| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.8 | Very low | 51.5 | Low | 250 Ų | 250 | 151.1 Ų | 151.1 | 100% | 1.232 | 88% | 0.875 | S | S | * | * | 0 | 136.4 | 0 | -76 | -160 | 157.8 | 0 | 0 | 108.4 | |||||
| 2 | A | 47.1 | Very low | 51.5 | Low | 99 Ų | 99 | 148.7 Ų | 148.7 | 82% | 0.818 | 87% | 0.869 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 143.6 | -155.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 3 | T | 53.5 | Low | 51.4 | Low | 143 Ų | 143 | 150.9 Ų | 150.9 | 88% | 0.877 | 87% | 0.873 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 122 | 165.9 | 40.9 | 0 | 0 | 0 | 0 | 109.4 | G5 | T3-G5 PolarHBondContact O-N 3.44Š|
| 4 | L | 56.1 | Low | 50.7 | Low | 178 Ų | 178 | 148.4 Ų | 148.4 | 93% | 0.932 | 87% | 0.868 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 116.7 | -179.5 | -71.3 | 164.3 | 0 | 0 | 0 | 110.4 | ||
| 5 | G | 52.3 | Low | 50.1 | Low | 72 Ų | 72 | 143.4 Ų | 143.4 | 74% | 0.742 | 86% | 0.861 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 135.9 | 169.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | T3 | T3-G5 PolarHBondContact O-N 3.44Š|
| 6 | R | 64.1 | Low | 49.5 | Very low | 233 Ų | 233 | 141 Ų | 141 | 88% | 0.879 | 85% | 0.853 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 135.3 | 169.2 | -72.6 | 177.9 | 171.1 | -126.7 | -0.2 | 109.7 | ||
| 7 | P | 58.1 | Low | 49.2 | Very low | 120 Ų | 120 | 139.3 Ų | 139.3 | 78% | 0.779 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -75 | 127 | 168.6 | 29.2 | -30.5 | 0 | 0 | 0 | 109.9 | S9 | P7-S9 PolarHBondContact O-N 3.41Š|
| 8 | F | 45.1 | Very low | 49 | Very low | 213 Ų | 213 | 140.8 Ų | 140.8 | 93% | 0.934 | 85% | 0.852 | S | S | * | * | P | Polyproline II helix | trans | -65 | 128.3 | 167.2 | -84.8 | -91.4 | 0 | 0 | 0 | 109.4 | ||
| 9 | S | 55.9 | Low | 48.9 | Very low | 115 Ų | 115 | 143.4 Ų | 143.4 | 80% | 0.804 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 129 | 174.7 | -43.9 | 0 | 0 | 0 | 0 | 109.7 | P7 | P7-S9 PolarHBondContact O-N 3.41Š|
| 10 | G | 42 | Very low | 49.1 | Very low | 75 Ų | 75 | 143.7 Ų | 143.7 | 77% | 0.773 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -62 | 146.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 11 | L | 50.9 | Low | 49.2 | Very low | 164 Ų | 164 | 145.8 Ų | 145.8 | 86% | 0.859 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -83.7 | 138.3 | 167.8 | -66.8 | 169.5 | 0 | 0 | 0 | 109 | L13 | L11-L13 PolarHBondContact O-N 3.36Š|
| 12 | P | 51.6 | Low | 49.7 | Very low | 122 Ų | 122 | 139.2 Ų | 139.2 | 79% | 0.792 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 126.9 | 175.4 | 28.7 | -31.4 | 0 | 0 | 0 | 110.6 | S14 | P12-S14 PolarHBondContact O-N 3.34Š|
| 13 | L | 49 | Very low | 50.5 | Low | 178 Ų | 178 | 139.8 Ų | 139.8 | 93% | 0.932 | 82% | 0.82 | S | S | * | * | trans | -68.3 | 108.8 | 161.9 | -64.8 | 168.6 | 0 | 0 | 0 | 107.6 | L11 | L11-L13 PolarHBondContact O-N 3.36Š| ||
| 14 | S | 42.1 | Very low | 50.4 | Low | 115 Ų | 115 | 139 Ų | 139 | 80% | 0.804 | 82% | 0.817 | S | S | * | * | trans | -101.9 | 107 | 165 | -167.5 | 0 | 0 | 0 | 0 | 108.5 | P12 | P12-S14 PolarHBondContact O-N 3.34Š| ||
| 15 | G | 41.5 | Very low | 50.2 | Low | 74 Ų | 74 | 139.1 Ų | 139.1 | 76% | 0.763 | 81% | 0.813 | S | S | * | * | trans | -101.9 | 126.8 | 165.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 16 | S | 41 | Very low | 50.1 | Low | 105 Ų | 105 | 140.8 Ų | 140.8 | 73% | 0.734 | 81% | 0.811 | S | S | * | * | trans | -175.6 | 110.1 | 149.8 | 41.3 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 17 | S | 44.4 | Very low | 48.9 | Very low | 112 Ų | 112 | 134.4 Ų | 134.4 | 78% | 0.783 | 81% | 0.808 | S | S | * | * | 48.3 | 83.2 | 85.7 | -172.5 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 18 | D | 44.6 | Very low | 48.2 | Very low | 167 Ų | 167 | 137.9 Ų | 137.9 | 89% | 0.893 | 81% | 0.811 | S | S | * | * | trans | -140.9 | 111.2 | 137.1 | -100.4 | -40.6 | 0 | 0 | 0 | 109.1 | ||||
| 19 | F | 47 | Very low | 48.4 | Very low | 189 Ų | 189 | 133.7 Ų | 133.7 | 83% | 0.829 | 81% | 0.805 | S | S | * | * | trans | -79.9 | 140.1 | 173 | -140 | -108.9 | 0 | 0 | 0 | 106.9 | ||||
| 20 | L | 53.6 | Low | 47.5 | Very low | 149 Ų | 149 | 132 Ų | 132 | 78% | 0.78 | 81% | 0.806 | S | S | * | * | trans | 82.4 | 82.7 | 167.1 | -46 | 179.2 | 0 | 0 | 0 | 118.2 | ||||
| 21 | Q | 50.8 | Low | 47.4 | Very low | 188 Ų | 188 | 139.2 Ų | 139.2 | 88% | 0.879 | 81% | 0.81 | S | S | * | * | trans | -149.8 | 118.4 | 143.1 | -159.1 | 158 | -49.4 | 0 | 0 | 111.5 | ||||
| 22 | P | 53.7 | Low | 46.8 | Very low | 112 Ų | 112 | 136.1 Ų | 136.1 | 73% | 0.727 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 147.6 | 170.3 | 29.7 | -30.3 | 0 | 0 | 0 | 110.6 | ||
| 23 | P | 62.6 | Low | 46.5 | Very low | 112 Ų | 112 | 139.1 Ų | 139.1 | 73% | 0.727 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 147.3 | 177.7 | 28.1 | -33.1 | 0 | 0 | 0 | 111.4 | Q25 | P23-Q25 PolarHBondContact O-N 3.09Š|
| 24 | P | 52.2 | Low | 47 | Very low | 126 Ų | 126 | 136.1 Ų | 136.1 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 128 | 178.6 | 27.9 | -31.7 | 0 | 0 | 0 | 110.8 | ||
| 25 | Q | 51.5 | Low | 47.2 | Very low | 180 Ų | 180 | 137.2 Ų | 137.2 | 84% | 0.841 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 136.2 | 172.7 | -63.5 | -97.9 | -38.8 | 0 | 0 | 110 | P23 A27 | P23-Q25 PolarHBondContact O-N 3.09Å; Q25-A27 PolarHBondContact O-N 3.27Å |
| 26 | P | 49.9 | Very low | 46.9 | Very low | 108 Ų | 108 | 137.3 Ų | 137.3 | 70% | 0.701 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 119.2 | 170.3 | 27.5 | -29.1 | 0 | 0 | 0 | 109.9 | F28 | P26-F28 PolarHBondContact O-N 3.46Š|
| 27 | A | 39.4 | Very low | 46.6 | Very low | 98 Ų | 98 | 137 Ų | 137 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 121.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111 | Q25 | Q25-A27 PolarHBondContact O-N 3.27Š|
| 28 | F | 44.3 | Very low | 46.4 | Very low | 194 Ų | 194 | 139.8 Ų | 139.8 | 85% | 0.851 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 127.3 | 165.4 | -69.2 | -85.8 | 0 | 0 | 0 | 109.3 | P26 G30 | P26-F28 PolarHBondContact O-N 3.46Å; F28-G30 PolarHBondContact O-N 3.28Å |
| 29 | P | 47.5 | Very low | 45.9 | Very low | 125 Ų | 125 | 135.3 Ų | 135.3 | 81% | 0.812 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 125.1 | 173 | 30.5 | -29.3 | 0 | 0 | 0 | 108.9 | ||
| 30 | G | 37 | Very low | 45.4 | Very low | 80 Ų | 80 | 131.1 Ų | 131.1 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 143.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | F28 | F28-G30 PolarHBondContact O-N 3.28Š|
| 31 | R | 41.3 | Very low | 44.9 | Very low | 225 Ų | 225 | 131.2 Ų | 131.2 | 85% | 0.849 | 81% | 0.81 | S | S | * | * | trans | -124.9 | 109 | 157.8 | -141.7 | 177.7 | -158.4 | -100.6 | 2.6 | 107.3 | ||||
| 32 | A | 37.3 | Very low | 44.5 | Very low | 99 Ų | 99 | 129.7 Ų | 129.7 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 131.3 | 172 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 33 | F | 45.1 | Very low | 43.9 | Very low | 186 Ų | 186 | 128.6 Ų | 128.6 | 82% | 0.816 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -98.3 | 137 | 165 | -71.5 | -84.1 | 0 | 0 | 0 | 108.7 | ||
| 34 | P | 60 | Low | 43.1 | Very low | 115 Ų | 115 | 128.6 Ų | 128.6 | 75% | 0.747 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 148.8 | 169.3 | 33.2 | -31.5 | 0 | 0 | 0 | 110.3 | ||
| 35 | P | 46.9 | Very low | 42.6 | Very low | 138 Ų | 138 | 133.8 Ų | 133.8 | 90% | 0.896 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 134.4 | 168.8 | 34 | -27.4 | 0 | 0 | 0 | 109.8 | ||
| 36 | G | 34.3 | Very low | 41.8 | Very low | 75 Ų | 75 | 130.6 Ų | 130.6 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | trans | -176.1 | 101.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 37 | A | 35.9 | Very low | 41.1 | Very low | 98 Ų | 98 | 128.9 Ų | 128.9 | 81% | 0.81 | 81% | 0.811 | S | S | * | * | trans | 62.2 | 119.3 | 142.1 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 38 | D | 39.4 | Very low | 41.4 | Very low | 171 Ų | 171 | 130.7 Ų | 130.7 | 91% | 0.914 | 81% | 0.814 | S | S | * | * | trans | 17.8 | 134 | 137.9 | -72.8 | -41.2 | 0 | 0 | 0 | 121.2 | ||||
| 39 | G | 34.8 | Very low | 41.4 | Very low | 73 Ų | 73 | 133.3 Ų | 133.3 | 75% | 0.753 | 82% | 0.818 | S | S | * | * | trans | 128.1 | 129.9 | 131.4 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 40 | A | 36.8 | Very low | 40.8 | Very low | 101 Ų | 101 | 131.6 Ų | 131.6 | 84% | 0.835 | 82% | 0.815 | S | S | * | * | trans | 79.7 | 95.4 | 156.5 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 41 | D | 42.9 | Very low | 41.3 | Very low | 152 Ų | 152 | 134.3 Ų | 134.3 | 81% | 0.813 | 82% | 0.815 | S | S | * | * | 21.5 | 153.5 | 111.3 | -139.8 | -12.2 | 0 | 0 | 0 | 120 | |||||
| 42 | L | 42.5 | Very low | 41.8 | Very low | 155 Ų | 155 | 129 Ų | 129 | 81% | 0.812 | 81% | 0.81 | S | S | * | * | trans | 100.2 | 89.6 | 171.7 | -49.5 | -179.5 | 0 | 0 | 0 | 117.4 | ||||
| 43 | A | 39.9 | Very low | 42.1 | Very low | 90 Ų | 90 | 129.9 Ų | 129.9 | 74% | 0.744 | 81% | 0.81 | S | S | * | * | trans | -82.9 | 155.7 | 136.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 44 | P | 47.3 | Very low | 42.2 | Very low | 111 Ų | 111 | 126.3 Ų | 126.3 | 72% | 0.721 | 81% | 0.808 | S | S | * | * | -158.7 | 173.4 | 59.4 | 44.6 | -23.1 | 0 | 0 | 0 | 118.7 | |||||
| 45 | R | 41.1 | Very low | 41.8 | Very low | 236 Ų | 236 | 126.8 Ų | 126.8 | 89% | 0.891 | 81% | 0.811 | S | S | * | * | trans | 74.6 | 151.3 | 156.4 | -59.8 | -160.8 | 168.2 | -158.7 | -6 | 118.2 | ||||
| 46 | S | 35.3 | Very low | 41.7 | Very low | 112 Ų | 112 | 125.3 Ų | 125.3 | 78% | 0.783 | 81% | 0.811 | S | S | * | * | cis | -180 | 141.9 | -16.2 | 47.6 | 0 | 0 | 0 | 0 | 107 | ||||
| 47 | G | 34.9 | Very low | 41.9 | Very low | 73 Ų | 73 | 125.5 Ų | 125.5 | 75% | 0.753 | 81% | 0.812 | S | S | * | * | trans | 170.5 | 139.2 | 166.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 48 | P | 45.9 | Very low | 42.3 | Very low | 136 Ų | 136 | 126.7 Ų | 126.7 | 88% | 0.883 | 82% | 0.815 | S | S | * | * | trans | -93.1 | 147.9 | -157.3 | 36.7 | -33.3 | 0 | 0 | 0 | 113.5 | ||||
| 49 | R | 42.8 | Very low | 42.3 | Very low | 248 Ų | 248 | 123 Ų | 123 | 94% | 0.936 | 81% | 0.808 | S | S | * | * | trans | -142.4 | 114.9 | 167.9 | -142.5 | 177.1 | -166.4 | -148.6 | 2.4 | 113.5 | ||||
| 50 | A | 36.5 | Very low | 43.2 | Very low | 90 Ų | 90 | 124.3 Ų | 124.3 | 74% | 0.744 | 81% | 0.812 | S | S | * | * | trans | 52.8 | 106.8 | 143.1 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 51 | V | 45.5 | Very low | 43.9 | Very low | 136 Ų | 136 | 131.1 Ų | 131.1 | 82% | 0.824 | 82% | 0.816 | S | S | * | * | trans | -68 | 133.7 | 153.9 | 176.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 52 | P | 53.6 | Low | 44 | Very low | 115 Ų | 115 | 127.5 Ų | 127.5 | 75% | 0.747 | 81% | 0.814 | S | S | * | * | trans | -91.5 | 113.3 | 158 | 31 | -25.8 | 0 | 0 | 0 | 110.2 | ||||
