34-M37 WeakPolarHBondContact O-CB 3.36Å; T34-M37 PolarHBondContact O-N 3.12Å; T34-M37 WeakPolarHBondContact OG1-CG 3.39Å; A35-M37 PolarHBondContact O-N 3.01Å |
| 38 | I | 78.9 | Confident | 70.5 | Confident | 116 Ų | 116 | 129 Ų | 129 | 60% | 0.595 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -97.1 | 111.6 | 174.1 | -54.2 | 176.1 | 0 | 0 | 0 | 106.4 | A35 D36 | A35-I38 WeakPolarHBondContact O-CB 3.26Å; A35-I38 PolarHBondContact O-N 3.32Å; D36-I38 VanDerWaalsContact C-N 3.35Å |
| 39 | S | 79.9 | Confident | 70.7 | Confident | 70 Ų | 70 | 130.3 Ų | 130.3 | 49% | 0.49 | 69% | 0.689 | S | S | . | * | | | trans | -57.8 | 143.8 | 175.5 | 54 | 0 | 0 | 0 | 0 | 110.5 | | |
| 40 | P | 77.9 | Confident | 70.8 | Confident | 104 Ų | 104 | 130.7 Ų | 130.7 | 68% | 0.675 | 67% | 0.673 | S | S | * | * | | | trans | -49.9 | 151.9 | 164.6 | -24 | 33.7 | 0 | 0 | 0 | 110.6 | L42 | P40-L42 PolarHBondContact O-N 3.03Š|
| 41 | P | 74.2 | Confident | 70.8 | Confident | 119 Ų | 119 | 125.3 Ų | 125.3 | 77% | 0.773 | 66% | 0.658 | S | S | * | * | | | trans | -55 | 115.1 | -179.3 | 22.8 | -33.4 | 0 | 0 | 0 | 110 | G43 | P41-G43 PolarHBondContact O-N 2.95Š|
| 42 | L | 75.8 | Confident | 70.3 | Confident | 125 Ų | 125 | 119.2 Ų | 119.2 | 65% | 0.654 | 65% | 0.649 | S | S | * | * | | | trans | -69.1 | 6.7 | -167.4 | -77.7 | 153.2 | 0 | 0 | 0 | 114.4 | P40 D44 | P40-L42 PolarHBondContact O-N 3.03Å; L42-D44 WeakPolarHBondContact CB-OD1 3.48Å; L42-D44 PolarHBondContact O-N 2.93Å; L42-D44 VanDerWaalsContact O-N 3.09Å |
| 43 | G | 68.9 | Low | 69.6 | Low | 72 Ų | 72 | 121.6 Ų | 121.6 | 74% | 0.742 | 66% | 0.658 | S | S | * | * | S | Bend | trans | 67.3 | 0 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | P41 | P41-G43 PolarHBondContact O-N 2.95Š|
| 44 | D | 70.3 | Confident | 68.8 | Low | 104 Ų | 104 | 119.1 Ų | 119.1 | 56% | 0.556 | 66% | 0.664 | S | S | * | * | | | trans | -92 | -8.9 | -174.4 | 71.6 | -26.8 | 0 | 0 | 0 | 113.8 | L42 R46 | L42-D44 WeakPolarHBondContact CB-OD1 3.48Å; L42-D44 PolarHBondContact O-N 2.93Å; L42-D44 VanDerWaalsContact O-N 3.09Å; D44-R46 PolarHBondContact O-N 2.9Å |
| 45 | F | 56.2 | Low | 68.2 | Low | 158 Ų | 158 | 118.4 Ų | 118.4 | 69% | 0.693 | 67% | 0.67 | S | S | * | * | | | trans | -67 | 62.4 | 169.2 | -74 | -80.5 | 0 | 0 | 0 | 112.4 | H47 | F45-H47 PolarHBondContact O-N 2.78Š|
| 46 | R | 62.9 | Low | 67.6 | Low | 201 Ų | 201 | 119.6 Ų | 119.6 | 76% | 0.758 | 67% | 0.665 | S | S | * | * | | | trans | -76.7 | 102 | 163.5 | -51.2 | -173.5 | 81.1 | -109.3 | 1.7 | 106.1 | D44 T48 | D44-R46 PolarHBondContact O-N 2.9Å; R46-T48 VanDerWaalsContact C-N 3.3Å; R46-T48 PolarHBondContact O-N 3.34Å |
| 47 | H | 65.2 | Low | 66.9 | Low | 173 Ų | 173 | 117.1 Ų | 117.1 | 80% | 0.801 | 66% | 0.655 | S | S | * | * | | | trans | -60.5 | 93.2 | 171.2 | -68.3 | -67.1 | 0 | 0 | 0 | 109.6 | F45 | F45-H47 PolarHBondContact O-N 2.78Š|
| 48 | T | 64.6 | Low | 65.3 | Low | 125 Ų | 125 | 119.3 Ų | 119.3 | 77% | 0.767 | 66% | 0.662 | S | S | * | * | | | trans | -77.6 | -13 | 173.7 | 51.3 | 0 | 0 | 0 | 0 | 112.2 | R46 H50 | R46-T48 VanDerWaalsContact C-N 3.3Å; R46-T48 PolarHBondContact O-N 3.34Å; T48-H50 PolarHBondContact O-N 3.4Å |
| 49 | M | 61.4 | Low | 64.6 | Low | 159 Ų | 159 | 116.5 Ų | 116.5 | 78% | 0.783 | 66% | 0.662 | S | S | * | * | | | trans | -76.9 | 66.3 | 174.4 | -164.4 | 164.7 | -69.2 | 0 | 0 | 110.9 | V51 | M49-V51 HydrophobicContact CG-CG2 3.92Å; M49-V51 PolarHBondContact O-N 2.86Å |
| 50 | H | 57.7 | Low | 63.7 | Low | 71 Ų | 71 | 118.5 Ų | 118.5 | 33% | 0.329 | 67% | 0.667 | S | S | . | * | | | trans | -66.5 | 107.8 | 158.4 | 165.4 | 50.7 | 0 | 0 | 0 | 108.1 | T48 G52 G54 G55 D56 | T48-H50 PolarHBondContact O-N 3.4Å; H50-G52 PolarHBondContact CD2-O 3.44Å; H50-G52 PolarHBondContact CE1-N 2.92Å; H50-G52 VanDerWaalsContact NE2-CA 3.27Å; H50-G52 WeakPolarHBondContact NE2-CA 3.41Å; H50-G52 PolarHBondContact NE2-N 2.97Å; H50-G52 PolarHBondContact NE2-O 2.85Å; H50-G52 PolarHBondContact O-N 3.11Å; H50-G52 VanDerWaalsContact O-N 3.15Å; H50-G54 PolarHBondContact NE2-N 3.42Å; H50-G55 WeakPolarHBondContact CE1-CA 3.3Å; H50-G55 PolarHBondContact CE1-N 2.99Å; H50-G55 PolarHBondContact NE2-N 3.27Å; H50-D56 PolarHBondContact CE1-N 3.33Å; H50-D56 PolarHBondContact CE1-O 3.31Å |
| 51 | V | 60.7 | Low | 62.8 | Low | 95 Ų | 95 | 117.3 Ų | 117.3 | 58% | 0.576 | 66% | 0.658 | S | S | * | * | | | trans | -84.8 | 84.6 | 177.7 | -176.5 | 0 | 0 | 0 | 0 | 109.5 | M49 | M49-V51 HydrophobicContact CG-CG2 3.92Å; M49-V51 PolarHBondContact O-N 2.86Å |
| 52 | G | 56.6 | Low | 62.3 | Low | 45 Ų | 45 | 114 Ų | 114 | 46% | 0.464 | 64% | 0.638 | S | S | . | * | S | Bend | trans | 170.9 | 177 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | H50 | H50-G52 PolarHBondContact CD2-O 3.44Å; H50-G52 PolarHBondContact CE1-N 2.92Å; H50-G52 VanDerWaalsContact NE2-CA 3.27Å; H50-G52 WeakPolarHBondContact NE2-CA 3.41Å; H50-G52 PolarHBondContact NE2-N 2.97Å; H50-G52 PolarHBondContact NE2-O 2.85Å; H50-G52 PolarHBondContact O-N 3.11Å; H50-G52 VanDerWaalsContact O-N 3.15Å |
| 53 | R | 57.6 | Low | 61.4 | Low | 268 Ų | 268 | 114.8 Ų | 114.8 | 100% | 1.011 | 64% | 0.636 | S | S | * | * | S | Bend | trans | -105.6 | 62 | 174.1 | -164.5 | -179.3 | 180 | 167 | 0.7 | 110.5 | | |
| 54 | G | 63 | Low | 60.9 | Low | 79 Ų | 79 | 117.4 Ų | 117.4 | 81% | 0.814 | 63% | 0.632 | S | S | * | * | S | Bend | trans | 144.8 | 7.9 | 166.8 | 0 | 0 | 0 | 0 | 0 | 119.1 | H50 | H50-G54 PolarHBondContact NE2-N 3.42Š|
| 55 | G | 62.3 | Low | 60.7 | Low | 51 Ų | 51 | 116.8 Ų | 116.8 | 53% | 0.526 | 64% | 0.636 | S | S | . | * | S | Bend | trans | 130.5 | -17 | 174 | 0 | 0 | 0 | 0 | 0 | 115.4 | H50 V57 | H50-G55 WeakPolarHBondContact CE1-CA 3.3Å; H50-G55 PolarHBondContact CE1-N 2.99Å; H50-G55 PolarHBondContact NE2-N 3.27Å; G55-V57 PolarHBondContact O-N 3.2Å |
| 56 | D | 63.1 | Low | 60.5 | Low | 101 Ų | 101 | 115.5 Ų | 115.5 | 54% | 0.54 | 64% | 0.636 | S | S | . | * | | | trans | -78 | 113.7 | -178.3 | -165 | -3.1 | 0 | 0 | 0 | 113.9 | H50 F58 | H50-D56 PolarHBondContact CE1-N 3.33Å; H50-D56 PolarHBondContact CE1-O 3.31Å; D56-F58 PolarHBondContact O-N 3.35Å; D56-F58 VanDerWaalsContact O-N 3.16Å |
| 57 | V | 61.9 | Low | 60 | Low | 103 Ų | 103 | 114.8 Ų | 114.8 | 62% | 0.624 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -69.3 | -11.1 | -170.7 | 171.6 | 0 | 0 | 0 | 0 | 113.5 | G55 | G55-V57 PolarHBondContact O-N 3.2Š|
| 58 | F | 52 | Low | 59.2 | Low | 166 Ų | 166 | 110.2 Ų | 110.2 | 73% | 0.728 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -119.5 | 135.5 | 175.7 | -73.1 | -90.1 | 0 | 0 | 0 | 111.6 | D56 D60 | D56-F58 PolarHBondContact O-N 3.35Å; D56-F58 VanDerWaalsContact O-N 3.16Å; F58-D60 PolarHBondContact O-N 3.31Å |
| 59 | G | 63.5 | Low | 58.1 | Low | 57 Ų | 57 | 107.8 Ų | 107.8 | 59% | 0.588 | 64% | 0.641 | S | S | * | * | | | trans | -55.9 | 123.5 | -172 | 0 | 0 | 0 | 0 | 0 | 113.8 | T61 | G59-T61 PolarHBondContact O-N 2.94Š|
| 60 | D | 61.9 | Low | 57.5 | Low | 113 Ų | 113 | 106.6 Ų | 106.6 | 60% | 0.604 | 65% | 0.648 | S | S | * | * | | | trans | 9.3 | 98.1 | 164.2 | -169.1 | 19 | 0 | 0 | 0 | 116.7 | F58 S62 | F58-D60 PolarHBondContact O-N 3.31Å; D60-S62 PolarHBondContact O-N 3.35Å; D60-S62 VanDerWaalsContact O-N 3.16Å; D60-S62 WeakPolarHBondContact OD1-CB 3.1Å; D60-S62 PolarHBondContact OD1-N 2.98Å; D60-S62 VanDerWaalsContact OD1-N 3.08Å; D60-S62 PolarHBondContact OD1-OG 3.39Å; D60-S62 WeakPolarHBondContact OD2-CB 3.4Å; D60-S62 PolarHBondContact OD2-OG 3.42Å |
| 61 | T | 60 | Low | 56.7 | Low | 78 Ų | 78 | 108.2 Ų | 108.2 | 48% | 0.479 | 67% | 0.667 | S | S | . | * | G | 310 helix | trans | -78.8 | 17.3 | 173.8 | 56 | 0 | 0 | 0 | 0 | 113.6 | G59 F63 L64 | G59-T61 PolarHBondContact O-N 2.94Å; T61-F63 HydrophobicContact CG2-CE1 4.33Å; T61-F63 PolarHBondContact O-N 2.9Å; T61-L64 WeakPolarHBondContact O-CB 3.26Å; T61-L64 PolarHBondContact O-N 2.97Å |
| 62 | S | 62 | Low | 56.2 | Low | 51 Ų | 51 | 115.7 Ų | 115.7 | 36% | 0.357 | 69% | 0.685 | S | S | . | * | G | 310 helix | trans | -52.6 | -24.7 | 175.8 | 60.5 | 0 | 0 | 0 | 0 | 114.4 | D60 L64 S65 | D60-S62 PolarHBondContact O-N 3.35Å; D60-S62 VanDerWaalsContact O-N 3.16Å; D60-S62 WeakPolarHBondContact OD1-CB 3.1Å; D60-S62 PolarHBondContact OD1-N 2.98Å; D60-S62 VanDerWaalsContact OD1-N 3.08Å; D60-S62 PolarHBondContact OD1-OG 3.39Å; D60-S62 WeakPolarHBondContact OD2-CB 3.4Å; D60-S62 PolarHBondContact OD2-OG 3.42Å; S62-L64 PolarHBondContact O-N 3.48Å; S62-S65 WeakPolarHBondContact O-CA 3.42Å; S62-S65 WeakPolarHBondContact O-CB 3.27Å; S62-S65 PolarHBondContact O-N 2.85Å |
| 63 | F | 58.3 | Low | 55.9 | Low | 140 Ų | 140 | 116.2 Ų | 116.2 | 61% | 0.614 | 69% | 0.691 | S | S | * | * | G | 310 helix | trans | -62.2 | -23 | 171.8 | 66.9 | -92.8 | 0 | 0 | 0 | 113.9 | T61 | T61-F63 HydrophobicContact CG2-CE1 4.33Å; T61-F63 PolarHBondContact O-N 2.9Å |
| 64 | L | 58.6 | Low | 55.1 | Low | 127 Ų | 127 | 109.8 Ų | 109.8 | 67% | 0.665 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -79.7 | -20.8 | 170.3 | -60.4 | -179.6 | 0 | 0 | 0 | 112.8 | T61 S62 | T61-L64 WeakPolarHBondContact O-CB 3.26Å; T61-L64 PolarHBondContact O-N 2.97Å; S62-L64 PolarHBondContact O-N 3.48Å |
| 65 | S | 64.7 | Low | 54.2 | Low | 92 Ų | 92 | 115.4 Ų | 115.4 | 64% | 0.643 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | -27.8 | -176.3 | -163.2 | 0 | 0 | 0 | 0 | 112.9 | S62 H67 | S62-S65 WeakPolarHBondContact O-CA 3.42Å; S62-S65 WeakPolarHBondContact O-CB 3.27Å; S62-S65 PolarHBondContact O-N 2.85Å; S65-H67 PolarHBondContact O-N 3.18Å |
| 66 | N | 53.6 | Low | 53.4 | Low | 130 Ų | 130 | 123.1 Ų | 123.1 | 70% | 0.695 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.5 | 22.7 | -164.5 | -72 | -8.2 | 0 | 0 | 0 | 115.6 | | |
| 67 | H | 51.1 | Low | 52.8 | Low | 187 Ų | 187 | 121 Ų | 121 | 87% | 0.866 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -110.7 | 60 | 165.2 | -72.6 | -36.9 | 0 | 0 | 0 | 113.1 | S65 | S65-H67 PolarHBondContact O-N 3.18Š|
| 68 | G | 48.7 | Very low | 52.5 | Low | 77 Ų | 77 | 121.2 Ų | 121.2 | 79% | 0.794 | 70% | 0.696 | S | S | * | * | S | Bend | trans | 102.8 | 101.8 | 144.6 | 0 | 0 | 0 | 0 | 0 | 117 | | |
| 69 | G | 40.7 | Very low | 52.7 | Low | 73 Ų | 73 | 120.2 Ų | 120.2 | 75% | 0.753 | 69% | 0.687 | S | S | * | * | | | trans | 126.2 | 98.2 | 144.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | S71 | G69-S71 PolarHBondContact O-N 2.95Å; G69-S71 VanDerWaalsContact O-N 3.14Å |
| 70 | S | 50.6 | Low | 52.7 | Low | 135 Ų | 135 | 121 Ų | 121 | 94% | 0.944 | 68% | 0.678 | S | S | * | * | | | trans | -52.2 | 115.1 | 159.1 | -61.2 | 0 | 0 | 0 | 0 | 110.9 | | |
| 71 | S | 40.2 | Very low | 53.1 | Low | 104 Ų | 104 | 122 Ų | 122 | 73% | 0.727 | 68% | 0.677 | S | S | * | * | | | trans | -138 | 97.7 | 163.4 | -172.3 | 0 | 0 | 0 | 0 | 109.7 | G69 G73 | G69-S71 PolarHBondContact O-N 2.95Å; G69-S71 VanDerWaalsContact O-N 3.14Å; S71-G73 PolarHBondContact O-N 3.09Å |
| 72 | R | 50.8 | Low | 53.5 | Low | 252 Ų | 252 | 122 Ų | 122 | 95% | 0.951 | 67% | 0.674 | S | S | * | * | | | trans | -54.8 | 127.7 | 157.3 | -83.3 | 155.1 | 50.8 | -175.4 | -4.2 | 107.9 | | |
| 73 | G | 49.3 | Very low | 53.7 | Low | 57 Ų | 57 | 120.5 Ų | 120.5 | 59% | 0.588 | 67% | 0.665 | S | S | * | * | S | Bend | trans | 112 | 127 | 165.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | S71 | S71-G73 PolarHBondContact O-N 3.09Š|
| 74 | T | 41.5 | Very low | 54.2 | Low | 133 Ų | 133 | 119.4 Ų | 119.4 | 82% | 0.816 | 66% | 0.66 | S | S | * | * | | | trans | 68.7 | 113.3 | 154.4 | -44.2 | 0 | 0 | 0 | 0 | 117.6 | R76 | T74-R76 PolarHBondContact O-N 3.27Š|
| 75 | H | 42.6 | Very low | 54.6 | Low | 196 Ų | 196 | 119.1 Ų | 119.1 | 91% | 0.907 | 65% | 0.653 | S | S | * | * | | | trans | -31.9 | 90.3 | 168 | -58.3 | -98.1 | 0 | 0 | 0 | 114.9 | S77 | H75-S77 PolarHBondContact O-N 3.48Š|
| 76 | R | 45.5 | Very low | 54.8 | Low | 214 Ų | 214 | 118.3 Ų | 118.3 | 81% | 0.808 | 64% | 0.641 | S | S | * | * | | | trans | -89 | 97.7 | 168.1 | -165 | 177.7 | -81.3 | -174.6 | -5.9 | 108.9 | T74 | T74-R76 PolarHBondContact O-N 3.27Š|
| 77 | S | 52.3 | Low | 55.3 | Low | 55 Ų | 55 | 117 Ų | 117 | 39% | 0.385 | 63% | 0.631 | S | S | . | * | | | trans | -48.1 | 143.5 | -177.4 | -177.6 | 0 | 0 | 0 | 0 | 113.7 | H75 R79 | H75-S77 PolarHBondContact O-N 3.48Å; S77-R79 PolarHBondContact O-N 3.2Å; S77-R79 WeakPolarHBondContact OG-CG 3.3Å |
