| 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 | 39.7 | Very low | 38.3 | Very low | 233 Ų | 233 | 149.9 Ų | 149.9 | 100% | 1.148 | 83% | 0.833 | S | S | * | * | 0 | 78.1 | 0 | -77.3 | 160.2 | 169.5 | 0 | 0 | 105.7 | |||||
| 2 | T | 37.5 | Very low | 38.2 | Very low | 135 Ų | 135 | 152.6 Ų | 152.6 | 83% | 0.828 | 83% | 0.834 | S | S | * | * | 43.1 | 129.6 | 56.3 | 11 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 3 | R | 34.8 | Very low | 37.9 | Very low | 225 Ų | 225 | 155.3 Ų | 155.3 | 85% | 0.849 | 84% | 0.837 | S | S | * | * | trans | 123.3 | 127.3 | 164.2 | -68.1 | -152.8 | -173.6 | 173.4 | 3.2 | 111.2 | ||||
| 4 | Y | 33 | Very low | 37.7 | Very low | 206 Ų | 206 | 151.1 Ų | 151.1 | 81% | 0.808 | 83% | 0.826 | S | S | * | * | cis | -167.5 | 136 | -11 | -107 | -83.9 | 0 | 0 | 0 | 105.5 | ||||
| 5 | L | 38.4 | Very low | 37.5 | Very low | 155 Ų | 155 | 154.5 Ų | 154.5 | 81% | 0.812 | 83% | 0.829 | S | S | * | * | trans | -77.7 | 154.9 | 147.7 | -102.9 | 149.5 | 0 | 0 | 0 | 107.4 | ||||
| 6 | P | 44.6 | Very low | 37.3 | Very low | 109 Ų | 109 | 155.4 Ų | 155.4 | 71% | 0.708 | 82% | 0.823 | S | S | * | * | -160.1 | -154.5 | 65.7 | 42.3 | -18.5 | 0 | 0 | 0 | 114 | |||||
| 7 | P | 50.1 | Low | 36.9 | Very low | 112 Ų | 112 | 158 Ų | 158 | 73% | 0.727 | 83% | 0.833 | S | S | * | * | cis | -126.8 | 167.8 | -33.9 | 20.1 | 3 | 0 | 0 | 0 | 115.5 | ||||
| 8 | L | 35.7 | Very low | 36.8 | Very low | 169 Ų | 169 | 158.3 Ų | 158.3 | 89% | 0.885 | 83% | 0.829 | S | S | * | * | trans | 7.5 | 125.6 | 144.4 | -119.1 | 76.5 | 0 | 0 | 0 | 120.3 | ||||
| 9 | G | 32.3 | Very low | 36.7 | Very low | 78 Ų | 78 | 161.9 Ų | 161.9 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | trans | -150.1 | 103.2 | 159.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 10 | V | 38.2 | Very low | 37.1 | Very low | 130 Ų | 130 | 161.5 Ų | 161.5 | 79% | 0.788 | 84% | 0.836 | S | S | * | * | trans | -74 | 122.5 | 175.4 | 175.3 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 11 | A | 36.8 | Very low | 37.3 | Very low | 97 Ų | 97 | 155.2 Ų | 155.2 | 80% | 0.802 | 81% | 0.81 | S | S | * | * | trans | -136.3 | 98 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | Q13 | A11-Q13 PolarHBondContact O-N 3.49Š| ||
| 12 | Q | 37.3 | Very low | 37.5 | Very low | 182 Ų | 182 | 146 Ų | 146 | 85% | 0.85 | 78% | 0.776 | S | S | * | * | trans | -79.1 | 107.3 | 172.1 | -179.1 | 166.6 | -30.5 | 0 | 0 | 108.8 | ||||
| 13 | Q | 34.1 | Very low | 37.9 | Very low | 188 Ų | 188 | 144.8 Ų | 144.8 | 88% | 0.879 | 77% | 0.773 | S | S | * | * | trans | -102.5 | 96.6 | 168.1 | -100.3 | -172.8 | -6.8 | 0 | 0 | 110.3 | A11 K15 | A11-Q13 PolarHBondContact O-N 3.49Å; Q13-K15 PolarHBondContact O-N 2.79Å | ||
| 14 | S | 35.8 | Very low | 38.7 | Very low | 96 Ų | 96 | 139.3 Ų | 139.3 | 67% | 0.671 | 76% | 0.764 | S | S | * | * | trans | -69.2 | 105.2 | 162 | -179.6 | 0 | 0 | 0 | 0 | 108.5 | K16 | S14-K16 PolarHBondContact O-N 3.33Š| ||
| 15 | K | 34.1 | Very low | 39.4 | Very low | 202 Ų | 202 | 137.4 Ų | 137.4 | 88% | 0.878 | 76% | 0.76 | S | S | * | * | trans | -84.8 | 92.6 | 171.8 | -134.1 | 171.5 | -173.5 | 176.9 | 0 | 108.2 | Q13 M17 | Q13-K15 PolarHBondContact O-N 2.79Å; K15-M17 PolarHBondContact O-N 2.89Å | ||
| 16 | K | 33.7 | Very low | 40 | Very low | 169 Ų | 169 | 134.9 Ų | 134.9 | 74% | 0.735 | 75% | 0.751 | S | S | * | * | trans | -66 | 118.8 | 169 | -77.4 | 179 | 176.5 | 177.5 | 0 | 109 | S14 H18 | S14-K16 PolarHBondContact O-N 3.33Å; K16-H18 PolarHBondContact O-N 2.89Å | ||
| 17 | M | 31.1 | Very low | 40 | Very low | 200 Ų | 200 | 132.7 Ų | 132.7 | 99% | 0.985 | 74% | 0.742 | S | S | * | * | trans | -77.7 | 101.6 | 173.2 | -148.2 | 139.3 | 97 | 0 | 0 | 108 | K15 W19 | K15-M17 PolarHBondContact O-N 2.89Å; M17-W19 PolarHBondContact O-N 3.47Å | ||
| 18 | H | 34.5 | Very low | 39.9 | Very low | 164 Ų | 164 | 132.9 Ų | 132.9 | 76% | 0.759 | 74% | 0.736 | S | S | * | * | trans | -84.1 | 108.9 | 175.5 | -104.1 | -114.8 | 0 | 0 | 0 | 110.1 | K16 T20 | K16-H18 PolarHBondContact O-N 2.89Å; H18-T20 PolarHBondContact O-N 3.12Å | ||
| 19 | W | 35.3 | Very low | 40.4 | Very low | 226 Ų | 226 | 128 Ų | 128 | 86% | 0.856 | 72% | 0.72 | S | S | * | * | trans | 29.5 | 83.1 | 139 | -123.5 | 48.2 | 0 | 0 | 0 | 118.7 | M17 G21 | M17-W19 PolarHBondContact O-N 3.47Å; W19-G21 PolarHBondContact O-N 3.23Å | ||
| 20 | T | 44.3 | Very low | 40.9 | Very low | 154 Ų | 154 | 128.8 Ų | 128.8 | 95% | 0.945 | 71% | 0.712 | S | S | * | * | trans | -88.8 | 60.5 | 154.8 | 51.9 | 0 | 0 | 0 | 0 | 109.5 | H18 | H18-T20 PolarHBondContact O-N 3.12Š| ||
| 21 | G | 41.5 | Very low | 41.3 | Very low | 29 Ų | 29 | 129.7 Ų | 129.7 | 30% | 0.299 | 71% | 0.712 | S | S | . | * | trans | -121 | -6.4 | 178 | 0 | 0 | 0 | 0 | 0 | 114.1 | W19 | W19-G21 PolarHBondContact O-N 3.23Š| ||
| 22 | G | 43.8 | Very low | 41.8 | Very low | 41 Ų | 41 | 132.3 Ų | 132.3 | 42% | 0.423 | 71% | 0.711 | S | S | . | * | H | α-helix | trans | -83.6 | -22.4 | -173 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 23 | S | 47.4 | Very low | 42.2 | Very low | 109 Ų | 109 | 127.5 Ų | 127.5 | 76% | 0.762 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -80 | -23.8 | -174.7 | -115.1 | 0 | 0 | 0 | 0 | 114.1 | ||
| 24 | V | 49.9 | Very low | 42.3 | Very low | 110 Ų | 110 | 124.3 Ų | 124.3 | 67% | 0.667 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -83.2 | -28.7 | -176.8 | -178.8 | 0 | 0 | 0 | 0 | 111.6 | ||
| 25 | F | 49.2 | Very low | 42.4 | Very low | 166 Ų | 166 | 131.3 Ų | 131.3 | 73% | 0.728 | 71% | 0.711 | S | S | * | * | H | α-helix | trans | -78.1 | -28.1 | 179 | -95.1 | -87.1 | 0 | 0 | 0 | 113.9 | A29 | F25-A29 PolarHBondContact O-N 2.86Å |
| 26 | V | 49.7 | Very low | 42.4 | Very low | 101 Ų | 101 | 127.6 Ų | 127.6 | 61% | 0.612 | 71% | 0.711 | S | S | * | * | H | α-helix | trans | -76 | -33.5 | 177.6 | 178.1 | 0 | 0 | 0 | 0 | 111.6 | A29 | V26-A29 PolarHBondContact O-N 3.29Å |
| 27 | A | 46 | Very low | 42.4 | Very low | 63 Ų | 63 | 124.5 Ų | 124.5 | 52% | 0.521 | 72% | 0.717 | S | S | . | * | H | α-helix | trans | -70.1 | -32.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 28 | L | 47.9 | Very low | 42.6 | Very low | 117 Ų | 117 | 119 Ų | 119 | 61% | 0.613 | 71% | 0.711 | S | S | * | * | H | α-helix | trans | -75.7 | -26.5 | 178.9 | -139.8 | 86.6 | 0 | 0 | 0 | 112.8 | ||
| 29 | A | 45.3 | Very low | 42.5 | Very low | 67 Ų | 67 | 116 Ų | 116 | 55% | 0.554 | 72% | 0.715 | S | S | * | * | H | α-helix | trans | -78.8 | -23.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | F25 V26 L31 | F25-A29 PolarHBondContact O-N 2.86Å; V26-A29 PolarHBondContact O-N 3.29Å; A29-L31 VanDerWaalsContact C-N 3.35Å |
| 30 | C | 43.6 | Very low | 42.3 | Very low | 93 Ų | 93 | 111.1 Ų | 111.1 | 63% | 0.628 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.3 | -17.1 | 176.9 | -76.1 | 0 | 0 | 0 | 0 | 114 | ||
| 31 | L | 45 | Very low | 41.7 | Very low | 150 Ų | 150 | 109.4 Ų | 109.4 | 79% | 0.785 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.8 | -4.6 | -179.7 | -72.3 | 170.5 | 0 | 0 | 0 | 114.2 | A29 | A29-L31 VanDerWaalsContact C-N 3.35Š|
| 32 | I | 48 | Very low | 41.3 | Very low | 151 Ų | 151 | 112.4 Ų | 112.4 | 77% | 0.774 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -108.9 | -3.2 | -178.2 | -58.7 | 177 | 0 | 0 | 0 | 112.5 | ||
| 33 | A | 45.8 | Very low | 40.7 | Very low | 82 Ų | 82 | 118.1 Ų | 118.1 | 68% | 0.678 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -111.9 | 22.4 | -174.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 34 | C | 37.3 | Very low | 40.4 | Very low | 121 Ų | 121 | 119.5 Ų | 119.5 | 82% | 0.818 | 76% | 0.756 | S | S | * | * | trans | -127.3 | 79.9 | 175 | -80.3 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 35 | R | 36.4 | Very low | 39.7 | Very low | 242 Ų | 242 | 121.5 Ų | 121.5 | 91% | 0.913 | 76% | 0.763 | S | S | * | * | trans | -134.8 | 142 | 149.9 | -95.9 | -172.9 | 155.9 | -167.7 | -6.5 | 109.7 | ||||
| 36 | S | 34.6 | Very low | 39.2 | Very low | 125 Ų | 125 | 117 Ų | 117 | 87% | 0.874 | 76% | 0.764 | S | S | * | * | trans | 73.4 | 96.7 | 172.5 | 69 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 37 | A | 34.3 | Very low | 38.5 | Very low | 104 Ų | 104 | 118.8 Ų | 118.8 | 86% | 0.86 | 77% | 0.77 | S | S | * | * | trans | -136.2 | 119.3 | 133 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 38 | G | 34.7 | Very low | 38.1 | Very low | 83 Ų | 83 | 127 Ų | 127 | 86% | 0.856 | 79% | 0.787 | S | S | * | * | trans | -70.8 | 153.4 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 39 | A | 32.3 | Very low | 37.7 | Very low | 103 Ų | 103 | 126.9 Ų | 126.9 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | trans | -136.5 | 120.3 | 159.8 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 40 | S | 30.5 | Very low | 37.6 | Very low | 122 Ų | 122 | 132.5 Ų | 132.5 | 85% | 0.853 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 129.8 | 174.5 | 47.5 | 0 | 0 | 0 | 0 | 112.5 | ||
| 41 | S | 32 | Very low | 37.9 | Very low | 119 Ų | 119 | 135.6 Ų | 135.6 | 83% | 0.832 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -90.9 | 116.8 | 159.4 | 56.2 | 0 | 0 | 0 | 0 | 108.7 | ||
| 42 | A | 33.8 | Very low | 37.9 | Very low | 91 Ų | 91 | 131.4 Ų | 131.4 | 75% | 0.752 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 134 | 173 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 43 | D | 31.4 | Very low | 37.9 | Very low | 162 Ų | 162 | 132 Ų | 132 | 87% | 0.866 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 134.1 | 163.8 | -77.1 | -45.3 | 0 | 0 | 0 | 110.1 | ||
| 44 | T | 40.3 | Very low | 38 | Very low | 137 Ų | 137 | 134.4 Ų | 134.4 | 84% | 0.84 | 82% | 0.82 | S | S | * | * | trans | -138.2 | 99.9 | 153.2 | -55 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 45 | D | 35.6 | Very low | 38.5 | Very low | 153 Ų | 153 | 134.7 Ų | 134.7 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | trans | -58.7 | 132.5 | 168.7 | -161.7 | -0.4 | 0 | 0 | 0 | 109.8 | ||||
| 46 | G | 38 | Very low | 39.3 | Very low | 72 Ų | 72 | 130.7 Ų | 130.7 | 74% | 0.742 | 82% | 0.815 | S | S | * | * | trans | -150.3 | 57.4 | -170 | 0 | 0 | 0 | 0 | 0 | 110.7 | R48 | G46-R48 PolarHBondContact O-N 3.49Š| ||
| 47 | N | 36.6 | Very low | 40.6 | Very low | 138 Ų | 138 | 127.1 Ų | 127.1 | 74% | 0.738 | 80% | 0.799 | S | S | * | * | trans | -62 | 115.2 | 171.4 | -170.9 | 6.1 | 0 | 0 | 0 | 110.4 | ||||
| 48 | R | 36.1 | Very low | 42.6 | Very low | 234 Ų | 234 | 125.7 Ų | 125.7 | 88% | 0.883 | 79% | 0.794 | S | S | * | * | trans | -132 | 99.5 | 161.8 | -160.3 | 172.2 | -177.4 | 151 | -1.2 | 109.2 | G46 E50 | G46-R48 PolarHBondContact O-N 3.49Å; R48-E50 PolarHBondContact O-N 2.96Å | ||
| 49 | T | 39.3 | Very low | 45 | Very low | 116 Ų | 116 | 122.9 Ų | 122.9 | 71% | 0.712 | 77% | 0.765 | S | S | * | * | trans | -58 | 116.6 | 163.4 | 18.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 50 | E | 43.3 | Very low | 47.7 | Very low | 184 Ų | 184 | 123 Ų | 123 | 86% | 0.86 | 75% | 0.747 | S | S | * | * | trans | -122.4 | 110.9 | 158.8 | -155 | 164.1 | -152 | 0 | 0 | 108.1 | R48 G52 | R48-E50 PolarHBondContact O-N 2.96Å; E50-G52 PolarHBondContact O-N 2.85Å | ||
| 51 | N | 49.7 | Very low | 50.6 | Low | 158 Ų | 158 | 121.1 Ų | 121.1 | 85% | 0.845 | 73% | 0.729 | S | S | * | * | trans | -67.6 | 114.3 | 177.4 | -69.5 | -24.3 | 0 | 0 | 0 | 108.9 | ||||
| 52 | G | 45.4 | Very low | 53.5 | Low | 62 Ų | 62 | 115.7 Ų | 115.7 | 64% | 0.639 | 69% | 0.692 | S | S | * | * | trans | -128.4 | 119.6 | 168.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | E50 V54 | E50-G52 PolarHBondContact O-N 2.85Å; G52-V54 PolarHBondContact O-N 3.03Å; G52-V54 VanDerWaalsContact O-N 3.16Å | ||
| 53 | N | 49.3 | Very low | 56.2 | Low | 164 Ų | 164 | 114.2 Ų | 114.2 | 88% | 0.877 | 67% | 0.673 | S | S | * | * | trans | -46.6 | 113.7 | -177.6 | -68.9 | -28.3 | 0 | 0 | 0 | 112.9 | T55 | N53-T55 PolarHBondContact O-N 2.82Å; N53-T55 VanDerWaalsContact O-N 3.12Å | ||
| 54 | V | 46.9 | Very low | 59.1 | Low | 132 Ų | 132 | 107.7 Ų | 107.7 | 80% | 0.8 | 64% | 0.639 | S | S | * | * | trans | -75.9 | 96.1 | 167.3 | 176.8 | 0 | 0 | 0 | 0 | 107.7 | G52 D56 | G52-V54 PolarHBondContact O-N 3.03Å; G52-V54 VanDerWaalsContact O-N 3.16Å; V54-D56 PolarHBondContact O-N 3.02Å | ||
| 55 | T | 47.5 | Very low | 61.4 | Low | 128 Ų | 128 | 106.3 Ų | 106.3 | 79% | 0.785 | 62% | 0.621 | S | S | * | * | trans | -71.2 | 112.6 | 148 | 46.9 | 0 | 0 | 0 | 0 | 106.5 | N53 G57 | N53-T55 PolarHBondContact O-N 2.82Å; N53-T55 VanDerWaalsContact O-N 3.12Å; T55-G57 PolarHBondContact O-N 3.38Å | ||
| 56 | D | 54.5 | Low | 63.8 | Low | 157 Ų | 157 | 101.3 Ų | 101.3 | 84% | 0.84 | 60% | 0.597 | S | S | * | * | trans | -62.5 | 79.8 | 173.5 | -172 | 29.3 | 0 | 0 | 0 | 109.8 | V54 | V54-D56 PolarHBondContact O-N 3.02Š| ||
| 57 | G | 61.7 | Low | 65.9 | Low | 51 Ų | 51 | 105.5 Ų | 105.5 | 53% | 0.526 | 59% | 0.594 | S | S | . | * | trans | -96.4 | 117.1 | 164.2 | 0 | 0 | 0 | 0 | 0 | 107 | T55 G59 | T55-G57 PolarHBondContact O-N 3.38Å; G57-G59 PolarHBondContact O-N 3.29Å | ||
| 58 | G | 76.1 | Confident | 68.3 | Low | 73 Ų | 73 | 100.6 Ų | 100.6 | 75% | 0.753 | 57% | 0.569 | S | S | * | * | trans | -68.4 | 63 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 59 | G | 84.1 | Confident | 70.7 | Confident | 24 Ų | 24 | 93.8 Ų | 93.8 | 25% | 0.247 | 56% | 0.558 | C | S | . | * | trans | -75.1 | 161.8 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | G57 D88 | G57-G59 PolarHBondContact O-N 3.29Å; G59-D88 CarbonylContact C-O 3.59Å; G59-D88 WeakPolarHBondContact CA-O 3.29Å | ||
| 60 | F | 88.9 | Confident | 73.2 | Confident | 107 Ų | 107 | 91.9 Ų | 91.9 | 47% | 0.469 | 54% | 0.541 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.6 | 151.2 | 180 | 58.3 | -88.8 | 0 | 0 | 0 | 111.8 | G87 D88 | F60-G87 VanDerWaalsContact CE2-CA 3.44Å; F60-D88 HydrophobicContact CD1-CB 3.67Å; F60-D88 HydrophobicContact CE1-CB 3.39Å; F60-D88 HydrophobicContact CG-CB 4.44Å; F60-D88 HydrophobicContact CZ-CB 3.98Å; F60-D88 PolarHBondContact N-O 3.33Å; F60-D88 PolarHBondContact O-N 3.24Å |
| 61 | V | 91.6 | Very high | 75.4 | Confident | 81 Ų | 81 | 83.6 Ų | 83.6 | 49% | 0.491 | 50% | 0.502 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -58.9 | 147 | 179.5 | -60.9 | 0 | 0 | 0 | 0 | 111.1 | H141 | V61-H141 HydrophobicContact CG1-CB 3.98Å; V61-H141 WeakPolarHBondContact CG1-O 3.45Å |
| 62 | P | 92.4 | Very high | 77.4 | Confident | 6 Ų | 6 | 78 Ų | 78 | 4% | 0.039 | 47% | 0.472 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.6 | 148.2 | 179.8 | 27 | -31.8 | 0 | 0 | 0 | 111.2 | T86 P91 A137 N139 G142 A144 | P62-T86 CarbonylContact C-O 3.56Å; P62-T86 WeakPolarHBondContact CA-O 3.24Å; P62-P91 HydrophobicContact CB-CB 3.84Å; P62-P91 HydrophobicContact CB-CG 3.94Å; P62-A137 HydrophobicContact CB-CB 4.03Å; P62-A137 WeakPolarHBondContact CG-O 3.45Å; P62-N139 HydrophobicContact CG-CB 4.27Å; P62-G142 WeakPolarHBondContact CD-O 3.47Å; P62-G142 VanDerWaalsContact CG-O 3.24Å; P62-G142 WeakPolarHBondContact CG-O 3.33Å; P62-A144 HydrophobicContact CB-CB 4.45Å; P62-A144 HydrophobicContact CG-CB 4.33Å; P62-A144 WeakPolarHBondContact O-CB 3.48Å |
| 63 | V | 90.9 | Very high | 79.5 | Confident | 60 Ų | 60 | 75.4 Ų | 75.4 | 36% | 0.364 | 44% | 0.444 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.1 | 136.7 | 174.1 | -174.4 | 0 | 0 | 0 | 0 | 108.2 | F65 V85 T86 | V63-F65 HydrophobicContact CB-CE2 4.07Å; V63-F65 HydrophobicContact CB-CZ 4.24Å; V63-F65 HydrophobicContact CG1-CD2 4.39Å; V63-F65 HydrophobicContact CG1-CE1 4.02Å; V63-F65 HydrophobicContact CG1-CE2 3.68Å; V63-F65 HydrophobicContact CG1-CZ 3.47Å; V63-F65 VanDerWaalsContact CG1-CZ 3.47Å; V63-V85 WeakPolarHBondContact O-CA 3.29Å; V63-T86 PolarHBondContact N-O 2.93Å; V63-T86 PolarHBondContact O-N 2.89Å |
| 64 | V | 91.9 | Very high | 81.4 | Confident | 24 Ų | 24 | 73.7 Ų | 73.7 | 15% | 0.145 | 43% | 0.426 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 128.6 | -177.6 | 174.3 | 0 | 0 | 0 | 0 | 109.8 | C83 V85 C135 A137 A144 | V64-C83 WeakPolarHBondContact CG1-SG 3.49Å; V64-V85 HydrophobicContact CG2-CG1 4.38Å; V64-V85 HydrophobicContact CG2-CG2 4.2Å; V64-C135 WeakPolarHBondContact CG1-SG 3.37Å; V64-A137 HydrophobicContact CG2-CB 3.7Å; V64-A144 HydrophobicContact CG2-CB 3.89Å |