| 53 | S | 42.4 | Very low | 44.6 | Very low | 116 Ų | 116 | 131.9 Ų | 131.9 | 81% | 0.811 | 82% | 0.82 | S | S | * | * | trans | -70.5 | 128.4 | 162.1 | 50.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 54 | S | 47 | Very low | 45 | Very low | 112 Ų | 112 | 133.7 Ų | 133.7 | 78% | 0.783 | 82% | 0.821 | S | S | * | * | trans | -118.9 | 152.4 | 169.9 | -73.5 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 55 | P | 52.1 | Low | 45.3 | Very low | 124 Ų | 124 | 133.6 Ų | 133.6 | 81% | 0.805 | 82% | 0.823 | S | S | * | * | trans | -86.7 | 152.9 | -152.8 | 33.8 | -34.8 | 0 | 0 | 0 | 114.1 | ||||
| 56 | A | 45.8 | Very low | 45.7 | Very low | 108 Ų | 108 | 127.6 Ų | 127.6 | 89% | 0.893 | 81% | 0.813 | S | S | * | * | trans | -60.7 | 138.9 | 165.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 57 | G | 37.3 | Very low | 46.6 | Very low | 78 Ų | 78 | 128.7 Ų | 128.7 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | -167.6 | 93.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 58 | S | 45.2 | Very low | 47.3 | Very low | 123 Ų | 123 | 130.2 Ų | 130.2 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -50 | 143.9 | 179.7 | -175.6 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 59 | A | 39.3 | Very low | 47.7 | Very low | 95 Ų | 95 | 130.8 Ų | 130.8 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | trans | -170.8 | 127 | 131.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 60 | A | 54 | Low | 48.9 | Very low | 99 Ų | 99 | 127.5 Ų | 127.5 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | -54.6 | 132.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 61 | R | 51.4 | Low | 50.4 | Low | 245 Ų | 245 | 131.2 Ų | 131.2 | 93% | 0.925 | 78% | 0.784 | S | S | * | * | trans | -127.8 | 117.5 | 151.6 | -75.5 | -171.1 | 176.7 | -101.1 | -0.6 | 108.2 | R63 | R61-R63 PolarHBondContact O-N 2.69Š| ||
| 62 | G | 43.9 | Very low | 51.3 | Low | 75 Ų | 75 | 132.5 Ų | 132.5 | 77% | 0.773 | 78% | 0.78 | S | S | * | * | trans | -56.1 | 128.1 | -170.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | V64 | G62-V64 PolarHBondContact O-N 3.28Š| ||
| 63 | R | 56.3 | Low | 51.6 | Low | 247 Ų | 247 | 135.3 Ų | 135.3 | 93% | 0.932 | 78% | 0.781 | S | S | * | * | trans | -72.9 | 104 | 159.1 | -63.9 | -176 | -164.1 | -100.4 | 2.6 | 106.4 | R61 S65 | R61-R63 PolarHBondContact O-N 2.69Å; R63-S65 VanDerWaalsContact C-N 3.3Å; R63-S65 PolarHBondContact O-N 2.74Å | ||
| 64 | V | 47.9 | Very low | 52 | Low | 128 Ų | 128 | 141 Ų | 141 | 78% | 0.776 | 78% | 0.784 | S | S | * | * | trans | -69.3 | 97.5 | 163.1 | -175.4 | 0 | 0 | 0 | 0 | 105.9 | G62 V66 | G62-V64 PolarHBondContact O-N 3.28Å; V64-V66 HydrophobicContact CG1-CG2 3.96Å; V64-V66 PolarHBondContact O-N 2.93Å | ||
| 65 | S | 53 | Low | 52.2 | Low | 109 Ų | 109 | 142.9 Ų | 142.9 | 76% | 0.762 | 78% | 0.781 | S | S | * | * | trans | -76.2 | 97.7 | 168.9 | -167.1 | 0 | 0 | 0 | 0 | 107.2 | R63 H67 | R63-S65 VanDerWaalsContact C-N 3.3Å; R63-S65 PolarHBondContact O-N 2.74Å; S65-H67 VanDerWaalsContact C-N 3.26Å; S65-H67 PolarHBondContact O-N 3.06Å | ||
| 66 | V | 50.4 | Low | 52 | Low | 111 Ų | 111 | 146 Ų | 146 | 67% | 0.673 | 78% | 0.784 | S | S | * | * | trans | -79.4 | 84.2 | 173.2 | -154.4 | 0 | 0 | 0 | 0 | 107.5 | V64 C68 | V64-V66 HydrophobicContact CG1-CG2 3.96Å; V64-V66 PolarHBondContact O-N 2.93Å; V66-C68 VanDerWaalsContact C-N 3.34Å; V66-C68 VanDerWaalsContact CG1-SG 3.58Å; V66-C68 PolarHBondContact O-N 2.82Å | ||
| 67 | H | 53.9 | Low | 51.9 | Low | 135 Ų | 135 | 149.7 Ų | 149.7 | 63% | 0.625 | 78% | 0.784 | S | S | * | * | trans | -70.7 | 94.6 | 164.7 | 146 | 31.8 | 0 | 0 | 0 | 107.5 | S65 K69 | S65-H67 VanDerWaalsContact C-N 3.26Å; S65-H67 PolarHBondContact O-N 3.06Å; H67-K69 VanDerWaalsContact CE1-CB 3.43Å; H67-K69 WeakPolarHBondContact CE1-CB 3.36Å; H67-K69 WeakPolarHBondContact CE1-CG 3.38Å; H67-K69 PolarHBondContact CE1-N 3.22Å; H67-K69 WeakPolarHBondContact ND1-CG 3.26Å; H67-K69 PolarHBondContact ND1-N 3.25Å; H67-K69 PolarHBondContact O-N 3.44Å | ||
| 68 | C | 48.7 | Very low | 52.5 | Low | 105 Ų | 105 | 152.9 Ų | 152.9 | 71% | 0.709 | 78% | 0.782 | S | S | * | * | trans | -92.9 | 84.7 | 165.8 | -70.3 | 0 | 0 | 0 | 0 | 109 | V66 K70 | V66-C68 VanDerWaalsContact C-N 3.34Å; V66-C68 VanDerWaalsContact CG1-SG 3.58Å; V66-C68 PolarHBondContact O-N 2.82Å; C68-K70 VanDerWaalsContact C-N 3.35Å; C68-K70 PolarHBondContact O-N 2.81Å | ||
| 69 | K | 54.1 | Low | 52.8 | Low | 148 Ų | 148 | 154 Ų | 154 | 64% | 0.643 | 78% | 0.778 | S | S | * | * | trans | -85 | 89.1 | 159.4 | -66.3 | 174.9 | -177.9 | -170.3 | 0 | 107.8 | H67 K71 | H67-K69 VanDerWaalsContact CE1-CB 3.43Å; H67-K69 WeakPolarHBondContact CE1-CB 3.36Å; H67-K69 WeakPolarHBondContact CE1-CG 3.38Å; H67-K69 PolarHBondContact CE1-N 3.22Å; H67-K69 WeakPolarHBondContact ND1-CG 3.26Å; H67-K69 PolarHBondContact ND1-N 3.25Å; H67-K69 PolarHBondContact O-N 3.44Å; K69-K71 PolarHBondContact O-N 3.26Å; K69-K71 VanDerWaalsContact O-N 3.12Å | ||
| 70 | K | 68.2 | Low | 53.4 | Low | 179 Ų | 179 | 156.2 Ų | 156.2 | 78% | 0.778 | 78% | 0.777 | S | S | * | * | trans | -70.7 | 99 | 160.1 | -176.4 | 170.2 | 172.9 | 175.8 | 0 | 107.1 | C68 | C68-K70 VanDerWaalsContact C-N 3.35Å; C68-K70 PolarHBondContact O-N 2.81Å | ||
| 71 | K | 68.5 | Low | 53.1 | Low | 168 Ų | 168 | 155.7 Ų | 155.7 | 73% | 0.73 | 77% | 0.767 | S | S | * | * | trans | -76.7 | 122 | 168.5 | -58.5 | -65.4 | -173 | 169.4 | 0 | 106.9 | K69 K73 | K69-K71 PolarHBondContact O-N 3.26Å; K69-K71 VanDerWaalsContact O-N 3.12Å; K71-K73 PolarHBondContact O-N 3.48Å | ||
| 72 | H | 64.6 | Low | 52.8 | Low | 162 Ų | 162 | 149.7 Ų | 149.7 | 75% | 0.75 | 76% | 0.759 | S | S | * | * | trans | -69.2 | 118.1 | 167.9 | -70.8 | -176.2 | 0 | 0 | 0 | 107.8 | R74 | H72-R74 PolarHBondContact O-N 2.92Š| ||
| 73 | K | 60.7 | Low | 53.3 | Low | 174 Ų | 174 | 152.1 Ų | 152.1 | 76% | 0.757 | 76% | 0.759 | S | S | * | * | trans | -71.2 | 108.9 | 162.7 | -177.6 | 175.2 | 178.9 | -109.8 | 0 | 105.4 | K71 E75 | K71-K73 PolarHBondContact O-N 3.48Å; K73-E75 PolarHBondContact O-N 3.29Å; K73-E75 VanDerWaalsContact O-N 3.13Å | ||
| 74 | R | 49.7 | Very low | 53.5 | Low | 235 Ų | 235 | 151.5 Ų | 151.5 | 89% | 0.887 | 76% | 0.756 | S | S | * | * | trans | -62.5 | 108.7 | 167.4 | -174.5 | 177.5 | -169.3 | 154.6 | 1.5 | 105.9 | H72 | H72-R74 PolarHBondContact O-N 2.92Š| ||
| 75 | E | 52.2 | Low | 53.9 | Low | 153 Ų | 153 | 155.4 Ų | 155.4 | 72% | 0.715 | 76% | 0.763 | S | S | * | * | trans | -71 | 125.8 | 161.3 | -74.2 | -171 | 136.8 | 0 | 0 | 106.7 | K73 E77 | K73-E75 PolarHBondContact O-N 3.29Å; K73-E75 VanDerWaalsContact O-N 3.13Å; E75-E77 PolarHBondContact O-N 3.12Å | ||
| 76 | E | 48 | Very low | 54.5 | Low | 188 Ų | 188 | 159 Ų | 159 | 88% | 0.879 | 77% | 0.765 | S | S | * | * | trans | -70.4 | 98.5 | 167 | -173.8 | 169.4 | -176.5 | 0 | 0 | 105.2 | D78 | E76-D78 PolarHBondContact O-N 2.84Š| ||
| 77 | E | 42.7 | Very low | 54.8 | Low | 187 Ų | 187 | 165.1 Ų | 165.1 | 87% | 0.874 | 78% | 0.776 | S | S | * | * | trans | -69.1 | 116.9 | 165.1 | -85.2 | -176.5 | 133.7 | 0 | 0 | 107.2 | E75 | E75-E77 PolarHBondContact O-N 3.12Š| ||
| 78 | D | 49 | Very low | 54.5 | Low | 145 Ų | 145 | 166.5 Ų | 166.5 | 78% | 0.775 | 79% | 0.786 | S | S | * | * | trans | -53.3 | 133.2 | 170.9 | -169.1 | 44.9 | 0 | 0 | 0 | 110.2 | E76 D80 | E76-D78 PolarHBondContact O-N 2.84Å; D78-D80 PolarHBondContact O-N 3.17Å; D78-D80 VanDerWaalsContact O-N 3.07Å | ||
| 79 | D | 53.2 | Low | 54.5 | Low | 145 Ų | 145 | 167.6 Ų | 167.6 | 78% | 0.775 | 79% | 0.79 | S | S | * | * | trans | -72.4 | 92.5 | -177 | -162.7 | -79.7 | 0 | 0 | 0 | 109.4 | ||||
| 80 | D | 50.4 | Low | 54 | Low | 143 Ų | 143 | 169.8 Ų | 169.8 | 77% | 0.765 | 80% | 0.802 | S | S | * | * | trans | -121.4 | 84.1 | 165.6 | -142.2 | -74.8 | 0 | 0 | 0 | 109.6 | D78 P82 | D78-D80 PolarHBondContact O-N 3.17Å; D78-D80 VanDerWaalsContact O-N 3.07Å; D80-P82 VanDerWaalsContact O-CD 3.28Å; D80-P82 WeakPolarHBondContact O-CD 3.3Å | ||
| 81 | C | 47.7 | Very low | 52.9 | Low | 88 Ų | 88 | 165.5 Ų | 165.5 | 60% | 0.595 | 80% | 0.8 | S | S | * | * | trans | -76.9 | 115.3 | 176.3 | -175.8 | 0 | 0 | 0 | 0 | 110.2 | V83 | C81-V83 PolarHBondContact O-N 3.13Š| ||
| 82 | P | 46.2 | Very low | 51.3 | Low | 118 Ų | 118 | 166.5 Ų | 166.5 | 77% | 0.766 | 81% | 0.807 | S | S | * | * | trans | -74.9 | 93 | 169.9 | 29 | -31.1 | 0 | 0 | 0 | 109.5 | D80 R84 | D80-P82 VanDerWaalsContact O-CD 3.28Å; D80-P82 WeakPolarHBondContact O-CD 3.3Å; P82-R84 PolarHBondContact O-N 3.25Å | ||
| 83 | V | 54.2 | Low | 50.7 | Low | 126 Ų | 126 | 167 Ų | 167 | 76% | 0.764 | 82% | 0.815 | S | S | * | * | trans | -61.6 | 88.2 | 171.5 | 175.1 | 0 | 0 | 0 | 0 | 110.1 | C81 | C81-V83 PolarHBondContact O-N 3.13Š| ||
| 84 | R | 59.7 | Low | 49.6 | Very low | 235 Ų | 235 | 165 Ų | 165 | 89% | 0.887 | 82% | 0.821 | S | S | * | * | trans | -155.9 | 71.2 | 158 | -59.9 | -168.6 | 74.7 | 174.6 | -0.4 | 112.8 | P82 | P82-R84 PolarHBondContact O-N 3.25Š| ||
| 85 | K | 56.8 | Low | 49.3 | Very low | 210 Ų | 210 | 158.1 Ų | 158.1 | 91% | 0.913 | 82% | 0.815 | S | S | * | * | trans | -102.2 | 100.3 | 163.3 | -145.6 | 172.2 | 172.2 | -179.4 | 0 | 110.2 | ||||
| 86 | K | 64.7 | Low | 49.1 | Very low | 185 Ų | 185 | 153.3 Ų | 153.3 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -60.8 | 133.3 | 168.5 | 52.6 | -173 | 175.1 | 176.9 | 0 | 110.1 | I88 | K86-I88 PolarHBondContact O-N 3.14Š| ||
| 87 | R | 57.6 | Low | 49.1 | Very low | 238 Ų | 238 | 150.3 Ų | 150.3 | 90% | 0.898 | 80% | 0.802 | S | S | * | * | trans | -67.7 | 122 | 170.7 | -63.2 | -171.5 | -64.8 | -159.9 | 0.4 | 108.6 | ||||
| 88 | I | 48.6 | Very low | 49 | Very low | 165 Ų | 165 | 148.2 Ų | 148.2 | 85% | 0.846 | 80% | 0.797 | S | S | * | * | trans | -94.6 | 106.2 | 159.6 | 32 | 167.8 | 0 | 0 | 0 | 106.5 | K86 | K86-I88 PolarHBondContact O-N 3.14Š| ||
| 89 | T | 47.2 | Very low | 49.2 | Very low | 127 Ų | 127 | 147.8 Ų | 147.8 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | trans | -68 | 122.1 | 163.9 | -55.9 | 0 | 0 | 0 | 0 | 107.2 | A91 | T89-A91 PolarHBondContact O-N 3.48Š| ||
| 90 | E | 45.1 | Very low | 49.1 | Very low | 195 Ų | 195 | 151.2 Ų | 151.2 | 91% | 0.911 | 80% | 0.797 | S | S | * | * | trans | -64.4 | 119.3 | 173 | -174.1 | 179.6 | 131.7 | 0 | 0 | 109.3 | ||||
| 91 | A | 44 | Very low | 49 | Very low | 88 Ų | 88 | 151 Ų | 151 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | trans | -140.7 | 120.9 | 168.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | T89 | T89-A91 PolarHBondContact O-N 3.48Š| ||
| 92 | E | 36 | Very low | 48.7 | Very low | 189 Ų | 189 | 154.6 Ų | 154.6 | 88% | 0.883 | 81% | 0.807 | S | S | * | * | trans | 75.5 | 104.7 | 150.5 | -137.2 | 166.4 | 140.5 | 0 | 0 | 118.6 | C94 | E92-C94 PolarHBondContact O-N 3.16Š| ||