| 78 | P | 55.3 | Low | 55.7 | Low | 108 Ų | 108 | 114 Ų | 114 | 70% | 0.701 | 62% | 0.62 | S | S | * | * | G | 310 helix | trans | -59.3 | -12.3 | 177.9 | 23 | -34.3 | 0 | 0 | 0 | 114.9 | N80 F81 | P78-N80 PolarHBondContact O-N 2.99Å; P78-F81 PolarHBondContact O-N 3.32Å |
| 79 | R | 55.8 | Low | 56.1 | Low | 145 Ų | 145 | 115.6 Ų | 115.6 | 55% | 0.547 | 62% | 0.615 | S | S | . | * | G | 310 helix | trans | -44.9 | -9.6 | 169.7 | -74.7 | 176.6 | 124.2 | 93.1 | 8.9 | 116.9 | S77 S208 | S77-R79 PolarHBondContact O-N 3.2Å; S77-R79 WeakPolarHBondContact OG-CG 3.3Å; R79-S208 PolarHBondContact NH2-OG 3.43Å |
| 80 | N | 64.3 | Low | 57 | Low | 74 Ų | 74 | 118.8 Ų | 118.8 | 40% | 0.396 | 60% | 0.604 | S | S | . | * | G | 310 helix | trans | -100.8 | -12.6 | 178.7 | -75.6 | -89.3 | 0 | 0 | 0 | 113.4 | P78 K84 | P78-N80 PolarHBondContact O-N 2.99Å; N80-K84 VanDerWaalsContact O-CB 3.3Å; N80-K84 WeakPolarHBondContact O-CB 3.45Å; N80-K84 VanDerWaalsContact O-CD 3.26Å; N80-K84 WeakPolarHBondContact O-CD 3.16Å; N80-K84 WeakPolarHBondContact O-CG 3.46Å; N80-K84 PolarHBondContact O-N 3.19Å |
| 81 | F | 70.3 | Confident | 57.1 | Low | 135 Ų | 135 | 122.9 Ų | 122.9 | 59% | 0.592 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -80.2 | -53.6 | -174.8 | -179.8 | -102.4 | 0 | 0 | 0 | 112 | P78 K84 K85 | P78-F81 PolarHBondContact O-N 3.32Å; F81-K84 PolarHBondContact O-N 2.7Å; F81-K85 HydrophobicContact CD1-CG 4.47Å; F81-K85 HydrophobicContact CE1-CG 4.14Å; F81-K85 HydrophobicContact CE2-CD 4.45Å; F81-K85 HydrophobicContact CE2-CG 4.21Å; F81-K85 HydrophobicContact CZ-CD 4.25Å; F81-K85 HydrophobicContact CZ-CG 4.01Å; F81-K85 WeakPolarHBondContact O-CG 3.23Å; F81-K85 PolarHBondContact O-N 3.47Å |
| 82 | L | 68.3 | Low | 57.6 | Low | 76 Ų | 76 | 124 Ų | 124 | 40% | 0.398 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -68 | -42.8 | -178.9 | -52.9 | 172.9 | 0 | 0 | 0 | 110.5 | K84 K85 L86 L206 E209 | L82-K84 VanDerWaalsContact C-N 3.33Å; L82-K84 PolarHBondContact O-N 3.31Å; L82-K85 PolarHBondContact O-N 3.46Å; L82-L86 WeakPolarHBondContact O-CB 3.12Å; L82-L86 WeakPolarHBondContact O-CG 3.26Å; L82-L86 PolarHBondContact O-N 3.45Å; L82-L206 HydrophobicContact CD1-CD2 4.1Å; L82-E209 WeakPolarHBondContact CB-OE1 3.37Å |
| 83 | A | 66.1 | Low | 57.7 | Low | 20 Ų | 20 | 115.3 Ų | 115.3 | 17% | 0.165 | 59% | 0.59 | C | S | . | * | H | α-helix | trans | -51.7 | -47.2 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q87 V213 | A83-Q87 WeakPolarHBondContact O-CB 3.39Å; A83-Q87 VanDerWaalsContact O-CG 3.27Å; A83-Q87 WeakPolarHBondContact O-CG 3.34Å; A83-Q87 PolarHBondContact O-N 3.29Å; A83-V213 HydrophobicContact CB-CG2 4.12Å |
| 84 | K | 67.3 | Low | 57.4 | Low | 118 Ų | 118 | 116.4 Ų | 116.4 | 51% | 0.513 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -68.6 | -40.3 | 177 | -75.4 | 174.9 | -174.2 | -177.6 | 0 | 113 | N80 F81 L82 Q87 L88 | N80-K84 VanDerWaalsContact O-CB 3.3Å; N80-K84 WeakPolarHBondContact O-CB 3.45Å; N80-K84 VanDerWaalsContact O-CD 3.26Å; N80-K84 WeakPolarHBondContact O-CD 3.16Å; N80-K84 WeakPolarHBondContact O-CG 3.46Å; N80-K84 PolarHBondContact O-N 3.19Å; F81-K84 PolarHBondContact O-N 2.7Å; L82-K84 VanDerWaalsContact C-N 3.33Å; L82-K84 PolarHBondContact O-N 3.31Å; K84-Q87 PolarHBondContact O-N 3.2Å; K84-L88 PolarHBondContact O-N 3.48Å |
| 85 | K | 66.9 | Low | 57.8 | Low | 120 Ų | 120 | 115.6 Ų | 115.6 | 52% | 0.522 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -64.2 | -42.1 | 177.5 | -71.7 | -78.9 | -73.6 | -174.2 | 0 | 111.3 | F81 L82 L88 V89 | F81-K85 HydrophobicContact CD1-CG 4.47Å; F81-K85 HydrophobicContact CE1-CG 4.14Å; F81-K85 HydrophobicContact CE2-CD 4.45Å; F81-K85 HydrophobicContact CE2-CG 4.21Å; F81-K85 HydrophobicContact CZ-CD 4.25Å; F81-K85 HydrophobicContact CZ-CG 4.01Å; F81-K85 WeakPolarHBondContact O-CG 3.23Å; F81-K85 PolarHBondContact O-N 3.47Å; L82-K85 PolarHBondContact O-N 3.46Å; K85-L88 WeakPolarHBondContact O-CB 3.41Å; K85-L88 PolarHBondContact O-N 3.3Å; K85-V89 WeakPolarHBondContact O-CG2 3.34Å; K85-V89 PolarHBondContact O-N 2.84Å; K85-V89 VanDerWaalsContact O-N 3.09Å |
| 86 | L | 68.7 | Low | 58.1 | Low | 76 Ų | 76 | 112 Ų | 112 | 40% | 0.398 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -67.8 | -38.9 | 175.7 | -69.2 | 171.2 | 0 | 0 | 0 | 112.2 | L82 L88 V89 R90 V213 | L82-L86 WeakPolarHBondContact O-CB 3.12Å; L82-L86 WeakPolarHBondContact O-CG 3.26Å; L82-L86 PolarHBondContact O-N 3.45Å; L86-L88 VanDerWaalsContact C-N 3.31Å; L86-L88 PolarHBondContact O-N 3.03Å; L86-V89 PolarHBondContact O-N 2.84Å; L86-R90 WeakPolarHBondContact O-CG 3.46Å; L86-R90 PolarHBondContact O-N 3.21Å; L86-V213 HydrophobicContact CD1-CG1 3.97Å |
| 87 | Q | 65 | Low | 58.3 | Low | 102 Ų | 102 | 114 Ų | 114 | 48% | 0.477 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -62.4 | -37.6 | 171.1 | -76.8 | 174.9 | -2 | 0 | 0 | 112.3 | A83 K84 R90 R91 | A83-Q87 WeakPolarHBondContact O-CB 3.39Å; A83-Q87 VanDerWaalsContact O-CG 3.27Å; A83-Q87 WeakPolarHBondContact O-CG 3.34Å; A83-Q87 PolarHBondContact O-N 3.29Å; K84-Q87 PolarHBondContact O-N 3.2Å; Q87-R90 PolarHBondContact O-N 3.35Å; Q87-R91 WeakPolarHBondContact O-CB 3.48Å; Q87-R91 PolarHBondContact O-N 3Å |
| 88 | L | 59.9 | Low | 58 | Low | 124 Ų | 124 | 122.9 Ų | 122.9 | 65% | 0.649 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -62.1 | -44.8 | 175.2 | -145.4 | 89 | 0 | 0 | 0 | 111.2 | K84 K85 L86 R91 V92 | K84-L88 PolarHBondContact O-N 3.48Å; K85-L88 WeakPolarHBondContact O-CB 3.41Å; K85-L88 PolarHBondContact O-N 3.3Å; L86-L88 VanDerWaalsContact C-N 3.31Å; L86-L88 PolarHBondContact O-N 3.03Å; L88-R91 PolarHBondContact O-N 3.41Å; L88-V92 PolarHBondContact O-N 2.85Å |
| 89 | V | 57.8 | Low | 57.2 | Low | 111 Ų | 111 | 126.9 Ų | 126.9 | 67% | 0.673 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -62.7 | -42.3 | 176.8 | 173.1 | 0 | 0 | 0 | 0 | 111.5 | K85 L86 R91 | K85-V89 WeakPolarHBondContact O-CG2 3.34Å; K85-V89 PolarHBondContact O-N 2.84Å; K85-V89 VanDerWaalsContact O-N 3.09Å; L86-V89 PolarHBondContact O-N 2.84Å; V89-R91 VanDerWaalsContact C-N 3.32Å; V89-R91 PolarHBondContact O-N 2.79Å |
| 90 | R | 57.9 | Low | 56.5 | Low | 140 Ų | 140 | 125 Ų | 125 | 53% | 0.528 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -66.3 | -30 | 174.5 | -65.6 | -171.6 | -150.7 | 165.5 | 2.9 | 113.2 | L86 Q87 V92 G93 V213 | L86-R90 WeakPolarHBondContact O-CG 3.46Å; L86-R90 PolarHBondContact O-N 3.21Å; Q87-R90 PolarHBondContact O-N 3.35Å; R90-V92 VanDerWaalsContact C-N 3.34Å; R90-V92 PolarHBondContact O-N 2.92Å; R90-G93 PolarHBondContact O-N 3.26Å; R90-V213 PolarHBondContact NH2-O 3.46Å |
| 91 | R | 54.1 | Low | 55.5 | Low | 220 Ų | 220 | 126.7 Ų | 126.7 | 83% | 0.83 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -78 | -9.8 | -178.8 | -108.1 | -175.7 | -178.3 | 170.3 | 2.3 | 115.5 | Q87 L88 V89 G93 | Q87-R91 WeakPolarHBondContact O-CB 3.48Å; Q87-R91 PolarHBondContact O-N 3Å; L88-R91 PolarHBondContact O-N 3.41Å; V89-R91 VanDerWaalsContact C-N 3.32Å; V89-R91 PolarHBondContact O-N 2.79Å; R91-G93 PolarHBondContact O-N 2.86Å |
| 92 | V | 50.3 | Low | 54.9 | Low | 127 Ų | 127 | 125.6 Ų | 125.6 | 77% | 0.77 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.5 | -7.1 | 172.6 | 176.7 | 0 | 0 | 0 | 0 | 111.8 | L88 R90 | L88-V92 PolarHBondContact O-N 2.85Å; R90-V92 VanDerWaalsContact C-N 3.34Å; R90-V92 PolarHBondContact O-N 2.92Å |
| 93 | G | 52.5 | Low | 54.1 | Low | 70 Ų | 70 | 128.1 Ų | 128.1 | 72% | 0.722 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.6 | 1.1 | -176.5 | 0 | 0 | 0 | 0 | 0 | 118.3 | R90 R91 | R90-G93 PolarHBondContact O-N 3.26Å; R91-G93 PolarHBondContact O-N 2.86Å |
| 94 | A | 43.2 | Very low | 53.6 | Low | 80 Ų | 80 | 131.2 Ų | 131.2 | 66% | 0.661 | 72% | 0.715 | S | S | * | * | | | trans | -157.8 | 106.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | | |
| 95 | P | 49.1 | Very low | 53.1 | Low | 117 Ų | 117 | 131.5 Ų | 131.5 | 76% | 0.76 | 73% | 0.729 | S | S | * | * | | | trans | -77.2 | 142.1 | 160.8 | 32 | -31.9 | 0 | 0 | 0 | 110.6 | R97 | P95-R97 PolarHBondContact O-N 3.45Š|
| 96 | P | 49.7 | Very low | 52.5 | Low | 119 Ų | 119 | 130.9 Ų | 130.9 | 77% | 0.773 | 74% | 0.739 | S | S | * | * | | | trans | -66.9 | 130.9 | 171.8 | 28.1 | -33.1 | 0 | 0 | 0 | 109.8 | R98 | P96-R98 PolarHBondContact O-N 3.29Š|
| 97 | R | 50.7 | Low | 52.4 | Low | 258 Ų | 258 | 133.1 Ų | 133.1 | 97% | 0.974 | 76% | 0.758 | S | S | * | * | | | trans | -58.4 | 104.7 | 172.6 | -77 | -176.8 | 173.2 | 128.1 | -3.6 | 110.1 | P95 | P95-R97 PolarHBondContact O-N 3.45Š|
| 98 | R | 44.1 | Very low | 52.2 | Low | 241 Ų | 241 | 132.5 Ų | 132.5 | 91% | 0.909 | 77% | 0.771 | S | S | * | * | | | trans | -108.5 | 148.3 | 157.4 | -95 | -173.8 | 179.5 | -176.2 | 1.2 | 109.4 | P96 | P96-R98 PolarHBondContact O-N 3.29Š|
| 99 | M | 39 | Very low | 52.4 | Low | 192 Ų | 192 | 132.3 Ų | 132.3 | 95% | 0.946 | 78% | 0.777 | S | S | * | * | | | trans | -64.7 | 154.2 | -166.2 | -66 | -61.9 | -175.4 | 0 | 0 | 113.2 | | |
| 100 | A | 42.5 | Very low | 52.9 | Low | 106 Ų | 106 | 132.9 Ų | 132.9 | 88% | 0.876 | 78% | 0.783 | S | S | * | * | | | trans | -63 | 145.3 | -174.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 101 | S | 41.9 | Very low | 53.1 | Low | 108 Ų | 108 | 130.7 Ų | 130.7 | 76% | 0.755 | 80% | 0.795 | S | S | * | * | | | trans | -128.2 | 147.1 | 159.5 | -170.5 | 0 | 0 | 0 | 0 | 107.7 | | |
| 102 | P | 58.9 | Low | 53.5 | Low | 113 Ų | 113 | 128 Ų | 128 | 73% | 0.734 | 80% | 0.795 | S | S | * | * | | | trans | -63 | 153.9 | -174.2 | -22.6 | 34.5 | 0 | 0 | 0 | 113.6 | A104 | P102-A104 PolarHBondContact O-N 2.93Š|
| 103 | P | 49.7 | Very low | 53.5 | Low | 129 Ų | 129 | 125.8 Ų | 125.8 | 84% | 0.838 | 79% | 0.785 | S | S | * | * | | | trans | -71.6 | 112.8 | -179.6 | 29.3 | -33.9 | 0 | 0 | 0 | 111.1 | | |
| 104 | A | 56.2 | Low | 53.8 | Low | 85 Ų | 85 | 128.4 Ų | 128.4 | 70% | 0.702 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 144.9 | 161.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | P102 S106 | P102-A104 PolarHBondContact O-N 2.93Å; A104-S106 PolarHBondContact O-N 2.86Å |
| 105 | P | 56.4 | Low | 54.6 | Low | 124 Ų | 124 | 132 Ų | 132 | 81% | 0.805 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 131.9 | 175.9 | 26.5 | -33.8 | 0 | 0 | 0 | 110 | | |
| 106 | S | 54.3 | Low | 55 | Low | 106 Ų | 106 | 132 Ų | 132 | 74% | 0.741 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 139 | -179.3 | 55.1 | 0 | 0 | 0 | 0 | 111.5 | A104 | A104-S106 PolarHBondContact O-N 2.86Š|
| 107 | P | 66.5 | Low | 55.5 | Low | 124 Ų | 124 | 135.9 Ų | 135.9 | 81% | 0.805 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 143.5 | 170 | 27 | -34.1 | 0 | 0 | 0 | 110.1 | | |
| 108 | A | 62.6 | Low | 55.9 | Low | 89 Ų | 89 | 131.1 Ų | 131.1 | 74% | 0.736 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 146.9 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | | |
| 109 | P | 63.9 | Low | 56.7 | Low | 119 Ų | 119 | 122.8 Ų | 122.8 | 77% | 0.773 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 143.9 | 178.3 | 26.2 | -34.5 | 0 | 0 | 0 | 110.8 | | |
| 110 | P | 67.8 | Low | 57.9 | Low | 123 Ų | 123 | 121.5 Ų | 121.5 | 80% | 0.799 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 145.9 | 179.6 | 26.1 | -34.4 | 0 | 0 | 0 | 110.8 | I112 | P110-I112 PolarHBondContact O-N 3.16Š|
| 111 | A | 62 | Low | 58.7 | Low | 94 Ų | 94 | 121.2 Ų | 121.2 | 78% | 0.777 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 134.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111 | S113 | A111-S113 PolarHBondContact O-N 3.3Å; A111-S113 VanDerWaalsContact O-N 3.08Å |
| 112 | I | 61.9 | Low | 59.8 | Low | 165 Ų | 165 | 123.4 Ų | 123.4 | 85% | 0.846 | 76% | 0.759 | S | S | * | * | | | trans | -57.2 | 115.8 | -178.6 | -61.7 | 169.8 | 0 | 0 | 0 | 109 | P110 | P110-I112 PolarHBondContact O-N 3.16Š|
| 113 | S | 51.2 | Low | 60 | Low | 80 Ų | 80 | 123.8 Ų | 123.8 | 56% | 0.559 | 76% | 0.761 | S | S | * | * | | | trans | -58.1 | 128.3 | -175.9 | -57.7 | 0 | 0 | 0 | 0 | 111.2 | A111 I115 I116 | A111-S113 PolarHBondContact O-N 3.3Å; A111-S113 VanDerWaalsContact O-N 3.08Å; S113-I115 PolarHBondContact O-N 3.01Å; S113-I116 PolarHBondContact O-N 3.39Å |
| 114 | P | 57.8 | Low | 60.5 | Low | 124 Ų | 124 | 125.8 Ų | 125.8 | 81% | 0.805 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.7 | -11.3 | -176.9 | -26.9 | 35 | 0 | 0 | 0 | 116 | | |
| 115 | I | 59.9 | Low | 60.5 | Low | 157 Ų | 157 | 127.9 Ų | 127.9 | 81% | 0.805 | 76% | 0.758 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.6 | -15.6 | -168.6 | -60.4 | 173.3 | 0 | 0 | 0 | 112.6 | S113 | S113-I115 PolarHBondContact O-N 3.01Š|