| 65 | F | 88.6 | Confident | 83.3 | Confident | 108 Ų | 108 | 70.2 Ų | 70.2 | 47% | 0.474 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.1 | 116.2 | 175.2 | -56.2 | -82.3 | 0 | 0 | 0 | 109.8 | V63 N84 T86 | V63-F65 HydrophobicContact CB-CE2 4.07Å; V63-F65 HydrophobicContact CB-CZ 4.24Å; V63-F65 HydrophobicContact CG1-CD2 4.39Å; V63-F65 HydrophobicContact CG1-CE1 4.02Å; V63-F65 HydrophobicContact CG1-CE2 3.68Å; V63-F65 HydrophobicContact CG1-CZ 3.47Å; V63-F65 VanDerWaalsContact CG1-CZ 3.47Å; F65-N84 HydrophobicContact CB-CB 4.27Å; F65-N84 PolarHBondContact N-O 2.87Å; F65-N84 PolarHBondContact O-N 3.41Å; F65-T86 HydrophobicContact CE2-CG2 4.2Å |
| 66 | T | 86.4 | Confident | 85.1 | Confident | 49 Ų | 49 | 66.8 Ų | 66.8 | 30% | 0.301 | 39% | 0.391 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.1 | 126 | 170.1 | 53.1 | 0 | 0 | 0 | 0 | 108.8 | V68 V148 | T66-V68 PolarHBondContact O-N 2.87Å; T66-V148 HydrophobicContact CG2-CG2 3.6Å |
| 67 | K | 82.8 | Confident | 86.8 | Confident | 159 Ų | 159 | 61.1 Ų | 61.1 | 69% | 0.691 | 36% | 0.363 | S | S | * | . | S | Bend | trans | -67.1 | -28.9 | 178.2 | -67.3 | 179.2 | -171.3 | 158.5 | 0 | 112.1 | D82 | K67-D82 HydrophobicContact CD-CB 4.37Å; K67-D82 IonicContact NZ-OD2 2.85Å; K67-D82 PolarHBondContact NZ-OD2 2.8Å |
| 68 | V | 85.8 | Confident | 88.1 | Confident | 36 Ų | 36 | 60 Ų | 60 | 22% | 0.218 | 35% | 0.347 | C | S | . | . | trans | -135.6 | 138.6 | -177.6 | -66.4 | 0 | 0 | 0 | 0 | 109.3 | T66 I71 V148 | T66-V68 PolarHBondContact O-N 2.87Å; V68-I71 HydrophobicContact CG2-CD1 3.87Å; V68-I71 HydrophobicContact CG2-CG1 3.64Å; V68-V148 HydrophobicContact CG2-CG1 4.48Å; V68-V148 WeakPolarHBondContact O-CG2 3.45Å | ||
| 69 | S | 87.6 | Confident | 88.8 | Confident | 91 Ų | 91 | 56.6 Ų | 56.6 | 64% | 0.636 | 31% | 0.312 | S | S | * | . | S | Bend | trans | -88.9 | -20.9 | 175.6 | 57.5 | 0 | 0 | 0 | 0 | 112.5 | T149 | S69-T149 PolarHBondContact O-N 2.79Š|
| 70 | Q | 91 | Very high | 89.2 | Confident | 76 Ų | 76 | 57.5 Ų | 57.5 | 36% | 0.355 | 31% | 0.311 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.4 | 137.4 | -179.1 | -170.5 | -179.1 | -70.5 | 0 | 0 | 110.9 | T149 R151 | Q70-T149 CarbonylContact C-O 3.58Å; Q70-T149 VanDerWaalsContact CA-O 3.29Å; Q70-T149 WeakPolarHBondContact CA-O 3.43Å; Q70-R151 HydrophobicContact CG-CG 4.33Å; Q70-R151 VanDerWaalsContact NE2-CD 3.32Å; Q70-R151 VanDerWaalsContact NE2-NE 3.17Å; Q70-R151 VanDerWaalsContact OE1-NE 3.08Å |
| 71 | I | 90.9 | Very high | 89.3 | Confident | 9 Ų | 9 | 52.4 Ų | 52.4 | 5% | 0.046 | 29% | 0.289 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.3 | 134.4 | 174.7 | -62.9 | 167.9 | 0 | 0 | 0 | 107.8 | V68 I81 V148 T149 L150 R151 | V68-I71 HydrophobicContact CG2-CD1 3.87Å; V68-I71 HydrophobicContact CG2-CG1 3.64Å; I71-I81 HydrophobicContact CD1-CB 4.2Å; I71-I81 HydrophobicContact CD1-CG1 3.85Å; I71-I81 HydrophobicContact CD1-CG2 4.07Å; I71-V148 HydrophobicContact CD1-CG1 3.85Å; I71-V148 HydrophobicContact CG1-CG1 4.03Å; I71-T149 PolarHBondContact N-O 2.89Å; I71-L150 HydrophobicContact CB-CD1 4.18Å; I71-L150 HydrophobicContact CG2-CD1 3.98Å; I71-R151 PolarHBondContact O-N 2.75Å |
| 72 | I | 90.9 | Very high | 89.2 | Confident | 41 Ų | 41 | 50 Ų | 50 | 21% | 0.21 | 27% | 0.274 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.4 | 117.9 | 174.2 | -55.3 | 174.9 | 0 | 0 | 0 | 107.2 | R151 V153 | I72-R151 WeakPolarHBondContact CA-O 3.08Å; I72-R151 HydrophobicContact CG1-CB 4.22Å; I72-V153 HydrophobicContact CG2-CB 4.5Å; I72-V153 HydrophobicContact CG2-CG1 3.72Å; I72-V153 HydrophobicContact CG2-CG2 3.96Å |
| 73 | A | 90.3 | Very high | 89 | Confident | 8 Ų | 8 | 49.9 Ų | 49.9 | 7% | 0.066 | 27% | 0.273 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.9 | 153.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111 | A79 I125 L150 R151 V152 V153 | A73-A79 HydrophobicContact CB-CB 4.2Å; A73-I125 HydrophobicContact CB-CD1 3.36Å; A73-L150 HydrophobicContact CB-CD1 4.04Å; A73-R151 PolarHBondContact N-O 2.81Å; A73-V152 CarbonylContact O-C 3.48Å; A73-V152 VanDerWaalsContact O-CA 3.29Å; A73-V152 WeakPolarHBondContact O-CA 2.78Å; A73-V153 WeakPolarHBondContact O-CG2 3.46Å; A73-V153 PolarHBondContact O-N 3.25Å |
| 74 | R | 88.6 | Confident | 89 | Confident | 128 Ų | 128 | 51.3 Ų | 51.3 | 48% | 0.483 | 28% | 0.278 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.4 | 145.5 | 179 | -60 | -179.1 | 172.9 | -144.1 | -0.6 | 109.9 | G76 S77 V153 T155 | R74-G76 PolarHBondContact O-N 3.21Å; R74-S77 PolarHBondContact N-OG 3Å; R74-S77 VanDerWaalsContact N-OG 3.12Å; R74-S77 WeakPolarHBondContact O-CB 3.46Å; R74-S77 PolarHBondContact O-N 2.83Å; R74-S77 VanDerWaalsContact O-N 3.07Å; R74-S77 PolarHBondContact O-OG 3.41Å; R74-V153 WeakPolarHBondContact CA-O 3.47Å; R74-V153 HydrophobicContact CG-CG2 3.98Å; R74-T155 HydrophobicContact CB-CG2 4.03Å; R74-T155 VanDerWaalsContact CD-CG2 3.46Å; R74-T155 HydrophobicContact CG-CG2 3.54Å |
| 75 | E | 87.6 | Confident | 88.9 | Confident | 58 Ų | 58 | 51.2 Ų | 51.2 | 27% | 0.271 | 28% | 0.278 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.4 | 136.9 | 169 | -173.6 | 173.8 | -129.8 | 0 | 0 | 110.4 | S77 V152 V153 F154 N156 | E75-S77 PolarHBondContact O-N 3.27Å; E75-V152 HydrophobicContact CB-CG1 4.09Å; E75-V153 PolarHBondContact N-O 3.46Å; E75-F154 WeakPolarHBondContact OE2-CD1 3.39Å; E75-F154 WeakPolarHBondContact OE2-CE1 3.46Å; E75-N156 PolarHBondContact OE2-ND2 2.85Å |
| 76 | G | 85.6 | Confident | 89 | Confident | 57 Ų | 57 | 48.7 Ų | 48.7 | 59% | 0.588 | 27% | 0.271 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.7 | -4.5 | -175.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | R74 I125 | R74-G76 PolarHBondContact O-N 3.21Å; G76-I125 PolarHBondContact N-O 3.46Å |
| 77 | S | 88.7 | Confident | 89.1 | Confident | 37 Ų | 37 | 46.9 Ų | 46.9 | 26% | 0.259 | 26% | 0.263 | S | S | . | . | trans | -89.2 | 172.3 | 174 | 72.7 | 0 | 0 | 0 | 0 | 112.3 | R74 E75 I125 | R74-S77 PolarHBondContact N-OG 3Å; R74-S77 VanDerWaalsContact N-OG 3.12Å; R74-S77 WeakPolarHBondContact O-CB 3.46Å; R74-S77 PolarHBondContact O-N 2.83Å; R74-S77 VanDerWaalsContact O-N 3.07Å; R74-S77 PolarHBondContact O-OG 3.41Å; E75-S77 PolarHBondContact O-N 3.27Å; S77-I125 WeakPolarHBondContact O-CB 3.17Å; S77-I125 WeakPolarHBondContact O-CD1 3.31Å; S77-I125 WeakPolarHBondContact O-CG1 3.17Å; S77-I125 PolarHBondContact O-N 2.93Å | ||
| 78 | C | 90.2 | Very high | 89.5 | Confident | 27 Ų | 27 | 43.2 Ų | 43.2 | 18% | 0.182 | 25% | 0.25 | C | S | . | . | trans | -100.6 | 151.8 | 171.3 | 52 | 0 | 0 | 0 | 0 | 112 | I122 C404 | C78-I122 CarbonylContact C-O 3.6Å; C78-I122 WeakPolarHBondContact CA-O 3.34Å; C78-I122 VanDerWaalsContact CB-O 3.25Å; C78-I122 WeakPolarHBondContact CB-O 3.39Å; C78-C404 HydrophobicContact CB-CB 4.4Å; C78-C404 WeakPolarHBondContact CB-SG 3.38Å; C78-C404 VanDerWaalsContact SG-CA 3.55Å; C78-C404 WeakPolarHBondContact SG-CB 3.1Å; C78-C404 CovalentContact SG-SG 2.05Å; C78-C404 PolarHBondContact SG-SG 2.89Å | ||
| 79 | A | 90.8 | Very high | 89.8 | Confident | 3 Ų | 3 | 44.3 Ų | 44.3 | 3% | 0.025 | 26% | 0.258 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.5 | 142.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | A73 I122 I125 L150 | A73-A79 HydrophobicContact CB-CB 4.2Å; A79-I122 PolarHBondContact N-O 3.24Å; A79-I122 PolarHBondContact O-N 2.96Å; A79-I125 HydrophobicContact CB-CD1 3.4Å; A79-I125 HydrophobicContact CB-CG1 4.48Å; A79-L150 HydrophobicContact CB-CD1 4.24Å |
| 80 | L | 91.1 | Very high | 89.9 | Confident | 42 Ų | 42 | 47.2 Ų | 47.2 | 22% | 0.22 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 123.6 | 174.3 | -62.2 | 176.1 | 0 | 0 | 0 | 108.7 | V119 L120 N121 V406 | L80-V119 HydrophobicContact CB-CG1 4.14Å; L80-V119 HydrophobicContact CD2-CG1 4.24Å; L80-L120 CarbonylContact C-O 3.54Å; L80-L120 WeakPolarHBondContact CA-O 3.21Å; L80-N121 HydrophobicContact CD2-CB 3.41Å; L80-N121 VanDerWaalsContact CD2-CB 3.41Å; L80-N121 VanDerWaalsContact CD2-CG 3.47Å; L80-V406 HydrophobicContact CD1-CG2 4.15Å; L80-V406 HydrophobicContact CG-CG2 4.49Å |
| 81 | I | 91.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 25% | 0.252 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 107.5 | 176.2 | -44.3 | -169.7 | 0 | 0 | 0 | 108.5 | I71 W95 V119 L120 I122 Y133 V148 | I71-I81 HydrophobicContact CD1-CB 4.2Å; I71-I81 HydrophobicContact CD1-CG1 3.85Å; I71-I81 HydrophobicContact CD1-CG2 4.07Å; I81-W95 HydrophobicContact CB-CH2 3.93Å; I81-W95 HydrophobicContact CB-CZ2 4.43Å; I81-W95 HydrophobicContact CB-CZ3 4.46Å; I81-W95 HydrophobicContact CG2-CH2 3.43Å; I81-W95 VanDerWaalsContact CG2-CH2 3.43Å; I81-W95 HydrophobicContact CG2-CZ2 4.31Å; I81-W95 HydrophobicContact CG2-CZ3 3.97Å; I81-W95 WeakPolarHBondContact O-CZ2 3.38Å; I81-V119 WeakPolarHBondContact O-CA 3.39Å; I81-L120 HydrophobicContact CB-CB 4.28Å; I81-L120 HydrophobicContact CD1-CD2 4.32Å; I81-L120 PolarHBondContact N-O 3.35Å; I81-L120 PolarHBondContact O-N 2.97Å; I81-I122 HydrophobicContact CD1-CD1 4.07Å; I81-Y133 HydrophobicContact CD1-CD2 3.87Å; I81-Y133 HydrophobicContact CD1-CG 3.87Å; I81-V148 HydrophobicContact CG2-CB 3.68Å; I81-V148 HydrophobicContact CG2-CG1 3.87Å; I81-V148 HydrophobicContact CG2-CG2 3.67Å |
| 82 | D | 89.9 | Confident | 89.8 | Confident | 32 Ų | 32 | 47 Ų | 47 | 17% | 0.171 | 27% | 0.273 | C | S | . | . | trans | -80.8 | 124.2 | 179.2 | -73 | 0.6 | 0 | 0 | 0 | 111.1 | K67 V119 | K67-D82 HydrophobicContact CD-CB 4.37Å; K67-D82 IonicContact NZ-OD2 2.85Å; K67-D82 PolarHBondContact NZ-OD2 2.8Å; D82-V119 HydrophobicContact CB-CG2 4.49Å; D82-V119 WeakPolarHBondContact OD1-CG1 3.49Å; D82-V119 VanDerWaalsContact OD1-CG2 3.29Å; D82-V119 WeakPolarHBondContact OD1-CG2 3.38Å | ||
| 83 | C | 89.2 | Confident | 89.8 | Confident | 3 Ų | 3 | 46.8 Ų | 46.8 | 2% | 0.02 | 27% | 0.274 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.9 | 102.7 | 168.4 | -179.6 | 0 | 0 | 0 | 0 | 108.6 | V64 W95 C135 | V64-C83 WeakPolarHBondContact CG1-SG 3.49Å; C83-W95 HydrophobicContact CB-CH2 3.87Å; C83-W95 HydrophobicContact CB-CZ2 3.37Å; C83-C135 HydrophobicContact CB-CB 3.66Å; C83-C135 WeakPolarHBondContact CB-SG 3.36Å; C83-C135 WeakPolarHBondContact SG-CB 3.32Å; C83-C135 CovalentContact SG-SG 2.05Å; C83-C135 PolarHBondContact SG-SG 2.85Å |
| 84 | N | 89.9 | Confident | 89.9 | Confident | 89 Ų | 89 | 48.7 Ų | 48.7 | 48% | 0.476 | 28% | 0.281 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.1 | 120.4 | 178.8 | -173.7 | 50.3 | 0 | 0 | 0 | 109.1 | F65 | F65-N84 HydrophobicContact CB-CB 4.27Å; F65-N84 PolarHBondContact N-O 2.87Å; F65-N84 PolarHBondContact O-N 3.41Å |
| 85 | V | 90.1 | Very high | 90.1 | Very high | 23 Ų | 23 | 42.6 Ų | 42.6 | 14% | 0.139 | 26% | 0.258 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.4 | 133.2 | -172.4 | -171.7 | 0 | 0 | 0 | 0 | 109.9 | V63 V64 P91 V93 A137 | V63-V85 WeakPolarHBondContact O-CA 3.29Å; V64-V85 HydrophobicContact CG2-CG1 4.38Å; V64-V85 HydrophobicContact CG2-CG2 4.2Å; V85-P91 HydrophobicContact CB-CG 4.36Å; V85-P91 HydrophobicContact CG1-CB 4.2Å; V85-P91 HydrophobicContact CG1-CG 3.3Å; V85-V93 HydrophobicContact CB-CG2 4.19Å; V85-V93 HydrophobicContact CG1-CG2 4.46Å; V85-V93 HydrophobicContact CG2-CG2 3.78Å; V85-A137 HydrophobicContact CB-CB 4.4Å; V85-A137 HydrophobicContact CG1-CB 3.29Å; V85-A137 HydrophobicContact CG2-CB 4.22Å |
| 86 | T | 90.1 | Very high | 90.3 | Very high | 54 Ų | 54 | 41.8 Ų | 41.8 | 33% | 0.331 | 25% | 0.254 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.3 | 139.1 | 175.7 | 59.4 | 0 | 0 | 0 | 0 | 109.7 | P62 V63 F65 | P62-T86 CarbonylContact C-O 3.56Å; P62-T86 WeakPolarHBondContact CA-O 3.24Å; V63-T86 PolarHBondContact N-O 2.93Å; V63-T86 PolarHBondContact O-N 2.89Å; F65-T86 HydrophobicContact CE2-CG2 4.2Å |
| 87 | G | 89.3 | Confident | 90.6 | Very high | 12 Ų | 12 | 39.9 Ų | 39.9 | 12% | 0.124 | 23% | 0.23 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -178 | 155 | 176.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | F60 P89 | F60-G87 VanDerWaalsContact CE2-CA 3.44Å; G87-P89 CarbonylContact C-O 3.57Å; G87-P89 VanDerWaalsContact C-O 3.23Å; G87-P89 CarbonylContact O-C 3.53Å |
| 88 | D | 90.9 | Very high | 90.6 | Very high | 81 Ų | 81 | 40.5 Ų | 40.5 | 43% | 0.433 | 23% | 0.234 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -132 | 117.8 | 174.2 | -175.2 | 19 | 0 | 0 | 0 | 109.6 | G59 F60 N139 H141 | G59-D88 CarbonylContact C-O 3.59Å; G59-D88 WeakPolarHBondContact CA-O 3.29Å; F60-D88 HydrophobicContact CD1-CB 3.67Å; F60-D88 HydrophobicContact CE1-CB 3.39Å; F60-D88 HydrophobicContact CG-CB 4.44Å; F60-D88 HydrophobicContact CZ-CB 3.98Å; F60-D88 PolarHBondContact N-O 3.33Å; F60-D88 PolarHBondContact O-N 3.24Å; D88-N139 PolarHBondContact O-ND2 3.23Å; D88-H141 PolarHBondContact O-CD2 3Å |
| 89 | P | 92.1 | Very high | 90.4 | Very high | 59 Ų | 59 | 46 Ų | 46 | 38% | 0.383 | 26% | 0.257 | S | S | . | . | S | Bend | cis | -57 | 161.5 | -6.2 | -26.3 | 34.8 | 0 | 0 | 0 | 115.4 | G87 P91 N139 V140 | G87-P89 CarbonylContact C-O 3.57Å; G87-P89 VanDerWaalsContact C-O 3.23Å; G87-P89 CarbonylContact O-C 3.53Å; P89-P91 WeakPolarHBondContact O-CD 3.35Å; P89-N139 VanDerWaalsContact CD-ND2 3.32Å; P89-N139 WeakPolarHBondContact CD-ND2 3.32Å; P89-N139 PolarHBondContact O-ND2 3.43Å; P89-N139 PolarHBondContact O-OD1 2.9Å; P89-V140 HydrophobicContact CG-CG2 4.31Å |
| 90 | L | 89.4 | Confident | 90.2 | Very high | 152 Ų | 152 | 48.3 Ų | 48.3 | 80% | 0.796 | 28% | 0.282 | S | S | * | . | P | Polyproline II helix | trans | -56.1 | 121.9 | -179.1 | -173.8 | 74.9 | 0 | 0 | 0 | 110.6 | ||
| 91 | P | 90.8 | Very high | 90 | Very high | 12 Ų | 12 | 52.1 Ų | 52.1 | 8% | 0.078 | 30% | 0.298 | C | S | . | . | P | Polyproline II helix | trans | -73.1 | 147.2 | -176.4 | 25.5 | -31.8 | 0 | 0 | 0 | 112.6 | P62 V85 P89 A137 T138 N139 | P62-P91 HydrophobicContact CB-CB 3.84Å; P62-P91 HydrophobicContact CB-CG 3.94Å; V85-P91 HydrophobicContact CB-CG 4.36Å; V85-P91 HydrophobicContact CG1-CB 4.2Å; V85-P91 HydrophobicContact CG1-CG 3.3Å; P89-P91 WeakPolarHBondContact O-CD 3.35Å; P91-A137 HydrophobicContact CB-CB 4.15Å; P91-A137 HydrophobicContact CG-CB 4.45Å; P91-T138 WeakPolarHBondContact CA-O 3.47Å; P91-N139 HydrophobicContact CB-CB 4.13Å |
| 92 | S | 89.6 | Confident | 90 | Very high | 68 Ų | 68 | 58.6 Ų | 58.6 | 48% | 0.476 | 32% | 0.323 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.7 | 135.2 | 166.2 | 59.5 | 0 | 0 | 0 | 0 | 110.3 | A137 T138 | S92-A137 CarbonylContact O-C 3.42Å; S92-A137 VanDerWaalsContact O-CA 3.32Å; S92-A137 WeakPolarHBondContact O-CA 3.25Å; S92-T138 PolarHBondContact N-O 3.38Å; S92-T138 PolarHBondContact O-N 3.29Å; S92-T138 PolarHBondContact OG-O 2.92Å; S92-T138 VanDerWaalsContact OG-O 3.06Å |
| 93 | V | 90.7 | Very high | 89.8 | Confident | 37 Ų | 37 | 57.6 Ų | 57.6 | 22% | 0.224 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 127.2 | -178.3 | -177.9 | 0 | 0 | 0 | 0 | 110.3 | V85 C135 M136 | V85-V93 HydrophobicContact CB-CG2 4.19Å; V85-V93 HydrophobicContact CG1-CG2 4.46Å; V85-V93 HydrophobicContact CG2-CG2 3.78Å; V93-C135 HydrophobicContact CG1-CB 4.41Å; V93-M136 WeakPolarHBondContact CA-O 3.25Å |
| 94 | E | 91.5 | Very high | 89.3 | Confident | 48 Ų | 48 | 59.6 Ų | 59.6 | 22% | 0.224 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 142.8 | 176.1 | -55.3 | -170.7 | 132.9 | 0 | 0 | 109.9 | F96 R102 C135 M136 | E94-F96 HydrophobicContact CB-CE2 3.9Å; E94-F96 HydrophobicContact CB-CZ 4.34Å; E94-R102 IonicContact OE1-CZ 3.56Å; E94-R102 IonicContact OE1-NE 3.87Å; E94-R102 PolarHBondContact OE1-NE 3.2Å; E94-R102 IonicContact OE1-NH2 2.69Å; E94-R102 PolarHBondContact OE1-NH2 2.99Å; E94-R102 IonicContact OE2-NE 3.18Å; E94-C135 CarbonylContact O-C 3.58Å; E94-C135 WeakPolarHBondContact O-CA 3.13Å; E94-M136 PolarHBondContact N-O 3.39Å; E94-M136 PolarHBondContact O-N 3.45Å; E94-M136 VanDerWaalsContact OE2-CE 3.27Å; E94-M136 WeakPolarHBondContact OE2-CE 3.31Å |
| 95 | W | 92.7 | Very high | 88.3 | Confident | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 142.5 | 178.8 | -81.6 | 90.1 | 0 | 0 | 0 | 111.2 | I81 C83 R102 L103 L114 G118 L120 T134 C135 | I81-W95 HydrophobicContact CB-CH2 3.93Å; I81-W95 HydrophobicContact CB-CZ2 4.43Å; I81-W95 HydrophobicContact CB-CZ3 4.46Å; I81-W95 HydrophobicContact CG2-CH2 3.43Å; I81-W95 VanDerWaalsContact CG2-CH2 3.43Å; I81-W95 HydrophobicContact CG2-CZ2 4.31Å; I81-W95 HydrophobicContact CG2-CZ3 3.97Å; I81-W95 WeakPolarHBondContact O-CZ2 3.38Å; C83-W95 HydrophobicContact CB-CH2 3.87Å; C83-W95 HydrophobicContact CB-CZ2 3.37Å; W95-R102 CarbonylContact O-C 3.23Å; W95-R102 WeakPolarHBondContact O-CA 3.02Å; W95-L103 HydrophobicContact CB-CB 4.08Å; W95-L103 HydrophobicContact CB-CD1 4.1Å; W95-L103 PolarHBondContact O-N 3.5Å; W95-L114 HydrophobicContact CB-CD1 4.17Å; W95-L114 HydrophobicContact CG-CD1 3.91Å; W95-G118 PolarHBondContact NE1-O 3.02Å; W95-L120 HydrophobicContact CB-CD1 4.44Å; W95-L120 HydrophobicContact CB-CD2 4.39Å; W95-L120 HydrophobicContact CD2-CB 3.79Å; W95-L120 HydrophobicContact CD2-CD2 3.85Å; W95-L120 HydrophobicContact CD2-CG 4.33Å; W95-L120 HydrophobicContact CE3-CB 4.31Å; W95-L120 HydrophobicContact CE3-CD2 3.76Å; W95-L120 HydrophobicContact CG-CB 4.13Å; W95-L120 HydrophobicContact CG-CD1 4.32Å; W95-L120 HydrophobicContact CG-CD2 4.18Å; W95-L120 HydrophobicContact CG-CG 4.46Å; W95-L120 HydrophobicContact CH2-CB 4.42Å; W95-L120 HydrophobicContact CZ2-CB 3.87Å; W95-L120 HydrophobicContact CZ3-CD2 4.32Å; W95-T134 CarbonylContact C-O 3.55Å; W95-C135 HydrophobicContact CD2-CB 3.82Å; W95-C135 HydrophobicContact CE3-CB 3.93Å; W95-C135 HydrophobicContact CH2-CB 3.81Å; W95-C135 HydrophobicContact CZ2-CB 3.73Å; W95-C135 HydrophobicContact CZ3-CB 3.9Å |