| 93 | L | 50.7 | Low | 48.4 | Very low | 173 Ų | 173 | 155.4 Ų | 155.4 | 91% | 0.906 | 81% | 0.814 | S | S | * | * | trans | -63.4 | 113.7 | 170.3 | -67.4 | 147.4 | 0 | 0 | 0 | 110.9 | ||||
| 94 | C | 38.2 | Very low | 47.9 | Very low | 131 Ų | 131 | 154 Ų | 154 | 89% | 0.885 | 82% | 0.816 | S | S | * | * | trans | -98.8 | 101.3 | 156.7 | -89.7 | 0 | 0 | 0 | 0 | 108.3 | E92 G96 | E92-C94 PolarHBondContact O-N 3.16Å; C94-G96 PolarHBondContact O-N 2.98Å | ||
| 95 | A | 44 | Very low | 46.7 | Very low | 92 Ų | 92 | 151 Ų | 151 | 76% | 0.76 | 81% | 0.811 | S | S | * | * | trans | -64.4 | 116.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 96 | G | 47 | Very low | 46.1 | Very low | 51 Ų | 51 | 149.4 Ų | 149.4 | 53% | 0.526 | 81% | 0.807 | S | S | . | * | trans | -104.2 | 152.7 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | C94 N98 | C94-G96 PolarHBondContact O-N 2.98Å; G96-N98 PolarHBondContact O-N 3.12Å | ||
| 97 | P | 48.5 | Very low | 44.6 | Very low | 125 Ų | 125 | 147.3 Ų | 147.3 | 81% | 0.812 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -71 | 87.9 | -158.6 | 28 | -34.3 | 0 | 0 | 0 | 112.6 | ||
| 98 | N | 39.5 | Very low | 43.8 | Very low | 143 Ų | 143 | 140.6 Ų | 140.6 | 77% | 0.765 | 79% | 0.79 | S | S | * | * | trans | -158.3 | 56.8 | 159.1 | -82 | -55.3 | 0 | 0 | 0 | 109.7 | G96 W100 | G96-N98 PolarHBondContact O-N 3.12Å; N98-W100 VanDerWaalsContact C-N 3.27Å; N98-W100 PolarHBondContact O-N 3.44Å | ||
| 99 | D | 54.7 | Low | 43.3 | Very low | 137 Ų | 137 | 141.6 Ų | 141.6 | 73% | 0.733 | 79% | 0.791 | S | S | * | * | trans | -76 | 76.8 | 166 | -67.5 | -39.3 | 0 | 0 | 0 | 109.5 | I101 | D99-I101 VanDerWaalsContact C-N 3.3Å; D99-I101 WeakPolarHBondContact O-CG1 3.37Å; D99-I101 PolarHBondContact O-N 2.86Å | ||
| 100 | W | 50.5 | Low | 42.9 | Very low | 217 Ų | 217 | 138.7 Ų | 138.7 | 82% | 0.822 | 79% | 0.787 | S | S | * | * | trans | -96.8 | 69.8 | 160.8 | 71.7 | -76.1 | 0 | 0 | 0 | 109.1 | N98 | N98-W100 VanDerWaalsContact C-N 3.27Å; N98-W100 PolarHBondContact O-N 3.44Å | ||
| 101 | I | 47.5 | Very low | 42.3 | Very low | 137 Ų | 137 | 138.8 Ų | 138.8 | 70% | 0.703 | 79% | 0.787 | S | S | * | * | 49.5 | 82 | 125.9 | -53.7 | 157.1 | 0 | 0 | 0 | 113.6 | D99 | D99-I101 VanDerWaalsContact C-N 3.3Å; D99-I101 WeakPolarHBondContact O-CG1 3.37Å; D99-I101 PolarHBondContact O-N 2.86Å | |||
| 102 | L | 42.5 | Very low | 41.8 | Very low | 164 Ų | 164 | 137.2 Ų | 137.2 | 86% | 0.859 | 78% | 0.779 | S | S | * | * | 52.4 | 87.6 | 98.9 | -64.7 | 171.6 | 0 | 0 | 0 | 114.8 | |||||
| 103 | C | 39.8 | Very low | 41.9 | Very low | 136 Ų | 136 | 134.8 Ų | 134.8 | 92% | 0.919 | 78% | 0.777 | S | S | * | * | trans | -82.4 | 110.3 | 149.2 | -74.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 104 | A | 43.2 | Very low | 41.5 | Very low | 96 Ų | 96 | 133.5 Ų | 133.5 | 79% | 0.793 | 77% | 0.771 | S | S | * | * | trans | -65.8 | 127.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 105 | H | 35.7 | Very low | 42.1 | Very low | 172 Ų | 172 | 131.9 Ų | 131.9 | 80% | 0.796 | 76% | 0.758 | S | S | * | * | trans | -138.1 | 87.4 | 141 | -164.8 | -81.8 | 0 | 0 | 0 | 108.1 | ||||
| 106 | Q | 42.4 | Very low | 42 | Very low | 177 Ų | 177 | 133.2 Ų | 133.2 | 83% | 0.827 | 76% | 0.761 | S | S | * | * | trans | -79.2 | 118.6 | 167.6 | -169.3 | 170.9 | 86.8 | 0 | 0 | 106.1 | ||||
| 107 | D | 33.1 | Very low | 41.5 | Very low | 141 Ų | 141 | 138.8 Ų | 138.8 | 75% | 0.754 | 78% | 0.777 | S | S | * | * | trans | -133.6 | 134.9 | 150.5 | -156.5 | 16.8 | 0 | 0 | 0 | 109.9 | ||||
| 108 | V | 41.9 | Very low | 41.3 | Very low | 96 Ų | 96 | 138.9 Ų | 138.9 | 58% | 0.582 | 78% | 0.781 | S | S | * | * | trans | -83.2 | 139.8 | -168.8 | 170.3 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 109 | E | 38.2 | Very low | 41.3 | Very low | 186 Ų | 186 | 135.6 Ų | 135.6 | 87% | 0.869 | 78% | 0.78 | S | S | * | * | 144.6 | 132.3 | 110.4 | -153.5 | 133.3 | 179.8 | 0 | 0 | 104.6 | |||||
| 110 | G | 38.3 | Very low | 41.2 | Very low | 67 Ų | 67 | 137.7 Ų | 137.7 | 69% | 0.691 | 79% | 0.79 | S | S | * | * | cis | 126.9 | 61.4 | 13.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 111 | H | 32.2 | Very low | 40.6 | Very low | 197 Ų | 197 | 133.1 Ų | 133.1 | 91% | 0.912 | 79% | 0.792 | S | S | * | * | trans | -175.2 | 139.7 | 161.3 | -138 | 33.6 | 0 | 0 | 0 | 110.6 | ||||
| 112 | G | 33.4 | Very low | 40.5 | Very low | 54 Ų | 54 | 133 Ų | 133 | 56% | 0.557 | 80% | 0.797 | S | S | * | * | cis | 155.9 | 127.4 | 6.7 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 113 | V | 39 | Very low | 40.9 | Very low | 139 Ų | 139 | 130.8 Ų | 130.8 | 84% | 0.842 | 79% | 0.793 | S | S | * | * | trans | 43.6 | 112.1 | 154.1 | -80.7 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 114 | N | 42.4 | Very low | 40.9 | Very low | 146 Ų | 146 | 127.7 Ų | 127.7 | 78% | 0.781 | 78% | 0.784 | S | S | * | * | 125.9 | -176.1 | 75.2 | -155.2 | -9.4 | 0 | 0 | 0 | 109.5 | |||||
| 115 | P | 50 | Low | 41.5 | Very low | 96 Ų | 96 | 131.8 Ų | 131.8 | 62% | 0.623 | 79% | 0.79 | S | S | * | * | -103.6 | 167.2 | -105.2 | 34.3 | -18.6 | 0 | 0 | 0 | 117.1 | |||||
| 116 | C | 41.4 | Very low | 42.3 | Very low | 121 Ų | 121 | 131 Ų | 131 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | 15.8 | 119.9 | 146 | -52.9 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 117 | I | 37.1 | Very low | 42.6 | Very low | 168 Ų | 168 | 129.1 Ų | 129.1 | 86% | 0.862 | 79% | 0.787 | S | S | * | * | trans | -134.1 | 106.1 | 143.8 | -63.1 | -178.7 | 0 | 0 | 0 | 108.7 | ||||
| 118 | S | 44.2 | Very low | 43.6 | Very low | 127 Ų | 127 | 128.8 Ų | 128.8 | 89% | 0.888 | 79% | 0.79 | S | S | * | * | trans | -72.1 | 127.3 | 157.4 | -68.1 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 119 | G | 40 | Very low | 43.6 | Very low | 73 Ų | 73 | 130 Ų | 130 | 75% | 0.753 | 79% | 0.792 | S | S | * | * | trans | -158 | 96.3 | 172 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 120 | L | 53.2 | Low | 44.3 | Very low | 181 Ų | 181 | 127.1 Ų | 127.1 | 95% | 0.948 | 79% | 0.79 | S | S | * | * | trans | -67.4 | 126.8 | 173.4 | -64.3 | 165.8 | 0 | 0 | 0 | 110 | ||||
| 121 | S | 37.7 | Very low | 44.8 | Very low | 121 Ų | 121 | 131.4 Ų | 131.4 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | trans | -164.4 | 114.2 | 144.9 | -151.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 122 | V | 44.9 | Very low | 45.8 | Very low | 134 Ų | 134 | 130.4 Ų | 130.4 | 81% | 0.812 | 79% | 0.788 | S | S | * | * | trans | -134.8 | 148.6 | 162.1 | 169.2 | 0 | 0 | 0 | 0 | 103.4 | ||||
| 123 | P | 51.3 | Low | 46.7 | Very low | 119 Ų | 119 | 135.5 Ų | 135.5 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | cis | -134.8 | 152.1 | 9.1 | 20.6 | 3.7 | 0 | 0 | 0 | 114.9 | ||||
| 124 | G | 39.4 | Very low | 47.8 | Very low | 71 Ų | 71 | 135 Ų | 135 | 73% | 0.732 | 79% | 0.792 | S | S | * | * | trans | -137.8 | 110.3 | 163 | 0 | 0 | 0 | 0 | 0 | 110.3 | L126 | G124-L126 PolarHBondContact O-N 2.91Š| ||
| 125 | I | 56.6 | Low | 48.2 | Very low | 181 Ų | 181 | 136.3 Ų | 136.3 | 93% | 0.928 | 79% | 0.793 | S | S | * | * | trans | -54.4 | 99.2 | 169.2 | -73.9 | 139.8 | 0 | 0 | 0 | 108.6 | ||||
| 126 | L | 52.4 | Low | 48.1 | Very low | 155 Ų | 155 | 136.9 Ų | 136.9 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | trans | -125.2 | 127.1 | 164 | -164.1 | 71.3 | 0 | 0 | 0 | 107 | G124 V128 | G124-L126 PolarHBondContact O-N 2.91Å; L126-V128 PolarHBondContact O-N 2.67Å | ||
| 127 | D | 47.3 | Very low | 48.7 | Very low | 139 Ų | 139 | 138.3 Ų | 138.3 | 74% | 0.743 | 80% | 0.8 | S | S | * | * | trans | -29.9 | 118.2 | 175.3 | -78.8 | -47.8 | 0 | 0 | 0 | 112.3 | I129 | D127-I129 HydrophobicContact CB-CG1 4.4Å; D127-I129 PolarHBondContact O-N 2.91Å | ||
| 128 | V | 54 | Low | 49.6 | Very low | 134 Ų | 134 | 132.7 Ų | 132.7 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | trans | -67.8 | 86.8 | 154.8 | 176 | 0 | 0 | 0 | 0 | 105.2 | L126 C130 | L126-V128 PolarHBondContact O-N 2.67Å; V128-C130 VanDerWaalsContact C-N 3.28Å; V128-C130 PolarHBondContact O-N 2.82Å | ||
| 129 | I | 42.7 | Very low | 50.1 | Low | 122 Ų | 122 | 133 Ų | 133 | 63% | 0.626 | 77% | 0.772 | S | S | * | * | trans | -55.9 | 105.9 | 154.3 | -63.7 | 173.5 | 0 | 0 | 0 | 104.1 | D127 E131 | D127-I129 HydrophobicContact CB-CG1 4.4Å; D127-I129 PolarHBondContact O-N 2.91Å; I129-E131 HydrophobicContact CG2-CB 4.08Å; I129-E131 HydrophobicContact CG2-CG 3.7Å; I129-E131 PolarHBondContact O-N 2.8Å | ||
| 130 | C | 53.1 | Low | 51.6 | Low | 124 Ų | 124 | 134.4 Ų | 134.4 | 84% | 0.838 | 77% | 0.768 | S | S | * | * | trans | -73.5 | 72.8 | 169.3 | -159 | 0 | 0 | 0 | 0 | 106.7 | V128 E132 | V128-C130 VanDerWaalsContact C-N 3.28Å; V128-C130 PolarHBondContact O-N 2.82Å; C130-E132 PolarHBondContact O-N 2.69Å | ||
| 131 | E | 48.1 | Very low | 52.5 | Low | 157 Ų | 157 | 132.6 Ų | 132.6 | 73% | 0.734 | 75% | 0.754 | S | S | * | * | trans | -79.9 | 100.2 | 166 | -101.5 | 172.1 | 171.7 | 0 | 0 | 106.9 | I129 M133 | I129-E131 HydrophobicContact CG2-CB 4.08Å; I129-E131 HydrophobicContact CG2-CG 3.7Å; I129-E131 PolarHBondContact O-N 2.8Å; E131-M133 PolarHBondContact O-N 2.95Å; E131-M133 VanDerWaalsContact O-N 3.11Å | ||
| 132 | E | 53.5 | Low | 54.3 | Low | 176 Ų | 176 | 130.6 Ų | 130.6 | 82% | 0.822 | 74% | 0.739 | S | S | * | * | 9.5 | 94.5 | 124.2 | -173.3 | 179.5 | 102.4 | 0 | 0 | 112.9 | C130 | C130-E132 PolarHBondContact O-N 2.69Š| |||
| 133 | M | 51.9 | Low | 56.3 | Low | 162 Ų | 162 | 127.9 Ų | 127.9 | 80% | 0.798 | 72% | 0.718 | S | S | * | * | trans | -118.3 | 52 | 167.5 | -142 | -179.2 | 72.3 | 0 | 0 | 108.6 | E131 | E131-M133 PolarHBondContact O-N 2.95Å; E131-M133 VanDerWaalsContact O-N 3.11Å | ||
| 134 | D | 62 | Low | 58.1 | Low | 127 Ų | 127 | 125.7 Ų | 125.7 | 68% | 0.679 | 70% | 0.702 | S | S | * | * | trans | -77.2 | 136.6 | 154.3 | -81.9 | -40.5 | 0 | 0 | 0 | 108 | ||||
| 135 | Q | 52.3 | Low | 60.6 | Low | 174 Ų | 174 | 124.7 Ų | 124.7 | 81% | 0.813 | 69% | 0.687 | S | S | * | * | trans | 82.3 | 66 | 173.1 | -60.8 | 126.9 | 53.5 | 0 | 0 | 117.7 | ||||
| 136 | T | 47.2 | Very low | 62.3 | Low | 109 Ų | 109 | 122.6 Ų | 122.6 | 67% | 0.669 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -143.3 | 105.5 | 137.4 | 43.1 | 0 | 0 | 0 | 0 | 111.1 | G138 | T136-G138 PolarHBondContact O-N 2.7Š|
| 137 | T | 54 | Low | 64.2 | Low | 150 Ų | 150 | 123 Ų | 123 | 92% | 0.92 | 66% | 0.658 | S | S | * | * | trans | 36 | 58.4 | 145.8 | -48.1 | 0 | 0 | 0 | 0 | 116.3 | E139 | T137-E139 PolarHBondContact O-N 2.96Š| ||
| 138 | G | 55.9 | Low | 66.4 | Low | 51 Ų | 51 | 122.2 Ų | 122.2 | 53% | 0.526 | 65% | 0.648 | S | S | . | * | trans | -91.2 | 88.4 | 163.4 | 0 | 0 | 0 | 0 | 0 | 109 | T136 C142 | T136-G138 PolarHBondContact O-N 2.7Å; G138-C142 PolarHBondContact O-SG 3.27Å | ||