| 116 | I | 58.3 | Low | 60.6 | Low | 116 Ų | 116 | 127.5 Ų | 127.5 | 60% | 0.595 | 75% | 0.749 | S | S | * | * | | | trans | -123.7 | 62.2 | -178.3 | -39.6 | -179.1 | 0 | 0 | 0 | 111.8 | S113 N118 A119 | S113-I116 PolarHBondContact O-N 3.39Å; I116-N118 PolarHBondContact O-N 3.49Å; I116-A119 HydrophobicContact CG2-CB 3.57Å |
| 117 | K | 60.5 | Low | 60.8 | Low | 201 Ų | 201 | 129.3 Ų | 129.3 | 87% | 0.874 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.2 | -6 | 177.7 | -156 | 172.6 | 179 | 180 | 0 | 114.5 | | |
| 118 | N | 57.8 | Low | 60.3 | Low | 157 Ų | 157 | 126.9 Ų | 126.9 | 84% | 0.84 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115 | 10 | 179.8 | -81.8 | -7.7 | 0 | 0 | 0 | 114.2 | I116 I120 | I116-N118 PolarHBondContact O-N 3.49Å; N118-I120 PolarHBondContact O-N 3.19Å; N118-I120 VanDerWaalsContact O-N 3.14Å |
| 119 | A | 62.6 | Low | 60.1 | Low | 67 Ų | 67 | 124.6 Ų | 124.6 | 55% | 0.554 | 72% | 0.718 | S | S | * | * | | | trans | -70.5 | 110.1 | 165.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | I116 S121 | I116-A119 HydrophobicContact CG2-CB 3.57Å; A119-S121 PolarHBondContact O-N 3.14Å |
| 120 | I | 63.3 | Low | 59.7 | Low | 165 Ų | 165 | 125.6 Ų | 125.6 | 85% | 0.846 | 71% | 0.707 | S | S | * | * | | | trans | -58.4 | 111.5 | 165.8 | -58.5 | 172.3 | 0 | 0 | 0 | 106.2 | N118 L122 | N118-I120 PolarHBondContact O-N 3.19Å; N118-I120 VanDerWaalsContact O-N 3.14Å; I120-L122 PolarHBondContact O-N 2.67Å |
| 121 | S | 60.4 | Low | 59.2 | Low | 100 Ų | 100 | 124.6 Ų | 124.6 | 70% | 0.699 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -56 | 123.6 | 177.3 | 53.6 | 0 | 0 | 0 | 0 | 109.1 | A119 | A119-S121 PolarHBondContact O-N 3.14Š|
| 122 | L | 64.3 | Low | 59 | Low | 154 Ų | 154 | 123.9 Ų | 123.9 | 81% | 0.806 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 140.5 | 168.7 | -66.8 | 173.9 | 0 | 0 | 0 | 108.5 | I120 Q124 | I120-L122 PolarHBondContact O-N 2.67Å; L122-Q124 PolarHBondContact O-N 3.08Å; L122-Q124 VanDerWaalsContact O-N 3.08Å |
| 123 | P | 61.8 | Low | 58.8 | Low | 120 Ų | 120 | 121.7 Ų | 121.7 | 78% | 0.779 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 121.6 | 177.1 | 23.5 | -33 | 0 | 0 | 0 | 108.7 | L125 | P123-L125 PolarHBondContact O-N 3.18Š|
| 124 | Q | 60.8 | Low | 59.2 | Low | 172 Ų | 172 | 122.8 Ų | 122.8 | 80% | 0.804 | 68% | 0.677 | S | S | * | * | | | trans | -62.8 | 111.7 | -177.9 | -69.5 | -177.3 | 5.6 | 0 | 0 | 108.9 | L122 N126 | L122-Q124 PolarHBondContact O-N 3.08Å; L122-Q124 VanDerWaalsContact O-N 3.08Å; Q124-N126 PolarHBondContact O-N 3.45Å |
| 125 | L | 56.6 | Low | 59.3 | Low | 129 Ų | 129 | 123 Ų | 123 | 68% | 0.675 | 68% | 0.675 | S | S | * | * | | | trans | -72.8 | 96.6 | 173.8 | -173.9 | 68.9 | 0 | 0 | 0 | 108.1 | P123 Q127 | P123-L125 PolarHBondContact O-N 3.18Å; L125-Q127 PolarHBondContact O-N 3.16Å |
| 126 | N | 58.9 | Low | 58.7 | Low | 115 Ų | 115 | 117.2 Ų | 117.2 | 62% | 0.615 | 66% | 0.655 | S | S | * | * | | | trans | -54.8 | 130.2 | 177.3 | -78.8 | -40.3 | 0 | 0 | 0 | 110.5 | Q124 A128 A129 | Q124-N126 PolarHBondContact O-N 3.45Å; N126-A128 PolarHBondContact O-N 3.27Å; N126-A128 VanDerWaalsContact O-N 3.1Å; N126-A129 VanDerWaalsContact O-CB 3.31Å; N126-A129 WeakPolarHBondContact O-CB 3.39Å; N126-A129 PolarHBondContact O-N 3.16Å |
| 127 | Q | 57.5 | Low | 58.4 | Low | 144 Ų | 144 | 120.7 Ų | 120.7 | 67% | 0.673 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -53.1 | -37.1 | -177.2 | -159.4 | 69.3 | 48 | 0 | 0 | 112.5 | L125 A129 Y130 D131 | L125-Q127 PolarHBondContact O-N 3.16Å; Q127-A129 PolarHBondContact O-N 3.2Å; Q127-Y130 WeakPolarHBondContact O-CB 3.38Å; Q127-Y130 PolarHBondContact O-N 3.23Å; Q127-D131 PolarHBondContact O-N 3.41Å |
| 128 | A | 57.3 | Low | 57.8 | Low | 74 Ų | 74 | 118.4 Ų | 118.4 | 61% | 0.612 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -62.7 | -23.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | N126 S132 | N126-A128 PolarHBondContact O-N 3.27Å; N126-A128 VanDerWaalsContact O-N 3.1Å; A128-S132 WeakPolarHBondContact O-CB 3.12Å; A128-S132 PolarHBondContact O-N 3.5Å |
| 129 | A | 57.8 | Low | 57.2 | Low | 41 Ų | 41 | 115.8 Ų | 115.8 | 34% | 0.339 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -73.6 | -31.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | N126 Q127 L133 | N126-A129 VanDerWaalsContact O-CB 3.31Å; N126-A129 WeakPolarHBondContact O-CB 3.39Å; N126-A129 PolarHBondContact O-N 3.16Å; Q127-A129 PolarHBondContact O-N 3.2Å; A129-L133 VanDerWaalsContact O-CG 3.29Å; A129-L133 WeakPolarHBondContact O-CG 3.37Å; A129-L133 PolarHBondContact O-N 3.32Å |
| 130 | Y | 55.7 | Low | 56.2 | Low | 139 Ų | 139 | 122.1 Ų | 122.1 | 55% | 0.545 | 67% | 0.672 | S | S | . | * | H | α-helix | trans | -69.6 | -46.4 | 177.4 | -159.8 | -92.6 | 0 | 0 | 0 | 111.1 | Q127 S132 L133 V134 | Q127-Y130 WeakPolarHBondContact O-CB 3.38Å; Q127-Y130 PolarHBondContact O-N 3.23Å; Y130-S132 VanDerWaalsContact C-N 3.26Å; Y130-S132 PolarHBondContact O-N 3.12Å; Y130-L133 PolarHBondContact O-N 3.28Å; Y130-L133 VanDerWaalsContact O-N 3.12Å; Y130-V134 HydrophobicContact CE1-CG1 4.4Å; Y130-V134 PolarHBondContact O-N 2.86Å |
| 131 | D | 56.7 | Low | 55.3 | Low | 102 Ų | 102 | 122 Ų | 122 | 55% | 0.545 | 67% | 0.672 | S | S | . | * | H | α-helix | trans | -63.2 | -33.3 | 176.4 | -66.5 | -15.7 | 0 | 0 | 0 | 112.1 | Q127 V134 | Q127-D131 PolarHBondContact O-N 3.41Å; D131-V134 VanDerWaalsContact O-CG2 3.29Å; D131-V134 WeakPolarHBondContact O-CG2 3.17Å |
| 132 | S | 58.8 | Low | 54.1 | Low | 80 Ų | 80 | 120 Ų | 120 | 56% | 0.559 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -73.2 | -31.5 | 174.4 | -160.9 | 0 | 0 | 0 | 0 | 112.9 | A128 Y130 G136 | A128-S132 WeakPolarHBondContact O-CB 3.12Å; A128-S132 PolarHBondContact O-N 3.5Å; Y130-S132 VanDerWaalsContact C-N 3.26Å; Y130-S132 PolarHBondContact O-N 3.12Å; S132-G136 WeakPolarHBondContact O-CA 3.49Å; S132-G136 PolarHBondContact O-N 3.15Å |
| 133 | L | 57.3 | Low | 52.6 | Low | 118 Ų | 118 | 118.5 Ų | 118.5 | 62% | 0.618 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -75.2 | -25.2 | 177.2 | -76.2 | 168.3 | 0 | 0 | 0 | 113.8 | A129 Y130 | A129-L133 VanDerWaalsContact O-CG 3.29Å; A129-L133 WeakPolarHBondContact O-CG 3.37Å; A129-L133 PolarHBondContact O-N 3.32Å; Y130-L133 PolarHBondContact O-N 3.28Å; Y130-L133 VanDerWaalsContact O-N 3.12Å |
| 134 | V | 60.1 | Low | 51.8 | Low | 103 Ų | 103 | 118.6 Ų | 118.6 | 62% | 0.624 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83 | -10.5 | 176.3 | -62.5 | 0 | 0 | 0 | 0 | 114 | Y130 D131 | Y130-V134 HydrophobicContact CE1-CG1 4.4Å; Y130-V134 PolarHBondContact O-N 2.86Å; D131-V134 VanDerWaalsContact O-CG2 3.29Å; D131-V134 WeakPolarHBondContact O-CG2 3.17Å |
| 135 | V | 59.4 | Low | 50.7 | Low | 128 Ų | 128 | 116.1 Ų | 116.1 | 78% | 0.776 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.6 | -21.4 | 175.7 | -179.4 | 0 | 0 | 0 | 0 | 112.5 | K137 | V135-K137 PolarHBondContact O-N 3.34Š|
| 136 | G | 46.3 | Very low | 49.9 | Very low | 36 Ų | 36 | 115.4 Ų | 115.4 | 37% | 0.371 | 68% | 0.679 | S | S | . | * | | | trans | -81.3 | 90.3 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | S132 L138 | S132-G136 WeakPolarHBondContact O-CA 3.49Å; S132-G136 PolarHBondContact O-N 3.15Å; G136-L138 PolarHBondContact O-N 3.22Å; G136-L138 VanDerWaalsContact O-N 3.14Å |
| 137 | K | 52.4 | Low | 48.9 | Very low | 189 Ų | 189 | 115 Ų | 115 | 82% | 0.822 | 69% | 0.685 | S | S | * | * | | | trans | -40.3 | 114.6 | 161.6 | 178.7 | 179.4 | 174.5 | -175.8 | 0 | 111.1 | V135 S139 | V135-K137 PolarHBondContact O-N 3.34Å; K137-S139 PolarHBondContact O-N 3.37Å |
| 138 | L | 49.1 | Very low | 48.6 | Very low | 153 Ų | 153 | 114.4 Ų | 114.4 | 80% | 0.801 | 69% | 0.691 | S | S | * | * | | | trans | -64.3 | 87.8 | -177.7 | -71.1 | 171.1 | 0 | 0 | 0 | 112.3 | G136 F140 | G136-L138 PolarHBondContact O-N 3.22Å; G136-L138 VanDerWaalsContact O-N 3.14Å; L138-F140 PolarHBondContact O-N 3.25Å |
| 139 | S | 44.7 | Very low | 47.6 | Very low | 103 Ų | 103 | 117.8 Ų | 117.8 | 72% | 0.72 | 70% | 0.699 | S | S | * | * | | | trans | -88.5 | 94.5 | 165.4 | -63.9 | 0 | 0 | 0 | 0 | 109.3 | K137 | K137-S139 PolarHBondContact O-N 3.37Š|
| 140 | F | 40.9 | Very low | 47.4 | Very low | 200 Ų | 200 | 119.3 Ų | 119.3 | 88% | 0.877 | 72% | 0.719 | S | S | * | * | | | trans | -89.8 | 103.9 | 161.7 | -117.1 | -90 | 0 | 0 | 0 | 107.6 | L138 | L138-F140 PolarHBondContact O-N 3.25Š|
| 141 | D | 44.2 | Very low | 47.1 | Very low | 161 Ų | 161 | 121.7 Ų | 121.7 | 86% | 0.861 | 74% | 0.735 | S | S | * | * | | | trans | -118 | 142.2 | 164.8 | -164.9 | 2.4 | 0 | 0 | 0 | 107.9 | | |
| 142 | G | 34.9 | Very low | 46.3 | Very low | 60 Ų | 60 | 122.3 Ų | 122.3 | 62% | 0.619 | 75% | 0.747 | S | S | * | * | | | trans | 119.6 | 72.5 | -171.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | | |
| 143 | S | 34.6 | Very low | 45.9 | Very low | 122 Ų | 122 | 124 Ų | 124 | 85% | 0.853 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 134.4 | 155.4 | -63.5 | 0 | 0 | 0 | 0 | 109.9 | | |
| 144 | P | 44.5 | Very low | 45.3 | Very low | 122 Ų | 122 | 128.2 Ų | 128.2 | 79% | 0.792 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -91.2 | 142.3 | 152.9 | 32.4 | -28 | 0 | 0 | 0 | 110.6 | | |
| 145 | S | 37.2 | Very low | 44.6 | Very low | 119 Ų | 119 | 126.8 Ų | 126.8 | 83% | 0.832 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 136.2 | -173.7 | -30.5 | 0 | 0 | 0 | 0 | 114.3 | S147 | S145-S147 PolarHBondContact O-N 3.21Å; S145-S147 VanDerWaalsContact O-N 3.07Å |
| 146 | S | 39.3 | Very low | 44.2 | Very low | 114 Ų | 114 | 129 Ų | 129 | 80% | 0.797 | 78% | 0.781 | S | S | * | * | | | trans | -66.9 | 103.5 | 165.7 | 53.9 | 0 | 0 | 0 | 0 | 110.3 | T148 | S146-T148 PolarHBondContact O-N 3.12Š|
| 147 | S | 38.6 | Very low | 44.5 | Very low | 106 Ų | 106 | 134.9 Ų | 134.9 | 74% | 0.741 | 80% | 0.804 | S | S | * | * | | | trans | -68 | 121.5 | 171.3 | -169 | 0 | 0 | 0 | 0 | 110.1 | S145 D149 | S145-S147 PolarHBondContact O-N 3.21Å; S145-S147 VanDerWaalsContact O-N 3.07Å; S147-D149 VanDerWaalsContact C-N 3.34Å; S147-D149 PolarHBondContact O-N 3.04Å; S147-D149 VanDerWaalsContact O-N 3.16Å |
| 148 | T | 50.8 | Low | 44.1 | Very low | 133 Ų | 133 | 130.9 Ų | 130.9 | 82% | 0.816 | 80% | 0.8 | S | S | * | * | | | trans | -85.1 | 75 | 174.9 | 53.8 | 0 | 0 | 0 | 0 | 110.2 | S146 | S146-T148 PolarHBondContact O-N 3.12Š|
| 149 | D | 35.7 | Very low | 44.4 | Very low | 144 Ų | 144 | 127.6 Ų | 127.6 | 77% | 0.77 | 80% | 0.802 | S | S | * | * | | | trans | -134.6 | 105.9 | 166.8 | -103.5 | -37 | 0 | 0 | 0 | 110.7 | S147 H151 | S147-D149 VanDerWaalsContact C-N 3.34Å; S147-D149 PolarHBondContact O-N 3.04Å; S147-D149 VanDerWaalsContact O-N 3.16Å; D149-H151 VanDerWaalsContact C-N 3.3Å; D149-H151 PolarHBondContact O-N 3.35Å |
| 150 | G | 54 | Low | 44.3 | Very low | 73 Ų | 73 | 131.3 Ų | 131.3 | 75% | 0.753 | 81% | 0.806 | S | S | * | * | | | trans | -82.1 | 62.4 | -176 | 0 | 0 | 0 | 0 | 0 | 113.3 | | |
| 151 | H | 48.8 | Very low | 44.5 | Very low | 190 Ų | 190 | 128.1 Ų | 128.1 | 88% | 0.88 | 81% | 0.807 | S | S | * | * | | | trans | -155.8 | 78.9 | 164 | -86.9 | -62 | 0 | 0 | 0 | 111.6 | D149 | D149-H151 VanDerWaalsContact C-N 3.3Å; D149-H151 PolarHBondContact O-N 3.35Å |
| 152 | S | 41.1 | Very low | 45 | Very low | 114 Ų | 114 | 126.4 Ų | 126.4 | 80% | 0.797 | 80% | 0.802 | S | S | * | * | | | trans | -101.1 | 96.8 | 165.1 | -165.8 | 0 | 0 | 0 | 0 | 109.9 | Y154 | S152-Y154 PolarHBondContact O-N 3.19Š|
| 153 | S | 49.3 | Very low | 45.6 | Very low | 117 Ų | 117 | 131.3 Ų | 131.3 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | | | trans | -65.4 | 109.5 | 164.2 | -179.5 | 0 | 0 | 0 | 0 | 108.1 | G155 | S153-G155 PolarHBondContact O-N 3.14Š|
| 154 | Y | 46.3 | Very low | 46 | Very low | 205 Ų | 205 | 130.9 Ų | 130.9 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | | | trans | -70.7 | 114.7 | 178.4 | 51.1 | -90.2 | 0 | 0 | 0 | 109.6 | S152 | S152-Y154 PolarHBondContact O-N 3.19Š|
| 155 | G | 44.4 | Very low | 46.1 | Very low | 73 Ų | 73 | 136.4 Ų | 136.4 | 75% | 0.753 | 82% | 0.815 | S | S | * | * | | | trans | -65.6 | 133.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | S153 D157 | S153-G155 PolarHBondContact O-N 3.14Å; G155-D157 PolarHBondContact O-N 2.73Å |
| 156 | L | 52 | Low | 46 | Very low | 176 Ų | 176 | 138.4 Ų | 138.4 | 92% | 0.921 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -77.1 | 90.1 | 171.4 | -72 | 162.1 | 0 | 0 | 0 | 110.1 | | |
