| 1 | M | 58.3 | Low | 56.4 | Low | 238 Ų | 238 | 191.4 Ų | 191.4 | 100% | 1.172 | 88% | 0.875 | S | S | * | * | | | | 0 | 106.7 | 0 | -101.4 | 163.4 | 54.4 | 0 | 0 | 108.5 | | |
| 2 | W | 46.5 | Very low | 56.5 | Low | 246 Ų | 246 | 195.6 Ų | 195.6 | 93% | 0.932 | 88% | 0.878 | S | S | * | * | | | trans | -88.6 | 138.8 | 175.5 | -74.2 | 67.2 | 0 | 0 | 0 | 109.7 | | |
| 3 | P | 57.1 | Low | 56.3 | Low | 113 Ų | 113 | 195.5 Ų | 195.5 | 73% | 0.734 | 88% | 0.88 | S | S | * | * | | | trans | -77.7 | 131.8 | -177.1 | 29.8 | -30.7 | 0 | 0 | 0 | 110.8 | R5 | P3-R5 PolarHBondContact O-N 2.99Š|
| 4 | L | 58.5 | Low | 55.5 | Low | 166 Ų | 166 | 186.9 Ų | 186.9 | 87% | 0.869 | 87% | 0.873 | S | S | * | * | | | trans | -60.5 | 113.9 | 170.9 | -105.8 | 74.8 | 0 | 0 | 0 | 109.6 | V6 | L4-V6 PolarHBondContact O-N 3.17Š|
| 5 | R | 59.8 | Low | 54.8 | Low | 222 Ų | 222 | 185.8 Ų | 185.8 | 84% | 0.838 | 87% | 0.868 | S | S | * | * | | | trans | -79.7 | 113.6 | 167.7 | -73.8 | -174.4 | -156.3 | -179.9 | 7.3 | 109.7 | P3 | P3-R5 PolarHBondContact O-N 2.99Š|
| 6 | V | 59.3 | Low | 54.3 | Low | 126 Ų | 126 | 187.8 Ų | 187.8 | 76% | 0.764 | 87% | 0.865 | S | S | * | * | | | trans | -82.8 | 111.8 | 170.5 | -176.2 | 0 | 0 | 0 | 0 | 108.3 | L4 | L4-V6 PolarHBondContact O-N 3.17Š|
| 7 | Y | 56.6 | Low | 54.2 | Low | 211 Ų | 211 | 184.7 Ų | 184.7 | 83% | 0.827 | 86% | 0.856 | S | S | * | * | | | trans | -85.5 | 118.2 | 171.9 | -102.9 | -87.3 | 0 | 0 | 0 | 110.2 | R9 | Y7-R9 PolarHBondContact O-N 2.89Š|
| 8 | T | 53 | Low | 53.9 | Low | 127 Ų | 127 | 181.6 Ų | 181.6 | 78% | 0.779 | 85% | 0.847 | S | S | * | * | | | trans | -82.8 | 112 | 169.9 | 48.6 | 0 | 0 | 0 | 0 | 109.4 | K10 | T8-K10 PolarHBondContact O-N 2.9Š|
| 9 | R | 54.2 | Low | 54 | Low | 246 Ų | 246 | 179.9 Ų | 179.9 | 93% | 0.928 | 84% | 0.843 | S | S | * | * | | | trans | -77.7 | 106.6 | 176.9 | -163 | -179.8 | -171.2 | -155.8 | 2.6 | 109.3 | Y7 K11 | Y7-R9 PolarHBondContact O-N 2.89Å; R9-K11 PolarHBondContact O-N 2.69Å |
| 10 | K | 60.2 | Low | 53.6 | Low | 204 Ų | 204 | 177.4 Ų | 177.4 | 89% | 0.887 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 124.5 | 171.4 | -134 | -169.4 | -176.1 | -174.3 | 0 | 109.4 | T8 R12 | T8-K10 PolarHBondContact O-N 2.9Å; K10-R12 PolarHBondContact O-N 2.87Å |
| 11 | K | 56.8 | Low | 53.5 | Low | 206 Ų | 206 | 174.5 Ų | 174.5 | 90% | 0.896 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 116.6 | 176.3 | -140.8 | -172 | -175.3 | -172 | 0 | 108.2 | R9 | R9-K11 PolarHBondContact O-N 2.69Š|
| 12 | R | 58.1 | Low | 53.3 | Low | 242 Ų | 242 | 169.1 Ų | 169.1 | 91% | 0.913 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 133.3 | 163.3 | -97.4 | -175.7 | -178.6 | 163 | 0.7 | 108.5 | K10 | K10-R12 PolarHBondContact O-N 2.87Š|
| 13 | E | 52.8 | Low | 53.6 | Low | 194 Ų | 194 | 163 Ų | 163 | 91% | 0.907 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 133.6 | 172.1 | -82.2 | 164.4 | 142.1 | 0 | 0 | 110.5 | Q15 | E13-Q15 PolarHBondContact O-N 3.24Š|
| 14 | G | 45.9 | Very low | 53.2 | Low | 75 Ų | 75 | 165.2 Ų | 165.2 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | | | trans | -73.4 | 110.7 | -174.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | R16 | G14-R16 PolarHBondContact O-N 3.16Š|
| 15 | Q | 44.9 | Very low | 52.8 | Low | 171 Ų | 171 | 165.1 Ų | 165.1 | 80% | 0.799 | 81% | 0.814 | S | S | * | * | | | trans | -71.9 | 111.3 | 161.2 | -162.5 | 164.4 | 19.2 | 0 | 0 | 107.8 | E13 L17 | E13-Q15 PolarHBondContact O-N 3.24Å; Q15-L17 PolarHBondContact O-N 3.32Å |
| 16 | R | 47.1 | Very low | 51.9 | Low | 217 Ų | 217 | 158.1 Ų | 158.1 | 82% | 0.819 | 81% | 0.811 | S | S | * | * | | | trans | -68.2 | 95.6 | 177.9 | -66.8 | 172.8 | 77.9 | 164.1 | 2.8 | 108.9 | G14 N18 | G14-R16 PolarHBondContact O-N 3.16Å; R16-N18 PolarHBondContact O-N 3.4Å |
| 17 | L | 51.8 | Low | 51.3 | Low | 136 Ų | 136 | 157.4 Ų | 157.4 | 71% | 0.712 | 81% | 0.812 | S | S | * | * | | | trans | -87 | 80 | 168.1 | -64.1 | 175.5 | 0 | 0 | 0 | 108.8 | Q15 L19 | Q15-L17 PolarHBondContact O-N 3.32Å; L17-L19 PolarHBondContact O-N 3.14Å |
| 18 | N | 50 | Low | 51.1 | Low | 129 Ų | 129 | 153.4 Ų | 153.4 | 69% | 0.69 | 81% | 0.812 | S | S | * | * | | | trans | -87.6 | 86.3 | 160.8 | -73.2 | -36.9 | 0 | 0 | 0 | 107.2 | R16 | R16-N18 PolarHBondContact O-N 3.4Š|
| 19 | L | 54.3 | Low | 50.8 | Low | 150 Ų | 150 | 151.9 Ų | 151.9 | 79% | 0.785 | 81% | 0.812 | S | S | * | * | | | trans | -115.7 | 97.5 | 166.3 | -66.9 | 178.1 | 0 | 0 | 0 | 107.6 | L17 | L17-L19 PolarHBondContact O-N 3.14Š|
| 20 | T | 45.8 | Very low | 50.3 | Low | 128 Ų | 128 | 150.7 Ų | 150.7 | 79% | 0.785 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 123.3 | 164.2 | -54.2 | 0 | 0 | 0 | 0 | 107.4 | T22 | T20-T22 PolarHBondContact O-N 2.92Š|
| 21 | P | 51.6 | Low | 49.6 | Very low | 117 Ų | 117 | 145.6 Ų | 145.6 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 116.3 | 172.9 | 28.7 | -28.6 | 0 | 0 | 0 | 109 | | |
| 22 | T | 54.8 | Low | 49 | Very low | 126 Ų | 126 | 145 Ų | 145 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 127.8 | 167.6 | -51.4 | 0 | 0 | 0 | 0 | 108.4 | T20 D24 | T20-T22 PolarHBondContact O-N 2.92Å; T22-D24 PolarHBondContact O-N 3.24Å |
| 23 | P | 53.2 | Low | 48 | Very low | 116 Ų | 116 | 137.8 Ų | 137.8 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 117.4 | 172.7 | 27.6 | -29 | 0 | 0 | 0 | 109.2 | | |
| 24 | D | 47.3 | Very low | 48.3 | Very low | 160 Ų | 160 | 134.2 Ų | 134.2 | 86% | 0.856 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 131.6 | 176.4 | -162.1 | 10.5 | 0 | 0 | 0 | 110.5 | T22 G26 | T22-D24 PolarHBondContact O-N 3.24Å; D24-G26 PolarHBondContact O-N 3.37Å |
| 25 | L | 50.9 | Low | 48 | Very low | 164 Ų | 164 | 136.9 Ų | 136.9 | 86% | 0.859 | 80% | 0.8 | S | S | * | * | | | trans | -83.4 | 93.7 | 179.3 | -80.1 | 165.1 | 0 | 0 | 0 | 108.1 | S27 | L25-S27 PolarHBondContact O-N 3.02Š|
| 26 | G | 41.9 | Very low | 47.8 | Very low | 75 Ų | 75 | 132.4 Ų | 132.4 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | | | trans | -54.6 | 122.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | D24 | D24-G26 PolarHBondContact O-N 3.37Š|
| 27 | S | 45.8 | Very low | 47.8 | Very low | 111 Ų | 111 | 128.1 Ų | 128.1 | 78% | 0.776 | 80% | 0.803 | S | S | * | * | | | trans | -66.2 | 142.2 | 172.1 | 52.1 | 0 | 0 | 0 | 0 | 110.9 | L25 A29 | L25-S27 PolarHBondContact O-N 3.02Å; S27-A29 PolarHBondContact O-N 2.93Å |
| 28 | P | 52.7 | Low | 47.5 | Very low | 127 Ų | 127 | 131.5 Ų | 131.5 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | | | trans | -79 | 115.5 | 179.8 | 30.3 | -30.1 | 0 | 0 | 0 | 109.7 | K30 | P28-K30 PolarHBondContact O-N 3.13Š|
| 29 | A | 45.6 | Very low | 47.5 | Very low | 96 Ų | 96 | 137.1 Ų | 137.1 | 79% | 0.793 | 82% | 0.824 | S | S | * | * | | | trans | -60.9 | 124.7 | 165.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | S27 A31 | S27-A29 PolarHBondContact O-N 2.93Å; A29-A31 PolarHBondContact O-N 3.17Å; A29-A31 VanDerWaalsContact O-N 3.13Å |
| 30 | K | 44.4 | Very low | 47.2 | Very low | 220 Ų | 220 | 140.6 Ų | 140.6 | 96% | 0.957 | 83% | 0.832 | S | S | * | * | | | trans | -54.2 | 111.9 | 166.2 | -93.4 | 177.4 | 169.8 | 176.7 | 0 | 108.9 | P28 | P28-K30 PolarHBondContact O-N 3.13Š|
| 31 | A | 46.3 | Very low | 47.4 | Very low | 97 Ų | 97 | 137.9 Ų | 137.9 | 80% | 0.802 | 83% | 0.829 | S | S | * | * | | | trans | -126.8 | 123 | 157.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | A29 | A29-A31 PolarHBondContact O-N 3.17Å; A29-A31 VanDerWaalsContact O-N 3.13Å |
| 32 | E | 43 | Very low | 47.3 | Very low | 193 Ų | 193 | 140.8 Ų | 140.8 | 90% | 0.902 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 133.7 | -177.8 | -169.2 | 176.9 | 165.6 | 0 | 0 | 111.7 | | |
| 33 | A | 38.7 | Very low | 47.3 | Very low | 92 Ų | 92 | 141.3 Ų | 141.3 | 76% | 0.76 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -91 | 141.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | | |
| 34 | P | 57.2 | Low | 47.4 | Very low | 118 Ų | 118 | 142.6 Ų | 142.6 | 77% | 0.766 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -91 | 148.7 | 153.7 | 32.7 | -25.7 | 0 | 0 | 0 | 110.6 | | |
| 35 | P | 41.2 | Very low | 47.7 | Very low | 131 Ų | 131 | 138.4 Ų | 138.4 | 85% | 0.851 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -89.2 | 146.1 | -161.9 | 34.4 | -33.8 | 0 | 0 | 0 | 113.7 | | |
| 36 | G | 40.1 | Very low | 48.1 | Very low | 77 Ų | 77 | 139 Ų | 139 | 79% | 0.794 | 83% | 0.827 | S | S | * | * | | | trans | 91.9 | 105.7 | 141.1 | 0 | 0 | 0 | 0 | 0 | 117.8 | | |
| 37 | S | 47 | Very low | 48.6 | Very low | 127 Ų | 127 | 140.8 Ų | 140.8 | 89% | 0.888 | 83% | 0.827 | S | S | * | * | | | | -166.9 | 132.9 | 122.9 | 49.2 | 0 | 0 | 0 | 0 | 111.1 | | |
| 38 | K | 46.4 | Very low | 49.8 | Very low | 208 Ų | 208 | 145.5 Ų | 145.5 | 90% | 0.904 | 83% | 0.833 | S | S | * | * | | | trans | -68.2 | 131.3 | -178.7 | -66.2 | 170 | 175.7 | 172.1 | 0 | 110.6 | | |
| 39 | R | 49 | Very low | 50.3 | Low | 247 Ų | 247 | 147.5 Ų | 147.5 | 93% | 0.932 | 84% | 0.835 | S | S | * | * | | | trans | -152.7 | 104.9 | 143.9 | -111.4 | 171.9 | -176.2 | -179.9 | 1.2 | 110.5 | G41 | R39-G41 PolarHBondContact O-N 3.06Š|
| 40 | K | 48.7 | Very low | 51.5 | Low | 223 Ų | 223 | 146.3 Ų | 146.3 | 97% | 0.97 | 83% | 0.826 | S | S | * | * | | | trans | -66 | 116.3 | 166.8 | -93.4 | -173.8 | 172.9 | -178.2 | 0 | 108.5 | | |
| 41 | G | 50.3 | Low | 52.5 | Low | 70 Ų | 70 | 145.1 Ų | 145.1 | 72% | 0.722 | 82% | 0.823 | S | S | * | * | | | trans | -127.9 | 109.1 | 167.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | R39 | R39-G41 PolarHBondContact O-N 3.06Š|
| 42 | K | 49.7 | Very low | 53.7 | Low | 179 Ų | 179 | 149.1 Ų | 149.1 | 78% | 0.778 | 82% | 0.823 | S | S | * | * | | | trans | -80.6 | 111.8 | -179.5 | -174 | 165 | -179.5 | 176.7 | 0 | 108.5 | H44 | K42-H44 WeakPolarHBondContact CE-NE2 3.01Š|
| 43 | V | 54.9 | Low | 54.7 | Low | 136 Ų | 136 | 144.8 Ų | 144.8 | 82% | 0.824 | 82% | 0.82 | S | S | * | * | | | trans | -113 | 112 | 170.7 | -173.6 | 0 | 0 | 0 | 0 | 107.9 | G45 | V43-G45 PolarHBondContact O-N 2.72Š|
| 44 | H | 54.6 | Low | 55.4 | Low | 143 Ų | 143 | 149.7 Ų | 149.7 | 66% | 0.662 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 116.2 | 175.2 | -71.2 | -91.2 | 0 | 0 | 0 | 109 | K42 L46 | K42-H44 WeakPolarHBondContact CE-NE2 3.01Å; H44-L46 PolarHBondContact O-N 3.02Å |
| 45 | G | 54.5 | Low | 55.1 | Low | 73 Ų | 73 | 155.1 Ų | 155.1 | 75% | 0.753 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 123.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | V43 | V43-G45 PolarHBondContact O-N 2.72Š|
| 46 | L | 57.4 | Low | 55.2 | Low | 177 Ų | 177 | 154.6 Ų | 154.6 | 93% | 0.927 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 134.3 | -180 | -69 | 170.8 | 0 | 0 | 0 | 111.2 | H44 | H44-L46 PolarHBondContact O-N 3.02Š|
| 47 | S | 54.2 | Low | 55.9 | Low | 111 Ų | 111 | 162.2 Ų | 162.2 | 78% | 0.776 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 142.9 | -179 | -49.9 | 0 | 0 | 0 | 0 | 112.1 | I49 | S47-I49 PolarHBondContact O-N 2.94Š|
| 48 | K | 69.5 | Low | 56 | Low | 210 Ų | 210 | 165.9 Ų | 165.9 | 91% | 0.913 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 117.7 | 177.8 | -148.8 | 171.9 | -172.7 | 178.5 | 0 | 110.3 | | |
| 49 | I | 64.4 | Low | 56 | Low | 169 Ų | 169 | 159.6 Ų | 159.6 | 87% | 0.867 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 127.6 | 176.1 | -51.5 | 170.4 | 0 | 0 | 0 | 108.3 | S47 | S47-I49 PolarHBondContact O-N 2.94Š|
| 50 | A | 69.4 | Low | 55.6 | Low | 72 Ų | 72 | 151.6 Ų | 151.6 | 60% | 0.595 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -99.6 | 118.9 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110 | | |
