| 1 | M | 58.6 | Low | 60.8 | Low | 237 Ų | 237 | 147.1 Ų | 147.1 | 100% | 1.167 | 81% | 0.812 | S | S | * | * | | | | 0 | 120.3 | 0 | -65.9 | -172.9 | 169.2 | 0 | 0 | 107.4 | | |
| 2 | P | 64.1 | Low | 60.6 | Low | 125 Ų | 125 | 149.3 Ų | 149.3 | 81% | 0.812 | 82% | 0.82 | S | S | * | * | | | trans | -74.8 | 131.6 | -178.3 | 29.4 | -30.6 | 0 | 0 | 0 | 110.5 | | |
| 3 | F | 59.8 | Low | 59.4 | Low | 206 Ų | 206 | 145.8 Ų | 145.8 | 90% | 0.904 | 81% | 0.813 | S | S | * | * | | | trans | -86.4 | 115.7 | 178.3 | -141.9 | -94.2 | 0 | 0 | 0 | 108.2 | | |
| 4 | I | 69.6 | Low | 59 | Low | 147 Ų | 147 | 140.1 Ų | 140.1 | 75% | 0.754 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -97.6 | 118.3 | 175.4 | -57.2 | 176.6 | 0 | 0 | 0 | 107.3 | | |
| 5 | P | 64.8 | Low | 58.5 | Low | 95 Ų | 95 | 139.3 Ų | 139.3 | 62% | 0.617 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 155.3 | 177 | 29.8 | -32.8 | 0 | 0 | 0 | 111.6 | | |
| 6 | P | 60.4 | Low | 57.7 | Low | 120 Ų | 120 | 138.9 Ų | 138.9 | 78% | 0.779 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -72 | 134.2 | -178 | 29 | -32.8 | 0 | 0 | 0 | 111.7 | | |
| 7 | I | 63.2 | Low | 56.5 | Low | 167 Ų | 167 | 134.5 Ų | 134.5 | 86% | 0.856 | 80% | 0.801 | S | S | * | * | | | trans | -81.4 | 115.2 | 174.7 | -63.1 | 168.9 | 0 | 0 | 0 | 108.1 | | |
| 8 | N | 56 | Low | 56.3 | Low | 143 Ų | 143 | 137.3 Ų | 137.3 | 77% | 0.765 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -73 | 144.4 | 170.1 | -79.5 | -51.6 | 0 | 0 | 0 | 110.7 | | |
| 9 | P | 62.9 | Low | 55.6 | Low | 110 Ų | 110 | 142.1 Ų | 142.1 | 71% | 0.714 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 154.9 | 175.5 | 30.9 | -33.4 | 0 | 0 | 0 | 111.5 | D11 | P9-D11 PolarHBondContact O-N 3.21Š|
| 10 | P | 60.8 | Low | 55.4 | Low | 118 Ų | 118 | 139.2 Ų | 139.2 | 77% | 0.766 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 128.5 | -178.1 | 28 | -32.6 | 0 | 0 | 0 | 111 | L12 | P10-L12 PolarHBondContact O-N 3.24Š|
| 11 | D | 48.9 | Very low | 55.2 | Low | 150 Ų | 150 | 140.7 Ų | 140.7 | 80% | 0.802 | 80% | 0.796 | S | S | * | * | | | trans | -63.4 | 113.5 | 174.4 | -150.6 | -11.5 | 0 | 0 | 0 | 109.5 | P9 S13 | P9-D11 PolarHBondContact O-N 3.21Å; D11-S13 PolarHBondContact O-N 3.32Å; D11-S13 VanDerWaalsContact O-N 3.08Å |
| 12 | L | 57.7 | Low | 55 | Low | 173 Ų | 173 | 137.4 Ų | 137.4 | 91% | 0.906 | 78% | 0.777 | S | S | * | * | | | trans | -85.6 | 60 | -178.4 | -74.1 | 170.2 | 0 | 0 | 0 | 110.7 | P10 | P10-L12 PolarHBondContact O-N 3.24Š|
| 13 | S | 44.8 | Very low | 54.5 | Low | 104 Ų | 104 | 134.5 Ų | 134.5 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | | | trans | -101 | 91.2 | 166.2 | 52.7 | 0 | 0 | 0 | 0 | 109.4 | D11 | D11-S13 PolarHBondContact O-N 3.32Å; D11-S13 VanDerWaalsContact O-N 3.08Å |
| 14 | G | 54.6 | Low | 54.6 | Low | 66 Ų | 66 | 130.6 Ų | 130.6 | 68% | 0.68 | 77% | 0.765 | S | S | * | * | | | trans | -123.8 | 155.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | | |
| 15 | P | 51.7 | Low | 53.8 | Low | 128 Ų | 128 | 129.5 Ų | 129.5 | 83% | 0.831 | 77% | 0.768 | S | S | * | * | | | trans | -91 | 168.2 | -131.9 | 35.7 | -36.7 | 0 | 0 | 0 | 115.7 | | |
| 16 | P | 44.9 | Very low | 53.1 | Low | 133 Ų | 133 | 128.3 Ų | 128.3 | 86% | 0.864 | 77% | 0.773 | S | S | * | * | | | trans | -85.2 | 136.4 | -169.7 | 33.9 | -31.8 | 0 | 0 | 0 | 112.6 | | |
| 17 | G | 38.3 | Very low | 52.8 | Low | 65 Ų | 65 | 130.3 Ų | 130.3 | 67% | 0.67 | 78% | 0.776 | S | S | * | * | | | trans | 99.6 | 120.2 | 151.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | | |
| 18 | H | 51.7 | Low | 52.5 | Low | 184 Ų | 184 | 132.3 Ų | 132.3 | 85% | 0.852 | 78% | 0.779 | S | S | * | * | | | trans | -157.1 | 98.1 | 136.4 | -104.2 | -76.4 | 0 | 0 | 0 | 108.3 | S20 | H18-S20 PolarHBondContact O-N 2.64Š|
| 19 | R | 42.8 | Very low | 52.8 | Low | 229 Ų | 229 | 132.4 Ų | 132.4 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | | | trans | -70.6 | 113.1 | 161.2 | -82.2 | -178.4 | 171.5 | -174.9 | -1.9 | 107.1 | | |
| 20 | S | 53 | Low | 52.5 | Low | 84 Ų | 84 | 132 Ų | 132 | 59% | 0.587 | 78% | 0.775 | S | S | * | * | | | trans | -127.9 | 119.5 | 166.6 | -85.2 | 0 | 0 | 0 | 0 | 110.7 | H18 H22 | H18-S20 PolarHBondContact O-N 2.64Å; S20-H22 PolarHBondContact O-N 2.91Å; S20-H22 VanDerWaalsContact O-N 3.11Å |
| 21 | H | 51.1 | Low | 52.3 | Low | 171 Ų | 171 | 131.9 Ų | 131.9 | 79% | 0.792 | 78% | 0.775 | S | S | * | * | | | trans | -80.5 | 65 | -172 | -70.5 | -87.6 | 0 | 0 | 0 | 112.9 | | |
| 22 | H | 54.9 | Low | 52.3 | Low | 167 Ų | 167 | 131 Ų | 131 | 77% | 0.773 | 78% | 0.78 | S | S | * | * | | | trans | -115.3 | 96.3 | 176.2 | -62.1 | -56.3 | 0 | 0 | 0 | 110.4 | S20 | S20-H22 PolarHBondContact O-N 2.91Å; S20-H22 VanDerWaalsContact O-N 3.11Å |
| 23 | G | 53.6 | Low | 52.2 | Low | 64 Ų | 64 | 133.2 Ų | 133.2 | 66% | 0.66 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 149 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | | |
| 24 | P | 59.9 | Low | 52.4 | Low | 124 Ų | 124 | 136 Ų | 136 | 81% | 0.805 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 139.7 | -175.6 | 26.2 | -32.2 | 0 | 0 | 0 | 111.3 | | |
| 25 | P | 53.8 | Low | 52.1 | Low | 125 Ų | 125 | 140.5 Ų | 140.5 | 81% | 0.812 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -65 | 142 | 175 | 25 | -29.8 | 0 | 0 | 0 | 111.2 | | |
| 26 | G | 49.1 | Very low | 51.7 | Low | 70 Ų | 70 | 139.5 Ų | 139.5 | 72% | 0.722 | 78% | 0.781 | S | S | * | * | | | trans | -39.4 | 125.3 | -167.6 | 0 | 0 | 0 | 0 | 0 | 117.6 | F28 | G26-F28 PolarHBondContact O-N 2.91Š|
| 27 | L | 55.8 | Low | 52.3 | Low | 162 Ų | 162 | 137.8 Ų | 137.8 | 85% | 0.848 | 77% | 0.77 | S | S | * | * | | | trans | -65.7 | 105.7 | 159.8 | -76.1 | 161.1 | 0 | 0 | 0 | 108.7 | I29 | L27-I29 HydrophobicContact CB-CG1 4.39Å; L27-I29 PolarHBondContact O-N 2.66Å |