| 139 | E | 54.3 | Low | 68.3 | Low | 133 Ų | 133 | 121.5 Ų | 121.5 | 62% | 0.621 | 64% | 0.639 | S | S | * | * | trans | 35.3 | 139.9 | 151.7 | -75.1 | 169 | 143.6 | 0 | 0 | 122.7 | T137 Q141 C142 | T137-E139 PolarHBondContact O-N 2.96Å; E139-Q141 HydrophobicContact CB-CB 4.41Å; E139-Q141 PolarHBondContact O-N 2.86Å; E139-C142 PolarHBondContact O-N 3.49Å; E139-C142 PolarHBondContact O-SG 3.43Å; E139-C142 VanDerWaalsContact O-SG 3.33Å | ||
| 140 | P | 72.7 | Confident | 70.7 | Confident | 103 Ų | 103 | 119.2 Ų | 119.2 | 67% | 0.669 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -56.4 | -18.8 | 169.4 | 26.6 | -35.2 | 0 | 0 | 0 | 113.3 | V144 | P140-V144 WeakPolarHBondContact O-CB 3.44Å; P140-V144 WeakPolarHBondContact O-CG2 3.42Å; P140-V144 PolarHBondContact O-N 2.81Å |
| 141 | Q | 70.3 | Confident | 72.6 | Confident | 142 Ų | 142 | 118.5 Ų | 118.5 | 66% | 0.664 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -70.9 | -34.7 | 177.7 | -67.4 | -163 | -0.6 | 0 | 0 | 113.5 | E139 E143 V144 A145 | E139-Q141 HydrophobicContact CB-CB 4.41Å; E139-Q141 PolarHBondContact O-N 2.86Å; Q141-E143 VanDerWaalsContact C-N 3.34Å; Q141-V144 PolarHBondContact O-N 2.98Å; Q141-A145 VanDerWaalsContact O-CB 3.3Å; Q141-A145 WeakPolarHBondContact O-CB 3.36Å; Q141-A145 PolarHBondContact O-N 3.39Å |
| 142 | C | 77 | Confident | 74.6 | Confident | 79 Ų | 79 | 114.3 Ų | 114.3 | 53% | 0.534 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -70.9 | -35 | 177.9 | 81.7 | 0 | 0 | 0 | 0 | 111.1 | G138 E139 A145 R146 | G138-C142 PolarHBondContact O-SG 3.27Å; E139-C142 PolarHBondContact O-N 3.49Å; E139-C142 PolarHBondContact O-SG 3.43Å; E139-C142 VanDerWaalsContact O-SG 3.33Å; C142-A145 PolarHBondContact O-N 2.86Å; C142-R146 WeakPolarHBondContact O-CB 3.44Å; C142-R146 PolarHBondContact O-N 2.67Å |
| 143 | E | 86.7 | Confident | 76.4 | Confident | 78 Ų | 78 | 110.8 Ų | 110.8 | 36% | 0.364 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -72.3 | -36.5 | 174.6 | -174.7 | 57.7 | -157.8 | 0 | 0 | 112 | Q141 R146 R147 | Q141-E143 VanDerWaalsContact C-N 3.34Å; E143-R146 PolarHBondContact O-N 2.88Å; E143-R146 IonicContact OE1-CZ 3.52Å; E143-R146 IonicContact OE1-NE 3.52Å; E143-R146 IonicContact OE1-NH2 2.71Å; E143-R146 PolarHBondContact OE1-NH2 2.76Å; E143-R146 IonicContact OE2-CZ 3.72Å; E143-R146 IonicContact OE2-NE 2.97Å; E143-R146 PolarHBondContact OE2-NE 3.48Å; E143-R146 IonicContact OE2-NH2 3.58Å; E143-R147 WeakPolarHBondContact O-CB 3.48Å; E143-R147 PolarHBondContact O-N 3.35Å |
| 144 | V | 89.4 | Confident | 78 | Confident | 72 Ų | 72 | 106.7 Ų | 106.7 | 44% | 0.436 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -65.5 | -42.2 | 171.3 | 167.4 | 0 | 0 | 0 | 0 | 111.1 | P140 Q141 R146 R147 K148 | P140-V144 WeakPolarHBondContact O-CB 3.44Å; P140-V144 WeakPolarHBondContact O-CG2 3.42Å; P140-V144 PolarHBondContact O-N 2.81Å; Q141-V144 PolarHBondContact O-N 2.98Å; V144-R146 VanDerWaalsContact C-N 3.34Å; V144-R147 PolarHBondContact O-N 3.23Å; V144-K148 HydrophobicContact CG1-CD 4.46Å; V144-K148 WeakPolarHBondContact O-CB 2.89Å; V144-K148 WeakPolarHBondContact O-CG 3.45Å; V144-K148 PolarHBondContact O-N 3.42Å |
| 145 | A | 91.1 | Very high | 79.2 | Confident | 51 Ų | 51 | 107.2 Ų | 107.2 | 42% | 0.421 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.6 | -43.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111 | Q141 C142 K148 L149 | Q141-A145 VanDerWaalsContact O-CB 3.3Å; Q141-A145 WeakPolarHBondContact O-CB 3.36Å; Q141-A145 PolarHBondContact O-N 3.39Å; C142-A145 PolarHBondContact O-N 2.86Å; A145-K148 PolarHBondContact O-N 3.18Å; A145-L149 WeakPolarHBondContact O-CG 3.34Å; A145-L149 PolarHBondContact O-N 3.32Å |
| 146 | R | 92.1 | Very high | 80.6 | Confident | 136 Ų | 136 | 102.7 Ų | 102.7 | 51% | 0.513 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62 | -43.7 | 175.5 | -162.3 | -174 | 70.3 | 74.2 | 1.4 | 112 | C142 E143 V144 L149 Q150 | C142-R146 WeakPolarHBondContact O-CB 3.44Å; C142-R146 PolarHBondContact O-N 2.67Å; E143-R146 PolarHBondContact O-N 2.88Å; E143-R146 IonicContact OE1-CZ 3.52Å; E143-R146 IonicContact OE1-NE 3.52Å; E143-R146 IonicContact OE1-NH2 2.71Å; E143-R146 PolarHBondContact OE1-NH2 2.76Å; E143-R146 IonicContact OE2-CZ 3.72Å; E143-R146 IonicContact OE2-NE 2.97Å; E143-R146 PolarHBondContact OE2-NE 3.48Å; E143-R146 IonicContact OE2-NH2 3.58Å; V144-R146 VanDerWaalsContact C-N 3.34Å; R146-L149 PolarHBondContact O-N 3.11Å; R146-Q150 PolarHBondContact O-N 3.28Å |
| 147 | R | 92.8 | Very high | 82 | Confident | 164 Ų | 164 | 102.2 Ų | 102.2 | 62% | 0.619 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -64.8 | -39 | 175.4 | -172.7 | 179.6 | -66.8 | 161.6 | 1.2 | 112.4 | E143 V144 Q150 E151 | E143-R147 WeakPolarHBondContact O-CB 3.48Å; E143-R147 PolarHBondContact O-N 3.35Å; V144-R147 PolarHBondContact O-N 3.23Å; R147-Q150 WeakPolarHBondContact O-CB 3.28Å; R147-Q150 PolarHBondContact O-N 2.94Å; R147-E151 WeakPolarHBondContact O-CB 3.25Å; R147-E151 PolarHBondContact O-N 3.39Å |
| 148 | K | 92.8 | Very high | 82.6 | Confident | 123 Ų | 123 | 101.4 Ų | 101.4 | 54% | 0.535 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68.1 | -36.7 | 175.1 | -78 | -170.1 | 173.4 | -170.3 | 0 | 112.5 | V144 A145 Q150 E151 I152 | V144-K148 HydrophobicContact CG1-CD 4.46Å; V144-K148 WeakPolarHBondContact O-CB 2.89Å; V144-K148 WeakPolarHBondContact O-CG 3.45Å; V144-K148 PolarHBondContact O-N 3.42Å; A145-K148 PolarHBondContact O-N 3.18Å; K148-Q150 VanDerWaalsContact C-N 3.34Å; K148-E151 PolarHBondContact O-N 3.27Å; K148-I152 WeakPolarHBondContact O-CD1 3.25Å; K148-I152 WeakPolarHBondContact O-CG1 3.41Å; K148-I152 PolarHBondContact O-N 3.49Å |
| 149 | L | 94.4 | Very high | 82.9 | Confident | 119 Ų | 119 | 105.3 Ų | 105.3 | 62% | 0.623 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64 | -41.9 | 172.2 | -73.9 | 171.5 | 0 | 0 | 0 | 111 | A145 R146 I152 E153 | A145-L149 WeakPolarHBondContact O-CG 3.34Å; A145-L149 PolarHBondContact O-N 3.32Å; R146-L149 PolarHBondContact O-N 3.11Å; L149-I152 PolarHBondContact O-N 3.37Å; L149-E153 WeakPolarHBondContact O-CB 3.02Å; L149-E153 PolarHBondContact O-N 3.42Å |
| 150 | Q | 92.5 | Very high | 83.4 | Confident | 74 Ų | 74 | 104.3 Ų | 104.3 | 35% | 0.346 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.3 | -44.1 | 174 | -167 | 66.7 | 57.6 | 0 | 0 | 112.1 | R146 R147 K148 I152 E153 D154 | R146-Q150 PolarHBondContact O-N 3.28Å; R147-Q150 WeakPolarHBondContact O-CB 3.28Å; R147-Q150 PolarHBondContact O-N 2.94Å; K148-Q150 VanDerWaalsContact C-N 3.34Å; Q150-I152 VanDerWaalsContact C-N 3.26Å; Q150-I152 PolarHBondContact O-N 3.47Å; Q150-E153 PolarHBondContact NE2-OE2 3.15Å; Q150-E153 PolarHBondContact O-N 2.69Å; Q150-E153 VanDerWaalsContact O-N 3.17Å; Q150-D154 PolarHBondContact NE2-OD1 2.76Å; Q150-D154 WeakPolarHBondContact O-CB 3.49Å; Q150-D154 PolarHBondContact O-N 2.97Å |
| 151 | E | 93.2 | Very high | 82.7 | Confident | 109 Ų | 109 | 108.3 Ų | 108.3 | 51% | 0.509 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -58.5 | -39 | 176.7 | -177.6 | -164.5 | 160.4 | 0 | 0 | 111.9 | R147 K148 R155 | R147-E151 WeakPolarHBondContact O-CB 3.25Å; R147-E151 PolarHBondContact O-N 3.39Å; K148-E151 PolarHBondContact O-N 3.27Å; E151-R155 VanDerWaalsContact O-CB 3.27Å; E151-R155 WeakPolarHBondContact O-CB 3.27Å; E151-R155 PolarHBondContact O-N 2.94Å |
| 152 | I | 91.2 | Very high | 82.3 | Confident | 69 Ų | 69 | 107.4 Ų | 107.4 | 35% | 0.354 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -70.9 | -42.8 | 176.5 | -66 | 161.6 | 0 | 0 | 0 | 110.6 | K148 L149 Q150 R155 I156 | K148-I152 WeakPolarHBondContact O-CD1 3.25Å; K148-I152 WeakPolarHBondContact O-CG1 3.41Å; K148-I152 PolarHBondContact O-N 3.49Å; L149-I152 PolarHBondContact O-N 3.37Å; Q150-I152 VanDerWaalsContact C-N 3.26Å; Q150-I152 PolarHBondContact O-N 3.47Å; I152-R155 PolarHBondContact O-N 2.83Å; I152-I156 HydrophobicContact CG2-CD1 3.63Å; I152-I156 HydrophobicContact CG2-CG1 4.34Å; I152-I156 WeakPolarHBondContact O-CB 3.27Å; I152-I156 WeakPolarHBondContact O-CD1 3.38Å; I152-I156 WeakPolarHBondContact O-CG1 3.32Å; I152-I156 PolarHBondContact O-N 2.65Å |
| 153 | E | 89.7 | Confident | 81.5 | Confident | 102 Ų | 102 | 109.4 Ų | 109.4 | 48% | 0.477 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -59.6 | -48.9 | 175.5 | 178.8 | 176.1 | -150.5 | 0 | 0 | 111 | L149 Q150 R155 I156 I157 | L149-E153 WeakPolarHBondContact O-CB 3.02Å; L149-E153 PolarHBondContact O-N 3.42Å; Q150-E153 PolarHBondContact NE2-OE2 3.15Å; Q150-E153 PolarHBondContact O-N 2.69Å; Q150-E153 VanDerWaalsContact O-N 3.17Å; E153-R155 VanDerWaalsContact C-N 3.34Å; E153-R155 PolarHBondContact O-N 3.41Å; E153-I156 PolarHBondContact O-N 2.96Å; E153-I157 HydrophobicContact CG-CD1 3.64Å; E153-I157 HydrophobicContact CG-CG1 4.46Å; E153-I157 WeakPolarHBondContact O-CB 3.21Å; E153-I157 WeakPolarHBondContact O-CD1 3.48Å; E153-I157 WeakPolarHBondContact O-CG1 2.99Å; E153-I157 PolarHBondContact O-N 3.09Å |
| 154 | D | 86.8 | Confident | 80.1 | Confident | 76 Ų | 76 | 108.8 Ų | 108.8 | 41% | 0.406 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.1 | -42.4 | 178.9 | -63.6 | -9.1 | 0 | 0 | 0 | 110.9 | Q150 I156 I157 D158 | Q150-D154 PolarHBondContact NE2-OD1 2.76Å; Q150-D154 WeakPolarHBondContact O-CB 3.49Å; Q150-D154 PolarHBondContact O-N 2.97Å; D154-I156 PolarHBondContact O-N 2.65Å; D154-I157 PolarHBondContact O-N 2.71Å; D154-D158 PolarHBondContact O-N 2.88Å |
| 155 | R | 87.1 | Confident | 78.6 | Confident | 137 Ų | 137 | 109.2 Ų | 109.2 | 52% | 0.517 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.7 | -37.2 | 176.7 | -172.1 | 177 | 67 | -151.5 | -3.4 | 112.9 | E151 I152 E153 E159 | E151-R155 VanDerWaalsContact O-CB 3.27Å; E151-R155 WeakPolarHBondContact O-CB 3.27Å; E151-R155 PolarHBondContact O-N 2.94Å; I152-R155 PolarHBondContact O-N 2.83Å; E153-R155 VanDerWaalsContact C-N 3.34Å; E153-R155 PolarHBondContact O-N 3.41Å; R155-E159 VanDerWaalsContact O-CB 3.27Å; R155-E159 WeakPolarHBondContact O-CB 3.15Å; R155-E159 PolarHBondContact O-N 3.16Å; R155-E159 VanDerWaalsContact O-N 3.13Å |
| 156 | I | 81.1 | Confident | 77 | Confident | 80 Ų | 80 | 111 Ų | 111 | 41% | 0.41 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -69.4 | -41.6 | 176.5 | -70.1 | 166.4 | 0 | 0 | 0 | 110.1 | I152 E153 D154 D158 E159 D160 | I152-I156 HydrophobicContact CG2-CD1 3.63Å; I152-I156 HydrophobicContact CG2-CG1 4.34Å; I152-I156 WeakPolarHBondContact O-CB 3.27Å; I152-I156 WeakPolarHBondContact O-CD1 3.38Å; I152-I156 WeakPolarHBondContact O-CG1 3.32Å; I152-I156 PolarHBondContact O-N 2.65Å; E153-I156 PolarHBondContact O-N 2.96Å; D154-I156 PolarHBondContact O-N 2.65Å; I156-D158 PolarHBondContact O-N 3.01Å; I156-E159 PolarHBondContact O-N 3.17Å; I156-D160 WeakPolarHBondContact CG2-OD2 3.35Å; I156-D160 WeakPolarHBondContact O-CB 3.33Å; I156-D160 PolarHBondContact O-N 3.21Å |