| 51 | E | 65.9 | Low | 55.4 | Low | 194 Ų | 194 | 147.4 Ų | 147.4 | 91% | 0.907 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 128.6 | 174.5 | -172.4 | -178.1 | 174 | 0 | 0 | 110.8 | | |
| 52 | K | 71.2 | Confident | 55 | Low | 181 Ų | 181 | 147.4 Ų | 147.4 | 79% | 0.787 | 83% | 0.827 | S | S | * | * | | | trans | -107.9 | 121.1 | 175.4 | -59.6 | -67.4 | -179.7 | 178.5 | 0 | 108.7 | E54 | K52-E54 PolarHBondContact O-N 2.97Š|
| 53 | A | 65.5 | Low | 54.9 | Low | 102 Ų | 102 | 144.9 Ų | 144.9 | 84% | 0.843 | 83% | 0.831 | S | S | * | * | | | trans | -63.3 | 128.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | R55 | A53-R55 PolarHBondContact O-N 2.83Š|
| 54 | E | 52.9 | Low | 54.5 | Low | 195 Ų | 195 | 141.6 Ų | 141.6 | 91% | 0.911 | 83% | 0.825 | S | S | * | * | | | trans | -73.3 | 117.4 | 178.3 | -159.8 | 173.7 | -172.4 | 0 | 0 | 110.1 | K52 | K52-E54 PolarHBondContact O-N 2.97Š|
| 55 | R | 49.9 | Very low | 53.9 | Low | 233 Ų | 233 | 140.8 Ų | 140.8 | 88% | 0.879 | 83% | 0.833 | S | S | * | * | | | trans | -81.1 | 114.8 | 171.3 | -109.5 | -179.3 | 167.5 | 144.9 | -3.6 | 108.3 | A53 R57 | A53-R55 PolarHBondContact O-N 2.83Å; R55-R57 PolarHBondContact O-N 3.48Å |
| 56 | S | 43.7 | Very low | 53.4 | Low | 119 Ų | 119 | 147.4 Ų | 147.4 | 83% | 0.832 | 84% | 0.841 | S | S | * | * | | | trans | -60.7 | 124.6 | 166.8 | 50 | 0 | 0 | 0 | 0 | 110.5 | | |
| 57 | R | 55.5 | Low | 52.7 | Low | 238 Ų | 238 | 144.5 Ų | 144.5 | 90% | 0.898 | 84% | 0.836 | S | S | * | * | | | trans | -118.3 | 109 | 158.4 | -78 | -163.9 | -174.5 | -121.4 | 5.6 | 108.9 | R55 | R55-R57 PolarHBondContact O-N 3.48Š|
| 58 | Q | 49 | Very low | 52.1 | Low | 204 Ų | 204 | 145 Ų | 145 | 95% | 0.953 | 84% | 0.836 | S | S | * | * | | | trans | -67.2 | 130.4 | 163.2 | -178.7 | 173 | -11.5 | 0 | 0 | 109 | | |
| 59 | G | 45.5 | Very low | 51 | Low | 76 Ų | 76 | 146.8 Ų | 146.8 | 78% | 0.784 | 84% | 0.837 | S | S | * | * | | | trans | 140.1 | 113.4 | 158.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | | |
| 60 | G | 42.1 | Very low | 50 | Low | 79 Ų | 79 | 146.9 Ų | 146.9 | 81% | 0.814 | 84% | 0.838 | S | S | * | * | | | trans | 103.2 | 103.3 | 131.9 | 0 | 0 | 0 | 0 | 0 | 118 | | |
| 61 | S | 43.2 | Very low | 48.9 | Very low | 135 Ų | 135 | 147.1 Ų | 147.1 | 94% | 0.944 | 85% | 0.848 | S | S | * | * | | | trans | 8.1 | 139 | 144.5 | -68.1 | 0 | 0 | 0 | 0 | 121 | | |
| 62 | G | 42.6 | Very low | 47.7 | Very low | 69 Ų | 69 | 144.2 Ų | 144.2 | 71% | 0.711 | 84% | 0.843 | S | S | * | * | | | trans | 141.4 | 94.9 | 138.9 | 0 | 0 | 0 | 0 | 0 | 116.5 | | |
| 63 | S | 47.3 | Very low | 46.8 | Very low | 126 Ų | 126 | 142.1 Ų | 142.1 | 88% | 0.881 | 85% | 0.846 | S | S | * | * | | | trans | 13.2 | 131.6 | 146.9 | 57.2 | 0 | 0 | 0 | 0 | 121.9 | | |
| 64 | G | 46.8 | Very low | 45.6 | Very low | 67 Ų | 67 | 140.3 Ų | 140.3 | 69% | 0.691 | 84% | 0.837 | S | S | * | * | | | trans | 119.6 | 125.5 | 138.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | | |
| 65 | P | 40.7 | Very low | 45.4 | Very low | 126 Ų | 126 | 140.3 Ų | 140.3 | 82% | 0.818 | 84% | 0.837 | S | S | * | * | | | trans | -92.6 | 138 | 178.4 | 35.2 | -28.5 | 0 | 0 | 0 | 111.9 | | |
| 66 | F | 44.6 | Very low | 45.2 | Very low | 213 Ų | 213 | 138.6 Ų | 138.6 | 93% | 0.934 | 84% | 0.836 | S | S | * | * | | | trans | -132.2 | 138 | 163 | -76.7 | -76 | 0 | 0 | 0 | 111.2 | | |
| 67 | S | 43.5 | Very low | 45.3 | Very low | 116 Ų | 116 | 139 Ų | 139 | 81% | 0.811 | 84% | 0.839 | S | S | * | * | | | trans | -70.7 | 158.5 | -174.8 | -156.5 | 0 | 0 | 0 | 0 | 113.5 | | |
| 68 | P | 41.4 | Very low | 44.7 | Very low | 120 Ų | 120 | 136.2 Ų | 136.2 | 78% | 0.779 | 84% | 0.841 | S | S | * | * | | | trans | -89 | 146.1 | -170.9 | 35 | -30.2 | 0 | 0 | 0 | 113.1 | | |
| 69 | R | 45.9 | Very low | 44.6 | Very low | 249 Ų | 249 | 135.2 Ų | 135.2 | 94% | 0.94 | 84% | 0.836 | S | S | * | * | | | trans | -131.3 | 131.1 | 168.9 | -113.7 | -179.3 | 179.8 | -108.3 | 1.5 | 110.6 | | |
| 70 | L | 43.3 | Very low | 44.4 | Very low | 170 Ų | 170 | 139.2 Ų | 139.2 | 89% | 0.89 | 83% | 0.834 | S | S | * | * | | | trans | -50.9 | 146.1 | 174.7 | -86.6 | 81.9 | 0 | 0 | 0 | 113.7 | | |
| 71 | G | 47.4 | Very low | 45 | Very low | 78 Ų | 78 | 142.8 Ų | 142.8 | 80% | 0.804 | 84% | 0.835 | S | S | * | * | | | trans | -148.7 | 110.8 | 156.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | | |
| 72 | V | 40.8 | Very low | 45.1 | Very low | 132 Ų | 132 | 147.7 Ų | 147.7 | 80% | 0.8 | 83% | 0.833 | S | S | * | * | | | trans | -101.6 | 126.1 | 170.9 | 173.4 | 0 | 0 | 0 | 0 | 107.4 | | |
| 73 | T | 51.8 | Low | 45.4 | Very low | 138 Ų | 138 | 149.5 Ų | 149.5 | 85% | 0.847 | 84% | 0.835 | S | S | * | * | | | trans | -155.9 | 114.4 | 165.9 | -47.9 | 0 | 0 | 0 | 0 | 107.5 | | |
| 74 | G | 40.1 | Very low | 45.5 | Very low | 64 Ų | 64 | 148.3 Ų | 148.3 | 66% | 0.66 | 83% | 0.826 | S | S | * | * | | | | 78.9 | 131.9 | 117.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 75 | E | 49.6 | Very low | 45.5 | Very low | 195 Ų | 195 | 153.5 Ų | 153.5 | 91% | 0.911 | 83% | 0.832 | S | S | * | * | | | cis | -170.7 | 177.2 | 48.1 | -73.8 | 174.3 | 142.1 | 0 | 0 | 109.5 | | |
| 76 | K | 44.8 | Very low | 45.9 | Very low | 197 Ų | 197 | 155.3 Ų | 155.3 | 86% | 0.857 | 84% | 0.835 | S | S | * | * | | | trans | -130.9 | 138.1 | -154.4 | 9.6 | 165.5 | 174.3 | 163.1 | 0 | 108.4 | | |
| 77 | S | 45.4 | Very low | 45.7 | Very low | 128 Ų | 128 | 150.5 Ų | 150.5 | 90% | 0.895 | 82% | 0.824 | S | S | * | * | | | trans | 169 | 135.3 | 133 | 47.3 | 0 | 0 | 0 | 0 | 112.6 | | |
| 78 | L | 43.3 | Very low | 45.8 | Very low | 179 Ų | 179 | 153 Ų | 153 | 94% | 0.937 | 82% | 0.823 | S | S | * | * | | | trans | -86 | 141 | 168.5 | -83.4 | 160.6 | 0 | 0 | 0 | 109 | | |
| 79 | Q | 45.9 | Very low | 46.1 | Very low | 182 Ų | 182 | 153 Ų | 153 | 85% | 0.85 | 82% | 0.816 | S | S | * | * | | | trans | -134.9 | 117 | 161.2 | -167.1 | 168.1 | 5.9 | 0 | 0 | 109.4 | | |
| 80 | E | 42.5 | Very low | 46.3 | Very low | 160 Ų | 160 | 148.9 Ų | 148.9 | 75% | 0.748 | 81% | 0.807 | S | S | * | * | | | trans | -87.7 | 144.8 | 178.1 | -168.5 | 176.9 | -164.9 | 0 | 0 | 109.1 | | |
| 81 | N | 54.3 | Low | 46.4 | Very low | 155 Ų | 155 | 149.8 Ų | 149.8 | 83% | 0.829 | 80% | 0.804 | S | S | * | * | | | trans | -158.2 | 117.3 | 158.9 | -78.8 | -36.8 | 0 | 0 | 0 | 109.6 | | |
| 82 | R | 44.9 | Very low | 46.7 | Very low | 237 Ų | 237 | 152.8 Ų | 152.8 | 89% | 0.894 | 80% | 0.8 | S | S | * | * | | | trans | -99.6 | 151.2 | 167 | -76.4 | -177.4 | 179 | -165 | 0.3 | 110 | | |
| 83 | S | 49 | Very low | 46.6 | Very low | 108 Ų | 108 | 150.2 Ų | 150.2 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | | | trans | -165.1 | 97.7 | 163.8 | 173.4 | 0 | 0 | 0 | 0 | 108 | | |
| 84 | S | 49.7 | Very low | 45.9 | Very low | 100 Ų | 100 | 149 Ų | 149 | 70% | 0.699 | 79% | 0.79 | S | S | * | * | | | | 53.5 | 107.6 | 108.2 | 66.2 | 0 | 0 | 0 | 0 | 114.5 | | |
| 85 | E | 47.8 | Very low | 45.8 | Very low | 176 Ų | 176 | 153.8 Ų | 153.8 | 82% | 0.822 | 80% | 0.8 | S | S | * | * | | | | 77.4 | 108.9 | 85.1 | -173.1 | 155.5 | -151.5 | 0 | 0 | 112.8 | | |
| 86 | D | 49 | Very low | 45.6 | Very low | 164 Ų | 164 | 155.4 Ų | 155.4 | 88% | 0.877 | 80% | 0.797 | S | S | * | * | | | trans | -163.9 | 143.9 | 136.8 | -138.3 | -15.5 | 0 | 0 | 0 | 111.6 | | |
| 87 | T | 39.3 | Very low | 45.4 | Very low | 113 Ų | 113 | 155 Ų | 155 | 69% | 0.693 | 80% | 0.798 | S | S | * | * | | | trans | -121.7 | 130.7 | -169.3 | -46.1 | 0 | 0 | 0 | 0 | 108.3 | | |
| 88 | Q | 45.9 | Very low | 45.7 | Very low | 168 Ų | 168 | 154.1 Ų | 154.1 | 79% | 0.785 | 79% | 0.793 | S | S | * | * | | | trans | -152.8 | 125.5 | 157.2 | -82.1 | -146.3 | -67 | 0 | 0 | 113.2 | | |
| 89 | D | 47.9 | Very low | 45.8 | Very low | 119 Ų | 119 | 151.9 Ų | 151.9 | 64% | 0.636 | 79% | 0.786 | S | S | * | * | | | trans | 58.3 | 117.9 | 130.4 | -59.6 | -23.4 | 0 | 0 | 0 | 120.5 | | |
| 90 | E | 50 | Low | 45.4 | Very low | 163 Ų | 163 | 149.3 Ų | 149.3 | 76% | 0.762 | 78% | 0.783 | S | S | * | * | | | | 102.9 | 103.8 | 61.4 | -166.6 | -173.4 | -169.8 | 0 | 0 | 111.1 | | |
| 91 | K | 45.6 | Very low | 45.6 | Very low | 189 Ų | 189 | 149.9 Ų | 149.9 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | | | trans | 179.1 | 102.6 | 145.7 | -121.3 | 176.6 | 164.6 | -174.3 | 0 | 110.3 | | |
| 92 | I | 52.3 | Low | 45.3 | Very low | 141 Ų | 141 | 149.3 Ų | 149.3 | 72% | 0.723 | 79% | 0.788 | S | S | * | * | | | | 59.1 | 129.1 | 91.8 | -54.2 | 162.8 | 0 | 0 | 0 | 111.5 | | |
| 93 | A | 39.5 | Very low | 45.5 | Very low | 79 Ų | 79 | 146.3 Ų | 146.3 | 65% | 0.653 | 79% | 0.789 | S | S | * | * | | | cis | -164.9 | 142.3 | 14.7 | 0 | 0 | 0 | 0 | 0 | 109 | | |
| 94 | S | 37.7 | Very low | 45.6 | Very low | 112 Ų | 112 | 149 Ų | 149 | 78% | 0.783 | 79% | 0.79 | S | S | * | * | | | | 53.1 | 106.5 | 103.7 | -49.4 | 0 | 0 | 0 | 0 | 116.4 | | |
| 95 | L | 37.7 | Very low | 45.7 | Very low | 164 Ų | 164 | 150.9 Ų | 150.9 | 86% | 0.859 | 80% | 0.796 | S | S | * | * | | | | 89.2 | 149.5 | 89.1 | -163 | 71.7 | 0 | 0 | 0 | 113.4 | | |
| 96 | R | 44.1 | Very low | 45.2 | Very low | 229 Ų | 229 | 149.1 Ų | 149.1 | 86% | 0.864 | 79% | 0.793 | S | S | * | * | | | trans | 101.8 | 100.8 | 172.3 | -49.7 | -160.6 | -165.8 | -138 | -0.9 | 113.5 | | |
| 97 | E | 42 | Very low | 45.2 | Very low | 188 Ų | 188 | 146.6 Ų | 146.6 | 88% | 0.879 | 79% | 0.788 | S | S | * | * | | | | 63.4 | 107.1 | 60.4 | -163.1 | 179.4 | -172.8 | 0 | 0 | 114.1 | | |
| 98 | S | 50.6 | Low | 45.4 | Very low | 111 Ų | 111 | 146.6 Ų | 146.6 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | | | trans | 163.9 | 154.7 | 141.1 | 47.3 | 0 | 0 | 0 | 0 | 108.5 | | |
| 99 | V | 45.2 | Very low | 45.4 | Very low | 132 Ų | 132 | 144 Ų | 144 | 80% | 0.8 | 79% | 0.793 | S | S | * | * | | | cis | -168.6 | 147.6 | -11.5 | 140.1 | 0 | 0 | 0 | 0 | 103.8 | | |
| 100 | T | 39.2 | Very low | 45.3 | Very low | 127 Ų | 127 | 142.7 Ų | 142.7 | 78% | 0.779 | 79% | 0.793 | S | S | * | * | | | trans | -63 | 147.7 | 176.3 | 38.1 | 0 | 0 | 0 | 0 | 114.3 | | |
| 101 | D | 47 | Very low | 45.2 | Very low | 172 Ų | 172 | 141.2 Ų | 141.2 | 92% | 0.92 | 79% | 0.79 | S | S | * | * | | | trans | -127.6 | 122.8 | 157.5 | -120.7 | -8.5 | 0 | 0 | 0 | 109.3 | | |
| 102 | D | 46 | Very low | 45.5 | Very low | 144 Ų | 144 | 137 Ų | 137 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | | | trans | -111.2 | 124.8 | -174.7 | -139.5 | 0.4 | 0 | 0 | 0 | 106.7 | | |
| 103 | L | 51.1 | Low | 45.3 | Very low | 174 Ų | 174 | 138.7 Ų | 138.7 | 91% | 0.911 | 79% | 0.79 | S | S | * | * | | | trans | -143.9 | 98.4 | 163.3 | -83.4 | -179.1 | 0 | 0 | 0 | 110.8 | | |
| 104 | Q | 49.4 | Very low | 45.4 | Very low | 164 Ų | 164 | 142.8 Ų | 142.8 | 77% | 0.766 | 80% | 0.8 | S | S | * | * | | | trans | -53.3 | 144.1 | 153.6 | -77.4 | 179.7 | -17.7 | 0 | 0 | 111.5 | | |
| 105 | V | 52.5 | Low | 45.7 | Very low | 139 Ų | 139 | 143.3 Ų | 143.3 | 84% | 0.842 | 80% | 0.798 | S | S | * | * | | | trans | -149.5 | 106.7 | 133.9 | 177.7 | 0 | 0 | 0 | 0 | 108.6 | | |
| 106 | D | 38.3 | Very low | 46 | Very low | 140 Ų | 140 | 141.2 Ų | 141.2 | 75% | 0.749 | 80% | 0.797 | S | S | * | * | | | trans | -80 | 143.3 | 159.7 | -79.1 | -44.8 | 0 | 0 | 0 | 110 | | |
| 107 | S | 47.7 | Very low | 45.8 | Very low | 111 Ų | 111 | 133.6 Ų | 133.6 | 78% | 0.776 | 79% | 0.789 | S | S | * | * | | | trans | -167.8 | 95.4 | 153.8 | -81.1 | 0 | 0 | 0 | 0 | 112.1 | | |
| 108 | S | 44.1 | Very low | 45.7 | Very low | 113 Ų | 113 | 132.8 Ų | 132.8 | 79% | 0.79 | 79% | 0.79 | S | S | * | * | | | | 41.4 | 124.4 | 120 | -51.9 | 0 | 0 | 0 | 0 | 119.9 | | |