| 96 | F | 91.9 | Very high | 87.1 | Confident | 42 Ų | 42 | 64.8 Ų | 64.8 | 18% | 0.184 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.2 | 136.2 | 177.5 | -62.1 | -93.2 | 0 | 0 | 0 | 109.9 | E94 E101 R102 Y133 T134 M136 | E94-F96 HydrophobicContact CB-CE2 3.9Å; E94-F96 HydrophobicContact CB-CZ 4.34Å; F96-E101 VanDerWaalsContact CA-O 3.31Å; F96-E101 WeakPolarHBondContact CA-O 3.44Å; F96-R102 HydrophobicContact CD1-CB 4.24Å; F96-R102 HydrophobicContact CE1-CB 3.89Å; F96-R102 HydrophobicContact CE1-CG 4.3Å; F96-R102 HydrophobicContact CZ-CG 4.46Å; F96-Y133 WeakPolarHBondContact O-CA 3.44Å; F96-T134 PolarHBondContact N-O 2.87Å; F96-T134 PolarHBondContact O-N 3.27Å; F96-M136 HydrophobicContact CD2-CB 4.23Å; F96-M136 HydrophobicContact CE2-CB 3.74Å; F96-M136 HydrophobicContact CE2-CE 3.6Å; F96-M136 HydrophobicContact CE2-SD 4.11Å; F96-M136 HydrophobicContact CZ-CE 3.62Å; F96-M136 HydrophobicContact CZ-SD 4.48Å |
| 97 | N | 91.6 | Very high | 85.7 | Confident | 17 Ų | 17 | 68.4 Ų | 68.4 | 9% | 0.091 | 37% | 0.367 | C | S | . | . | trans | -77.4 | -179.9 | 174.1 | 72.6 | 9.5 | 0 | 0 | 0 | 111.7 | H99 G100 E101 L103 K132 Y133 | N97-H99 PolarHBondContact O-N 2.96Å; N97-H99 VanDerWaalsContact OD1-CA 3.31Å; N97-H99 WeakPolarHBondContact OD1-CA 3.26Å; N97-H99 WeakPolarHBondContact OD1-CB 3.43Å; N97-H99 PolarHBondContact OD1-N 3.48Å; N97-G100 PolarHBondContact O-N 3.27Å; N97-G100 PolarHBondContact OD1-N 3.36Å; N97-E101 PolarHBondContact N-O 2.89Å; N97-E101 PolarHBondContact ND2-OE2 3.37Å; N97-E101 PolarHBondContact OD1-N 3.4Å; N97-L103 HydrophobicContact CB-CD1 4.31Å; N97-L103 HydrophobicContact CB-CD2 3.99Å; N97-L103 HydrophobicContact CB-CG 4.24Å; N97-K132 CarbonylContact C-O 3.6Å; N97-Y133 HydrophobicContact CB-CD1 4.44Å; N97-Y133 HydrophobicContact CB-CE1 3.86Å | ||
| 98 | S | 89.7 | Confident | 84.4 | Confident | 49 Ų | 49 | 69.6 Ų | 69.6 | 34% | 0.343 | 37% | 0.374 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.3 | -17.9 | 177.7 | 49.6 | 0 | 0 | 0 | 0 | 114.8 | G100 K132 | S98-G100 VanDerWaalsContact C-N 3.34Å; S98-K132 VanDerWaalsContact CA-O 3.25Å; S98-K132 WeakPolarHBondContact CA-O 3.3Å; S98-K132 PolarHBondContact N-O 3.33Å |
| 99 | H | 86.5 | Confident | 83.3 | Confident | 142 Ų | 142 | 69.7 Ų | 69.7 | 66% | 0.657 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.3 | -2.4 | 176.9 | -57.4 | -74.6 | 0 | 0 | 0 | 112.4 | N97 E101 | N97-H99 PolarHBondContact O-N 2.96Å; N97-H99 VanDerWaalsContact OD1-CA 3.31Å; N97-H99 WeakPolarHBondContact OD1-CA 3.26Å; N97-H99 WeakPolarHBondContact OD1-CB 3.43Å; N97-H99 PolarHBondContact OD1-N 3.48Å; H99-E101 VanDerWaalsContact C-N 3.32Å; H99-E101 HydrophobicContact CB-CG 4.26Å |
| 100 | G | 85.1 | Confident | 82.4 | Confident | 53 Ų | 53 | 68 Ų | 68 | 55% | 0.546 | 39% | 0.387 | S | S | . | . | S | Bend | trans | 79.6 | 12.7 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | N97 S98 | N97-G100 PolarHBondContact O-N 3.27Å; N97-G100 PolarHBondContact OD1-N 3.36Å; S98-G100 VanDerWaalsContact C-N 3.34Å |
| 101 | E | 88.7 | Confident | 82.2 | Confident | 122 Ų | 122 | 62.9 Ų | 62.9 | 57% | 0.57 | 36% | 0.358 | S | S | * | . | P | Polyproline II helix | trans | -84.1 | 136 | 177.1 | -56.9 | 173.6 | 136.8 | 0 | 0 | 110.2 | F96 N97 H99 L103 | F96-E101 VanDerWaalsContact CA-O 3.31Å; F96-E101 WeakPolarHBondContact CA-O 3.44Å; N97-E101 PolarHBondContact N-O 2.89Å; N97-E101 PolarHBondContact ND2-OE2 3.37Å; N97-E101 PolarHBondContact OD1-N 3.4Å; H99-E101 VanDerWaalsContact C-N 3.32Å; H99-E101 HydrophobicContact CB-CG 4.26Å; E101-L103 PolarHBondContact O-N 3.03Å |
| 102 | R | 89.4 | Confident | 82 | Confident | 136 Ų | 136 | 63.2 Ų | 63.2 | 51% | 0.513 | 36% | 0.358 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.8 | 122 | 176 | -173.3 | 175.6 | -178.4 | -112.1 | 4.6 | 109.4 | E94 W95 F96 | E94-R102 IonicContact OE1-CZ 3.56Å; E94-R102 IonicContact OE1-NE 3.87Å; E94-R102 PolarHBondContact OE1-NE 3.2Å; E94-R102 IonicContact OE1-NH2 2.69Å; E94-R102 PolarHBondContact OE1-NH2 2.99Å; E94-R102 IonicContact OE2-NE 3.18Å; W95-R102 CarbonylContact O-C 3.23Å; W95-R102 WeakPolarHBondContact O-CA 3.02Å; F96-R102 HydrophobicContact CD1-CB 4.24Å; F96-R102 HydrophobicContact CE1-CB 3.89Å; F96-R102 HydrophobicContact CE1-CG 4.3Å; F96-R102 HydrophobicContact CZ-CG 4.46Å |
| 103 | L | 87.6 | Confident | 81.9 | Confident | 10 Ų | 10 | 65.8 Ų | 65.8 | 5% | 0.052 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.4 | 121.5 | 176.4 | -64.1 | 176.2 | 0 | 0 | 0 | 108.9 | W95 N97 E101 W112 L120 Y133 | W95-L103 HydrophobicContact CB-CB 4.08Å; W95-L103 HydrophobicContact CB-CD1 4.1Å; W95-L103 PolarHBondContact O-N 3.5Å; N97-L103 HydrophobicContact CB-CD1 4.31Å; N97-L103 HydrophobicContact CB-CD2 3.99Å; N97-L103 HydrophobicContact CB-CG 4.24Å; E101-L103 PolarHBondContact O-N 3.03Å; L103-W112 HydrophobicContact CD1-CD2 3.98Å; L103-W112 HydrophobicContact CD1-CE3 3.4Å; L103-W112 HydrophobicContact CD1-CH2 4.39Å; L103-W112 HydrophobicContact CD1-CZ3 3.64Å; L103-W112 HydrophobicContact CD2-CD2 3.57Å; L103-W112 HydrophobicContact CD2-CE3 3.88Å; L103-W112 HydrophobicContact CD2-CG 4.03Å; L103-W112 HydrophobicContact CD2-CH2 4.38Å; L103-W112 HydrophobicContact CD2-CZ2 4.05Å; L103-W112 HydrophobicContact CD2-CZ3 4.28Å; L103-W112 HydrophobicContact CG-CD2 4.3Å; L103-W112 HydrophobicContact CG-CE3 4.2Å; L103-L120 HydrophobicContact CD1-CD1 4.24Å; L103-L120 HydrophobicContact CD1-CD2 3.74Å; L103-Y133 HydrophobicContact CD1-CD1 3.88Å; L103-Y133 HydrophobicContact CD1-CE1 4Å |
| 104 | D | 78.3 | Confident | 81.7 | Confident | 45 Ų | 45 | 66.9 Ų | 66.9 | 24% | 0.241 | 36% | 0.362 | C | S | . | . | trans | -130.8 | 140.9 | 174.5 | -169 | -1.4 | 0 | 0 | 0 | 109.8 | Q106 I107 S108 | D104-Q106 PolarHBondContact O-N 2.97Å; D104-Q106 PolarHBondContact OD1-N 2.97Å; D104-I107 HydrophobicContact CB-CB 4.23Å; D104-I107 HydrophobicContact CB-CD1 3.79Å; D104-I107 HydrophobicContact CB-CG1 3.93Å; D104-I107 PolarHBondContact O-N 3.49Å; D104-S108 PolarHBondContact O-N 2.6Å | ||
| 105 | T | 69.3 | Low | 81.3 | Confident | 50 Ų | 50 | 68 Ų | 68 | 31% | 0.307 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.7 | -33.8 | 176.9 | 60.5 | 0 | 0 | 0 | 0 | 112.3 | L114 | T105-L114 HydrophobicContact CG2-CB 4.02Š|
| 106 | Q | 63.9 | Low | 80.3 | Confident | 172 Ų | 172 | 76.6 Ų | 76.6 | 80% | 0.804 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.1 | -29.3 | -177.3 | -60.2 | -169 | 20.2 | 0 | 0 | 113.7 | D104 | D104-Q106 PolarHBondContact O-N 2.97Å; D104-Q106 PolarHBondContact OD1-N 2.97Å |
| 107 | I | 61.3 | Low | 79.2 | Confident | 129 Ų | 129 | 79.6 Ų | 79.6 | 66% | 0.662 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.6 | -27.7 | -169.3 | -58.9 | 174.5 | 0 | 0 | 0 | 111.6 | D104 | D104-I107 HydrophobicContact CB-CB 4.23Å; D104-I107 HydrophobicContact CB-CD1 3.79Å; D104-I107 HydrophobicContact CB-CG1 3.93Å; D104-I107 PolarHBondContact O-N 3.49Å |
| 108 | S | 62.5 | Low | 78.7 | Confident | 38 Ų | 38 | 79.2 Ų | 79.2 | 27% | 0.266 | 43% | 0.433 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.4 | 29.4 | -167.5 | -59.8 | 0 | 0 | 0 | 0 | 115.1 | D104 G110 K111 | D104-S108 PolarHBondContact O-N 2.6Å; S108-G110 PolarHBondContact O-N 3.42Å; S108-K111 PolarHBondContact O-N 3.02Å; S108-K111 VanDerWaalsContact O-N 3.11Å |
| 109 | G | 66.4 | Low | 78.7 | Confident | 83 Ų | 83 | 77.3 Ų | 77.3 | 86% | 0.856 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.3 | 25.4 | 170.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 110 | G | 74.1 | Confident | 78.9 | Confident | 23 Ų | 23 | 70.6 Ų | 70.6 | 24% | 0.237 | 39% | 0.388 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 79.5 | 14.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | S108 W113 T123 | S108-G110 PolarHBondContact O-N 3.42Å; G110-W113 PolarHBondContact O-NE1 3.48Å; G110-T123 PolarHBondContact O-OG1 2.99Å |
| 111 | K | 84.3 | Confident | 79.1 | Confident | 45 Ų | 45 | 69.1 Ų | 69.1 | 20% | 0.196 | 37% | 0.367 | C | S | . | . | S | Bend | trans | -76.5 | -32 | 172.6 | -177.8 | 174.5 | -174.6 | 174.1 | 0 | 113.1 | S108 T123 S124 D129 | S108-K111 PolarHBondContact O-N 3.02Å; S108-K111 VanDerWaalsContact O-N 3.11Å; K111-T123 PolarHBondContact O-N 3.41Å; K111-T123 VanDerWaalsContact O-N 3.13Å; K111-T123 PolarHBondContact O-OG1 3.1Å; K111-S124 VanDerWaalsContact CE-O 3.25Å; K111-S124 WeakPolarHBondContact CE-O 3.03Å; K111-D129 WeakPolarHBondContact CE-OD1 3.4Å; K111-D129 WeakPolarHBondContact CE-OD2 3.39Å; K111-D129 IonicContact NZ-OD1 2.66Å; K111-D129 PolarHBondContact NZ-OD1 3.15Å; K111-D129 IonicContact NZ-OD2 3.1Å; K111-D129 PolarHBondContact NZ-OD2 3.04Å |
| 112 | W | 87.9 | Confident | 79.3 | Confident | 18 Ų | 18 | 63.3 Ų | 63.3 | 7% | 0.068 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.1 | 127.7 | -175.7 | -47.4 | 75.5 | 0 | 0 | 0 | 109.2 | L103 L120 N121 I122 Y133 | L103-W112 HydrophobicContact CD1-CD2 3.98Å; L103-W112 HydrophobicContact CD1-CE3 3.4Å; L103-W112 HydrophobicContact CD1-CH2 4.39Å; L103-W112 HydrophobicContact CD1-CZ3 3.64Å; L103-W112 HydrophobicContact CD2-CD2 3.57Å; L103-W112 HydrophobicContact CD2-CE3 3.88Å; L103-W112 HydrophobicContact CD2-CG 4.03Å; L103-W112 HydrophobicContact CD2-CH2 4.38Å; L103-W112 HydrophobicContact CD2-CZ2 4.05Å; L103-W112 HydrophobicContact CD2-CZ3 4.28Å; L103-W112 HydrophobicContact CG-CD2 4.3Å; L103-W112 HydrophobicContact CG-CE3 4.2Å; W112-L120 HydrophobicContact CB-CD1 4.35Å; W112-L120 HydrophobicContact CE3-CD1 4.1Å; W112-L120 HydrophobicContact CE3-CD2 4.04Å; W112-L120 HydrophobicContact CE3-CG 4.35Å; W112-L120 HydrophobicContact CZ3-CD2 4.2Å; W112-N121 WeakPolarHBondContact CA-O 3.44Å; W112-I122 HydrophobicContact CE3-CD1 4.15Å; W112-I122 HydrophobicContact CE3-CG1 3.76Å; W112-I122 HydrophobicContact CH2-CD1 4.24Å; W112-I122 HydrophobicContact CZ3-CD1 3.5Å; W112-I122 VanDerWaalsContact CZ3-CD1 3.5Å; W112-I122 HydrophobicContact CZ3-CG1 3.63Å; W112-I122 HydrophobicContact CZ3-CG2 4.38Å; W112-Y133 HydrophobicContact CE3-CE1 4.29Å; W112-Y133 HydrophobicContact CH2-CD1 4.42Å; W112-Y133 AromaticContact CH2-CE1 3.28Å; W112-Y133 HydrophobicContact CH2-CE1 3.28Å; W112-Y133 AromaticContact CH2-CZ 3.53Å; W112-Y133 WeakPolarHBondContact CH2-OH 3.38Å; W112-Y133 HydrophobicContact CZ2-CE1 4.47Å; W112-Y133 AromaticContact CZ3-CD1 3.9Å; W112-Y133 HydrophobicContact CZ3-CD1 3.9Å; W112-Y133 AromaticContact CZ3-CE1 3.13Å; W112-Y133 HydrophobicContact CZ3-CE1 3.13Å; W112-Y133 AromaticContact CZ3-CZ 3.69Å |
| 113 | W | 86 | Confident | 79.2 | Confident | 123 Ų | 123 | 59.5 Ų | 59.5 | 47% | 0.466 | 33% | 0.332 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 121.6 | 178.1 | -63 | 86.8 | 0 | 0 | 0 | 109.4 | G110 L115 N121 | G110-W113 PolarHBondContact O-NE1 3.48Å; W113-L115 HydrophobicContact CB-CD1 4.36Å; W113-N121 HydrophobicContact CB-CB 4.12Å; W113-N121 PolarHBondContact N-O 2.9Å; W113-N121 PolarHBondContact O-N 2.94Å |
| 114 | L | 86.9 | Confident | 79.2 | Confident | 60 Ų | 60 | 62.3 Ų | 62.3 | 31% | 0.314 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.9 | 121.8 | 169.3 | -120.2 | 61.6 | 0 | 0 | 0 | 108 | W95 T105 L120 | W95-L114 HydrophobicContact CB-CD1 4.17Å; W95-L114 HydrophobicContact CG-CD1 3.91Å; T105-L114 HydrophobicContact CG2-CB 4.02Å; L114-L120 HydrophobicContact CD1-CB 4.46Å; L114-L120 HydrophobicContact CD1-CD1 3.56Å |
| 115 | L | 83.1 | Confident | 79.7 | Confident | 72 Ų | 72 | 60.2 Ų | 60.2 | 38% | 0.377 | 34% | 0.342 | S | S | . | . | trans | -88.5 | 156 | 172.7 | -81.4 | 61.8 | 0 | 0 | 0 | 109.9 | W113 N117 G118 V119 N121 | W113-L115 HydrophobicContact CB-CD1 4.36Å; L115-N117 WeakPolarHBondContact CB-OD1 3.44Å; L115-N117 PolarHBondContact O-N 3.43Å; L115-G118 PolarHBondContact O-N 3.13Å; L115-V119 HydrophobicContact CB-CB 4.25Å; L115-V119 PolarHBondContact N-O 2.89Å; L115-N121 HydrophobicContact CD1-CB 3.87Å | ||
| 116 | D | 71.2 | Confident | 80.7 | Confident | 179 Ų | 179 | 62.8 Ų | 62.8 | 96% | 0.957 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60 | -18 | -175.3 | -58.2 | -37 | 0 | 0 | 0 | 114.1 | ||
| 117 | N | 70.1 | Confident | 81.8 | Confident | 105 Ų | 105 | 57.9 Ų | 57.9 | 56% | 0.561 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.6 | 9.5 | 177.6 | 62.6 | -8.1 | 0 | 0 | 0 | 113.9 | L115 V119 | L115-N117 WeakPolarHBondContact CB-OD1 3.44Å; L115-N117 PolarHBondContact O-N 3.43Å; N117-V119 VanDerWaalsContact C-N 3.33Å; N117-V119 VanDerWaalsContact CG-CG2 3.43Å; N117-V119 VanDerWaalsContact ND2-CG2 3.33Å; N117-V119 WeakPolarHBondContact ND2-CG2 3.27Å; N117-V119 VanDerWaalsContact OD1-CB 3.28Å; N117-V119 WeakPolarHBondContact OD1-CB 3.39Å; N117-V119 WeakPolarHBondContact OD1-CG2 3.43Å; N117-V119 PolarHBondContact OD1-N 3.43Å |
| 118 | G | 80.9 | Confident | 83 | Confident | 9 Ų | 9 | 54.6 Ų | 54.6 | 9% | 0.093 | 32% | 0.315 | C | S | . | . | S | Bend | trans | 81.3 | 8.1 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | W95 L115 | W95-G118 PolarHBondContact NE1-O 3.02Å; L115-G118 PolarHBondContact O-N 3.13Å |
| 119 | V | 88.4 | Confident | 84.3 | Confident | 9 Ų | 9 | 53.4 Ų | 53.4 | 6% | 0.055 | 31% | 0.306 | C | S | . | . | P | Polyproline II helix | trans | -80.9 | 132.2 | 178 | 177.8 | 0 | 0 | 0 | 0 | 110.5 | L80 I81 D82 L115 N117 | L80-V119 HydrophobicContact CB-CG1 4.14Å; L80-V119 HydrophobicContact CD2-CG1 4.24Å; I81-V119 WeakPolarHBondContact O-CA 3.39Å; D82-V119 HydrophobicContact CB-CG2 4.49Å; D82-V119 WeakPolarHBondContact OD1-CG1 3.49Å; D82-V119 VanDerWaalsContact OD1-CG2 3.29Å; D82-V119 WeakPolarHBondContact OD1-CG2 3.38Å; L115-V119 HydrophobicContact CB-CB 4.25Å; L115-V119 PolarHBondContact N-O 2.89Å; N117-V119 VanDerWaalsContact C-N 3.33Å; N117-V119 VanDerWaalsContact CG-CG2 3.43Å; N117-V119 VanDerWaalsContact ND2-CG2 3.33Å; N117-V119 WeakPolarHBondContact ND2-CG2 3.27Å; N117-V119 VanDerWaalsContact OD1-CB 3.28Å; N117-V119 WeakPolarHBondContact OD1-CB 3.39Å; N117-V119 WeakPolarHBondContact OD1-CG2 3.43Å; N117-V119 PolarHBondContact OD1-N 3.43Å |
| 120 | L | 90.7 | Very high | 85.5 | Confident | 1 Ų | 1 | 55.3 Ų | 55.3 | 1% | 0.005 | 29% | 0.287 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.3 | 119.1 | 172.3 | 178.7 | 68.4 | 0 | 0 | 0 | 110 | L80 I81 W95 L103 W112 L114 I122 Y133 | L80-L120 CarbonylContact C-O 3.54Å; L80-L120 WeakPolarHBondContact CA-O 3.21Å; I81-L120 HydrophobicContact CB-CB 4.28Å; I81-L120 HydrophobicContact CD1-CD2 4.32Å; I81-L120 PolarHBondContact N-O 3.35Å; I81-L120 PolarHBondContact O-N 2.97Å; W95-L120 HydrophobicContact CB-CD1 4.44Å; W95-L120 HydrophobicContact CB-CD2 4.39Å; W95-L120 HydrophobicContact CD2-CB 3.79Å; W95-L120 HydrophobicContact CD2-CD2 3.85Å; W95-L120 HydrophobicContact CD2-CG 4.33Å; W95-L120 HydrophobicContact CE3-CB 4.31Å; W95-L120 HydrophobicContact CE3-CD2 3.76Å; W95-L120 HydrophobicContact CG-CB 4.13Å; W95-L120 HydrophobicContact CG-CD1 4.32Å; W95-L120 HydrophobicContact CG-CD2 4.18Å; W95-L120 HydrophobicContact CG-CG 4.46Å; W95-L120 HydrophobicContact CH2-CB 4.42Å; W95-L120 HydrophobicContact CZ2-CB 3.87Å; W95-L120 HydrophobicContact CZ3-CD2 4.32Å; L103-L120 HydrophobicContact CD1-CD1 4.24Å; L103-L120 HydrophobicContact CD1-CD2 3.74Å; W112-L120 HydrophobicContact CB-CD1 4.35Å; W112-L120 HydrophobicContact CE3-CD1 4.1Å; W112-L120 HydrophobicContact CE3-CD2 4.04Å; W112-L120 HydrophobicContact CE3-CG 4.35Å; W112-L120 HydrophobicContact CZ3-CD2 4.2Å; L114-L120 HydrophobicContact CD1-CB 4.46Å; L114-L120 HydrophobicContact CD1-CD1 3.56Å; L120-I122 HydrophobicContact CD2-CG1 4.47Å; L120-I122 HydrophobicContact CG-CG1 4.33Å; L120-Y133 HydrophobicContact CD2-CD1 3.96Å; L120-Y133 HydrophobicContact CD2-CG 4.46Å |