| 28 | F | 55.3 | Low | 53.1 | Low | 209 Ų | 209 | 141.9 Ų | 141.9 | 92% | 0.917 | 78% | 0.776 | S | S | * | * | | | trans | -61 | 97.9 | 160.5 | -96.1 | -97.9 | 0 | 0 | 0 | 108.2 | G26 P30 | G26-F28 PolarHBondContact O-N 2.91Å; F28-P30 WeakPolarHBondContact O-CD 3.47Å |
| 29 | I | 62.2 | Low | 53.4 | Low | 144 Ų | 144 | 142.3 Ų | 142.3 | 74% | 0.738 | 78% | 0.779 | S | S | * | * | | | trans | -86 | 111.8 | 170.8 | -58.3 | 172.5 | 0 | 0 | 0 | 106.8 | L27 | L27-I29 HydrophobicContact CB-CG1 4.39Å; L27-I29 PolarHBondContact O-N 2.66Å |
| 30 | P | 58.3 | Low | 54.4 | Low | 102 Ų | 102 | 137.3 Ų | 137.3 | 66% | 0.662 | 78% | 0.776 | S | S | * | * | | | trans | -66 | 141.5 | 171.8 | 27.7 | -32.5 | 0 | 0 | 0 | 109.3 | F28 S32 | F28-P30 WeakPolarHBondContact O-CD 3.47Å; P30-S32 PolarHBondContact O-N 2.79Å; P30-S32 VanDerWaalsContact O-N 3.09Å |
| 31 | P | 55 | Low | 55.2 | Low | 116 Ų | 116 | 136.4 Ų | 136.4 | 75% | 0.753 | 78% | 0.78 | S | S | * | * | | | trans | -65 | 115.3 | 178.8 | 24.3 | -30.2 | 0 | 0 | 0 | 109.7 | R33 | P31-R33 PolarHBondContact O-N 3.08Š|
| 32 | S | 50.7 | Low | 56.2 | Low | 132 Ų | 132 | 133.8 Ų | 133.8 | 92% | 0.923 | 78% | 0.778 | S | S | * | * | | | trans | -56.4 | 102.6 | 169.5 | -97.5 | 0 | 0 | 0 | 0 | 109.4 | P30 | P30-S32 PolarHBondContact O-N 2.79Å; P30-S32 VanDerWaalsContact O-N 3.09Å |
| 33 | R | 53.9 | Low | 56.8 | Low | 219 Ų | 219 | 131.8 Ų | 131.8 | 83% | 0.826 | 78% | 0.78 | S | S | * | * | | | trans | -82.6 | 125.7 | 164.6 | -71.3 | -175.1 | 175.5 | -173.8 | -1.1 | 108.3 | P31 | P31-R33 PolarHBondContact O-N 3.08Š|
| 34 | H | 50.2 | Low | 57.5 | Low | 161 Ų | 161 | 135.5 Ų | 135.5 | 75% | 0.745 | 79% | 0.789 | S | S | * | * | | | trans | 134.1 | 65.8 | 151.8 | -70.4 | 91.4 | 0 | 0 | 0 | 111.3 | C36 | H34-C36 VanDerWaalsContact C-N 3.35Å; H34-C36 PolarHBondContact O-N 2.89Å |
| 35 | D | 47.4 | Very low | 57.8 | Low | 161 Ų | 161 | 137.7 Ų | 137.7 | 86% | 0.861 | 79% | 0.789 | S | S | * | * | | | trans | -60.1 | 101.2 | 140.6 | -104.6 | -78.7 | 0 | 0 | 0 | 107.2 | | |
| 36 | C | 43.6 | Very low | 58.4 | Low | 107 Ų | 107 | 137.5 Ų | 137.5 | 72% | 0.723 | 79% | 0.788 | S | S | * | * | | | trans | -107.5 | 103.8 | 159.4 | -81.6 | 0 | 0 | 0 | 0 | 106.4 | H34 | H34-C36 VanDerWaalsContact C-N 3.35Å; H34-C36 PolarHBondContact O-N 2.89Å |
| 37 | P | 57.3 | Low | 59 | Low | 98 Ų | 98 | 140 Ų | 140 | 64% | 0.636 | 79% | 0.794 | S | S | * | * | | | trans | -77.7 | 153.7 | 173.2 | 34.1 | -31.4 | 0 | 0 | 0 | 109.6 | | |
| 38 | D | 55 | Low | 59.5 | Low | 150 Ų | 150 | 140.8 Ų | 140.8 | 80% | 0.802 | 79% | 0.794 | S | S | * | * | | | trans | 77.7 | 58.8 | 157.2 | -54 | -47 | 0 | 0 | 0 | 120.1 | | |
| 39 | Q | 58.7 | Low | 59.9 | Low | 194 Ų | 194 | 136.9 Ų | 136.9 | 91% | 0.907 | 79% | 0.789 | S | S | * | * | | | trans | -99.4 | 113.4 | 149.4 | -114.3 | -173 | -35.6 | 0 | 0 | 110.6 | G41 | Q39-G41 PolarHBondContact O-N 2.81Š|
| 40 | P | 64.5 | Low | 59.7 | Low | 124 Ų | 124 | 133.2 Ų | 133.2 | 81% | 0.805 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -61 | 126.3 | 174.4 | -17.2 | 28.8 | 0 | 0 | 0 | 110 | | |
| 41 | G | 68.5 | Low | 60.3 | Low | 65 Ų | 65 | 134.1 Ų | 134.1 | 67% | 0.67 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 152.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q39 | Q39-G41 PolarHBondContact O-N 2.81Š|
| 42 | P | 72.6 | Confident | 60.5 | Low | 116 Ų | 116 | 133.6 Ų | 133.6 | 75% | 0.753 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 153.4 | 175.6 | 27 | -33.6 | 0 | 0 | 0 | 111.3 | V44 | P42-V44 PolarHBondContact O-N 2.97Š|
| 43 | P | 67.9 | Low | 60.3 | Low | 124 Ų | 124 | 130.5 Ų | 130.5 | 81% | 0.805 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -62 | 128 | -177 | 24.7 | -32.9 | 0 | 0 | 0 | 111.2 | Q45 | P43-Q45 PolarHBondContact O-N 3.17Š|
| 44 | V | 67.8 | Low | 60 | Low | 142 Ų | 142 | 128.5 Ų | 128.5 | 86% | 0.861 | 78% | 0.778 | S | S | * | * | | | trans | -69.5 | 113.7 | 172.9 | -177.6 | 0 | 0 | 0 | 0 | 108 | P42 | P42-V44 PolarHBondContact O-N 2.97Š|
| 45 | Q | 66.7 | Low | 60.1 | Low | 170 Ų | 170 | 129.9 Ų | 129.9 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 140.8 | 170.5 | -72.8 | -169.4 | -6.7 | 0 | 0 | 109.9 | P43 S47 | P43-Q45 PolarHBondContact O-N 3.17Å; Q45-S47 PolarHBondContact O-N 3.04Å |
| 46 | P | 65.8 | Low | 60 | Low | 122 Ų | 122 | 125.2 Ų | 125.2 | 79% | 0.792 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 126.2 | 176.4 | 23.6 | -30 | 0 | 0 | 0 | 110.5 | Q48 | P46-Q48 PolarHBondContact O-N 2.82Š|
| 47 | S | 62 | Low | 60.1 | Low | 122 Ų | 122 | 130.4 Ų | 130.4 | 85% | 0.853 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -59 | 120.2 | 175.7 | -52 | 0 | 0 | 0 | 0 | 110.3 | Q45 | Q45-S47 PolarHBondContact O-N 3.04Š|
| 48 | Q | 66.8 | Low | 59.5 | Low | 179 Ų | 179 | 132.3 Ų | 132.3 | 84% | 0.836 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 147.6 | 169.1 | -71.3 | -164 | -57.2 | 0 | 0 | 110.5 | P46 G50 | P46-Q48 PolarHBondContact O-N 2.82Å; Q48-G50 PolarHBondContact O-N 3.1Å |
| 49 | P | 64.1 | Low | 59.5 | Low | 126 Ų | 126 | 132.3 Ų | 132.3 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 126.3 | 175.7 | -18.8 | 29.8 | 0 | 0 | 0 | 110.5 | | |
| 50 | G | 56.9 | Low | 59.5 | Low | 67 Ų | 67 | 131.8 Ų | 131.8 | 69% | 0.691 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 141 | 177 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q48 | Q48-G50 PolarHBondContact O-N 3.1Š|
| 51 | P | 70.4 | Confident | 59.7 | Low | 121 Ų | 121 | 130.9 Ų | 130.9 | 79% | 0.786 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 152.7 | 176.7 | 28.2 | -32.4 | 0 | 0 | 0 | 111.2 | | |