| 109 | S | 46.5 | Very low | 45.2 | Very low | 113 Ų | 113 | 133 Ų | 133 | 79% | 0.79 | 79% | 0.792 | S | S | * | * | | | | 88.6 | 139.5 | 98.2 | 170.7 | 0 | 0 | 0 | 0 | 113 | | |
| 110 | S | 44.7 | Very low | 45.1 | Very low | 91 Ų | 91 | 135.4 Ų | 135.4 | 64% | 0.636 | 80% | 0.799 | S | S | * | * | | | cis | 175.7 | -177.8 | 4.3 | 172.1 | 0 | 0 | 0 | 0 | 107.2 | | |
| 111 | N | 48.5 | Very low | 45.3 | Very low | 132 Ų | 132 | 137.6 Ų | 137.6 | 71% | 0.706 | 80% | 0.8 | S | S | * | * | | | trans | 106.4 | 102.2 | 153 | -50.5 | -13.2 | 0 | 0 | 0 | 115.4 | | |
| 112 | S | 51.2 | Low | 45 | Very low | 101 Ų | 101 | 137.9 Ų | 137.9 | 71% | 0.706 | 80% | 0.796 | S | S | * | * | | | | 85 | 144.8 | 84.9 | 71.2 | 0 | 0 | 0 | 0 | 111.3 | | |
| 113 | E | 48.3 | Very low | 44.7 | Very low | 177 Ų | 177 | 134.8 Ų | 134.8 | 83% | 0.827 | 80% | 0.798 | S | S | * | * | | | cis | -160.1 | 131.4 | 34.5 | -64.2 | 166.5 | 141.8 | 0 | 0 | 107 | | |
| 114 | L | 41.2 | Very low | 44.2 | Very low | 165 Ų | 165 | 135.5 Ų | 135.5 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | | | | 53.6 | 120.8 | 86.6 | -71.3 | -162.3 | 0 | 0 | 0 | 119.1 | | |
| 115 | V | 44.8 | Very low | 43.8 | Very low | 122 Ų | 122 | 131.8 Ų | 131.8 | 74% | 0.739 | 80% | 0.796 | S | S | * | * | | | | 110.8 | 129.3 | 129.4 | 169.7 | 0 | 0 | 0 | 0 | 121.9 | | |
| 116 | S | 44.3 | Very low | 43.2 | Very low | 121 Ų | 121 | 130.4 Ų | 130.4 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | | | trans | 71.3 | 144.6 | 151.7 | -71.6 | 0 | 0 | 0 | 0 | 121 | | |
| 117 | G | 40 | Very low | 43.5 | Very low | 68 Ų | 68 | 128.1 Ų | 128.1 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | | | cis | 170.4 | 147.6 | 4.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 118 | L | 38.9 | Very low | 43.3 | Very low | 171 Ų | 171 | 130.4 Ų | 130.4 | 90% | 0.895 | 79% | 0.79 | S | S | * | * | | | trans | 21.7 | 125.8 | 151.7 | -58.6 | 162.4 | 0 | 0 | 0 | 118.6 | | |
| 119 | S | 40.5 | Very low | 43.4 | Very low | 117 Ų | 117 | 133.1 Ų | 133.1 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | | | | 171.2 | 142.2 | 78.8 | 45.2 | 0 | 0 | 0 | 0 | 109.6 | | |
| 120 | L | 43.2 | Very low | 43 | Very low | 181 Ų | 181 | 132.1 Ų | 132.1 | 95% | 0.948 | 79% | 0.788 | S | S | * | * | | | trans | -117.9 | 114.1 | 169.3 | -173.4 | 61.6 | 0 | 0 | 0 | 109.9 | | |
| 121 | H | 43.9 | Very low | 43.1 | Very low | 173 Ų | 173 | 138.3 Ų | 138.3 | 80% | 0.801 | 80% | 0.799 | S | S | * | * | | | trans | -80 | 147.1 | -175.4 | -176.4 | -87.9 | 0 | 0 | 0 | 112.3 | | |
| 122 | H | 39 | Very low | 42.6 | Very low | 179 Ų | 179 | 136.7 Ų | 136.7 | 83% | 0.829 | 80% | 0.798 | S | S | * | * | | | trans | -56 | 151 | 175 | -70.5 | -51.6 | 0 | 0 | 0 | 114.3 | | |
| 123 | G | 41.2 | Very low | 42.3 | Very low | 79 Ų | 79 | 138.3 Ų | 138.3 | 81% | 0.814 | 80% | 0.803 | S | S | * | * | | | trans | -161.4 | 100.8 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 124 | M | 39.6 | Very low | 42.2 | Very low | 189 Ų | 189 | 135.4 Ų | 135.4 | 93% | 0.931 | 80% | 0.798 | S | S | * | * | | | trans | -68.6 | 171.4 | 179.7 | -60.5 | -174.4 | 84.1 | 0 | 0 | 113.9 | | |
| 125 | A | 41.8 | Very low | 42.4 | Very low | 86 Ų | 86 | 134.4 Ų | 134.4 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | | | trans | 119.9 | 107.4 | 146.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 126 | S | 39.4 | Very low | 42.3 | Very low | 110 Ų | 110 | 133.1 Ų | 133.1 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | | | | 103.2 | 139.5 | 92.5 | 63.7 | 0 | 0 | 0 | 0 | 108.5 | | |
| 127 | S | 44.4 | Very low | 42.2 | Very low | 92 Ų | 92 | 138.4 Ų | 138.4 | 64% | 0.643 | 79% | 0.793 | S | S | * | * | | | cis | 178.7 | 150.8 | 5.3 | 41.4 | 0 | 0 | 0 | 0 | 106.3 | | |
| 128 | L | 43.7 | Very low | 42.8 | Very low | 159 Ų | 159 | 138.8 Ų | 138.8 | 83% | 0.832 | 79% | 0.789 | S | S | * | * | | | trans | 63.3 | 114.2 | 147.6 | -62.8 | 156.8 | 0 | 0 | 0 | 118.3 | | |
| 129 | L | 45.3 | Very low | 42.7 | Very low | 169 Ų | 169 | 139.1 Ų | 139.1 | 89% | 0.885 | 79% | 0.786 | S | S | * | * | | | | -164.2 | 121.6 | 109.4 | -155.5 | 58.1 | 0 | 0 | 0 | 111.8 | | |
| 130 | S | 38.1 | Very low | 43.2 | Very low | 92 Ų | 92 | 144 Ų | 144 | 64% | 0.643 | 79% | 0.788 | S | S | * | * | | | trans | -73.5 | 145.5 | 172.3 | 52.5 | 0 | 0 | 0 | 0 | 112.9 | | |
| 131 | Y | 46.9 | Very low | 43.5 | Very low | 222 Ų | 222 | 144.6 Ų | 144.6 | 87% | 0.871 | 78% | 0.783 | S | S | * | * | | | trans | -157.5 | 125.4 | 130.9 | -143.7 | -102.5 | 0 | 0 | 0 | 111.2 | V133 | Y131-V133 HydrophobicContact CE1-CG2 4.35Š|
| 132 | S | 38.2 | Very low | 43.7 | Very low | 97 Ų | 97 | 141.3 Ų | 141.3 | 68% | 0.678 | 78% | 0.779 | S | S | * | * | | | trans | -97.7 | 142.9 | 178.5 | 9.6 | 0 | 0 | 0 | 0 | 109.7 | | |
| 133 | V | 46.2 | Very low | 44.5 | Very low | 135 Ų | 135 | 140.7 Ų | 140.7 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | | | trans | -148.1 | 120.9 | 144.3 | -178.9 | 0 | 0 | 0 | 0 | 108.7 | Y131 | Y131-V133 HydrophobicContact CE1-CG2 4.35Š|
| 134 | T | 46.1 | Very low | 44.7 | Very low | 116 Ų | 116 | 145.8 Ų | 145.8 | 71% | 0.712 | 78% | 0.778 | S | S | * | * | | | trans | -72.3 | 144.8 | 176 | -42.5 | 0 | 0 | 0 | 0 | 111.4 | | |
| 135 | D | 45.1 | Very low | 45.2 | Very low | 144 Ų | 144 | 142.7 Ų | 142.7 | 77% | 0.77 | 76% | 0.761 | S | S | * | * | | | | -165.5 | 132.3 | 117.9 | -125.6 | -29 | 0 | 0 | 0 | 114.4 | | |
| 136 | S | 43.3 | Very low | 46.2 | Very low | 96 Ų | 96 | 143.6 Ų | 143.6 | 67% | 0.671 | 76% | 0.762 | S | S | * | * | | | trans | 11.7 | 151.6 | 149.5 | 49.4 | 0 | 0 | 0 | 0 | 121.2 | | |
| 137 | Y | 41.7 | Very low | 46.9 | Very low | 232 Ų | 232 | 145.7 Ų | 145.7 | 91% | 0.91 | 76% | 0.757 | S | S | * | * | | | cis | -174.9 | 168.7 | 6.2 | 172.6 | -100 | 0 | 0 | 0 | 107.4 | | |
| 138 | A | 53.3 | Low | 48.1 | Very low | 75 Ų | 75 | 146.4 Ų | 146.4 | 62% | 0.62 | 76% | 0.76 | S | S | * | * | | | trans | 95.5 | 93.1 | 171.7 | 0 | 0 | 0 | 0 | 0 | 117.4 | Y140 | A138-Y140 PolarHBondContact O-N 3.36Š|
| 139 | E | 36 | Very low | 48.7 | Very low | 179 Ų | 179 | 143 Ų | 143 | 84% | 0.836 | 75% | 0.749 | S | S | * | * | | | trans | -49.8 | 111.4 | 163.8 | -173.2 | 176.5 | -174.3 | 0 | 0 | 112.3 | | |
| 140 | Y | 51.5 | Low | 49.8 | Very low | 220 Ų | 220 | 140.3 Ų | 140.3 | 86% | 0.863 | 74% | 0.742 | S | S | * | * | | | trans | -117.8 | 117 | 161.3 | -116.7 | -96.1 | 0 | 0 | 0 | 107.6 | A138 S142 | A138-Y140 PolarHBondContact O-N 3.36Å; Y140-S142 VanDerWaalsContact C-N 3.35Å; Y140-S142 PolarHBondContact O-N 3.36Å |
| 141 | K | 48 | Very low | 50.8 | Low | 192 Ų | 192 | 144.3 Ų | 144.3 | 84% | 0.835 | 75% | 0.75 | S | S | * | * | | | trans | -58.4 | 93 | 175 | -71.2 | -179.6 | 174.7 | -172.4 | 0 | 109.5 | F143 | K141-F143 PolarHBondContact O-N 2.99Š|
| 142 | S | 48 | Very low | 51.3 | Low | 104 Ų | 104 | 138.8 Ų | 138.8 | 73% | 0.727 | 74% | 0.736 | S | S | * | * | | | trans | -80.6 | 114.9 | 167.6 | 61.4 | 0 | 0 | 0 | 0 | 108.2 | Y140 E144 | Y140-S142 VanDerWaalsContact C-N 3.35Å; Y140-S142 PolarHBondContact O-N 3.36Å; S142-E144 PolarHBondContact O-N 3.47Å |
| 143 | F | 55.8 | Low | 52.1 | Low | 166 Ų | 166 | 142.7 Ų | 142.7 | 73% | 0.728 | 74% | 0.74 | S | S | * | * | | | trans | -53.4 | 127.1 | 163.5 | 53.3 | -85.4 | 0 | 0 | 0 | 108.1 | K141 E145 | K141-F143 PolarHBondContact O-N 2.99Å; F143-E145 VanDerWaalsContact C-N 3.25Å; F143-E145 HydrophobicContact CD2-CB 4.1Å; F143-E145 HydrophobicContact CE2-CB 4.16Å; F143-E145 PolarHBondContact O-N 3.06Å |
| 144 | E | 46.6 | Very low | 53 | Low | 187 Ų | 187 | 147.6 Ų | 147.6 | 87% | 0.874 | 74% | 0.744 | S | S | * | * | | | trans | -75.1 | 77.5 | -173.9 | -163.4 | 168.9 | -171.3 | 0 | 0 | 108.9 | S142 S146 | S142-E144 PolarHBondContact O-N 3.47Å; E144-S146 PolarHBondContact O-N 3.13Å |
| 145 | E | 49.3 | Very low | 53.2 | Low | 124 Ų | 124 | 149.4 Ų | 149.4 | 58% | 0.579 | 74% | 0.742 | S | S | * | * | | | trans | -79.9 | 78.1 | 171.6 | -149.8 | 168.1 | -152.6 | 0 | 0 | 108.3 | F143 F147 | F143-E145 VanDerWaalsContact C-N 3.25Å; F143-E145 HydrophobicContact CD2-CB 4.1Å; F143-E145 HydrophobicContact CE2-CB 4.16Å; F143-E145 PolarHBondContact O-N 3.06Å; E145-F147 HydrophobicContact CB-CE2 4.14Å; E145-F147 HydrophobicContact CB-CZ 4.44Å; E145-F147 HydrophobicContact CG-CE1 4.38Å; E145-F147 HydrophobicContact CG-CE2 4.01Å; E145-F147 HydrophobicContact CG-CZ 3.83Å; E145-F147 VanDerWaalsContact O-CD2 3.29Å; E145-F147 WeakPolarHBondContact O-CD2 3.48Å; E145-F147 PolarHBondContact O-N 2.75Å |
| 146 | S | 63.2 | Low | 53.6 | Low | 105 Ų | 105 | 148 Ų | 148 | 73% | 0.734 | 74% | 0.743 | S | S | * | * | | | trans | -71.6 | 90.5 | 177.3 | -157.6 | 0 | 0 | 0 | 0 | 108.9 | E144 | E144-S146 PolarHBondContact O-N 3.13Š|
| 147 | F | 54.3 | Low | 54 | Low | 153 Ų | 153 | 149.3 Ų | 149.3 | 67% | 0.671 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 123.1 | 173.5 | -68.4 | -79.3 | 0 | 0 | 0 | 109.3 | E145 S149 | E145-F147 HydrophobicContact CB-CE2 4.14Å; E145-F147 HydrophobicContact CB-CZ 4.44Å; E145-F147 HydrophobicContact CG-CE1 4.38Å; E145-F147 HydrophobicContact CG-CE2 4.01Å; E145-F147 HydrophobicContact CG-CZ 3.83Å; E145-F147 VanDerWaalsContact O-CD2 3.29Å; E145-F147 WeakPolarHBondContact O-CD2 3.48Å; E145-F147 PolarHBondContact O-N 2.75Å; F147-S149 PolarHBondContact O-N 3.2Å |
| 148 | P | 69.3 | Low | 54.7 | Low | 107 Ų | 107 | 147.3 Ų | 147.3 | 70% | 0.695 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 124.6 | 175.9 | 26.2 | -31.3 | 0 | 0 | 0 | 108.7 | | |
| 149 | S | 56.5 | Low | 54.9 | Low | 87 Ų | 87 | 150.9 Ų | 150.9 | 61% | 0.608 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -49 | 137.1 | 174.9 | -68.9 | 0 | 0 | 0 | 0 | 110.8 | F147 E151 | F147-S149 PolarHBondContact O-N 3.2Å; S149-E151 PolarHBondContact O-N 2.88Å |
| 150 | P | 67.6 | Low | 56 | Low | 113 Ų | 113 | 149.7 Ų | 149.7 | 73% | 0.734 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -68.9 | 10.4 | -172.7 | 28.3 | -35.7 | 0 | 0 | 0 | 114.7 | | |
| 151 | E | 59.9 | Low | 56.3 | Low | 176 Ų | 176 | 150.1 Ų | 150.1 | 82% | 0.822 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -88.7 | -0.3 | -176.5 | -85.9 | -169.7 | 140.8 | 0 | 0 | 114.7 | S149 F153 | S149-E151 PolarHBondContact O-N 2.88Å; E151-F153 VanDerWaalsContact C-N 3.33Å; E151-F153 PolarHBondContact O-N 3.25Å |
| 152 | L | 57.1 | Low | 57 | Low | 107 Ų | 107 | 149.5 Ų | 149.5 | 56% | 0.56 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -79.3 | -2.3 | -176.3 | -91.3 | 158.4 | 0 | 0 | 0 | 115.9 | R154 | L152-R154 PolarHBondContact O-N 3Å; L152-R154 VanDerWaalsContact O-N 3.12Å |
| 153 | F | 55.9 | Low | 57.5 | Low | 178 Ų | 178 | 149.6 Ų | 149.6 | 78% | 0.781 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -78.8 | 12.5 | -179.6 | -63.9 | -75.8 | 0 | 0 | 0 | 115.2 | E151 | E151-F153 VanDerWaalsContact C-N 3.33Å; E151-F153 PolarHBondContact O-N 3.25Å |
| 154 | R | 64.8 | Low | 57.6 | Low | 239 Ų | 239 | 147.3 Ų | 147.3 | 90% | 0.902 | 74% | 0.744 | S | S | * | * | G | 310 helix | trans | -117.2 | 3.7 | -179.7 | -69.9 | -165.6 | -178.4 | -103.3 | 0.9 | 115.2 | L152 | L152-R154 PolarHBondContact O-N 3Å; L152-R154 VanDerWaalsContact O-N 3.12Å |
| 155 | K | 51 | Low | 57.8 | Low | 153 Ų | 153 | 145.8 Ų | 145.8 | 67% | 0.665 | 74% | 0.742 | S | S | * | * | | | trans | -99 | 127 | 173.2 | -82.5 | -177.5 | 174.7 | -179.5 | 0 | 110.8 | D157 | K155-D157 VanDerWaalsContact C-N 3.27Å; K155-D157 PolarHBondContact O-N 3.48Å; K155-D157 VanDerWaalsContact O-N 3.17Å |
| 156 | S | 52.2 | Low | 58.2 | Low | 114 Ų | 114 | 145.5 Ų | 145.5 | 80% | 0.797 | 74% | 0.744 | S | S | * | * | | | trans | -81.8 | 30.4 | -164.5 | 47.6 | 0 | 0 | 0 | 0 | 115 | | |