| 121 | N | 90.8 | Very high | 86.4 | Confident | 22 Ų | 22 | 55.1 Ų | 55.1 | 12% | 0.118 | 29% | 0.285 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 123.9 | 173.8 | 178.2 | 16.9 | 0 | 0 | 0 | 110.8 | L80 W112 W113 L115 | L80-N121 HydrophobicContact CD2-CB 3.41Å; L80-N121 VanDerWaalsContact CD2-CB 3.41Å; L80-N121 VanDerWaalsContact CD2-CG 3.47Å; W112-N121 WeakPolarHBondContact CA-O 3.44Å; W113-N121 HydrophobicContact CB-CB 4.12Å; W113-N121 PolarHBondContact N-O 2.9Å; W113-N121 PolarHBondContact O-N 2.94Å; L115-N121 HydrophobicContact CD1-CB 3.87Å |
| 122 | I | 91.4 | Very high | 86.9 | Confident | 0 Ų | 0 | 59.3 Ų | 59.3 | 0% | 0 | 30% | 0.303 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 112.9 | 176.2 | -49.5 | 174 | 0 | 0 | 0 | 106.7 | C78 A79 I81 W112 L120 I125 L150 | C78-I122 CarbonylContact C-O 3.6Å; C78-I122 WeakPolarHBondContact CA-O 3.34Å; C78-I122 VanDerWaalsContact CB-O 3.25Å; C78-I122 WeakPolarHBondContact CB-O 3.39Å; A79-I122 PolarHBondContact N-O 3.24Å; A79-I122 PolarHBondContact O-N 2.96Å; I81-I122 HydrophobicContact CD1-CD1 4.07Å; W112-I122 HydrophobicContact CE3-CD1 4.15Å; W112-I122 HydrophobicContact CE3-CG1 3.76Å; W112-I122 HydrophobicContact CH2-CD1 4.24Å; W112-I122 HydrophobicContact CZ3-CD1 3.5Å; W112-I122 VanDerWaalsContact CZ3-CD1 3.5Å; W112-I122 HydrophobicContact CZ3-CG1 3.63Å; W112-I122 HydrophobicContact CZ3-CG2 4.38Å; L120-I122 HydrophobicContact CD2-CG1 4.47Å; L120-I122 HydrophobicContact CG-CG1 4.33Å; I122-I125 HydrophobicContact CB-CG1 4.21Å; I122-I125 HydrophobicContact CG2-CG1 3.75Å; I122-L150 HydrophobicContact CD1-CD2 3.8Å |
| 123 | T | 87.4 | Confident | 87.2 | Confident | 56 Ų | 56 | 58.6 Ų | 58.6 | 34% | 0.344 | 30% | 0.3 | S | S | . | . | S | Bend | trans | -83.2 | -35.8 | -169.2 | 47.2 | 0 | 0 | 0 | 0 | 114.2 | G110 K111 | G110-T123 PolarHBondContact O-OG1 2.99Å; K111-T123 PolarHBondContact O-N 3.41Å; K111-T123 VanDerWaalsContact O-N 3.13Å; K111-T123 PolarHBondContact O-OG1 3.1Å |
| 124 | S | 87.4 | Confident | 87.6 | Confident | 69 Ų | 69 | 54.3 Ų | 54.3 | 48% | 0.483 | 29% | 0.288 | S | S | . | . | S | Bend | trans | -133.6 | 89.6 | -178.8 | 177.8 | 0 | 0 | 0 | 0 | 109.7 | K111 E126 | K111-S124 VanDerWaalsContact CE-O 3.25Å; K111-S124 WeakPolarHBondContact CE-O 3.03Å; S124-E126 PolarHBondContact O-N 3.33Å |
| 125 | I | 90.5 | Very high | 87.9 | Confident | 1 Ų | 1 | 51.5 Ų | 51.5 | 1% | 0.005 | 27% | 0.273 | C | S | . | . | trans | -72.3 | 125.3 | -178.2 | -64.7 | 167 | 0 | 0 | 0 | 110.2 | A73 G76 S77 A79 I122 V152 | A73-I125 HydrophobicContact CB-CD1 3.36Å; G76-I125 PolarHBondContact N-O 3.46Å; S77-I125 WeakPolarHBondContact O-CB 3.17Å; S77-I125 WeakPolarHBondContact O-CD1 3.31Å; S77-I125 WeakPolarHBondContact O-CG1 3.17Å; S77-I125 PolarHBondContact O-N 2.93Å; A79-I125 HydrophobicContact CB-CD1 3.4Å; A79-I125 HydrophobicContact CB-CG1 4.48Å; I122-I125 HydrophobicContact CB-CG1 4.21Å; I122-I125 HydrophobicContact CG2-CG1 3.75Å; I125-V152 HydrophobicContact CG2-CB 4.23Å; I125-V152 HydrophobicContact CG2-CG1 3.78Å; I125-V152 HydrophobicContact CG2-CG2 3.41Å; I125-V152 VanDerWaalsContact CG2-CG2 3.41Å | ||
| 126 | E | 89 | Confident | 88.3 | Confident | 104 Ų | 104 | 50.8 Ų | 50.8 | 49% | 0.486 | 27% | 0.269 | S | S | . | . | trans | -107.9 | 157.5 | 172.4 | -171.1 | 172 | -177.9 | 0 | 0 | 109.9 | S124 S128 D129 | S124-E126 PolarHBondContact O-N 3.33Å; E126-S128 WeakPolarHBondContact CG-OG 3.33Å; E126-S128 PolarHBondContact O-N 2.97Å; E126-S128 VanDerWaalsContact O-N 3.11Å; E126-D129 PolarHBondContact N-OD2 3.49Å; E126-D129 WeakPolarHBondContact O-CB 3.44Å; E126-D129 PolarHBondContact O-N 2.92Å | ||
| 127 | F | 86.8 | Confident | 89.4 | Confident | 69 Ų | 69 | 42.2 Ų | 42.2 | 30% | 0.303 | 22% | 0.223 | S | C | . | . | G | 310 helix | trans | -57.9 | -26.8 | 176.6 | -171.5 | -117.1 | 0 | 0 | 0 | 113.7 | D129 R130 V152 F154 | F127-D129 VanDerWaalsContact C-N 3.26Å; F127-D129 PolarHBondContact O-N 3.04Å; F127-R130 WeakPolarHBondContact O-CD 3.43Å; F127-R130 VanDerWaalsContact O-CG 3.23Å; F127-R130 WeakPolarHBondContact O-CG 3.21Å; F127-R130 PolarHBondContact O-N 3.34Å; F127-R130 PolarHBondContact O-NH1 3.04Å; F127-V152 HydrophobicContact CD2-CB 4.31Å; F127-F154 HydrophobicContact CB-CE1 3.85Å; F127-F154 HydrophobicContact CB-CZ 3.6Å; F127-F154 HydrophobicContact CD1-CE2 4.13Å; F127-F154 AromaticContact CD1-CZ 3.59Å; F127-F154 HydrophobicContact CD1-CZ 3.59Å; F127-F154 HydrophobicContact CD2-CD2 4.23Å; F127-F154 HydrophobicContact CD2-CE1 4.05Å; F127-F154 AromaticContact CD2-CE2 3.33Å; F127-F154 HydrophobicContact CD2-CE2 3.33Å; F127-F154 AromaticContact CD2-CZ 3.23Å; F127-F154 HydrophobicContact CD2-CZ 3.23Å; F127-F154 HydrophobicContact CE1-CE2 4.1Å; F127-F154 AromaticContact CE1-CZ 4Å; F127-F154 HydrophobicContact CE1-CZ 4Å; F127-F154 HydrophobicContact CE2-CD2 4.21Å; F127-F154 AromaticContact CE2-CE2 3.31Å; F127-F154 HydrophobicContact CE2-CE2 3.31Å; F127-F154 AromaticContact CE2-CZ 3.7Å; F127-F154 HydrophobicContact CE2-CZ 3.7Å; F127-F154 AromaticContact CG-CE1 3.95Å; F127-F154 HydrophobicContact CG-CE1 3.95Å; F127-F154 AromaticContact CG-CE2 3.77Å; F127-F154 HydrophobicContact CG-CE2 3.77Å; F127-F154 AromaticContact CG-CZ 3.18Å; F127-F154 HydrophobicContact CG-CZ 3.18Å; F127-F154 AromaticContact CZ-CE2 3.72Å; F127-F154 HydrophobicContact CZ-CE2 3.72Å; F127-F154 HydrophobicContact CZ-CZ 4.06Å |
| 128 | S | 87.9 | Confident | 90.5 | Very high | 61 Ų | 61 | 39.4 Ų | 39.4 | 43% | 0.427 | 21% | 0.21 | S | C | . | . | G | 310 helix | trans | -66.7 | -24 | 173.6 | 52.7 | 0 | 0 | 0 | 0 | 113.6 | E126 R130 | E126-S128 WeakPolarHBondContact CG-OG 3.33Å; E126-S128 PolarHBondContact O-N 2.97Å; E126-S128 VanDerWaalsContact O-N 3.11Å; S128-R130 PolarHBondContact O-N 3.11Å |
| 129 | D | 89.2 | Confident | 91.1 | Very high | 13 Ų | 13 | 40 Ų | 40 | 7% | 0.07 | 21% | 0.21 | C | C | . | . | G | 310 helix | trans | -79.4 | -4 | -178.3 | -55 | -34.2 | 0 | 0 | 0 | 112.7 | K111 E126 F127 G131 Y133 | K111-D129 WeakPolarHBondContact CE-OD1 3.4Å; K111-D129 WeakPolarHBondContact CE-OD2 3.39Å; K111-D129 IonicContact NZ-OD1 2.66Å; K111-D129 PolarHBondContact NZ-OD1 3.15Å; K111-D129 IonicContact NZ-OD2 3.1Å; K111-D129 PolarHBondContact NZ-OD2 3.04Å; E126-D129 PolarHBondContact N-OD2 3.49Å; E126-D129 WeakPolarHBondContact O-CB 3.44Å; E126-D129 PolarHBondContact O-N 2.92Å; F127-D129 VanDerWaalsContact C-N 3.26Å; F127-D129 PolarHBondContact O-N 3.04Å; D129-G131 PolarHBondContact O-N 2.96Å; D129-Y133 WeakPolarHBondContact O-CE2 3.14Å; D129-Y133 PolarHBondContact O-OH 3.3Å |
| 130 | R | 92.1 | Very high | 91.3 | Very high | 122 Ų | 122 | 45.2 Ų | 45.2 | 46% | 0.46 | 24% | 0.242 | S | C | . | . | trans | -60.6 | 133.9 | 175.4 | 75.1 | -171.6 | -175.4 | -87.5 | 4.9 | 109.9 | F127 S128 L150 V152 | F127-R130 WeakPolarHBondContact O-CD 3.43Å; F127-R130 VanDerWaalsContact O-CG 3.23Å; F127-R130 WeakPolarHBondContact O-CG 3.21Å; F127-R130 PolarHBondContact O-N 3.34Å; F127-R130 PolarHBondContact O-NH1 3.04Å; S128-R130 PolarHBondContact O-N 3.11Å; R130-L150 WeakPolarHBondContact CA-O 3.32Å; R130-V152 HydrophobicContact CB-CB 4.37Å; R130-V152 HydrophobicContact CB-CG2 3.93Å | ||
| 131 | G | 93 | Very high | 91.4 | Very high | 19 Ų | 19 | 49.3 Ų | 49.3 | 20% | 0.196 | 26% | 0.261 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 155 | -167.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | D129 T149 L150 | D129-G131 PolarHBondContact O-N 2.96Å; G131-T149 CarbonylContact O-C 3.44Å; G131-T149 WeakPolarHBondContact O-CA 3.19Å; G131-L150 PolarHBondContact N-O 3.42Å; G131-L150 PolarHBondContact O-N 3.49Å |
| 132 | K | 94.6 | Very high | 91.4 | Very high | 133 Ų | 133 | 49.5 Ų | 49.5 | 58% | 0.578 | 27% | 0.268 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -95.2 | 120.9 | -179.8 | -67.3 | -177.5 | -178.5 | -176.8 | 0 | 109.5 | N97 S98 T147 V148 | N97-K132 CarbonylContact C-O 3.6Å; S98-K132 VanDerWaalsContact CA-O 3.25Å; S98-K132 WeakPolarHBondContact CA-O 3.3Å; S98-K132 PolarHBondContact N-O 3.33Å; K132-T147 HydrophobicContact CB-CG2 3.75Å; K132-T147 HydrophobicContact CD-CG2 4.22Å; K132-T147 HydrophobicContact CG-CG2 4.17Å; K132-V148 WeakPolarHBondContact CA-O 3.27Å |
| 133 | Y | 93.7 | Very high | 91.5 | Very high | 3 Ų | 3 | 54.2 Ų | 54.2 | 1% | 0.012 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.7 | 126.8 | 172.1 | -69.8 | -84.3 | 0 | 0 | 0 | 108.7 | I81 F96 N97 L103 W112 L120 D129 T147 V148 L150 | I81-Y133 HydrophobicContact CD1-CD2 3.87Å; I81-Y133 HydrophobicContact CD1-CG 3.87Å; F96-Y133 WeakPolarHBondContact O-CA 3.44Å; N97-Y133 HydrophobicContact CB-CD1 4.44Å; N97-Y133 HydrophobicContact CB-CE1 3.86Å; L103-Y133 HydrophobicContact CD1-CD1 3.88Å; L103-Y133 HydrophobicContact CD1-CE1 4Å; W112-Y133 HydrophobicContact CE3-CE1 4.29Å; W112-Y133 HydrophobicContact CH2-CD1 4.42Å; W112-Y133 AromaticContact CH2-CE1 3.28Å; W112-Y133 HydrophobicContact CH2-CE1 3.28Å; W112-Y133 AromaticContact CH2-CZ 3.53Å; W112-Y133 WeakPolarHBondContact CH2-OH 3.38Å; W112-Y133 HydrophobicContact CZ2-CE1 4.47Å; W112-Y133 AromaticContact CZ3-CD1 3.9Å; W112-Y133 HydrophobicContact CZ3-CD1 3.9Å; W112-Y133 AromaticContact CZ3-CE1 3.13Å; W112-Y133 HydrophobicContact CZ3-CE1 3.13Å; W112-Y133 AromaticContact CZ3-CZ 3.69Å; L120-Y133 HydrophobicContact CD2-CD1 3.96Å; L120-Y133 HydrophobicContact CD2-CG 4.46Å; D129-Y133 WeakPolarHBondContact O-CE2 3.14Å; D129-Y133 PolarHBondContact O-OH 3.3Å; Y133-T147 CarbonylContact O-C 3.54Å; Y133-T147 WeakPolarHBondContact O-CA 3.49Å; Y133-V148 PolarHBondContact N-O 3.41Å; Y133-V148 PolarHBondContact O-N 3Å; Y133-L150 HydrophobicContact CD2-CB 3.83Å; Y133-L150 HydrophobicContact CE2-CB 3.65Å; Y133-L150 HydrophobicContact CE2-CD2 3.81Å; Y133-L150 HydrophobicContact CE2-CG 4.39Å |
| 134 | T | 93.8 | Very high | 91.8 | Very high | 34 Ų | 34 | 52.6 Ų | 52.6 | 21% | 0.209 | 29% | 0.289 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114 | 120.7 | -178.9 | -59.4 | 0 | 0 | 0 | 0 | 109.2 | W95 F96 N145 G146 T147 | W95-T134 CarbonylContact C-O 3.55Å; F96-T134 PolarHBondContact N-O 2.87Å; F96-T134 PolarHBondContact O-N 3.27Å; T134-N145 HydrophobicContact CG2-CB 4.01Å; T134-G146 CarbonylContact C-O 3.59Å; T134-G146 VanDerWaalsContact CA-O 3.29Å; T134-G146 WeakPolarHBondContact CA-O 3.45Å; T134-T147 PolarHBondContact OG1-OG1 3.5Å |
| 135 | C | 93 | Very high | 92.1 | Very high | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 30% | 0.295 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 136.4 | 164.6 | 60.2 | 0 | 0 | 0 | 0 | 109.3 | V64 C83 V93 E94 W95 N145 G146 | V64-C135 WeakPolarHBondContact CG1-SG 3.37Å; C83-C135 HydrophobicContact CB-CB 3.66Å; C83-C135 WeakPolarHBondContact CB-SG 3.36Å; C83-C135 WeakPolarHBondContact SG-CB 3.32Å; C83-C135 CovalentContact SG-SG 2.05Å; C83-C135 PolarHBondContact SG-SG 2.85Å; V93-C135 HydrophobicContact CG1-CB 4.41Å; E94-C135 CarbonylContact O-C 3.58Å; E94-C135 WeakPolarHBondContact O-CA 3.13Å; W95-C135 HydrophobicContact CD2-CB 3.82Å; W95-C135 HydrophobicContact CE3-CB 3.93Å; W95-C135 HydrophobicContact CH2-CB 3.81Å; W95-C135 HydrophobicContact CZ2-CB 3.73Å; W95-C135 HydrophobicContact CZ3-CB 3.9Å; C135-N145 CarbonylContact O-C 3.52Å; C135-N145 WeakPolarHBondContact O-CA 3.26Å; C135-N145 WeakPolarHBondContact O-CB 3.39Å; C135-G146 PolarHBondContact N-O 3.33Å; C135-G146 PolarHBondContact O-N 2.88Å; C135-G146 PolarHBondContact SG-O 2.89Å |
| 136 | M | 93.1 | Very high | 92.2 | Very high | 57 Ų | 57 | 55 Ų | 55 | 28% | 0.281 | 30% | 0.299 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.7 | 121.4 | 177.2 | -170.4 | 169.6 | 73.6 | 0 | 0 | 108.2 | V93 E94 F96 A144 | V93-M136 WeakPolarHBondContact CA-O 3.25Å; E94-M136 PolarHBondContact N-O 3.39Å; E94-M136 PolarHBondContact O-N 3.45Å; E94-M136 VanDerWaalsContact OE2-CE 3.27Å; E94-M136 WeakPolarHBondContact OE2-CE 3.31Å; F96-M136 HydrophobicContact CD2-CB 4.23Å; F96-M136 HydrophobicContact CE2-CB 3.74Å; F96-M136 HydrophobicContact CE2-CE 3.6Å; F96-M136 HydrophobicContact CE2-SD 4.11Å; F96-M136 HydrophobicContact CZ-CE 3.62Å; F96-M136 HydrophobicContact CZ-SD 4.48Å; M136-A144 CarbonylContact C-O 3.48Å; M136-A144 WeakPolarHBondContact CA-O 3.36Å |
| 137 | A | 93.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.294 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.4 | 123.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | P62 V64 V85 P91 S92 T143 A144 | P62-A137 HydrophobicContact CB-CB 4.03Å; P62-A137 WeakPolarHBondContact CG-O 3.45Å; V64-A137 HydrophobicContact CG2-CB 3.7Å; V85-A137 HydrophobicContact CB-CB 4.4Å; V85-A137 HydrophobicContact CG1-CB 3.29Å; V85-A137 HydrophobicContact CG2-CB 4.22Å; P91-A137 HydrophobicContact CB-CB 4.15Å; P91-A137 HydrophobicContact CG-CB 4.45Å; S92-A137 CarbonylContact O-C 3.42Å; S92-A137 VanDerWaalsContact O-CA 3.32Å; S92-A137 WeakPolarHBondContact O-CA 3.25Å; A137-T143 CarbonylContact O-C 3.39Å; A137-T143 VanDerWaalsContact O-CA 3.26Å; A137-T143 WeakPolarHBondContact O-CA 3.31Å; A137-A144 PolarHBondContact N-O 2.88Å; A137-A144 PolarHBondContact O-N 2.76Å |
| 138 | T | 93.1 | Very high | 92.7 | Very high | 46 Ų | 46 | 49.8 Ų | 49.8 | 28% | 0.282 | 28% | 0.28 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.9 | 128.5 | -176.3 | -56.4 | 0 | 0 | 0 | 0 | 110.9 | P91 S92 T143 | P91-T138 WeakPolarHBondContact CA-O 3.47Å; S92-T138 PolarHBondContact N-O 3.38Å; S92-T138 PolarHBondContact O-N 3.29Å; S92-T138 PolarHBondContact OG-O 2.92Å; S92-T138 VanDerWaalsContact OG-O 3.06Å; T138-T143 HydrophobicContact CG2-CG2 3.78Å |
| 139 | N | 93.7 | Very high | 93 | Very high | 20 Ų | 20 | 48.9 Ų | 48.9 | 11% | 0.107 | 27% | 0.272 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.9 | 168.9 | 173 | -175.7 | 22 | 0 | 0 | 0 | 109.8 | P62 D88 P89 P91 H141 G142 | P62-N139 HydrophobicContact CG-CB 4.27Å; D88-N139 PolarHBondContact O-ND2 3.23Å; P89-N139 VanDerWaalsContact CD-ND2 3.32Å; P89-N139 WeakPolarHBondContact CD-ND2 3.32Å; P89-N139 PolarHBondContact O-ND2 3.43Å; P89-N139 PolarHBondContact O-OD1 2.9Å; P91-N139 HydrophobicContact CB-CB 4.13Å; N139-H141 PolarHBondContact O-N 3.46Å; N139-H141 VanDerWaalsContact O-N 3.08Å; N139-G142 PolarHBondContact N-O 3.31Å; N139-G142 PolarHBondContact O-N 3.02Å |
| 140 | V | 93.9 | Very high | 93.2 | Very high | 120 Ų | 120 | 48.3 Ų | 48.3 | 73% | 0.727 | 27% | 0.269 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | -25.7 | 178.9 | -57 | 0 | 0 | 0 | 0 | 113.5 | P89 | P89-V140 HydrophobicContact CG-CG2 4.31Š|
| 141 | H | 91.2 | Very high | 93.2 | Very high | 87 Ų | 87 | 49.1 Ų | 49.1 | 40% | 0.403 | 27% | 0.272 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.2 | -17.2 | 179.5 | -62 | -66.7 | 0 | 0 | 0 | 113.8 | V61 D88 N139 | V61-H141 HydrophobicContact CG1-CB 3.98Å; V61-H141 WeakPolarHBondContact CG1-O 3.45Å; D88-H141 PolarHBondContact O-CD2 3Å; N139-H141 PolarHBondContact O-N 3.46Å; N139-H141 VanDerWaalsContact O-N 3.08Å |
| 142 | G | 91.4 | Very high | 93.1 | Very high | 25 Ų | 25 | 48.9 Ų | 48.9 | 26% | 0.258 | 27% | 0.267 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 159.2 | -170.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | P62 N139 | P62-G142 WeakPolarHBondContact CD-O 3.47Å; P62-G142 VanDerWaalsContact CG-O 3.24Å; P62-G142 WeakPolarHBondContact CG-O 3.33Å; N139-G142 PolarHBondContact N-O 3.31Å; N139-G142 PolarHBondContact O-N 3.02Å |
| 143 | T | 93.9 | Very high | 92.7 | Very high | 99 Ų | 99 | 45.5 Ų | 45.5 | 61% | 0.607 | 26% | 0.257 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -129.4 | 141.6 | -176.4 | 54.7 | 0 | 0 | 0 | 0 | 111.3 | A137 T138 | A137-T143 CarbonylContact O-C 3.39Å; A137-T143 VanDerWaalsContact O-CA 3.26Å; A137-T143 WeakPolarHBondContact O-CA 3.31Å; T138-T143 HydrophobicContact CG2-CG2 3.78Å |
| 144 | A | 93.2 | Very high | 92 | Very high | 22 Ų | 22 | 49.1 Ų | 49.1 | 18% | 0.182 | 27% | 0.273 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.7 | 153.5 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | P62 V64 M136 A137 | P62-A144 HydrophobicContact CB-CB 4.45Å; P62-A144 HydrophobicContact CG-CB 4.33Å; P62-A144 WeakPolarHBondContact O-CB 3.48Å; V64-A144 HydrophobicContact CG2-CB 3.89Å; M136-A144 CarbonylContact C-O 3.48Å; M136-A144 WeakPolarHBondContact CA-O 3.36Å; A137-A144 PolarHBondContact N-O 2.88Å; A137-A144 PolarHBondContact O-N 2.76Å |
| 145 | N | 93.5 | Very high | 90.7 | Very high | 112 Ų | 112 | 50.3 Ų | 50.3 | 60% | 0.599 | 28% | 0.28 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -133.5 | 154.2 | 179.1 | 60.9 | 7.9 | 0 | 0 | 0 | 112.3 | T134 C135 | T134-N145 HydrophobicContact CG2-CB 4.01Å; C135-N145 CarbonylContact O-C 3.52Å; C135-N145 WeakPolarHBondContact O-CA 3.26Å; C135-N145 WeakPolarHBondContact O-CB 3.39Å |
