| 1 | M | 61.6 | Low | 68.8 | Low | 220 Ų | 220 | 150.7 Ų | 150.7 | 100% | 1.084 | 81% | 0.806 | S | S | * | * | | | | 0 | 120.2 | 0 | 7.2 | 72.1 | 90.7 | 0 | 0 | 105.3 | L3 | M1-L3 VanDerWaalsContact O-N 3.13Å; M1-L3 PolarHBondContact O-N 3.13Å |
| 2 | D | 73.9 | Confident | 68.1 | Low | 154 Ų | 154 | 153.5 Ų | 153.5 | 82% | 0.824 | 80% | 0.797 | S | S | * | * | | | trans | -65.6 | 114.3 | -170.1 | -62.5 | -46.3 | 0 | 0 | 0 | 110.1 | F4 | D2-F4 PolarHBondContact O-N 3.26Š|
| 3 | L | 74.8 | Confident | 67.7 | Low | 159 Ų | 159 | 147.5 Ų | 147.5 | 83% | 0.832 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | -4.6 | -179.1 | -173.4 | 57.3 | 0 | 0 | 0 | 112.7 | M1 | M1-L3 VanDerWaalsContact O-N 3.13Å; M1-L3 PolarHBondContact O-N 3.13Å |
| 4 | F | 71.4 | Confident | 66.9 | Low | 188 Ų | 188 | 145.7 Ų | 145.7 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.4 | 7.8 | -177.7 | -63.3 | -82.5 | 0 | 0 | 0 | 113.4 | D2 | D2-F4 PolarHBondContact O-N 3.26Š|
| 5 | G | 65.4 | Low | 66.6 | Low | 62 Ų | 62 | 147.7 Ų | 147.7 | 64% | 0.639 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -80 | -15 | -174.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | | |
| 6 | D | 69.1 | Low | 65.8 | Low | 161 Ų | 161 | 146.3 Ų | 146.3 | 86% | 0.861 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -121.1 | 10.9 | -172.5 | -64.9 | -39.8 | 0 | 0 | 0 | 114.1 | P8 | D6-P8 WeakPolarHBondContact O-CD 3.27Š|
| 7 | L | 70.6 | Confident | 64.9 | Low | 143 Ų | 143 | 143.4 Ų | 143.4 | 75% | 0.749 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -72.2 | 121.3 | 169.9 | -168 | 71.4 | 0 | 0 | 0 | 106.8 | E9 | L7-E9 VanDerWaalsContact O-N 3.17Å; L7-E9 PolarHBondContact O-N 3.17Å |
| 8 | P | 72.1 | Confident | 64.5 | Low | 101 Ų | 101 | 141.7 Ų | 141.7 | 66% | 0.656 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 131.2 | 174.3 | 23.2 | -33 | 0 | 0 | 0 | 107.4 | D6 | D6-P8 WeakPolarHBondContact O-CD 3.27Š|
| 9 | E | 69.4 | Low | 64.1 | Low | 172 Ų | 172 | 137.6 Ų | 137.6 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 125.2 | 168.5 | -84.2 | -148.2 | 145.8 | 0 | 0 | 106.2 | L7 E11 | L7-E9 VanDerWaalsContact O-N 3.17Å; L7-E9 PolarHBondContact O-N 3.17Å; E9-E11 PolarHBondContact O-N 2.78Å |
| 10 | P | 67.6 | Low | 63.8 | Low | 112 Ų | 112 | 139.5 Ų | 139.5 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | | | trans | -55.1 | 111.8 | 177.8 | 22.1 | -31.4 | 0 | 0 | 0 | 105.6 | R12 | P10-R12 WeakPolarHBondContact O-CA 3.44Å; P10-R12 PolarHBondContact O-N 3.06Å |