| 157 | I | 78 | Confident | 75.5 | Confident | 98 Ų | 98 | 113.1 Ų | 113.1 | 50% | 0.503 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -64.2 | -41.4 | 179.1 | -67.7 | 164.5 | 0 | 0 | 0 | 111.4 | E153 D154 | E153-I157 HydrophobicContact CG-CD1 3.64Å; E153-I157 HydrophobicContact CG-CG1 4.46Å; E153-I157 WeakPolarHBondContact O-CB 3.21Å; E153-I157 WeakPolarHBondContact O-CD1 3.48Å; E153-I157 WeakPolarHBondContact O-CG1 2.99Å; E153-I157 PolarHBondContact O-N 3.09Å; D154-I157 PolarHBondContact O-N 2.71Å |
| 158 | D | 64.6 | Low | 74 | Confident | 134 Ų | 134 | 108.3 Ų | 108.3 | 72% | 0.717 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -72 | -27.5 | 177.3 | -72.4 | -25.7 | 0 | 0 | 0 | 113.1 | D154 I156 | D154-D158 PolarHBondContact O-N 2.88Å; I156-D158 PolarHBondContact O-N 3.01Å |
| 159 | E | 62.2 | Low | 72.5 | Confident | 133 Ų | 133 | 108 Ų | 108 | 62% | 0.621 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -81.9 | -22.4 | 178.4 | -166.6 | 171.5 | -169 | 0 | 0 | 112.5 | R155 I156 | R155-E159 VanDerWaalsContact O-CB 3.27Å; R155-E159 WeakPolarHBondContact O-CB 3.15Å; R155-E159 PolarHBondContact O-N 3.16Å; R155-E159 VanDerWaalsContact O-N 3.13Å; I156-E159 PolarHBondContact O-N 3.17Å |
| 160 | D | 64.9 | Low | 71.2 | Confident | 112 Ų | 112 | 108.6 Ų | 108.6 | 60% | 0.599 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -94.7 | -10 | -175.8 | -69.7 | -21.5 | 0 | 0 | 0 | 114.8 | I156 | I156-D160 WeakPolarHBondContact CG2-OD2 3.35Å; I156-D160 WeakPolarHBondContact O-CB 3.33Å; I156-D160 PolarHBondContact O-N 3.21Å |
| 161 | E | 58.2 | Low | 70.3 | Confident | 186 Ų | 186 | 112.2 Ų | 112.2 | 87% | 0.869 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.5 | 15.3 | 168.8 | -150.7 | -176.1 | 178.1 | 0 | 0 | 113.4 | ||
| 162 | E | 62 | Low | 69.8 | Low | 123 Ų | 123 | 113.4 Ų | 113.4 | 58% | 0.575 | 57% | 0.574 | S | S | * | * | trans | -144.1 | 68.8 | 158.1 | -147.1 | -169.5 | -165.1 | 0 | 0 | 108.4 | E164 | E162-E164 VanDerWaalsContact CD-CD 3.48Å; E162-E164 VanDerWaalsContact CD-CG 3.42Å; E162-E164 HydrophobicContact CG-CG 3.63Å; E162-E164 PolarHBondContact O-N 3.05Å; E162-E164 VanDerWaalsContact OE1-OE2 3.04Å | ||
| 163 | V | 60.2 | Low | 69.5 | Low | 122 Ų | 122 | 116.2 Ų | 116.2 | 74% | 0.739 | 60% | 0.597 | S | S | * | * | trans | -63.5 | 79.6 | 143.6 | 177.1 | 0 | 0 | 0 | 0 | 105 | A165 | V163-A165 PolarHBondContact O-N 3.08Š| ||
| 164 | E | 58.7 | Low | 69.3 | Low | 64 Ų | 64 | 116.3 Ų | 116.3 | 30% | 0.299 | 61% | 0.609 | S | S | . | * | trans | -47.2 | 100.4 | 150.1 | -76 | -64.5 | -89.6 | 0 | 0 | 103.1 | E162 D166 R167 | E162-E164 VanDerWaalsContact CD-CD 3.48Å; E162-E164 VanDerWaalsContact CD-CG 3.42Å; E162-E164 HydrophobicContact CG-CG 3.63Å; E162-E164 PolarHBondContact O-N 3.05Å; E162-E164 VanDerWaalsContact OE1-OE2 3.04Å; E164-D166 WeakPolarHBondContact O-CA 3.26Å; E164-D166 PolarHBondContact O-N 2.98Å; E164-R167 VanDerWaalsContact CD-CZ 3.48Å; E164-R167 WeakPolarHBondContact OE1-CD 3.23Å; E164-R167 WeakPolarHBondContact OE1-CG 3.43Å; E164-R167 IonicContact OE1-CZ 3.48Å; E164-R167 IonicContact OE1-NE 2.67Å; E164-R167 PolarHBondContact OE1-NE 2.77Å; E164-R167 IonicContact OE1-NH1 3.18Å; E164-R167 PolarHBondContact OE1-NH1 2.91Å; E164-R167 IonicContact OE1-NH2 3.13Å; E164-R167 PolarHBondContact OE1-NH2 2.77Å; E164-R167 IonicContact OE2-CZ 2.8Å; E164-R167 IonicContact OE2-NE 3.35Å; E164-R167 PolarHBondContact OE2-NE 2.94Å; E164-R167 IonicContact OE2-NH2 2.95Å; E164-R167 PolarHBondContact OE2-NH2 3.21Å | ||
| 165 | A | 57.2 | Low | 69.5 | Low | 82 Ų | 82 | 119.6 Ų | 119.6 | 68% | 0.678 | 63% | 0.626 | S | S | * | * | trans | -54.8 | 96.7 | 165.1 | 0 | 0 | 0 | 0 | 0 | 103.5 | V163 R167 | V163-A165 PolarHBondContact O-N 3.08Å; A165-R167 VanDerWaalsContact C-N 3.33Å; A165-R167 WeakPolarHBondContact O-CG 3.48Å; A165-R167 PolarHBondContact O-N 3.34Å | ||
| 166 | D | 58.1 | Low | 69.7 | Low | 89 Ų | 89 | 119.1 Ų | 119.1 | 48% | 0.476 | 64% | 0.638 | S | S | . | * | trans | -17 | 90.4 | -168.9 | -177.8 | 7.7 | 0 | 0 | 0 | 111.9 | E164 N168 | E164-D166 WeakPolarHBondContact O-CA 3.26Å; E164-D166 PolarHBondContact O-N 2.98Å; D166-N168 PolarHBondContact O-N 2.89Å; D166-N168 WeakPolarHBondContact OD1-CA 3.27Å; D166-N168 WeakPolarHBondContact OD1-CB 3.27Å; D166-N168 PolarHBondContact OD1-N 3Å; D166-N168 PolarHBondContact OD1-ND2 3.38Å; D166-N168 PolarHBondContact OD1-OD1 3.44Å; D166-N168 PolarHBondContact OD2-OD1 3Å | ||
| 167 | R | 60.6 | Low | 70.2 | Confident | 180 Ų | 180 | 118.5 Ų | 118.5 | 68% | 0.679 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.7 | 5.3 | 178.7 | -55.2 | -166.2 | -174.6 | 165.5 | 13.4 | 110.7 | E164 A165 | E164-R167 VanDerWaalsContact CD-CZ 3.48Å; E164-R167 WeakPolarHBondContact OE1-CD 3.23Å; E164-R167 WeakPolarHBondContact OE1-CG 3.43Å; E164-R167 IonicContact OE1-CZ 3.48Å; E164-R167 IonicContact OE1-NE 2.67Å; E164-R167 PolarHBondContact OE1-NE 2.77Å; E164-R167 IonicContact OE1-NH1 3.18Å; E164-R167 PolarHBondContact OE1-NH1 2.91Å; E164-R167 IonicContact OE1-NH2 3.13Å; E164-R167 PolarHBondContact OE1-NH2 2.77Å; E164-R167 IonicContact OE2-CZ 2.8Å; E164-R167 IonicContact OE2-NE 3.35Å; E164-R167 PolarHBondContact OE2-NE 2.94Å; E164-R167 IonicContact OE2-NH2 2.95Å; E164-R167 PolarHBondContact OE2-NH2 3.21Å; A165-R167 VanDerWaalsContact C-N 3.33Å; A165-R167 WeakPolarHBondContact O-CG 3.48Å; A165-R167 PolarHBondContact O-N 3.34Å |
| 168 | N | 60.6 | Low | 71 | Confident | 63 Ų | 63 | 116.9 Ų | 116.9 | 34% | 0.337 | 63% | 0.632 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -101.7 | 37.3 | 178.5 | 83.2 | 56.6 | 0 | 0 | 0 | 114.6 | D166 N170 H171 | D166-N168 PolarHBondContact O-N 2.89Å; D166-N168 WeakPolarHBondContact OD1-CA 3.27Å; D166-N168 WeakPolarHBondContact OD1-CB 3.27Å; D166-N168 PolarHBondContact OD1-N 3Å; D166-N168 PolarHBondContact OD1-ND2 3.38Å; D166-N168 PolarHBondContact OD1-OD1 3.44Å; D166-N168 PolarHBondContact OD2-OD1 3Å; N168-N170 PolarHBondContact O-N 3.49Å; N168-H171 HydrophobicContact CB-CB 4.28Å; N168-H171 WeakPolarHBondContact CB-CD2 3.38Å; N168-H171 PolarHBondContact O-N 3.13Å |
| 169 | V | 62.3 | Low | 72.4 | Confident | 115 Ų | 115 | 115.8 Ų | 115.8 | 70% | 0.697 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.6 | -9.4 | 161.5 | -59.8 | 0 | 0 | 0 | 0 | 114.3 | ||
| 170 | N | 65.7 | Low | 73.9 | Confident | 133 Ų | 133 | 115 Ų | 115 | 71% | 0.711 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.1 | -1.4 | 175.9 | -54.4 | -61.9 | 0 | 0 | 0 | 115.4 | N168 | N168-N170 PolarHBondContact O-N 3.49Š|
| 171 | H | 73.7 | Confident | 75 | Confident | 149 Ų | 149 | 113.7 Ų | 113.7 | 69% | 0.69 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -86.5 | -8.2 | 176.3 | -73.7 | -15.4 | 0 | 0 | 0 | 113.7 | N168 | N168-H171 HydrophobicContact CB-CB 4.28Å; N168-H171 WeakPolarHBondContact CB-CD2 3.38Å; N168-H171 PolarHBondContact O-N 3.13Å |
| 172 | L | 83.2 | Confident | 76.6 | Confident | 135 Ų | 135 | 109.9 Ų | 109.9 | 71% | 0.707 | 60% | 0.603 | S | S | * | * | S | Bend | trans | -88.6 | 141.1 | 173.1 | -62.7 | 176.7 | 0 | 0 | 0 | 110.6 | S174 | L172-S174 PolarHBondContact O-N 3.36Å; L172-S174 VanDerWaalsContact O-N 3.16Å |
| 173 | P | 85.6 | Confident | 77.8 | Confident | 127 Ų | 127 | 107.3 Ų | 107.3 | 83% | 0.825 | 60% | 0.596 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 122.5 | 173.2 | 23.5 | -31.7 | 0 | 0 | 0 | 109.8 | ||
| 174 | S | 85.6 | Confident | 79 | Confident | 105 Ų | 105 | 102.4 Ų | 102.4 | 73% | 0.734 | 57% | 0.57 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 121.7 | 176.4 | -170.1 | 0 | 0 | 0 | 0 | 109.8 | L172 V176 | L172-S174 PolarHBondContact O-N 3.36Å; L172-S174 VanDerWaalsContact O-N 3.16Å; S174-V176 PolarHBondContact O-N 3.49Å |
| 175 | L | 89.1 | Confident | 80.1 | Confident | 145 Ų | 145 | 101.8 Ų | 101.8 | 76% | 0.759 | 57% | 0.568 | S | S | * | * | trans | -76.3 | 108.3 | 172.3 | -178.7 | 65.9 | 0 | 0 | 0 | 109.4 | L177 | L175-L177 HydrophobicContact CD2-CD2 3.78Å; L175-L177 HydrophobicContact CG-CD2 3.89Å | ||
| 176 | V | 91.4 | Very high | 81.3 | Confident | 126 Ų | 126 | 106.5 Ų | 106.5 | 76% | 0.764 | 57% | 0.573 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 121 | 173.3 | -176.9 | 0 | 0 | 0 | 0 | 109.3 | S174 | S174-V176 PolarHBondContact O-N 3.49Š|
| 177 | L | 92.9 | Very high | 82.3 | Confident | 67 Ų | 67 | 112 Ų | 112 | 35% | 0.351 | 59% | 0.587 | S | S | . | * | P | Polyproline II helix | trans | -92.7 | 143.1 | 177.6 | -57.8 | 178.8 | 0 | 0 | 0 | 110.7 | L175 M181 L185 | L175-L177 HydrophobicContact CD2-CD2 3.78Å; L175-L177 HydrophobicContact CG-CD2 3.89Å; L177-M181 HydrophobicContact CB-CE 3.79Å; L177-M181 HydrophobicContact CD2-CE 3.34Å; L177-M181 HydrophobicContact CD2-SD 3.92Å; L177-M181 HydrophobicContact CG-CE 4.12Å; L177-L185 HydrophobicContact CD1-CD1 4.26Å |
| 178 | S | 94.3 | Very high | 82.8 | Confident | 65 Ų | 65 | 107.4 Ų | 107.4 | 46% | 0.455 | 57% | 0.574 | S | S | . | * | P | Polyproline II helix | trans | -64.8 | 153.3 | 172.1 | 66.1 | 0 | 0 | 0 | 0 | 111.5 | T180 M181 K182 | S178-T180 PolarHBondContact O-N 2.85Å; S178-M181 PolarHBondContact O-N 3.07Å; S178-M181 VanDerWaalsContact OG-CB 3.26Å; S178-M181 WeakPolarHBondContact OG-CB 3.26Å; S178-M181 PolarHBondContact OG-N 3.03Å; S178-K182 WeakPolarHBondContact O-CB 3.42Å; S178-K182 PolarHBondContact O-N 3.3Å |
| 179 | D | 94.3 | Very high | 83.3 | Confident | 110 Ų | 110 | 110.4 Ų | 110.4 | 59% | 0.588 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -60.1 | -36.2 | 179.8 | -75.5 | -38.6 | 0 | 0 | 0 | 112.7 | K182 T183 | D179-K182 WeakPolarHBondContact OD1-CE 3.44Å; D179-K182 IonicContact OD1-NZ 2.76Å; D179-K182 PolarHBondContact OD1-NZ 2.91Å; D179-T183 WeakPolarHBondContact O-CB 3.45Å; D179-T183 VanDerWaalsContact O-CG2 3.3Å; D179-T183 WeakPolarHBondContact O-CG2 3.43Å; D179-T183 PolarHBondContact O-N 3.04Å; D179-T183 PolarHBondContact O-OG1 3.38Å |
| 180 | T | 92.7 | Very high | 83.5 | Confident | 117 Ų | 117 | 111.6 Ų | 111.6 | 72% | 0.718 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -62.8 | -44.4 | 173.9 | -49.4 | 0 | 0 | 0 | 0 | 111.2 | S178 T183 G184 | S178-T180 PolarHBondContact O-N 2.85Å; T180-T183 PolarHBondContact O-OG1 2.93Å; T180-G184 WeakPolarHBondContact O-CA 3.46Å; T180-G184 PolarHBondContact O-N 3.41Å |
| 181 | M | 89.3 | Confident | 83.8 | Confident | 84 Ų | 84 | 113.1 Ų | 113.1 | 41% | 0.414 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -70.3 | -41.6 | 178.7 | -179.9 | 164.9 | 45.5 | 0 | 0 | 111.9 | L177 S178 T183 G184 L185 | L177-M181 HydrophobicContact CB-CE 3.79Å; L177-M181 HydrophobicContact CD2-CE 3.34Å; L177-M181 HydrophobicContact CD2-SD 3.92Å; L177-M181 HydrophobicContact CG-CE 4.12Å; S178-M181 PolarHBondContact O-N 3.07Å; S178-M181 VanDerWaalsContact OG-CB 3.26Å; S178-M181 WeakPolarHBondContact OG-CB 3.26Å; S178-M181 PolarHBondContact OG-N 3.03Å; M181-T183 PolarHBondContact O-N 3.44Å; M181-G184 PolarHBondContact O-N 3.33Å; M181-L185 HydrophobicContact CG-CD1 4.14Å; M181-L185 WeakPolarHBondContact O-CB 3.18Å; M181-L185 WeakPolarHBondContact O-CG 3.43Å; M181-L185 PolarHBondContact O-N 3.07Å |