| 52 | P | 60.8 | Low | 59.9 | Low | 106 Ų | 106 | 133.6 Ų | 133.6 | 69% | 0.688 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 135.9 | -172.7 | 24.5 | -32.4 | 0 | 0 | 0 | 112 | H54 | P52-H54 PolarHBondContact O-N 2.97Å; P52-H54 VanDerWaalsContact O-N 3.12Å |
| 53 | G | 45.9 | Very low | 59.8 | Low | 66 Ų | 66 | 135.2 Ų | 135.2 | 68% | 0.68 | 78% | 0.777 | S | S | * | * | | | trans | -63.1 | 108.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | H55 | G53-H55 PolarHBondContact O-N 2.72Š|
| 54 | H | 48 | Very low | 59.9 | Low | 178 Ų | 178 | 134.6 Ų | 134.6 | 82% | 0.824 | 77% | 0.773 | S | S | * | * | | | trans | -82.4 | 87.1 | 167.3 | -73.5 | -46.4 | 0 | 0 | 0 | 109.7 | P52 G56 | P52-H54 PolarHBondContact O-N 2.97Å; P52-H54 VanDerWaalsContact O-N 3.12Å; H54-G56 PolarHBondContact O-N 3.12Å |
| 55 | H | 51.4 | Low | 60.1 | Low | 189 Ų | 189 | 138.2 Ų | 138.2 | 88% | 0.875 | 77% | 0.771 | S | S | * | * | | | trans | -65.6 | 114.1 | 161.6 | -67 | -68.6 | 0 | 0 | 0 | 109.2 | G53 | G53-H55 PolarHBondContact O-N 2.72Š|
| 56 | G | 45 | Very low | 60.1 | Low | 64 Ų | 64 | 136 Ų | 136 | 66% | 0.66 | 77% | 0.771 | S | S | * | * | S | Bend | trans | 94.8 | 124.8 | 161.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | H54 | H54-G56 PolarHBondContact O-N 3.12Š|
| 57 | R | 46.8 | Very low | 59.7 | Low | 216 Ų | 216 | 138.6 Ų | 138.6 | 82% | 0.815 | 77% | 0.772 | S | S | * | * | | | trans | 91.4 | 123.2 | 161.4 | -65 | -175.2 | 165.6 | -152.3 | -3.1 | 117.1 | | |
| 58 | H | 44.9 | Very low | 59.3 | Low | 137 Ų | 137 | 141.6 Ų | 141.6 | 63% | 0.634 | 77% | 0.773 | S | S | * | * | | | trans | 78.6 | 101.1 | 151 | -48.5 | 139 | 0 | 0 | 0 | 115.1 | | |
| 59 | N | 54.7 | Low | 58.6 | Low | 150 Ų | 150 | 144.1 Ų | 144.1 | 80% | 0.802 | 77% | 0.774 | S | S | * | * | | | | 162.1 | 90.6 | 105.5 | -76.8 | -44.3 | 0 | 0 | 0 | 106.5 | | |
| 60 | H | 57.3 | Low | 58.1 | Low | 184 Ų | 184 | 145 Ų | 145 | 85% | 0.852 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -58 | 131.4 | 161.9 | -72.7 | -78.8 | 0 | 0 | 0 | 106.9 | | |
| 61 | P | 69.7 | Low | 57.6 | Low | 105 Ų | 105 | 152.1 Ų | 152.1 | 68% | 0.682 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 137.2 | 168.5 | 24.5 | -31.4 | 0 | 0 | 0 | 107.1 | I63 | P61-I63 PolarHBondContact O-N 3.21Å; P61-I63 VanDerWaalsContact O-N 3.1Å |
| 62 | P | 72.5 | Confident | 56.8 | Low | 121 Ų | 121 | 153.5 Ų | 153.5 | 79% | 0.786 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 126.4 | 174.4 | 22 | -30.6 | 0 | 0 | 0 | 107.9 | P64 | P62-P64 WeakPolarHBondContact O-CD 3.45Å; P62-P64 VanDerWaalsContact O-N 3.12Å |
| 63 | I | 70.1 | Confident | 56.1 | Low | 151 Ų | 151 | 151.7 Ų | 151.7 | 77% | 0.774 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 122.8 | 171.9 | -60.4 | 172.8 | 0 | 0 | 0 | 105.6 | P61 R65 | P61-I63 PolarHBondContact O-N 3.21Å; P61-I63 VanDerWaalsContact O-N 3.1Å; I63-R65 PolarHBondContact O-N 3.25Å |
| 64 | P | 70.5 | Confident | 56.3 | Low | 111 Ų | 111 | 156.8 Ų | 156.8 | 72% | 0.721 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 118 | 177.7 | 20 | -28.6 | 0 | 0 | 0 | 106.9 | P62 | P62-P64 WeakPolarHBondContact O-CD 3.45Å; P62-P64 VanDerWaalsContact O-N 3.12Å |
| 65 | R | 71.3 | Confident | 56.5 | Low | 218 Ų | 218 | 155.6 Ų | 155.6 | 82% | 0.823 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 136.7 | 173.1 | -63 | -169.2 | -164.3 | -171.8 | 5.7 | 106.1 | I63 H67 | I63-R65 PolarHBondContact O-N 3.25Å; R65-H67 PolarHBondContact O-N 2.86Å |
| 66 | P | 66.9 | Low | 56.4 | Low | 123 Ų | 123 | 156 Ų | 156 | 80% | 0.799 | 79% | 0.785 | S | S | * | * | | | trans | -55.2 | 111.1 | 169.4 | 22.5 | -29.7 | 0 | 0 | 0 | 105.8 | Q68 | P66-Q68 PolarHBondContact O-N 3.43Š|
| 67 | H | 58.3 | Low | 56.7 | Low | 177 Ų | 177 | 156.3 Ų | 156.3 | 82% | 0.819 | 79% | 0.789 | S | S | * | * | | | trans | -55.3 | 115.3 | 171.8 | -83.3 | -64.3 | 0 | 0 | 0 | 104.8 | R65 R69 | R65-H67 PolarHBondContact O-N 2.86Å; H67-R69 PolarHBondContact O-N 2.9Å |
| 68 | Q | 53.4 | Low | 56.9 | Low | 184 Ų | 184 | 153 Ų | 153 | 86% | 0.86 | 79% | 0.787 | S | S | * | * | | | trans | -57 | 84.6 | 166.2 | -172.7 | 175.8 | 2.8 | 0 | 0 | 105.1 | P66 Q70 | P66-Q68 PolarHBondContact O-N 3.43Å; Q68-Q70 PolarHBondContact O-N 3.49Å |
| 69 | R | 51.8 | Low | 57.4 | Low | 232 Ų | 232 | 152.3 Ų | 152.3 | 88% | 0.875 | 80% | 0.795 | S | S | * | * | | | trans | -62.2 | 99.5 | 166.9 | -94.7 | -168.9 | 165.4 | 169.8 | -2.4 | 103 | H67 K71 | H67-R69 PolarHBondContact O-N 2.9Å; R69-K71 PolarHBondContact O-N 3.29Å |
| 70 | Q | 53.3 | Low | 57.2 | Low | 145 Ų | 145 | 149.6 Ų | 149.6 | 68% | 0.678 | 79% | 0.788 | S | S | * | * | | | trans | -34.6 | 128.3 | 164.1 | -71.3 | 171.5 | -35.2 | 0 | 0 | 106.8 | Q68 H72 | Q68-Q70 PolarHBondContact O-N 3.49Å; Q70-H72 PolarHBondContact O-N 3.1Å; Q70-H72 PolarHBondContact O-ND1 3.39Å |
| 71 | K | 46.9 | Very low | 56.8 | Low | 216 Ų | 216 | 147.1 Ų | 147.1 | 94% | 0.939 | 79% | 0.785 | S | S | * | * | | | trans | -46.1 | 87 | 168.7 | -85.4 | 177.1 | 167.2 | -178.4 | 0 | 108.4 | R69 G73 | R69-K71 PolarHBondContact O-N 3.29Å; K71-G73 PolarHBondContact O-N 3.29Å |
| 72 | H | 52.9 | Low | 55.8 | Low | 151 Ų | 151 | 147.1 Ų | 147.1 | 70% | 0.699 | 78% | 0.783 | S | S | * | * | | | trans | -82.5 | 103.4 | 162.4 | -77.1 | 101.7 | 0 | 0 | 0 | 103.7 | Q70 L74 | Q70-H72 PolarHBondContact O-N 3.1Å; Q70-H72 PolarHBondContact O-ND1 3.39Å; H72-L74 PolarHBondContact O-N 3.21Å; H72-L74 VanDerWaalsContact O-N 3.08Å |
| 73 | G | 46.1 | Very low | 55.1 | Low | 68 Ų | 68 | 148.8 Ų | 148.8 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | | | trans | -51.8 | 116.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | K71 N75 | K71-G73 PolarHBondContact O-N 3.29Å; G73-N75 PolarHBondContact O-N 3.12Å |