| 146 | G | 92 | Very high | 89.6 | Confident | 10 Ų | 10 | 54 Ų | 54 | 10% | 0.103 | 30% | 0.3 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -140 | 137.7 | 174 | 0 | 0 | 0 | 0 | 0 | 109.9 | T134 C135 | T134-G146 CarbonylContact C-O 3.59Å; T134-G146 VanDerWaalsContact CA-O 3.29Å; T134-G146 WeakPolarHBondContact CA-O 3.45Å; C135-G146 PolarHBondContact N-O 3.33Å; C135-G146 PolarHBondContact O-N 2.88Å; C135-G146 PolarHBondContact SG-O 2.89Å |
| 147 | T | 93.3 | Very high | 88.2 | Confident | 62 Ų | 62 | 54.3 Ų | 54.3 | 38% | 0.38 | 32% | 0.318 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.5 | 133.8 | -176.6 | -55.9 | 0 | 0 | 0 | 0 | 110.8 | K132 Y133 T134 | K132-T147 HydrophobicContact CB-CG2 3.75Å; K132-T147 HydrophobicContact CD-CG2 4.22Å; K132-T147 HydrophobicContact CG-CG2 4.17Å; Y133-T147 CarbonylContact O-C 3.54Å; Y133-T147 WeakPolarHBondContact O-CA 3.49Å; T134-T147 PolarHBondContact OG1-OG1 3.5Å |
| 148 | V | 94.1 | Very high | 86.8 | Confident | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.1 | 136.2 | 174.1 | -174.8 | 0 | 0 | 0 | 0 | 109.3 | T66 V68 I71 I81 K132 Y133 | T66-V148 HydrophobicContact CG2-CG2 3.6Å; V68-V148 HydrophobicContact CG2-CG1 4.48Å; V68-V148 WeakPolarHBondContact O-CG2 3.45Å; I71-V148 HydrophobicContact CD1-CG1 3.85Å; I71-V148 HydrophobicContact CG1-CG1 4.03Å; I81-V148 HydrophobicContact CG2-CB 3.68Å; I81-V148 HydrophobicContact CG2-CG1 3.87Å; I81-V148 HydrophobicContact CG2-CG2 3.67Å; K132-V148 WeakPolarHBondContact CA-O 3.27Å; Y133-V148 PolarHBondContact N-O 3.41Å; Y133-V148 PolarHBondContact O-N 3Å |
| 149 | T | 94.4 | Very high | 85.9 | Confident | 42 Ų | 42 | 60.8 Ų | 60.8 | 26% | 0.258 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.5 | 117 | 178.4 | -56 | 0 | 0 | 0 | 0 | 110.6 | S69 Q70 I71 G131 | S69-T149 PolarHBondContact O-N 2.79Å; Q70-T149 CarbonylContact C-O 3.58Å; Q70-T149 VanDerWaalsContact CA-O 3.29Å; Q70-T149 WeakPolarHBondContact CA-O 3.43Å; I71-T149 PolarHBondContact N-O 2.89Å; G131-T149 CarbonylContact O-C 3.44Å; G131-T149 WeakPolarHBondContact O-CA 3.19Å |
| 150 | L | 93.8 | Very high | 85.1 | Confident | 2 Ų | 2 | 61.9 Ų | 61.9 | 1% | 0.01 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.2 | 118.6 | 170.3 | -175.4 | 65.4 | 0 | 0 | 0 | 109.9 | I71 A73 A79 I122 R130 G131 Y133 V152 | I71-L150 HydrophobicContact CB-CD1 4.18Å; I71-L150 HydrophobicContact CG2-CD1 3.98Å; A73-L150 HydrophobicContact CB-CD1 4.04Å; A79-L150 HydrophobicContact CB-CD1 4.24Å; I122-L150 HydrophobicContact CD1-CD2 3.8Å; R130-L150 WeakPolarHBondContact CA-O 3.32Å; G131-L150 PolarHBondContact N-O 3.42Å; G131-L150 PolarHBondContact O-N 3.49Å; Y133-L150 HydrophobicContact CD2-CB 3.83Å; Y133-L150 HydrophobicContact CE2-CB 3.65Å; Y133-L150 HydrophobicContact CE2-CD2 3.81Å; Y133-L150 HydrophobicContact CE2-CG 4.39Å; L150-V152 HydrophobicContact CD2-CG2 4.49Å; L150-V152 HydrophobicContact CG-CG2 4.38Å |
| 151 | R | 92.1 | Very high | 84.6 | Confident | 139 Ų | 139 | 60.2 Ų | 60.2 | 53% | 0.525 | 36% | 0.355 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 133.3 | 167.6 | -67 | -171.7 | -178.3 | -110.7 | 1.5 | 109.1 | Q70 I71 I72 A73 | Q70-R151 HydrophobicContact CG-CG 4.33Å; Q70-R151 VanDerWaalsContact NE2-CD 3.32Å; Q70-R151 VanDerWaalsContact NE2-NE 3.17Å; Q70-R151 VanDerWaalsContact OE1-NE 3.08Å; I71-R151 PolarHBondContact O-N 2.75Å; I72-R151 WeakPolarHBondContact CA-O 3.08Å; I72-R151 HydrophobicContact CG1-CB 4.22Å; A73-R151 PolarHBondContact N-O 2.81Å |
| 152 | V | 90.9 | Very high | 84.2 | Confident | 14 Ų | 14 | 62.9 Ų | 62.9 | 9% | 0.085 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.8 | 122.9 | 176.5 | -173.5 | 0 | 0 | 0 | 0 | 108.5 | A73 E75 I125 F127 R130 L150 | A73-V152 CarbonylContact O-C 3.48Å; A73-V152 VanDerWaalsContact O-CA 3.29Å; A73-V152 WeakPolarHBondContact O-CA 2.78Å; E75-V152 HydrophobicContact CB-CG1 4.09Å; I125-V152 HydrophobicContact CG2-CB 4.23Å; I125-V152 HydrophobicContact CG2-CG1 3.78Å; I125-V152 HydrophobicContact CG2-CG2 3.41Å; I125-V152 VanDerWaalsContact CG2-CG2 3.41Å; F127-V152 HydrophobicContact CD2-CB 4.31Å; R130-V152 HydrophobicContact CB-CB 4.37Å; R130-V152 HydrophobicContact CB-CG2 3.93Å; L150-V152 HydrophobicContact CD2-CG2 4.49Å; L150-V152 HydrophobicContact CG-CG2 4.38Å |
| 153 | V | 86.3 | Confident | 84 | Confident | 61 Ų | 61 | 67.9 Ų | 67.9 | 37% | 0.37 | 38% | 0.375 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 133.9 | 173.8 | -71.9 | 0 | 0 | 0 | 0 | 110 | I72 A73 R74 E75 T155 | I72-V153 HydrophobicContact CG2-CB 4.5Å; I72-V153 HydrophobicContact CG2-CG1 3.72Å; I72-V153 HydrophobicContact CG2-CG2 3.96Å; A73-V153 WeakPolarHBondContact O-CG2 3.46Å; A73-V153 PolarHBondContact O-N 3.25Å; R74-V153 WeakPolarHBondContact CA-O 3.47Å; R74-V153 HydrophobicContact CG-CG2 3.98Å; E75-V153 PolarHBondContact N-O 3.46Å; V153-T155 HydrophobicContact CG2-CG2 4.47Å; V153-T155 PolarHBondContact O-N 3.41Å |
| 154 | F | 78.4 | Confident | 83.7 | Confident | 80 Ų | 80 | 68.8 Ų | 68.8 | 35% | 0.351 | 37% | 0.373 | S | S | . | . | trans | -73.2 | 120 | 172.2 | -68.2 | -73.8 | 0 | 0 | 0 | 109.1 | E75 F127 M159 | E75-F154 WeakPolarHBondContact OE2-CD1 3.39Å; E75-F154 WeakPolarHBondContact OE2-CE1 3.46Å; F127-F154 HydrophobicContact CB-CE1 3.85Å; F127-F154 HydrophobicContact CB-CZ 3.6Å; F127-F154 HydrophobicContact CD1-CE2 4.13Å; F127-F154 AromaticContact CD1-CZ 3.59Å; F127-F154 HydrophobicContact CD1-CZ 3.59Å; F127-F154 HydrophobicContact CD2-CD2 4.23Å; F127-F154 HydrophobicContact CD2-CE1 4.05Å; F127-F154 AromaticContact CD2-CE2 3.33Å; F127-F154 HydrophobicContact CD2-CE2 3.33Å; F127-F154 AromaticContact CD2-CZ 3.23Å; F127-F154 HydrophobicContact CD2-CZ 3.23Å; F127-F154 HydrophobicContact CE1-CE2 4.1Å; F127-F154 AromaticContact CE1-CZ 4Å; F127-F154 HydrophobicContact CE1-CZ 4Å; F127-F154 HydrophobicContact CE2-CD2 4.21Å; F127-F154 AromaticContact CE2-CE2 3.31Å; F127-F154 HydrophobicContact CE2-CE2 3.31Å; F127-F154 AromaticContact CE2-CZ 3.7Å; F127-F154 HydrophobicContact CE2-CZ 3.7Å; F127-F154 AromaticContact CG-CE1 3.95Å; F127-F154 HydrophobicContact CG-CE1 3.95Å; F127-F154 AromaticContact CG-CE2 3.77Å; F127-F154 HydrophobicContact CG-CE2 3.77Å; F127-F154 AromaticContact CG-CZ 3.18Å; F127-F154 HydrophobicContact CG-CZ 3.18Å; F127-F154 AromaticContact CZ-CE2 3.72Å; F127-F154 HydrophobicContact CZ-CE2 3.72Å; F127-F154 HydrophobicContact CZ-CZ 4.06Å; F154-M159 HydrophobicContact CB-CG 4.26Å | ||
| 155 | T | 67.3 | Low | 83.5 | Confident | 59 Ų | 59 | 71.4 Ų | 71.4 | 36% | 0.362 | 39% | 0.387 | S | S | . | . | trans | -115.2 | 37.1 | 167.5 | 64.3 | 0 | 0 | 0 | 0 | 111 | R74 V153 G157 | R74-T155 HydrophobicContact CB-CG2 4.03Å; R74-T155 VanDerWaalsContact CD-CG2 3.46Å; R74-T155 HydrophobicContact CG-CG2 3.54Å; V153-T155 HydrophobicContact CG2-CG2 4.47Å; V153-T155 PolarHBondContact O-N 3.41Å; T155-G157 PolarHBondContact O-N 2.91Å | ||
| 156 | N | 68.9 | Low | 83.4 | Confident | 78 Ų | 78 | 68.9 Ų | 68.9 | 42% | 0.417 | 38% | 0.375 | S | S | . | . | trans | -63.9 | 109.2 | 157.3 | -62.1 | -53.5 | 0 | 0 | 0 | 104.6 | E75 D158 M159 | E75-N156 PolarHBondContact OE2-ND2 2.85Å; N156-D158 PolarHBondContact O-N 2.99Å; N156-M159 HydrophobicContact CB-CG 4.13Å; N156-M159 PolarHBondContact O-N 3.28Å | ||
| 157 | G | 64.4 | Low | 83.5 | Confident | 63 Ų | 63 | 70.9 Ų | 70.9 | 65% | 0.649 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -50.3 | -19.8 | 173 | 0 | 0 | 0 | 0 | 0 | 112 | T155 | T155-G157 PolarHBondContact O-N 2.91Å |
| 158 | D | 62.9 | Low | 83.5 | Confident | 117 Ų | 117 | 73.4 Ų | 73.4 | 63% | 0.626 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -75.1 | -19.1 | 176 | -53.4 | -33.9 | 0 | 0 | 0 | 115.1 | N156 V161 Y162 | N156-D158 PolarHBondContact O-N 2.99Å; D158-V161 CarbonylContact O-C 3.51Å; D158-V161 PolarHBondContact O-N 3.29Å; D158-Y162 WeakPolarHBondContact O-CB 3.16Å; D158-Y162 PolarHBondContact O-N 2.89Å |
| 159 | M | 74.7 | Confident | 83.7 | Confident | 65 Ų | 65 | 76.9 Ų | 76.9 | 32% | 0.32 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -66.6 | -42.9 | 175.4 | -73.3 | -64.2 | -72.6 | 0 | 0 | 110.2 | F154 N156 Y162 Y163 | F154-M159 HydrophobicContact CB-CG 4.26Å; N156-M159 HydrophobicContact CB-CG 4.13Å; N156-M159 PolarHBondContact O-N 3.28Å; M159-Y162 WeakPolarHBondContact O-CB 3.38Å; M159-Y162 PolarHBondContact O-N 2.69Å; M159-Y163 HydrophobicContact CB-CE2 4.35Å; M159-Y163 HydrophobicContact CE-CE2 3.88Å; M159-Y163 WeakPolarHBondContact O-CD2 3.35Å; M159-Y163 PolarHBondContact O-N 3.17Å |
| 160 | G | 77 | Confident | 83.7 | Confident | 43 Ų | 43 | 77.9 Ų | 77.9 | 44% | 0.443 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -60.8 | -45.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y162 Y163 M164 | G160-Y162 VanDerWaalsContact C-N 3.33Å; G160-Y162 PolarHBondContact O-N 3.18Å; G160-Y163 PolarHBondContact O-N 3.33Å; G160-M164 WeakPolarHBondContact O-CB 3.37Å; G160-M164 VanDerWaalsContact O-CG 3.27Å; G160-M164 WeakPolarHBondContact O-CG 3.44Å; G160-M164 PolarHBondContact O-N 2.92Å |
| 161 | V | 82.1 | Confident | 83.9 | Confident | 84 Ų | 84 | 84.1 Ų | 84.1 | 51% | 0.509 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -62.7 | -40.3 | 176.2 | -179.5 | 0 | 0 | 0 | 0 | 111.4 | D158 M164 V165 | D158-V161 CarbonylContact O-C 3.51Å; D158-V161 PolarHBondContact O-N 3.29Å; V161-M164 PolarHBondContact O-N 3.44Å; V161-V165 HydrophobicContact CG1-CG2 4.27Å; V161-V165 WeakPolarHBondContact O-CB 3.37Å; V161-V165 VanDerWaalsContact O-CG2 3.26Å; V161-V165 WeakPolarHBondContact O-CG2 3.47Å; V161-V165 PolarHBondContact O-N 3.05Å |
| 162 | Y | 84.6 | Confident | 84.1 | Confident | 143 Ų | 143 | 80.7 Ų | 80.7 | 56% | 0.561 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -61.2 | -49.5 | 176.6 | 175.2 | -96.6 | 0 | 0 | 0 | 110.9 | D158 M159 G160 M164 V165 V166 | D158-Y162 WeakPolarHBondContact O-CB 3.16Å; D158-Y162 PolarHBondContact O-N 2.89Å; M159-Y162 WeakPolarHBondContact O-CB 3.38Å; M159-Y162 PolarHBondContact O-N 2.69Å; G160-Y162 VanDerWaalsContact C-N 3.33Å; G160-Y162 PolarHBondContact O-N 3.18Å; Y162-M164 VanDerWaalsContact C-N 3.33Å; Y162-M164 PolarHBondContact O-N 3.32Å; Y162-V165 PolarHBondContact O-N 2.84Å; Y162-V166 HydrophobicContact CD1-CG2 4.23Å; Y162-V166 HydrophobicContact CD2-CG2 4.42Å; Y162-V166 HydrophobicContact CE1-CG2 3.86Å; Y162-V166 HydrophobicContact CE2-CG2 4.07Å; Y162-V166 HydrophobicContact CG-CG2 4.49Å; Y162-V166 WeakPolarHBondContact O-CB 3.26Å; Y162-V166 VanDerWaalsContact O-CG2 3.25Å; Y162-V166 WeakPolarHBondContact O-CG2 3.28Å; Y162-V166 PolarHBondContact O-N 2.93Å |
| 163 | Y | 85.3 | Confident | 84.4 | Confident | 130 Ų | 130 | 84.2 Ų | 84.2 | 51% | 0.51 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.9 | -39.4 | 176.1 | -68.2 | -62.7 | 0 | 0 | 0 | 111.8 | M159 G160 V166 C167 | M159-Y163 HydrophobicContact CB-CE2 4.35Å; M159-Y163 HydrophobicContact CE-CE2 3.88Å; M159-Y163 WeakPolarHBondContact O-CD2 3.35Å; M159-Y163 PolarHBondContact O-N 3.17Å; G160-Y163 PolarHBondContact O-N 3.33Å; Y163-V166 PolarHBondContact O-N 3.49Å; Y163-C167 WeakPolarHBondContact O-CB 3.24Å; Y163-C167 PolarHBondContact O-N 3.44Å; Y163-C167 PolarHBondContact O-SG 3.15Å |
| 164 | M | 87.9 | Confident | 84.7 | Confident | 118 Ų | 118 | 85.5 Ų | 85.5 | 58% | 0.581 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -61.3 | -46 | 173.9 | -71.8 | -63.7 | 100 | 0 | 0 | 112.3 | G160 V161 Y162 C167 L168 | G160-M164 WeakPolarHBondContact O-CB 3.37Å; G160-M164 VanDerWaalsContact O-CG 3.27Å; G160-M164 WeakPolarHBondContact O-CG 3.44Å; G160-M164 PolarHBondContact O-N 2.92Å; V161-M164 PolarHBondContact O-N 3.44Å; Y162-M164 VanDerWaalsContact C-N 3.33Å; Y162-M164 PolarHBondContact O-N 3.32Å; M164-C167 PolarHBondContact O-N 2.86Å; M164-L168 VanDerWaalsContact O-CG 3.28Å; M164-L168 WeakPolarHBondContact O-CG 3.44Å; M164-L168 PolarHBondContact O-N 2.87Å |
| 165 | V | 89.5 | Confident | 85.4 | Confident | 78 Ų | 78 | 86.7 Ų | 86.7 | 47% | 0.473 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.2 | -45 | 177.1 | 171.5 | 0 | 0 | 0 | 0 | 110.7 | V161 Y162 C167 L168 V169 | V161-V165 HydrophobicContact CG1-CG2 4.27Å; V161-V165 WeakPolarHBondContact O-CB 3.37Å; V161-V165 VanDerWaalsContact O-CG2 3.26Å; V161-V165 WeakPolarHBondContact O-CG2 3.47Å; V161-V165 PolarHBondContact O-N 3.05Å; Y162-V165 PolarHBondContact O-N 2.84Å; V165-C167 VanDerWaalsContact C-N 3.34Å; V165-C167 PolarHBondContact O-N 2.91Å; V165-L168 PolarHBondContact O-N 2.93Å; V165-V169 HydrophobicContact CG1-CG2 4.33Å; V165-V169 WeakPolarHBondContact O-CB 3.33Å; V165-V169 VanDerWaalsContact O-CG2 3.27Å; V165-V169 WeakPolarHBondContact O-CG2 3.3Å; V165-V169 PolarHBondContact O-N 3.45Å |
| 166 | V | 92.6 | Very high | 86.6 | Confident | 58 Ų | 58 | 88.5 Ų | 88.5 | 35% | 0.352 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.3 | -42.4 | 176.3 | 171.7 | 0 | 0 | 0 | 0 | 111.1 | Y162 Y163 V169 T170 | Y162-V166 HydrophobicContact CD1-CG2 4.23Å; Y162-V166 HydrophobicContact CD2-CG2 4.42Å; Y162-V166 HydrophobicContact CE1-CG2 3.86Å; Y162-V166 HydrophobicContact CE2-CG2 4.07Å; Y162-V166 HydrophobicContact CG-CG2 4.49Å; Y162-V166 WeakPolarHBondContact O-CB 3.26Å; Y162-V166 VanDerWaalsContact O-CG2 3.25Å; Y162-V166 WeakPolarHBondContact O-CG2 3.28Å; Y162-V166 PolarHBondContact O-N 2.93Å; Y163-V166 PolarHBondContact O-N 3.49Å; V166-V169 PolarHBondContact O-N 3.47Å; V166-T170 HydrophobicContact CG1-CG2 4.43Å; V166-T170 WeakPolarHBondContact O-CB 3.37Å; V166-T170 VanDerWaalsContact O-CG2 3.29Å; V166-T170 WeakPolarHBondContact O-CG2 3.44Å; V166-T170 PolarHBondContact O-N 3.22Å; V166-T170 PolarHBondContact O-OG1 3.35Å |
| 167 | C | 92.5 | Very high | 87.6 | Confident | 52 Ų | 52 | 90 Ų | 90 | 35% | 0.351 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.8 | -48.3 | 173.7 | -74.7 | 0 | 0 | 0 | 0 | 111.3 | Y163 M164 V165 V169 T170 F171 | Y163-C167 WeakPolarHBondContact O-CB 3.24Å; Y163-C167 PolarHBondContact O-N 3.44Å; Y163-C167 PolarHBondContact O-SG 3.15Å; M164-C167 PolarHBondContact O-N 2.86Å; V165-C167 VanDerWaalsContact C-N 3.34Å; V165-C167 PolarHBondContact O-N 2.91Å; C167-V169 VanDerWaalsContact C-N 3.34Å; C167-V169 PolarHBondContact O-N 2.74Å; C167-T170 WeakPolarHBondContact CA-OG1 3.43Å; C167-T170 PolarHBondContact O-N 3.41Å; C167-T170 PolarHBondContact O-OG1 3.33Å; C167-F171 HydrophobicContact CB-CD2 4.37Å; C167-F171 HydrophobicContact CB-CE2 4.34Å; C167-F171 WeakPolarHBondContact O-CB 3.41Å; C167-F171 WeakPolarHBondContact O-CD2 3.44Å; C167-F171 PolarHBondContact O-N 3.4Å |
| 168 | L | 94.9 | Very high | 88.7 | Confident | 115 Ų | 115 | 91.1 Ų | 91.1 | 60% | 0.602 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61.1 | -42.3 | 178.2 | -70.6 | 172.6 | 0 | 0 | 0 | 112.2 | M164 V165 T172 | M164-L168 VanDerWaalsContact O-CG 3.28Å; M164-L168 WeakPolarHBondContact O-CG 3.44Å; M164-L168 PolarHBondContact O-N 2.87Å; V165-L168 PolarHBondContact O-N 2.93Å; L168-T172 WeakPolarHBondContact O-CB 3.34Å; L168-T172 VanDerWaalsContact O-CG2 3.24Å; L168-T172 WeakPolarHBondContact O-CG2 3.47Å; L168-T172 PolarHBondContact O-N 3.4Å; L168-T172 PolarHBondContact O-OG1 2.91Å |
| 169 | V | 96.9 | Very high | 90.2 | Very high | 73 Ų | 73 | 89.6 Ų | 89.6 | 44% | 0.442 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.6 | -43.2 | 176.5 | 172.8 | 0 | 0 | 0 | 0 | 111 | V165 V166 C167 T172 I173 | V165-V169 HydrophobicContact CG1-CG2 4.33Å; V165-V169 WeakPolarHBondContact O-CB 3.33Å; V165-V169 VanDerWaalsContact O-CG2 3.27Å; V165-V169 WeakPolarHBondContact O-CG2 3.3Å; V165-V169 PolarHBondContact O-N 3.45Å; V166-V169 PolarHBondContact O-N 3.47Å; C167-V169 VanDerWaalsContact C-N 3.34Å; C167-V169 PolarHBondContact O-N 2.74Å; V169-T172 WeakPolarHBondContact CA-OG1 3.5Å; V169-T172 PolarHBondContact O-N 2.85Å; V169-T172 PolarHBondContact O-OG1 2.89Å; V169-I173 HydrophobicContact CG1-CD1 3.86Å; V169-I173 WeakPolarHBondContact O-CD1 3.47Å; V169-I173 VanDerWaalsContact O-CG1 3.23Å; V169-I173 WeakPolarHBondContact O-CG1 3.28Å; V169-I173 PolarHBondContact O-N 3.28Å |
| 170 | T | 95.5 | Very high | 90.9 | Very high | 64 Ų | 64 | 89.8 Ų | 89.8 | 39% | 0.393 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -67.1 | -43.3 | 177.7 | 52.1 | 0 | 0 | 0 | 0 | 112 | V166 C167 T172 I173 I174 | V166-T170 HydrophobicContact CG1-CG2 4.43Å; V166-T170 WeakPolarHBondContact O-CB 3.37Å; V166-T170 VanDerWaalsContact O-CG2 3.29Å; V166-T170 WeakPolarHBondContact O-CG2 3.44Å; V166-T170 PolarHBondContact O-N 3.22Å; V166-T170 PolarHBondContact O-OG1 3.35Å; C167-T170 WeakPolarHBondContact CA-OG1 3.43Å; C167-T170 PolarHBondContact O-N 3.41Å; C167-T170 PolarHBondContact O-OG1 3.33Å; T170-T172 PolarHBondContact O-N 3.3Å; T170-I173 PolarHBondContact O-N 3.49Å; T170-I174 VanDerWaalsContact O-CG1 3.25Å; T170-I174 WeakPolarHBondContact O-CG1 3.06Å; T170-I174 PolarHBondContact O-N 3.34Å |