| 157 | D | 51.5 | Low | 58 | Low | 125 Ų | 125 | 148 Ų | 148 | 67% | 0.668 | 74% | 0.744 | S | S | * | * | | | trans | -121.7 | 44 | -164.6 | -52.2 | -21.7 | 0 | 0 | 0 | 112.1 | K155 | K155-D157 VanDerWaalsContact C-N 3.27Å; K155-D157 PolarHBondContact O-N 3.48Å; K155-D157 VanDerWaalsContact O-N 3.17Å |
| 158 | Y | 57.1 | Low | 58.3 | Low | 190 Ų | 190 | 149.2 Ų | 149.2 | 75% | 0.745 | 75% | 0.752 | S | S | * | * | | | trans | -91.8 | 101.3 | 168.9 | -75.8 | -86.7 | 0 | 0 | 0 | 109.4 | D160 | Y158-D160 PolarHBondContact O-N 3.11Š|
| 159 | L | 57.8 | Low | 57.7 | Low | 149 Ų | 149 | 147.2 Ų | 147.2 | 78% | 0.78 | 73% | 0.733 | S | S | * | * | | | trans | -33.4 | 120 | 159.6 | -99.2 | 64.1 | 0 | 0 | 0 | 111.6 | W161 | L159-W161 PolarHBondContact O-N 3.07Š|
| 160 | D | 57.7 | Low | 57.7 | Low | 155 Ų | 155 | 150.6 Ų | 150.6 | 83% | 0.829 | 74% | 0.741 | S | S | * | * | | | | 36.4 | 57 | 123.2 | -133.7 | 16 | 0 | 0 | 0 | 116.6 | Y158 E162 | Y158-D160 PolarHBondContact O-N 3.11Å; D160-E162 VanDerWaalsContact C-N 3.33Å; D160-E162 PolarHBondContact O-N 3.4Å |
| 161 | W | 59.4 | Low | 57.3 | Low | 228 Ų | 228 | 154 Ų | 154 | 86% | 0.864 | 75% | 0.747 | S | S | * | * | | | trans | -81.1 | 89.7 | 158.7 | -82.5 | 116.5 | 0 | 0 | 0 | 108.3 | L159 C163 | L159-W161 PolarHBondContact O-N 3.07Å; W161-C163 PolarHBondContact O-N 3.21Å |
| 162 | E | 63 | Low | 57.1 | Low | 180 Ų | 180 | 154 Ų | 154 | 84% | 0.841 | 74% | 0.74 | S | S | * | * | | | trans | -50.8 | 101.5 | 168.3 | -169.6 | 168.6 | -168.7 | 0 | 0 | 109.3 | D160 | D160-E162 VanDerWaalsContact C-N 3.33Å; D160-E162 PolarHBondContact O-N 3.4Å |
| 163 | C | 57.2 | Low | 57.2 | Low | 106 Ų | 106 | 157.1 Ų | 157.1 | 72% | 0.716 | 75% | 0.749 | S | S | * | * | | | trans | -74.5 | 126 | 174.9 | -70.9 | 0 | 0 | 0 | 0 | 108.1 | W161 N165 | W161-C163 PolarHBondContact O-N 3.21Å; C163-N165 PolarHBondContact O-N 2.75Å |
| 164 | P | 59.2 | Low | 57.6 | Low | 117 Ų | 117 | 157.2 Ų | 157.2 | 76% | 0.76 | 76% | 0.757 | S | S | * | * | | | trans | -60.4 | 132.1 | 177 | 24.6 | -31.5 | 0 | 0 | 0 | 109.4 | L166 | P164-L166 PolarHBondContact O-N 3.05Š|
| 165 | N | 49 | Very low | 57.3 | Low | 155 Ų | 155 | 149.6 Ų | 149.6 | 83% | 0.829 | 74% | 0.741 | S | S | * | * | | | trans | -38.8 | 98.4 | -177.8 | -68.9 | -50.3 | 0 | 0 | 0 | 112.9 | C163 E167 | C163-N165 PolarHBondContact O-N 2.75Å; N165-E167 PolarHBondContact O-N 3.49Å; N165-E167 VanDerWaalsContact O-N 3.12Å |
| 166 | L | 57.5 | Low | 57.6 | Low | 118 Ų | 118 | 145.6 Ų | 145.6 | 62% | 0.618 | 73% | 0.729 | S | S | * | * | | | trans | -86.7 | 54.5 | 175.1 | -163.9 | 82.1 | 0 | 0 | 0 | 110 | P164 E168 H169 | P164-L166 PolarHBondContact O-N 3.05Å; L166-E168 PolarHBondContact O-N 3.45Å; L166-H169 HydrophobicContact CD2-CB 4.47Å; L166-H169 HydrophobicContact CG-CB 4.47Å |
| 167 | E | 59.8 | Low | 58 | Low | 157 Ų | 157 | 147.6 Ų | 147.6 | 73% | 0.734 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -1.7 | -174.9 | -157.9 | 63.8 | -143.4 | 0 | 0 | 112.9 | N165 | N165-E167 PolarHBondContact O-N 3.49Å; N165-E167 VanDerWaalsContact O-N 3.12Å |
| 168 | E | 60.2 | Low | 58.7 | Low | 180 Ų | 180 | 148.3 Ų | 148.3 | 84% | 0.841 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.5 | 9.4 | -176.1 | -88.8 | -173.6 | 164.4 | 0 | 0 | 115.7 | L166 | L166-E168 PolarHBondContact O-N 3.45Š|
| 169 | H | 58.1 | Low | 59 | Low | 65 Ų | 65 | 145.5 Ų | 145.5 | 30% | 0.301 | 73% | 0.731 | S | S | . | * | | | trans | -123.1 | 7.5 | -169.7 | -69.5 | -21.6 | 0 | 0 | 0 | 116.2 | L166 Q171 W172 | L166-H169 HydrophobicContact CD2-CB 4.47Å; L166-H169 HydrophobicContact CG-CB 4.47Å; H169-Q171 PolarHBondContact O-N 3.17Å; H169-W172 HydrophobicContact CB-CD2 4.26Å; H169-W172 HydrophobicContact CB-CH2 3.86Å; H169-W172 HydrophobicContact CB-CZ2 3.37Å; H169-W172 HydrophobicContact CB-CZ3 4.48Å; H169-W172 AromaticContact CD2-CH2 3.94Å; H169-W172 AromaticContact CD2-CZ2 3.51Å; H169-W172 AromaticContact CG-CE2 3.71Å; H169-W172 AromaticContact CG-CH2 3.91Å; H169-W172 AromaticContact CG-CZ2 3.19Å; H169-W172 AromaticContact CG-NE1 3.98Å; H169-W172 AromaticContact ND1-CE2 3.93Å; H169-W172 AromaticContact ND1-CZ2 3.62Å; H169-W172 AromaticContact ND1-NE1 3.78Å |
| 170 | M | 55.1 | Low | 59.6 | Low | 157 Ų | 157 | 144 Ų | 144 | 77% | 0.773 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.8 | 5.8 | 179.6 | -70 | -63.7 | 103.7 | 0 | 0 | 115.5 | | |
| 171 | Q | 60.4 | Low | 59.8 | Low | 185 Ų | 185 | 139.4 Ų | 139.4 | 86% | 0.864 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.7 | 17.5 | 175.6 | -63.5 | -165.5 | 21.2 | 0 | 0 | 114.4 | H169 K173 | H169-Q171 PolarHBondContact O-N 3.17Å; Q171-K173 VanDerWaalsContact C-N 3.27Å; Q171-K173 PolarHBondContact O-N 2.9Å |
| 172 | W | 55.2 | Low | 60.5 | Low | 176 Ų | 176 | 138.4 Ų | 138.4 | 67% | 0.667 | 71% | 0.71 | S | S | * | * | | | trans | -72.6 | 82 | 179.2 | -62.5 | -11.6 | 0 | 0 | 0 | 111.6 | H169 N174 | H169-W172 HydrophobicContact CB-CD2 4.26Å; H169-W172 HydrophobicContact CB-CH2 3.86Å; H169-W172 HydrophobicContact CB-CZ2 3.37Å; H169-W172 HydrophobicContact CB-CZ3 4.48Å; H169-W172 AromaticContact CD2-CH2 3.94Å; H169-W172 AromaticContact CD2-CZ2 3.51Å; H169-W172 AromaticContact CG-CE2 3.71Å; H169-W172 AromaticContact CG-CH2 3.91Å; H169-W172 AromaticContact CG-CZ2 3.19Å; H169-W172 AromaticContact CG-NE1 3.98Å; H169-W172 AromaticContact ND1-CE2 3.93Å; H169-W172 AromaticContact ND1-CZ2 3.62Å; H169-W172 AromaticContact ND1-NE1 3.78Å; W172-N174 PolarHBondContact O-N 3.31Å |
| 173 | K | 59.9 | Low | 60.9 | Low | 172 Ų | 172 | 133.6 Ų | 133.6 | 75% | 0.748 | 70% | 0.701 | S | S | * | * | | | trans | -56.6 | 129.7 | 159.7 | -101.5 | 179.5 | 169.7 | 177.1 | 0 | 108.2 | Q171 S175 | Q171-K173 VanDerWaalsContact C-N 3.27Å; Q171-K173 PolarHBondContact O-N 2.9Å; K173-S175 PolarHBondContact O-N 3.42Å |
| 174 | N | 62.7 | Low | 61.4 | Low | 180 Ų | 180 | 134.8 Ų | 134.8 | 96% | 0.963 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.3 | 36.8 | -178.5 | -68.2 | -47.4 | 0 | 0 | 0 | 115.2 | W172 | W172-N174 PolarHBondContact O-N 3.31Š|
| 175 | S | 58.3 | Low | 61.9 | Low | 80 Ų | 80 | 132.6 Ų | 132.6 | 56% | 0.559 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -136.2 | 1.7 | -171.2 | 55.1 | 0 | 0 | 0 | 0 | 116.2 | K173 | K173-S175 PolarHBondContact O-N 3.42Š|
| 176 | T | 58.2 | Low | 63 | Low | 68 Ų | 68 | 132.7 Ų | 132.7 | 42% | 0.417 | 70% | 0.695 | S | S | . | * | | | trans | -100.3 | 7.2 | -172.5 | 41.6 | 0 | 0 | 0 | 0 | 116.3 | L178 D179 T180 | T176-L178 PolarHBondContact O-N 3.48Å; T176-D179 HydrophobicContact CG2-CB 4.13Å; T176-D179 PolarHBondContact O-N 3.26Å; T176-T180 PolarHBondContact O-N 3Å |
| 177 | L | 61.1 | Low | 63.5 | Low | 156 Ų | 156 | 134.3 Ų | 134.3 | 82% | 0.817 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.2 | -24.5 | 179.6 | -141.1 | 153.8 | 0 | 0 | 0 | 112.4 | | |
| 178 | L | 66.1 | Low | 63.9 | Low | 141 Ų | 141 | 134.4 Ų | 134.4 | 74% | 0.738 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.6 | -29.1 | 171.3 | -62.1 | 179.2 | 0 | 0 | 0 | 112.9 | T176 S181 | T176-L178 PolarHBondContact O-N 3.48Å; L178-S181 PolarHBondContact O-N 3.49Å; L178-S181 PolarHBondContact O-OG 3.31Å |
| 179 | D | 63.8 | Low | 64.1 | Low | 130 Ų | 130 | 128.7 Ų | 128.7 | 70% | 0.695 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | -27.4 | -172.9 | -79.3 | -14.8 | 0 | 0 | 0 | 114.3 | T176 | T176-D179 HydrophobicContact CG2-CB 4.13Å; T176-D179 PolarHBondContact O-N 3.26Å |
| 180 | T | 70.5 | Confident | 64.8 | Low | 118 Ų | 118 | 131.1 Ų | 131.1 | 72% | 0.724 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.2 | -5.9 | 175.4 | 59.5 | 0 | 0 | 0 | 0 | 113.3 | T176 K182 | T176-T180 PolarHBondContact O-N 3Å; T180-K182 PolarHBondContact O-N 3.34Å |
| 181 | S | 61.5 | Low | 65.7 | Low | 58 Ų | 58 | 132.7 Ų | 132.7 | 41% | 0.406 | 71% | 0.709 | S | S | . | * | | | trans | -80.2 | 112.9 | -178.3 | 71.3 | 0 | 0 | 0 | 0 | 110.4 | L178 A183 | L178-S181 PolarHBondContact O-N 3.49Å; L178-S181 PolarHBondContact O-OG 3.31Å; S181-A183 PolarHBondContact O-N 2.95Å |
| 182 | K | 73.7 | Confident | 66.2 | Low | 208 Ų | 208 | 132.9 Ų | 132.9 | 90% | 0.904 | 71% | 0.707 | S | S | * | * | | | trans | -70.6 | 43.6 | 162.6 | -68.7 | -173.2 | 178.6 | -179.2 | 0 | 111 | T180 V184 | T180-K182 PolarHBondContact O-N 3.34Å; K182-V184 PolarHBondContact O-N 2.85Å |
| 183 | A | 70.5 | Confident | 67.2 | Low | 79 Ų | 79 | 130 Ų | 130 | 65% | 0.653 | 71% | 0.714 | S | S | * | * | | | trans | -69.4 | 99.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 108 | S181 A185 | S181-A183 PolarHBondContact O-N 2.95Å; A183-A185 PolarHBondContact O-N 3.31Å |
| 184 | V | 69.4 | Low | 67.7 | Low | 130 Ų | 130 | 127.2 Ų | 127.2 | 79% | 0.788 | 71% | 0.707 | S | S | * | * | | | trans | -58 | 124.8 | 170.5 | 171.4 | 0 | 0 | 0 | 0 | 107.6 | K182 I186 | K182-V184 PolarHBondContact O-N 2.85Å; V184-I186 PolarHBondContact O-N 3.3Å |
| 185 | A | 69.6 | Low | 68.2 | Low | 72 Ų | 72 | 122.5 Ų | 122.5 | 60% | 0.595 | 68% | 0.684 | S | S | * | * | | | trans | -57 | 112.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 109 | A183 E187 | A183-A185 PolarHBondContact O-N 3.31Å; A185-E187 PolarHBondContact O-N 3.04Å |
| 186 | I | 70.5 | Confident | 68.9 | Low | 156 Ų | 156 | 122 Ų | 122 | 80% | 0.8 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -62.6 | 1.5 | 177.6 | 52.4 | 170.5 | 0 | 0 | 0 | 113.7 | V184 K188 A189 | V184-I186 PolarHBondContact O-N 3.3Å; I186-K188 PolarHBondContact O-N 3.45Å; I186-K188 VanDerWaalsContact O-N 3.17Å; I186-A189 PolarHBondContact O-N 3.42Å |
| 187 | E | 69.9 | Low | 69.2 | Low | 152 Ų | 152 | 122.5 Ų | 122.5 | 71% | 0.71 | 69% | 0.692 | S | S | * | * | G | 310 helix | trans | -66.6 | -13.1 | 179.5 | -153.5 | -158.3 | 121.5 | 0 | 0 | 113.7 | A185 | A185-E187 PolarHBondContact O-N 3.04Š|
| 188 | K | 67.6 | Low | 69.5 | Low | 160 Ų | 160 | 120.9 Ų | 120.9 | 70% | 0.696 | 68% | 0.683 | S | S | * | * | G | 310 helix | trans | -121.3 | 24.6 | 177.2 | -53.1 | -63 | 161.9 | -139.5 | 0 | 113.5 | I186 | I186-K188 PolarHBondContact O-N 3.45Å; I186-K188 VanDerWaalsContact O-N 3.17Å |
| 189 | A | 65.1 | Low | 69.4 | Low | 59 Ų | 59 | 122.1 Ų | 122.1 | 49% | 0.488 | 68% | 0.682 | S | S | . | * | S | Bend | trans | -61.1 | 131.2 | 164.7 | 0 | 0 | 0 | 0 | 0 | 108.8 | I186 Q191 | I186-A189 PolarHBondContact O-N 3.42Å; A189-Q191 PolarHBondContact O-N 2.92Å; A189-Q191 VanDerWaalsContact O-N 3.11Å |
| 190 | P | 72.9 | Confident | 69.3 | Low | 117 Ų | 117 | 120.5 Ų | 120.5 | 76% | 0.76 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 122.6 | 171.5 | -24.2 | 32.7 | 0 | 0 | 0 | 108.7 | F192 | P190-F192 PolarHBondContact O-N 3.39Å; P190-F192 VanDerWaalsContact O-N 3.07Å |
| 191 | Q | 73.6 | Confident | 68.5 | Low | 190 Ų | 190 | 119.9 Ų | 119.9 | 89% | 0.888 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 121.7 | 176.9 | -75.3 | -173.9 | 6.7 | 0 | 0 | 108 | A189 S193 | A189-Q191 PolarHBondContact O-N 2.92Å; A189-Q191 VanDerWaalsContact O-N 3.11Å; Q191-S193 PolarHBondContact O-N 3Å |
| 192 | F | 71.2 | Confident | 68.1 | Low | 189 Ų | 189 | 119.7 Ų | 119.7 | 83% | 0.829 | 68% | 0.676 | S | S | * | * | | | trans | -54.2 | 110.8 | 173.1 | -64.4 | -80.2 | 0 | 0 | 0 | 108.1 | P190 N194 | P190-F192 PolarHBondContact O-N 3.39Å; P190-F192 VanDerWaalsContact O-N 3.07Å; F192-N194 PolarHBondContact O-N 3.26Å; F192-N194 VanDerWaalsContact O-N 3.13Å |
| 193 | S | 74.4 | Confident | 67.3 | Low | 116 Ų | 116 | 115.4 Ų | 115.4 | 81% | 0.811 | 67% | 0.672 | S | S | * | * | | | trans | -64.3 | 113.8 | 175.8 | 35.3 | 0 | 0 | 0 | 0 | 109.1 | Q191 | Q191-S193 PolarHBondContact O-N 3Š|