| 157 | D | 50.9 | Low | 46.1 | Very low | 159 Ų | 159 | 138.3 Ų | 138.3 | 85% | 0.85 | 81% | 0.812 | S | S | * | * | | | trans | -161.6 | 73.7 | 150.8 | -165.6 | 19.9 | 0 | 0 | 0 | 112.6 | G155 | G155-D157 PolarHBondContact O-N 2.73Š|
| 158 | S | 45.7 | Very low | 46.1 | Very low | 105 Ų | 105 | 144.6 Ų | 144.6 | 73% | 0.734 | 82% | 0.819 | S | S | * | * | | | trans | -161.3 | 114 | 160.8 | -156.2 | 0 | 0 | 0 | 0 | 111.6 | F160 | S158-F160 PolarHBondContact O-N 3.17Š|
| 159 | G | 54.5 | Low | 45.4 | Very low | 83 Ų | 83 | 143.4 Ų | 143.4 | 86% | 0.856 | 82% | 0.817 | S | S | * | * | | | trans | -75.5 | 38.9 | -175.6 | 0 | 0 | 0 | 0 | 0 | 116 | | |
| 160 | F | 41.6 | Very low | 45.3 | Very low | 182 Ų | 182 | 145.1 Ų | 145.1 | 80% | 0.798 | 82% | 0.82 | S | S | * | * | | | trans | -106.7 | 106 | 174.8 | -100.1 | -88.5 | 0 | 0 | 0 | 111.6 | S158 T162 | S158-F160 PolarHBondContact O-N 3.17Å; F160-T162 PolarHBondContact O-N 3.49Å |
| 161 | C | 46.5 | Very low | 44.7 | Very low | 133 Ų | 133 | 150.6 Ų | 150.6 | 90% | 0.899 | 82% | 0.823 | S | S | * | * | | | trans | -67.3 | 93.9 | 173.1 | -58.8 | 0 | 0 | 0 | 0 | 110.6 | | |
| 162 | T | 54.4 | Low | 44 | Very low | 125 Ų | 125 | 146.7 Ų | 146.7 | 77% | 0.767 | 82% | 0.815 | S | S | * | * | | | trans | -75.3 | 143.9 | 168.4 | 54.5 | 0 | 0 | 0 | 0 | 110.4 | F160 S164 | F160-T162 PolarHBondContact O-N 3.49Å; T162-S164 PolarHBondContact O-N 2.84Å |
| 163 | I | 47.7 | Very low | 43.7 | Very low | 162 Ų | 162 | 148.7 Ų | 148.7 | 83% | 0.831 | 81% | 0.811 | S | S | * | * | | | trans | -54.8 | 128.3 | -175.5 | -61.1 | 168.4 | 0 | 0 | 0 | 110 | R165 | I163-R165 PolarHBondContact O-N 3.1Š|
| 164 | S | 42.5 | Very low | 42.8 | Very low | 113 Ų | 113 | 150.5 Ų | 150.5 | 79% | 0.79 | 81% | 0.812 | S | S | * | * | | | trans | -54.4 | 108.5 | -179.6 | -53 | 0 | 0 | 0 | 0 | 111.3 | T162 L166 | T162-S164 PolarHBondContact O-N 2.84Å; S164-L166 PolarHBondContact O-N 3.15Å; S164-L166 VanDerWaalsContact O-N 3.1Å |
| 165 | R | 47.2 | Very low | 42.5 | Very low | 238 Ų | 238 | 150 Ų | 150 | 90% | 0.898 | 81% | 0.808 | S | S | * | * | | | trans | -67.7 | 108.3 | 167.6 | -71.1 | -171.8 | 175.7 | -156.1 | -0.5 | 107.9 | I163 | I163-R165 PolarHBondContact O-N 3.1Š|
| 166 | L | 35.6 | Very low | 42.3 | Very low | 162 Ų | 162 | 154.3 Ų | 154.3 | 85% | 0.848 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 124 | 173.1 | -173.5 | 72.7 | 0 | 0 | 0 | 108.8 | S164 R168 | S164-L166 PolarHBondContact O-N 3.15Å; S164-L166 VanDerWaalsContact O-N 3.1Å; L166-R168 PolarHBondContact O-N 2.78Å |
| 167 | P | 40 | Very low | 41.6 | Very low | 112 Ų | 112 | 157 Ų | 157 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -61 | 125 | 175.6 | 23.7 | -32.1 | 0 | 0 | 0 | 109 | S169 | P167-S169 PolarHBondContact O-N 2.72Š|
| 168 | R | 39.6 | Very low | 40.8 | Very low | 238 Ų | 238 | 157.3 Ų | 157.3 | 90% | 0.898 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 120.8 | 175.3 | 178.6 | -177.1 | -179.2 | 104.9 | -4.1 | 108.4 | L166 E170 | L166-R168 PolarHBondContact O-N 2.78Å; R168-E170 PolarHBondContact O-N 3.09Å |
| 169 | S | 36.3 | Very low | 40.2 | Very low | 108 Ų | 108 | 155.9 Ų | 155.9 | 76% | 0.755 | 82% | 0.815 | S | S | * | * | | | trans | -58.1 | 111.6 | 175.4 | 175.4 | 0 | 0 | 0 | 0 | 109.6 | P167 K171 | P167-S169 PolarHBondContact O-N 2.72Å; S169-K171 PolarHBondContact O-N 3.25Å |
| 170 | E | 32.5 | Very low | 39.1 | Very low | 180 Ų | 180 | 157.9 Ų | 157.9 | 84% | 0.841 | 82% | 0.816 | S | S | * | * | | | trans | -72.2 | 114.6 | 167.2 | -171.7 | 177.3 | 152.1 | 0 | 0 | 107.7 | R168 | R168-E170 PolarHBondContact O-N 3.09Š|
| 171 | K | 41 | Very low | 38.6 | Very low | 187 Ų | 187 | 158.6 Ų | 158.6 | 81% | 0.813 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -101.2 | 120.6 | 171.5 | -171.1 | 83.2 | 176.6 | -173.8 | 0 | 106.4 | S169 | S169-K171 PolarHBondContact O-N 3.25Š|
| 172 | P | 34.5 | Very low | 38.8 | Very low | 109 Ų | 109 | 158 Ų | 158 | 71% | 0.708 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 148 | -172.4 | 24.8 | -33.7 | 0 | 0 | 0 | 112.1 | D174 | P172-D174 PolarHBondContact O-N 3.34Š|
| 173 | H | 34.6 | Very low | 37.8 | Very low | 155 Ų | 155 | 158 Ų | 158 | 72% | 0.718 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 117.6 | 176.4 | -150 | -41.8 | 0 | 0 | 0 | 110.7 | R175 | H173-R175 WeakPolarHBondContact CE1-CG 3.27Å; H173-R175 WeakPolarHBondContact ND1-CG 3.29Å |
| 174 | D | 30.8 | Very low | 37.2 | Very low | 156 Ų | 156 | 158.8 Ų | 158.8 | 83% | 0.834 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -97.5 | 118.6 | 153.7 | -153.4 | -5.9 | 0 | 0 | 0 | 106.1 | P172 | P172-D174 PolarHBondContact O-N 3.34Š|
| 175 | R | 39.9 | Very low | 37.7 | Very low | 193 Ų | 193 | 158.8 Ų | 158.8 | 73% | 0.728 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -92.4 | 119.5 | 174.5 | -87.2 | -167.7 | 178.6 | -165.8 | 1.7 | 106.8 | H173 | H173-R175 WeakPolarHBondContact CE1-CG 3.27Å; H173-R175 WeakPolarHBondContact ND1-CG 3.29Å |
| 176 | D | 39.9 | Very low | 37 | Very low | 165 Ų | 165 | 150.8 Ų | 150.8 | 88% | 0.882 | 81% | 0.808 | S | S | * | * | | | | -167.8 | 152.2 | 129.4 | -97 | -26.4 | 0 | 0 | 0 | 112.6 | | |
| 177 | R | 36.9 | Very low | 37.7 | Very low | 233 Ų | 233 | 149.5 Ų | 149.5 | 88% | 0.879 | 80% | 0.801 | S | S | * | * | | | trans | 86.2 | 78.6 | 159.4 | -134 | 163 | -166.4 | 144.1 | 2.3 | 120 | | |
| 178 | D | 35.6 | Very low | 37.7 | Very low | 164 Ų | 164 | 155.1 Ų | 155.1 | 88% | 0.877 | 81% | 0.808 | S | S | * | * | | | trans | 19.6 | 128.5 | 134 | -52.5 | -54.2 | 0 | 0 | 0 | 121 | | |
| 179 | G | 33.1 | Very low | 38 | Very low | 75 Ų | 75 | 153.5 Ų | 153.5 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | | | trans | 166.9 | 93.5 | 157.9 | 0 | 0 | 0 | 0 | 0 | 118.6 | | |
| 180 | S | 31.8 | Very low | 38.7 | Very low | 125 Ų | 125 | 154 Ų | 154 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | | | trans | 65.4 | 125.4 | 154.6 | -157.4 | 0 | 0 | 0 | 0 | 121.6 | | |
| 181 | F | 30.4 | Very low | 39.3 | Very low | 197 Ų | 197 | 152 Ų | 152 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | | | trans | -82.6 | -169.5 | 164.6 | -62.7 | -87.7 | 0 | 0 | 0 | 111.9 | | |
| 182 | P | 50.5 | Low | 39.4 | Very low | 120 Ų | 120 | 147.1 Ų | 147.1 | 78% | 0.779 | 79% | 0.79 | S | S | * | * | | | | -132 | 166.6 | -59.2 | 36.2 | -21.7 | 0 | 0 | 0 | 113.5 | | |
| 183 | S | 33 | Very low | 40.1 | Very low | 126 Ų | 126 | 149.7 Ų | 149.7 | 88% | 0.881 | 80% | 0.797 | S | S | * | * | | | trans | -159.4 | 142.7 | 156.1 | 56.3 | 0 | 0 | 0 | 0 | 116.6 | | |
| 184 | E | 36.2 | Very low | 40.9 | Very low | 179 Ų | 179 | 149.8 Ų | 149.8 | 84% | 0.836 | 80% | 0.802 | S | S | * | * | | | trans | -50.3 | 169.1 | 178.1 | -90.1 | -84.3 | 100.9 | 0 | 0 | 118.5 | G186 | E184-G186 PolarHBondContact O-N 3.05Š|
| 185 | P | 51.5 | Low | 41.6 | Very low | 112 Ų | 112 | 146.9 Ų | 146.9 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | | | trans | -81.2 | 119.7 | -162.8 | 32.5 | -35.3 | 0 | 0 | 0 | 114.7 | | |
| 186 | G | 34.4 | Very low | 41.9 | Very low | 70 Ų | 70 | 145.7 Ų | 145.7 | 72% | 0.722 | 79% | 0.794 | S | S | * | * | | | trans | -97.6 | 111 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | E184 R188 | E184-G186 PolarHBondContact O-N 3.05Å; G186-R188 PolarHBondContact O-N 2.87Å; G186-R188 VanDerWaalsContact O-N 3.12Å |
| 187 | L | 49.9 | Very low | 42.3 | Very low | 135 Ų | 135 | 147.8 Ų | 147.8 | 71% | 0.707 | 79% | 0.79 | S | S | * | * | | | trans | -65.7 | 108.2 | 172.6 | -167.6 | 110.9 | 0 | 0 | 0 | 111.2 | R189 | L187-R189 HydrophobicContact CD2-CG 4.41Š|
| 188 | R | 40.6 | Very low | 43.2 | Very low | 230 Ų | 230 | 143.7 Ų | 143.7 | 87% | 0.868 | 78% | 0.784 | S | S | * | * | | | trans | -118.4 | 96.4 | 164.3 | -73.5 | -62.7 | 93.7 | 142.6 | 5.8 | 110.1 | G186 | G186-R188 PolarHBondContact O-N 2.87Å; G186-R188 VanDerWaalsContact O-N 3.12Å |
| 189 | R | 45.6 | Very low | 43.8 | Very low | 205 Ų | 205 | 142.4 Ų | 142.4 | 77% | 0.774 | 78% | 0.777 | S | S | * | * | | | trans | -84.3 | 153.5 | 158.8 | -69.3 | 179.5 | 167.1 | -179.9 | -4 | 108.9 | L187 | L187-R189 HydrophobicContact CD2-CG 4.41Š|
| 190 | S | 49.6 | Very low | 44.8 | Very low | 118 Ų | 118 | 144.9 Ų | 144.9 | 83% | 0.825 | 77% | 0.772 | S | S | * | * | | | trans | 94.8 | 52.1 | 147 | -49.2 | 0 | 0 | 0 | 0 | 121.1 | | |
| 191 | D | 45.3 | Very low | 46 | Very low | 139 Ų | 139 | 146.6 Ų | 146.6 | 74% | 0.743 | 77% | 0.771 | S | S | * | * | | | trans | -157.3 | 81.4 | 163.6 | 47.2 | -35.5 | 0 | 0 | 0 | 114.8 | | |
| 192 | S | 44.4 | Very low | 47.7 | Very low | 84 Ų | 84 | 139.8 Ų | 139.8 | 59% | 0.587 | 74% | 0.744 | S | S | * | * | | | trans | -178.2 | 81.7 | 142.8 | -86.5 | 0 | 0 | 0 | 0 | 113 | L194 S195 | S192-L194 PolarHBondContact O-N 3.1Å; S192-S195 PolarHBondContact O-OG 3.37Å |
| 193 | L | 49.3 | Very low | 49 | Very low | 162 Ų | 162 | 135.6 Ų | 135.6 | 85% | 0.848 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.2 | 22.7 | 157.3 | -71.8 | 175.7 | 0 | 0 | 0 | 112.2 | | |
| 194 | L | 50.5 | Low | 50.7 | Low | 158 Ų | 158 | 135.1 Ų | 135.1 | 83% | 0.827 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.3 | 2.7 | 178 | -65.5 | 171.3 | 0 | 0 | 0 | 112.3 | S192 F196 | S192-L194 PolarHBondContact O-N 3.1Å; L194-F196 VanDerWaalsContact C-N 3.27Å; L194-F196 PolarHBondContact O-N 3.24Å |
| 195 | S | 45.3 | Very low | 52.3 | Low | 94 Ų | 94 | 131 Ų | 131 | 66% | 0.657 | 71% | 0.707 | S | S | * | * | | | trans | -82.9 | 1.7 | 175.9 | 60.4 | 0 | 0 | 0 | 0 | 114 | S192 R197 | S192-S195 PolarHBondContact O-OG 3.37Å; S195-R197 PolarHBondContact O-N 3.11Å |
| 196 | F | 45.7 | Very low | 53.4 | Low | 169 Ų | 169 | 129.5 Ų | 129.5 | 74% | 0.741 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -70.1 | 68.2 | 151.2 | -63.4 | -69.2 | 0 | 0 | 0 | 108.8 | L194 L198 | L194-F196 VanDerWaalsContact C-N 3.27Å; L194-F196 PolarHBondContact O-N 3.24Å; F196-L198 PolarHBondContact O-N 3.1Å |
| 197 | R | 49.8 | Very low | 55.7 | Low | 209 Ų | 209 | 129.3 Ų | 129.3 | 79% | 0.789 | 68% | 0.675 | S | S | * | * | | | trans | -57.6 | 123.5 | 173.2 | -158.9 | 180 | -165.9 | 174.9 | 1.8 | 106.8 | S195 D199 | S195-R197 PolarHBondContact O-N 3.11Å; R197-D199 PolarHBondContact O-N 3.2Å |
| 198 | L | 54.3 | Low | 56.9 | Low | 147 Ų | 147 | 125.4 Ų | 125.4 | 77% | 0.77 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -75.4 | 49.3 | -168.1 | -69.4 | 160.5 | 0 | 0 | 0 | 112.7 | F196 L200 | F196-L198 PolarHBondContact O-N 3.1Å; L198-L200 PolarHBondContact O-N 3.19Å |
| 199 | D | 49 | Very low | 58.7 | Low | 136 Ų | 136 | 116 Ų | 116 | 73% | 0.727 | 63% | 0.625 | S | S | * | * | | | trans | -83.6 | 19.5 | 169.5 | -63.6 | -35.7 | 0 | 0 | 0 | 111.4 | R197 D201 | R197-D199 PolarHBondContact O-N 3.2Å; D199-D201 PolarHBondContact O-N 2.97Å |
| 200 | L | 54.6 | Low | 60.4 | Low | 128 Ų | 128 | 109.8 Ų | 109.8 | 67% | 0.67 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -83.8 | 99.3 | 160.5 | -169.9 | 69.2 | 0 | 0 | 0 | 106.6 | L198 L202 | L198-L200 PolarHBondContact O-N 3.19Å; L200-L202 HydrophobicContact CD2-CD1 4.02Å; L200-L202 HydrophobicContact CD2-CG 4.21Å; L200-L202 HydrophobicContact CG-CD1 4.42Å; L200-L202 HydrophobicContact CG-CG 4.18Å; L200-L202 PolarHBondContact O-N 3.44Å |
| 201 | D | 55.7 | Low | 61.9 | Low | 160 Ų | 160 | 108.8 Ų | 108.8 | 86% | 0.856 | 59% | 0.592 | S | S | * | * | | | trans | -68.1 | 67.8 | -174.8 | -168.9 | 19.8 | 0 | 0 | 0 | 112.4 | D199 G203 | D199-D201 PolarHBondContact O-N 2.97Å; D201-G203 PolarHBondContact O-N 3.3Å |
| 202 | L | 66.6 | Low | 63.3 | Low | 54 Ų | 54 | 104.1 Ų | 104.1 | 28% | 0.283 | 58% | 0.576 | S | S | . | * | | | trans | -75.8 | 98 | 169.2 | -70.2 | 165.8 | 0 | 0 | 0 | 106.5 | L200 L206 L207 | L200-L202 HydrophobicContact CD2-CD1 4.02Å; L200-L202 HydrophobicContact CD2-CG 4.21Å; L200-L202 HydrophobicContact CG-CD1 4.42Å; L200-L202 HydrophobicContact CG-CG 4.18Å; L200-L202 PolarHBondContact O-N 3.44Å; L202-L206 HydrophobicContact CB-CB 4.28Å; L202-L206 HydrophobicContact CD2-CB 4.23Å; L202-L206 HydrophobicContact CD2-CD1 3.91Å; L202-L207 HydrophobicContact CB-CD2 3.98Å; L202-L207 HydrophobicContact CB-CG 3.88Å; L202-L207 HydrophobicContact CD1-CD2 4.18Å; L202-L207 WeakPolarHBondContact O-CD1 3.38Å; L202-L207 VanDerWaalsContact O-CG 3.23Å; L202-L207 WeakPolarHBondContact O-CG 3.29Å |