| 171 | F | 96.8 | Very high | 91.3 | Very high | 133 Ų | 133 | 97.1 Ų | 97.1 | 58% | 0.583 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.3 | -43.2 | 174.8 | -81.4 | -62.1 | 0 | 0 | 0 | 112.5 | C167 I174 M175 | C167-F171 HydrophobicContact CB-CD2 4.37Å; C167-F171 HydrophobicContact CB-CE2 4.34Å; C167-F171 WeakPolarHBondContact O-CB 3.41Å; C167-F171 WeakPolarHBondContact O-CD2 3.44Å; C167-F171 PolarHBondContact O-N 3.4Å; F171-I174 PolarHBondContact O-N 2.81Å; F171-M175 WeakPolarHBondContact O-CB 3.47Å; F171-M175 PolarHBondContact O-N 3.26Å |
| 172 | T | 96.6 | Very high | 91.4 | Very high | 66 Ų | 66 | 99 Ų | 99 | 41% | 0.405 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.3 | -40.9 | 177.6 | 51.3 | 0 | 0 | 0 | 0 | 112 | L168 V169 T170 M175 I176 | L168-T172 WeakPolarHBondContact O-CB 3.34Å; L168-T172 VanDerWaalsContact O-CG2 3.24Å; L168-T172 WeakPolarHBondContact O-CG2 3.47Å; L168-T172 PolarHBondContact O-N 3.4Å; L168-T172 PolarHBondContact O-OG1 2.91Å; V169-T172 WeakPolarHBondContact CA-OG1 3.5Å; V169-T172 PolarHBondContact O-N 2.85Å; V169-T172 PolarHBondContact O-OG1 2.89Å; T170-T172 PolarHBondContact O-N 3.3Å; T172-M175 PolarHBondContact O-N 2.68Å; T172-I176 VanDerWaalsContact O-CG1 3.26Å; T172-I176 WeakPolarHBondContact O-CG1 3.23Å; T172-I176 PolarHBondContact O-N 2.96Å |
| 173 | I | 96.4 | Very high | 91.3 | Very high | 88 Ų | 88 | 95.3 Ų | 95.3 | 45% | 0.451 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.6 | -48.2 | 173.4 | -68.8 | 165.8 | 0 | 0 | 0 | 110.4 | V169 T170 M175 I176 L177 | V169-I173 HydrophobicContact CG1-CD1 3.86Å; V169-I173 WeakPolarHBondContact O-CD1 3.47Å; V169-I173 VanDerWaalsContact O-CG1 3.23Å; V169-I173 WeakPolarHBondContact O-CG1 3.28Å; V169-I173 PolarHBondContact O-N 3.28Å; T170-I173 PolarHBondContact O-N 3.49Å; I173-M175 VanDerWaalsContact C-N 3.32Å; I173-M175 PolarHBondContact O-N 3.4Å; I173-I176 PolarHBondContact O-N 3.06Å; I173-L177 HydrophobicContact CG2-CD1 3.92Å; I173-L177 HydrophobicContact CG2-CG 4.28Å; I173-L177 WeakPolarHBondContact O-CB 3.46Å; I173-L177 VanDerWaalsContact O-CG 3.28Å; I173-L177 WeakPolarHBondContact O-CG 3.26Å; I173-L177 PolarHBondContact O-N 3.46Å |
| 174 | I | 93.5 | Very high | 90.9 | Very high | 88 Ų | 88 | 95 Ų | 95 | 45% | 0.451 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60 | -43.8 | 178.4 | -68.2 | 164.8 | 0 | 0 | 0 | 110.8 | T170 F171 I176 L177 N178 | T170-I174 VanDerWaalsContact O-CG1 3.25Å; T170-I174 WeakPolarHBondContact O-CG1 3.06Å; T170-I174 PolarHBondContact O-N 3.34Å; F171-I174 PolarHBondContact O-N 2.81Å; I174-I176 PolarHBondContact O-N 3.25Å; I174-L177 PolarHBondContact O-N 3.41Å; I174-N178 WeakPolarHBondContact CG2-ND2 3.27Å; I174-N178 WeakPolarHBondContact O-CB 3.46Å; I174-N178 PolarHBondContact O-N 3.19Å; I174-N178 PolarHBondContact O-ND2 3.12Å |
| 175 | M | 93.3 | Very high | 90.6 | Very high | 106 Ų | 106 | 94.4 Ų | 94.4 | 52% | 0.522 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.6 | -47 | 176.1 | -175.6 | -173.5 | 70.3 | 0 | 0 | 111.4 | F171 T172 I173 L177 N178 I179 | F171-M175 WeakPolarHBondContact O-CB 3.47Å; F171-M175 PolarHBondContact O-N 3.26Å; T172-M175 PolarHBondContact O-N 2.68Å; I173-M175 VanDerWaalsContact C-N 3.32Å; I173-M175 PolarHBondContact O-N 3.4Å; M175-L177 PolarHBondContact O-N 2.93Å; M175-N178 PolarHBondContact O-N 3.36Å; M175-I179 HydrophobicContact CG-CD1 3.84Å; M175-I179 HydrophobicContact CG-CG1 4.49Å; M175-I179 VanDerWaalsContact O-CG1 3.25Å; M175-I179 WeakPolarHBondContact O-CG1 3.49Å; M175-I179 PolarHBondContact O-N 3.28Å |
| 176 | I | 93.3 | Very high | 89.9 | Confident | 96 Ų | 96 | 93.1 Ų | 93.1 | 49% | 0.492 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.6 | -43.6 | 177.9 | -68.7 | 165.5 | 0 | 0 | 0 | 110.9 | T172 I173 I174 N178 I179 T180 | T172-I176 VanDerWaalsContact O-CG1 3.26Å; T172-I176 WeakPolarHBondContact O-CG1 3.23Å; T172-I176 PolarHBondContact O-N 2.96Å; I173-I176 PolarHBondContact O-N 3.06Å; I174-I176 PolarHBondContact O-N 3.25Å; I176-N178 VanDerWaalsContact C-N 3.33Å; I176-N178 PolarHBondContact O-N 3.42Å; I176-I179 PolarHBondContact O-N 3.33Å; I176-T180 WeakPolarHBondContact O-CB 3.48Å; I176-T180 PolarHBondContact O-N 3.29Å; I176-T180 PolarHBondContact O-OG1 2.98Å |
| 177 | L | 89.6 | Confident | 89.3 | Confident | 109 Ų | 109 | 92.5 Ų | 92.5 | 57% | 0.571 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.2 | -41.6 | 177.1 | -69.8 | 175.6 | 0 | 0 | 0 | 111.5 | I173 I174 M175 T180 R181 | I173-L177 HydrophobicContact CG2-CD1 3.92Å; I173-L177 HydrophobicContact CG2-CG 4.28Å; I173-L177 WeakPolarHBondContact O-CB 3.46Å; I173-L177 VanDerWaalsContact O-CG 3.28Å; I173-L177 WeakPolarHBondContact O-CG 3.26Å; I173-L177 PolarHBondContact O-N 3.46Å; I174-L177 PolarHBondContact O-N 3.41Å; M175-L177 PolarHBondContact O-N 2.93Å; L177-T180 PolarHBondContact O-N 3.31Å; L177-R181 WeakPolarHBondContact O-CB 3.27Å; L177-R181 PolarHBondContact O-N 3.2Å |
| 178 | N | 86.8 | Confident | 88.2 | Confident | 88 Ų | 88 | 95.3 Ų | 95.3 | 47% | 0.471 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.9 | -45.5 | 176.4 | -79.1 | -36 | 0 | 0 | 0 | 112.3 | I174 M175 I176 T180 R181 L182 | I174-N178 WeakPolarHBondContact CG2-ND2 3.27Å; I174-N178 WeakPolarHBondContact O-CB 3.46Å; I174-N178 PolarHBondContact O-N 3.19Å; I174-N178 PolarHBondContact O-ND2 3.12Å; M175-N178 PolarHBondContact O-N 3.36Å; I176-N178 VanDerWaalsContact C-N 3.33Å; I176-N178 PolarHBondContact O-N 3.42Å; N178-T180 VanDerWaalsContact C-N 3.32Å; N178-T180 PolarHBondContact O-N 3.01Å; N178-R181 PolarHBondContact O-N 3.41Å; N178-L182 WeakPolarHBondContact O-CG 3.44Å; N178-L182 PolarHBondContact O-N 3.46Å |
| 179 | I | 93.4 | Very high | 86.8 | Confident | 84 Ų | 84 | 94.4 Ų | 94.4 | 43% | 0.431 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59.4 | -46.2 | 174.3 | -67.7 | 165.1 | 0 | 0 | 0 | 109.8 | M175 I176 R181 L182 C183 | M175-I179 HydrophobicContact CG-CD1 3.84Å; M175-I179 HydrophobicContact CG-CG1 4.49Å; M175-I179 VanDerWaalsContact O-CG1 3.25Å; M175-I179 WeakPolarHBondContact O-CG1 3.49Å; M175-I179 PolarHBondContact O-N 3.28Å; I176-I179 PolarHBondContact O-N 3.33Å; I179-R181 VanDerWaalsContact C-N 3.34Å; I179-R181 PolarHBondContact O-N 3.13Å; I179-L182 PolarHBondContact O-N 2.94Å; I179-C183 WeakPolarHBondContact O-CB 3.29Å; I179-C183 PolarHBondContact O-N 3.49Å; I179-C183 PolarHBondContact O-SG 2.81Å |
| 180 | T | 90.1 | Very high | 85.5 | Confident | 70 Ų | 70 | 97.8 Ų | 97.8 | 43% | 0.429 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.1 | -41.8 | 179.9 | -56.1 | 0 | 0 | 0 | 0 | 111.6 | I176 L177 N178 C183 M184 | I176-T180 WeakPolarHBondContact O-CB 3.48Å; I176-T180 PolarHBondContact O-N 3.29Å; I176-T180 PolarHBondContact O-OG1 2.98Å; L177-T180 PolarHBondContact O-N 3.31Å; N178-T180 VanDerWaalsContact C-N 3.32Å; N178-T180 PolarHBondContact O-N 3.01Å; T180-C183 PolarHBondContact O-N 3Å; T180-M184 WeakPolarHBondContact O-CB 3.34Å; T180-M184 VanDerWaalsContact O-CG 3.3Å; T180-M184 WeakPolarHBondContact O-CG 3.07Å; T180-M184 PolarHBondContact O-N 3.44Å |
| 181 | R | 85.9 | Confident | 84.7 | Confident | 196 Ų | 196 | 101.8 Ų | 101.8 | 74% | 0.74 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.1 | -44.5 | 174.6 | 178 | 179.6 | -91.1 | -139 | -1.6 | 111.6 | L177 N178 I179 M184 M185 | L177-R181 WeakPolarHBondContact O-CB 3.27Å; L177-R181 PolarHBondContact O-N 3.2Å; N178-R181 PolarHBondContact O-N 3.41Å; I179-R181 VanDerWaalsContact C-N 3.34Å; I179-R181 PolarHBondContact O-N 3.13Å; R181-M184 PolarHBondContact O-N 3.09Å; R181-M185 WeakPolarHBondContact O-CB 3.25Å; R181-M185 PolarHBondContact O-N 3.39Å |
| 182 | L | 84.6 | Confident | 83.4 | Confident | 123 Ų | 123 | 98 Ų | 98 | 64% | 0.644 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.9 | -42.2 | 175.6 | -72.6 | 170.9 | 0 | 0 | 0 | 111.6 | N178 I179 M185 S186 | N178-L182 WeakPolarHBondContact O-CG 3.44Å; N178-L182 PolarHBondContact O-N 3.46Å; I179-L182 PolarHBondContact O-N 2.94Å; L182-M185 PolarHBondContact O-N 2.88Å; L182-S186 VanDerWaalsContact O-CB 3.31Å; L182-S186 WeakPolarHBondContact O-CB 3.28Å; L182-S186 PolarHBondContact O-N 3.35Å; L182-S186 PolarHBondContact O-OG 2.82Å |
| 183 | C | 81.9 | Confident | 82.2 | Confident | 66 Ų | 66 | 101.1 Ų | 101.1 | 45% | 0.446 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.3 | -45.5 | 176.3 | -69.7 | 0 | 0 | 0 | 0 | 111.5 | I179 T180 M185 S186 S187 | I179-C183 WeakPolarHBondContact O-CB 3.29Å; I179-C183 PolarHBondContact O-N 3.49Å; I179-C183 PolarHBondContact O-SG 2.81Å; T180-C183 PolarHBondContact O-N 3Å; C183-M185 PolarHBondContact O-N 3.47Å; C183-S186 WeakPolarHBondContact CA-OG 3.38Å; C183-S186 PolarHBondContact O-N 2.79Å; C183-S186 PolarHBondContact O-OG 3.48Å; C183-S187 WeakPolarHBondContact O-CB 3.47Å; C183-S187 PolarHBondContact O-N 3.48Å |
| 184 | M | 77.6 | Confident | 81.2 | Confident | 125 Ų | 125 | 104.3 Ų | 104.3 | 62% | 0.616 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.2 | -45.5 | 175.3 | -74 | -70.8 | 135.1 | 0 | 0 | 111.4 | T180 R181 S187 H188 | T180-M184 WeakPolarHBondContact O-CB 3.34Å; T180-M184 VanDerWaalsContact O-CG 3.3Å; T180-M184 WeakPolarHBondContact O-CG 3.07Å; T180-M184 PolarHBondContact O-N 3.44Å; R181-M184 PolarHBondContact O-N 3.09Å; M184-S187 WeakPolarHBondContact O-CB 3.5Å; M184-S187 PolarHBondContact O-N 2.91Å; M184-S187 PolarHBondContact O-OG 3.35Å; M184-H188 PolarHBondContact O-N 2.71Å; M184-H188 VanDerWaalsContact O-N 3.12Å |
| 185 | M | 80 | Confident | 80.3 | Confident | 105 Ų | 105 | 103 Ų | 103 | 52% | 0.517 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.1 | -45.5 | 176.6 | -171.3 | 60.2 | 161 | 0 | 0 | 112 | R181 L182 C183 S187 H188 L189 | R181-M185 WeakPolarHBondContact O-CB 3.25Å; R181-M185 PolarHBondContact O-N 3.39Å; L182-M185 PolarHBondContact O-N 2.88Å; C183-M185 PolarHBondContact O-N 3.47Å; M185-S187 PolarHBondContact O-N 3.27Å; M185-H188 WeakPolarHBondContact O-CB 3.45Å; M185-H188 PolarHBondContact O-N 3.46Å; M185-L189 HydrophobicContact CG-CD1 4.5Å; M185-L189 WeakPolarHBondContact O-CG 3.38Å; M185-L189 PolarHBondContact O-N 2.85Å |
| 186 | S | 74.9 | Confident | 79.1 | Confident | 50 Ų | 50 | 102.5 Ų | 102.5 | 35% | 0.35 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.9 | -33.2 | 176.1 | 77.7 | 0 | 0 | 0 | 0 | 112.2 | L182 C183 L189 K190 | L182-S186 VanDerWaalsContact O-CB 3.31Å; L182-S186 WeakPolarHBondContact O-CB 3.28Å; L182-S186 PolarHBondContact O-N 3.35Å; L182-S186 PolarHBondContact O-OG 2.82Å; C183-S186 WeakPolarHBondContact CA-OG 3.38Å; C183-S186 PolarHBondContact O-N 2.79Å; C183-S186 PolarHBondContact O-OG 3.48Å; S186-L189 PolarHBondContact O-N 3.39Å; S186-K190 WeakPolarHBondContact O-CB 3.35Å; S186-K190 WeakPolarHBondContact O-CG 3.23Å; S186-K190 PolarHBondContact O-N 3.02Å |
| 187 | S | 81.3 | Confident | 78 | Confident | 45 Ų | 45 | 103.5 Ų | 103.5 | 32% | 0.315 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -68.8 | -37.5 | 175.5 | 85.7 | 0 | 0 | 0 | 0 | 111.6 | C183 M184 M185 K190 K191 | C183-S187 WeakPolarHBondContact O-CB 3.47Å; C183-S187 PolarHBondContact O-N 3.48Å; M184-S187 WeakPolarHBondContact O-CB 3.5Å; M184-S187 PolarHBondContact O-N 2.91Å; M184-S187 PolarHBondContact O-OG 3.35Å; M185-S187 PolarHBondContact O-N 3.27Å; S187-K190 PolarHBondContact O-N 3.3Å; S187-K191 WeakPolarHBondContact O-CG 3.41Å; S187-K191 PolarHBondContact O-N 2.71Å |
| 188 | H | 69.1 | Low | 77.1 | Confident | 111 Ų | 111 | 102.1 Ų | 102.1 | 51% | 0.514 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67.3 | -42.3 | 174.7 | -167.8 | -86.8 | 0 | 0 | 0 | 110.5 | M184 M185 K190 K191 T192 | M184-H188 PolarHBondContact O-N 2.71Å; M184-H188 VanDerWaalsContact O-N 3.12Å; M185-H188 WeakPolarHBondContact O-CB 3.45Å; M185-H188 PolarHBondContact O-N 3.46Å; H188-K190 PolarHBondContact O-N 3.4Å; H188-K191 WeakPolarHBondContact O-CB 3.5Å; H188-K191 PolarHBondContact O-N 3.43Å; H188-K191 VanDerWaalsContact O-N 3.17Å; H188-T192 WeakPolarHBondContact O-CG2 3.16Å; H188-T192 PolarHBondContact O-N 3.24Å; H188-T192 PolarHBondContact O-OG1 3.29Å |
| 189 | L | 64.3 | Low | 76.1 | Confident | 96 Ų | 96 | 103.3 Ų | 103.3 | 50% | 0.503 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62 | -42.5 | 175.7 | -67.5 | 176.3 | 0 | 0 | 0 | 112.4 | M185 S186 K191 T192 E193 | M185-L189 HydrophobicContact CG-CD1 4.5Å; M185-L189 WeakPolarHBondContact O-CG 3.38Å; M185-L189 PolarHBondContact O-N 2.85Å; S186-L189 PolarHBondContact O-N 3.39Å; L189-K191 VanDerWaalsContact C-N 3.33Å; L189-K191 PolarHBondContact O-N 3.24Å; L189-T192 VanDerWaalsContact CA-OG1 3.26Å; L189-T192 WeakPolarHBondContact CA-OG1 3.33Å; L189-T192 PolarHBondContact O-N 3.45Å; L189-T192 PolarHBondContact O-OG1 2.86Å; L189-E193 WeakPolarHBondContact O-CB 3.25Å; L189-E193 PolarHBondContact O-N 3.46Å |
| 190 | K | 71.6 | Confident | 74.6 | Confident | 145 Ų | 145 | 106 Ų | 106 | 63% | 0.63 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.8 | -36.8 | 173.5 | -76.7 | 179.7 | 178.4 | -179.2 | 0 | 112.6 | S186 S187 H188 K194 | S186-K190 WeakPolarHBondContact O-CB 3.35Å; S186-K190 WeakPolarHBondContact O-CG 3.23Å; S186-K190 PolarHBondContact O-N 3.02Å; S187-K190 PolarHBondContact O-N 3.3Å; H188-K190 PolarHBondContact O-N 3.4Å; K190-K194 WeakPolarHBondContact O-CB 3.25Å; K190-K194 PolarHBondContact O-N 2.86Å |
| 191 | K | 77.1 | Confident | 73.5 | Confident | 148 Ų | 148 | 110.9 Ų | 110.9 | 64% | 0.643 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -66.3 | -42.1 | 173.5 | -75.2 | 174 | -176.7 | 175.4 | 0 | 111.3 | S187 H188 L189 A195 | S187-K191 WeakPolarHBondContact O-CG 3.41Å; S187-K191 PolarHBondContact O-N 2.71Å; H188-K191 WeakPolarHBondContact O-CB 3.5Å; H188-K191 PolarHBondContact O-N 3.43Å; H188-K191 VanDerWaalsContact O-N 3.17Å; L189-K191 VanDerWaalsContact C-N 3.33Å; L189-K191 PolarHBondContact O-N 3.24Å; K191-A195 WeakPolarHBondContact O-CB 3.2Å; K191-A195 PolarHBondContact O-N 2.92Å |
| 192 | T | 69.2 | Low | 72.5 | Confident | 52 Ų | 52 | 104.9 Ų | 104.9 | 32% | 0.319 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67.4 | -40 | 176.4 | 52.7 | 0 | 0 | 0 | 0 | 111.8 | H188 L189 A195 I196 | H188-T192 WeakPolarHBondContact O-CG2 3.16Å; H188-T192 PolarHBondContact O-N 3.24Å; H188-T192 PolarHBondContact O-OG1 3.29Å; L189-T192 VanDerWaalsContact CA-OG1 3.26Å; L189-T192 WeakPolarHBondContact CA-OG1 3.33Å; L189-T192 PolarHBondContact O-N 3.45Å; L189-T192 PolarHBondContact O-OG1 2.86Å; T192-A195 PolarHBondContact O-N 3.32Å; T192-I196 WeakPolarHBondContact O-CB 2.9Å; T192-I196 WeakPolarHBondContact O-CD1 3.37Å; T192-I196 WeakPolarHBondContact O-CG1 3.48Å; T192-I196 PolarHBondContact O-N 2.83Å |
| 193 | E | 72.8 | Confident | 71.3 | Confident | 133 Ų | 133 | 102.2 Ų | 102.2 | 62% | 0.621 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.4 | -48 | 175.4 | -177.3 | -175.1 | -178.7 | 0 | 0 | 111 | L189 A195 I196 N197 | L189-E193 WeakPolarHBondContact O-CB 3.25Å; L189-E193 PolarHBondContact O-N 3.46Å; E193-A195 VanDerWaalsContact C-N 3.35Å; E193-A195 PolarHBondContact O-N 2.93Å; E193-I196 PolarHBondContact O-N 2.87Å; E193-N197 WeakPolarHBondContact O-CB 3.16Å; E193-N197 PolarHBondContact O-N 2.85Å |
| 194 | K | 74.5 | Confident | 70.2 | Confident | 154 Ų | 154 | 100.6 Ų | 100.6 | 67% | 0.67 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.9 | -41.5 | 176.6 | -171.4 | 178 | -179.8 | -178.6 | 0 | 112.1 | K190 N197 E198 | K190-K194 WeakPolarHBondContact O-CB 3.25Å; K190-K194 PolarHBondContact O-N 2.86Å; K194-N197 PolarHBondContact O-N 3.24Å; K194-E198 WeakPolarHBondContact O-CB 3.44Å; K194-E198 PolarHBondContact O-N 3.21Å |
| 195 | A | 74.4 | Confident | 69.1 | Low | 60 Ų | 60 | 97.5 Ų | 97.5 | 50% | 0.496 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.9 | -42.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112 | K191 T192 E193 E198 F199 | K191-A195 WeakPolarHBondContact O-CB 3.2Å; K191-A195 PolarHBondContact O-N 2.92Å; T192-A195 PolarHBondContact O-N 3.32Å; E193-A195 VanDerWaalsContact C-N 3.35Å; E193-A195 PolarHBondContact O-N 2.93Å; A195-E198 PolarHBondContact O-N 2.89Å; A195-F199 VanDerWaalsContact O-CB 3.27Å; A195-F199 WeakPolarHBondContact O-CB 3.32Å; A195-F199 PolarHBondContact O-N 2.88Å |