| 11 | E | 60.5 | Low | 63.5 | Low | 186 Ų | 186 | 140.2 Ų | 140.2 | 87% | 0.869 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -40.3 | 105.5 | -169.8 | -69 | -173.1 | 139.3 | 0 | 0 | 108.4 | E9 A13 | E9-E11 PolarHBondContact O-N 2.78Å; E11-A13 VanDerWaalsContact C-N 3.34Å; E11-A13 WeakPolarHBondContact O-CA 3.47Å; E11-A13 PolarHBondContact O-N 2.82Å |
| 12 | R | 60.8 | Low | 63.3 | Low | 184 Ų | 184 | 135.1 Ų | 135.1 | 69% | 0.694 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -15.9 | 92.2 | -171.1 | -164.9 | -176 | -128.3 | 152.9 | 1 | 110.3 | P10 | P10-R12 WeakPolarHBondContact O-CA 3.44Å; P10-R12 PolarHBondContact O-N 3.06Å |
| 13 | A | 62.1 | Low | 62.5 | Low | 76 Ų | 76 | 136.5 Ų | 136.5 | 63% | 0.628 | 77% | 0.766 | S | S | * | * | | | trans | -41.3 | 135.2 | -174.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | E11 R15 | E11-A13 VanDerWaalsContact C-N 3.34Å; E11-A13 WeakPolarHBondContact O-CA 3.47Å; E11-A13 PolarHBondContact O-N 2.82Å; A13-R15 PolarHBondContact O-N 2.78Å |
| 14 | P | 57.6 | Low | 61.5 | Low | 122 Ų | 122 | 131.9 Ų | 131.9 | 79% | 0.792 | 76% | 0.757 | S | S | * | * | | | trans | -42.7 | 108.7 | -167.2 | -26.6 | 29.4 | 0 | 0 | 0 | 108.6 | P16 | P14-P16 VanDerWaalsContact O-CD 3.27Å; P14-P16 WeakPolarHBondContact O-CD 3.43Å |
| 15 | R | 61.5 | Low | 60.8 | Low | 175 Ų | 175 | 131.7 Ų | 131.7 | 66% | 0.66 | 75% | 0.751 | S | S | * | * | | | trans | -53.2 | 117 | 172.4 | -79 | -173.3 | -97.5 | -175 | -6.8 | 102.8 | A13 S17 | A13-R15 PolarHBondContact O-N 2.78Å; R15-S17 VanDerWaalsContact C-N 3.3Å; R15-S17 PolarHBondContact O-N 2.79Å |
| 16 | P | 54.3 | Low | 60.5 | Low | 126 Ų | 126 | 132.8 Ų | 132.8 | 82% | 0.818 | 75% | 0.747 | S | S | * | * | | | trans | -54.8 | 107.6 | -174.3 | 18.7 | -29.7 | 0 | 0 | 0 | 105.5 | P14 A18 | P14-P16 VanDerWaalsContact O-CD 3.27Å; P14-P16 WeakPolarHBondContact O-CD 3.43Å; P16-A18 PolarHBondContact O-N 2.7Å |
| 17 | S | 50.7 | Low | 60.1 | Low | 96 Ų | 96 | 130.3 Ų | 130.3 | 67% | 0.671 | 74% | 0.737 | S | S | * | * | | | trans | -58 | 119.8 | 174.8 | 49.8 | 0 | 0 | 0 | 0 | 103.6 | R15 G19 | R15-S17 VanDerWaalsContact C-N 3.3Å; R15-S17 PolarHBondContact O-N 2.79Å; S17-G19 PolarHBondContact O-N 2.87Å |
| 18 | A | 58.2 | Low | 59.7 | Low | 113 Ų | 113 | 129.7 Ų | 129.7 | 93% | 0.934 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -44.7 | 112 | 173.7 | 0 | 0 | 0 | 0 | 0 | 108.3 | P16 | P16-A18 PolarHBondContact O-N 2.7Š|
| 19 | G | 56 | Low | 59.1 | Low | 64 Ų | 64 | 132.1 Ų | 132.1 | 66% | 0.66 | 74% | 0.735 | S | S | * | * | | | trans | 104.4 | 76.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | S17 | S17-G19 PolarHBondContact O-N 2.87Š|