| 203 | G | 77.3 | Confident | 64.8 | Low | 33 Ų | 33 | 100.9 Ų | 100.9 | 34% | 0.34 | 55% | 0.553 | S | S | . | * | | | trans | -49.7 | 154.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | D201 S205 L206 | D201-G203 PolarHBondContact O-N 3.3Å; G203-S205 PolarHBondContact O-N 3.49Å; G203-L206 PolarHBondContact O-N 3.46Å |
| 204 | P | 69.8 | Low | 65.9 | Low | 115 Ų | 115 | 99.6 Ų | 99.6 | 75% | 0.747 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -53 | -27.7 | -161.8 | 16.7 | -31.9 | 0 | 0 | 0 | 115.3 | S208 | P204-S208 WeakPolarHBondContact O-CB 3.17Å; P204-S208 PolarHBondContact O-N 2.98Å; P204-S208 VanDerWaalsContact O-N 3.11Å |
| 205 | S | 69.8 | Low | 66.9 | Low | 92 Ų | 92 | 96.6 Ų | 96.6 | 64% | 0.643 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -56.3 | -47.4 | 172.1 | -58.4 | 0 | 0 | 0 | 0 | 113.6 | G203 S208 E209 | G203-S205 PolarHBondContact O-N 3.49Å; S205-S208 PolarHBondContact O-OG 3.19Å; S205-E209 PolarHBondContact O-N 2.89Å |
| 206 | L | 73.7 | Confident | 67.5 | Low | 82 Ų | 82 | 96.3 Ų | 96.3 | 43% | 0.429 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -78.7 | -38.7 | -174.7 | -75.2 | 167.4 | 0 | 0 | 0 | 112.4 | L82 L202 G203 S208 E209 L210 | L82-L206 HydrophobicContact CD1-CD2 4.1Å; L202-L206 HydrophobicContact CB-CB 4.28Å; L202-L206 HydrophobicContact CD2-CB 4.23Å; L202-L206 HydrophobicContact CD2-CD1 3.91Å; G203-L206 PolarHBondContact O-N 3.46Å; L206-S208 VanDerWaalsContact C-N 3.29Å; L206-S208 PolarHBondContact O-N 3.08Å; L206-E209 PolarHBondContact O-N 3.02Å; L206-L210 PolarHBondContact O-N 3.49Å |
| 207 | L | 83.1 | Confident | 68 | Low | 65 Ų | 65 | 94.1 Ų | 94.1 | 34% | 0.34 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.6 | -40.6 | 172.2 | -70.3 | 172.5 | 0 | 0 | 0 | 111.1 | L202 E209 L210 L211 | L202-L207 HydrophobicContact CB-CD2 3.98Å; L202-L207 HydrophobicContact CB-CG 3.88Å; L202-L207 HydrophobicContact CD1-CD2 4.18Å; L202-L207 WeakPolarHBondContact O-CD1 3.38Å; L202-L207 VanDerWaalsContact O-CG 3.23Å; L202-L207 WeakPolarHBondContact O-CG 3.29Å; L207-E209 VanDerWaalsContact C-N 3.26Å; L207-E209 PolarHBondContact O-N 3.08Å; L207-L210 PolarHBondContact O-N 3.27Å; L207-L211 HydrophobicContact CB-CD1 4.37Å; L207-L211 WeakPolarHBondContact O-CD1 3.43Å; L207-L211 PolarHBondContact O-N 2.98Å |
| 208 | S | 74.3 | Confident | 67.5 | Low | 53 Ų | 53 | 92.9 Ų | 92.9 | 37% | 0.371 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.2 | -31.9 | 176.9 | 80.3 | 0 | 0 | 0 | 0 | 113.6 | R79 P204 S205 L206 G212 | R79-S208 PolarHBondContact NH2-OG 3.43Å; P204-S208 WeakPolarHBondContact O-CB 3.17Å; P204-S208 PolarHBondContact O-N 2.98Å; P204-S208 VanDerWaalsContact O-N 3.11Å; S205-S208 PolarHBondContact O-OG 3.19Å; L206-S208 VanDerWaalsContact C-N 3.29Å; L206-S208 PolarHBondContact O-N 3.08Å; S208-G212 PolarHBondContact O-N 3.39Å; S208-G212 VanDerWaalsContact O-N 3.16Å |
| 209 | E | 78.4 | Confident | 66.9 | Low | 32 Ų | 32 | 90 Ų | 90 | 15% | 0.15 | 53% | 0.53 | C | S | . | . | H | α-helix | trans | -75.6 | -43.7 | 175.4 | -175.8 | 165.9 | -176.2 | 0 | 0 | 111.3 | L82 S205 L206 L207 G212 V213 | L82-E209 WeakPolarHBondContact CB-OE1 3.37Å; S205-E209 PolarHBondContact O-N 2.89Å; L206-E209 PolarHBondContact O-N 3.02Å; L207-E209 VanDerWaalsContact C-N 3.26Å; L207-E209 PolarHBondContact O-N 3.08Å; E209-G212 PolarHBondContact O-N 3Å; E209-V213 WeakPolarHBondContact O-CB 3.31Å; E209-V213 VanDerWaalsContact O-CG2 3.3Å; E209-V213 WeakPolarHBondContact O-CG2 3.29Å; E209-V213 PolarHBondContact O-N 2.88Å |
| 210 | L | 82.4 | Confident | 66.8 | Low | 75 Ų | 75 | 89.2 Ų | 89.2 | 39% | 0.393 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.7 | -50.6 | 177.4 | -176.5 | 63.6 | 0 | 0 | 0 | 111.7 | L206 L207 G212 V213 M214 | L206-L210 PolarHBondContact O-N 3.49Å; L207-L210 PolarHBondContact O-N 3.27Å; L210-G212 VanDerWaalsContact C-N 3.33Å; L210-G212 PolarHBondContact O-N 3.46Å; L210-V213 PolarHBondContact O-N 3Å; L210-V213 VanDerWaalsContact O-N 3.17Å; L210-M214 HydrophobicContact CD1-SD 4.45Å; L210-M214 HydrophobicContact CG-SD 3.98Å; L210-M214 VanDerWaalsContact O-CG 3.26Å; L210-M214 WeakPolarHBondContact O-CG 3.5Å; L210-M214 PolarHBondContact O-N 3.01Å |
| 211 | L | 79.8 | Confident | 65.9 | Low | 98 Ų | 98 | 87.7 Ų | 87.7 | 51% | 0.513 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.8 | -42 | 176.7 | -85.2 | 83.7 | 0 | 0 | 0 | 111.2 | L207 V213 M214 S215 | L207-L211 HydrophobicContact CB-CD1 4.37Å; L207-L211 WeakPolarHBondContact O-CD1 3.43Å; L207-L211 PolarHBondContact O-N 2.98Å; L211-V213 VanDerWaalsContact C-N 3.29Å; L211-V213 PolarHBondContact O-N 3.31Å; L211-M214 WeakPolarHBondContact O-CB 3.35Å; L211-M214 PolarHBondContact O-N 3.32Å; L211-M214 VanDerWaalsContact O-N 3.12Å; L211-S215 WeakPolarHBondContact O-CB 3.49Å; L211-S215 PolarHBondContact O-N 3.45Å; L211-S215 PolarHBondContact O-OG 3.01Å |
| 212 | G | 75.8 | Confident | 65.2 | Low | 41 Ų | 41 | 84.6 Ų | 84.6 | 42% | 0.423 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -60.6 | -35.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | S208 E209 L210 | S208-G212 PolarHBondContact O-N 3.39Å; S208-G212 VanDerWaalsContact O-N 3.16Å; E209-G212 PolarHBondContact O-N 3Å; L210-G212 VanDerWaalsContact C-N 3.33Å; L210-G212 PolarHBondContact O-N 3.46Å |
| 213 | V | 75.9 | Confident | 63.7 | Low | 16 Ų | 16 | 91 Ų | 91 | 10% | 0.097 | 56% | 0.564 | C | S | . | * | H | α-helix | trans | -76.9 | -21.6 | 177 | 167.6 | 0 | 0 | 0 | 0 | 112.9 | A83 L86 R90 E209 L210 L211 | A83-V213 HydrophobicContact CB-CG2 4.12Å; L86-V213 HydrophobicContact CD1-CG1 3.97Å; R90-V213 PolarHBondContact NH2-O 3.46Å; E209-V213 WeakPolarHBondContact O-CB 3.31Å; E209-V213 VanDerWaalsContact O-CG2 3.3Å; E209-V213 WeakPolarHBondContact O-CG2 3.29Å; E209-V213 PolarHBondContact O-N 2.88Å; L210-V213 PolarHBondContact O-N 3Å; L210-V213 VanDerWaalsContact O-N 3.17Å; L211-V213 VanDerWaalsContact C-N 3.29Å; L211-V213 PolarHBondContact O-N 3.31Å |
| 214 | M | 72.9 | Confident | 61.8 | Low | 135 Ų | 135 | 95.7 Ų | 95.7 | 67% | 0.665 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -83.5 | -33 | 171 | -65.6 | 164.8 | 121.9 | 0 | 0 | 112.2 | L210 L211 L216 | L210-M214 HydrophobicContact CD1-SD 4.45Å; L210-M214 HydrophobicContact CG-SD 3.98Å; L210-M214 VanDerWaalsContact O-CG 3.26Å; L210-M214 WeakPolarHBondContact O-CG 3.5Å; L210-M214 PolarHBondContact O-N 3.01Å; L211-M214 WeakPolarHBondContact O-CB 3.35Å; L211-M214 PolarHBondContact O-N 3.32Å; L211-M214 VanDerWaalsContact O-N 3.12Å; M214-L216 PolarHBondContact O-N 3.14Å |
| 215 | S | 69.9 | Low | 60.4 | Low | 94 Ų | 94 | 95.8 Ų | 95.8 | 66% | 0.657 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -82.8 | 13.2 | -179.7 | -58.5 | 0 | 0 | 0 | 0 | 114.6 | L211 P217 | L211-S215 WeakPolarHBondContact O-CB 3.49Å; L211-S215 PolarHBondContact O-N 3.45Å; L211-S215 PolarHBondContact O-OG 3.01Å; S215-P217 VanDerWaalsContact O-CD 3.26Å; S215-P217 WeakPolarHBondContact O-CD 3.44Å |
| 216 | L | 58.8 | Low | 59 | Low | 89 Ų | 89 | 95.9 Ų | 95.9 | 47% | 0.466 | 59% | 0.593 | S | S | . | * | | | trans | -71.5 | 114.9 | 169.2 | -77.6 | 164.5 | 0 | 0 | 0 | 109 | M214 E218 | M214-L216 PolarHBondContact O-N 3.14Å; L216-E218 PolarHBondContact O-N 2.94Å |
| 217 | P | 55.8 | Low | 57.6 | Low | 123 Ų | 123 | 97.8 Ų | 97.8 | 80% | 0.799 | 61% | 0.61 | S | S | * | * | | | trans | -67.9 | 128.7 | 175.4 | 27.8 | -33.2 | 0 | 0 | 0 | 110.5 | S215 | S215-P217 VanDerWaalsContact O-CD 3.26Å; S215-P217 WeakPolarHBondContact O-CD 3.44Å |
| 218 | E | 39.7 | Very low | 55.8 | Low | 182 Ų | 182 | 99.8 Ų | 99.8 | 85% | 0.85 | 64% | 0.636 | S | S | * | * | | | trans | -67.6 | 139.4 | 170.4 | -166.4 | 78.4 | 173.4 | 0 | 0 | 109.6 | L216 | L216-E218 PolarHBondContact O-N 2.94Š|
| 219 | A | 41.5 | Very low | 54.1 | Low | 87 Ų | 87 | 101.7 Ų | 101.7 | 72% | 0.719 | 66% | 0.655 | S | S | * | * | | | trans | -54.2 | 174.6 | -171.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | | |
| 220 | P | 46.7 | Very low | 52.8 | Low | 120 Ų | 120 | 107.7 Ų | 107.7 | 78% | 0.779 | 69% | 0.688 | S | S | * | * | | | cis | -149.5 | 175.7 | 26.5 | 43.7 | -21.8 | 0 | 0 | 0 | 120.3 | | |
| 221 | A | 35.3 | Very low | 51.3 | Low | 95 Ų | 95 | 109.4 Ų | 109.4 | 79% | 0.785 | 70% | 0.704 | S | S | * | * | | | trans | 36.2 | 133.8 | 147.2 | 0 | 0 | 0 | 0 | 0 | 123.7 | | |
| 222 | A | 41.8 | Very low | 50 | Low | 95 Ų | 95 | 110.8 Ų | 110.8 | 79% | 0.785 | 72% | 0.718 | S | S | * | * | | | trans | 64.7 | 100.1 | 152.9 | 0 | 0 | 0 | 0 | 0 | 119 | | |
| 223 | E | 35.4 | Very low | 48.8 | Very low | 190 Ų | 190 | 113 Ų | 113 | 89% | 0.888 | 73% | 0.733 | S | S | * | * | | | | -177.2 | 156.4 | 89.8 | -90.9 | -158.7 | 139.5 | 0 | 0 | 111.2 | | |
| 224 | T | 37.1 | Very low | 47.6 | Very low | 131 Ų | 131 | 118.2 Ų | 118.2 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | | | trans | -78.1 | 131.7 | 173.8 | -39.6 | 0 | 0 | 0 | 0 | 109.6 | | |
| 225 | P | 39.3 | Very low | 46.4 | Very low | 116 Ų | 116 | 116.7 Ų | 116.7 | 75% | 0.753 | 78% | 0.775 | S | S | * | * | | | | -135.2 | 139.5 | 115.5 | 35 | -25.6 | 0 | 0 | 0 | 111.8 | P227 | P225-P227 WeakPolarHBondContact O-CD 3.48Š|
| 226 | A | 40.9 | Very low | 45.5 | Very low | 94 Ų | 94 | 116.4 Ų | 116.4 | 78% | 0.777 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 127 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | | |
| 227 | P | 43.7 | Very low | 45.3 | Very low | 123 Ų | 123 | 119.1 Ų | 119.1 | 80% | 0.799 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -93 | 119.3 | 159.9 | 32 | -23.6 | 0 | 0 | 0 | 109.4 | P225 | P225-P227 WeakPolarHBondContact O-CD 3.48Š|
| 228 | A | 45.7 | Very low | 45.3 | Very low | 106 Ų | 106 | 118.8 Ų | 118.8 | 88% | 0.876 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 121.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 229 | A | 39.4 | Very low | 46.3 | Very low | 93 Ų | 93 | 116 Ų | 116 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | | | trans | -171.9 | 119.9 | 146.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | | |
| 230 | N | 50.5 | Low | 47.1 | Very low | 159 Ų | 159 | 116.2 Ų | 116.2 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 132.8 | 171.6 | -66.6 | -55.7 | 0 | 0 | 0 | 109.4 | | |
| 231 | P | 51.8 | Low | 47.6 | Very low | 111 Ų | 111 | 116.3 Ų | 116.3 | 72% | 0.721 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 142.2 | 163.5 | 28.4 | -33.1 | 0 | 0 | 0 | 108.7 | A233 | P231-A233 PolarHBondContact O-N 3.36Š|
| 232 | P | 52.6 | Low | 48.6 | Very low | 126 Ų | 126 | 116.4 Ų | 116.4 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 135.8 | 176.8 | 25.6 | -33.4 | 0 | 0 | 0 | 109.6 | | |
| 233 | A | 50 | Low | 49.2 | Very low | 89 Ų | 89 | 116 Ų | 116 | 74% | 0.736 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 138.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | P231 A235 | P231-A233 PolarHBondContact O-N 3.36Å; A233-A235 PolarHBondContact O-N 3.35Å |
| 234 | P | 50.3 | Low | 50.3 | Low | 125 Ų | 125 | 113.8 Ų | 113.8 | 81% | 0.812 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 133.4 | 174.9 | 25.7 | -33.3 | 0 | 0 | 0 | 109.3 | A236 | P234-A236 PolarHBondContact O-N 3.07Š|
| 235 | A | 47.2 | Very low | 51.2 | Low | 102 Ų | 102 | 113 Ų | 113 | 84% | 0.843 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 137.7 | -174.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | A233 N237 | A233-A235 PolarHBondContact O-N 3.35Å; A235-N237 PolarHBondContact O-N 2.88Å |
| 236 | A | 51.3 | Low | 52.5 | Low | 89 Ų | 89 | 113.3 Ų | 113.3 | 74% | 0.736 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -63 | 128.7 | -173.8 | 0 | 0 | 0 | 0 | 0 | 112 | P234 | P234-A236 PolarHBondContact O-N 3.07Š|
| 237 | N | 55.5 | Low | 53.5 | Low | 145 Ų | 145 | 113.1 Ų | 113.1 | 78% | 0.775 | 78% | 0.781 | S | S | * | * | | | trans | 59.3 | 115 | 162.7 | -55.4 | -33.6 | 0 | 0 | 0 | 117.2 | A235 | A235-N237 PolarHBondContact O-N 2.88Š|
| 238 | P | 54.7 | Low | 54.1 | Low | 116 Ų | 116 | 113 Ų | 113 | 75% | 0.753 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 150.3 | 158.1 | 29.5 | -33.9 | 0 | 0 | 0 | 109.5 | A240 | P238-A240 PolarHBondContact O-N 3.17Š|
| 239 | P | 62.2 | Low | 54.9 | Low | 125 Ų | 125 | 112.3 Ų | 112.3 | 81% | 0.812 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 139.3 | 176.4 | 25 | -33.9 | 0 | 0 | 0 | 110.1 | | |
| 240 | A | 58.2 | Low | 55.7 | Low | 90 Ų | 90 | 112.4 Ų | 112.4 | 74% | 0.744 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 137.9 | -178.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | P238 A242 | P238-A240 PolarHBondContact O-N 3.17Å; A240-A242 PolarHBondContact O-N 3.31Å |