| 196 | I | 68.9 | Low | 68.3 | Low | 96 Ų | 96 | 99.5 Ų | 99.5 | 49% | 0.492 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.2 | -46.5 | 175.7 | -68.8 | 165 | 0 | 0 | 0 | 110.1 | T192 E193 E198 F199 F200 | T192-I196 WeakPolarHBondContact O-CB 2.9Å; T192-I196 WeakPolarHBondContact O-CD1 3.37Å; T192-I196 WeakPolarHBondContact O-CG1 3.48Å; T192-I196 PolarHBondContact O-N 2.83Å; E193-I196 PolarHBondContact O-N 2.87Å; I196-E198 VanDerWaalsContact C-N 3.34Å; I196-E198 PolarHBondContact O-N 3.32Å; I196-F199 WeakPolarHBondContact O-CB 3.12Å; I196-F199 PolarHBondContact O-N 2.94Å; I196-F200 HydrophobicContact CG2-CD2 3.6Å; I196-F200 HydrophobicContact CG2-CE2 3.49Å; I196-F200 VanDerWaalsContact CG2-CE2 3.49Å; I196-F200 WeakPolarHBondContact O-CD2 3Å; I196-F200 PolarHBondContact O-N 3.32Å |
| 197 | N | 69 | Low | 67.6 | Low | 117 Ų | 117 | 103.3 Ų | 103.3 | 63% | 0.626 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.5 | -37.4 | -179 | -153.8 | 19.7 | 0 | 0 | 0 | 112.1 | E193 K194 R201 | E193-N197 WeakPolarHBondContact O-CB 3.16Å; E193-N197 PolarHBondContact O-N 2.85Å; K194-N197 PolarHBondContact O-N 3.24Å; N197-R201 WeakPolarHBondContact O-CB 3.25Å; N197-R201 PolarHBondContact O-N 2.98Å; N197-R201 VanDerWaalsContact O-N 3.1Å |
| 198 | E | 72.6 | Confident | 66.4 | Low | 80 Ų | 80 | 107.2 Ų | 107.2 | 37% | 0.374 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -67.7 | -41.7 | 173.8 | -158.8 | 74.9 | -144.5 | 0 | 0 | 111.4 | K194 A195 I196 R201 T202 | K194-E198 WeakPolarHBondContact O-CB 3.44Å; K194-E198 PolarHBondContact O-N 3.21Å; A195-E198 PolarHBondContact O-N 2.89Å; I196-E198 VanDerWaalsContact C-N 3.34Å; I196-E198 PolarHBondContact O-N 3.32Å; E198-R201 PolarHBondContact O-N 2.88Å; E198-R201 VanDerWaalsContact O-N 3.13Å; E198-R201 IonicContact OE1-CZ 2.8Å; E198-R201 IonicContact OE1-NE 3.6Å; E198-R201 IonicContact OE1-NH2 3.47Å; E198-R201 PolarHBondContact OE1-NH2 3.45Å; E198-T202 HydrophobicContact CG-CG2 4.39Å; E198-T202 WeakPolarHBondContact O-CG2 3.39Å; E198-T202 PolarHBondContact O-N 3.38Å; E198-T202 PolarHBondContact O-OG1 2.93Å |
| 199 | F | 65.6 | Low | 66 | Low | 113 Ų | 113 | 107.2 Ų | 107.2 | 50% | 0.496 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -59.6 | -46.4 | 176.5 | -179.5 | -91 | 0 | 0 | 0 | 112.1 | A195 I196 R201 T202 E203 | A195-F199 VanDerWaalsContact O-CB 3.27Å; A195-F199 WeakPolarHBondContact O-CB 3.32Å; A195-F199 PolarHBondContact O-N 2.88Å; I196-F199 WeakPolarHBondContact O-CB 3.12Å; I196-F199 PolarHBondContact O-N 2.94Å; F199-R201 VanDerWaalsContact C-N 3.28Å; F199-R201 PolarHBondContact O-N 3.02Å; F199-T202 PolarHBondContact O-N 3.4Å; F199-E203 HydrophobicContact CE2-CB 4.43Å; F199-E203 WeakPolarHBondContact CE2-OE2 3.25Å; F199-E203 HydrophobicContact CZ-CB 4.47Å; F199-E203 WeakPolarHBondContact CZ-OE2 3.49Å; F199-E203 WeakPolarHBondContact O-CB 3.35Å; F199-E203 PolarHBondContact O-N 3.02Å |
| 200 | F | 62.1 | Low | 66.3 | Low | 142 Ų | 142 | 109.7 Ų | 109.7 | 62% | 0.623 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64 | -34.5 | 174.6 | -81.9 | -70.8 | 0 | 0 | 0 | 112.3 | I196 G204 | I196-F200 HydrophobicContact CG2-CD2 3.6Å; I196-F200 HydrophobicContact CG2-CE2 3.49Å; I196-F200 VanDerWaalsContact CG2-CE2 3.49Å; I196-F200 WeakPolarHBondContact O-CD2 3Å; I196-F200 PolarHBondContact O-N 3.32Å; F200-G204 WeakPolarHBondContact O-CA 3.1Å; F200-G204 PolarHBondContact O-N 3.49Å |
| 201 | R | 66 | Low | 65.6 | Low | 172 Ų | 172 | 105.5 Ų | 105.5 | 65% | 0.649 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -74 | -36.7 | 180 | -162.1 | 176.9 | 74.5 | 135.3 | 0.8 | 113.2 | N197 E198 F199 A205 | N197-R201 WeakPolarHBondContact O-CB 3.25Å; N197-R201 PolarHBondContact O-N 2.98Å; N197-R201 VanDerWaalsContact O-N 3.1Å; E198-R201 PolarHBondContact O-N 2.88Å; E198-R201 VanDerWaalsContact O-N 3.13Å; E198-R201 IonicContact OE1-CZ 2.8Å; E198-R201 IonicContact OE1-NE 3.6Å; E198-R201 IonicContact OE1-NH2 3.47Å; E198-R201 PolarHBondContact OE1-NH2 3.45Å; F199-R201 VanDerWaalsContact C-N 3.28Å; F199-R201 PolarHBondContact O-N 3.02Å; R201-A205 VanDerWaalsContact O-CB 3.25Å; R201-A205 WeakPolarHBondContact O-CB 3.34Å |
| 202 | T | 64 | Low | 64.7 | Low | 69 Ų | 69 | 104.4 Ų | 104.4 | 42% | 0.423 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -94.5 | -51.2 | -175 | 57.5 | 0 | 0 | 0 | 0 | 112.4 | E198 F199 E206 | E198-T202 HydrophobicContact CG-CG2 4.39Å; E198-T202 WeakPolarHBondContact O-CG2 3.39Å; E198-T202 PolarHBondContact O-N 3.38Å; E198-T202 PolarHBondContact O-OG1 2.93Å; F199-T202 PolarHBondContact O-N 3.4Å; T202-E206 PolarHBondContact O-N 2.81Å; T202-E206 VanDerWaalsContact O-N 3.11Å |
| 203 | E | 60.2 | Low | 64.3 | Low | 67 Ų | 67 | 105.7 Ų | 105.7 | 31% | 0.313 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -78.3 | -34 | -178 | -166.4 | 165.6 | 173.1 | 0 | 0 | 111.5 | F199 K207 | F199-E203 HydrophobicContact CE2-CB 4.43Å; F199-E203 WeakPolarHBondContact CE2-OE2 3.25Å; F199-E203 HydrophobicContact CZ-CB 4.47Å; F199-E203 WeakPolarHBondContact CZ-OE2 3.49Å; F199-E203 WeakPolarHBondContact O-CB 3.35Å; F199-E203 PolarHBondContact O-N 3.02Å; E203-K207 HydrophobicContact CG-CG 3.9Å; E203-K207 WeakPolarHBondContact O-CB 3.06Å; E203-K207 WeakPolarHBondContact O-CG 3.42Å; E203-K207 PolarHBondContact O-N 3.39Å; E203-K207 WeakPolarHBondContact OE1-CE 3.2Å; E203-K207 IonicContact OE1-NZ 2.7Å; E203-K207 PolarHBondContact OE1-NZ 3.46Å |
| 204 | G | 58.1 | Low | 63.8 | Low | 33 Ų | 33 | 104.5 Ų | 104.5 | 34% | 0.34 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.6 | -45 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | F200 L208 | F200-G204 WeakPolarHBondContact O-CA 3.1Å; F200-G204 PolarHBondContact O-N 3.49Å; G204-L208 WeakPolarHBondContact O-CB 3.46Å; G204-L208 PolarHBondContact O-N 3.05Å |
| 205 | A | 55.8 | Low | 62.8 | Low | 59 Ų | 59 | 99.7 Ų | 99.7 | 49% | 0.488 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -71.1 | -41.8 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | R201 Q209 | R201-A205 VanDerWaalsContact O-CB 3.25Å; R201-A205 WeakPolarHBondContact O-CB 3.34Å; A205-Q209 WeakPolarHBondContact O-CB 3.48Å; A205-Q209 PolarHBondContact O-N 2.85Å |
| 206 | E | 62.2 | Low | 61.9 | Low | 148 Ų | 148 | 103.8 Ų | 103.8 | 69% | 0.692 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -68.8 | -42.4 | 177.2 | -83.6 | -169 | 145.4 | 0 | 0 | 112.8 | T202 L208 K210 | T202-E206 PolarHBondContact O-N 2.81Å; T202-E206 VanDerWaalsContact O-N 3.11Å; E206-L208 VanDerWaalsContact C-N 3.34Å; E206-K210 WeakPolarHBondContact O-CB 3.29Å; E206-K210 PolarHBondContact O-N 2.96Å |
| 207 | K | 60.6 | Low | 61.2 | Low | 130 Ų | 130 | 109.4 Ų | 109.4 | 57% | 0.565 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65.8 | -39 | 177.6 | -66.2 | -83.6 | 173.8 | 91.2 | 0 | 110.9 | E203 A211 | E203-K207 HydrophobicContact CG-CG 3.9Å; E203-K207 WeakPolarHBondContact O-CB 3.06Å; E203-K207 WeakPolarHBondContact O-CG 3.42Å; E203-K207 PolarHBondContact O-N 3.39Å; E203-K207 WeakPolarHBondContact OE1-CE 3.2Å; E203-K207 IonicContact OE1-NZ 2.7Å; E203-K207 PolarHBondContact OE1-NZ 3.46Å; K207-A211 VanDerWaalsContact O-CB 3.31Å; K207-A211 WeakPolarHBondContact O-CB 3.41Å; K207-A211 PolarHBondContact O-N 3.37Å |
| 208 | L | 56.8 | Low | 60.5 | Low | 126 Ų | 126 | 109.4 Ų | 109.4 | 66% | 0.66 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -75.3 | -38.2 | -179.7 | -157.5 | 148.4 | 0 | 0 | 0 | 111.9 | G204 E206 A211 F212 | G204-L208 WeakPolarHBondContact O-CB 3.46Å; G204-L208 PolarHBondContact O-N 3.05Å; E206-L208 VanDerWaalsContact C-N 3.34Å; L208-A211 PolarHBondContact O-N 3.44Å; L208-F212 VanDerWaalsContact O-CB 3.31Å; L208-F212 WeakPolarHBondContact O-CB 2.96Å; L208-F212 PolarHBondContact O-N 3.35Å |
| 209 | Q | 60.4 | Low | 59.1 | Low | 111 Ų | 111 | 110.4 Ų | 110.4 | 52% | 0.519 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -67.6 | -38.9 | 173 | -169.4 | 67.1 | 18.8 | 0 | 0 | 112.1 | A205 F212 E213 | A205-Q209 WeakPolarHBondContact O-CB 3.48Å; A205-Q209 PolarHBondContact O-N 2.85Å; Q209-F212 PolarHBondContact O-N 3.5Å; Q209-E213 PolarHBondContact O-N 3.29Å |
| 210 | K | 70 | Confident | 58.5 | Low | 148 Ų | 148 | 112.5 Ų | 112.5 | 64% | 0.643 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -67 | -39.4 | 174.5 | -170 | 173.2 | -176.7 | 176.1 | 0 | 111.5 | E206 I214 | E206-K210 WeakPolarHBondContact O-CB 3.29Å; E206-K210 PolarHBondContact O-N 2.96Å; K210-I214 HydrophobicContact CG-CD1 4.19Å; K210-I214 WeakPolarHBondContact O-CB 3.38Å; K210-I214 WeakPolarHBondContact O-CD1 3.47Å; K210-I214 WeakPolarHBondContact O-CG1 3.16Å; K210-I214 PolarHBondContact O-N 2.82Å |
| 211 | A | 57.1 | Low | 57.5 | Low | 58 Ų | 58 | 112.4 Ų | 112.4 | 48% | 0.479 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -65.3 | -38.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | K207 L208 I214 A215 | K207-A211 VanDerWaalsContact O-CB 3.31Å; K207-A211 WeakPolarHBondContact O-CB 3.41Å; K207-A211 PolarHBondContact O-N 3.37Å; L208-A211 PolarHBondContact O-N 3.44Å; A211-I214 PolarHBondContact O-N 3.05Å; A211-A215 WeakPolarHBondContact O-CB 3.33Å; A211-A215 PolarHBondContact O-N 3.09Å |
| 212 | F | 57.8 | Low | 56.8 | Low | 124 Ų | 124 | 110 Ų | 110 | 54% | 0.544 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -67.3 | -42.6 | 176.2 | -173 | -97.5 | 0 | 0 | 0 | 112.6 | L208 Q209 I214 A215 K216 | L208-F212 VanDerWaalsContact O-CB 3.31Å; L208-F212 WeakPolarHBondContact O-CB 2.96Å; L208-F212 PolarHBondContact O-N 3.35Å; Q209-F212 PolarHBondContact O-N 3.5Å; F212-I214 VanDerWaalsContact C-N 3.35Å; F212-A215 PolarHBondContact O-N 3.02Å; F212-K216 WeakPolarHBondContact O-CB 3.23Å; F212-K216 PolarHBondContact O-N 2.98Å |
| 213 | E | 61.2 | Low | 56.1 | Low | 79 Ų | 79 | 109.9 Ų | 109.9 | 37% | 0.369 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -68.7 | -31.2 | 174.4 | -85.3 | -63.4 | 131.3 | 0 | 0 | 112.8 | Q209 K216 | Q209-E213 PolarHBondContact O-N 3.29Å; E213-K216 WeakPolarHBondContact OE1-CD 3.43Å; E213-K216 IonicContact OE1-NZ 2.66Å; E213-K216 PolarHBondContact OE1-NZ 2.98Å |
| 214 | I | 62.2 | Low | 55.9 | Low | 108 Ų | 108 | 111.3 Ų | 111.3 | 55% | 0.554 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -67.2 | -42.7 | 169.7 | -69.4 | 164.2 | 0 | 0 | 0 | 110.5 | K210 A211 F212 K216 R217 | K210-I214 HydrophobicContact CG-CD1 4.19Å; K210-I214 WeakPolarHBondContact O-CB 3.38Å; K210-I214 WeakPolarHBondContact O-CD1 3.47Å; K210-I214 WeakPolarHBondContact O-CG1 3.16Å; K210-I214 PolarHBondContact O-N 2.82Å; A211-I214 PolarHBondContact O-N 3.05Å; F212-I214 VanDerWaalsContact C-N 3.35Å; I214-K216 VanDerWaalsContact C-N 3.34Å; I214-K216 PolarHBondContact O-N 3.43Å; I214-R217 PolarHBondContact O-N 3.4Å |
| 215 | A | 54.8 | Low | 55.6 | Low | 53 Ų | 53 | 118.7 Ų | 118.7 | 44% | 0.438 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -65.3 | -34.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A211 F212 R217 I218 | A211-A215 WeakPolarHBondContact O-CB 3.33Å; A211-A215 PolarHBondContact O-N 3.09Å; F212-A215 PolarHBondContact O-N 3.02Å; A215-R217 VanDerWaalsContact C-N 3.27Å; A215-R217 PolarHBondContact O-N 2.99Å; A215-I218 WeakPolarHBondContact O-CB 3.34Å; A215-I218 PolarHBondContact O-N 2.79Å |
| 216 | K | 54.1 | Low | 55.3 | Low | 146 Ų | 146 | 119.7 Ų | 119.7 | 64% | 0.635 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -68.3 | -22.3 | 177.4 | -168.3 | 177.9 | 176.4 | -175.3 | 0 | 113.8 | F212 E213 I214 I218 | F212-K216 WeakPolarHBondContact O-CB 3.23Å; F212-K216 PolarHBondContact O-N 2.98Å; E213-K216 WeakPolarHBondContact OE1-CD 3.43Å; E213-K216 IonicContact OE1-NZ 2.66Å; E213-K216 PolarHBondContact OE1-NZ 2.98Å; I214-K216 VanDerWaalsContact C-N 3.34Å; I214-K216 PolarHBondContact O-N 3.43Å; K216-I218 VanDerWaalsContact C-N 3.3Å |
| 217 | R | 55.1 | Low | 54.8 | Low | 214 Ų | 214 | 117.7 Ų | 117.7 | 81% | 0.808 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.7 | -2.6 | 174.1 | -72.4 | -166 | -177.5 | -119.3 | 2.7 | 113.9 | I214 A215 P219 | I214-R217 PolarHBondContact O-N 3.4Å; A215-R217 VanDerWaalsContact C-N 3.27Å; A215-R217 PolarHBondContact O-N 2.99Å; R217-P219 VanDerWaalsContact O-CD 3.26Å; R217-P219 WeakPolarHBondContact O-CD 3.33Å |
| 218 | I | 54.8 | Low | 54.7 | Low | 117 Ų | 117 | 116.6 Ų | 116.6 | 60% | 0.6 | 61% | 0.61 | S | S | * | * | S | Bend | trans | -84.2 | 110.1 | 175.3 | -54.5 | 174.6 | 0 | 0 | 0 | 107.5 | A215 K216 I220 | A215-I218 WeakPolarHBondContact O-CB 3.34Å; A215-I218 PolarHBondContact O-N 2.79Å; K216-I218 VanDerWaalsContact C-N 3.3Å; I218-I220 PolarHBondContact O-N 2.6Å |
| 219 | P | 43.2 | Very low | 54.5 | Low | 102 Ų | 102 | 116 Ų | 116 | 66% | 0.662 | 61% | 0.607 | S | S | * | * | trans | -62.8 | 125.6 | 179.9 | 24 | -31 | 0 | 0 | 0 | 109.8 | R217 I221 | R217-P219 VanDerWaalsContact O-CD 3.26Å; R217-P219 WeakPolarHBondContact O-CD 3.33Å; P219-I221 VanDerWaalsContact C-N 3.31Å; P219-I221 PolarHBondContact O-N 2.05Å | ||
| 220 | I | 51.3 | Low | 54.3 | Low | 156 Ų | 156 | 113.1 Ų | 113.1 | 80% | 0.8 | 60% | 0.602 | S | S | * | * | trans | -64.2 | 91.8 | 173.9 | -57.8 | 173.7 | 0 | 0 | 0 | 107.6 | I218 T222 | I218-I220 PolarHBondContact O-N 2.6Å; I220-T222 HydrophobicContact CG2-CG2 3.96Å; I220-T222 PolarHBondContact O-N 3.12Å | ||
| 221 | I | 42.6 | Very low | 53.7 | Low | 141 Ų | 141 | 111 Ų | 111 | 72% | 0.723 | 59% | 0.593 | S | S | * | * | trans | -92 | 96.2 | 160.9 | -50.4 | 179.3 | 0 | 0 | 0 | 106 | P219 S223 | P219-I221 VanDerWaalsContact C-N 3.31Å; P219-I221 PolarHBondContact O-N 2.05Å; I221-S223 PolarHBondContact O-N 3.34Å | ||
| 222 | T | 50.6 | Low | 53.6 | Low | 121 Ų | 121 | 112.4 Ų | 112.4 | 74% | 0.742 | 60% | 0.595 | S | S | * | * | trans | -50.5 | 112.9 | 171.6 | 49.4 | 0 | 0 | 0 | 0 | 110.9 | I220 | I220-T222 HydrophobicContact CG2-CG2 3.96Å; I220-T222 PolarHBondContact O-N 3.12Å | ||
| 223 | S | 48.8 | Very low | 53.5 | Low | 67 Ų | 67 | 110.4 Ų | 110.4 | 47% | 0.469 | 59% | 0.593 | S | S | . | * | trans | -138 | 135.5 | 152.4 | 87.8 | 0 | 0 | 0 | 0 | 108.6 | I221 K225 T226 | I221-S223 PolarHBondContact O-N 3.34Å; S223-K225 PolarHBondContact O-N 2.99Å; S223-T226 PolarHBondContact O-N 3.07Å; S223-T226 VanDerWaalsContact O-N 3.12Å; S223-T226 PolarHBondContact O-OG1 3.37Å | ||
| 224 | A | 56.5 | Low | 53.2 | Low | 97 Ų | 97 | 113.3 Ų | 113.3 | 80% | 0.802 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.2 | -12.7 | -175 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 225 | K | 51.8 | Low | 53.2 | Low | 187 Ų | 187 | 114.7 Ų | 114.7 | 81% | 0.813 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -79.6 | -19 | 179.9 | -143.4 | 170.5 | -174.6 | 170.7 | 0 | 113.8 | S223 | S223-K225 PolarHBondContact O-N 2.99Å |
| 226 | T | 50.2 | Low | 53.3 | Low | 81 Ų | 81 | 119.4 Ų | 119.4 | 50% | 0.497 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -85.7 | -15.1 | 177.6 | 44.8 | 0 | 0 | 0 | 0 | 113.8 | S223 A230 | S223-T226 PolarHBondContact O-N 3.07Å; S223-T226 VanDerWaalsContact O-N 3.12Å; S223-T226 PolarHBondContact O-OG1 3.37Å; T226-A230 VanDerWaalsContact O-CB 3.24Å; T226-A230 WeakPolarHBondContact O-CB 3.29Å; T226-A230 PolarHBondContact O-N 3.15Å |
| 227 | L | 51.3 | Low | 53.5 | Low | 106 Ų | 106 | 116.4 Ų | 116.4 | 56% | 0.555 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -71.3 | -40.4 | 176.4 | -171.1 | 73.1 | 0 | 0 | 0 | 112 | A230 K231 | L227-A230 PolarHBondContact O-N 3.22Å; L227-K231 WeakPolarHBondContact O-CG 3.49Å; L227-K231 PolarHBondContact O-N 3.41Å |
| 228 | E | 57.8 | Low | 53.5 | Low | 107 Ų | 107 | 113.1 Ų | 113.1 | 50% | 0.5 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -69.9 | -37.2 | 176.9 | -67.3 | -57.6 | 129.7 | 0 | 0 | 111.4 | K231 V232 | E228-K231 PolarHBondContact O-N 3.26Å; E228-K231 IonicContact OE1-NZ 2.79Å; E228-K231 PolarHBondContact OE1-NZ 3.22Å; E228-V232 WeakPolarHBondContact O-CG2 3.29Å; E228-V232 PolarHBondContact O-N 3.13Å |
| 229 | L | 52.7 | Low | 53.8 | Low | 113 Ų | 113 | 113 Ų | 113 | 59% | 0.592 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -66.7 | -39.8 | 171.6 | -169.2 | 66 | 0 | 0 | 0 | 111.4 | V232 T233 | L229-V232 PolarHBondContact O-N 2.96Å; L229-T233 WeakPolarHBondContact O-CB 3.19Å; L229-T233 PolarHBondContact O-N 3.44Å; L229-T233 PolarHBondContact O-OG1 2.84Å |
| 230 | A | 55.8 | Low | 54.5 | Low | 50 Ų | 50 | 114.5 Ų | 114.5 | 41% | 0.413 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -63.8 | -39.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | T226 L227 T233 Q234 | T226-A230 VanDerWaalsContact O-CB 3.24Å; T226-A230 WeakPolarHBondContact O-CB 3.29Å; T226-A230 PolarHBondContact O-N 3.15Å; L227-A230 PolarHBondContact O-N 3.22Å; A230-T233 PolarHBondContact O-N 3.4Å; A230-Q234 VanDerWaalsContact O-CB 3.29Å; A230-Q234 WeakPolarHBondContact O-CB 3.28Å; A230-Q234 PolarHBondContact O-N 2.87Å |