| 20 | K | 58.4 | Low | 58.7 | Low | 175 Ų | 175 | 129.7 Ų | 129.7 | 76% | 0.761 | 72% | 0.723 | S | S | * | * | S | Bend | | -179.7 | 110.4 | 116.3 | -120.2 | 135.8 | 160.7 | 168.5 | 0 | 110.6 | A22 | K20-A22 PolarHBondContact O-N 3.03Š|
| 21 | E | 57.1 | Low | 58.5 | Low | 156 Ų | 156 | 131.4 Ų | 131.4 | 73% | 0.729 | 73% | 0.726 | S | S | * | * | | | trans | 54.6 | 62.8 | 133.4 | -57.2 | 169.4 | -142.3 | 0 | 0 | 116.5 | Q23 | E21-Q23 PolarHBondContact O-N 3.38Š|
| 22 | A | 57 | Low | 58.6 | Low | 112 Ų | 112 | 128 Ų | 128 | 93% | 0.926 | 71% | 0.714 | S | S | * | * | | | trans | -76.8 | 59.1 | 148 | 0 | 0 | 0 | 0 | 0 | 109.1 | K20 | K20-A22 PolarHBondContact O-N 3.03Š|
| 23 | Q | 56.9 | Low | 58.8 | Low | 184 Ų | 184 | 124.4 Ų | 124.4 | 86% | 0.86 | 71% | 0.714 | S | S | * | * | | | trans | -106.9 | 95.7 | 169.3 | -75.2 | -111.1 | -2.4 | 0 | 0 | 106.3 | E21 | E21-Q23 PolarHBondContact O-N 3.38Š|
| 24 | G | 53.8 | Low | 58.7 | Low | 62 Ų | 62 | 126.3 Ų | 126.3 | 64% | 0.639 | 72% | 0.72 | S | S | * | * | | | trans | 145 | 94.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | | |
| 25 | R | 58 | Low | 58.6 | Low | 183 Ų | 183 | 125 Ų | 125 | 69% | 0.691 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -48.1 | 138.3 | 141.7 | -74.8 | 168.1 | 67.5 | 176.7 | -0.4 | 106.4 | V27 E30 | R25-V27 PolarHBondContact O-N 2.68Å; R25-V27 WeakPolarHBondContact O-CG2 3.32Å; R25-E30 IonicContact CZ-OE1 3.6Å; R25-E30 IonicContact NH2-OE1 2.68Å; R25-E30 PolarHBondContact NH2-OE1 2.84Å; R25-E30 IonicContact NH2-OE2 3.83Å |
| 26 | P | 59.6 | Low | 58.1 | Low | 86 Ų | 86 | 121.9 Ų | 121.9 | 56% | 0.558 | 72% | 0.724 | S | S | * | * | | | trans | -58.1 | 106.9 | 172.9 | 24 | -31.5 | 0 | 0 | 0 | 107.6 | L28 | P26-L28 PolarHBondContact O-N 2.81Š|
| 27 | V | 60 | Low | 57.9 | Low | 108 Ų | 108 | 120.9 Ų | 120.9 | 66% | 0.655 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.6 | 18.7 | -174.5 | -145.2 | 0 | 0 | 0 | 0 | 111.9 | R25 | R25-V27 PolarHBondContact O-N 2.68Å; R25-V27 WeakPolarHBondContact O-CG2 3.32Å |
| 28 | L | 61.3 | Low | 58.3 | Low | 130 Ų | 130 | 122 Ų | 122 | 68% | 0.681 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.8 | -13.9 | -174.4 | -58.7 | 179.3 | 0 | 0 | 0 | 112.7 | P26 L32 | P26-L28 PolarHBondContact O-N 2.81Å; L28-L32 WeakPolarHBondContact O-CG 3.45Å; L28-L32 WeakPolarHBondContact O-CD1 3.47Å |
| 29 | F | 60.5 | Low | 57.9 | Low | 153 Ų | 153 | 123.1 Ų | 123.1 | 67% | 0.671 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -109.6 | -2.8 | -179.8 | -59.6 | -72.3 | 0 | 0 | 0 | 113.9 | | |