| 241 | P | 55.8 | Low | 56.2 | Low | 122 Ų | 122 | 111.5 Ų | 111.5 | 79% | 0.792 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 137.1 | 174.5 | 26.3 | -33.7 | 0 | 0 | 0 | 109.1 | A243 | P241-A243 PolarHBondContact O-N 3.32Å; P241-A243 VanDerWaalsContact O-N 3.09Å |
| 242 | A | 56.3 | Low | 56.6 | Low | 97 Ų | 97 | 111.5 Ų | 111.5 | 80% | 0.802 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 119.5 | -177.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | A240 N244 | A240-A242 PolarHBondContact O-N 3.31Å; A242-N244 PolarHBondContact O-N 3.22Å |
| 243 | A | 54.6 | Low | 57.2 | Low | 86 Ų | 86 | 111.4 Ų | 111.4 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -66.5 | 124 | 178.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | P241 | P241-A243 PolarHBondContact O-N 3.32Å; P241-A243 VanDerWaalsContact O-N 3.09Å |
| 244 | N | 58.3 | Low | 57.9 | Low | 144 Ų | 144 | 111.3 Ų | 111.3 | 77% | 0.77 | 77% | 0.769 | S | S | * | * | | | trans | 78.9 | 109.8 | 179.2 | -45.2 | -49.3 | 0 | 0 | 0 | 115.3 | A242 | A242-N244 PolarHBondContact O-N 3.22Š|
| 245 | P | 57.3 | Low | 58.2 | Low | 116 Ų | 116 | 111 Ų | 111 | 75% | 0.753 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 151.8 | 152.7 | 29.7 | -34.2 | 0 | 0 | 0 | 109.3 | A247 | P245-A247 PolarHBondContact O-N 2.95Š|
| 246 | P | 66.1 | Low | 58.9 | Low | 122 Ų | 122 | 110.4 Ų | 110.4 | 79% | 0.792 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 137.4 | 173.7 | 25.2 | -33.6 | 0 | 0 | 0 | 109.8 | | |
| 247 | A | 61.6 | Low | 59.2 | Low | 89 Ų | 89 | 110.7 Ų | 110.7 | 74% | 0.736 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 138.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | P245 A249 | P245-A247 PolarHBondContact O-N 2.95Å; A247-A249 PolarHBondContact O-N 3.21Å |
| 248 | P | 57.6 | Low | 59.5 | Low | 122 Ų | 122 | 110.3 Ų | 110.3 | 79% | 0.792 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 135.7 | 175.6 | 25.6 | -33.6 | 0 | 0 | 0 | 109.3 | A250 | P248-A250 PolarHBondContact O-N 3.17Š|
| 249 | A | 60.6 | Low | 59.7 | Low | 90 Ų | 90 | 110 Ų | 110 | 74% | 0.744 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 117 | -178.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | A247 N251 | A247-A249 PolarHBondContact O-N 3.21Å; A249-N251 PolarHBondContact O-N 3.33Å |
| 250 | A | 56.8 | Low | 59.8 | Low | 95 Ų | 95 | 110.2 Ų | 110.2 | 79% | 0.785 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -66.9 | -3.9 | -166 | 0 | 0 | 0 | 0 | 0 | 115.1 | P248 | P248-A250 PolarHBondContact O-N 3.17Š|
| 251 | N | 61.3 | Low | 60 | Low | 140 Ų | 140 | 108.8 Ų | 108.8 | 75% | 0.749 | 76% | 0.756 | S | S | * | * | | | trans | -140.8 | 113.3 | 172.9 | -69.5 | -67.7 | 0 | 0 | 0 | 109.6 | A249 | A249-N251 PolarHBondContact O-N 3.33Š|
| 252 | P | 59.9 | Low | 60.1 | Low | 111 Ų | 111 | 109.1 Ų | 109.1 | 72% | 0.721 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -62 | 145.1 | 155.6 | 29 | -32.7 | 0 | 0 | 0 | 108.5 | A254 | P252-A254 PolarHBondContact O-N 3.19Š|
| 253 | P | 66.6 | Low | 60.2 | Low | 124 Ų | 124 | 109.2 Ų | 109.2 | 81% | 0.805 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 134.9 | 172.8 | 25.4 | -33.2 | 0 | 0 | 0 | 109.2 | | |
| 254 | A | 62.9 | Low | 60.3 | Low | 88 Ų | 88 | 109.5 Ų | 109.5 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 139.5 | -179.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | P252 A256 | P252-A254 PolarHBondContact O-N 3.19Å; A254-A256 PolarHBondContact O-N 2.92Å |
| 255 | P | 58.2 | Low | 60.3 | Low | 119 Ų | 119 | 109.5 Ų | 109.5 | 77% | 0.773 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 135.2 | 175.8 | 25.3 | -33.6 | 0 | 0 | 0 | 109.1 | A257 | P255-A257 PolarHBondContact O-N 3.12Š|
| 256 | A | 61.1 | Low | 60.4 | Low | 89 Ų | 89 | 109.5 Ų | 109.5 | 74% | 0.736 | 76% | 0.761 | S | S | * | * | | | trans | -55.2 | 114.6 | -179.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | A254 N258 | A254-A256 PolarHBondContact O-N 2.92Å; A256-N258 PolarHBondContact O-N 3.35Å |
| 257 | A | 58 | Low | 60.3 | Low | 95 Ų | 95 | 109.7 Ų | 109.7 | 79% | 0.785 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -65.4 | -8.2 | -165.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | P255 | P255-A257 PolarHBondContact O-N 3.12Š|
| 258 | N | 61.3 | Low | 60.3 | Low | 137 Ų | 137 | 109.8 Ų | 109.8 | 73% | 0.733 | 76% | 0.763 | S | S | * | * | | | trans | -141.1 | 117.8 | 171.2 | -65.6 | -74.3 | 0 | 0 | 0 | 109.3 | A256 | A256-N258 PolarHBondContact O-N 3.35Š|
| 259 | P | 59.3 | Low | 60.1 | Low | 110 Ų | 110 | 109.2 Ų | 109.2 | 71% | 0.714 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 147.6 | 155.9 | 29.3 | -32.8 | 0 | 0 | 0 | 108.6 | G261 | P259-G261 PolarHBondContact O-N 3.29Š|
| 260 | P | 64.3 | Low | 59.9 | Low | 129 Ų | 129 | 109.5 Ų | 109.5 | 84% | 0.838 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 131.2 | 171.2 | 24.9 | -32.6 | 0 | 0 | 0 | 109.1 | | |
| 261 | G | 61.6 | Low | 59.5 | Low | 60 Ų | 60 | 111.2 Ų | 111.2 | 62% | 0.619 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 154.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | P259 A263 | P259-G261 PolarHBondContact O-N 3.29Å; G261-A263 PolarHBondContact O-N 3.34Å |
| 262 | P | 57.8 | Low | 59.1 | Low | 129 Ų | 129 | 110.1 Ų | 110.1 | 84% | 0.838 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -56 | 133.5 | 179.4 | 24.7 | -34 | 0 | 0 | 0 | 110.1 | A264 | P262-A264 PolarHBondContact O-N 3.02Å; P262-A264 VanDerWaalsContact O-N 3.15Å |
| 263 | A | 59.1 | Low | 58.9 | Low | 98 Ų | 98 | 110.1 Ų | 110.1 | 81% | 0.81 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 121.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 110 | G261 N265 | G261-A263 PolarHBondContact O-N 3.34Å; A263-N265 PolarHBondContact O-N 3.47Å; A263-N265 VanDerWaalsContact O-N 3.1Å |
| 264 | A | 56.9 | Low | 58.4 | Low | 92 Ų | 92 | 110.1 Ų | 110.1 | 76% | 0.76 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -66.9 | 113.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | P262 | P262-A264 PolarHBondContact O-N 3.02Å; P262-A264 VanDerWaalsContact O-N 3.15Å |
| 265 | N | 58.5 | Low | 58 | Low | 144 Ų | 144 | 110.1 Ų | 110.1 | 77% | 0.77 | 76% | 0.761 | S | S | * | * | | | trans | 68.3 | 116.7 | 174.7 | -53.3 | -38.9 | 0 | 0 | 0 | 116.2 | A263 | A263-N265 PolarHBondContact O-N 3.47Å; A263-N265 VanDerWaalsContact O-N 3.1Å |
| 266 | P | 59.3 | Low | 57.6 | Low | 116 Ų | 116 | 110.4 Ų | 110.4 | 75% | 0.753 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -63 | 150.8 | 153.8 | 30.3 | -33.5 | 0 | 0 | 0 | 109.5 | A268 | P266-A268 PolarHBondContact O-N 3.16Š|
| 267 | P | 62.8 | Low | 57 | Low | 127 Ų | 127 | 111 Ų | 111 | 83% | 0.825 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 140.1 | 174.1 | 26 | -33.8 | 0 | 0 | 0 | 110.3 | | |
| 268 | A | 61.6 | Low | 56.7 | Low | 90 Ų | 90 | 110.5 Ų | 110.5 | 74% | 0.744 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 141.5 | -179 | 0 | 0 | 0 | 0 | 0 | 111.2 | P266 A270 | P266-A268 PolarHBondContact O-N 3.16Å; A268-A270 PolarHBondContact O-N 3.1Å |
| 269 | P | 54.3 | Low | 56.3 | Low | 111 Ų | 111 | 111 Ų | 111 | 72% | 0.721 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 137 | 175 | 26.9 | -34.1 | 0 | 0 | 0 | 109.9 | T271 | P269-T271 PolarHBondContact O-N 2.98Š|
| 270 | A | 55.4 | Low | 55.9 | Low | 95 Ų | 95 | 111.5 Ų | 111.5 | 79% | 0.785 | 77% | 0.769 | S | S | * | * | | | trans | -65 | 106.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | A268 T272 | A268-A270 PolarHBondContact O-N 3.1Å; A270-T272 PolarHBondContact O-N 3.09Å |
| 271 | T | 50.2 | Low | 55.4 | Low | 131 Ų | 131 | 111.3 Ų | 111.3 | 80% | 0.804 | 77% | 0.768 | S | S | * | * | | | trans | -79.4 | 30.8 | -175.9 | 55.9 | 0 | 0 | 0 | 0 | 113.9 | P269 | P269-T271 PolarHBondContact O-N 2.98Š|
| 272 | T | 52.9 | Low | 54.7 | Low | 117 Ų | 117 | 112.9 Ų | 112.9 | 72% | 0.718 | 78% | 0.775 | S | S | * | * | | | trans | -135.2 | 103.7 | -178.3 | -11.4 | 0 | 0 | 0 | 0 | 109.8 | A270 | A270-T272 PolarHBondContact O-N 3.09Š|
| 273 | P | 53.9 | Low | 54 | Low | 112 Ų | 112 | 112.8 Ų | 112.8 | 73% | 0.727 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 141.8 | 166 | 28.5 | -32.9 | 0 | 0 | 0 | 109 | | |
| 274 | P | 57.7 | Low | 53 | Low | 123 Ų | 123 | 112.8 Ų | 112.8 | 80% | 0.799 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 139.7 | 172.2 | 26.7 | -33.4 | 0 | 0 | 0 | 109.7 | | |
| 275 | A | 53.2 | Low | 52.2 | Low | 89 Ų | 89 | 115.1 Ų | 115.1 | 74% | 0.736 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 141.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | A277 | A275-A277 PolarHBondContact O-N 3.46Š|
| 276 | P | 50.6 | Low | 51.1 | Low | 124 Ų | 124 | 113.6 Ų | 113.6 | 81% | 0.805 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 130.5 | 177.5 | 26.1 | -33.7 | 0 | 0 | 0 | 110 | A278 | P276-A278 PolarHBondContact O-N 3.18Š|
| 277 | A | 48.6 | Very low | 50.1 | Low | 103 Ų | 103 | 113.5 Ų | 113.5 | 85% | 0.851 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 119.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | A275 | A275-A277 PolarHBondContact O-N 3.46Š|
| 278 | A | 52.4 | Low | 49 | Very low | 83 Ų | 83 | 113.1 Ų | 113.1 | 69% | 0.686 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -70.6 | 134.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | P276 | P276-A278 PolarHBondContact O-N 3.18Š|
| 279 | N | 52.2 | Low | 47.9 | Very low | 147 Ų | 147 | 114.8 Ų | 114.8 | 79% | 0.786 | 78% | 0.782 | S | S | * | * | | | trans | 80 | 105.3 | 173.7 | -46.5 | -45.5 | 0 | 0 | 0 | 116.6 | | |
| 280 | P | 51 | Low | 47 | Very low | 121 Ų | 121 | 117.6 Ų | 117.6 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 147.1 | 153 | 31.6 | -33 | 0 | 0 | 0 | 110.1 | | |
| 281 | P | 53.7 | Low | 46.1 | Very low | 125 Ų | 125 | 116.3 Ų | 116.3 | 81% | 0.812 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 145.8 | 171.8 | 28.5 | -33.8 | 0 | 0 | 0 | 111 | | |
| 282 | A | 46.8 | Very low | 45.4 | Very low | 93 Ų | 93 | 118.3 Ų | 118.3 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -63 | 145.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | A284 | A282-A284 PolarHBondContact O-N 3.21Š|
| 283 | P | 42.3 | Very low | 44.5 | Very low | 127 Ų | 127 | 118.5 Ų | 118.5 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -66 | 127.2 | 179.2 | 27.1 | -33.8 | 0 | 0 | 0 | 110.9 | | |
| 284 | A | 38.5 | Very low | 44.4 | Very low | 98 Ų | 98 | 118.4 Ų | 118.4 | 81% | 0.81 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 135.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | A282 S286 | A282-A284 PolarHBondContact O-N 3.21Å; A284-S286 PolarHBondContact O-N 3.23Å |
| 285 | T | 40.3 | Very low | 43.5 | Very low | 141 Ų | 141 | 120.7 Ų | 120.7 | 87% | 0.865 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 123.4 | 175.2 | 47.7 | 0 | 0 | 0 | 0 | 110.3 | S287 | T285-S287 PolarHBondContact O-N 3.04Š|
| 286 | S | 36.4 | Very low | 42.6 | Very low | 113 Ų | 113 | 120.2 Ų | 120.2 | 79% | 0.79 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 125 | -176.7 | 49.7 | 0 | 0 | 0 | 0 | 112.2 | A284 T288 | A284-S286 PolarHBondContact O-N 3.23Å; S286-T288 PolarHBondContact O-N 3.04Å |
| 287 | S | 36.7 | Very low | 41.8 | Very low | 113 Ų | 113 | 120.8 Ų | 120.8 | 79% | 0.79 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 129.5 | 167.4 | 51.1 | 0 | 0 | 0 | 0 | 110.6 | T285 | T285-S287 PolarHBondContact O-N 3.04Š|
| 288 | T | 39.6 | Very low | 41.3 | Very low | 119 Ų | 119 | 122.4 Ų | 122.4 | 73% | 0.73 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 130.1 | 175.7 | 39 | 0 | 0 | 0 | 0 | 111.7 | S286 H290 | S286-T288 PolarHBondContact O-N 3.04Å; T288-H290 PolarHBondContact O-N 2.78Å |
| 289 | P | 38.8 | Very low | 40.6 | Very low | 126 Ų | 126 | 123.1 Ų | 123.1 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | | | trans | -77.8 | 113 | 166.7 | 30.2 | -30 | 0 | 0 | 0 | 109 | G291 | P289-G291 VanDerWaalsContact C-N 3.31Å; P289-G291 PolarHBondContact O-N 2.96Å |
| 290 | H | 36.8 | Very low | 39.7 | Very low | 169 Ų | 169 | 119.3 Ų | 119.3 | 78% | 0.782 | 80% | 0.796 | S | S | * | * | | | trans | -69.3 | 86.5 | 172.3 | -106.7 | -73.6 | 0 | 0 | 0 | 110.5 | T288 H292 | T288-H290 PolarHBondContact O-N 2.78Å; H290-H292 PolarHBondContact O-N 3.28Å |