| 74 | L | 51.8 | Low | 54.3 | Low | 173 Ų | 173 | 150.8 Ų | 150.8 | 91% | 0.906 | 79% | 0.788 | S | S | * | * | | | trans | -72.9 | 77.7 | 157.8 | -90 | 156 | 0 | 0 | 0 | 106.6 | H72 | H72-L74 PolarHBondContact O-N 3.21Å; H72-L74 VanDerWaalsContact O-N 3.08Å |
| 75 | N | 50.7 | Low | 53.3 | Low | 152 Ų | 152 | 148.7 Ų | 148.7 | 81% | 0.813 | 79% | 0.787 | S | S | * | * | | | trans | -93.9 | 107.1 | 160.3 | -152.6 | -13.8 | 0 | 0 | 0 | 104.8 | G73 | G73-N75 PolarHBondContact O-N 3.12Š|
| 76 | K | 50.5 | Low | 52.3 | Low | 197 Ų | 197 | 143.8 Ų | 143.8 | 86% | 0.857 | 78% | 0.781 | S | S | * | * | | | trans | 139.8 | 115.4 | 177.6 | -83.8 | 166.1 | -166.3 | -154 | 0 | 106.6 | | |
| 77 | G | 50.6 | Low | 52 | Low | 71 Ų | 71 | 143.7 Ų | 143.7 | 73% | 0.732 | 78% | 0.78 | S | S | * | * | | | cis | 177.8 | 156.8 | 7.7 | 0 | 0 | 0 | 0 | 0 | 104.8 | | |
| 78 | D | 51.4 | Low | 51.5 | Low | 147 Ų | 147 | 137.5 Ų | 137.5 | 79% | 0.786 | 76% | 0.764 | S | S | * | * | | | trans | -40.1 | 129.9 | -179.7 | -101.5 | -48.3 | 0 | 0 | 0 | 113.2 | S80 | D78-S80 PolarHBondContact O-N 3.38Š|
| 79 | P | 54.5 | Low | 51.6 | Low | 123 Ų | 123 | 135.1 Ų | 135.1 | 80% | 0.799 | 76% | 0.764 | S | S | * | * | | | trans | -77.9 | 56 | 161.2 | 35.8 | -31.7 | 0 | 0 | 0 | 108.6 | V81 | P79-V81 VanDerWaalsContact C-N 3.31Š|
| 80 | S | 50.4 | Low | 51.5 | Low | 92 Ų | 92 | 132 Ų | 132 | 64% | 0.643 | 76% | 0.76 | S | S | * | * | | | trans | -100.6 | 59.1 | 167.5 | -163.2 | 0 | 0 | 0 | 0 | 108.5 | D78 | D78-S80 PolarHBondContact O-N 3.38Š|
| 81 | V | 50.4 | Low | 51.1 | Low | 132 Ų | 132 | 131.4 Ų | 131.4 | 80% | 0.8 | 76% | 0.761 | S | S | * | * | | | trans | -93.8 | 98 | 158 | -80 | 0 | 0 | 0 | 0 | 106.7 | P79 L83 | P79-V81 VanDerWaalsContact C-N 3.31Å; V81-L83 PolarHBondContact O-N 3.41Å |
| 82 | T | 48.6 | Very low | 51.4 | Low | 105 Ų | 105 | 128.1 Ų | 128.1 | 64% | 0.644 | 75% | 0.754 | S | S | * | * | | | trans | -46.9 | 107.4 | 172.2 | -35.5 | 0 | 0 | 0 | 0 | 109.6 | K84 | T82-K84 HydrophobicContact CG2-CD 4.49Å; T82-K84 HydrophobicContact CG2-CG 3.61Å; T82-K84 PolarHBondContact O-N 2.96Å |
| 83 | L | 56.8 | Low | 51.2 | Low | 157 Ų | 157 | 129.5 Ų | 129.5 | 82% | 0.822 | 76% | 0.76 | S | S | * | * | | | trans | -71.1 | 71.5 | 162.3 | -75.3 | 171.9 | 0 | 0 | 0 | 108.1 | V81 G85 | V81-L83 PolarHBondContact O-N 3.41Å; L83-G85 PolarHBondContact O-N 3.28Å |
| 84 | K | 52.6 | Low | 51.7 | Low | 192 Ų | 192 | 129.2 Ų | 129.2 | 84% | 0.835 | 76% | 0.758 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.3 | 105.6 | 161.2 | -71.7 | -167.2 | 178.3 | -175.8 | 0 | 106.5 | T82 | T82-K84 HydrophobicContact CG2-CD 4.49Å; T82-K84 HydrophobicContact CG2-CG 3.61Å; T82-K84 PolarHBondContact O-N 2.96Å |
| 85 | G | 50.4 | Low | 52 | Low | 67 Ų | 67 | 127.1 Ų | 127.1 | 69% | 0.691 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 122.1 | 32.4 | 158 | 0 | 0 | 0 | 0 | 0 | 117.7 | L83 P87 | L83-G85 PolarHBondContact O-N 3.28Å; G85-P87 WeakPolarHBondContact O-CD 3.3Å |
| 86 | V | 50.6 | Low | 51.9 | Low | 116 Ų | 116 | 128.6 Ų | 128.6 | 70% | 0.703 | 76% | 0.756 | S | S | * | * | | | trans | -99.2 | 108.4 | 155.4 | -175.8 | 0 | 0 | 0 | 0 | 107.4 | G88 | V86-G88 PolarHBondContact O-N 3.32Š|
| 87 | P | 60.7 | Low | 52.4 | Low | 121 Ų | 121 | 126.3 Ų | 126.3 | 79% | 0.786 | 75% | 0.752 | S | S | * | * | | | trans | -61.3 | 105 | 164.9 | -14.4 | 28.3 | 0 | 0 | 0 | 107.3 | G85 | G85-P87 WeakPolarHBondContact O-CD 3.3Š|
| 88 | G | 48 | Very low | 52.8 | Low | 46 Ų | 46 | 127 Ų | 127 | 47% | 0.474 | 74% | 0.744 | S | S | . | * | | | trans | -63.2 | 155 | 163.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | V86 H90 | V86-G88 PolarHBondContact O-N 3.32Å; G88-H90 PolarHBondContact O-N 3.17Å |
| 89 | P | 55 | Low | 53.2 | Low | 134 Ų | 134 | 128.6 Ų | 128.6 | 87% | 0.87 | 75% | 0.752 | S | S | * | * | | | trans | -71.4 | 82 | 178 | 31.3 | -31.4 | 0 | 0 | 0 | 107.6 | | |
| 90 | H | 49.4 | Very low | 52.9 | Low | 168 Ų | 168 | 131 Ų | 131 | 78% | 0.778 | 75% | 0.75 | S | S | * | * | | | trans | -86.6 | 121.5 | 175.2 | -132.2 | -34.2 | 0 | 0 | 0 | 108.2 | G88 D92 | G88-H90 PolarHBondContact O-N 3.17Å; H90-D92 PolarHBondContact O-N 3.49Å |
| 91 | D | 45.1 | Very low | 53 | Low | 132 Ų | 132 | 132 Ų | 132 | 71% | 0.706 | 76% | 0.756 | S | S | * | * | | | trans | -43.1 | 108.5 | 172.3 | -58.5 | -91.4 | 0 | 0 | 0 | 112.9 | | |
| 92 | D | 53 | Low | 53.1 | Low | 147 Ų | 147 | 133.5 Ų | 133.5 | 79% | 0.786 | 76% | 0.759 | S | S | * | * | | | trans | -133.9 | 93.7 | 163 | -97.7 | -52.1 | 0 | 0 | 0 | 109.8 | H90 G94 | H90-D92 PolarHBondContact O-N 3.49Å; D92-G94 PolarHBondContact O-N 3.28Å |
| 93 | H | 48.8 | Very low | 53.1 | Low | 179 Ų | 179 | 136.7 Ų | 136.7 | 83% | 0.829 | 77% | 0.767 | S | S | * | * | | | trans | 8.6 | 90.6 | 155.8 | -51.8 | -63.1 | 0 | 0 | 0 | 118.6 | | |
| 94 | G | 57 | Low | 53.1 | Low | 63 Ų | 63 | 133.1 Ų | 133.1 | 65% | 0.649 | 75% | 0.751 | S | S | * | * | | | trans | -91.4 | 149.8 | 154.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | D92 Q96 | D92-G94 PolarHBondContact O-N 3.28Å; G94-Q96 PolarHBondContact O-N 2.91Å; G94-Q96 VanDerWaalsContact O-N 3.16Å |
| 95 | P | 57.6 | Low | 53 | Low | 128 Ų | 128 | 127.1 Ų | 127.1 | 83% | 0.831 | 73% | 0.734 | S | S | * | * | | | trans | -57.6 | 123.6 | 176.8 | 23.2 | -31.1 | 0 | 0 | 0 | 110.1 | L97 | P95-L97 PolarHBondContact O-N 3.46Š|
| 96 | Q | 49.2 | Very low | 53.4 | Low | 184 Ų | 184 | 134.5 Ų | 134.5 | 86% | 0.86 | 74% | 0.741 | S | S | * | * | | | trans | -49.7 | 102.7 | -178.8 | -168.6 | 179.1 | 76.5 | 0 | 0 | 110.8 | G94 | G94-Q96 PolarHBondContact O-N 2.91Å; G94-Q96 VanDerWaalsContact O-N 3.16Å |