| 194 | N | 70.5 | Confident | 66.6 | Low | 113 Ų | 113 | 119.7 Ų | 119.7 | 60% | 0.604 | 68% | 0.679 | S | S | * | * | | | trans | 42.6 | 92.9 | 165.7 | -158.1 | -9.2 | 0 | 0 | 0 | 117.9 | F192 S196 | F192-N194 PolarHBondContact O-N 3.26Å; F192-N194 VanDerWaalsContact O-N 3.13Å; N194-S196 PolarHBondContact O-N 2.88Å; N194-S196 WeakPolarHBondContact OD1-CA 3.42Å; N194-S196 WeakPolarHBondContact OD1-CB 3.43Å; N194-S196 PolarHBondContact OD1-N 3.3Å; N194-S196 PolarHBondContact OD1-OG 2.95Å |
| 195 | V | 73.6 | Confident | 66.1 | Low | 81 Ų | 81 | 118.3 Ų | 118.3 | 49% | 0.491 | 67% | 0.667 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -67.7 | -3.4 | 169.4 | -65.9 | 0 | 0 | 0 | 0 | 114.4 | A197 I198 F199 | V195-A197 PolarHBondContact O-N 3.43Å; V195-A197 VanDerWaalsContact O-N 3.16Å; V195-I198 HydrophobicContact CB-CD1 4.27Å; V195-I198 HydrophobicContact CG1-CD1 4.18Å; V195-I198 WeakPolarHBondContact O-CB 3.48Å; V195-I198 PolarHBondContact O-N 2.99Å; V195-F199 HydrophobicContact CB-CE2 4.49Å; V195-F199 HydrophobicContact CG2-CE2 4.4Å; V195-F199 WeakPolarHBondContact O-CD2 3.12Å |
| 196 | S | 72.7 | Confident | 65.4 | Low | 69 Ų | 69 | 123.3 Ų | 123.3 | 48% | 0.483 | 67% | 0.672 | S | S | . | * | H | α-helix | trans | -60.9 | -24.3 | 177.8 | -64 | 0 | 0 | 0 | 0 | 113 | N194 I198 F199 S200 | N194-S196 PolarHBondContact O-N 2.88Å; N194-S196 WeakPolarHBondContact OD1-CA 3.42Å; N194-S196 WeakPolarHBondContact OD1-CB 3.43Å; N194-S196 PolarHBondContact OD1-N 3.3Å; N194-S196 PolarHBondContact OD1-OG 2.95Å; S196-I198 VanDerWaalsContact C-N 3.26Å; S196-I198 PolarHBondContact O-N 2.93Å; S196-F199 PolarHBondContact O-N 3.48Å; S196-S200 PolarHBondContact O-N 3.32Å; S196-S200 PolarHBondContact O-OG 2.82Å |
| 197 | A | 66 | Low | 64.8 | Low | 78 Ų | 78 | 124.4 Ų | 124.4 | 65% | 0.645 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -64.7 | -30.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | V195 F199 | V195-A197 PolarHBondContact O-N 3.43Å; V195-A197 VanDerWaalsContact O-N 3.16Å; A197-F199 VanDerWaalsContact C-N 3.34Å |
| 198 | I | 67.6 | Low | 64.3 | Low | 123 Ų | 123 | 126.2 Ų | 126.2 | 63% | 0.631 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -74.8 | -28.6 | 180 | -51.4 | 175.4 | 0 | 0 | 0 | 110.8 | V195 S196 | V195-I198 HydrophobicContact CB-CD1 4.27Å; V195-I198 HydrophobicContact CG1-CD1 4.18Å; V195-I198 WeakPolarHBondContact O-CB 3.48Å; V195-I198 PolarHBondContact O-N 2.99Å; S196-I198 VanDerWaalsContact C-N 3.26Å; S196-I198 PolarHBondContact O-N 2.93Å |
| 199 | F | 64 | Low | 63.5 | Low | 167 Ų | 167 | 123.9 Ų | 123.9 | 73% | 0.732 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -95.4 | -1.3 | -179.2 | -66.4 | -74 | 0 | 0 | 0 | 114.3 | V195 S196 A197 | V195-F199 HydrophobicContact CB-CE2 4.49Å; V195-F199 HydrophobicContact CG2-CE2 4.4Å; V195-F199 WeakPolarHBondContact O-CD2 3.12Å; S196-F199 PolarHBondContact O-N 3.48Å; A197-F199 VanDerWaalsContact C-N 3.34Å |
| 200 | S | 59.8 | Low | 62.8 | Low | 96 Ų | 96 | 128.5 Ų | 128.5 | 67% | 0.671 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -89.5 | -3.9 | -177.5 | -60.5 | 0 | 0 | 0 | 0 | 114 | S196 | S196-S200 PolarHBondContact O-N 3.32Å; S196-S200 PolarHBondContact O-OG 2.82Å |
| 201 | T | 54.7 | Low | 61.8 | Low | 104 Ų | 104 | 134.3 Ų | 134.3 | 64% | 0.638 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -96.3 | 101 | 171.2 | 54.9 | 0 | 0 | 0 | 0 | 110.3 | | |
| 202 | S | 53.1 | Low | 60.7 | Low | 54 Ų | 54 | 134.8 Ų | 134.8 | 38% | 0.378 | 70% | 0.699 | S | S | . | * | | | trans | 41.8 | 94.9 | 159.7 | 65.1 | 0 | 0 | 0 | 0 | 118.2 | E204 D205 | S202-E204 PolarHBondContact O-N 3.37Å; S202-E204 VanDerWaalsContact O-N 3.14Å; S202-D205 PolarHBondContact OG-OD2 3.08Å |
| 203 | S | 56.9 | Low | 59.7 | Low | 118 Ų | 118 | 132.6 Ų | 132.6 | 83% | 0.825 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | 8.6 | 155.2 | 79.8 | 0 | 0 | 0 | 0 | 113.3 | | |
| 204 | E | 55.9 | Low | 58.5 | Low | 169 Ų | 169 | 133.6 Ų | 133.6 | 79% | 0.79 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.1 | -16.1 | -178.4 | -147.2 | 101.9 | -146.8 | 0 | 0 | 112.8 | S202 | S202-E204 PolarHBondContact O-N 3.37Å; S202-E204 VanDerWaalsContact O-N 3.14Å |
| 205 | D | 59.3 | Low | 57.3 | Low | 102 Ų | 102 | 136.3 Ų | 136.3 | 55% | 0.545 | 71% | 0.713 | S | S | . | * | S | Bend | trans | -95.5 | -19.4 | -174.9 | -71.7 | -48.8 | 0 | 0 | 0 | 114.4 | S202 Q207 K208 | S202-D205 PolarHBondContact OG-OD2 3.08Å; D205-Q207 VanDerWaalsContact C-N 3.33Å; D205-Q207 PolarHBondContact O-N 3.34Å; D205-K208 PolarHBondContact O-N 3.38Å |
| 206 | Y | 54.7 | Low | 56.3 | Low | 177 Ų | 177 | 138.7 Ų | 138.7 | 69% | 0.694 | 73% | 0.728 | S | S | * | * | G | 310 helix | trans | -75.5 | -15.9 | -176.7 | -72.7 | -80.2 | 0 | 0 | 0 | 114.3 | K208 H210 | Y206-K208 VanDerWaalsContact C-N 3.33Å; Y206-H210 PolarHBondContact O-CD2 2.8Å |
| 207 | Q | 57 | Low | 55.3 | Low | 179 Ų | 179 | 140.7 Ų | 140.7 | 84% | 0.836 | 74% | 0.737 | S | S | * | * | G | 310 helix | trans | -82.8 | -10.3 | 179 | -132.7 | -168.1 | 6.5 | 0 | 0 | 113.8 | D205 | D205-Q207 VanDerWaalsContact C-N 3.33Å; D205-Q207 PolarHBondContact O-N 3.34Å |
| 208 | K | 61 | Low | 54.2 | Low | 189 Ų | 189 | 141.2 Ų | 141.2 | 82% | 0.822 | 74% | 0.741 | S | S | * | * | G | 310 helix | trans | -86.6 | -13.2 | -177.1 | -157.6 | 169 | -179.4 | -174.6 | 0 | 113.9 | D205 Y206 | D205-K208 PolarHBondContact O-N 3.38Å; Y206-K208 VanDerWaalsContact C-N 3.33Å |
| 209 | C | 49.1 | Very low | 53.2 | Low | 111 Ų | 111 | 142.7 Ų | 142.7 | 75% | 0.75 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -98.2 | 0.1 | -176.6 | -70.2 | 0 | 0 | 0 | 0 | 115.4 | | |
| 210 | H | 50.2 | Low | 52.3 | Low | 157 Ų | 157 | 142.9 Ų | 142.9 | 73% | 0.727 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -105.2 | 21.7 | -172 | -68.6 | -61 | 0 | 0 | 0 | 116.2 | Y206 | Y206-H210 PolarHBondContact O-CD2 2.8Š|
| 211 | R | 52.7 | Low | 51.4 | Low | 238 Ų | 238 | 145 Ų | 145 | 90% | 0.898 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -128.6 | 22.8 | -175.1 | -95 | -169.4 | -172.9 | -174.4 | 4.2 | 117.6 | | |
| 212 | K | 51 | Low | 50.9 | Low | 200 Ų | 200 | 146.5 Ų | 146.5 | 87% | 0.87 | 77% | 0.766 | S | S | * | * | | | trans | -134.4 | 67 | 177.9 | -73.7 | -176.7 | 176.7 | 178.5 | 0 | 112.7 | | |
| 213 | T | 49.3 | Very low | 50.4 | Low | 144 Ų | 144 | 149.4 Ų | 149.4 | 88% | 0.883 | 79% | 0.786 | S | S | * | * | | | trans | -153.1 | 64.6 | 160.9 | -38 | 0 | 0 | 0 | 0 | 109.4 | | |
| 214 | V | 49.1 | Very low | 49.7 | Very low | 136 Ų | 136 | 149 Ų | 149 | 82% | 0.824 | 78% | 0.781 | S | S | * | * | | | trans | -122.2 | 101.4 | 164 | 178.3 | 0 | 0 | 0 | 0 | 106.7 | T216 | V214-T216 PolarHBondContact O-N 3.34Š|
| 215 | M | 46.2 | Very low | 48.8 | Very low | 171 Ų | 171 | 150.7 Ų | 150.7 | 84% | 0.842 | 79% | 0.785 | S | S | * | * | | | trans | -72.1 | 102.5 | 174.5 | 178.7 | 152.6 | 78.7 | 0 | 0 | 108.4 | V217 | M215-V217 HydrophobicContact CG-CG2 4.49Å; M215-V217 PolarHBondContact O-N 2.77Å |
| 216 | T | 52.2 | Low | 48.3 | Very low | 130 Ų | 130 | 150.7 Ų | 150.7 | 80% | 0.798 | 80% | 0.8 | S | S | * | * | | | trans | -79.5 | 102.4 | 169.7 | 41.8 | 0 | 0 | 0 | 0 | 109.1 | V214 | V214-T216 PolarHBondContact O-N 3.34Š|
| 217 | V | 50.9 | Low | 47.6 | Very low | 112 Ų | 112 | 151.8 Ų | 151.8 | 68% | 0.679 | 81% | 0.808 | S | S | * | * | | | trans | -72.7 | 119.7 | 161.2 | 176.6 | 0 | 0 | 0 | 0 | 106.9 | M215 D219 | M215-V217 HydrophobicContact CG-CG2 4.49Å; M215-V217 PolarHBondContact O-N 2.77Å; V217-D219 PolarHBondContact O-N 3Å |
| 218 | A | 43.2 | Very low | 46.7 | Very low | 88 Ų | 88 | 149.7 Ų | 149.7 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | | | trans | -81.6 | 107.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | Q220 | A218-Q220 PolarHBondContact O-N 3.43Š|
| 219 | D | 47.1 | Very low | 45.5 | Very low | 154 Ų | 154 | 145.1 Ų | 145.1 | 82% | 0.824 | 81% | 0.809 | S | S | * | * | | | trans | -80.4 | 110.1 | 165.2 | -78.9 | -26.6 | 0 | 0 | 0 | 108.8 | V217 N221 | V217-D219 PolarHBondContact O-N 3Å; D219-N221 PolarHBondContact O-N 3.27Å |
| 220 | Q | 45.4 | Very low | 45.5 | Very low | 172 Ų | 172 | 145.3 Ų | 145.3 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | | | trans | -70.2 | 119.2 | 172.1 | -64.1 | -162.9 | 23.3 | 0 | 0 | 110.2 | A218 | A218-Q220 PolarHBondContact O-N 3.43Š|
| 221 | N | 39.6 | Very low | 44.8 | Very low | 139 Ų | 139 | 145.2 Ų | 145.2 | 74% | 0.743 | 82% | 0.817 | S | S | * | * | | | trans | 38.8 | 125 | 132 | -54.3 | -47.4 | 0 | 0 | 0 | 119.3 | D219 | D219-N221 PolarHBondContact O-N 3.27Š|
| 222 | V | 44.8 | Very low | 44.6 | Very low | 137 Ų | 137 | 140 Ų | 140 | 83% | 0.83 | 82% | 0.816 | S | S | * | * | | | | 147.6 | 112.3 | 111.9 | 176.7 | 0 | 0 | 0 | 0 | 108.6 | | |
| 223 | S | 43.5 | Very low | 44 | Very low | 114 Ų | 114 | 139 Ų | 139 | 80% | 0.797 | 82% | 0.815 | S | S | * | * | | | trans | -117.3 | 132.1 | 161.6 | 179.9 | 0 | 0 | 0 | 0 | 108.2 | | |
| 224 | P | 42.6 | Very low | 44.1 | Very low | 109 Ų | 109 | 136.7 Ų | 136.7 | 71% | 0.708 | 81% | 0.805 | S | S | * | * | | | trans | -92.1 | 164.8 | -172.6 | 36.1 | -32.3 | 0 | 0 | 0 | 112 | | |
| 225 | K | 36.4 | Very low | 43.9 | Very low | 205 Ų | 205 | 137 Ų | 137 | 89% | 0.891 | 80% | 0.802 | S | S | * | * | | | trans | 113.9 | 93.4 | 144.6 | -153.5 | 176.3 | -165.2 | 172.1 | 0 | 115.8 | | |
| 226 | A | 48.2 | Very low | 43.8 | Very low | 103 Ų | 103 | 135.9 Ų | 135.9 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | | | trans | -145.9 | 125.1 | 140.9 | 0 | 0 | 0 | 0 | 0 | 109.3 | | |
| 227 | K | 39.4 | Very low | 43.4 | Very low | 200 Ų | 200 | 134.4 Ų | 134.4 | 87% | 0.87 | 80% | 0.801 | S | S | * | * | | | trans | -74.1 | 133.5 | 171.4 | -72.9 | 172.9 | 170.9 | 179.5 | 0 | 108.6 | | |
| 228 | C | 38 | Very low | 42.8 | Very low | 135 Ų | 135 | 133.6 Ų | 133.6 | 91% | 0.912 | 81% | 0.806 | S | S | * | * | | | | -178.3 | 141.9 | 121 | -98.5 | 0 | 0 | 0 | 0 | 110.8 | | |
| 229 | A | 36.8 | Very low | 43 | Very low | 92 Ų | 92 | 135.2 Ų | 135.2 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | | | trans | -79.9 | 144.5 | -166 | 0 | 0 | 0 | 0 | 0 | 113.4 | | |
| 230 | S | 48.9 | Very low | 42.7 | Very low | 116 Ų | 116 | 135.5 Ų | 135.5 | 81% | 0.811 | 81% | 0.806 | S | S | * | * | | | trans | -171.8 | 130.4 | 134 | 52.7 | 0 | 0 | 0 | 0 | 109.3 | | |
| 231 | N | 35.1 | Very low | 42.3 | Very low | 154 Ų | 154 | 134.8 Ų | 134.8 | 82% | 0.824 | 81% | 0.807 | S | S | * | * | | | trans | -82.8 | 139.4 | -170 | -40.1 | -42.9 | 0 | 0 | 0 | 109.8 | | |
| 232 | S | 48.1 | Very low | 42.7 | Very low | 128 Ų | 128 | 135.3 Ų | 135.3 | 90% | 0.895 | 81% | 0.808 | S | S | * | * | | | trans | -163.1 | 136 | 142.3 | 4.1 | 0 | 0 | 0 | 0 | 109.8 | | |
| 233 | E | 39.8 | Very low | 42.4 | Very low | 179 Ų | 179 | 136.6 Ų | 136.6 | 84% | 0.836 | 81% | 0.81 | S | S | * | * | | | trans | -99.7 | 163.9 | -164.5 | 178.3 | 172.7 | 175.1 | 0 | 0 | 109.8 | | |
| 234 | S | 50.8 | Low | 42.5 | Very low | 97 Ų | 97 | 135.8 Ų | 135.8 | 68% | 0.678 | 81% | 0.81 | S | S | * | * | | | trans | 73 | 146.4 | 165 | 75.1 | 0 | 0 | 0 | 0 | 116.9 | | |
| 235 | D | 45.7 | Very low | 42.4 | Very low | 142 Ų | 142 | 138.9 Ų | 138.9 | 76% | 0.759 | 82% | 0.815 | S | S | * | * | | | cis | -159.9 | 145.1 | -9.2 | -106.5 | -17.1 | 0 | 0 | 0 | 107.7 | A237 | D235-A237 PolarHBondContact O-N 2.84Š|
| 236 | N | 42.8 | Very low | 42.6 | Very low | 147 Ų | 147 | 137.6 Ų | 137.6 | 79% | 0.786 | 81% | 0.81 | S | S | * | * | | | trans | -33.1 | 117.8 | 159.6 | 49.5 | -6.4 | 0 | 0 | 0 | 116.4 | | |
| 237 | A | 44 | Very low | 42.5 | Very low | 100 Ų | 100 | 139.1 Ų | 139.1 | 83% | 0.826 | 81% | 0.809 | S | S | * | * | | | trans | -142.4 | 115.7 | 156.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | D235 | D235-A237 PolarHBondContact O-N 2.84Š|