| 291 | G | 35.1 | Very low | 39 | Very low | 68 Ų | 68 | 122.1 Ų | 122.1 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | | | trans | -72.6 | 98.3 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | P289 C293 | P289-G291 VanDerWaalsContact C-N 3.31Å; P289-G291 PolarHBondContact O-N 2.96Å; G291-C293 PolarHBondContact O-N 2.88Å |
| 292 | H | 35 | Very low | 37.9 | Very low | 174 Ų | 174 | 119.3 Ų | 119.3 | 81% | 0.806 | 80% | 0.796 | S | S | * | * | | | trans | -76.5 | 106.7 | 170 | -102.6 | -73.8 | 0 | 0 | 0 | 110.4 | H290 P294 | H290-H292 PolarHBondContact O-N 3.28Å; H292-P294 WeakPolarHBondContact O-CD 3.41Å |
| 293 | C | 34.9 | Very low | 38.1 | Very low | 121 Ų | 121 | 120.7 Ų | 120.7 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | | | trans | -100.7 | 110.5 | 164.8 | -63.4 | 0 | 0 | 0 | 0 | 109.2 | G291 | G291-C293 PolarHBondContact O-N 2.88Š|
| 294 | P | 52.8 | Low | 37.9 | Very low | 109 Ų | 109 | 121.4 Ų | 121.4 | 71% | 0.708 | 80% | 0.799 | S | S | * | * | | | trans | -86.5 | 118.7 | 168 | 32.2 | -28.3 | 0 | 0 | 0 | 109.7 | H292 | H292-P294 WeakPolarHBondContact O-CD 3.41Š|
| 295 | N | 37.3 | Very low | 37.7 | Very low | 172 Ų | 172 | 120.9 Ų | 120.9 | 92% | 0.92 | 80% | 0.795 | S | S | * | * | | | trans | 153.9 | 115.2 | 149.2 | -79.6 | -25.5 | 0 | 0 | 0 | 109.8 | | |
| 296 | G | 35.2 | Very low | 37.4 | Very low | 78 Ų | 78 | 122.9 Ų | 122.9 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | | | trans | 169.3 | 59.6 | -177.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | | |
| 297 | V | 34.5 | Very low | 37.1 | Very low | 136 Ų | 136 | 123.4 Ų | 123.4 | 82% | 0.824 | 79% | 0.792 | S | S | * | * | | | trans | 22 | 115.6 | 152.7 | -170.2 | 0 | 0 | 0 | 0 | 120.1 | | |
| 298 | T | 37.8 | Very low | 36.9 | Very low | 138 Ų | 138 | 127.5 Ų | 127.5 | 85% | 0.847 | 80% | 0.796 | S | S | * | * | | | trans | -1.7 | 111.7 | 146.1 | -40.1 | 0 | 0 | 0 | 0 | 120.4 | | |
| 299 | A | 36.2 | Very low | 36.4 | Very low | 97 Ų | 97 | 125.8 Ų | 125.8 | 80% | 0.802 | 79% | 0.794 | S | S | * | * | | | trans | -163.3 | 132.2 | 131.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | | |
| 300 | G | 34.3 | Very low | 36.3 | Very low | 68 Ų | 68 | 125.1 Ų | 125.1 | 70% | 0.701 | 79% | 0.792 | S | S | * | * | | | cis | 104.6 | 95.7 | 24.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | | |
| 301 | L | 35.2 | Very low | 36.9 | Very low | 180 Ų | 180 | 122.7 Ų | 122.7 | 94% | 0.942 | 79% | 0.791 | S | S | * | * | | | trans | 133 | 115.9 | 166.5 | -73.7 | 172.7 | 0 | 0 | 0 | 113.2 | | |
| 302 | G | 31.1 | Very low | 36.9 | Very low | 65 Ų | 65 | 126.5 Ų | 126.5 | 67% | 0.67 | 80% | 0.801 | S | S | * | * | | | trans | -116.5 | -150.5 | 143.7 | 0 | 0 | 0 | 0 | 0 | 107.6 | | |
| 303 | P | 51.9 | Low | 36.8 | Very low | 123 Ų | 123 | 122 Ų | 122 | 80% | 0.799 | 80% | 0.801 | S | S | * | * | | | cis | -135 | 153.4 | -27.1 | 38.6 | -23.9 | 0 | 0 | 0 | 113.2 | | |
| 304 | V | 37 | Very low | 36.5 | Very low | 141 Ų | 141 | 120 Ų | 120 | 86% | 0.855 | 80% | 0.801 | S | S | * | * | | | trans | -149.8 | 124.9 | 158.3 | 179.6 | 0 | 0 | 0 | 0 | 106.5 | | |
| 305 | A | 34.7 | Very low | 35.4 | Very low | 87 Ų | 87 | 118.5 Ų | 118.5 | 72% | 0.719 | 81% | 0.806 | S | S | * | * | | | cis | 94.3 | 79.6 | 23.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | | |
| 306 | E | 34.2 | Very low | 36.1 | Very low | 184 Ų | 184 | 115.9 Ų | 115.9 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | | | trans | -155.3 | 130.6 | 154.4 | -109.4 | 179.6 | 145 | 0 | 0 | 106.8 | | |
| 307 | V | 30.8 | Very low | 36.2 | Very low | 123 Ų | 123 | 124.1 Ų | 124.1 | 75% | 0.745 | 81% | 0.805 | S | S | * | * | | | cis | 60.4 | 118.6 | 41.2 | -179.7 | 0 | 0 | 0 | 0 | 109.4 | | |
| 308 | K | 32 | Very low | 36.1 | Very low | 200 Ų | 200 | 121 Ų | 121 | 87% | 0.87 | 80% | 0.801 | S | S | * | * | | | cis | -157.9 | 176.2 | 14.6 | -130.8 | 179.8 | -177.8 | 179.9 | 0 | 106.9 | | |
| 309 | A | 29.8 | Very low | 36.7 | Very low | 82 Ų | 82 | 120.5 Ų | 120.5 | 68% | 0.678 | 80% | 0.8 | S | S | * | * | | | cis | -159.3 | 170.3 | -1.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | | |
| 310 | S | 35.3 | Very low | 36.7 | Very low | 112 Ų | 112 | 121 Ų | 121 | 78% | 0.783 | 80% | 0.804 | S | S | * | * | | | trans | -105 | 166.3 | 148.8 | -45.3 | 0 | 0 | 0 | 0 | 108.5 | | |
| 311 | P | 49.4 | Very low | 36.6 | Very low | 118 Ų | 118 | 121.4 Ų | 121.4 | 77% | 0.766 | 81% | 0.808 | S | S | * | * | | | | -160.4 | 172.3 | 82.7 | 42.9 | -22.6 | 0 | 0 | 0 | 119.1 | | |
| 312 | V | 34.7 | Very low | 37.5 | Very low | 148 Ų | 148 | 118.9 Ų | 118.9 | 90% | 0.897 | 80% | 0.802 | S | S | * | * | | | trans | 98.1 | 136.1 | 134.3 | 112.1 | 0 | 0 | 0 | 0 | 122.4 | | |
| 313 | G | 33.8 | Very low | 37.7 | Very low | 80 Ų | 80 | 120.1 Ų | 120.1 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | | | trans | 91.9 | 124.7 | 164.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | | |
| 314 | G | 29.6 | Very low | 37 | Very low | 78 Ų | 78 | 122.3 Ų | 122.3 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | | | cis | 173.3 | 142.9 | -5.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | | |
| 315 | G | 29.3 | Very low | 36.8 | Very low | 79 Ų | 79 | 118.3 Ų | 118.3 | 81% | 0.814 | 80% | 0.798 | S | S | * | * | | | trans | -88 | -152.8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 316 | P | 51.5 | Low | 37.2 | Very low | 117 Ų | 117 | 126.2 Ų | 126.2 | 76% | 0.76 | 81% | 0.809 | S | S | * | * | | | cis | -146.9 | 179.7 | -5 | 44 | -25.8 | 0 | 0 | 0 | 117.3 | | |
| 317 | R | 37 | Very low | 37.4 | Very low | 250 Ų | 250 | 124.9 Ų | 124.9 | 94% | 0.943 | 80% | 0.802 | S | S | * | * | | | trans | 61.8 | 149.2 | 160.7 | -69.2 | 171.5 | 165.5 | -177.9 | -6 | 117.8 | | |
| 318 | G | 33.3 | Very low | 37.6 | Very low | 71 Ų | 71 | 129.9 Ų | 129.9 | 73% | 0.732 | 81% | 0.808 | S | S | * | * | | | cis | 140.8 | 179 | 12.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | | |
| 319 | P | 50.5 | Low | 37.8 | Very low | 128 Ų | 128 | 123.6 Ų | 123.6 | 83% | 0.831 | 80% | 0.8 | S | S | * | * | | | cis | -138.7 | 175.3 | -31.9 | 43.2 | -25.8 | 0 | 0 | 0 | 116.4 | | |
| 320 | A | 35.9 | Very low | 38.1 | Very low | 108 Ų | 108 | 124.4 Ų | 124.4 | 89% | 0.893 | 81% | 0.806 | S | S | * | * | | | trans | 52 | 138.1 | 142.9 | 0 | 0 | 0 | 0 | 0 | 126.4 | | |
| 321 | G | 32.3 | Very low | 37.9 | Very low | 76 Ų | 76 | 122.6 Ų | 122.6 | 78% | 0.784 | 81% | 0.806 | S | S | * | * | | | trans | 178.5 | 135.4 | 159.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 322 | P | 54.4 | Low | 37.2 | Very low | 127 Ų | 127 | 129.2 Ų | 129.2 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | | | trans | -135.7 | 175.9 | -159.1 | 43.7 | -27.4 | 0 | 0 | 0 | 119.9 | | |
| 323 | A | 35.2 | Very low | 37.1 | Very low | 90 Ų | 90 | 126 Ų | 126 | 74% | 0.744 | 81% | 0.813 | S | S | * | * | | | trans | 68.9 | 162.6 | 157 | 0 | 0 | 0 | 0 | 0 | 117.9 | | |
| 324 | L | 36.8 | Very low | 37 | Very low | 169 Ų | 169 | 126.2 Ų | 126.2 | 89% | 0.885 | 82% | 0.815 | S | S | * | * | | | cis | -134.5 | 179.9 | -2.2 | -74.2 | 87.5 | 0 | 0 | 0 | 108.5 | | |
| 325 | G | 33.6 | Very low | 37.3 | Very low | 58 Ų | 58 | 126.1 Ų | 126.1 | 60% | 0.598 | 81% | 0.814 | S | S | * | * | | | cis | 136.9 | 109.8 | -14.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | | |
| 326 | R | 42.9 | Very low | 37.7 | Very low | 252 Ų | 252 | 134 Ų | 134 | 95% | 0.951 | 82% | 0.819 | S | S | * | * | | | trans | 75.4 | 161.9 | 169.2 | -39.8 | -175.5 | -167.2 | -76.9 | -1.4 | 115.7 | | |
| 327 | H | 37.6 | Very low | 37 | Very low | 156 Ų | 156 | 137.2 Ų | 137.2 | 72% | 0.722 | 82% | 0.823 | S | S | * | * | | | cis | -155.9 | 162.8 | 5.4 | 106.6 | -30.4 | 0 | 0 | 0 | 113.5 | | |
| 328 | W | 35.4 | Very low | 36.7 | Very low | 229 Ų | 229 | 136 Ų | 136 | 87% | 0.867 | 82% | 0.82 | S | S | * | * | | | trans | 28 | 145.1 | 149.2 | -107.4 | -96.1 | 0 | 0 | 0 | 122.3 | | |
| 329 | G | 35.9 | Very low | 37.5 | Very low | 67 Ų | 67 | 137.9 Ų | 137.9 | 69% | 0.691 | 82% | 0.819 | S | S | * | * | | | cis | 169.4 | 179.6 | -1.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 330 | A | 36.3 | Very low | 37 | Very low | 99 Ų | 99 | 139.3 Ų | 139.3 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | | | trans | 3.2 | 139.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 123.9 | | |
| 331 | G | 30.3 | Very low | 37 | Very low | 75 Ų | 75 | 142.6 Ų | 142.6 | 77% | 0.773 | 81% | 0.814 | S | S | * | * | | | trans | -168.2 | 83.6 | 168.3 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 332 | W | 35.2 | Very low | 37.2 | Very low | 256 Ų | 256 | 144.8 Ų | 144.8 | 97% | 0.97 | 81% | 0.808 | S | S | * | * | | | trans | -15.9 | 142.7 | 157.1 | -49.7 | 58.3 | 0 | 0 | 0 | 115.7 | | |
| 333 | G | 31.8 | Very low | 36.6 | Very low | 81 Ų | 81 | 143.7 Ų | 143.7 | 84% | 0.835 | 81% | 0.81 | S | S | * | * | | | cis | 165.4 | -177.1 | 6.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | | |
| 334 | G | 33.3 | Very low | 36.7 | Very low | 85 Ų | 85 | 150.1 Ų | 150.1 | 88% | 0.876 | 82% | 0.815 | S | S | * | * | | | trans | 121.4 | 94.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 335 | G | 35.5 | Very low | 36.6 | Very low | 75 Ų | 75 | 150.9 Ų | 150.9 | 77% | 0.773 | 81% | 0.814 | S | S | * | * | | | trans | -88.3 | 167.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 336 | R | 36.5 | Very low | 36.7 | Very low | 246 Ų | 246 | 156.4 Ų | 156.4 | 93% | 0.928 | 82% | 0.824 | S | S | * | * | | | trans | -149.5 | 126.9 | 145.4 | -113.2 | -176.5 | -78.9 | -99.5 | 5.6 | 108.3 | | |
| 337 | H | 36.9 | Very low | 36.3 | Very low | 183 Ų | 183 | 155.2 Ų | 155.2 | 85% | 0.847 | 82% | 0.819 | S | S | * | * | | | trans | -70.2 | 143.4 | 170.3 | -68.3 | -107 | 0 | 0 | 0 | 109.6 | | |
| 338 | Y | 31.6 | Very low | 36.2 | Very low | 226 Ų | 226 | 154.3 Ų | 154.3 | 89% | 0.886 | 83% | 0.825 | S | S | * | * | | | | -163.4 | 151.2 | 120.6 | -110.6 | -89.4 | 0 | 0 | 0 | 107 | | |
| 339 | P | 49.6 | Very low | 36.1 | Very low | 109 Ų | 109 | 151.6 Ų | 151.6 | 71% | 0.708 | 82% | 0.822 | S | S | * | * | | | trans | -98.4 | 172.9 | -164.2 | 37.9 | -30.2 | 0 | 0 | 0 | 113.7 | | |
| 340 | E | 39.3 | Very low | 36.4 | Very low | 158 Ų | 158 | 155 Ų | 155 | 74% | 0.738 | 83% | 0.829 | S | S | * | * | | | trans | 13.9 | 132.5 | 139.3 | -138.8 | 75.5 | -163.1 | 0 | 0 | 118.2 | | |
| 341 | M | 36.2 | Very low | 36.3 | Very low | 178 Ų | 178 | 157.7 Ų | 157.7 | 88% | 0.877 | 83% | 0.828 | S | S | * | * | | | | -170.9 | 133.7 | 121.2 | -91.8 | -84.8 | 137.9 | 0 | 0 | 110.3 | | |
| 342 | D | 37.7 | Very low | 36.8 | Very low | 121 Ų | 121 | 159.4 Ų | 159.4 | 65% | 0.647 | 83% | 0.826 | S | S | * | * | | | trans | -40.7 | 139.2 | -173.8 | -80.1 | -46.4 | 0 | 0 | 0 | 117.9 | R344 | D342-R344 HydrophobicContact CB-CG 4.48Å; D342-R344 PolarHBondContact O-N 3.06Å |
| 343 | A | 40.1 | Very low | 36.8 | Very low | 105 Ų | 105 | 156.7 Ų | 156.7 | 87% | 0.868 | 82% | 0.824 | S | S | * | * | | | trans | -72.4 | 104.7 | 156.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | | |
| 344 | R | 37.7 | Very low | 36.7 | Very low | 224 Ų | 224 | 157.3 Ų | 157.3 | 85% | 0.845 | 82% | 0.822 | S | S | * | * | | | trans | -105.8 | 99.9 | 163.5 | -73.7 | -163.1 | 174.2 | -94.1 | -7.7 | 111.3 | D342 E346 | D342-R344 HydrophobicContact CB-CG 4.48Å; D342-R344 PolarHBondContact O-N 3.06Å; R344-E346 PolarHBondContact O-N 2.99Å |
| 345 | Q | 36.1 | Very low | 36.8 | Very low | 185 Ų | 185 | 164.1 Ų | 164.1 | 86% | 0.864 | 82% | 0.821 | S | S | * | * | | | trans | -69.2 | 106.2 | 168.5 | -179.4 | 134.1 | 20.3 | 0 | 0 | 110.1 | | |
| 346 | E | 33.9 | Very low | 36.6 | Very low | 174 Ų | 174 | 164.5 Ų | 164.5 | 81% | 0.813 | 82% | 0.816 | S | S | * | * | | | trans | -80.6 | 133.7 | 166.9 | -166.4 | 171.3 | 174 | 0 | 0 | 110.1 | R344 | R344-E346 PolarHBondContact O-N 2.99Š|
| 347 | R | 35.8 | Very low | 36.6 | Very low | 227 Ų | 227 | 157 Ų | 157 | 86% | 0.857 | 80% | 0.802 | S | S | * | * | | | trans | -88.1 | 112.1 | 175.9 | -67.9 | 176.6 | 169.8 | -169.4 | -3.9 | 108.2 | E349 | R347-E349 PolarHBondContact O-N 2.93Å; R347-E349 VanDerWaalsContact O-N 3.11Å |
| 348 | V | 34.3 | Very low | 36.4 | Very low | 138 Ų | 138 | 160.2 Ų | 160.2 | 84% | 0.836 | 81% | 0.806 | S | S | * | * | | | trans | -75.2 | 102.6 | 162.6 | 178.6 | 0 | 0 | 0 | 0 | 107.7 | V350 | V348-V350 PolarHBondContact O-N 2.93Š|