| 97 | L | 61.1 | Low | 53.8 | Low | 148 Ų | 148 | 136.8 Ų | 136.8 | 78% | 0.775 | 74% | 0.743 | S | S | * | * | | | trans | -61.9 | 133.4 | 167.8 | -74.1 | 170.1 | 0 | 0 | 0 | 107.9 | P95 L99 | P95-L97 PolarHBondContact O-N 3.46Å; L97-L99 PolarHBondContact O-N 2.96Å |
| 98 | P | 59.2 | Low | 53.3 | Low | 87 Ų | 87 | 139.9 Ų | 139.9 | 57% | 0.565 | 74% | 0.74 | S | S | * | * | | | trans | -58.4 | 118.8 | 178.1 | -18.2 | 28.4 | 0 | 0 | 0 | 109.2 | K100 | P98-K100 HydrophobicContact CB-CB 4.26Å; P98-K100 HydrophobicContact CB-CD 3.73Å; P98-K100 HydrophobicContact CB-CG 3.79Å; P98-K100 PolarHBondContact O-N 3.28Å |
| 99 | L | 57.9 | Low | 54 | Low | 180 Ų | 180 | 142.5 Ų | 142.5 | 94% | 0.942 | 75% | 0.749 | S | S | * | * | | | trans | -67.3 | 41.5 | 170 | -76.9 | 159.8 | 0 | 0 | 0 | 111.7 | L97 | L97-L99 PolarHBondContact O-N 2.96Š|
| 100 | K | 50 | Low | 54 | Low | 173 Ų | 173 | 144 Ų | 144 | 75% | 0.752 | 75% | 0.745 | S | S | * | * | | | trans | -101.5 | 108.6 | -178.9 | -60.1 | 176.8 | -177.1 | 177.3 | 0 | 105.7 | P98 | P98-K100 HydrophobicContact CB-CB 4.26Å; P98-K100 HydrophobicContact CB-CD 3.73Å; P98-K100 HydrophobicContact CB-CG 3.79Å; P98-K100 PolarHBondContact O-N 3.28Å |
| 101 | S | 51.2 | Low | 54.2 | Low | 112 Ų | 112 | 143.3 Ų | 143.3 | 78% | 0.783 | 74% | 0.741 | S | S | * | * | | | trans | 101.7 | 33.7 | 163.1 | 81.4 | 0 | 0 | 0 | 0 | 120.7 | H103 | S101-H103 PolarHBondContact O-N 3.29Š|
| 102 | L | 52.8 | Low | 54.3 | Low | 164 Ų | 164 | 142 Ų | 142 | 86% | 0.859 | 74% | 0.742 | S | S | * | * | | | trans | -84.1 | 59.5 | 145 | -85.8 | 162.1 | 0 | 0 | 0 | 109.3 | T104 | L102-T104 HydrophobicContact CD2-CG2 4.49Å; L102-T104 PolarHBondContact O-N 2.94Å |
| 103 | H | 48.6 | Very low | 54.6 | Low | 173 Ų | 173 | 140.1 Ų | 140.1 | 80% | 0.801 | 74% | 0.741 | S | S | * | * | | | trans | -73.9 | 87.3 | 159.3 | -163.4 | -127.6 | 0 | 0 | 0 | 105 | S101 S105 | S101-H103 PolarHBondContact O-N 3.29Å; H103-S105 PolarHBondContact O-N 3.46Å |
| 104 | T | 56.4 | Low | 55.1 | Low | 82 Ų | 82 | 136.9 Ų | 136.9 | 50% | 0.503 | 74% | 0.735 | S | S | . | * | | | trans | -65 | 83.9 | 165.9 | 53.7 | 0 | 0 | 0 | 0 | 106 | L102 W106 | L102-T104 HydrophobicContact CD2-CG2 4.49Å; L102-T104 PolarHBondContact O-N 2.94Å; T104-W106 PolarHBondContact O-N 3.07Å; T104-W106 PolarHBondContact OG1-NE1 3.46Å |
| 105 | S | 50.1 | Low | 55 | Low | 66 Ų | 66 | 139.5 Ų | 139.5 | 46% | 0.462 | 74% | 0.741 | S | S | . | * | | | trans | -61.7 | 93.2 | 160.8 | -177.8 | 0 | 0 | 0 | 0 | 104.7 | H103 H107 | H103-S105 PolarHBondContact O-N 3.46Å; S105-H107 PolarHBondContact O-N 3.29Å; S105-H107 PolarHBondContact OG-CD2 3.34Å; S105-H107 PolarHBondContact OG-NE2 2.88Å |
| 106 | W | 60.7 | Low | 54.9 | Low | 222 Ų | 222 | 138.5 Ų | 138.5 | 84% | 0.841 | 73% | 0.733 | S | S | * | * | | | trans | -65.5 | 82.2 | 162.3 | -64.7 | 96.1 | 0 | 0 | 0 | 105.1 | T104 Y108 | T104-W106 PolarHBondContact O-N 3.07Å; T104-W106 PolarHBondContact OG1-NE1 3.46Å; W106-Y108 PolarHBondContact O-N 3.27Å |
| 107 | H | 57.1 | Low | 55.2 | Low | 163 Ų | 163 | 132.7 Ų | 132.7 | 76% | 0.755 | 72% | 0.722 | S | S | * | * | | | trans | -60.4 | 92.1 | 164.5 | -88.5 | -74.6 | 0 | 0 | 0 | 105.7 | S105 P109 | S105-H107 PolarHBondContact O-N 3.29Å; S105-H107 PolarHBondContact OG-CD2 3.34Å; S105-H107 PolarHBondContact OG-NE2 2.88Å; H107-P109 VanDerWaalsContact O-CD 3.23Å; H107-P109 WeakPolarHBondContact O-CD 3.35Å |
| 108 | Y | 50.8 | Low | 54.8 | Low | 186 Ų | 186 | 133.8 Ų | 133.8 | 73% | 0.729 | 72% | 0.721 | S | S | * | * | | | trans | -56 | 116.9 | 168 | -148.1 | -91.6 | 0 | 0 | 0 | 105.3 | W106 H110 | W106-Y108 PolarHBondContact O-N 3.27Å; Y108-H110 VanDerWaalsContact C-N 3.32Å; Y108-H110 PolarHBondContact O-N 3.3Å |
| 109 | P | 63.2 | Low | 54.6 | Low | 101 Ų | 101 | 137.1 Ų | 137.1 | 66% | 0.656 | 73% | 0.729 | S | S | * | * | | | trans | -61.6 | 104.2 | 171 | -15.8 | 29.4 | 0 | 0 | 0 | 106.1 | H107 H111 | H107-P109 VanDerWaalsContact O-CD 3.23Å; H107-P109 WeakPolarHBondContact O-CD 3.35Å; P109-H111 PolarHBondContact O-N 3.26Å |
| 110 | H | 54.4 | Low | 54.4 | Low | 167 Ų | 167 | 132.1 Ų | 132.1 | 77% | 0.773 | 71% | 0.713 | S | S | * | * | | | trans | -71.8 | 61.5 | 168.9 | -86.4 | -91 | 0 | 0 | 0 | 108.6 | Y108 | Y108-H110 VanDerWaalsContact C-N 3.32Å; Y108-H110 PolarHBondContact O-N 3.3Å |
| 111 | H | 54.9 | Low | 54.7 | Low | 153 Ų | 153 | 126.4 Ų | 126.4 | 71% | 0.708 | 70% | 0.698 | S | S | * | * | | | trans | -136.5 | 84.3 | 175.7 | -67.1 | -64.5 | 0 | 0 | 0 | 108.6 | P109 | P109-H111 PolarHBondContact O-N 3.26Š|
| 112 | S | 46.3 | Very low | 54.9 | Low | 104 Ų | 104 | 124 Ų | 124 | 73% | 0.727 | 69% | 0.685 | S | S | * | * | | | | 39.1 | 104.1 | 128.2 | 49.6 | 0 | 0 | 0 | 0 | 116.3 | | |
| 113 | S | 59.8 | Low | 55.1 | Low | 108 Ų | 108 | 118.6 Ų | 118.6 | 76% | 0.755 | 66% | 0.664 | S | S | * | * | | | trans | 116.4 | 122.6 | 158.6 | -48.9 | 0 | 0 | 0 | 0 | 112.5 | | |
| 114 | P | 58.8 | Low | 55.5 | Low | 110 Ų | 110 | 114 Ų | 114 | 71% | 0.714 | 65% | 0.652 | S | S | * | * | | | trans | -61.4 | 136.7 | 172.2 | 26 | -30.7 | 0 | 0 | 0 | 108.6 | T116 | P114-T116 PolarHBondContact O-N 3.09Š|
| 115 | P | 55 | Low | 55.6 | Low | 119 Ų | 119 | 117.6 Ų | 117.6 | 77% | 0.773 | 66% | 0.66 | S | S | * | * | | | trans | -57.4 | 112.7 | 169.1 | 24.6 | -30.7 | 0 | 0 | 0 | 106.2 | G117 | P115-G117 PolarHBondContact O-N 3.18Å; P115-G117 VanDerWaalsContact O-N 3.08Å |
| 116 | T | 55.5 | Low | 55.9 | Low | 107 Ų | 107 | 119.9 Ų | 119.9 | 66% | 0.656 | 66% | 0.662 | S | S | * | * | | | trans | -61.2 | 118.7 | 179.1 | -49.7 | 0 | 0 | 0 | 0 | 105.5 | P114 F118 E119 | P114-T116 PolarHBondContact O-N 3.09Å; T116-F118 HydrophobicContact CG2-CD2 4.48Å; T116-F118 PolarHBondContact O-N 3.16Å; T116-E119 PolarHBondContact O-N 3.39Å |