| 238 | A | 38.4 | Very low | 42.3 | Very low | 95 Ų | 95 | 135.2 Ų | 135.2 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | | | trans | -59.9 | 147.5 | 168.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | | |
| 239 | C | 48.2 | Very low | 42.6 | Very low | 121 Ų | 121 | 134.7 Ų | 134.7 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | | | trans | -170.9 | 101.2 | 153.3 | -91.3 | 0 | 0 | 0 | 0 | 106.3 | | |
| 240 | E | 41.2 | Very low | 42.8 | Very low | 160 Ų | 160 | 135.7 Ų | 135.7 | 75% | 0.748 | 80% | 0.801 | S | S | * | * | | | | 102.4 | 113.4 | 79 | -111.4 | -154.2 | 166.7 | 0 | 0 | 110.1 | | |
| 241 | I | 36.7 | Very low | 42.2 | Very low | 158 Ų | 158 | 136.3 Ų | 136.3 | 81% | 0.81 | 80% | 0.8 | S | S | * | * | | | trans | -90.6 | 111.3 | 174.7 | -65.8 | 165.1 | 0 | 0 | 0 | 105.5 | | |
| 242 | L | 46.5 | Very low | 43 | Very low | 149 Ų | 149 | 135.3 Ų | 135.3 | 78% | 0.78 | 80% | 0.803 | S | S | * | * | | | trans | -116.6 | 104.8 | 170.6 | -78.2 | 175.3 | 0 | 0 | 0 | 110.6 | | |
| 243 | L | 39.6 | Very low | 43.1 | Very low | 164 Ų | 164 | 136.3 Ų | 136.3 | 86% | 0.859 | 79% | 0.793 | S | S | * | * | | | trans | -90.6 | 124.3 | 159.5 | -77.1 | 165.2 | 0 | 0 | 0 | 108.3 | | |
| 244 | A | 44.6 | Very low | 43.3 | Very low | 98 Ų | 98 | 135.8 Ų | 135.8 | 81% | 0.81 | 79% | 0.788 | S | S | * | * | | | trans | -165.4 | 102.6 | 155.9 | 0 | 0 | 0 | 0 | 0 | 107.1 | | |
| 245 | E | 41.1 | Very low | 43.3 | Very low | 173 Ų | 173 | 138.4 Ų | 138.4 | 81% | 0.808 | 80% | 0.8 | S | S | * | * | | | | 79 | 104.8 | 83.2 | -159.1 | 176.1 | 164.6 | 0 | 0 | 114.1 | | |
| 246 | K | 40.7 | Very low | 43.4 | Very low | 178 Ų | 178 | 141.4 Ų | 141.4 | 77% | 0.774 | 81% | 0.807 | S | S | * | * | | | trans | 52.4 | 125.2 | 142.9 | -51 | -82.6 | 176.5 | 175.8 | 0 | 118.7 | | |
| 247 | T | 45.7 | Very low | 43.6 | Very low | 136 Ų | 136 | 144.5 Ų | 144.5 | 83% | 0.834 | 81% | 0.813 | S | S | * | * | | | | 178.1 | 131.4 | 114.1 | -68.7 | 0 | 0 | 0 | 0 | 109.7 | | |
| 248 | C | 36.1 | Very low | 43.6 | Very low | 118 Ų | 118 | 149.2 Ų | 149.2 | 80% | 0.797 | 82% | 0.815 | S | S | * | * | | | trans | -117 | 176 | 158.6 | -70.6 | 0 | 0 | 0 | 0 | 106.3 | | |
| 249 | P | 43.5 | Very low | 43.7 | Very low | 124 Ų | 124 | 154.9 Ų | 154.9 | 81% | 0.805 | 82% | 0.822 | S | S | * | * | | | cis | -140.2 | -176.1 | 8 | 36.6 | -14.8 | 0 | 0 | 0 | 114.1 | | |
| 250 | S | 41.5 | Very low | 43.3 | Very low | 112 Ų | 112 | 154.4 Ų | 154.4 | 78% | 0.783 | 82% | 0.815 | S | S | * | * | | | trans | 174.9 | 129.5 | 131.4 | -170.3 | 0 | 0 | 0 | 0 | 112.6 | | |
| 251 | T | 36.6 | Very low | 43.2 | Very low | 129 Ų | 129 | 153.5 Ų | 153.5 | 79% | 0.791 | 82% | 0.816 | S | S | * | * | | | trans | -66.1 | 158.9 | 170.8 | 41.2 | 0 | 0 | 0 | 0 | 113.9 | | |
| 252 | P | 52.1 | Low | 43.5 | Very low | 134 Ų | 134 | 151.6 Ų | 151.6 | 87% | 0.87 | 82% | 0.816 | S | S | * | * | | | | -137.7 | 174.5 | 129.4 | 36.4 | -22.1 | 0 | 0 | 0 | 115.2 | | |
| 253 | E | 48.8 | Very low | 43.5 | Very low | 148 Ų | 148 | 149.6 Ų | 149.6 | 69% | 0.692 | 82% | 0.815 | S | S | * | * | | | trans | -102 | 147.3 | -146.5 | -165.9 | -176.4 | 170.7 | 0 | 0 | 114.2 | | |
| 254 | K | 44.9 | Very low | 43.9 | Very low | 168 Ų | 168 | 147.8 Ų | 147.8 | 73% | 0.73 | 81% | 0.811 | S | S | * | * | | | trans | 33 | 132.1 | 152.1 | -65.3 | 170.6 | -168.8 | 146.2 | 0 | 121 | | |
| 255 | T | 51.4 | Low | 44 | Very low | 153 Ų | 153 | 149.6 Ų | 149.6 | 94% | 0.939 | 81% | 0.814 | S | S | * | * | | | | -169.6 | 143.2 | 111.6 | 23.3 | 0 | 0 | 0 | 0 | 112.9 | | |
| 256 | K | 46.3 | Very low | 44.3 | Very low | 205 Ų | 205 | 144.8 Ų | 144.8 | 89% | 0.891 | 81% | 0.811 | S | S | * | * | | | trans | -74.1 | 146.7 | -175.5 | -68.3 | 172.2 | 171.5 | 173.2 | 0 | 113.1 | | |
| 257 | K | 47.7 | Very low | 45.1 | Very low | 212 Ų | 212 | 145.3 Ų | 145.3 | 92% | 0.922 | 81% | 0.813 | S | S | * | * | | | | -169.5 | 128.5 | 129.8 | -106.3 | 167.9 | -174.8 | 177.6 | 0 | 113.3 | | |
| 258 | K | 43.7 | Very low | 45.2 | Very low | 198 Ų | 198 | 148.8 Ų | 148.8 | 86% | 0.861 | 82% | 0.817 | S | S | * | * | | | trans | -56.8 | 144 | 170.7 | -97.1 | 173.5 | 166.1 | 175.9 | 0 | 112.7 | | |
| 259 | K | 41.3 | Very low | 46.1 | Very low | 214 Ų | 214 | 150.3 Ų | 150.3 | 93% | 0.93 | 82% | 0.817 | S | S | * | * | | | | -164.6 | 125.9 | 129.7 | -115.6 | 177.5 | 179.9 | -177.6 | 0 | 112.4 | | |
| 260 | T | 38.6 | Very low | 46.4 | Very low | 111 Ų | 111 | 157.1 Ų | 157.1 | 68% | 0.681 | 83% | 0.827 | S | S | * | * | | | trans | -78.3 | 146.4 | 177.1 | -36.4 | 0 | 0 | 0 | 0 | 111.5 | | |
| 261 | N | 39.9 | Very low | 46.8 | Very low | 142 Ų | 142 | 154.7 Ų | 154.7 | 76% | 0.759 | 82% | 0.819 | S | S | * | * | | | | 135.9 | 142.6 | 128.5 | -69.8 | -42.9 | 0 | 0 | 0 | 116.2 | | |
| 262 | S | 43.1 | Very low | 47.4 | Very low | 118 Ų | 118 | 156.4 Ų | 156.4 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | | | trans | 78.9 | 122.1 | 161.5 | 77 | 0 | 0 | 0 | 0 | 115.6 | | |
| 263 | S | 47.1 | Very low | 47.3 | Very low | 107 Ų | 107 | 158.4 Ų | 158.4 | 75% | 0.748 | 83% | 0.825 | S | S | * | * | | | | -146.5 | 125.3 | 66.9 | 53.7 | 0 | 0 | 0 | 0 | 115.2 | | |
| 264 | T | 48.1 | Very low | 47.5 | Very low | 126 Ų | 126 | 157.2 Ų | 157.2 | 77% | 0.773 | 83% | 0.828 | S | S | * | * | | | trans | 25.1 | 127.4 | 137.7 | 50.3 | 0 | 0 | 0 | 0 | 121.9 | | |
| 265 | P | 46 | Very low | 47.8 | Very low | 136 Ų | 136 | 154.7 Ų | 154.7 | 88% | 0.883 | 83% | 0.832 | S | S | * | * | | | trans | -88.7 | 121.3 | 165.5 | 34.1 | -27.4 | 0 | 0 | 0 | 111.1 | | |
| 266 | G | 47.2 | Very low | 48.3 | Very low | 72 Ų | 72 | 153.6 Ų | 153.6 | 74% | 0.742 | 83% | 0.825 | S | S | * | * | | | trans | -105.3 | 112.2 | -177 | 0 | 0 | 0 | 0 | 0 | 114.2 | | |
| 267 | K | 56.6 | Low | 49.1 | Very low | 189 Ų | 189 | 149.8 Ų | 149.8 | 82% | 0.822 | 82% | 0.821 | S | S | * | * | | | trans | 61.6 | 101 | 142.9 | -66.2 | 177.8 | 176.4 | 176.7 | 0 | 120.1 | N269 | K267-N269 PolarHBondContact O-OD1 2.92Š|
| 268 | K | 48.5 | Very low | 49.7 | Very low | 209 Ų | 209 | 145 Ų | 145 | 91% | 0.909 | 82% | 0.815 | S | S | * | * | | | | 26.6 | 93.3 | 120.6 | -54 | 178.6 | -176 | 179.8 | 0 | 118.3 | | |
| 269 | N | 55.2 | Low | 50.3 | Low | 149 Ų | 149 | 141 Ų | 141 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | | | trans | -126.3 | 97.2 | 160.3 | -50.8 | -0.5 | 0 | 0 | 0 | 108.9 | K267 G271 | K267-N269 PolarHBondContact O-OD1 2.92Å; N269-G271 PolarHBondContact O-N 3.35Å; N269-G271 VanDerWaalsContact O-N 3.17Å |
| 270 | R | 49.4 | Very low | 51.3 | Low | 267 Ų | 267 | 139 Ų | 139 | 100% | 1.008 | 81% | 0.806 | S | S | * | * | | | trans | -71.2 | 97.1 | 158 | -79.8 | 177.3 | 164.4 | -176.4 | -5.2 | 106.1 | | |
| 271 | G | 50 | Low | 52.1 | Low | 61 Ų | 61 | 140.4 Ų | 140.4 | 63% | 0.629 | 81% | 0.814 | S | S | * | * | | | trans | -140 | 124 | -179.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | N269 | N269-G271 PolarHBondContact O-N 3.35Å; N269-G271 VanDerWaalsContact O-N 3.17Å |
| 272 | L | 48.7 | Very low | 53.1 | Low | 165 Ų | 165 | 136.1 Ų | 136.1 | 86% | 0.864 | 80% | 0.798 | S | S | * | * | | | trans | -43.8 | 134.6 | -178 | -70.4 | 151.4 | 0 | 0 | 0 | 112.3 | T274 | L272-T274 PolarHBondContact O-N 3.45Š|
| 273 | L | 50 | Low | 54.1 | Low | 176 Ų | 176 | 134.1 Ų | 134.1 | 92% | 0.921 | 80% | 0.796 | S | S | * | * | | | trans | -63.7 | 92.4 | 177.7 | -65.8 | 171.1 | 0 | 0 | 0 | 110.4 | | |
| 274 | T | 53.1 | Low | 55.3 | Low | 123 Ų | 123 | 137.2 Ų | 137.2 | 76% | 0.755 | 80% | 0.797 | S | S | * | * | | | trans | -136.5 | 80.7 | 163.3 | 59.9 | 0 | 0 | 0 | 0 | 108.1 | L272 | L272-T274 PolarHBondContact O-N 3.45Š|
| 275 | S | 52.6 | Low | 56.8 | Low | 116 Ų | 116 | 138 Ų | 138 | 81% | 0.811 | 80% | 0.801 | S | S | * | * | | | trans | -91.7 | 102.6 | 175.2 | 52.5 | 0 | 0 | 0 | 0 | 110.2 | | |
| 276 | T | 60.8 | Low | 58.1 | Low | 130 Ų | 130 | 138.2 Ų | 138.2 | 80% | 0.798 | 79% | 0.793 | S | S | * | * | | | trans | -67.4 | 130.7 | 160.8 | -16.2 | 0 | 0 | 0 | 0 | 108.5 | S278 | T276-S278 PolarHBondContact O-N 3.22Š|
| 277 | P | 64.1 | Low | 59.7 | Low | 124 Ų | 124 | 140.2 Ų | 140.2 | 81% | 0.805 | 79% | 0.787 | S | S | * | * | | | trans | -73.4 | 113.6 | 176.1 | 28.1 | -30.6 | 0 | 0 | 0 | 109.8 | | |
| 278 | S | 59.1 | Low | 60.6 | Low | 113 Ų | 113 | 137.5 Ų | 137.5 | 79% | 0.79 | 78% | 0.78 | S | S | * | * | | | trans | -74.6 | 126.5 | 169.6 | -175.2 | 0 | 0 | 0 | 0 | 109.5 | T276 E280 | T276-S278 PolarHBondContact O-N 3.22Å; S278-E280 PolarHBondContact O-N 2.93Å |
| 279 | S | 57.3 | Low | 61.8 | Low | 113 Ų | 113 | 132 Ų | 132 | 79% | 0.79 | 77% | 0.768 | S | S | * | * | | | trans | -90.4 | 81.3 | 178.7 | 52.3 | 0 | 0 | 0 | 0 | 110.4 | | |
| 280 | E | 62 | Low | 62.3 | Low | 173 Ų | 173 | 129.8 Ų | 129.8 | 81% | 0.808 | 77% | 0.765 | S | S | * | * | | | trans | -104.2 | 102.8 | 165.3 | -164.7 | 171.9 | 179.8 | 0 | 0 | 108.3 | S278 A282 | S278-E280 PolarHBondContact O-N 2.93Å; E280-A282 VanDerWaalsContact C-N 3.27Å; E280-A282 PolarHBondContact O-N 3.4Å |
| 281 | T | 55 | Low | 63.3 | Low | 140 Ų | 140 | 122.6 Ų | 122.6 | 86% | 0.859 | 75% | 0.75 | S | S | * | * | | | trans | -73.9 | 77.8 | -178.5 | -53.5 | 0 | 0 | 0 | 0 | 109.6 | | |
| 282 | A | 62.2 | Low | 64.1 | Low | 52 Ų | 52 | 128.5 Ų | 128.5 | 43% | 0.43 | 76% | 0.761 | S | S | . | * | | | trans | -77.3 | 120.5 | 162.5 | 0 | 0 | 0 | 0 | 0 | 108.1 | E280 F284 | E280-A282 VanDerWaalsContact C-N 3.27Å; E280-A282 PolarHBondContact O-N 3.4Å; A282-F284 HydrophobicContact CB-CE1 3.74Å; A282-F284 HydrophobicContact CB-CE2 4.37Å; A282-F284 HydrophobicContact CB-CZ 3.64Å; A282-F284 WeakPolarHBondContact O-CD2 3.11Å; A282-F284 WeakPolarHBondContact O-CE2 3.12Å; A282-F284 WeakPolarHBondContact O-CZ 3.22Å; A282-F284 PolarHBondContact O-N 3.3Å |
| 283 | G | 63.4 | Low | 65 | Low | 76 Ų | 76 | 130.5 Ų | 130.5 | 78% | 0.784 | 76% | 0.763 | S | S | * | * | | | trans | -67.7 | 97.2 | -178.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | | |
| 284 | F | 71.9 | Confident | 65.6 | Low | 172 Ų | 172 | 126.6 Ų | 126.6 | 75% | 0.754 | 76% | 0.756 | S | S | * | * | | | trans | -89.9 | 106.5 | 170.9 | -37.9 | -73.4 | 0 | 0 | 0 | 108.9 | A282 | A282-F284 HydrophobicContact CB-CE1 3.74Å; A282-F284 HydrophobicContact CB-CE2 4.37Å; A282-F284 HydrophobicContact CB-CZ 3.64Å; A282-F284 WeakPolarHBondContact O-CD2 3.11Å; A282-F284 WeakPolarHBondContact O-CE2 3.12Å; A282-F284 WeakPolarHBondContact O-CZ 3.22Å; A282-F284 PolarHBondContact O-N 3.3Å |
| 285 | V | 79 | Confident | 65.9 | Low | 141 Ų | 141 | 124.5 Ų | 124.5 | 86% | 0.855 | 75% | 0.747 | S | S | * | * | | | trans | -78.5 | 116.2 | 168.1 | 177.3 | 0 | 0 | 0 | 0 | 107.4 | | |
| 286 | I | 74.5 | Confident | 66.6 | Low | 141 Ų | 141 | 126.7 Ų | 126.7 | 72% | 0.723 | 74% | 0.742 | S | S | * | * | | | trans | -88.4 | 110.8 | 175.7 | -58.5 | 174.7 | 0 | 0 | 0 | 107.8 | L288 | I286-L288 HydrophobicContact CG2-CD2 4.01Š|
| 287 | D | 79.6 | Confident | 66.7 | Low | 115 Ų | 115 | 127.3 Ų | 127.3 | 62% | 0.615 | 74% | 0.736 | S | S | * | * | | | trans | -77.5 | 120.2 | 172.7 | -176.9 | 13.9 | 0 | 0 | 0 | 110.5 | S289 | D287-S289 WeakPolarHBondContact OD1-CB 3.27Å; D287-S289 PolarHBondContact OD1-N 3.18Å; D287-S289 PolarHBondContact OD1-OG 3.06Å; D287-S289 PolarHBondContact OD2-OG 3.12Å |
| 288 | L | 75.9 | Confident | 66.4 | Low | 131 Ų | 131 | 129.5 Ų | 129.5 | 69% | 0.686 | 74% | 0.735 | S | S | * | * | | | trans | -97 | 7.2 | 178.5 | -60.8 | 179.8 | 0 | 0 | 0 | 112.8 | I286 S290 V291 | I286-L288 HydrophobicContact CG2-CD2 4.01Å; L288-S290 PolarHBondContact O-N 3.17Å; L288-V291 PolarHBondContact O-N 3.41Å |
| 289 | S | 73.4 | Confident | 66.4 | Low | 94 Ų | 94 | 130.9 Ų | 130.9 | 66% | 0.657 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61 | -17 | -175.5 | 67 | 0 | 0 | 0 | 0 | 114.8 | D287 | D287-S289 WeakPolarHBondContact OD1-CB 3.27Å; D287-S289 PolarHBondContact OD1-N 3.18Å; D287-S289 PolarHBondContact OD1-OG 3.06Å; D287-S289 PolarHBondContact OD2-OG 3.12Å |