| 30 | E | 60.4 | Low | 58.1 | Low | 121 Ų | 121 | 125.1 Ų | 125.1 | 57% | 0.565 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -101.8 | -12.7 | -179.3 | -51.6 | -63.3 | 155.2 | 0 | 0 | 112.5 | R25 | R25-E30 IonicContact CZ-OE1 3.6Å; R25-E30 IonicContact NH2-OE1 2.68Å; R25-E30 PolarHBondContact NH2-OE1 2.84Å; R25-E30 IonicContact NH2-OE2 3.83Å |
| 31 | D | 64 | Low | 58.1 | Low | 148 Ų | 148 | 119.7 Ų | 119.7 | 79% | 0.791 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -114.7 | 15.1 | 177.4 | -150.4 | 28.8 | 0 | 0 | 0 | 112.6 | | |
| 32 | L | 63.4 | Low | 58.3 | Low | 115 Ų | 115 | 118.5 Ų | 118.5 | 60% | 0.602 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -93.4 | 127.2 | 164.7 | -64.2 | 178.2 | 0 | 0 | 0 | 107.6 | L28 | L28-L32 WeakPolarHBondContact O-CG 3.45Å; L28-L32 WeakPolarHBondContact O-CD1 3.47Å |
| 33 | P | 63.2 | Low | 58.5 | Low | 107 Ų | 107 | 116.4 Ų | 116.4 | 70% | 0.695 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 138.3 | 165.4 | 25.9 | -32.4 | 0 | 0 | 0 | 107.1 | A35 | P33-A35 PolarHBondContact O-N 2.85Š|
| 34 | P | 61.7 | Low | 59 | Low | 116 Ų | 116 | 110.1 Ų | 110.1 | 75% | 0.753 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -49.9 | 122.7 | 176.3 | 20.3 | -31 | 0 | 0 | 0 | 107.2 | S36 | P34-S36 VanDerWaalsContact C-N 3.34Å; P34-S36 PolarHBondContact O-N 3.26Å |
| 35 | A | 53.7 | Low | 59.5 | Low | 94 Ų | 94 | 111.1 Ų | 111.1 | 78% | 0.777 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -51.7 | 103.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | P33 S37 | P33-A35 PolarHBondContact O-N 2.85Å; A35-S37 PolarHBondContact O-N 2.93Å |
| 36 | S | 53 | Low | 59.9 | Low | 110 Ų | 110 | 108.9 Ų | 108.9 | 77% | 0.769 | 69% | 0.69 | S | S | * | * | | | trans | 27.1 | 64.1 | 162.5 | -165.2 | 0 | 0 | 0 | 0 | 114.8 | P34 T38 | P34-S36 VanDerWaalsContact C-N 3.34Å; P34-S36 PolarHBondContact O-N 3.26Å; S36-T38 PolarHBondContact O-N 2.91Å; S36-T38 VanDerWaalsContact O-N 3.13Å |
| 37 | S | 50.2 | Low | 60 | Low | 106 Ų | 106 | 112.6 Ų | 112.6 | 74% | 0.741 | 71% | 0.705 | S | S | * | * | | | trans | -80 | 90.2 | 155.4 | -72.9 | 0 | 0 | 0 | 0 | 106.8 | A35 D39 | A35-S37 PolarHBondContact O-N 2.93Å; S37-D39 PolarHBondContact O-N 2.73Å |
| 38 | T | 57.3 | Low | 59.9 | Low | 118 Ų | 118 | 114.3 Ų | 114.3 | 72% | 0.724 | 70% | 0.703 | S | S | * | * | | | trans | -62.4 | 67.6 | 154.1 | -179.8 | 0 | 0 | 0 | 0 | 109.3 | S36 S40 | S36-T38 PolarHBondContact O-N 2.91Å; S36-T38 VanDerWaalsContact O-N 3.13Å; T38-S40 PolarHBondContact O-N 2.99Å; T38-S40 PolarHBondContact O-OG 3.15Å |
| 39 | D | 49.5 | Very low | 59.9 | Low | 137 Ų | 137 | 114.4 Ų | 114.4 | 73% | 0.733 | 71% | 0.705 | S | S | * | * | | | trans | -92.3 | 85 | 163.1 | -168.6 | 54.3 | 0 | 0 | 0 | 106.1 | S37 G41 | S37-D39 PolarHBondContact O-N 2.73Å; D39-G41 VanDerWaalsContact C-N 3.27Å; D39-G41 PolarHBondContact O-N 3.49Å |
| 40 | S | 61.2 | Low | 60 | Low | 106 Ų | 106 | 114.5 Ų | 114.5 | 74% | 0.741 | 71% | 0.712 | S | S | * | * | | | | 47.1 | 50.8 | 85.8 | -61.9 | 0 | 0 | 0 | 0 | 112.9 | T38 | T38-S40 PolarHBondContact O-N 2.99Å; T38-S40 PolarHBondContact O-OG 3.15Å |
| 41 | G | 57.4 | Low | 60.3 | Low | 61 Ų | 61 | 113.9 Ų | 113.9 | 63% | 0.629 | 71% | 0.712 | S | S | * | * | | | trans | -142.8 | 82.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | D39 G43 | D39-G41 VanDerWaalsContact C-N 3.27Å; D39-G41 PolarHBondContact O-N 3.49Å; G41-G43 PolarHBondContact O-N 3.13Å |
| 42 | S | 63.1 | Low | 60.3 | Low | 131 Ų | 131 | 112.1 Ų | 112.1 | 92% | 0.916 | 71% | 0.709 | S | S | * | * | | | trans | -13.8 | 88.4 | 156.4 | 163.5 | 0 | 0 | 0 | 0 | 115.2 | | |
| 43 | G | 61.1 | Low | 60.5 | Low | 68 Ų | 68 | 112.5 Ų | 112.5 | 70% | 0.701 | 72% | 0.718 | S | S | * | * | | | trans | -114.6 | 47.7 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114 | G41 | G41-G43 PolarHBondContact O-N 3.13Š|
| 44 | G | 66.7 | Low | 60.3 | Low | 53 Ų | 53 | 111.7 Ų | 111.7 | 55% | 0.546 | 72% | 0.721 | S | S | . | * | | | trans | 75.9 | 146 | 167.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | L46 | G44-L46 PolarHBondContact O-N 3.1Š|
| 45 | P | 63.9 | Low | 60.1 | Low | 82 Ų | 82 | 111.4 Ų | 111.4 | 53% | 0.532 | 73% | 0.728 | S | S | . | * | | | trans | -65 | 107.3 | 174.4 | 28.5 | -31.4 | 0 | 0 | 0 | 108.6 | L47 F48 | P45-L47 PolarHBondContact O-N 2.94Å; P45-L47 VanDerWaalsContact O-N 3.1Å; P45-F48 HydrophobicContact CB-CD2 4.2Å |
| 46 | L | 66.4 | Low | 60.6 | Low | 137 Ų | 137 | 112.5 Ų | 112.5 | 72% | 0.717 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -51.1 | 116.3 | 172.9 | -61.2 | 172.8 | 0 | 0 | 0 | 109.6 | G44 F48 | G44-L46 PolarHBondContact O-N 3.1Å; L46-F48 WeakPolarHBondContact O-CD2 3.41Å; L46-F48 WeakPolarHBondContact O-CE2 2.99Å; L46-F48 PolarHBondContact O-N 3.2Å |
| 47 | L | 61.8 | Low | 60.9 | Low | 164 Ų | 164 | 110.7 Ų | 110.7 | 86% | 0.859 | 73% | 0.728 | S | S | * | * | S | Bend | trans | 57.1 | 7.9 | 160.5 | -54.3 | 174.4 | 0 | 0 | 0 | 117.2 | P45 | P45-L47 PolarHBondContact O-N 2.94Å; P45-L47 VanDerWaalsContact O-N 3.1Å |
| 48 | F | 57.2 | Low | 60.7 | Low | 143 Ų | 143 | 112.8 Ų | 112.8 | 63% | 0.627 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -83.2 | -3.7 | 167.8 | -60.8 | -74.6 | 0 | 0 | 0 | 112 | P45 L46 D50 L51 | P45-F48 HydrophobicContact CB-CD2 4.2Å; L46-F48 WeakPolarHBondContact O-CD2 3.41Å; L46-F48 WeakPolarHBondContact O-CE2 2.99Å; L46-F48 PolarHBondContact O-N 3.2Å; F48-D50 PolarHBondContact O-N 3.35Å; F48-L51 HydrophobicContact CD1-CD1 4.18Å; F48-L51 PolarHBondContact O-N 2.78Å |
| 49 | D | 62.8 | Low | 60.8 | Low | 132 Ų | 132 | 113.1 Ų | 113.1 | 71% | 0.706 | 74% | 0.739 | S | S | * | * | G | 310 helix | trans | -69.6 | -10.2 | -178.4 | -66.4 | -38.7 | 0 | 0 | 0 | 113.5 | | |
| 50 | D | 61.8 | Low | 60.7 | Low | 155 Ų | 155 | 108.9 Ų | 108.9 | 83% | 0.829 | 73% | 0.727 | S | S | * | * | G | 310 helix | trans | -132.3 | 33.1 | 173.4 | -144.1 | 10.2 | 0 | 0 | 0 | 113.1 | F48 | F48-D50 PolarHBondContact O-N 3.35Š|
| 51 | L | 66.3 | Low | 60.6 | Low | 108 Ų | 108 | 108.4 Ų | 108.4 | 57% | 0.565 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -108.5 | 133.5 | 160.5 | -65.5 | 178.6 | 0 | 0 | 0 | 107.7 | F48 P53 | F48-L51 HydrophobicContact CD1-CD1 4.18Å; F48-L51 PolarHBondContact O-N 2.78Å; L51-P53 VanDerWaalsContact O-N 3.17Å |
| 52 | P | 65.5 | Low | 60.4 | Low | 111 Ų | 111 | 114.5 Ų | 114.5 | 72% | 0.721 | 73% | 0.733 | S | S | * | * | | | trans | -53.6 | 131.7 | 169.8 | 25.4 | -32.8 | 0 | 0 | 0 | 106.5 | A54 | P52-A54 PolarHBondContact O-N 2.6Š|
| 53 | P | 67.4 | Low | 59.8 | Low | 124 Ų | 124 | 112.6 Ų | 112.6 | 81% | 0.805 | 72% | 0.719 | S | S | * | * | | | trans | -49.4 | 117.1 | -176.3 | 15.8 | -28.6 | 0 | 0 | 0 | 107.4 | L51 A55 | L51-P53 VanDerWaalsContact O-N 3.17Å; P53-A55 PolarHBondContact O-N 2.95Å |
| 54 | A | 57.9 | Low | 59.1 | Low | 90 Ų | 90 | 121.8 Ų | 121.8 | 74% | 0.744 | 73% | 0.733 | S | S | * | * | | | trans | -49 | 115.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 104.9 | P52 S56 | P52-A54 PolarHBondContact O-N 2.6Å; A54-S56 PolarHBondContact O-N 2.88Å; A54-S56 WeakPolarHBondContact O-CB 3.47Å |
| 55 | A | 58.6 | Low | 58.6 | Low | 109 Ų | 109 | 127 Ų | 127 | 90% | 0.901 | 75% | 0.748 | S | S | * | * | | | trans | -63 | 81.1 | -166.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | P53 G57 | P53-A55 PolarHBondContact O-N 2.95Å; A55-G57 PolarHBondContact O-N 3.4Å |
| 56 | S | 62.6 | Low | 58.2 | Low | 117 Ų | 117 | 126.7 Ų | 126.7 | 82% | 0.818 | 75% | 0.751 | S | S | * | * | | | trans | -95.3 | 92.2 | -179.1 | 179.4 | 0 | 0 | 0 | 0 | 105.8 | A54 | A54-S56 PolarHBondContact O-N 2.88Å; A54-S56 WeakPolarHBondContact O-CB 3.47Å |
| 57 | G | 60.3 | Low | 57.8 | Low | 72 Ų | 72 | 127 Ų | 127 | 74% | 0.742 | 76% | 0.759 | S | S | * | * | | | trans | 61.9 | 94.8 | 150.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | A55 | A55-G57 PolarHBondContact O-N 3.4Š|
| 58 | N | 46.1 | Very low | 57.4 | Low | 151 Ų | 151 | 122 Ų | 122 | 81% | 0.807 | 75% | 0.748 | S | S | * | * | | | | -133.3 | 113 | 124.3 | -164.8 | 39.8 | 0 | 0 | 0 | 109.8 | G60 | N58-G60 PolarHBondContact O-N 3.1Š|
| 59 | S | 58.6 | Low | 57.1 | Low | 125 Ų | 125 | 124.1 Ų | 124.1 | 87% | 0.874 | 76% | 0.757 | S | S | * | * | | | trans | -63 | 93.5 | 158.7 | -178.6 | 0 | 0 | 0 | 0 | 106.9 | | |
| 60 | G | 47.9 | Very low | 57 | Low | 47 Ų | 47 | 123.1 Ų | 123.1 | 49% | 0.485 | 76% | 0.76 | S | S | . | * | | | trans | -140.9 | 89.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 107.7 | N58 | N58-G60 PolarHBondContact O-N 3.1Š|
| 61 | S | 59.4 | Low | 56.9 | Low | 97 Ų | 97 | 126.2 Ų | 126.2 | 68% | 0.678 | 76% | 0.76 | S | S | * | * | | | trans | -29.6 | 140.8 | 147.4 | 176.4 | 0 | 0 | 0 | 0 | 111.4 | | |
| 62 | F | 52.8 | Low | 56.9 | Low | 188 Ų | 188 | 126 Ų | 126 | 83% | 0.825 | 77% | 0.768 | S | S | * | * | | | trans | 77.5 | 104.8 | -176.1 | -55 | -86.4 | 0 | 0 | 0 | 113.9 | | |
| 63 | C | 51.6 | Low | 57 | Low | 91 Ų | 91 | 127.7 Ų | 127.7 | 62% | 0.615 | 77% | 0.77 | S | S | * | * | | | | -166.5 | 64.6 | 77.5 | -138.2 | 0 | 0 | 0 | 0 | 112.7 | L65 | C63-L65 PolarHBondContact O-N 2.88Å; C63-L65 VanDerWaalsContact O-N 3.1Å |
| 64 | W | 46 | Very low | 56.8 | Low | 261 Ų | 261 | 127.1 Ų | 127.1 | 99% | 0.989 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.2 | 5.9 | 164 | -80.7 | 89.8 | 0 | 0 | 0 | 113.1 | | |
| 65 | L | 56.7 | Low | 57 | Low | 164 Ų | 164 | 131 Ų | 131 | 86% | 0.859 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.9 | 2 | -174.7 | -112.1 | 94.3 | 0 | 0 | 0 | 115.3 | C63 | C63-L65 PolarHBondContact O-N 2.88Å; C63-L65 VanDerWaalsContact O-N 3.1Å |
| 66 | A | 55.4 | Low | 57.1 | Low | 74 Ų | 74 | 135.8 Ų | 135.8 | 61% | 0.612 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -103.2 | 5.1 | -173.1 | 0 | 0 | 0 | 0 | 0 | 116 | | |
| 67 | T | 57.2 | Low | 56.9 | Low | 145 Ų | 145 | 139.3 Ų | 139.3 | 89% | 0.89 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -135.6 | 59.5 | 173 | 54.2 | 0 | 0 | 0 | 0 | 111.4 | | |
| 68 | G | 53.8 | Low | 56.8 | Low | 59 Ų | 59 | 147.5 Ų | 147.5 | 61% | 0.608 | 80% | 0.796 | S | S | * | * | | | trans | -170.6 | 44.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | S70 | G68-S70 PolarHBondContact O-N 2.95Š|
| 69 | F | 50.5 | Low | 57.3 | Low | 186 Ų | 186 | 147.4 Ų | 147.4 | 82% | 0.816 | 80% | 0.795 | S | S | * | * | | | trans | -37.9 | 111.4 | 162.7 | -178.8 | -99.9 | 0 | 0 | 0 | 109.3 | R71 | F69-R71 HydrophobicContact CD1-CG 3.98Å; F69-R71 HydrophobicContact CE1-CG 4.21Å; F69-R71 PolarHBondContact O-N 3.17Å |
| 70 | S | 60.2 | Low | 57.3 | Low | 112 Ų | 112 | 148.5 Ų | 148.5 | 78% | 0.783 | 79% | 0.791 | S | S | * | * | | | trans | -56.3 | 95.4 | -178.2 | -55.5 | 0 | 0 | 0 | 0 | 110.2 | G68 S72 | G68-S70 PolarHBondContact O-N 2.95Å; S70-S72 VanDerWaalsContact C-N 3.3Å; S70-S72 PolarHBondContact O-N 2.86Å |
| 71 | R | 60 | Low | 57.8 | Low | 220 Ų | 220 | 154.2 Ų | 154.2 | 83% | 0.83 | 81% | 0.808 | S | S | * | * | | | trans | -85.6 | 87.9 | 161.6 | -71.9 | -165.5 | -67.7 | -137.8 | -1.2 | 107.9 | F69 L73 | F69-R71 HydrophobicContact CD1-CG 3.98Å; F69-R71 HydrophobicContact CE1-CG 4.21Å; F69-R71 PolarHBondContact O-N 3.17Å; R71-L73 PolarHBondContact O-N 3.2Å |
| 72 | S | 66.3 | Low | 57.7 | Low | 103 Ų | 103 | 157.5 Ų | 157.5 | 72% | 0.72 | 82% | 0.815 | S | S | * | * | | | trans | -26.7 | 112.6 | 159 | -179.5 | 0 | 0 | 0 | 0 | 111.7 | S70 P74 | S70-S72 VanDerWaalsContact C-N 3.3Å; S70-S72 PolarHBondContact O-N 2.86Å; S72-P74 VanDerWaalsContact O-CD 3.32Å; S72-P74 WeakPolarHBondContact O-CD 3.32Å |
| 73 | L | 67.9 | Low | 58 | Low | 146 Ų | 146 | 155.6 Ų | 155.6 | 76% | 0.764 | 82% | 0.815 | S | S | * | * | | | trans | -75.6 | 116 | 162.4 | -94.9 | 143.1 | 0 | 0 | 0 | 107.2 | R71 Q75 | R71-L73 PolarHBondContact O-N 3.2Å; L73-Q75 PolarHBondContact O-N 2.95Å |
| 74 | P | 62.1 | Low | 58.4 | Low | 112 Ų | 112 | 159.9 Ų | 159.9 | 73% | 0.727 | 83% | 0.828 | S | S | * | * | | | trans | -68.3 | 101.4 | 164.5 | 27.3 | -30.5 | 0 | 0 | 0 | 108.2 | S72 K76 | S72-P74 VanDerWaalsContact O-CD 3.32Å; S72-P74 WeakPolarHBondContact O-CD 3.32Å; P74-K76 VanDerWaalsContact C-N 3.3Å; P74-K76 PolarHBondContact O-N 2.95Å |
| 75 | Q | 63.1 | Low | 59.3 | Low | 172 Ų | 172 | 152.7 Ų | 152.7 | 80% | 0.804 | 82% | 0.817 | S | S | * | * | | | trans | -61.7 | 94.5 | 160.8 | -72.3 | -80 | -24 | 0 | 0 | 107.4 | L73 K77 | L73-Q75 PolarHBondContact O-N 2.95Å; Q75-K77 PolarHBondContact O-N 3.42Å |
| 76 | K | 60.6 | Low | 59.5 | Low | 209 Ų | 209 | 151.8 Ų | 151.8 | 91% | 0.909 | 81% | 0.814 | S | S | * | * | | | trans | -94.9 | 88.9 | 168.5 | -140 | 171.3 | -176 | -169.7 | 0 | 108.1 | P74 | P74-K76 VanDerWaalsContact C-N 3.3Å; P74-K76 PolarHBondContact O-N 2.95Å |
| 77 | K | 58 | Low | 59.8 | Low | 191 Ų | 191 | 158.3 Ų | 158.3 | 83% | 0.83 | 83% | 0.83 | S | S | * | * | | | trans | -90.2 | 109.1 | 166.4 | -171.6 | 172.5 | -171.2 | 176.8 | 0 | 107.5 | Q75 | Q75-K77 PolarHBondContact O-N 3.42Š|
| 78 | L | 58.3 | Low | 60.1 | Low | 245 Ų | 245 | 159.5 Ų | 159.5 | 100% | 1.283 | 83% | 0.825 | S | S | * | * | | | trans | -157.2 | 0 | 142.7 | -141.7 | 79.7 | 0 | 0 | 0 | 109.1 | | |