| 349 | E | 34.5 | Very low | 36.6 | Very low | 172 Ų | 172 | 156.8 Ų | 156.8 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | | | trans | -71.9 | 120.1 | -178.6 | -167.8 | 162.1 | -144.6 | 0 | 0 | 110.3 | R347 L351 | R347-E349 PolarHBondContact O-N 2.93Å; R347-E349 VanDerWaalsContact O-N 3.11Å; E349-L351 PolarHBondContact O-N 3.3Å |
| 350 | V | 42.4 | Very low | 35.9 | Very low | 139 Ų | 139 | 157.2 Ų | 157.2 | 84% | 0.842 | 80% | 0.804 | S | S | * | * | | | trans | -76.5 | 107.8 | 173.1 | 173.2 | 0 | 0 | 0 | 0 | 108.3 | V348 | V348-V350 PolarHBondContact O-N 2.93Š|
| 351 | L | 34.4 | Very low | 35.7 | Very low | 154 Ų | 154 | 156.8 Ų | 156.8 | 81% | 0.806 | 81% | 0.806 | S | S | * | * | | | trans | -111.8 | 126.9 | 168.9 | -160.3 | 72.9 | 0 | 0 | 0 | 110 | E349 | E349-L351 PolarHBondContact O-N 3.3Š|
| 352 | P | 40.3 | Very low | 35.8 | Very low | 111 Ų | 111 | 156.3 Ų | 156.3 | 72% | 0.721 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 129.3 | -175.2 | 29.8 | -34.3 | 0 | 0 | 0 | 111.5 | | |
| 353 | Q | 33.9 | Very low | 36 | Very low | 199 Ų | 199 | 158.4 Ų | 158.4 | 93% | 0.93 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 133.7 | 178.3 | -157.4 | 170.6 | 26.1 | 0 | 0 | 111 | | |
| 354 | A | 30.8 | Very low | 36.1 | Very low | 95 Ų | 95 | 159.6 Ų | 159.6 | 79% | 0.785 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 133 | -169.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | A356 | A354-A356 PolarHBondContact O-N 2.8Å; A354-A356 VanDerWaalsContact O-N 3.12Å |
| 355 | R | 35.5 | Very low | 35.8 | Very low | 228 Ų | 228 | 160.7 Ų | 160.7 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | | | trans | -75.3 | 92.8 | 172.5 | -178.2 | 178.2 | 177.8 | -176.2 | -3.6 | 110 | S357 | R355-S357 PolarHBondContact O-N 3.01Š|
| 356 | A | 31.9 | Very low | 35.7 | Very low | 82 Ų | 82 | 161.1 Ų | 161.1 | 68% | 0.678 | 80% | 0.799 | S | S | * | * | | | trans | -73.3 | 120.4 | 167 | 0 | 0 | 0 | 0 | 0 | 109.7 | A354 | A354-A356 PolarHBondContact O-N 2.8Å; A354-A356 VanDerWaalsContact O-N 3.12Å |
| 357 | S | 36.4 | Very low | 36.1 | Very low | 89 Ų | 89 | 156.7 Ų | 156.7 | 62% | 0.622 | 79% | 0.791 | S | S | * | * | | | trans | -80.9 | 125.3 | -178.6 | -172.9 | 0 | 0 | 0 | 0 | 111.1 | R355 | R355-S357 PolarHBondContact O-N 3.01Š|
| 358 | W | 32.6 | Very low | 36.3 | Very low | 250 Ų | 250 | 151.7 Ų | 151.7 | 95% | 0.947 | 79% | 0.789 | S | S | * | * | | | trans | -124.8 | 78.6 | 163.3 | -68.8 | 108.5 | 0 | 0 | 0 | 108.5 | | |
| 359 | E | 36.1 | Very low | 36.4 | Very low | 155 Ų | 155 | 153.6 Ų | 153.6 | 72% | 0.724 | 79% | 0.788 | S | S | * | * | | | trans | -119.8 | 139.1 | 167.1 | -77.2 | -176.5 | 67.5 | 0 | 0 | 109 | | |
| 360 | S | 35 | Very low | 36.8 | Very low | 117 Ų | 117 | 148.8 Ų | 148.8 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | | | trans | 78.6 | 98.1 | 170.5 | -150.3 | 0 | 0 | 0 | 0 | 118.2 | | |
| 361 | L | 34.3 | Very low | 36.7 | Very low | 149 Ų | 149 | 150.8 Ų | 150.8 | 78% | 0.78 | 78% | 0.778 | S | S | * | * | | | | -165.1 | 87.2 | 101.7 | -147.5 | 106.6 | 0 | 0 | 0 | 111.8 | | |
| 362 | D | 37.4 | Very low | 36.7 | Very low | 168 Ų | 168 | 149.1 Ų | 149.1 | 90% | 0.898 | 78% | 0.779 | S | S | * | * | | | trans | -114.9 | 77 | 169.7 | -82.8 | -53.6 | 0 | 0 | 0 | 109.4 | E364 | D362-E364 PolarHBondContact O-N 3.02Š|
| 363 | E | 43.4 | Very low | 37 | Very low | 166 Ų | 166 | 155.7 Ų | 155.7 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | | | trans | -82.1 | 106.6 | 179.6 | -160.2 | 72.4 | -177.5 | 0 | 0 | 111.1 | | |
| 364 | E | 42.3 | Very low | 37.4 | Very low | 129 Ų | 129 | 152.3 Ų | 152.3 | 60% | 0.603 | 78% | 0.783 | S | S | * | * | | | trans | 44.5 | 78.8 | 151.8 | -159.8 | 172.1 | -153.3 | 0 | 0 | 119.4 | D362 R366 | D362-E364 PolarHBondContact O-N 3.02Å; E364-R366 HydrophobicContact CG-CB 4.29Å; E364-R366 HydrophobicContact CG-CG 3.62Å; E364-R366 PolarHBondContact O-N 2.75Å; E364-R366 WeakPolarHBondContact OE1-CG 3.44Å; E364-R366 IonicContact OE1-NE 3.27Å; E364-R366 PolarHBondContact OE1-NE 3Å |
| 365 | W | 29.7 | Very low | 38 | Very low | 247 Ų | 247 | 153.7 Ų | 153.7 | 94% | 0.936 | 78% | 0.784 | S | S | * | * | | | trans | -83.9 | 84.1 | 151.9 | -167.2 | -97.9 | 0 | 0 | 0 | 111.4 | A367 | W365-A367 PolarHBondContact O-N 3.26Š|
| 366 | R | 34.8 | Very low | 38.5 | Very low | 195 Ų | 195 | 149.1 Ų | 149.1 | 74% | 0.736 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 124.6 | 171.4 | -95.7 | -87 | -162 | 143.7 | 6.1 | 111.4 | E364 | E364-R366 HydrophobicContact CG-CB 4.29Å; E364-R366 HydrophobicContact CG-CG 3.62Å; E364-R366 PolarHBondContact O-N 2.75Å; E364-R366 WeakPolarHBondContact OE1-CG 3.44Å; E364-R366 IonicContact OE1-NE 3.27Å; E364-R366 PolarHBondContact OE1-NE 3Å |
| 367 | A | 42.2 | Very low | 38.9 | Very low | 80 Ų | 80 | 150.8 Ų | 150.8 | 66% | 0.661 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 137.7 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | W365 Q369 | W365-A367 PolarHBondContact O-N 3.26Å; A367-Q369 PolarHBondContact O-N 3.37Å |
| 368 | P | 39.8 | Very low | 39.7 | Very low | 123 Ų | 123 | 151.9 Ų | 151.9 | 80% | 0.799 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 121.4 | 173.6 | 28.1 | -30.1 | 0 | 0 | 0 | 110.8 | | |
| 369 | Q | 37.1 | Very low | 40.6 | Very low | 177 Ų | 177 | 146.3 Ų | 146.3 | 83% | 0.827 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 148 | 167 | -83.8 | -80.7 | 11.3 | 0 | 0 | 110.6 | A367 | A367-Q369 PolarHBondContact O-N 3.37Š|
| 370 | A | 42.4 | Very low | 40.9 | Very low | 72 Ų | 72 | 146 Ų | 146 | 60% | 0.595 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 145 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | | |
| 371 | H | 40.8 | Very low | 41.4 | Very low | 180 Ų | 180 | 148.7 Ų | 148.7 | 83% | 0.833 | 79% | 0.794 | S | S | * | * | | | trans | 158 | 95.2 | 140 | -75.9 | -11.8 | 0 | 0 | 0 | 111.4 | | |
| 372 | S | 33.2 | Very low | 41.9 | Very low | 119 Ų | 119 | 146.4 Ų | 146.4 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | | | trans | -174.1 | 131.6 | 138 | 33.7 | 0 | 0 | 0 | 0 | 110.1 | | |
| 373 | R | 48.4 | Very low | 42.1 | Very low | 250 Ų | 250 | 144.8 Ų | 144.8 | 94% | 0.943 | 79% | 0.788 | S | S | * | * | | | trans | -76.9 | 134 | 168.3 | -85.4 | 172.8 | 159.1 | 179.1 | -6.7 | 108.8 | | |
| 374 | T | 40.7 | Very low | 42.1 | Very low | 127 Ų | 127 | 143.1 Ų | 143.1 | 78% | 0.779 | 79% | 0.789 | S | S | * | * | | | trans | -130.1 | 152.3 | 155.1 | 46.6 | 0 | 0 | 0 | 0 | 109.3 | | |
| 375 | P | 43.6 | Very low | 42 | Very low | 124 Ų | 124 | 145.9 Ų | 145.9 | 81% | 0.805 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 142.2 | -166.4 | -0.8 | 18.8 | 0 | 0 | 0 | 112.1 | | |
| 376 | V | 45.8 | Very low | 42.7 | Very low | 132 Ų | 132 | 142.9 Ų | 142.9 | 80% | 0.8 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 128.3 | 172 | -179.3 | 0 | 0 | 0 | 0 | 109.5 | S378 | V376-S378 PolarHBondContact O-N 3.38Š|
| 377 | P | 41.8 | Very low | 42.9 | Very low | 118 Ų | 118 | 143.4 Ų | 143.4 | 77% | 0.766 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 118.5 | 169.8 | 29.2 | -32.3 | 0 | 0 | 0 | 110.3 | T379 | P377-T379 PolarHBondContact O-N 2.74Š|
| 378 | S | 53.2 | Low | 43 | Very low | 111 Ų | 111 | 144 Ų | 144 | 78% | 0.776 | 81% | 0.809 | S | S | * | * | | | trans | -91.8 | 82.7 | -177.3 | 59.2 | 0 | 0 | 0 | 0 | 112.7 | V376 | V376-S378 PolarHBondContact O-N 3.38Š|
| 379 | T | 51.1 | Low | 43.5 | Very low | 133 Ų | 133 | 146.1 Ų | 146.1 | 82% | 0.816 | 81% | 0.813 | S | S | * | * | | | trans | -159.5 | 89.2 | 163.4 | 36.1 | 0 | 0 | 0 | 0 | 112.9 | P377 | P377-T379 PolarHBondContact O-N 2.74Š|
| 380 | V | 41.1 | Very low | 44.2 | Very low | 148 Ų | 148 | 142 Ų | 142 | 90% | 0.897 | 81% | 0.81 | S | S | * | * | | | trans | -136.3 | 121.9 | 146.3 | -178.7 | 0 | 0 | 0 | 0 | 107.2 | | |
| 381 | Q | 45.6 | Very low | 44.8 | Very low | 175 Ų | 175 | 147.1 Ų | 147.1 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | | | trans | -68.3 | 134.5 | 177.5 | -70 | 165.8 | -57.2 | 0 | 0 | 109.9 | N383 | Q381-N383 PolarHBondContact O-N 2.92Å; Q381-N383 VanDerWaalsContact O-N 3.1Å |
| 382 | A | 45.3 | Very low | 45.4 | Very low | 100 Ų | 100 | 147.5 Ų | 147.5 | 83% | 0.826 | 82% | 0.824 | S | S | * | * | | | trans | -75.3 | 94.6 | 167 | 0 | 0 | 0 | 0 | 0 | 109 | T384 | A382-T384 PolarHBondContact O-N 2.79Š|
| 383 | N | 42.2 | Very low | 46.5 | Very low | 135 Ų | 135 | 149.1 Ų | 149.1 | 72% | 0.722 | 82% | 0.823 | S | S | * | * | | | trans | -76.1 | 101.8 | 164.1 | -92.7 | 2.6 | 0 | 0 | 0 | 108.8 | Q381 F385 | Q381-N383 PolarHBondContact O-N 2.92Å; Q381-N383 VanDerWaalsContact O-N 3.1Å; N383-F385 PolarHBondContact O-N 3.09Å |
| 384 | T | 42.3 | Very low | 47 | Very low | 130 Ų | 130 | 144.4 Ų | 144.4 | 80% | 0.798 | 82% | 0.816 | S | S | * | * | | | trans | -54.4 | 121.7 | 158.1 | -67 | 0 | 0 | 0 | 0 | 108.6 | A382 E386 | A382-T384 PolarHBondContact O-N 2.79Å; T384-E386 PolarHBondContact O-N 3.44Å |
| 385 | F | 41.1 | Very low | 47.9 | Very low | 188 Ų | 188 | 145.1 Ų | 145.1 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | | | trans | -81.4 | 110.6 | 165.3 | -89.3 | -94.5 | 0 | 0 | 0 | 108.5 | N383 | N383-F385 PolarHBondContact O-N 3.09Š|
| 386 | E | 44.1 | Very low | 48.3 | Very low | 183 Ų | 183 | 145.9 Ų | 145.9 | 86% | 0.855 | 81% | 0.813 | S | S | * | * | | | trans | -83 | 126.6 | 168.4 | -167.3 | 167.4 | -141.8 | 0 | 0 | 108.2 | T384 A388 | T384-E386 PolarHBondContact O-N 3.44Å; E386-A388 PolarHBondContact O-N 3.47Å |
| 387 | F | 39.1 | Very low | 48.7 | Very low | 206 Ų | 206 | 147 Ų | 147 | 90% | 0.904 | 81% | 0.807 | S | S | * | * | | | trans | -79.5 | 115 | 173.1 | -92.5 | -101 | 0 | 0 | 0 | 108.6 | | |
| 388 | A | 44.1 | Very low | 49.2 | Very low | 93 Ų | 93 | 151.4 Ų | 151.4 | 77% | 0.769 | 83% | 0.832 | S | S | * | * | | | trans | -89.3 | 109.9 | 164.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | E386 | E386-A388 PolarHBondContact O-N 3.47Š|
| 389 | D | 50.5 | Low | 49 | Very low | 167 Ų | 167 | 153.5 Ų | 153.5 | 89% | 0.893 | 83% | 0.834 | S | S | * | * | | | trans | -66.5 | 131.3 | 158.9 | -99.2 | -33.3 | 0 | 0 | 0 | 108.4 | | |
| 390 | A | 51.3 | Low | 48.9 | Very low | 92 Ų | 92 | 154.5 Ų | 154.5 | 76% | 0.76 | 84% | 0.835 | S | S | * | * | | | trans | -132 | 99.1 | 169.6 | 0 | 0 | 0 | 0 | 0 | 107.7 | | |
| 391 | E | 55.2 | Low | 49.3 | Very low | 178 Ų | 178 | 154.9 Ų | 154.9 | 83% | 0.832 | 83% | 0.832 | S | S | * | * | | | trans | -73.1 | 127.9 | 163.4 | -68.4 | -163.4 | 142.3 | 0 | 0 | 109 | | |
| 392 | E | 54.2 | Low | 49.5 | Very low | 189 Ų | 189 | 153.7 Ų | 153.7 | 88% | 0.883 | 83% | 0.833 | S | S | * | * | | | trans | -113.5 | 91.1 | 158.5 | -79.7 | -173.6 | 143 | 0 | 0 | 107.9 | D394 | E392-D394 PolarHBondContact O-N 3.24Š|
| 393 | D | 54.6 | Low | 49.8 | Very low | 152 Ų | 152 | 157.1 Ų | 157.1 | 81% | 0.813 | 83% | 0.833 | S | S | * | * | | | trans | -71.3 | 109.7 | 158.5 | -102 | -29.5 | 0 | 0 | 0 | 108.2 | | |
| 394 | D | 59 | Low | 50.3 | Low | 151 Ų | 151 | 158.5 Ų | 158.5 | 81% | 0.807 | 84% | 0.841 | S | S | * | * | | | trans | -104.6 | 96.9 | 170.8 | -125.1 | -25 | 0 | 0 | 0 | 110.1 | E392 V396 | E392-D394 PolarHBondContact O-N 3.24Å; D394-V396 PolarHBondContact O-N 3.33Å |
| 395 | E | 59.8 | Low | 50.8 | Low | 142 Ų | 142 | 160.6 Ų | 160.6 | 66% | 0.664 | 84% | 0.844 | S | S | * | * | | | trans | -72.2 | 103.4 | -175.4 | -170.5 | -164.6 | 168.1 | 0 | 0 | 111.2 | K397 | E395-K397 PolarHBondContact O-N 3.04Å; E395-K397 WeakPolarHBondContact OE1-CE 3.1Å; E395-K397 IonicContact OE1-NZ 2.84Å; E395-K397 PolarHBondContact OE1-NZ 3.42Å; E395-K397 IonicContact OE2-NZ 2.84Å; E395-K397 PolarHBondContact OE2-NZ 3.27Å |
| 396 | V | 51.9 | Low | 51.6 | Low | 141 Ų | 141 | 158.5 Ų | 158.5 | 86% | 0.855 | 85% | 0.845 | S | S | * | * | | | trans | -71.7 | 96.9 | 176.9 | -163.5 | 0 | 0 | 0 | 0 | 110.5 | D394 | D394-V396 PolarHBondContact O-N 3.33Š|
| 397 | K | 55.1 | Low | 52.2 | Low | 154 Ų | 154 | 156.4 Ų | 156.4 | 67% | 0.67 | 84% | 0.844 | S | S | * | * | | | trans | -77.4 | 142.6 | 174.9 | -100.1 | 175.2 | 179.8 | 106.2 | 0 | 113 | E395 | E395-K397 PolarHBondContact O-N 3.04Å; E395-K397 WeakPolarHBondContact OE1-CE 3.1Å; E395-K397 IonicContact OE1-NZ 2.84Å; E395-K397 PolarHBondContact OE1-NZ 3.42Å; E395-K397 IonicContact OE2-NZ 2.84Å; E395-K397 PolarHBondContact OE2-NZ 3.27Å |
| 398 | V | 51.6 | Low | 53.4 | Low | 212 Ų | 212 | 151.9 Ų | 151.9 | 100% | 1.285 | 84% | 0.839 | S | S | * | * | | | trans | -71.1 | 0 | -164.5 | -156.5 | 0 | 0 | 0 | 0 | 113.9 | | |