| 290 | S | 66.9 | Low | 66.4 | Low | 103 Ų | 103 | 133.7 Ų | 133.7 | 72% | 0.72 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.9 | 2.6 | -174.9 | 53.7 | 0 | 0 | 0 | 0 | 115.5 | L288 Q292 | L288-S290 PolarHBondContact O-N 3.17Å; S290-Q292 PolarHBondContact O-N 3.15Å |
| 291 | V | 69 | Low | 66.4 | Low | 115 Ų | 115 | 130.7 Ų | 130.7 | 70% | 0.697 | 73% | 0.727 | S | S | * | * | | | trans | -82.9 | 83.7 | 177 | -171.3 | 0 | 0 | 0 | 0 | 110 | L288 K293 | L288-V291 PolarHBondContact O-N 3.41Å; V291-K293 PolarHBondContact O-N 2.76Å |
| 292 | Q | 68.5 | Low | 66.5 | Low | 186 Ų | 186 | 131.3 Ų | 131.3 | 87% | 0.869 | 73% | 0.725 | S | S | * | * | | | trans | -63.2 | 129 | 165.8 | -101.3 | 179.7 | -27.8 | 0 | 0 | 109.8 | S290 A294 | S290-Q292 PolarHBondContact O-N 3.15Å; Q292-A294 PolarHBondContact O-N 2.95Å |
| 293 | K | 66.5 | Low | 66.2 | Low | 207 Ų | 207 | 135 Ų | 135 | 90% | 0.9 | 74% | 0.742 | S | S | * | * | | | trans | -68.2 | 112.3 | 171.3 | -71.8 | -169.7 | 173.1 | -173.4 | 0 | 108.9 | V291 S295 | V291-K293 PolarHBondContact O-N 2.76Å; K293-S295 PolarHBondContact O-N 2.94Å |
| 294 | A | 62.5 | Low | 65.8 | Low | 93 Ų | 93 | 134.9 Ų | 134.9 | 77% | 0.769 | 73% | 0.729 | S | S | * | * | | | trans | -64.4 | 128.7 | 167.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | Q292 | Q292-A294 PolarHBondContact O-N 2.95Š|
| 295 | S | 60.4 | Low | 65.1 | Low | 80 Ų | 80 | 134.2 Ų | 134.2 | 56% | 0.559 | 73% | 0.733 | S | S | * | * | | | trans | -71.6 | 143.1 | 174.5 | 45 | 0 | 0 | 0 | 0 | 110.8 | K293 E297 | K293-S295 PolarHBondContact O-N 2.94Å; S295-E297 PolarHBondContact O-N 3.36Å |
| 296 | F | 66.1 | Low | 63.9 | Low | 162 Ų | 162 | 137.6 Ų | 137.6 | 71% | 0.711 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -65.7 | -6.2 | -174.3 | 60.9 | -91.2 | 0 | 0 | 0 | 114.9 | E298 | F296-E298 VanDerWaalsContact C-N 3.33Å; F296-E298 PolarHBondContact O-N 3.11Å |
| 297 | E | 62.5 | Low | 63 | Low | 143 Ų | 143 | 136.3 Ų | 136.3 | 67% | 0.668 | 73% | 0.73 | S | S | * | * | G | 310 helix | trans | -75.8 | -16.5 | -179.4 | -136.6 | 96.3 | -156.8 | 0 | 0 | 113.7 | S295 | S295-E297 PolarHBondContact O-N 3.36Š|
| 298 | E | 58.3 | Low | 61.9 | Low | 169 Ų | 169 | 138.1 Ų | 138.1 | 79% | 0.79 | 74% | 0.74 | S | S | * | * | G | 310 helix | trans | -94.3 | 6.8 | -173.1 | -144.7 | 171.1 | -167.1 | 0 | 0 | 113.5 | F296 | F296-E298 VanDerWaalsContact C-N 3.33Å; F296-E298 PolarHBondContact O-N 3.11Å |
| 299 | L | 60 | Low | 61 | Low | 142 Ų | 142 | 135.7 Ų | 135.7 | 74% | 0.743 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -91.9 | 9.7 | -177.4 | -94 | 163.6 | 0 | 0 | 0 | 114.9 | P301 | L299-P301 VanDerWaalsContact O-CD 3.27Å; L299-P301 WeakPolarHBondContact O-CD 3.5Å |
| 300 | F | 57.4 | Low | 60.1 | Low | 172 Ų | 172 | 138.5 Ų | 138.5 | 75% | 0.754 | 74% | 0.742 | S | S | * | * | | | trans | -100.4 | 101.9 | 170.2 | -63.9 | -73.1 | 0 | 0 | 0 | 109.6 | N302 | F300-N302 PolarHBondContact O-N 2.97Š|
| 301 | P | 62.3 | Low | 59.8 | Low | 110 Ų | 110 | 142 Ų | 142 | 71% | 0.714 | 75% | 0.747 | S | S | * | * | | | trans | -59.1 | 117.4 | 166.1 | 25 | -30 | 0 | 0 | 0 | 106.7 | L299 V303 | L299-P301 VanDerWaalsContact O-CD 3.27Å; L299-P301 WeakPolarHBondContact O-CD 3.5Å; P301-V303 VanDerWaalsContact C-N 3.26Å; P301-V303 PolarHBondContact O-N 3.33Å |
| 302 | N | 56.8 | Low | 59.3 | Low | 154 Ų | 154 | 144.6 Ų | 144.6 | 82% | 0.824 | 76% | 0.755 | S | S | * | * | | | trans | -56.1 | 91.4 | 173.9 | -163.7 | -6.5 | 0 | 0 | 0 | 108 | F300 S304 | F300-N302 PolarHBondContact O-N 2.97Å; N302-S304 PolarHBondContact O-N 2.71Å |
| 303 | V | 55.1 | Low | 58.7 | Low | 130 Ų | 130 | 141 Ų | 141 | 79% | 0.788 | 75% | 0.745 | S | S | * | * | | | trans | -73 | 82 | 169.2 | -99.5 | 0 | 0 | 0 | 0 | 106.2 | P301 N305 | P301-V303 VanDerWaalsContact C-N 3.26Å; P301-V303 PolarHBondContact O-N 3.33Å; V303-N305 PolarHBondContact O-N 3.41Å |
| 304 | S | 55.8 | Low | 58.5 | Low | 73 Ų | 73 | 136.5 Ų | 136.5 | 51% | 0.51 | 74% | 0.738 | S | S | . | * | | | trans | -54.4 | 121.3 | 164.9 | 58.1 | 0 | 0 | 0 | 0 | 108 | N302 Y306 | N302-S304 PolarHBondContact O-N 2.71Å; S304-Y306 PolarHBondContact O-N 3.26Å |
| 305 | N | 56.9 | Low | 58 | Low | 157 Ų | 157 | 138.7 Ų | 138.7 | 84% | 0.84 | 74% | 0.741 | S | S | * | * | | | trans | -61.6 | 77.8 | 168.2 | -75.2 | -36.2 | 0 | 0 | 0 | 109.6 | V303 V307 | V303-N305 PolarHBondContact O-N 3.41Å; N305-V307 VanDerWaalsContact C-N 3.29Å; N305-V307 PolarHBondContact O-N 3.11Å |
| 306 | Y | 54.2 | Low | 57.3 | Low | 212 Ų | 212 | 139.4 Ų | 139.4 | 83% | 0.831 | 75% | 0.746 | S | S | * | * | | | trans | -79.1 | 90.4 | 165.6 | -100.3 | -85.2 | 0 | 0 | 0 | 108.5 | S304 N308 | S304-Y306 PolarHBondContact O-N 3.26Å; Y306-N308 PolarHBondContact O-N 2.73Å; Y306-N308 VanDerWaalsContact O-N 3.13Å |
| 307 | V | 55.2 | Low | 56.2 | Low | 114 Ų | 114 | 136.8 Ų | 136.8 | 69% | 0.691 | 75% | 0.748 | S | S | * | * | | | trans | -35.3 | 106.2 | 153.4 | 175.2 | 0 | 0 | 0 | 0 | 110.1 | N305 S309 | N305-V307 VanDerWaalsContact C-N 3.29Å; N305-V307 PolarHBondContact O-N 3.11Å; V307-S309 VanDerWaalsContact CG1-OG 3.22Å; V307-S309 WeakPolarHBondContact CG1-OG 3.36Å |
| 308 | N | 56.2 | Low | 55.4 | Low | 153 Ų | 153 | 137.4 Ų | 137.4 | 82% | 0.818 | 76% | 0.755 | S | S | * | * | | | trans | -116 | 86.3 | 149.7 | -171.3 | 19.4 | 0 | 0 | 0 | 106.6 | Y306 N310 | Y306-N308 PolarHBondContact O-N 2.73Å; Y306-N308 VanDerWaalsContact O-N 3.13Å; N308-N310 PolarHBondContact O-N 3.34Å |
| 309 | S | 56.9 | Low | 55 | Low | 81 Ų | 81 | 136.3 Ų | 136.3 | 57% | 0.566 | 75% | 0.75 | S | S | * | * | | | trans | -56.9 | 129.2 | 171.2 | -46.7 | 0 | 0 | 0 | 0 | 109.2 | V307 | V307-S309 VanDerWaalsContact CG1-OG 3.22Å; V307-S309 WeakPolarHBondContact CG1-OG 3.36Å |
| 310 | N | 54.7 | Low | 54.3 | Low | 153 Ų | 153 | 137.4 Ų | 137.4 | 82% | 0.818 | 75% | 0.751 | S | S | * | * | | | trans | -170.1 | 87.3 | 137.6 | -77.5 | -27.2 | 0 | 0 | 0 | 107.1 | N308 | N308-N310 PolarHBondContact O-N 3.34Š|
| 311 | E | 60.6 | Low | 53.6 | Low | 176 Ų | 176 | 137 Ų | 137 | 82% | 0.822 | 76% | 0.757 | S | S | * | * | | | trans | 61 | 92.1 | 144.4 | -165 | 177.7 | -167.4 | 0 | 0 | 118.6 | | |
| 312 | I | 58.9 | Low | 52.9 | Low | 170 Ų | 170 | 137.4 Ų | 137.4 | 87% | 0.872 | 76% | 0.762 | S | S | * | * | | | trans | -141.8 | 114.5 | 130.1 | -50.3 | -179.8 | 0 | 0 | 0 | 107.3 | | |
| 313 | V | 54.7 | Low | 52.4 | Low | 109 Ų | 109 | 135.1 Ų | 135.1 | 66% | 0.661 | 76% | 0.758 | S | S | * | * | | | trans | -74.9 | 126.5 | -176.6 | 176.3 | 0 | 0 | 0 | 0 | 110.8 | V315 | V313-V315 HydrophobicContact CG1-CG2 4.31Š|
| 314 | P | 62.9 | Low | 52 | Low | 114 Ų | 114 | 136.5 Ų | 136.5 | 74% | 0.74 | 76% | 0.761 | S | S | * | * | | | trans | -87.2 | 110.3 | 155.8 | 29.9 | -22.4 | 0 | 0 | 0 | 108.6 | S316 | P314-S316 PolarHBondContact O-N 3.17Š|
| 315 | V | 51.3 | Low | 51.6 | Low | 138 Ų | 138 | 141.3 Ų | 141.3 | 84% | 0.836 | 78% | 0.776 | S | S | * | * | | | trans | -59.8 | 127.4 | 172.3 | 166.7 | 0 | 0 | 0 | 0 | 109.1 | V313 | V313-V315 HydrophobicContact CG1-CG2 4.31Š|
| 316 | S | 46.4 | Very low | 51.5 | Low | 96 Ų | 96 | 143.2 Ų | 143.2 | 67% | 0.671 | 78% | 0.777 | S | S | * | * | | | trans | -80.5 | 148.3 | -171.5 | -46.9 | 0 | 0 | 0 | 0 | 113.7 | P314 | P314-S316 PolarHBondContact O-N 3.17Š|
| 317 | S | 43.9 | Very low | 51.1 | Low | 107 Ų | 107 | 139.1 Ų | 139.1 | 75% | 0.748 | 78% | 0.776 | S | S | * | * | | | trans | 54.1 | 108.2 | 136.2 | 64.8 | 0 | 0 | 0 | 0 | 120.4 | | |
| 318 | L | 44.8 | Very low | 51.1 | Low | 156 Ų | 156 | 137.9 Ų | 137.9 | 82% | 0.817 | 78% | 0.778 | S | S | * | * | | | trans | -156 | 101.9 | 137.9 | -146.3 | 63.4 | 0 | 0 | 0 | 105 | | |
| 319 | Q | 50.1 | Low | 51 | Low | 146 Ų | 146 | 137 Ų | 137 | 68% | 0.682 | 77% | 0.773 | S | S | * | * | | | | 111.6 | 146.1 | 86.8 | 171.8 | 156.7 | -11.9 | 0 | 0 | 108.9 | | |
| 320 | E | 45.4 | Very low | 50.9 | Low | 165 Ų | 165 | 137.8 Ų | 137.8 | 77% | 0.771 | 78% | 0.784 | S | S | * | * | | | trans | 97.1 | 116.3 | 167.8 | -79.1 | 152.5 | -148.7 | 0 | 0 | 118.4 | | |
| 321 | N | 41.8 | Very low | 51.2 | Low | 164 Ų | 164 | 134.2 Ų | 134.2 | 88% | 0.877 | 77% | 0.772 | S | S | * | * | | | trans | -95.3 | 129 | -174.3 | -40.9 | -51.9 | 0 | 0 | 0 | 107.3 | | |
| 322 | S | 48.8 | Very low | 51.8 | Low | 117 Ų | 117 | 135 Ų | 135 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | | | trans | -155.1 | 111.8 | 150.6 | 63.9 | 0 | 0 | 0 | 0 | 109.8 | | |
| 323 | S | 44.8 | Very low | 52.5 | Low | 107 Ų | 107 | 133.9 Ų | 133.9 | 75% | 0.748 | 77% | 0.769 | S | S | * | * | | | trans | -54.7 | 130.6 | 166.7 | 47 | 0 | 0 | 0 | 0 | 111.5 | | |
| 324 | N | 48.4 | Very low | 53.3 | Low | 158 Ų | 158 | 134.3 Ų | 134.3 | 85% | 0.845 | 78% | 0.776 | S | S | * | * | | | trans | -169.5 | 99.3 | 139.5 | -84.4 | -21.5 | 0 | 0 | 0 | 109.4 | | |
| 325 | E | 47.6 | Very low | 54 | Low | 175 Ų | 175 | 133.3 Ų | 133.3 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | | | trans | 4.6 | 117.7 | 138.8 | -170.6 | 170.6 | -167.1 | 0 | 0 | 118 | | |
| 326 | F | 53.7 | Low | 55.4 | Low | 197 Ų | 197 | 134 Ų | 134 | 86% | 0.864 | 77% | 0.768 | S | S | * | * | | | trans | -167.3 | 113.4 | 140.5 | -98.5 | -72 | 0 | 0 | 0 | 109.5 | A328 | F326-A328 PolarHBondContact O-N 3.37Š|
| 327 | P | 46.4 | Very low | 56.9 | Low | 126 Ų | 126 | 136.2 Ų | 136.2 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | | | trans | -91.8 | 82.8 | 171.3 | 34.6 | -26.1 | 0 | 0 | 0 | 108.3 | N329 | P327-N329 PolarHBondContact O-N 3.5Š|
| 328 | A | 54.2 | Low | 58.6 | Low | 87 Ų | 87 | 142 Ų | 142 | 72% | 0.719 | 78% | 0.776 | S | S | * | * | | | trans | -95.9 | 93.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | F326 A330 | F326-A328 PolarHBondContact O-N 3.37Å; A328-A330 PolarHBondContact O-N 3.48Å |
| 329 | N | 53.8 | Low | 60 | Low | 134 Ų | 134 | 140.3 Ų | 140.3 | 72% | 0.717 | 77% | 0.773 | S | S | * | * | | | trans | 17.4 | 93.6 | 144.2 | -176.6 | 0.3 | 0 | 0 | 0 | 115.1 | P327 S331 | P327-N329 PolarHBondContact O-N 3.5Å; N329-S331 PolarHBondContact ND2-OG 3.21Å; N329-S331 PolarHBondContact O-N 2.78Å; N329-S331 PolarHBondContact OD1-N 3.41Å; N329-S331 PolarHBondContact OD1-OG 3.19Å |
| 330 | A | 55.2 | Low | 61.1 | Low | 98 Ų | 98 | 138.2 Ų | 138.2 | 81% | 0.81 | 78% | 0.775 | S | S | * | * | | | trans | -70.8 | 75.9 | 167.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | A328 E332 | A328-A330 PolarHBondContact O-N 3.48Å; A330-E332 PolarHBondContact O-N 3.42Å |
| 331 | S | 62 | Low | 62.4 | Low | 79 Ų | 79 | 136.6 Ų | 136.6 | 55% | 0.552 | 78% | 0.778 | S | S | * | * | | | trans | -68.8 | 111.2 | 164.9 | -67.3 | 0 | 0 | 0 | 0 | 107.7 | N329 I333 | N329-S331 PolarHBondContact ND2-OG 3.21Å; N329-S331 PolarHBondContact O-N 2.78Å; N329-S331 PolarHBondContact OD1-N 3.41Å; N329-S331 PolarHBondContact OD1-OG 3.19Å; S331-I333 PolarHBondContact O-N 3.18Å |
| 332 | E | 72 | Confident | 63.6 | Low | 193 Ų | 193 | 131.9 Ų | 131.9 | 90% | 0.902 | 77% | 0.769 | S | S | * | * | | | trans | -60.5 | 99.6 | 171 | -70.2 | 179.4 | 171.7 | 0 | 0 | 109.2 | A330 C334 | A330-E332 PolarHBondContact O-N 3.42Å; E332-C334 PolarHBondContact O-N 2.99Å; E332-C334 VanDerWaalsContact O-N 3.12Å |
| 333 | I | 74.1 | Confident | 64.4 | Low | 145 Ų | 145 | 132.9 Ų | 132.9 | 74% | 0.744 | 77% | 0.77 | S | S | * | * | | | trans | -78.1 | 98.1 | 175.4 | -52.9 | 172.1 | 0 | 0 | 0 | 107.5 | S331 C335 | S331-I333 PolarHBondContact O-N 3.18Å; I333-C335 PolarHBondContact O-N 3.34Å |