| 117 | G | 56.1 | Low | 55.7 | Low | 61 Ų | 61 | 113.9 Ų | 113.9 | 63% | 0.629 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.5 | 11.5 | -172.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | P115 | P115-G117 PolarHBondContact O-N 3.18Å; P115-G117 VanDerWaalsContact O-N 3.08Å |
| 118 | F | 53 | Low | 55.9 | Low | 171 Ų | 171 | 112.2 Ų | 112.2 | 75% | 0.75 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -70.4 | -32.9 | 170.6 | -103.8 | -92.4 | 0 | 0 | 0 | 113.3 | T116 A121 A122 | T116-F118 HydrophobicContact CG2-CD2 4.48Å; T116-F118 PolarHBondContact O-N 3.16Å; F118-A121 PolarHBondContact O-N 3.06Å; F118-A122 PolarHBondContact O-N 3.33Å; F118-A122 VanDerWaalsContact O-N 3.13Å |
| 119 | E | 53.3 | Low | 56.4 | Low | 158 Ų | 158 | 111.1 Ų | 111.1 | 74% | 0.738 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -71.5 | -35.9 | -175.6 | -159.7 | 175 | 175 | 0 | 0 | 112.2 | T116 A122 A123 | T116-E119 PolarHBondContact O-N 3.39Å; E119-A122 PolarHBondContact O-N 3.4Å; E119-A123 PolarHBondContact O-N 2.89Å |
| 120 | A | 54.1 | Low | 56.6 | Low | 74 Ų | 74 | 114.8 Ų | 114.8 | 61% | 0.612 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -68.6 | -34.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | S124 | A120-S124 WeakPolarHBondContact O-CB 3.26Å; A120-S124 PolarHBondContact O-N 3.35Å; A120-S124 VanDerWaalsContact O-N 3.15Å |
| 121 | A | 56.5 | Low | 57.4 | Low | 53 Ų | 53 | 108.1 Ų | 108.1 | 44% | 0.438 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -71.5 | -35.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | F118 K125 | F118-A121 PolarHBondContact O-N 3.06Å; A121-K125 PolarHBondContact O-N 3.34Å |
| 122 | A | 55.2 | Low | 58.5 | Low | 61 Ų | 61 | 104.8 Ų | 104.8 | 50% | 0.504 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -69 | -42.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | F118 E119 S124 K125 F126 | F118-A122 PolarHBondContact O-N 3.33Å; F118-A122 VanDerWaalsContact O-N 3.13Å; E119-A122 PolarHBondContact O-N 3.4Å; A122-S124 VanDerWaalsContact C-N 3.33Å; A122-S124 PolarHBondContact O-N 2.96Å; A122-K125 PolarHBondContact O-N 2.85Å; A122-F126 PolarHBondContact O-N 3.32Å |
| 123 | A | 56.7 | Low | 60.4 | Low | 51 Ų | 51 | 107.5 Ų | 107.5 | 42% | 0.421 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -64.6 | -37.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | E119 F126 L127 | E119-A123 PolarHBondContact O-N 2.89Å; A123-F126 PolarHBondContact O-N 3.02Å; A123-L127 WeakPolarHBondContact O-CG 3.4Å; A123-L127 PolarHBondContact O-N 3.04Å |
| 124 | S | 56.8 | Low | 61.5 | Low | 77 Ų | 77 | 105.5 Ų | 105.5 | 54% | 0.538 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -63.2 | -43 | 177.8 | -178.2 | 0 | 0 | 0 | 0 | 112.6 | A120 A122 F126 L127 H128 | A120-S124 WeakPolarHBondContact O-CB 3.26Å; A120-S124 PolarHBondContact O-N 3.35Å; A120-S124 VanDerWaalsContact O-N 3.15Å; A122-S124 VanDerWaalsContact C-N 3.33Å; A122-S124 PolarHBondContact O-N 2.96Å; S124-F126 VanDerWaalsContact C-N 3.35Å; S124-F126 PolarHBondContact O-N 2.99Å; S124-L127 PolarHBondContact O-N 3.31Å; S124-H128 PolarHBondContact O-N 3.05Å; S124-H128 VanDerWaalsContact O-N 3.13Å |
| 125 | K | 58.5 | Low | 62.7 | Low | 157 Ų | 157 | 104.3 Ų | 104.3 | 68% | 0.683 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -64.2 | -39.7 | 175.4 | -71.2 | -174.5 | 178.4 | -173.9 | 0 | 112.2 | A121 A122 H128 E129 | A121-K125 PolarHBondContact O-N 3.34Å; A122-K125 PolarHBondContact O-N 2.85Å; K125-H128 PolarHBondContact O-N 2.91Å; K125-E129 PolarHBondContact O-N 3.19Å |
| 126 | F | 57.2 | Low | 64.2 | Low | 115 Ų | 115 | 105.5 Ų | 105.5 | 50% | 0.504 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -67.6 | -38 | -179.8 | -132.1 | -98.9 | 0 | 0 | 0 | 112.9 | A122 A123 S124 R130 | A122-F126 PolarHBondContact O-N 3.32Å; A123-F126 PolarHBondContact O-N 3.02Å; S124-F126 VanDerWaalsContact C-N 3.35Å; S124-F126 PolarHBondContact O-N 2.99Å; F126-R130 HydrophobicContact CD1-CG 4.33Å; F126-R130 HydrophobicContact CE1-CG 4.43Å; F126-R130 WeakPolarHBondContact O-CB 3.5Å; F126-R130 PolarHBondContact O-N 3.36Å |
| 127 | L | 57 | Low | 66 | Low | 96 Ų | 96 | 103.1 Ų | 103.1 | 50% | 0.503 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -69 | -36.3 | 176 | -74.6 | 166.9 | 0 | 0 | 0 | 112.1 | A123 S124 C131 I134 | A123-L127 WeakPolarHBondContact O-CG 3.4Å; A123-L127 PolarHBondContact O-N 3.04Å; S124-L127 PolarHBondContact O-N 3.31Å; L127-C131 CarbonylContact O-C 3.47Å; L127-C131 WeakPolarHBondContact O-CA 3.48Å; L127-C131 PolarHBondContact O-N 3.13Å; L127-I134 HydrophobicContact CD2-CD1 4.29Å |
| 128 | H | 61.2 | Low | 67.6 | Low | 128 Ų | 128 | 102.7 Ų | 102.7 | 59% | 0.593 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -66.3 | -41.3 | 177.5 | -171.5 | -92.9 | 0 | 0 | 0 | 112.6 | S124 K125 I135 | S124-H128 PolarHBondContact O-N 3.05Å; S124-H128 VanDerWaalsContact O-N 3.13Å; K125-H128 PolarHBondContact O-N 2.91Å; H128-I135 HydrophobicContact CB-CD1 4.3Å; H128-I135 WeakPolarHBondContact CD2-CD1 3.32Å |
| 129 | E | 61 | Low | 69.4 | Low | 162 Ų | 162 | 101 Ų | 101 | 76% | 0.757 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -79.3 | -36.4 | 179.7 | -80.2 | -172.2 | 139.4 | 0 | 0 | 113.8 | K125 | K125-E129 PolarHBondContact O-N 3.19Å |
| 130 | R | 66.4 | Low | 71.4 | Confident | 178 Ų | 178 | 96.7 Ų | 96.7 | 67% | 0.672 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -94.2 | -21.5 | -173.8 | -65.2 | -157.2 | 172.4 | 177.3 | 0.1 | 114.6 | F126 | F126-R130 HydrophobicContact CD1-CG 4.33Å; F126-R130 HydrophobicContact CE1-CG 4.43Å; F126-R130 WeakPolarHBondContact O-CB 3.5Å; F126-R130 PolarHBondContact O-N 3.36Å |