| 182 | K | 90.7 | Very high | 84.1 | Confident | 107 Ų | 107 | 110.7 Ų | 110.7 | 47% | 0.465 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -60.7 | -43.6 | 176.2 | -177.4 | 178.9 | 67.2 | -161.1 | 0 | 112 | S178 D179 K186 | S178-K182 WeakPolarHBondContact O-CB 3.42Å; S178-K182 PolarHBondContact O-N 3.3Å; D179-K182 WeakPolarHBondContact OD1-CE 3.44Å; D179-K182 IonicContact OD1-NZ 2.76Å; D179-K182 PolarHBondContact OD1-NZ 2.91Å; K182-K186 WeakPolarHBondContact O-CB 3.45Å; K182-K186 PolarHBondContact O-N 2.84Å |
| 183 | T | 87.6 | Confident | 84.1 | Confident | 69 Ų | 69 | 107.1 Ų | 107.1 | 42% | 0.423 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -80.3 | -31 | 179.4 | 56.3 | 0 | 0 | 0 | 0 | 113.1 | D179 T180 M181 R187 | D179-T183 WeakPolarHBondContact O-CB 3.45Å; D179-T183 VanDerWaalsContact O-CG2 3.3Å; D179-T183 WeakPolarHBondContact O-CG2 3.43Å; D179-T183 PolarHBondContact O-N 3.04Å; D179-T183 PolarHBondContact O-OG1 3.38Å; T180-T183 PolarHBondContact O-OG1 2.93Å; M181-T183 PolarHBondContact O-N 3.44Å; T183-R187 WeakPolarHBondContact O-CB 3.19Å; T183-R187 PolarHBondContact O-N 3.02Å |
| 184 | G | 85.8 | Confident | 84.1 | Confident | 19 Ų | 19 | 104.2 Ų | 104.2 | 20% | 0.196 | 54% | 0.543 | C | S | . | . | H | α-helix | trans | -56.3 | -65.2 | 168.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | T180 M181 K186 R187 E188 | T180-G184 WeakPolarHBondContact O-CA 3.46Å; T180-G184 PolarHBondContact O-N 3.41Å; M181-G184 PolarHBondContact O-N 3.33Å; G184-K186 VanDerWaalsContact C-N 3.3Å; G184-K186 PolarHBondContact O-N 2.91Å; G184-R187 WeakPolarHBondContact O-CA 3.49Å; G184-R187 WeakPolarHBondContact O-CB 3.39Å; G184-R187 PolarHBondContact O-N 2.81Å; G184-E188 WeakPolarHBondContact O-CG 3.37Å; G184-E188 PolarHBondContact O-N 3.06Å; G184-E188 VanDerWaalsContact O-N 3.14Å |
| 185 | L | 82.7 | Confident | 84.3 | Confident | 50 Ų | 50 | 106.2 Ų | 106.2 | 26% | 0.262 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -50.5 | -48.5 | 179.6 | -71 | 172.4 | 0 | 0 | 0 | 112.2 | L177 M181 R187 E188 F189 F193 | L177-L185 HydrophobicContact CD1-CD1 4.26Å; M181-L185 HydrophobicContact CG-CD1 4.14Å; M181-L185 WeakPolarHBondContact O-CB 3.18Å; M181-L185 WeakPolarHBondContact O-CG 3.43Å; M181-L185 PolarHBondContact O-N 3.07Å; L185-R187 PolarHBondContact O-N 3.17Å; L185-R187 VanDerWaalsContact O-N 3.12Å; L185-E188 PolarHBondContact O-N 3.32Å; L185-F189 VanDerWaalsContact O-CD2 3.28Å; L185-F189 WeakPolarHBondContact O-CD2 3.27Å; L185-F189 PolarHBondContact O-N 3.03Å; L185-F189 VanDerWaalsContact O-N 3.13Å; L185-F193 HydrophobicContact CD2-CD2 4.45Å; L185-F193 HydrophobicContact CD2-CE2 3.89Å; L185-F193 HydrophobicContact CD2-CZ 4.17Å |
| 186 | K | 80.8 | Confident | 84.2 | Confident | 182 Ų | 182 | 105.9 Ų | 105.9 | 79% | 0.791 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -56.1 | -31.1 | 177.7 | -113.6 | 178.2 | 151.5 | -170.9 | 0 | 114.4 | K182 G184 | K182-K186 WeakPolarHBondContact O-CB 3.45Å; K182-K186 PolarHBondContact O-N 2.84Å; G184-K186 VanDerWaalsContact C-N 3.3Å; G184-K186 PolarHBondContact O-N 2.91Å |
| 187 | R | 79.1 | Confident | 84 | Confident | 204 Ų | 204 | 104.1 Ų | 104.1 | 77% | 0.77 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -84 | -34.8 | -178.2 | -173.5 | -168.4 | -58.5 | -173.6 | 1.3 | 112.7 | T183 G184 L185 | T183-R187 WeakPolarHBondContact O-CB 3.19Å; T183-R187 PolarHBondContact O-N 3.02Å; G184-R187 WeakPolarHBondContact O-CA 3.49Å; G184-R187 WeakPolarHBondContact O-CB 3.39Å; G184-R187 PolarHBondContact O-N 2.81Å; L185-R187 PolarHBondContact O-N 3.17Å; L185-R187 VanDerWaalsContact O-N 3.12Å |
| 188 | E | 72.6 | Confident | 83.9 | Confident | 83 Ų | 83 | 105.8 Ų | 105.8 | 39% | 0.388 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -94.3 | -6.9 | -174.2 | 17.3 | 178.1 | -157.4 | 0 | 0 | 113.7 | G184 L185 D190 F193 | G184-E188 WeakPolarHBondContact O-CG 3.37Å; G184-E188 PolarHBondContact O-N 3.06Å; G184-E188 VanDerWaalsContact O-N 3.14Å; L185-E188 PolarHBondContact O-N 3.32Å; E188-D190 PolarHBondContact O-N 2.91Å; E188-D190 VanDerWaalsContact O-N 3.12Å; E188-F193 HydrophobicContact CB-CB 4.38Å; E188-F193 WeakPolarHBondContact O-CB 3.39Å; E188-F193 PolarHBondContact O-N 3.22Å |
| 189 | F | 69.8 | Low | 83.7 | Confident | 126 Ų | 126 | 107 Ų | 107 | 55% | 0.553 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.5 | -17 | 178 | -115 | -91.6 | 0 | 0 | 0 | 114.4 | L185 E191 F193 | L185-F189 VanDerWaalsContact O-CD2 3.28Å; L185-F189 WeakPolarHBondContact O-CD2 3.27Å; L185-F189 PolarHBondContact O-N 3.03Å; L185-F189 VanDerWaalsContact O-N 3.13Å; F189-E191 VanDerWaalsContact C-N 3.3Å; F189-E191 PolarHBondContact O-N 3.23Å; F189-F193 HydrophobicContact CD2-CD1 4.31Å; F189-F193 HydrophobicContact CE2-CD1 4.18Å; F189-F193 HydrophobicContact CE2-CE1 4.09Å; F189-F193 HydrophobicContact CZ-CD1 4.35Å; F189-F193 HydrophobicContact CZ-CE1 4.2Å |
| 190 | D | 66.8 | Low | 83.2 | Confident | 141 Ų | 141 | 105 Ų | 105 | 75% | 0.754 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.5 | 80.5 | 173.4 | -94.6 | -11.9 | 0 | 0 | 0 | 110.8 | E188 V192 | E188-D190 PolarHBondContact O-N 2.91Å; E188-D190 VanDerWaalsContact O-N 3.12Å; D190-V192 PolarHBondContact O-N 3.43Å |
| 191 | E | 71.5 | Confident | 82.9 | Confident | 165 Ų | 165 | 106.8 Ų | 106.8 | 77% | 0.771 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.7 | -29.7 | 169.6 | -75.8 | 168.7 | 145.8 | 0 | 0 | 117.3 | F189 K195 | F189-E191 VanDerWaalsContact C-N 3.3Å; F189-E191 PolarHBondContact O-N 3.23Å; E191-K195 WeakPolarHBondContact O-CB 3.35Å; E191-K195 PolarHBondContact O-N 3.42Å |
| 192 | V | 79.9 | Confident | 82.7 | Confident | 98 Ų | 98 | 106.9 Ų | 106.9 | 59% | 0.594 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -67.3 | -43.7 | 177.7 | 178.7 | 0 | 0 | 0 | 0 | 110.3 | D190 K195 K196 | D190-V192 PolarHBondContact O-N 3.43Å; V192-K195 PolarHBondContact O-N 3.25Å; V192-K196 WeakPolarHBondContact O-CB 3.38Å; V192-K196 PolarHBondContact O-N 3.44Å |
| 193 | F | 83.4 | Confident | 82.4 | Confident | 59 Ų | 59 | 109.2 Ų | 109.2 | 26% | 0.259 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63 | -49.2 | 175.9 | 179.8 | -105.1 | 0 | 0 | 0 | 111.9 | L185 E188 F189 K195 K196 M197 | L185-F193 HydrophobicContact CD2-CD2 4.45Å; L185-F193 HydrophobicContact CD2-CE2 3.89Å; L185-F193 HydrophobicContact CD2-CZ 4.17Å; E188-F193 HydrophobicContact CB-CB 4.38Å; E188-F193 WeakPolarHBondContact O-CB 3.39Å; E188-F193 PolarHBondContact O-N 3.22Å; F189-F193 HydrophobicContact CD2-CD1 4.31Å; F189-F193 HydrophobicContact CE2-CD1 4.18Å; F189-F193 HydrophobicContact CE2-CE1 4.09Å; F189-F193 HydrophobicContact CZ-CD1 4.35Å; F189-F193 HydrophobicContact CZ-CE1 4.2Å; F193-K195 VanDerWaalsContact C-N 3.33Å; F193-K195 PolarHBondContact O-N 3.5Å; F193-K196 PolarHBondContact O-N 3.32Å; F193-M197 HydrophobicContact CD1-CE 3.87Å; F193-M197 HydrophobicContact CE1-CE 3.25Å; F193-M197 HydrophobicContact CZ-CE 3.79Å; F193-M197 WeakPolarHBondContact O-CB 3.49Å; F193-M197 PolarHBondContact O-N 2.85Å |
| 194 | T | 85.7 | Confident | 82 | Confident | 66 Ų | 66 | 112.3 Ų | 112.3 | 41% | 0.405 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -61.3 | -41.6 | 177.4 | -52.5 | 0 | 0 | 0 | 0 | 111.3 | M197 I198 | T194-M197 PolarHBondContact O-N 3.43Å; T194-I198 HydrophobicContact CG2-CD1 3.97Å; T194-I198 VanDerWaalsContact O-CG1 3.27Å; T194-I198 WeakPolarHBondContact O-CG1 3.44Å; T194-I198 PolarHBondContact O-N 3.02Å |
| 195 | K | 89.3 | Confident | 81.2 | Confident | 147 Ų | 147 | 116.9 Ų | 116.9 | 64% | 0.639 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -62 | -46 | 174.9 | -178 | -177.2 | 176.2 | -175.4 | 0 | 111.7 | E191 V192 F193 M197 I198 E199 | E191-K195 WeakPolarHBondContact O-CB 3.35Å; E191-K195 PolarHBondContact O-N 3.42Å; V192-K195 PolarHBondContact O-N 3.25Å; F193-K195 VanDerWaalsContact C-N 3.33Å; F193-K195 PolarHBondContact O-N 3.5Å; K195-M197 VanDerWaalsContact C-N 3.33Å; K195-M197 PolarHBondContact O-N 3.34Å; K195-I198 PolarHBondContact O-N 2.92Å; K195-E199 VanDerWaalsContact O-CB 3.25Å; K195-E199 WeakPolarHBondContact O-CB 3.5Å; K195-E199 PolarHBondContact O-N 2.94Å |
| 196 | K | 87.1 | Confident | 80.7 | Confident | 138 Ų | 138 | 121.7 Ų | 121.7 | 60% | 0.6 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -66.8 | -35.6 | -179.4 | -166.1 | 172.5 | 177.8 | -177.4 | 0 | 111.7 | V192 F193 S200 | V192-K196 WeakPolarHBondContact O-CB 3.38Å; V192-K196 PolarHBondContact O-N 3.44Å; F193-K196 PolarHBondContact O-N 3.32Å; K196-S200 VanDerWaalsContact O-CB 3.27Å; K196-S200 WeakPolarHBondContact O-CB 3.14Å; K196-S200 PolarHBondContact O-N 3.02Å; K196-S200 PolarHBondContact O-OG 3.12Å |
| 197 | M | 88.4 | Confident | 80.7 | Confident | 90 Ų | 90 | 121.2 Ų | 121.2 | 44% | 0.443 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -64.3 | -52.9 | 172.9 | -171.2 | -169 | -48.5 | 0 | 0 | 111.1 | F193 T194 K195 E199 S200 M201 | F193-M197 HydrophobicContact CD1-CE 3.87Å; F193-M197 HydrophobicContact CE1-CE 3.25Å; F193-M197 HydrophobicContact CZ-CE 3.79Å; F193-M197 WeakPolarHBondContact O-CB 3.49Å; F193-M197 PolarHBondContact O-N 2.85Å; T194-M197 PolarHBondContact O-N 3.43Å; K195-M197 VanDerWaalsContact C-N 3.33Å; K195-M197 PolarHBondContact O-N 3.34Å; M197-E199 VanDerWaalsContact C-N 3.31Å; M197-E199 PolarHBondContact O-N 2.96Å; M197-S200 PolarHBondContact O-N 3.35Å; M197-S200 VanDerWaalsContact O-N 3.15Å; M197-S200 PolarHBondContact O-OG 2.96Å; M197-M201 WeakPolarHBondContact O-CG 3.38Å; M197-M201 PolarHBondContact O-N 2.88Å |
| 198 | I | 89.4 | Confident | 80.9 | Confident | 101 Ų | 101 | 118.8 Ų | 118.8 | 52% | 0.518 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -59.6 | -44.1 | 178.2 | -66.2 | 166.1 | 0 | 0 | 0 | 110.4 | T194 K195 S200 M201 S202 | T194-I198 HydrophobicContact CG2-CD1 3.97Å; T194-I198 VanDerWaalsContact O-CG1 3.27Å; T194-I198 WeakPolarHBondContact O-CG1 3.44Å; T194-I198 PolarHBondContact O-N 3.02Å; K195-I198 PolarHBondContact O-N 2.92Å; I198-S200 PolarHBondContact O-N 2.97Å; I198-M201 PolarHBondContact O-N 3.43Å; I198-S202 VanDerWaalsContact O-CB 3.26Å; I198-S202 WeakPolarHBondContact O-CB 3.2Å; I198-S202 PolarHBondContact O-N 3.43Å; I198-S202 PolarHBondContact O-OG 3.29Å |
| 199 | E | 90.3 | Very high | 81.4 | Confident | 92 Ų | 92 | 119.4 Ų | 119.4 | 43% | 0.43 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -60.1 | -44.5 | 176.2 | -172.1 | -172.3 | 159.1 | 0 | 0 | 111.6 | K195 M197 M201 S202 R203 | K195-E199 VanDerWaalsContact O-CB 3.25Å; K195-E199 WeakPolarHBondContact O-CB 3.5Å; K195-E199 PolarHBondContact O-N 2.94Å; M197-E199 VanDerWaalsContact C-N 3.31Å; M197-E199 PolarHBondContact O-N 2.96Å; E199-M201 PolarHBondContact O-N 2.84Å; E199-S202 PolarHBondContact O-N 3.36Å; E199-R203 WeakPolarHBondContact O-CG 3.3Å; E199-R203 PolarHBondContact O-N 2.87Å; E199-R203 IonicContact OE1-CZ 2.69Å; E199-R203 IonicContact OE1-NH2 3.83Å; E199-R203 PolarHBondContact OE1-NH2 2.97Å |
| 200 | S | 85.3 | Confident | 82.2 | Confident | 67 Ų | 67 | 120 Ų | 120 | 47% | 0.469 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -64.2 | -39.6 | 179.6 | 70.2 | 0 | 0 | 0 | 0 | 112.7 | K196 M197 I198 S202 | K196-S200 VanDerWaalsContact O-CB 3.27Å; K196-S200 WeakPolarHBondContact O-CB 3.14Å; K196-S200 PolarHBondContact O-N 3.02Å; K196-S200 PolarHBondContact O-OG 3.12Å; M197-S200 PolarHBondContact O-N 3.35Å; M197-S200 VanDerWaalsContact O-N 3.15Å; M197-S200 PolarHBondContact O-OG 2.96Å; I198-S200 PolarHBondContact O-N 2.97Å; S200-S202 VanDerWaalsContact C-N 3.32Å |
| 201 | M | 84.8 | Confident | 82.9 | Confident | 155 Ų | 155 | 124.2 Ų | 124.2 | 76% | 0.764 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -76.9 | -20.6 | 178.6 | -65.7 | -62.7 | -66.4 | 0 | 0 | 112.7 | M197 I198 E199 R203 | M197-M201 WeakPolarHBondContact O-CG 3.38Å; M197-M201 PolarHBondContact O-N 2.88Å; I198-M201 PolarHBondContact O-N 3.43Å; E199-M201 PolarHBondContact O-N 2.84Å; M201-R203 VanDerWaalsContact C-N 3.34Å |
| 202 | S | 85.9 | Confident | 83.5 | Confident | 85 Ų | 85 | 124.4 Ų | 124.4 | 59% | 0.594 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.3 | -4.6 | 178.9 | -57.9 | 0 | 0 | 0 | 0 | 113 | I198 E199 S200 P204 | I198-S202 VanDerWaalsContact O-CB 3.26Å; I198-S202 WeakPolarHBondContact O-CB 3.2Å; I198-S202 PolarHBondContact O-N 3.43Å; I198-S202 PolarHBondContact O-OG 3.29Å; E199-S202 PolarHBondContact O-N 3.36Å; S200-S202 VanDerWaalsContact C-N 3.32Å; S202-P204 WeakPolarHBondContact O-CD 3.36Å |
| 203 | R | 85.3 | Confident | 83.5 | Confident | 156 Ų | 156 | 125.2 Ų | 125.2 | 59% | 0.589 | 64% | 0.638 | S | S | * | * | S | Bend | trans | -78.5 | 125.8 | 174 | -58.1 | -158.2 | 178 | -143.1 | -1 | 109.1 | E199 M201 S205 | E199-R203 WeakPolarHBondContact O-CG 3.3Å; E199-R203 PolarHBondContact O-N 2.87Å; E199-R203 IonicContact OE1-CZ 2.69Å; E199-R203 IonicContact OE1-NH2 3.83Å; E199-R203 PolarHBondContact OE1-NH2 2.97Å; M201-R203 VanDerWaalsContact C-N 3.34Å; R203-S205 VanDerWaalsContact C-N 3.34Å; R203-S205 PolarHBondContact O-N 2.71Å |
| 204 | P | 78.6 | Confident | 83.1 | Confident | 135 Ų | 135 | 129.6 Ų | 129.6 | 88% | 0.877 | 66% | 0.663 | S | S | * | * | trans | -64.9 | 97.1 | 167.8 | -13.4 | 28 | 0 | 0 | 0 | 107.8 | S202 | S202-P204 WeakPolarHBondContact O-CD 3.36Š| ||
| 205 | S | 67.8 | Low | 82.6 | Confident | 114 Ų | 114 | 131.1 Ų | 131.1 | 80% | 0.797 | 67% | 0.674 | S | S | * | * | trans | -98.4 | 8 | -165.3 | 57 | 0 | 0 | 0 | 0 | 114.5 | R203 | R203-S205 VanDerWaalsContact C-N 3.34Å; R203-S205 PolarHBondContact O-N 2.71Å | ||
| 206 | M | 73.9 | Confident | 81.8 | Confident | 152 Ų | 152 | 133 Ų | 133 | 75% | 0.749 | 69% | 0.686 | S | S | * | * | trans | -124.2 | 78.7 | -176.2 | -163.2 | 164.8 | 59.9 | 0 | 0 | 109.9 | L208 | M206-L208 HydrophobicContact CG-CD2 3.97Å; M206-L208 PolarHBondContact O-N 2.88Å; M206-L208 HydrophobicContact SD-CD2 4.42Å | ||
| 207 | E | 79.1 | Confident | 80.7 | Confident | 172 Ų | 172 | 133.5 Ų | 133.5 | 80% | 0.804 | 69% | 0.694 | S | S | * | * | trans | -76.1 | 114.9 | 159.8 | 61.9 | -179.2 | -176.8 | 0 | 0 | 108.3 | V209 | E207-V209 PolarHBondContact O-N 3.43Å; E207-V209 VanDerWaalsContact O-N 3.09Å | ||
| 208 | L | 83.3 | Confident | 79.4 | Confident | 152 Ų | 152 | 137.9 Ų | 137.9 | 80% | 0.796 | 72% | 0.718 | S | S | * | * | trans | -75.3 | 99.4 | 174.8 | -62.9 | 178.7 | 0 | 0 | 0 | 108.1 | M206 L210 | M206-L208 HydrophobicContact CG-CD2 3.97Å; M206-L208 PolarHBondContact O-N 2.88Å; M206-L208 HydrophobicContact SD-CD2 4.42Å; L208-L210 PolarHBondContact O-N 2.9Å | ||
| 209 | V | 84.8 | Confident | 77.8 | Confident | 96 Ų | 96 | 138.3 Ų | 138.3 | 58% | 0.582 | 73% | 0.73 | S | S | * | * | trans | -79.6 | 110 | 165.8 | 179.1 | 0 | 0 | 0 | 0 | 107.3 | E207 W211 | E207-V209 PolarHBondContact O-N 3.43Å; E207-V209 VanDerWaalsContact O-N 3.09Å; V209-W211 VanDerWaalsContact O-CD1 3.32Å; V209-W211 PolarHBondContact O-N 3.28Å | ||
| 210 | L | 86.3 | Confident | 75.8 | Confident | 140 Ų | 140 | 140.9 Ų | 140.9 | 73% | 0.733 | 75% | 0.746 | S | S | * | * | trans | -70.3 | 100.6 | 173.2 | -178.1 | 65.2 | 0 | 0 | 0 | 108.6 | L208 K212 | L208-L210 PolarHBondContact O-N 2.9Å; L210-K212 HydrophobicContact CD2-CD 4.26Å; L210-K212 HydrophobicContact CD2-CG 3.77Å; L210-K212 HydrophobicContact CG-CG 3.87Å; L210-K212 PolarHBondContact O-N 3.31Å | ||
| 211 | W | 81.6 | Confident | 74.5 | Confident | 228 Ų | 228 | 146.4 Ų | 146.4 | 86% | 0.864 | 76% | 0.762 | S | S | * | * | trans | -70.3 | 88.8 | 166 | -73.2 | 79.3 | 0 | 0 | 0 | 107.7 | V209 P213 | V209-W211 VanDerWaalsContact O-CD1 3.32Å; V209-W211 PolarHBondContact O-N 3.28Å; W211-P213 VanDerWaalsContact O-CD 3.23Å; W211-P213 WeakPolarHBondContact O-CD 3.35Å | ||
| 212 | K | 82.7 | Confident | 73.1 | Confident | 169 Ų | 169 | 144.7 Ų | 144.7 | 74% | 0.735 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 116.8 | 168.8 | -64.9 | -175.3 | 82.8 | 164.4 | 0 | 106.1 | L210 L214 | L210-K212 HydrophobicContact CD2-CD 4.26Å; L210-K212 HydrophobicContact CD2-CG 3.77Å; L210-K212 HydrophobicContact CG-CG 3.87Å; L210-K212 PolarHBondContact O-N 3.31Å; K212-L214 PolarHBondContact O-N 3.42Å |
| 213 | P | 81.6 | Confident | 71.8 | Confident | 116 Ų | 116 | 149.5 Ų | 149.5 | 75% | 0.753 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -56 | 137.5 | 172.1 | 10 | -10.2 | 0 | 0 | 0 | 108.1 | W211 | W211-P213 VanDerWaalsContact O-CD 3.23Å; W211-P213 WeakPolarHBondContact O-CD 3.35Å |
| 214 | L | 74 | Confident | 70.1 | Confident | 151 Ų | 151 | 148.1 Ų | 148.1 | 79% | 0.791 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 125.5 | 176.6 | -166.4 | 71 | 0 | 0 | 0 | 106.8 | K212 E216 | K212-L214 PolarHBondContact O-N 3.42Å; L214-E216 PolarHBondContact O-N 3.07Å; L214-E216 VanDerWaalsContact O-N 3.08Å |
| 215 | P | 76.3 | Confident | 68.7 | Low | 98 Ų | 98 | 146.9 Ų | 146.9 | 64% | 0.636 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 125.4 | 177 | -22.9 | 31.4 | 0 | 0 | 0 | 107.8 | L217 | P215-L217 VanDerWaalsContact C-N 3.27Å; P215-L217 PolarHBondContact O-N 2.93Å |
| 216 | E | 72.6 | Confident | 68 | Low | 187 Ų | 187 | 147.2 Ų | 147.2 | 87% | 0.874 | 78% | 0.781 | S | S | * | * | trans | -57.7 | 99.4 | 171.5 | -68.4 | 177.8 | -174.5 | 0 | 0 | 106.3 | L214 L218 | L214-E216 PolarHBondContact O-N 3.07Å; L214-E216 VanDerWaalsContact O-N 3.08Å; E216-L218 PolarHBondContact O-N 3.33Å | ||
| 217 | L | 63.6 | Low | 66.4 | Low | 147 Ų | 147 | 146.7 Ų | 146.7 | 77% | 0.77 | 78% | 0.781 | S | S | * | * | trans | -62.1 | 108.1 | 175 | -69.5 | 174.5 | 0 | 0 | 0 | 105.4 | P215 S219 | P215-L217 VanDerWaalsContact C-N 3.27Å; P215-L217 PolarHBondContact O-N 2.93Å; L217-S219 VanDerWaalsContact C-N 3.33Å; L217-S219 PolarHBondContact O-N 2.94Å | ||
| 218 | L | 60.8 | Low | 64.9 | Low | 183 Ų | 183 | 144.6 Ų | 144.6 | 96% | 0.958 | 78% | 0.78 | S | S | * | * | trans | -37 | 96.1 | 167.4 | -63.8 | 168 | 0 | 0 | 0 | 110.1 | E216 | E216-L218 PolarHBondContact O-N 3.33Š| ||
| 219 | S | 55.4 | Low | 63.1 | Low | 109 Ų | 109 | 145.8 Ų | 145.8 | 76% | 0.762 | 78% | 0.779 | S | S | * | * | trans | -136.8 | 100.9 | 159.7 | 57 | 0 | 0 | 0 | 0 | 103.7 | L217 | L217-S219 VanDerWaalsContact C-N 3.33Å; L217-S219 PolarHBondContact O-N 2.94Å | ||
| 220 | D | 47.4 | Very low | 61.1 | Low | 146 Ų | 146 | 147.5 Ų | 147.5 | 78% | 0.781 | 79% | 0.785 | S | S | * | * | -131.9 | 117.7 | 80.3 | -160.2 | 15.1 | 0 | 0 | 0 | 110.8 | P222 | D220-P222 VanDerWaalsContact O-CD 3.26Å; D220-P222 WeakPolarHBondContact O-CD 3.28Å; D220-P222 VanDerWaalsContact O-N 3.13Å | |||
| 221 | K | 58.7 | Low | 58.5 | Low | 183 Ų | 183 | 151.9 Ų | 151.9 | 80% | 0.796 | 79% | 0.793 | S | S | * | * | trans | -48.5 | 118.7 | 152.5 | -93.4 | 171.1 | 164.9 | 170.3 | 0 | 106 | K223 | K221-K223 PolarHBondContact O-N 3.19Š| ||
| 222 | P | 54.6 | Low | 56.4 | Low | 120 Ų | 120 | 147.8 Ų | 147.8 | 78% | 0.779 | 79% | 0.794 | S | S | * | * | trans | -58.6 | 121.6 | 159.3 | 25.5 | -30.1 | 0 | 0 | 0 | 106 | D220 | D220-P222 VanDerWaalsContact O-CD 3.26Å; D220-P222 WeakPolarHBondContact O-CD 3.28Å; D220-P222 VanDerWaalsContact O-N 3.13Å | ||
| 223 | K | 59.9 | Low | 54.1 | Low | 186 Ų | 186 | 142.8 Ų | 142.8 | 81% | 0.809 | 79% | 0.79 | S | S | * | * | trans | -34.7 | 134.5 | 170 | -82.4 | 162.4 | 173.5 | 159.3 | 0 | 109.3 | K221 S225 | K221-K223 PolarHBondContact O-N 3.19Å; K223-S225 PolarHBondContact O-N 3.39Å | ||
| 224 | P | 49.5 | Very low | 52 | Low | 127 Ų | 127 | 146.3 Ų | 146.3 | 83% | 0.825 | 80% | 0.796 | S | S | * | * | trans | -60.4 | 107.8 | 167 | 25.6 | -30.1 | 0 | 0 | 0 | 106.8 | S226 | P224-S226 PolarHBondContact O-N 3.13Š| ||
| 225 | S | 49.7 | Very low | 50.3 | Low | 109 Ų | 109 | 144.3 Ų | 144.3 | 76% | 0.762 | 80% | 0.795 | S | S | * | * | trans | -61.6 | 114.8 | 172.3 | 63 | 0 | 0 | 0 | 0 | 106.3 | K223 N227 | K223-S225 PolarHBondContact O-N 3.39Å; S225-N227 PolarHBondContact O-N 2.96Å | ||
| 226 | S | 52.2 | Low | 48.9 | Very low | 120 Ų | 120 | 148.5 Ų | 148.5 | 84% | 0.839 | 81% | 0.806 | S | S | * | * | trans | -59.7 | 99.8 | 166.6 | 53.1 | 0 | 0 | 0 | 0 | 108.1 | P224 | P224-S226 PolarHBondContact O-N 3.13Š| ||
| 227 | N | 41.3 | Very low | 47 | Very low | 141 Ų | 141 | 143.9 Ų | 143.9 | 75% | 0.754 | 80% | 0.8 | S | S | * | * | trans | -121.9 | 101.7 | 160.1 | -164.3 | -67.6 | 0 | 0 | 0 | 108.4 | S225 K229 | S225-N227 PolarHBondContact O-N 2.96Å; N227-K229 PolarHBondContact O-N 3.47Å | ||
| 228 | T | 46.7 | Very low | 46.1 | Very low | 128 Ų | 128 | 146 Ų | 146 | 79% | 0.785 | 80% | 0.803 | S | S | * | * | trans | -48.2 | 119.9 | 161.5 | -52.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 229 | K | 44.6 | Very low | 45.3 | Very low | 178 Ų | 178 | 146.3 Ų | 146.3 | 77% | 0.774 | 80% | 0.799 | S | S | * | * | trans | 165.4 | 105.8 | 131.8 | -162.4 | 168.7 | -170.2 | 177.4 | 0 | 111.4 | N227 | N227-K229 PolarHBondContact O-N 3.47Š| ||
| 230 | N | 43.3 | Very low | 44.2 | Very low | 132 Ų | 132 | 145.3 Ų | 145.3 | 71% | 0.706 | 80% | 0.798 | S | S | * | * | trans | 34.4 | 126.4 | 143.4 | -50.7 | -59.4 | 0 | 0 | 0 | 119.9 | ||||
| 231 | Y | 31.1 | Very low | 43.6 | Very low | 232 Ų | 232 | 143.3 Ų | 143.3 | 91% | 0.91 | 80% | 0.801 | S | S | * | * | -175.4 | 143 | 106.6 | -112.4 | -92.3 | 0 | 0 | 0 | 111.6 | |||||
| 232 | T | 37.8 | Very low | 42.8 | Very low | 142 Ų | 142 | 139.6 Ų | 139.6 | 87% | 0.871 | 81% | 0.805 | S | S | * | * | trans | -74.6 | 148.2 | -178.8 | -59.9 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 233 | G | 35.6 | Very low | 42.1 | Very low | 63 Ų | 63 | 137.2 Ų | 137.2 | 65% | 0.649 | 80% | 0.802 | S | S | * | * | trans | 132.8 | 99.8 | 156.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 234 | E | 36.8 | Very low | 41.2 | Very low | 190 Ų | 190 | 135.1 Ų | 135.1 | 89% | 0.888 | 81% | 0.805 | S | S | * | * | 64.8 | 116.1 | 101.1 | -141.6 | -176.6 | 156.7 | 0 | 0 | 112.5 | |||||
| 235 | S | 38.6 | Very low | 41 | Very low | 110 Ų | 110 | 133.1 Ų | 133.1 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | 168.3 | 157.1 | 78.8 | 33.3 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 236 | Q | 46.5 | Very low | 40.5 | Very low | 185 Ų | 185 | 137.4 Ų | 137.4 | 86% | 0.864 | 80% | 0.804 | S | S | * | * | trans | -69 | 151.6 | 177.7 | -59.4 | -172.7 | -9.3 | 0 | 0 | 113.3 | ||||
| 237 | A | 32.6 | Very low | 40.1 | Very low | 90 Ų | 90 | 137.4 Ų | 137.4 | 74% | 0.744 | 80% | 0.801 | S | S | * | * | trans | -165.2 | 129 | 139.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 238 | K | 46 | Very low | 40.1 | Very low | 191 Ų | 191 | 139 Ų | 139 | 83% | 0.83 | 80% | 0.804 | S | S | * | * | trans | -66.7 | 137.9 | 169.8 | -61.5 | 163.8 | 174.8 | 175.4 | 0 | 109.8 | ||||
| 239 | H | 43.6 | Very low | 40 | Very low | 190 Ų | 190 | 143.4 Ų | 143.4 | 88% | 0.88 | 81% | 0.807 | S | S | * | * | trans | -128 | 118.9 | 148.1 | -80.1 | -75.9 | 0 | 0 | 0 | 109.9 | ||||
| 240 | A | 32.4 | Very low | 40.1 | Very low | 89 Ų | 89 | 140 Ų | 140 | 74% | 0.736 | 80% | 0.801 | S | S | * | * | trans | -89.7 | 153 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 241 | A | 34.9 | Very low | 40.2 | Very low | 104 Ų | 104 | 140.2 Ų | 140.2 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | trans | 64.2 | 144.3 | 153.9 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 242 | A | 42 | Very low | 40.9 | Very low | 105 Ų | 105 | 136.3 Ų | 136.3 | 87% | 0.868 | 79% | 0.792 | S | S | * | * | cis | -164.1 | 152.9 | -4.7 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 243 | G | 38.2 | Very low | 40.8 | Very low | 69 Ų | 69 | 138.3 Ų | 138.3 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | trans | -168.7 | 65.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 244 | T | 41.2 | Very low | 41.3 | Very low | 142 Ų | 142 | 142.7 Ų | 142.7 | 87% | 0.871 | 80% | 0.796 | S | S | * | * | trans | 41.4 | 126.3 | 144.1 | 61.8 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 245 | A | 45.7 | Very low | 41.7 | Very low | 86 Ų | 86 | 142.1 Ų | 142.1 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | 82.3 | 77.9 | 127.3 | 0 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 246 | F | 38.7 | Very low | 41.8 | Very low | 198 Ų | 198 | 141.6 Ų | 141.6 | 87% | 0.868 | 79% | 0.787 | S | S | * | * | trans | -152.3 | 130 | 130.7 | -98.8 | -81.8 | 0 | 0 | 0 | 108.3 | Q248 | F246-Q248 PolarHBondContact O-N 3.34Š| ||
| 247 | P | 45.1 | Very low | 41.6 | Very low | 120 Ų | 120 | 143.9 Ų | 143.9 | 78% | 0.779 | 79% | 0.788 | S | S | * | * | trans | -71.5 | 101.5 | 170.2 | 27.4 | -27.8 | 0 | 0 | 0 | 108.1 | R249 | P247-R249 PolarHBondContact O-N 3.43Š| ||
| 248 | Q | 41.5 | Very low | 42.1 | Very low | 175 Ų | 175 | 147.6 Ų | 147.6 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | trans | -59.7 | 106.6 | 160.7 | -77.4 | 178.5 | -0 | 0 | 0 | 106.9 | F246 T250 | F246-Q248 PolarHBondContact O-N 3.34Å; Q248-T250 PolarHBondContact O-N 2.87Å; Q248-T250 PolarHBondContact O-OG1 2.91Å | ||
| 249 | R | 44.1 | Very low | 42 | Very low | 221 Ų | 221 | 143.4 Ų | 143.4 | 83% | 0.834 | 78% | 0.783 | S | S | * | * | trans | -69.4 | 90.3 | 162.3 | -76.8 | -179.3 | 110.7 | 133.7 | 0.1 | 106.8 | P247 E251 | P247-R249 PolarHBondContact O-N 3.43Å; R249-E251 PolarHBondContact O-N 3.07Å | ||
| 250 | T | 47.4 | Very low | 41.7 | Very low | 106 Ų | 106 | 137.7 Ų | 137.7 | 65% | 0.65 | 78% | 0.775 | S | S | * | * | trans | -73.2 | 78.2 | 165.6 | -33.8 | 0 | 0 | 0 | 0 | 107.6 | Q248 L252 | Q248-T250 PolarHBondContact O-N 2.87Å; Q248-T250 PolarHBondContact O-OG1 2.91Å; T250-L252 VanDerWaalsContact C-N 3.34Å; T250-L252 HydrophobicContact CG2-CG 4.37Å; T250-L252 PolarHBondContact O-N 3.11Å | ||
| 251 | E | 43.5 | Very low | 42.3 | Very low | 137 Ų | 137 | 142 Ų | 142 | 64% | 0.64 | 78% | 0.782 | S | S | * | * | trans | -79.9 | 93.3 | 161.8 | -71.3 | -81.2 | 153.7 | 0 | 0 | 106.2 | R249 F253 | R249-E251 PolarHBondContact O-N 3.07Å; E251-F253 HydrophobicContact CB-CD2 4.43Å; E251-F253 PolarHBondContact O-N 3.31Å | ||
| 252 | L | 47 | Very low | 42.4 | Very low | 149 Ų | 149 | 142.3 Ų | 142.3 | 78% | 0.78 | 78% | 0.778 | S | S | * | * | trans | -62 | 91.6 | 161.3 | -70.2 | 166.2 | 0 | 0 | 0 | 107.3 | T250 L254 | T250-L252 VanDerWaalsContact C-N 3.34Å; T250-L252 HydrophobicContact CG2-CG 4.37Å; T250-L252 PolarHBondContact O-N 3.11Å; L252-L254 VanDerWaalsContact C-N 3.28Å; L252-L254 PolarHBondContact O-N 2.88Å | ||
| 253 | F | 34.4 | Very low | 42.5 | Very low | 185 Ų | 185 | 143.9 Ų | 143.9 | 81% | 0.811 | 77% | 0.771 | S | S | * | * | trans | -71.6 | 94.4 | 164 | -105.3 | -91.9 | 0 | 0 | 0 | 107.8 | E251 E255 | E251-F253 HydrophobicContact CB-CD2 4.43Å; E251-F253 PolarHBondContact O-N 3.31Å; F253-E255 PolarHBondContact O-N 2.96Å; F253-E255 VanDerWaalsContact O-N 3.16Å | ||
| 254 | L | 47.9 | Very low | 42.9 | Very low | 154 Ų | 154 | 150.8 Ų | 150.8 | 81% | 0.806 | 78% | 0.777 | S | S | * | * | trans | -61.7 | 107.8 | 158 | -75.6 | 163.8 | 0 | 0 | 0 | 107.2 | L252 | L252-L254 VanDerWaalsContact C-N 3.28Å; L252-L254 PolarHBondContact O-N 2.88Å | ||
| 255 | E | 44.3 | Very low | 43 | Very low | 178 Ų | 178 | 151.7 Ų | 151.7 | 83% | 0.832 | 78% | 0.777 | S | S | * | * | trans | -61.5 | 128.2 | 170 | -174.7 | 157.3 | 168 | 0 | 0 | 109.9 | F253 R257 | F253-E255 PolarHBondContact O-N 2.96Å; F253-E255 VanDerWaalsContact O-N 3.16Å; E255-R257 PolarHBondContact O-N 2.85Å; E255-R257 VanDerWaalsContact O-N 3.11Å | ||
| 256 | P | 41.9 | Very low | 42.9 | Very low | 99 Ų | 99 | 152.1 Ų | 152.1 | 64% | 0.643 | 77% | 0.774 | S | S | * | * | trans | -65.2 | 113.9 | 173 | -20 | 32.2 | 0 | 0 | 0 | 110.1 | Q258 | P256-Q258 PolarHBondContact O-N 3.24Š| ||
| 257 | R | 40.9 | Very low | 43.3 | Very low | 234 Ų | 234 | 149.4 Ų | 149.4 | 88% | 0.883 | 77% | 0.768 | S | S | * | * | trans | -49.1 | 100.9 | 164.1 | 177.4 | 180 | 178 | 147.5 | -0.7 | 109.8 | E255 | E255-R257 PolarHBondContact O-N 2.85Å; E255-R257 VanDerWaalsContact O-N 3.11Å | ||
| 258 | Q | 44.3 | Very low | 43.2 | Very low | 167 Ų | 167 | 151.8 Ų | 151.8 | 78% | 0.78 | 77% | 0.769 | S | S | * | * | trans | -86.4 | 122.6 | 163.1 | -72.8 | -63.6 | -27.4 | 0 | 0 | 109.2 | P256 | P256-Q258 PolarHBondContact O-N 3.24Š| ||
| 259 | P | 43.4 | Very low | 43.3 | Very low | 104 Ų | 104 | 150 Ų | 150 | 68% | 0.675 | 77% | 0.77 | S | S | * | * | trans | -81.1 | 135.7 | -178.8 | 30.1 | -29.9 | 0 | 0 | 0 | 112 | ||||
| 260 | G | 36 | Very low | 43.4 | Very low | 69 Ų | 69 | 143.5 Ų | 143.5 | 71% | 0.711 | 76% | 0.763 | S | S | * | * | trans | 75.5 | 94.4 | 135.1 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 261 | M | 45.1 | Very low | 43.1 | Very low | 180 Ų | 180 | 144.9 Ų | 144.9 | 89% | 0.887 | 77% | 0.772 | S | S | * | * | 41.7 | 122.9 | 126.8 | -56.4 | 170.9 | 72.8 | 0 | 0 | 120.3 | |||||
| 262 | S | 37.9 | Very low | 42.9 | Very low | 111 Ų | 111 | 144.1 Ų | 144.1 | 78% | 0.776 | 78% | 0.782 | S | S | * | * | -166.8 | 96.6 | 128.5 | -168.4 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 263 | L | 45 | Very low | 43.1 | Very low | 137 Ų | 137 | 143.6 Ų | 143.6 | 72% | 0.717 | 79% | 0.785 | S | S | * | * | 70 | 115.2 | 103.8 | -95.1 | 99.5 | 0 | 0 | 0 | 115.2 | |||||
| 264 | Y | 44.8 | Very low | 44.2 | Very low | 215 Ų | 215 | 143.5 Ų | 143.5 | 84% | 0.843 | 79% | 0.787 | S | S | * | * | trans | 0.1 | 119.6 | 149.4 | -83.4 | -98.7 | 0 | 0 | 0 | 117.5 | ||||
| 265 | N | 43.3 | Very low | 44.9 | Very low | 161 Ų | 161 | 145.1 Ų | 145.1 | 86% | 0.861 | 79% | 0.79 | S | S | * | * | trans | -149 | 98.4 | 144.3 | -86.4 | -52 | 0 | 0 | 0 | 103.8 | ||||
| 266 | S | 43.6 | Very low | 45.7 | Very low | 94 Ų | 94 | 143.6 Ų | 143.6 | 66% | 0.657 | 78% | 0.783 | S | S | * | * | 57.3 | 90.5 | 59.2 | -155 | 0 | 0 | 0 | 0 | 114 | |||||
| 267 | L | 48.5 | Very low | 46.6 | Very low | 142 Ų | 142 | 148 Ų | 148 | 74% | 0.743 | 80% | 0.797 | S | S | * | * | 162.5 | 112.3 | 128.7 | -111.3 | 68.6 | 0 | 0 | 0 | 108.1 | |||||
| 268 | E | 43.4 | Very low | 47.9 | Very low | 169 Ų | 169 | 144.8 Ų | 144.8 | 79% | 0.79 | 79% | 0.792 | S | S | * | * | 88.7 | 109.1 | 80.2 | -161.8 | 161.7 | -135.2 | 0 | 0 | 112.7 | |||||
| 269 | T | 41.9 | Very low | 48.3 | Very low | 138 Ų | 138 | 148.6 Ų | 148.6 | 85% | 0.847 | 82% | 0.817 | S | S | * | * | trans | -173.2 | 91.9 | 154.9 | 13.8 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 270 | A | 46.5 | Very low | 48.6 | Very low | 84 Ų | 84 | 150.8 Ų | 150.8 | 69% | 0.694 | 82% | 0.824 | S | S | * | * | 81.2 | 99.2 | 92.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 271 | T | 41.8 | Very low | 49.2 | Very low | 135 Ų | 135 | 155.1 Ų | 155.1 | 83% | 0.828 | 83% | 0.83 | S | S | * | * | trans | 53.5 | 85.7 | 150.3 | 65.3 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 272 | S | 38.5 | Very low | 49.5 | Very low | 122 Ų | 122 | 153.7 Ų | 153.7 | 85% | 0.853 | 83% | 0.827 | S | S | * | * | trans | -94.5 | 105.8 | 145.1 | -177.5 | 0 | 0 | 0 | 0 | 106.9 | E274 | S272-E274 PolarHBondContact O-N 2.98Å; S272-E274 VanDerWaalsContact O-N 3.09Å | ||
| 273 | T | 52.5 | Low | 50.1 | Low | 137 Ų | 137 | 156.2 Ų | 156.2 | 84% | 0.84 | 83% | 0.83 | S | S | * | * | trans | -70 | 101.4 | 174.1 | -17.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 274 | E | 56.3 | Low | 50.5 | Low | 184 Ų | 184 | 157.4 Ų | 157.4 | 86% | 0.86 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 116.2 | 164.1 | 177 | 179.7 | -177.2 | 0 | 0 | 108.2 | S272 | S272-E274 PolarHBondContact O-N 2.98Å; S272-E274 VanDerWaalsContact O-N 3.09Å |
| 275 | E | 63.1 | Low | 50.9 | Low | 187 Ų | 187 | 153.6 Ų | 153.6 | 87% | 0.874 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -96.6 | 123.9 | 165.2 | -174.7 | 177.7 | 166.3 | 0 | 0 | 107.6 | ||
| 276 | E | 60.5 | Low | 51.4 | Low | 147 Ų | 147 | 153.1 Ų | 153.1 | 69% | 0.687 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -65 | 131.2 | -179.6 | 76.7 | -159.6 | 172.7 | 0 | 0 | 110.8 | E278 | E276-E278 HydrophobicContact CG-CG 4.45Š|
| 277 | M | 60.9 | Low | 52 | Low | 190 Ų | 190 | 157.6 Ų | 157.6 | 94% | 0.936 | 85% | 0.848 | S | S | * | * | trans | -94.3 | 92 | 158.1 | -73.8 | -164.1 | -77.1 | 0 | 0 | 106.8 | ||||
| 278 | E | 67.9 | Low | 52.3 | Low | 167 Ų | 167 | 158.9 Ų | 158.9 | 78% | 0.78 | 86% | 0.857 | S | S | * | * | trans | -67.8 | 139.2 | 163.4 | -90 | -170.1 | 155.4 | 0 | 0 | 109.9 | E276 | E276-E278 HydrophobicContact CG-CG 4.45Š| ||
| 279 | L | 54 | Low | 53.1 | Low | 247 Ų | 247 | 158 Ų | 158 | 100% | 1.293 | 86% | 0.863 | S | S | * | * | trans | -70.3 | 0 | -173.6 | -70.9 | 162.5 | 0 | 0 | 0 | 113.8 |
Retrieved 279 of 279 residues in 50.9 ms
(Link to these results)