| 334 | C | 72.9 | Confident | 65.2 | Low | 118 Ų | 118 | 138.5 Ų | 138.5 | 80% | 0.797 | 78% | 0.775 | S | S | * | * | | | trans | -75.6 | 99.8 | 171.1 | -174.9 | 0 | 0 | 0 | 0 | 109.9 | E332 I336 | E332-C334 PolarHBondContact O-N 2.99Å; E332-C334 VanDerWaalsContact O-N 3.12Å; C334-I336 PolarHBondContact O-N 3.3Å |
| 335 | C | 75.9 | Confident | 66 | Low | 94 Ų | 94 | 139.3 Ų | 139.3 | 64% | 0.635 | 77% | 0.774 | S | S | * | * | | | trans | -76.2 | 116.7 | 174.7 | -52.8 | 0 | 0 | 0 | 0 | 110.9 | I333 I337 | I333-C335 PolarHBondContact O-N 3.34Å; C335-I337 PolarHBondContact O-N 2.88Å; C335-I337 VanDerWaalsContact O-N 3.15Å |
| 336 | I | 80.7 | Confident | 66.8 | Low | 153 Ų | 153 | 135.4 Ų | 135.4 | 79% | 0.785 | 76% | 0.761 | S | S | * | * | | | trans | -78.9 | 95.3 | 166.9 | -58.3 | 175.3 | 0 | 0 | 0 | 108.2 | C334 R338 | C334-I336 PolarHBondContact O-N 3.3Å; I336-R338 PolarHBondContact O-N 3.2Å; I336-R338 VanDerWaalsContact O-N 3.11Å |
| 337 | I | 79.4 | Confident | 67.4 | Low | 141 Ų | 141 | 135.5 Ų | 135.5 | 72% | 0.723 | 76% | 0.761 | S | S | * | * | | | trans | -71.8 | 105.2 | 171.8 | -56.8 | 176.4 | 0 | 0 | 0 | 107.8 | C335 T339 | C335-I337 PolarHBondContact O-N 2.88Å; C335-I337 VanDerWaalsContact O-N 3.15Å; I337-T339 PolarHBondContact O-N 2.85Å |
| 338 | R | 78.1 | Confident | 68.2 | Low | 228 Ų | 228 | 136 Ų | 136 | 86% | 0.86 | 76% | 0.757 | S | S | * | * | | | trans | -66.7 | 96.7 | 166.9 | -78.6 | -179.7 | 64.5 | -170.9 | -0.5 | 108.3 | I336 S340 | I336-R338 PolarHBondContact O-N 3.2Å; I336-R338 VanDerWaalsContact O-N 3.11Å; R338-S340 PolarHBondContact O-N 2.99Å |
| 339 | T | 75.5 | Confident | 68.9 | Low | 122 Ų | 122 | 141.1 Ų | 141.1 | 75% | 0.748 | 76% | 0.763 | S | S | * | * | | | trans | -63 | 123.9 | 162.6 | 57.4 | 0 | 0 | 0 | 0 | 107.7 | I337 | I337-T339 PolarHBondContact O-N 2.85Š|
| 340 | S | 71.7 | Confident | 68.9 | Low | 102 Ų | 102 | 137.9 Ų | 137.9 | 71% | 0.713 | 76% | 0.762 | S | S | * | * | | | trans | -49.7 | 143.3 | 168.2 | 22.8 | 0 | 0 | 0 | 0 | 109.3 | R338 G342 | R338-S340 PolarHBondContact O-N 2.99Å; S340-G342 VanDerWaalsContact C-N 3.29Å; S340-G342 PolarHBondContact O-N 3.34Å |
| 341 | P | 72.6 | Confident | 69.3 | Low | 130 Ų | 130 | 139.2 Ų | 139.2 | 84% | 0.844 | 76% | 0.759 | S | S | * | * | | | trans | -64.1 | 95.2 | 179.9 | 18.7 | -21.7 | 0 | 0 | 0 | 108.5 | T343 | P341-T343 PolarHBondContact O-N 3.45Š|
| 342 | G | 68.5 | Low | 69.5 | Low | 66 Ų | 66 | 143 Ų | 143 | 68% | 0.68 | 77% | 0.772 | S | S | * | * | | | trans | -60.6 | 127.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | S340 R344 | S340-G342 VanDerWaalsContact C-N 3.29Å; S340-G342 PolarHBondContact O-N 3.34Å; G342-R344 PolarHBondContact O-N 3.01Å |
| 343 | T | 65.6 | Low | 69.2 | Low | 138 Ų | 138 | 139.4 Ų | 139.4 | 85% | 0.847 | 76% | 0.762 | S | S | * | * | | | trans | -66.2 | 72.8 | 170.6 | 27.8 | 0 | 0 | 0 | 0 | 109.5 | P341 Q345 | P341-T343 PolarHBondContact O-N 3.45Å; T343-Q345 PolarHBondContact O-N 3.25Å |
| 344 | R | 61.7 | Low | 68.9 | Low | 225 Ų | 225 | 141.6 Ų | 141.6 | 85% | 0.849 | 77% | 0.767 | S | S | * | * | | | trans | -66.8 | 103.4 | 167.1 | -161.6 | 177.4 | -169.3 | -144.8 | 3.6 | 106.7 | G342 V346 | G342-R344 PolarHBondContact O-N 3.01Å; R344-V346 PolarHBondContact O-N 3.44Å |
| 345 | Q | 65 | Low | 68.4 | Low | 175 Ų | 175 | 145.8 Ų | 145.8 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | | | trans | -58.9 | 88.6 | 166.3 | -72.2 | -105.7 | 24.1 | 0 | 0 | 107.9 | T343 K347 | T343-Q345 PolarHBondContact O-N 3.25Å; Q345-K347 PolarHBondContact O-N 3.4Å; Q345-K347 VanDerWaalsContact O-N 3.08Å |
| 346 | V | 64.7 | Low | 68 | Low | 93 Ų | 93 | 149.1 Ų | 149.1 | 56% | 0.564 | 78% | 0.775 | S | S | * | * | | | trans | -70.1 | 104.6 | 167.8 | 177.4 | 0 | 0 | 0 | 0 | 105.8 | R344 N348 | R344-V346 PolarHBondContact O-N 3.44Å; V346-N348 VanDerWaalsContact CG1-OD1 3.24Å; V346-N348 WeakPolarHBondContact CG1-OD1 3.24Å; V346-N348 PolarHBondContact O-N 3.24Å |
| 347 | K | 64.8 | Low | 67.4 | Low | 198 Ų | 198 | 151.5 Ų | 151.5 | 86% | 0.861 | 78% | 0.78 | S | S | * | * | | | trans | -65.3 | 77.7 | 165.9 | -70.9 | -178.2 | 178.9 | 177.8 | 0 | 108.1 | Q345 K349 | Q345-K347 PolarHBondContact O-N 3.4Å; Q345-K347 VanDerWaalsContact O-N 3.08Å; K347-K349 PolarHBondContact O-N 3.12Å |
| 348 | N | 63.9 | Low | 66.4 | Low | 137 Ų | 137 | 154.4 Ų | 154.4 | 73% | 0.733 | 78% | 0.783 | S | S | * | * | | | trans | -67.9 | 102.3 | 166.7 | -85.9 | -18.7 | 0 | 0 | 0 | 106.9 | V346 G350 | V346-N348 VanDerWaalsContact CG1-OD1 3.24Å; V346-N348 WeakPolarHBondContact CG1-OD1 3.24Å; V346-N348 PolarHBondContact O-N 3.24Å; N348-G350 VanDerWaalsContact C-N 3.29Å; N348-G350 PolarHBondContact O-N 2.88Å |
| 349 | K | 69.1 | Low | 65.9 | Low | 195 Ų | 195 | 148.7 Ų | 148.7 | 85% | 0.848 | 78% | 0.778 | S | S | * | * | | | trans | -61.8 | 99.8 | 161.9 | -70.1 | -174.1 | 177.1 | -176.3 | 0 | 106.1 | K347 V351 | K347-K349 PolarHBondContact O-N 3.12Å; K349-V351 PolarHBondContact O-N 3.31Å |
| 350 | G | 54.1 | Low | 65.5 | Low | 66 Ų | 66 | 149.9 Ų | 149.9 | 68% | 0.68 | 78% | 0.779 | S | S | * | * | | | trans | -57.4 | 109.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 110 | N348 I352 | N348-G350 VanDerWaalsContact C-N 3.29Å; N348-G350 PolarHBondContact O-N 2.88Å; G350-I352 PolarHBondContact O-N 2.94Å |
| 351 | V | 64 | Low | 65.3 | Low | 126 Ų | 126 | 149.8 Ų | 149.8 | 76% | 0.764 | 78% | 0.776 | S | S | * | * | | | trans | -70.4 | 112.9 | 164.1 | 176.5 | 0 | 0 | 0 | 0 | 106.1 | K349 V353 | K349-V351 PolarHBondContact O-N 3.31Å; V351-V353 VanDerWaalsContact C-N 3.28Å; V351-V353 HydrophobicContact CG1-CG2 4.07Å; V351-V353 PolarHBondContact O-N 3.31Å |
| 352 | I | 64.9 | Low | 65 | Low | 159 Ų | 159 | 154 Ų | 154 | 82% | 0.815 | 78% | 0.781 | S | S | * | * | | | trans | -68.5 | 90.1 | 172.4 | -58.5 | 172.5 | 0 | 0 | 0 | 107.1 | G350 K354 | G350-I352 PolarHBondContact O-N 2.94Å; I352-K354 PolarHBondContact O-N 3.12Å |
| 353 | V | 65.7 | Low | 65 | Low | 116 Ų | 116 | 158 Ų | 158 | 70% | 0.703 | 79% | 0.787 | S | S | * | * | | | trans | -77 | 109.2 | 168.5 | -175.8 | 0 | 0 | 0 | 0 | 106.8 | V351 K355 | V351-V353 VanDerWaalsContact C-N 3.28Å; V351-V353 HydrophobicContact CG1-CG2 4.07Å; V351-V353 PolarHBondContact O-N 3.31Å; V353-K355 PolarHBondContact O-N 3.34Å |
| 354 | K | 68.3 | Low | 64.8 | Low | 191 Ų | 191 | 156 Ų | 156 | 83% | 0.83 | 78% | 0.775 | S | S | * | * | | | trans | -54.2 | 112.2 | 171.7 | -73.9 | -166.4 | 173.1 | -177.3 | 0 | 108.5 | I352 K356 | I352-K354 PolarHBondContact O-N 3.12Å; K354-K356 PolarHBondContact O-N 2.82Å |
| 355 | K | 63.1 | Low | 65.1 | Low | 207 Ų | 207 | 150.9 Ų | 150.9 | 90% | 0.9 | 77% | 0.77 | S | S | * | * | | | trans | -60.1 | 102.5 | 172.7 | -76.5 | -171.8 | 173.3 | -178.3 | 0 | 108.8 | V353 K357 | V353-K355 PolarHBondContact O-N 3.34Å; K355-K357 PolarHBondContact O-N 3.23Å |
| 356 | K | 66.6 | Low | 65.1 | Low | 163 Ų | 163 | 150.8 Ų | 150.8 | 71% | 0.709 | 77% | 0.77 | S | S | * | * | | | trans | -70.3 | 124.3 | 163.2 | -160.4 | 168.5 | -177.3 | 176.3 | 0 | 106.5 | K354 Y358 | K354-K356 PolarHBondContact O-N 2.82Å; K356-Y358 HydrophobicContact CB-CE2 4.17Å; K356-Y358 WeakPolarHBondContact O-CD2 3.29Å; K356-Y358 PolarHBondContact O-N 3.26Å |
| 357 | K | 68.7 | Low | 65.1 | Low | 203 Ų | 203 | 153.3 Ų | 153.3 | 88% | 0.883 | 78% | 0.78 | S | S | * | * | | | trans | -62.8 | 100.6 | 173.7 | -72.3 | -176.9 | 176.8 | -178.4 | 0 | 107.7 | K355 S359 | K355-K357 PolarHBondContact O-N 3.23Å; K357-S359 PolarHBondContact O-N 3.33Å |
| 358 | Y | 58.5 | Low | 65.4 | Low | 202 Ų | 202 | 150.5 Ų | 150.5 | 79% | 0.792 | 77% | 0.773 | S | S | * | * | | | trans | -81.6 | 106.8 | 165.1 | -75.4 | -86.4 | 0 | 0 | 0 | 107.1 | K356 | K356-Y358 HydrophobicContact CB-CE2 4.17Å; K356-Y358 WeakPolarHBondContact O-CD2 3.29Å; K356-Y358 PolarHBondContact O-N 3.26Å |
| 359 | S | 66.3 | Low | 65.6 | Low | 109 Ų | 109 | 151.4 Ų | 151.4 | 76% | 0.762 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 135 | 162.9 | 39.1 | 0 | 0 | 0 | 0 | 109 | K357 | K357-S359 PolarHBondContact O-N 3.33Š|
| 360 | L | 67.6 | Low | 65.5 | Low | 146 Ų | 146 | 148.3 Ų | 148.3 | 76% | 0.764 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 142.9 | 173.2 | -103.3 | 82.7 | 0 | 0 | 0 | 110.5 | K362 | L360-K362 PolarHBondContact O-N 3.32Š|
| 361 | P | 66.8 | Low | 66.1 | Low | 100 Ų | 100 | 154.4 Ų | 154.4 | 65% | 0.649 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 127.5 | 167.9 | -12.4 | 26.2 | 0 | 0 | 0 | 108.8 | D363 | P361-D363 PolarHBondContact O-N 3.26Š|
| 362 | K | 66.1 | Low | 65.8 | Low | 219 Ų | 219 | 156.5 Ų | 156.5 | 95% | 0.952 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -74.9 | 22.8 | -176 | -76.6 | -174.5 | 173.5 | -176.6 | 0 | 114.4 | L360 | L360-K362 PolarHBondContact O-N 3.32Š|
| 363 | D | 69 | Low | 65.9 | Low | 151 Ų | 151 | 157.3 Ų | 157.3 | 81% | 0.807 | 81% | 0.81 | S | S | * | * | | | trans | -140.4 | 34.5 | -166.8 | -153 | 25.2 | 0 | 0 | 0 | 114.4 | P361 | P361-D363 PolarHBondContact O-N 3.26Š|
| 364 | T | 61.8 | Low | 65.9 | Low | 96 Ų | 96 | 159.4 Ų | 159.4 | 59% | 0.589 | 82% | 0.815 | S | S | * | * | | | trans | -96.7 | 119.4 | 169.4 | 51.7 | 0 | 0 | 0 | 0 | 109.6 | Q366 | T364-Q366 PolarHBondContact O-N 2.97Š|
| 365 | P | 69.1 | Low | 65.8 | Low | 116 Ų | 116 | 157.7 Ų | 157.7 | 75% | 0.753 | 81% | 0.814 | S | S | * | * | | | trans | -61.1 | 131.3 | 171.8 | 25.6 | -31.2 | 0 | 0 | 0 | 108.9 | D367 | P365-D367 PolarHBondContact O-N 3.2Å; P365-D367 VanDerWaalsContact O-N 3.11Å |
| 366 | Q | 64.4 | Low | 66 | Low | 173 Ų | 173 | 155 Ų | 155 | 81% | 0.808 | 81% | 0.809 | S | S | * | * | | | trans | -68.7 | 105.8 | 172.3 | -85.6 | 124.9 | 19.5 | 0 | 0 | 108.5 | T364 I368 | T364-Q366 PolarHBondContact O-N 2.97Å; Q366-I368 VanDerWaalsContact C-N 3.35Å; Q366-I368 PolarHBondContact O-N 3.29Å |
| 367 | D | 65 | Low | 65.9 | Low | 147 Ų | 147 | 154.5 Ų | 154.5 | 79% | 0.786 | 82% | 0.815 | S | S | * | * | | | trans | -64.9 | 98.6 | 162.8 | -82.1 | -19.4 | 0 | 0 | 0 | 108.2 | P365 I369 | P365-D367 PolarHBondContact O-N 3.2Å; P365-D367 VanDerWaalsContact O-N 3.11Å; D367-I369 PolarHBondContact O-N 3.13Å |
| 368 | I | 69.9 | Low | 65.8 | Low | 139 Ų | 139 | 151.5 Ų | 151.5 | 71% | 0.713 | 81% | 0.811 | S | S | * | * | | | trans | -76.8 | 97.7 | 172.8 | -56.5 | 173.2 | 0 | 0 | 0 | 107.1 | Q366 I370 | Q366-I368 VanDerWaalsContact C-N 3.35Å; Q366-I368 PolarHBondContact O-N 3.29Å; I368-I370 HydrophobicContact CG2-CD1 4.33Å; I368-I370 HydrophobicContact CG2-CG1 3.67Å; I368-I370 PolarHBondContact O-N 3.17Å |
| 369 | I | 68.3 | Low | 66.2 | Low | 155 Ų | 155 | 148.1 Ų | 148.1 | 80% | 0.795 | 81% | 0.812 | S | S | * | * | | | trans | -79 | 95.8 | 167.7 | -58.9 | 175.7 | 0 | 0 | 0 | 107.6 | D367 K371 | D367-I369 PolarHBondContact O-N 3.13Å; I369-K371 PolarHBondContact O-N 3.34Å |
| 370 | I | 67.5 | Low | 66.2 | Low | 130 Ų | 130 | 150.9 Ų | 150.9 | 67% | 0.667 | 82% | 0.816 | S | S | * | * | | | trans | -78 | 113.4 | 168.3 | -56.1 | -179.6 | 0 | 0 | 0 | 107.7 | I368 | I368-I370 HydrophobicContact CG2-CD1 4.33Å; I368-I370 HydrophobicContact CG2-CG1 3.67Å; I368-I370 PolarHBondContact O-N 3.17Å |
| 371 | K | 66.2 | Low | 66.1 | Low | 195 Ų | 195 | 151.3 Ų | 151.3 | 85% | 0.848 | 82% | 0.82 | S | S | * | * | | | trans | -88.4 | 103.8 | 170.2 | -154.1 | 177.8 | -174.7 | -177 | 0 | 107.5 | I369 | I369-K371 PolarHBondContact O-N 3.34Š|
| 372 | M | 59 | Low | 66.1 | Low | 170 Ų | 170 | 155.6 Ų | 155.6 | 84% | 0.837 | 83% | 0.834 | S | S | * | * | | | trans | -69.3 | 131.3 | 170.8 | -68.6 | -82.6 | -86.3 | 0 | 0 | 108.5 | | |
| 373 | A | 66.5 | Low | 66.1 | Low | 176 Ų | 176 | 149.8 Ų | 149.8 | 100% | 1.455 | 82% | 0.823 | S | S | * | * | | | trans | -74.3 | 0 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | | |