| 1 | N | 42.8 | Very low | 56.5 | Low | 215 Ų | 215 | 142.2 Ų | 142.2 | 100% | 1.15 | 80% | 0.801 | S | S | * | * | | | | 0 | 82.4 | 0 | -43.7 | -36.3 | 0 | 0 | 0 | 107.4 | | |
| 2 | T | 43.8 | Very low | 57 | Low | 143 Ų | 143 | 146 Ų | 146 | 88% | 0.877 | 81% | 0.807 | S | S | * | * | | | trans | -80.5 | 137.4 | -170.8 | -55.1 | 0 | 0 | 0 | 0 | 109.7 | A4 | T2-A4 PolarHBondContact O-N 2.89Š|
| 3 | A | 52.5 | Low | 57.9 | Low | 89 Ų | 89 | 142.2 Ų | 142.2 | 74% | 0.736 | 80% | 0.797 | S | S | * | * | | | trans | -46.2 | 129.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | S5 | A3-S5 VanDerWaalsContact C-N 3.28Å; A3-S5 PolarHBondContact O-N 2.68Å |
| 4 | A | 60.6 | Low | 58.8 | Low | 106 Ų | 106 | 144.8 Ų | 144.8 | 88% | 0.876 | 80% | 0.8 | S | S | * | * | | | trans | -68 | 89.8 | 167.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | T2 L6 | T2-A4 PolarHBondContact O-N 2.89Å; A4-L6 PolarHBondContact O-N 3.35Å |
| 5 | S | 59.8 | Low | 59.5 | Low | 99 Ų | 99 | 143.8 Ų | 143.8 | 69% | 0.692 | 80% | 0.799 | S | S | * | * | | | trans | -76.9 | 113.2 | 175.7 | -158.6 | 0 | 0 | 0 | 0 | 108.9 | A3 Q7 | A3-S5 VanDerWaalsContact C-N 3.28Å; A3-S5 PolarHBondContact O-N 2.68Å; S5-Q7 PolarHBondContact O-N 2.85Å |
| 6 | L | 57.8 | Low | 60 | Low | 140 Ų | 140 | 142 Ų | 142 | 73% | 0.733 | 80% | 0.799 | S | S | * | * | | | trans | 19.9 | 93.7 | 140.3 | -73.8 | 83 | 0 | 0 | 0 | 115.1 | A4 | A4-L6 PolarHBondContact O-N 3.35Š|
| 7 | Q | 60.7 | Low | 60.4 | Low | 186 Ų | 186 | 140.9 Ų | 140.9 | 87% | 0.869 | 80% | 0.797 | S | S | * | * | | | trans | -142.4 | 80.5 | 133.9 | -65.9 | -165 | -8.9 | 0 | 0 | 106 | S5 N9 | S5-Q7 PolarHBondContact O-N 2.85Å; Q7-N9 PolarHBondContact O-N 2.61Å |
| 8 | Q | 58.8 | Low | 60.9 | Low | 181 Ų | 181 | 140.3 Ų | 140.3 | 85% | 0.846 | 79% | 0.791 | S | S | * | * | | | trans | -59 | 92.6 | 158.8 | -68.9 | 180 | -97.5 | 0 | 0 | 105.1 | E10 | Q8-E10 WeakPolarHBondContact O-CG 3.12Å; Q8-E10 PolarHBondContact O-N 2.92Å |
| 9 | N | 55.4 | Low | 61.4 | Low | 98 Ų | 98 | 141.8 Ų | 141.8 | 52% | 0.524 | 79% | 0.791 | S | S | . | * | | | trans | -59.4 | 108.7 | -173.1 | 168.9 | 40.6 | 0 | 0 | 0 | 108.7 | Q7 N11 | Q7-N9 PolarHBondContact O-N 2.61Å; N9-N11 VanDerWaalsContact CG-CG 3.41Å; N9-N11 VanDerWaalsContact CG-ND2 3.26Å; N9-N11 PolarHBondContact ND2-ND2 2.74Å; N9-N11 PolarHBondContact ND2-OD1 3.29Å; N9-N11 PolarHBondContact O-N 3.33Å; N9-N11 PolarHBondContact OD1-ND2 3.07Å |
| 10 | E | 63.9 | Low | 61.8 | Low | 199 Ų | 199 | 139.2 Ų | 139.2 | 93% | 0.93 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | 28.1 | -174.6 | -62.8 | 167.1 | 90.3 | 0 | 0 | 113.1 | Q8 | Q8-E10 WeakPolarHBondContact O-CG 3.12Å; Q8-E10 PolarHBondContact O-N 2.92Å |
| 11 | N | 65.6 | Low | 62 | Low | 108 Ų | 108 | 140.2 Ų | 140.2 | 58% | 0.578 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.4 | 22 | -172.2 | 82 | 26.2 | 0 | 0 | 0 | 115.6 | N9 S13 | N9-N11 VanDerWaalsContact CG-CG 3.41Å; N9-N11 VanDerWaalsContact CG-ND2 3.26Å; N9-N11 PolarHBondContact ND2-ND2 2.74Å; N9-N11 PolarHBondContact ND2-OD1 3.29Å; N9-N11 PolarHBondContact O-N 3.33Å; N9-N11 PolarHBondContact OD1-ND2 3.07Å; N11-S13 PolarHBondContact O-N 2.81Å |
| 12 | E | 62.8 | Low | 63 | Low | 188 Ų | 188 | 134.9 Ų | 134.9 | 88% | 0.879 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -72.3 | 73.2 | 164.2 | -54.1 | -147.7 | 123.4 | 0 | 0 | 109.7 | Q14 | E12-Q14 PolarHBondContact O-N 2.69Š|
| 13 | S | 68.1 | Low | 64 | Low | 97 Ų | 97 | 132.9 Ų | 132.9 | 68% | 0.678 | 75% | 0.745 | S | S | * | * | | | trans | 33.9 | 88.6 | 150.7 | -170.8 | 0 | 0 | 0 | 0 | 114 | N11 V15 | N11-S13 PolarHBondContact O-N 2.81Å; S13-V15 PolarHBondContact O-N 2.79Å |
| 14 | Q | 70.3 | Confident | 64.7 | Low | 178 Ų | 178 | 138.2 Ų | 138.2 | 83% | 0.832 | 75% | 0.746 | S | S | * | * | | | trans | -41.3 | 111.1 | 160.1 | -73 | -76.4 | -67.3 | 0 | 0 | 109.1 | E12 S16 | E12-Q14 PolarHBondContact O-N 2.69Å; Q14-S16 VanDerWaalsContact C-N 3.33Å; Q14-S16 PolarHBondContact O-N 3.47Å |
| 15 | V | 69.3 | Low | 65 | Low | 130 Ų | 130 | 138 Ų | 138 | 79% | 0.788 | 74% | 0.738 | S | S | * | * | | | trans | -63.8 | 94.8 | 171.8 | -81.3 | 0 | 0 | 0 | 0 | 107.9 | S13 T17 | S13-V15 PolarHBondContact O-N 2.79Å; V15-T17 PolarHBondContact O-N 2.81Å |
| 16 | S | 68 | Low | 65.3 | Low | 115 Ų | 115 | 139.2 Ų | 139.2 | 80% | 0.804 | 74% | 0.744 | S | S | * | * | | | trans | -77 | 80.4 | 171.6 | -65.4 | 0 | 0 | 0 | 0 | 108.3 | Q14 D18 | Q14-S16 VanDerWaalsContact C-N 3.33Å; Q14-S16 PolarHBondContact O-N 3.47Å; S16-D18 VanDerWaalsContact C-N 3.33Å |
| 17 | T | 66.4 | Low | 65.4 | Low | 123 Ų | 123 | 135.7 Ų | 135.7 | 76% | 0.755 | 74% | 0.741 | S | S | * | * | | | trans | -95.7 | 74.3 | 158.4 | -50 | 0 | 0 | 0 | 0 | 106.9 | V15 E19 | V15-T17 PolarHBondContact O-N 2.81Å; T17-E19 PolarHBondContact O-N 3.48Å |
| 18 | D | 69.8 | Low | 65.8 | Low | 130 Ų | 130 | 132.9 Ų | 132.9 | 70% | 0.695 | 73% | 0.732 | S | S | * | * | | | trans | -89.6 | 95.9 | 159.9 | -175.2 | -118.2 | 0 | 0 | 0 | 107 | S16 S20 | S16-D18 VanDerWaalsContact C-N 3.33Å; D18-S20 PolarHBondContact O-N 3.04Å |
| 19 | E | 70 | Confident | 66 | Low | 169 Ų | 169 | 132.9 Ų | 132.9 | 79% | 0.79 | 73% | 0.729 | S | S | * | * | | | trans | -58.6 | 66 | 162.3 | -94.9 | -102.1 | 105.9 | 0 | 0 | 109.4 | T17 E21 | T17-E19 PolarHBondContact O-N 3.48Å; E19-E21 PolarHBondContact O-N 2.94Å |
| 20 | S | 70.5 | Confident | 66.2 | Low | 90 Ų | 90 | 132 Ų | 132 | 63% | 0.629 | 73% | 0.731 | S | S | * | * | | | trans | -71.8 | 83.1 | 161.9 | 52.2 | 0 | 0 | 0 | 0 | 106.8 | D18 N22 | D18-S20 PolarHBondContact O-N 3.04Å; S20-N22 PolarHBondContact O-N 2.81Å |
| 21 | E | 65.8 | Low | 66.2 | Low | 160 Ų | 160 | 130.6 Ų | 130.6 | 75% | 0.748 | 73% | 0.729 | S | S | * | * | | | trans | -54.7 | 85.4 | 145.2 | -171.9 | -175.4 | 94.3 | 0 | 0 | 105.1 | E19 S23 | E19-E21 PolarHBondContact O-N 2.94Å; E21-S23 PolarHBondContact O-N 2.9Å; E21-S23 PolarHBondContact O-OG 3.47Å |
| 22 | N | 63.3 | Low | 66 | Low | 103 Ų | 103 | 133 Ų | 133 | 55% | 0.551 | 74% | 0.742 | S | S | * | * | | | trans | -48.8 | 100.4 | 162.4 | 163.3 | 83.5 | 0 | 0 | 0 | 103.3 | S20 R24 | S20-N22 PolarHBondContact O-N 2.81Å; N22-R24 WeakPolarHBondContact ND2-CB 3.2Å; N22-R24 PolarHBondContact O-N 3.48Å |
| 23 | S | 64 | Low | 65.9 | Low | 101 Ų | 101 | 130.2 Ų | 130.2 | 71% | 0.706 | 73% | 0.732 | S | S | * | * | | | trans | -68 | 72.2 | -173.2 | -6.7 | 0 | 0 | 0 | 0 | 105.8 | E21 S25 | E21-S23 PolarHBondContact O-N 2.9Å; E21-S23 PolarHBondContact O-OG 3.47Å; S23-S25 PolarHBondContact O-N 2.92Å |
| 24 | R | 67.3 | Low | 65.8 | Low | 201 Ų | 201 | 134.2 Ų | 134.2 | 76% | 0.758 | 74% | 0.737 | S | S | * | * | | | trans | -79.1 | 80.8 | 179.4 | -146 | 165.4 | -163.5 | 116.5 | 4.7 | 103.4 | N22 P26 | N22-R24 WeakPolarHBondContact ND2-CB 3.2Å; N22-R24 PolarHBondContact O-N 3.48Å; R24-P26 WeakPolarHBondContact O-CD 3.4Å |
| 25 | S | 68.1 | Low | 65.6 | Low | 102 Ų | 102 | 130.3 Ų | 130.3 | 71% | 0.713 | 73% | 0.727 | S | S | * | * | | | trans | -46 | 117.4 | 155.3 | -80 | 0 | 0 | 0 | 0 | 105.3 | S23 G27 | S23-S25 PolarHBondContact O-N 2.92Å; S25-G27 PolarHBondContact O-N 3.47Å |
| 26 | P | 65.1 | Low | 65.5 | Low | 125 Ų | 125 | 134.2 Ų | 134.2 | 81% | 0.812 | 73% | 0.734 | S | S | * | * | | | trans | -62.5 | 94.6 | 175.7 | -20 | 33.1 | 0 | 0 | 0 | 105.2 | R24 N28 | R24-P26 WeakPolarHBondContact O-CD 3.4Å; P26-N28 PolarHBondContact O-N 2.72Å |
| 27 | G | 59.4 | Low | 65.5 | Low | 65 Ų | 65 | 132.1 Ų | 132.1 | 67% | 0.67 | 72% | 0.719 | S | S | * | * | | | trans | -53.2 | 112.3 | 177 | 0 | 0 | 0 | 0 | 0 | 105.6 | S25 | S25-G27 PolarHBondContact O-N 3.47Š|
| 28 | N | 69.4 | Low | 65.4 | Low | 127 Ų | 127 | 129 Ų | 129 | 68% | 0.679 | 71% | 0.706 | S | S | * | * | | | trans | -50.3 | 150.4 | 176.7 | 52.9 | 61.4 | 0 | 0 | 0 | 109.9 | P26 | P26-N28 PolarHBondContact O-N 2.72Š|
| 29 | K | 64.1 | Low | 65.8 | Low | 181 Ų | 181 | 126.5 Ų | 126.5 | 79% | 0.787 | 70% | 0.696 | S | S | * | * | | | trans | 93 | 118.7 | 177.8 | -48 | 163.6 | -144.8 | -159.9 | 0 | 112 | | |
| 30 | S | 58.7 | Low | 65.8 | Low | 80 Ų | 80 | 129.2 Ų | 129.2 | 56% | 0.559 | 70% | 0.7 | S | S | * | * | | | cis | -161.4 | 138.9 | 15.6 | 37.7 | 0 | 0 | 0 | 0 | 107.4 | N32 | S30-N32 PolarHBondContact O-N 2.83Š|
| 31 | D | 64.4 | Low | 65.7 | Low | 169 Ų | 169 | 130.7 Ų | 130.7 | 90% | 0.904 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -38.2 | 130.2 | 163.6 | -80.4 | -93.1 | 0 | 0 | 0 | 110.8 | | |
| 32 | N | 60.4 | Low | 66.2 | Low | 159 Ų | 159 | 127.1 Ų | 127.1 | 85% | 0.85 | 69% | 0.693 | S | S | * | * | | | trans | 86.7 | 39.4 | 178.8 | -140.1 | -76.2 | 0 | 0 | 0 | 118.2 | S30 | S30-N32 PolarHBondContact O-N 2.83Š|
| 33 | I | 61.7 | Low | 67 | Low | 129 Ų | 129 | 131 Ų | 131 | 66% | 0.662 | 71% | 0.705 | S | S | * | * | | | trans | -102.4 | 86.7 | 153.8 | -52.2 | 171.3 | 0 | 0 | 0 | 106.8 | P35 | I33-P35 WeakPolarHBondContact O-CD 3.49Š|
| 34 | K | 66.7 | Low | 68 | Low | 181 Ų | 181 | 131.7 Ų | 131.7 | 79% | 0.787 | 70% | 0.701 | S | S | * | * | | | trans | -56.7 | 115 | 166.2 | -177.2 | 169.9 | 174 | -177.4 | 0 | 106.2 | K36 | K34-K36 PolarHBondContact O-N 2.96Š|
| 35 | P | 65.4 | Low | 69 | Low | 96 Ų | 96 | 127.2 Ų | 127.2 | 62% | 0.623 | 70% | 0.698 | S | S | * | * | | | trans | -60.8 | 112.2 | -177.4 | 22.8 | -31.2 | 0 | 0 | 0 | 107.9 | I33 S37 | I33-P35 WeakPolarHBondContact O-CD 3.49Å; P35-S37 PolarHBondContact O-N 2.73Å; P35-S37 VanDerWaalsContact O-N 3.07Å |
| 36 | K | 66.8 | Low | 69.9 | Low | 213 Ų | 213 | 127.8 Ų | 127.8 | 93% | 0.926 | 70% | 0.699 | S | S | * | * | | | trans | -73.8 | 23.4 | 169.1 | -74.5 | 178.2 | 170.5 | 177 | 0 | 111.2 | K34 A38 | K34-K36 PolarHBondContact O-N 2.96Å; K36-A38 PolarHBondContact O-N 3.01Å |
| 37 | S | 67.4 | Low | 71 | Confident | 71 Ų | 71 | 127.3 Ų | 127.3 | 50% | 0.497 | 70% | 0.696 | S | S | . | * | P | Polyproline II helix | trans | -68.4 | 121.2 | 165.1 | 57.2 | 0 | 0 | 0 | 0 | 106.3 | P35 | P35-S37 PolarHBondContact O-N 2.73Å; P35-S37 VanDerWaalsContact O-N 3.07Å |
| 38 | A | 66.1 | Low | 72.4 | Confident | 57 Ų | 57 | 129.4 Ų | 129.4 | 47% | 0.471 | 70% | 0.698 | S | S | . | * | P | Polyproline II helix | trans | -47.3 | 130.5 | 159.6 | 0 | 0 | 0 | 0 | 0 | 106.8 | K36 W40 | K36-A38 PolarHBondContact O-N 3.01Å; A38-W40 PolarHBondContact O-N 2.76Å |
| 39 | P | 77.6 | Confident | 73.4 | Confident | 77 Ų | 77 | 129.2 Ų | 129.2 | 50% | 0.5 | 70% | 0.703 | S | S | . | * | P | Polyproline II helix | trans | -54.2 | 125.8 | 172.3 | 22.2 | -29.1 | 0 | 0 | 0 | 105.1 | N41 S42 | P39-N41 PolarHBondContact O-N 2.81Å; P39-S42 WeakPolarHBondContact O-CB 3.46Å; P39-S42 PolarHBondContact O-N 2.74Å |
| 40 | W | 69.9 | Low | 74.6 | Confident | 227 Ų | 227 | 128.5 Ų | 128.5 | 86% | 0.86 | 71% | 0.705 | S | S | * | * | G | 310 helix | trans | -53.8 | -16.6 | -178.4 | -75.6 | 58.1 | 0 | 0 | 0 | 111.9 | A38 S42 | A38-W40 PolarHBondContact O-N 2.76Å; W40-S42 VanDerWaalsContact C-N 3.35Å; W40-S42 PolarHBondContact O-N 3.18Å |
| 41 | N | 69 | Low | 75.8 | Confident | 120 Ų | 120 | 129.5 Ų | 129.5 | 64% | 0.642 | 71% | 0.709 | S | S | * | * | G | 310 helix | trans | -74.3 | -9.1 | 173.9 | -54.6 | -42.7 | 0 | 0 | 0 | 115.5 | P39 F43 L44 | P39-N41 PolarHBondContact O-N 2.81Å; N41-F43 VanDerWaalsContact C-N 3.32Å; N41-F43 PolarHBondContact O-N 2.96Å; N41-L44 HydrophobicContact CB-CD1 4.49Å; N41-L44 PolarHBondContact O-N 3.32Å |
| 42 | S | 75.4 | Confident | 76.5 | Confident | 86 Ų | 86 | 123.8 Ų | 123.8 | 60% | 0.601 | 69% | 0.69 | S | S | * | * | G | 310 helix | trans | -76.2 | -15.6 | -179.8 | -96.8 | 0 | 0 | 0 | 0 | 114.2 | P39 W40 | P39-S42 WeakPolarHBondContact O-CB 3.46Å; P39-S42 PolarHBondContact O-N 2.74Å; W40-S42 VanDerWaalsContact C-N 3.35Å; W40-S42 PolarHBondContact O-N 3.18Å |
| 43 | F | 79.9 | Confident | 77.3 | Confident | 183 Ų | 183 | 122.5 Ų | 122.5 | 80% | 0.803 | 69% | 0.691 | S | S | * | * | G | 310 helix | trans | -91.1 | -0.5 | 175.6 | -67.3 | -78.2 | 0 | 0 | 0 | 113.3 | N41 | N41-F43 VanDerWaalsContact C-N 3.32Å; N41-F43 PolarHBondContact O-N 2.96Å |
| 44 | L | 85.6 | Confident | 77.6 | Confident | 116 Ų | 116 | 127.3 Ų | 127.3 | 61% | 0.607 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -79.6 | 139.1 | 177.1 | -59.7 | 178.7 | 0 | 0 | 0 | 109.6 | N41 | N41-L44 HydrophobicContact CB-CD1 4.49Å; N41-L44 PolarHBondContact O-N 3.32Å |
| 45 | P | 88 | Confident | 77.5 | Confident | 108 Ų | 108 | 124.2 Ų | 124.2 | 70% | 0.701 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 150.3 | 170.9 | 26.9 | -33.7 | 0 | 0 | 0 | 109.8 | | |
| 46 | P | 86.8 | Confident | 77.7 | Confident | 114 Ų | 114 | 121.6 Ų | 121.6 | 74% | 0.74 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 145.7 | 175.8 | 25.1 | -33.7 | 0 | 0 | 0 | 110 | | |
| 47 | P | 87.4 | Confident | 77.8 | Confident | 114 Ų | 114 | 118.6 Ų | 118.6 | 74% | 0.74 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -58 | 144.3 | 177 | 25.1 | -33.1 | 0 | 0 | 0 | 109.7 | | |
| 48 | P | 90.4 | Very high | 77.5 | Confident | 110 Ų | 110 | 118.1 Ų | 118.1 | 71% | 0.714 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 149.9 | 176.1 | 26.4 | -33.8 | 0 | 0 | 0 | 109.9 | M50 | P48-M50 PolarHBondContact O-N 3.32Š|
| 49 | P | 90.4 | Very high | 77.2 | Confident | 122 Ų | 122 | 122 Ų | 122 | 79% | 0.792 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 127.4 | 172.5 | 24.5 | -32.3 | 0 | 0 | 0 | 108.4 | | |
| 50 | M | 88.4 | Confident | 76.4 | Confident | 166 Ų | 166 | 126.5 Ų | 126.5 | 82% | 0.818 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 134.1 | 174.7 | -161.5 | 68.1 | 63.3 | 0 | 0 | 107.8 | P48 G52 | P48-M50 PolarHBondContact O-N 3.32Å; M50-G52 PolarHBondContact O-N 2.77Å |
| 51 | P | 83.7 | Confident | 75.7 | Confident | 101 Ų | 101 | 123.3 Ų | 123.3 | 66% | 0.656 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 117.7 | 166.6 | -21.4 | 31.7 | 0 | 0 | 0 | 106.9 | | |
| 52 | G | 79 | Confident | 75.1 | Confident | 49 Ų | 49 | 125.8 Ų | 125.8 | 51% | 0.505 | 72% | 0.72 | S | S | . | * | P | Polyproline II helix | trans | -53.2 | 157.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | M50 R54 | M50-G52 PolarHBondContact O-N 2.77Å; G52-R54 PolarHBondContact O-N 2.92Å |
| 53 | P | 78.8 | Confident | 73.5 | Confident | 132 Ų | 132 | 128.9 Ų | 128.9 | 86% | 0.857 | 75% | 0.751 | S | S | * | * | | | trans | -46.2 | 115 | 173.5 | -22.7 | 30.9 | 0 | 0 | 0 | 107.3 | L55 | P53-L55 PolarHBondContact O-N 2.85Š|
| 54 | R | 67.5 | Low | 73.2 | Confident | 231 Ų | 231 | 126.2 Ų | 126.2 | 87% | 0.872 | 75% | 0.749 | S | S | * | * | | | trans | -60.6 | 103.4 | 175.2 | -70.7 | -162.1 | -156 | -95.7 | 3.8 | 104 | G52 G56 | G52-R54 PolarHBondContact O-N 2.92Å; R54-G56 PolarHBondContact O-N 3.45Å |
| 55 | L | 64.5 | Low | 72.6 | Confident | 115 Ų | 115 | 126.7 Ų | 126.7 | 60% | 0.602 | 76% | 0.756 | S | S | * | * | | | trans | -68.1 | 88.2 | 167 | -169.8 | 80.7 | 0 | 0 | 0 | 104.7 | P53 K59 | P53-L55 PolarHBondContact O-N 2.85Å; L55-K59 HydrophobicContact CD1-CD 3.67Å; L55-K59 HydrophobicContact CD1-CG 3.84Å; L55-K59 HydrophobicContact CD2-CD 4.04Å; L55-K59 HydrophobicContact CD2-CG 3.94Å; L55-K59 HydrophobicContact CG-CD 4.21Å; L55-K59 HydrophobicContact CG-CG 3.98Å |
| 56 | G | 69 | Low | 71.7 | Confident | 41 Ų | 41 | 127.7 Ų | 127.7 | 42% | 0.423 | 76% | 0.759 | S | S | . | * | | | trans | -53.3 | 150.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 109 | R54 G58 | R54-G56 PolarHBondContact O-N 3.45Å; G56-G58 PolarHBondContact O-N 2.97Å |
| 57 | P | 68.8 | Low | 70.8 | Confident | 150 Ų | 150 | 128.5 Ų | 128.5 | 97% | 0.974 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -58.9 | 89.8 | 165.7 | -14.5 | 27.9 | 0 | 0 | 0 | 108.1 | | |
| 58 | G | 61.4 | Low | 69.8 | Low | 61 Ų | 61 | 129.4 Ų | 129.4 | 63% | 0.629 | 76% | 0.761 | S | S | * | * | | | trans | -179.8 | 11.3 | -171.2 | 0 | 0 | 0 | 0 | 0 | 114 | G56 | G56-G58 PolarHBondContact O-N 2.97Š|
| 59 | K | 60 | Low | 68.4 | Low | 138 Ų | 138 | 130.7 Ų | 130.7 | 60% | 0.6 | 77% | 0.765 | S | S | * | * | | | trans | -117.9 | 68.8 | 159.7 | 67.3 | 155.7 | -160 | -113.4 | 0 | 110.5 | L55 M61 | L55-K59 HydrophobicContact CD1-CD 3.67Å; L55-K59 HydrophobicContact CD1-CG 3.84Å; L55-K59 HydrophobicContact CD2-CD 4.04Å; L55-K59 HydrophobicContact CD2-CG 3.94Å; L55-K59 HydrophobicContact CG-CD 4.21Å; L55-K59 HydrophobicContact CG-CG 3.98Å; K59-M61 PolarHBondContact O-N 3.15Å |
| 60 | E | 61.3 | Low | 66.9 | Low | 172 Ų | 172 | 131.4 Ų | 131.4 | 80% | 0.804 | 76% | 0.763 | S | S | * | * | | | trans | -58.1 | 95.8 | 139.5 | 48.7 | -123 | -177.7 | 0 | 0 | 107.4 | L62 | E60-L62 PolarHBondContact O-N 2.73Š|
| 61 | M | 55.2 | Low | 65.2 | Low | 160 Ų | 160 | 128.7 Ų | 128.7 | 79% | 0.788 | 76% | 0.758 | S | S | * | * | | | trans | -73.4 | 90.2 | 166.4 | -169.3 | 175 | 77.4 | 0 | 0 | 106.2 | K59 A63 | K59-M61 PolarHBondContact O-N 3.15Å; M61-A63 PolarHBondContact O-N 3.01Å; M61-A63 VanDerWaalsContact O-N 3.15Å |
| 62 | L | 54.8 | Low | 63.7 | Low | 172 Ų | 172 | 131 Ų | 131 | 90% | 0.901 | 77% | 0.767 | S | S | * | * | | | trans | -71.5 | 94.8 | 165.3 | -158.6 | 150.2 | 0 | 0 | 0 | 106.7 | E60 | E60-L62 PolarHBondContact O-N 2.73Š|
| 63 | A | 43.6 | Very low | 62.3 | Low | 151 Ų | 151 | 138.5 Ų | 138.5 | 100% | 1.248 | 79% | 0.791 | S | S | * | * | | | trans | -165.5 | 0 | 158.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | M61 | M61-A63 PolarHBondContact O-N 3.01Å; M61-A63 VanDerWaalsContact O-N 3.15Å |