| 131 | C | 72.2 | Confident | 73.3 | Confident | 28 Ų | 28 | 98.6 Ų | 98.6 | 19% | 0.189 | 50% | 0.503 | C | S | . | . | | | trans | -137.6 | 60.1 | -172.4 | -66.4 | 0 | 0 | 0 | 0 | 112.7 | L127 W133 I134 | L127-C131 CarbonylContact O-C 3.47Å; L127-C131 WeakPolarHBondContact O-CA 3.48Å; L127-C131 PolarHBondContact O-N 3.13Å; C131-W133 PolarHBondContact O-N 3.02Å; C131-W133 VanDerWaalsContact O-N 3.09Å; C131-I134 HydrophobicContact CB-CB 4.28Å; C131-I134 HydrophobicContact CB-CD1 3.49Å; C131-I134 VanDerWaalsContact CB-CD1 3.49Å; C131-I134 HydrophobicContact CB-CG1 3.78Å; C131-I134 PolarHBondContact O-N 2.74Å |
| 132 | P | 78 | Confident | 75 | Confident | 83 Ų | 83 | 99.9 Ų | 99.9 | 54% | 0.539 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.1 | -26.4 | 175.5 | 25.1 | -34.4 | 0 | 0 | 0 | 112.3 | I134 I135 Y136 | P132-I134 VanDerWaalsContact C-N 3.3Å; P132-I134 PolarHBondContact O-N 3.47Å; P132-I135 PolarHBondContact O-N 3.31Å; P132-Y136 PolarHBondContact O-N 3.25Å |
| 133 | W | 85.3 | Confident | 76.9 | Confident | 161 Ų | 161 | 100.7 Ų | 100.7 | 61% | 0.61 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.4 | -32.6 | 175.1 | 68 | -92.7 | 0 | 0 | 0 | 113 | C131 Y136 C137 | C131-W133 PolarHBondContact O-N 3.02Å; C131-W133 VanDerWaalsContact O-N 3.09Å; W133-Y136 PolarHBondContact O-N 3.44Å; W133-C137 WeakPolarHBondContact O-CB 3.27Å; W133-C137 PolarHBondContact O-N 3.45Å; W133-C137 PolarHBondContact O-SG 3.32Å |
| 134 | I | 84.2 | Confident | 78.6 | Confident | 66 Ų | 66 | 103.8 Ų | 103.8 | 34% | 0.338 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.3 | -42.8 | 178.5 | -65.6 | 175.9 | 0 | 0 | 0 | 110 | L127 C131 P132 Y136 C137 A138 | L127-I134 HydrophobicContact CD2-CD1 4.29Å; C131-I134 HydrophobicContact CB-CB 4.28Å; C131-I134 HydrophobicContact CB-CD1 3.49Å; C131-I134 VanDerWaalsContact CB-CD1 3.49Å; C131-I134 HydrophobicContact CB-CG1 3.78Å; C131-I134 PolarHBondContact O-N 2.74Å; P132-I134 VanDerWaalsContact C-N 3.3Å; P132-I134 PolarHBondContact O-N 3.47Å; I134-Y136 VanDerWaalsContact C-N 3.34Å; I134-C137 PolarHBondContact O-N 3.15Å; I134-A138 WeakPolarHBondContact O-CB 3.43Å; I134-A138 PolarHBondContact O-N 2.98Å |
| 135 | I | 83.5 | Confident | 80.4 | Confident | 84 Ų | 84 | 106.2 Ų | 106.2 | 43% | 0.431 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64 | -43.3 | 177.3 | -61.5 | 170.3 | 0 | 0 | 0 | 110 | H128 P132 A138 Y139 | H128-I135 HydrophobicContact CB-CD1 4.3Å; H128-I135 WeakPolarHBondContact CD2-CD1 3.32Å; P132-I135 PolarHBondContact O-N 3.31Å; I135-A138 PolarHBondContact O-N 3.21Å; I135-Y139 WeakPolarHBondContact O-CB 3.4Å; I135-Y139 PolarHBondContact O-N 3.23Å |
| 136 | Y | 87.2 | Confident | 81.9 | Confident | 145 Ų | 145 | 104.3 Ų | 104.3 | 57% | 0.569 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.6 | -45 | 175.5 | -178.6 | -104.5 | 0 | 0 | 0 | 112.3 | P132 W133 I134 A138 Y139 L140 | P132-Y136 PolarHBondContact O-N 3.25Å; W133-Y136 PolarHBondContact O-N 3.44Å; I134-Y136 VanDerWaalsContact C-N 3.34Å; Y136-A138 PolarHBondContact O-N 3.47Å; Y136-Y139 WeakPolarHBondContact O-CB 3.29Å; Y136-Y139 PolarHBondContact O-N 3.18Å; Y136-L140 HydrophobicContact CD1-CD1 3.92Å; Y136-L140 HydrophobicContact CD1-CG 4.35Å; Y136-L140 HydrophobicContact CE1-CD1 3.31Å; Y136-L140 HydrophobicContact CE1-CG 3.95Å; Y136-L140 HydrophobicContact CE2-CG 4.39Å; Y136-L140 WeakPolarHBondContact O-CG 3.03Å; Y136-L140 PolarHBondContact O-N 3.28Å |
| 137 | C | 92.1 | Very high | 83.3 | Confident | 56 Ų | 56 | 106.1 Ų | 106.1 | 38% | 0.378 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.8 | -45 | 175.3 | -72.4 | 0 | 0 | 0 | 0 | 111.8 | W133 I134 Y139 L140 I141 | W133-C137 WeakPolarHBondContact O-CB 3.27Å; W133-C137 PolarHBondContact O-N 3.45Å; W133-C137 PolarHBondContact O-SG 3.32Å; I134-C137 PolarHBondContact O-N 3.15Å; C137-Y139 VanDerWaalsContact C-N 3.33Å; C137-Y139 PolarHBondContact O-N 3.5Å; C137-L140 PolarHBondContact O-N 3.13Å; C137-I141 VanDerWaalsContact O-CG1 3.27Å; C137-I141 WeakPolarHBondContact O-CG1 3.38Å; C137-I141 PolarHBondContact O-N 3.35Å |
| 138 | A | 90.6 | Very high | 84.6 | Confident | 52 Ų | 52 | 107.1 Ų | 107.1 | 43% | 0.43 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.8 | -43.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | I134 I135 Y136 I141 V142 | I134-A138 WeakPolarHBondContact O-CB 3.43Å; I134-A138 PolarHBondContact O-N 2.98Å; I135-A138 PolarHBondContact O-N 3.21Å; Y136-A138 PolarHBondContact O-N 3.47Å; A138-I141 PolarHBondContact O-N 3.38Å; A138-V142 WeakPolarHBondContact O-CG2 3.44Å; A138-V142 PolarHBondContact O-N 2.79Å; A138-V142 VanDerWaalsContact O-N 3.07Å |
| 139 | Y | 91.3 | Very high | 85.2 | Confident | 136 Ų | 136 | 110.1 Ų | 110.1 | 53% | 0.533 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60.8 | -45.5 | 175.1 | 177.3 | -99.7 | 0 | 0 | 0 | 112.2 | I135 Y136 C137 I141 V142 M143 | I135-Y139 WeakPolarHBondContact O-CB 3.4Å; I135-Y139 PolarHBondContact O-N 3.23Å; Y136-Y139 WeakPolarHBondContact O-CB 3.29Å; Y136-Y139 PolarHBondContact O-N 3.18Å; C137-Y139 VanDerWaalsContact C-N 3.33Å; C137-Y139 PolarHBondContact O-N 3.5Å; Y139-I141 PolarHBondContact O-N 2.85Å; Y139-V142 PolarHBondContact O-N 2.75Å; Y139-M143 HydrophobicContact CD1-CG 4.17Å; Y139-M143 HydrophobicContact CD2-CG 4.48Å; Y139-M143 HydrophobicContact CE1-CG 3.72Å; Y139-M143 HydrophobicContact CE2-CG 4.06Å; Y139-M143 HydrophobicContact CE2-SD 4.28Å; Y139-M143 WeakPolarHBondContact O-CG 3.34Å; Y139-M143 PolarHBondContact O-N 3.08Å |
| 140 | L | 94.5 | Very high | 86.5 | Confident | 67 Ų | 67 | 107.5 Ų | 107.5 | 35% | 0.351 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.4 | -41.7 | 176.4 | -75 | -177.2 | 0 | 0 | 0 | 112.4 | Y136 C137 V142 M143 L144 | Y136-L140 HydrophobicContact CD1-CD1 3.92Å; Y136-L140 HydrophobicContact CD1-CG 4.35Å; Y136-L140 HydrophobicContact CE1-CD1 3.31Å; Y136-L140 HydrophobicContact CE1-CG 3.95Å; Y136-L140 HydrophobicContact CE2-CG 4.39Å; Y136-L140 WeakPolarHBondContact O-CG 3.03Å; Y136-L140 PolarHBondContact O-N 3.28Å; C137-L140 PolarHBondContact O-N 3.13Å; L140-V142 VanDerWaalsContact C-N 3.33Å; L140-V142 PolarHBondContact O-N 2.68Å; L140-M143 PolarHBondContact O-N 2.94Å; L140-L144 WeakPolarHBondContact O-CB 3.4Å; L140-L144 VanDerWaalsContact O-CG 3.26Å; L140-L144 WeakPolarHBondContact O-CG 3.42Å; L140-L144 PolarHBondContact O-N 2.74Å |
| 141 | I | 94.3 | Very high | 87.5 | Confident | 114 Ų | 114 | 103.8 Ų | 103.8 | 59% | 0.585 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -60.9 | -44.3 | 177.4 | -68.9 | 163.2 | 0 | 0 | 0 | 110.6 | C137 A138 Y139 L144 Y145 | C137-I141 VanDerWaalsContact O-CG1 3.27Å; C137-I141 WeakPolarHBondContact O-CG1 3.38Å; C137-I141 PolarHBondContact O-N 3.35Å; A138-I141 PolarHBondContact O-N 3.38Å; Y139-I141 PolarHBondContact O-N 2.85Å; I141-L144 PolarHBondContact O-N 3.23Å; I141-Y145 WeakPolarHBondContact O-CB 3.47Å; I141-Y145 PolarHBondContact O-N 2.82Å |
| 142 | V | 92.4 | Very high | 88.4 | Confident | 80 Ų | 80 | 108 Ų | 108 | 49% | 0.485 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.9 | -44.2 | 177 | 173.8 | 0 | 0 | 0 | 0 | 111 | A138 Y139 L140 L144 Y145 M146 | A138-V142 WeakPolarHBondContact O-CG2 3.44Å; A138-V142 PolarHBondContact O-N 2.79Å; A138-V142 VanDerWaalsContact O-N 3.07Å; Y139-V142 PolarHBondContact O-N 2.75Å; L140-V142 VanDerWaalsContact C-N 3.33Å; L140-V142 PolarHBondContact O-N 2.68Å; V142-L144 PolarHBondContact O-N 3.17Å; V142-Y145 PolarHBondContact O-N 3.28Å; V142-M146 HydrophobicContact CG1-CG 4.44Å; V142-M146 VanDerWaalsContact O-CG 3.29Å; V142-M146 WeakPolarHBondContact O-CG 3.35Å; V142-M146 PolarHBondContact O-N 3.11Å |
| 143 | M | 93.4 | Very high | 89 | Confident | 79 Ų | 79 | 109.5 Ų | 109.5 | 39% | 0.389 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.8 | -42.8 | 178 | -72.3 | -63 | -67.8 | 0 | 0 | 112.1 | Y139 L140 M146 Q147 | Y139-M143 HydrophobicContact CD1-CG 4.17Å; Y139-M143 HydrophobicContact CD2-CG 4.48Å; Y139-M143 HydrophobicContact CE1-CG 3.72Å; Y139-M143 HydrophobicContact CE2-CG 4.06Å; Y139-M143 HydrophobicContact CE2-SD 4.28Å; Y139-M143 WeakPolarHBondContact O-CG 3.34Å; Y139-M143 PolarHBondContact O-N 3.08Å; L140-M143 PolarHBondContact O-N 2.94Å; M143-M146 PolarHBondContact O-N 3.09Å; M143-Q147 VanDerWaalsContact O-CG 3.3Å; M143-Q147 WeakPolarHBondContact O-CG 3.23Å; M143-Q147 PolarHBondContact O-N 2.82Å; M143-Q147 VanDerWaalsContact O-N 3.12Å |
| 144 | L | 94 | Very high | 89.2 | Confident | 116 Ų | 116 | 106.3 Ų | 106.3 | 61% | 0.607 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63.4 | -43.7 | 175 | -72.2 | 169.8 | 0 | 0 | 0 | 111.3 | L140 I141 V142 M146 Q147 C148 | L140-L144 WeakPolarHBondContact O-CB 3.4Å; L140-L144 VanDerWaalsContact O-CG 3.26Å; L140-L144 WeakPolarHBondContact O-CG 3.42Å; L140-L144 PolarHBondContact O-N 2.74Å; I141-L144 PolarHBondContact O-N 3.23Å; V142-L144 PolarHBondContact O-N 3.17Å; L144-M146 VanDerWaalsContact C-N 3.31Å; L144-M146 PolarHBondContact O-N 2.9Å; L144-Q147 PolarHBondContact O-N 3.43Å; L144-C148 PolarHBondContact O-N 2.97Å; L144-C148 VanDerWaalsContact O-N 3.1Å; L144-C148 PolarHBondContact O-SG 3.18Å |
| 145 | Y | 92.9 | Very high | 89.5 | Confident | 128 Ų | 128 | 108.9 Ų | 108.9 | 50% | 0.502 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -61.3 | -38.6 | 177.5 | -178.3 | -101.1 | 0 | 0 | 0 | 112.7 | I141 V142 C148 K149 | I141-Y145 WeakPolarHBondContact O-CB 3.47Å; I141-Y145 PolarHBondContact O-N 2.82Å; V142-Y145 PolarHBondContact O-N 3.28Å; Y145-C148 PolarHBondContact O-N 3.41Å; Y145-K149 HydrophobicContact CE1-CD 4.01Å; Y145-K149 VanDerWaalsContact CE1-CE 3.49Å; Y145-K149 VanDerWaalsContact CE1-NZ 3.35Å; Y145-K149 WeakPolarHBondContact OH-CE 3.43Å; Y145-K149 PolarHBondContact OH-NZ 3.08Å |
| 146 | M | 90.7 | Very high | 90 | Very high | 117 Ų | 117 | 110.7 Ų | 110.7 | 58% | 0.576 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -72.8 | -26.4 | 177.5 | -68.1 | -63.9 | -180 | 0 | 0 | 113.3 | V142 M143 L144 | V142-M146 HydrophobicContact CG1-CG 4.44Å; V142-M146 VanDerWaalsContact O-CG 3.29Å; V142-M146 WeakPolarHBondContact O-CG 3.35Å; V142-M146 PolarHBondContact O-N 3.11Å; M143-M146 PolarHBondContact O-N 3.09Å; L144-M146 VanDerWaalsContact C-N 3.31Å; L144-M146 PolarHBondContact O-N 2.9Å |
| 147 | Q | 87.7 | Confident | 90.2 | Very high | 153 Ų | 153 | 108.1 Ų | 108.1 | 72% | 0.715 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -79.7 | -22.8 | 174.4 | -68.1 | -71.2 | -34.7 | 0 | 0 | 112.6 | M143 L144 | M143-Q147 VanDerWaalsContact O-CG 3.3Å; M143-Q147 WeakPolarHBondContact O-CG 3.23Å; M143-Q147 PolarHBondContact O-N 2.82Å; M143-Q147 VanDerWaalsContact O-N 3.12Å; L144-Q147 PolarHBondContact O-N 3.43Å |
| 148 | C | 82.8 | Confident | 90 | Very high | 116 Ų | 116 | 112.4 Ų | 112.4 | 78% | 0.784 | 57% | 0.566 | S | S | * | * | | | trans | -89.6 | -1.1 | 179.5 | -67.8 | 0 | 0 | 0 | 0 | 114.3 | L144 Y145 | L144-C148 PolarHBondContact O-N 2.97Å; L144-C148 VanDerWaalsContact O-N 3.1Å; L144-C148 PolarHBondContact O-SG 3.18Å; Y145-C148 PolarHBondContact O-N 3.41Å |
| 149 | K | 75.5 | Confident | 90 | Very high | 191 Ų | 191 | 117.9 Ų | 117.9 | 83% | 0.83 | 58% | 0.578 | S | S | * | * | | | trans | -101.8 | 0 | 173.5 | -85.4 | -173 | 171.9 | 175.4 | 0 | 110.8 | Y145 | Y145-K149 HydrophobicContact CE1-CD 4.01Å; Y145-K149 VanDerWaalsContact CE1-CE 3.49Å; Y145-K149 VanDerWaalsContact CE1-NZ 3.35Å; Y145-K149 WeakPolarHBondContact OH-CE 3.43Å; Y145-K149 PolarHBondContact OH-NZ 3.08Å |