| 231 | K | 57.6 | Low | 54.8 | Low | 104 Ų | 104 | 109.8 Ų | 109.8 | 45% | 0.452 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -62.5 | -43.6 | 172 | -75 | 175.7 | -173 | 166.2 | 0 | 112 | L227 E228 T233 Q234 F235 | L227-K231 WeakPolarHBondContact O-CG 3.49Å; L227-K231 PolarHBondContact O-N 3.41Å; E228-K231 PolarHBondContact O-N 3.26Å; E228-K231 IonicContact OE1-NZ 2.79Å; E228-K231 PolarHBondContact OE1-NZ 3.22Å; K231-T233 VanDerWaalsContact C-N 3.3Å; K231-T233 PolarHBondContact O-N 2.79Å; K231-Q234 PolarHBondContact O-N 3.38Å; K231-F235 VanDerWaalsContact O-CB 3.29Å; K231-F235 WeakPolarHBondContact O-CB 3.47Å; K231-F235 PolarHBondContact O-N 2.75Å |
| 232 | V | 55.1 | Low | 55.9 | Low | 88 Ų | 88 | 111.1 Ų | 111.1 | 53% | 0.533 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -64.1 | -38.1 | 175.4 | 171.5 | 0 | 0 | 0 | 0 | 111.1 | E228 L229 K236 | E228-V232 WeakPolarHBondContact O-CG2 3.29Å; E228-V232 PolarHBondContact O-N 3.13Å; L229-V232 PolarHBondContact O-N 2.96Å; V232-K236 VanDerWaalsContact O-CB 3.27Å; V232-K236 WeakPolarHBondContact O-CB 3.5Å; V232-K236 PolarHBondContact O-N 3.44Å |
| 233 | T | 55.5 | Low | 56.3 | Low | 81 Ų | 81 | 112.6 Ų | 112.6 | 50% | 0.497 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -71.2 | -38.2 | 178.9 | -40.1 | 0 | 0 | 0 | 0 | 111.2 | L229 A230 K231 K236 T237 | L229-T233 WeakPolarHBondContact O-CB 3.19Å; L229-T233 PolarHBondContact O-N 3.44Å; L229-T233 PolarHBondContact O-OG1 2.84Å; A230-T233 PolarHBondContact O-N 3.4Å; K231-T233 VanDerWaalsContact C-N 3.3Å; K231-T233 PolarHBondContact O-N 2.79Å; T233-K236 PolarHBondContact O-N 2.94Å; T233-T237 WeakPolarHBondContact O-CG2 3.43Å; T233-T237 PolarHBondContact O-N 3.27Å; T233-T237 PolarHBondContact O-OG1 2.84Å |
| 234 | Q | 56.7 | Low | 56.9 | Low | 141 Ų | 141 | 113.6 Ų | 113.6 | 66% | 0.659 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -71.3 | -38.2 | 176.6 | -163.8 | -176.2 | 13.1 | 0 | 0 | 112.4 | A230 K231 T237 M238 | A230-Q234 VanDerWaalsContact O-CB 3.29Å; A230-Q234 WeakPolarHBondContact O-CB 3.28Å; A230-Q234 PolarHBondContact O-N 2.87Å; K231-Q234 PolarHBondContact O-N 3.38Å; Q234-T237 VanDerWaalsContact CA-OG1 3.32Å; Q234-T237 WeakPolarHBondContact CA-OG1 3.17Å; Q234-T237 PolarHBondContact O-OG1 3.46Å; Q234-M238 WeakPolarHBondContact O-CB 3.47Å; Q234-M238 PolarHBondContact O-N 3.12Å |
| 235 | F | 60.4 | Low | 57.2 | Low | 137 Ų | 137 | 115.1 Ų | 115.1 | 60% | 0.601 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -63.9 | -44.3 | 173.3 | -171.3 | -92.3 | 0 | 0 | 0 | 110.6 | K231 T237 M238 E239 | K231-F235 VanDerWaalsContact O-CB 3.29Å; K231-F235 WeakPolarHBondContact O-CB 3.47Å; K231-F235 PolarHBondContact O-N 2.75Å; F235-T237 PolarHBondContact O-N 3.11Å; F235-M238 PolarHBondContact O-N 3.41Å; F235-E239 WeakPolarHBondContact O-CB 3.49Å; F235-E239 PolarHBondContact O-N 3.03Å |
| 236 | K | 57.7 | Low | 57.8 | Low | 151 Ų | 151 | 111.2 Ų | 111.2 | 66% | 0.657 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -70 | -31.6 | 179.9 | -155.8 | 174.4 | -171.5 | 177.3 | 0 | 113.1 | V232 T233 F240 | V232-K236 VanDerWaalsContact O-CB 3.27Å; V232-K236 WeakPolarHBondContact O-CB 3.5Å; V232-K236 PolarHBondContact O-N 3.44Å; T233-K236 PolarHBondContact O-N 2.94Å; K236-F240 WeakPolarHBondContact O-CB 3.49Å; K236-F240 PolarHBondContact O-N 2.66Å |
| 237 | T | 57.5 | Low | 58.1 | Low | 84 Ų | 84 | 111.3 Ų | 111.3 | 52% | 0.515 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -74.2 | -32.8 | 172.8 | 47.5 | 0 | 0 | 0 | 0 | 112.6 | T233 Q234 F235 F240 A241 | T233-T237 WeakPolarHBondContact O-CG2 3.43Å; T233-T237 PolarHBondContact O-N 3.27Å; T233-T237 PolarHBondContact O-OG1 2.84Å; Q234-T237 VanDerWaalsContact CA-OG1 3.32Å; Q234-T237 WeakPolarHBondContact CA-OG1 3.17Å; Q234-T237 PolarHBondContact O-OG1 3.46Å; F235-T237 PolarHBondContact O-N 3.11Å; T237-F240 PolarHBondContact O-N 2.7Å; T237-A241 WeakPolarHBondContact O-CB 3.36Å; T237-A241 PolarHBondContact O-N 2.91Å |
| 238 | M | 55.3 | Low | 58.2 | Low | 144 Ų | 144 | 109.2 Ų | 109.2 | 71% | 0.709 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -68.4 | -38.3 | 172.9 | -177.3 | 169.4 | 157.2 | 0 | 0 | 112 | Q234 F235 A241 R242 | Q234-M238 WeakPolarHBondContact O-CB 3.47Å; Q234-M238 PolarHBondContact O-N 3.12Å; F235-M238 PolarHBondContact O-N 3.41Å; M238-A241 PolarHBondContact O-N 3.45Å; M238-R242 PolarHBondContact O-N 2.81Å |
| 239 | E | 62.5 | Low | 57.9 | Low | 116 Ų | 116 | 113.9 Ų | 113.9 | 54% | 0.542 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -68.9 | -38.6 | 175.2 | -148.2 | 172.8 | -156.4 | 0 | 0 | 111.7 | F235 R242 Y243 | F235-E239 WeakPolarHBondContact O-CB 3.49Å; F235-E239 PolarHBondContact O-N 3.03Å; E239-R242 PolarHBondContact O-N 3.47Å; E239-Y243 WeakPolarHBondContact O-CB 3.31Å; E239-Y243 PolarHBondContact O-N 2.58Å |
| 240 | F | 57.2 | Low | 57.7 | Low | 133 Ų | 133 | 112.3 Ų | 112.3 | 58% | 0.583 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.8 | -39 | 172.7 | -171.3 | -108.6 | 0 | 0 | 0 | 112.4 | K236 T237 Y243 I244 | K236-F240 WeakPolarHBondContact O-CB 3.49Å; K236-F240 PolarHBondContact O-N 2.66Å; T237-F240 PolarHBondContact O-N 2.7Å; F240-Y243 PolarHBondContact O-N 3.38Å; F240-I244 HydrophobicContact CD1-CD1 3.78Å; F240-I244 HydrophobicContact CE1-CD1 3.43Å; F240-I244 VanDerWaalsContact CE1-CD1 3.43Å; F240-I244 HydrophobicContact CE1-CG1 4.4Å; F240-I244 HydrophobicContact CZ-CD1 3.92Å; F240-I244 WeakPolarHBondContact O-CG1 3.38Å; F240-I244 PolarHBondContact O-N 2.78Å |
| 241 | A | 58 | Low | 57.3 | Low | 56 Ų | 56 | 115.8 Ų | 115.8 | 46% | 0.463 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -64.8 | -42.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112 | T237 M238 Y243 I244 E245 | T237-A241 WeakPolarHBondContact O-CB 3.36Å; T237-A241 PolarHBondContact O-N 2.91Å; M238-A241 PolarHBondContact O-N 3.45Å; A241-Y243 VanDerWaalsContact C-N 3.34Å; A241-Y243 PolarHBondContact O-N 3.11Å; A241-I244 PolarHBondContact O-N 3.5Å; A241-E245 PolarHBondContact O-N 2.88Å |
| 242 | R | 65.6 | Low | 56.6 | Low | 170 Ų | 170 | 116 Ų | 116 | 64% | 0.642 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -64.5 | -37.3 | 174.7 | -171.7 | -174.3 | 159.2 | 120.3 | 5.3 | 111.9 | M238 E239 E245 E246 | M238-R242 PolarHBondContact O-N 2.81Å; E239-R242 PolarHBondContact O-N 3.47Å; R242-E245 PolarHBondContact O-N 2.79Å; R242-E246 WeakPolarHBondContact O-CB 3.31Å; R242-E246 PolarHBondContact O-N 2.79Å |
| 243 | Y | 57.7 | Low | 56.3 | Low | 152 Ų | 152 | 118.5 Ų | 118.5 | 60% | 0.596 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -65.8 | -36.4 | 175.2 | -172.8 | -103.1 | 0 | 0 | 0 | 112.4 | E239 F240 A241 L247 | E239-Y243 WeakPolarHBondContact O-CB 3.31Å; E239-Y243 PolarHBondContact O-N 2.58Å; F240-Y243 PolarHBondContact O-N 3.38Å; A241-Y243 VanDerWaalsContact C-N 3.34Å; A241-Y243 PolarHBondContact O-N 3.11Å; Y243-L247 HydrophobicContact CD1-CD1 3.78Å; Y243-L247 HydrophobicContact CE1-CD1 3.4Å; Y243-L247 VanDerWaalsContact CE1-CD1 3.4Å; Y243-L247 HydrophobicContact CE1-CG 4.37Å; Y243-L247 WeakPolarHBondContact O-CB 3.42Å; Y243-L247 PolarHBondContact O-N 2.79Å |
| 244 | I | 61.3 | Low | 55.9 | Low | 87 Ų | 87 | 118.5 Ų | 118.5 | 45% | 0.446 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -68.5 | -38.2 | 173.4 | -69.6 | 170.8 | 0 | 0 | 0 | 111.4 | F240 A241 L247 A248 | F240-I244 HydrophobicContact CD1-CD1 3.78Å; F240-I244 HydrophobicContact CE1-CD1 3.43Å; F240-I244 VanDerWaalsContact CE1-CD1 3.43Å; F240-I244 HydrophobicContact CE1-CG1 4.4Å; F240-I244 HydrophobicContact CZ-CD1 3.92Å; F240-I244 WeakPolarHBondContact O-CG1 3.38Å; F240-I244 PolarHBondContact O-N 2.78Å; A241-I244 PolarHBondContact O-N 3.5Å; I244-L247 PolarHBondContact O-N 3.22Å; I244-A248 WeakPolarHBondContact O-CB 3.02Å; I244-A248 PolarHBondContact O-N 3.29Å |
| 245 | E | 64.6 | Low | 55.6 | Low | 130 Ų | 130 | 116.3 Ų | 116.3 | 61% | 0.607 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -66.9 | -38.6 | 175.6 | -167 | 175.9 | -176.2 | 0 | 0 | 112.2 | A241 R242 A248 R249 | A241-E245 PolarHBondContact O-N 2.88Å; R242-E245 PolarHBondContact O-N 2.79Å; E245-A248 PolarHBondContact O-N 3.41Å; E245-R249 PolarHBondContact O-N 2.8Å |
| 246 | E | 63.8 | Low | 54.7 | Low | 104 Ų | 104 | 115.2 Ų | 115.2 | 49% | 0.486 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -69.7 | -36.3 | 173.4 | -155.6 | 75.4 | -131.5 | 0 | 0 | 111.9 | R242 R249 S250 | R242-E246 WeakPolarHBondContact O-CB 3.31Å; R242-E246 PolarHBondContact O-N 2.79Å; E246-R249 PolarHBondContact O-N 3.33Å; E246-S250 WeakPolarHBondContact O-CB 3.38Å; E246-S250 PolarHBondContact O-N 2.96Å; E246-S250 PolarHBondContact O-OG 2.86Å |
| 247 | L | 55.6 | Low | 54.4 | Low | 83 Ų | 83 | 113.6 Ų | 113.6 | 44% | 0.435 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -62.3 | -42.4 | 169.5 | -102.1 | 160.1 | 0 | 0 | 0 | 111.3 | Y243 I244 R249 S250 I251 | Y243-L247 HydrophobicContact CD1-CD1 3.78Å; Y243-L247 HydrophobicContact CE1-CD1 3.4Å; Y243-L247 VanDerWaalsContact CE1-CD1 3.4Å; Y243-L247 HydrophobicContact CE1-CG 4.37Å; Y243-L247 WeakPolarHBondContact O-CB 3.42Å; Y243-L247 PolarHBondContact O-N 2.79Å; I244-L247 PolarHBondContact O-N 3.22Å; L247-R249 VanDerWaalsContact C-N 3.31Å; L247-R249 PolarHBondContact O-N 3.33Å; L247-S250 VanDerWaalsContact CA-OG 3.3Å; L247-S250 WeakPolarHBondContact CA-OG 3.25Å; L247-S250 PolarHBondContact O-N 3.27Å; L247-S250 VanDerWaalsContact O-N 3.15Å; L247-S250 PolarHBondContact O-OG 3.43Å; L247-S250 VanDerWaalsContact O-OG 3.05Å; L247-I251 WeakPolarHBondContact O-CG1 3.08Å; L247-I251 PolarHBondContact O-N 3Å; L247-I251 VanDerWaalsContact O-N 3.15Å |
| 248 | A | 53.2 | Low | 54.2 | Low | 62 Ų | 62 | 115.7 Ų | 115.7 | 51% | 0.512 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -65.5 | -32.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | I244 E245 | I244-A248 WeakPolarHBondContact O-CB 3.02Å; I244-A248 PolarHBondContact O-N 3.29Å; E245-A248 PolarHBondContact O-N 3.41Å |
| 249 | R | 52.1 | Low | 54.1 | Low | 206 Ų | 206 | 113.6 Ų | 113.6 | 78% | 0.777 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -74.4 | -23.3 | 172.1 | -81.1 | -174.2 | 107.9 | 93.4 | -2 | 114.1 | E245 E246 L247 | E245-R249 PolarHBondContact O-N 2.8Å; E246-R249 PolarHBondContact O-N 3.33Å; L247-R249 VanDerWaalsContact C-N 3.31Å; L247-R249 PolarHBondContact O-N 3.33Å |
| 250 | S | 48.4 | Very low | 53.6 | Low | 79 Ų | 79 | 112.1 Ų | 112.1 | 55% | 0.552 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -96 | -0.5 | -179.9 | 53.9 | 0 | 0 | 0 | 0 | 114 | E246 L247 P252 | E246-S250 WeakPolarHBondContact O-CB 3.38Å; E246-S250 PolarHBondContact O-N 2.96Å; E246-S250 PolarHBondContact O-OG 2.86Å; L247-S250 VanDerWaalsContact CA-OG 3.3Å; L247-S250 WeakPolarHBondContact CA-OG 3.25Å; L247-S250 PolarHBondContact O-N 3.27Å; L247-S250 VanDerWaalsContact O-N 3.15Å; L247-S250 PolarHBondContact O-OG 3.43Å; L247-S250 VanDerWaalsContact O-OG 3.05Å; S250-P252 WeakPolarHBondContact O-CD 3.29Å |
| 251 | I | 48.1 | Very low | 53.5 | Low | 123 Ų | 123 | 113.7 Ų | 113.7 | 63% | 0.631 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -69.5 | 108.2 | 166.2 | -65.9 | 162.4 | 0 | 0 | 0 | 107.3 | L247 L253 | L247-I251 WeakPolarHBondContact O-CG1 3.08Å; L247-I251 PolarHBondContact O-N 3Å; L247-I251 VanDerWaalsContact O-N 3.15Å; I251-L253 PolarHBondContact O-N 2.95Å |
| 252 | P | 42.7 | Very low | 53.5 | Low | 109 Ų | 109 | 114.4 Ų | 114.4 | 71% | 0.708 | 58% | 0.584 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 131.7 | -178.1 | 27.4 | -31.9 | 0 | 0 | 0 | 108.6 | S250 | S250-P252 WeakPolarHBondContact O-CD 3.29Š|
| 253 | L | 47.9 | Very low | 52.9 | Low | 140 Ų | 140 | 112.5 Ų | 112.5 | 73% | 0.733 | 58% | 0.581 | S | S | * | * | P | Polyproline II helix | trans | -46.4 | 131.4 | 165.3 | -77.9 | 159 | 0 | 0 | 0 | 107.9 | I251 | I251-L253 PolarHBondContact O-N 2.95Š|
| 254 | P | 47.9 | Very low | 52.8 | Low | 81 Ų | 81 | 112.3 Ų | 112.3 | 53% | 0.526 | 59% | 0.587 | S | S | . | * | P | Polyproline II helix | trans | -52.5 | 149.9 | -173.7 | -25.6 | 31.6 | 0 | 0 | 0 | 111.6 | L256 I257 | P254-L256 HydrophobicContact CB-CD1 4.43Å; P254-L256 PolarHBondContact O-N 2.92Å; P254-I257 PolarHBondContact O-N 2.99Å |
| 255 | P | 49.7 | Very low | 52.8 | Low | 96 Ų | 96 | 112.9 Ų | 112.9 | 62% | 0.623 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.8 | 3.4 | -178 | 22.1 | -32.7 | 0 | 0 | 0 | 115.4 | I257 M258 N259 | P255-I257 PolarHBondContact O-N 2.81Å; P255-M258 PolarHBondContact O-N 2.84Å; P255-N259 WeakPolarHBondContact O-CB 3.49Å; P255-N259 PolarHBondContact O-N 2.88Å |
| 256 | L | 42.5 | Very low | 52.3 | Low | 114 Ų | 114 | 112.5 Ų | 112.5 | 60% | 0.597 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -61.8 | -36.5 | 174.4 | -73.3 | 165.6 | 0 | 0 | 0 | 113 | P254 C260 | P254-L256 HydrophobicContact CB-CD1 4.43Å; P254-L256 PolarHBondContact O-N 2.92Å; L256-C260 PolarHBondContact O-N 3.32Å; L256-C260 PolarHBondContact O-SG 2.89Å |
| 257 | I | 51.5 | Low | 52 | Low | 116 Ų | 116 | 111.5 Ų | 111.5 | 60% | 0.595 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -72.9 | -35.2 | 177.1 | -74.4 | 170.8 | 0 | 0 | 0 | 111.5 | P254 P255 C260 R261 | P254-I257 PolarHBondContact O-N 2.99Å; P255-I257 PolarHBondContact O-N 2.81Å; I257-C260 PolarHBondContact O-N 3.23Å; I257-R261 PolarHBondContact O-N 2.78Å |
| 258 | M | 51.8 | Low | 51.7 | Low | 129 Ų | 129 | 112 Ų | 112 | 64% | 0.635 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -69.9 | -41 | 174.7 | -75.8 | -63.5 | -69.8 | 0 | 0 | 111.3 | P255 C260 R261 T262 | P255-M258 PolarHBondContact O-N 2.84Å; M258-C260 PolarHBondContact O-N 3.33Å; M258-R261 PolarHBondContact O-N 3.36Å; M258-T262 PolarHBondContact O-N 3.04Å; M258-T262 VanDerWaalsContact O-N 3.09Å; M258-T262 PolarHBondContact O-OG1 3.02Å |
| 259 | N | 53.7 | Low | 51.7 | Low | 100 Ų | 100 | 116.7 Ų | 116.7 | 54% | 0.535 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -65.5 | -32.3 | 174 | -85.5 | -19.5 | 0 | 0 | 0 | 113.5 | P255 R261 T262 F263 | P255-N259 WeakPolarHBondContact O-CB 3.49Å; P255-N259 PolarHBondContact O-N 2.88Å; N259-R261 VanDerWaalsContact C-N 3.27Å; N259-R261 PolarHBondContact O-N 3Å; N259-T262 WeakPolarHBondContact CA-OG1 3.41Å; N259-T262 PolarHBondContact O-N 3.4Å; N259-F263 WeakPolarHBondContact O-CB 3.32Å; N259-F263 PolarHBondContact O-N 2.88Å |
| 260 | C | 51.7 | Low | 51.6 | Low | 85 Ų | 85 | 112.9 Ų | 112.9 | 57% | 0.574 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -65.2 | -33.4 | 174.3 | -71.5 | 0 | 0 | 0 | 0 | 112.2 | L256 I257 M258 M264 | L256-C260 PolarHBondContact O-N 3.32Å; L256-C260 PolarHBondContact O-SG 2.89Å; I257-C260 PolarHBondContact O-N 3.23Å; M258-C260 PolarHBondContact O-N 3.33Å; C260-M264 WeakPolarHBondContact O-CB 3.27Å; C260-M264 PolarHBondContact O-N 2.89Å |
| 261 | R | 56.8 | Low | 51.4 | Low | 165 Ų | 165 | 113.2 Ų | 113.2 | 62% | 0.623 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -71.5 | -46.7 | 175.4 | -170.8 | 178 | 179 | 169.7 | 5.2 | 111.1 | I257 M258 N259 F263 M264 E265 | I257-R261 PolarHBondContact O-N 2.78Å; M258-R261 PolarHBondContact O-N 3.36Å; N259-R261 VanDerWaalsContact C-N 3.27Å; N259-R261 PolarHBondContact O-N 3Å; R261-F263 VanDerWaalsContact C-N 3.33Å; R261-F263 PolarHBondContact O-N 2.88Å; R261-M264 PolarHBondContact O-N 3.06Å; R261-E265 WeakPolarHBondContact CG-OE1 3.46Å; R261-E265 IonicContact NE-OE1 2.79Å; R261-E265 PolarHBondContact NE-OE1 2.95Å; R261-E265 WeakPolarHBondContact O-CB 3.44Å; R261-E265 WeakPolarHBondContact O-CG 3.32Å; R261-E265 PolarHBondContact O-N 2.82Å |
| 262 | T | 56.6 | Low | 51.3 | Low | 71 Ų | 71 | 110.2 Ų | 110.2 | 44% | 0.436 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -64.4 | -36.6 | 175.2 | -1.6 | 0 | 0 | 0 | 0 | 112.3 | M258 N259 E265 E266 | M258-T262 PolarHBondContact O-N 3.04Å; M258-T262 VanDerWaalsContact O-N 3.09Å; M258-T262 PolarHBondContact O-OG1 3.02Å; N259-T262 WeakPolarHBondContact CA-OG1 3.41Å; N259-T262 PolarHBondContact O-N 3.4Å; T262-E265 PolarHBondContact O-N 2.77Å; T262-E266 WeakPolarHBondContact O-CB 3.46Å; T262-E266 PolarHBondContact O-N 3.18Å |
| 263 | F | 54 | Low | 51.5 | Low | 131 Ų | 131 | 109.1 Ų | 109.1 | 58% | 0.575 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -71.7 | -33.2 | 177.4 | -166.2 | -100.9 | 0 | 0 | 0 | 112.3 | N259 R261 I267 | N259-F263 WeakPolarHBondContact O-CB 3.32Å; N259-F263 PolarHBondContact O-N 2.88Å; R261-F263 VanDerWaalsContact C-N 3.33Å; R261-F263 PolarHBondContact O-N 2.88Å; F263-I267 HydrophobicContact CD1-CD1 3.54Å; F263-I267 HydrophobicContact CD1-CG1 4.43Å; F263-I267 HydrophobicContact CE1-CD1 3.26Å; F263-I267 HydrophobicContact CE1-CG1 4.33Å; F263-I267 HydrophobicContact CG-CD1 4.37Å; F263-I267 HydrophobicContact CZ-CD1 3.87Å; F263-I267 WeakPolarHBondContact O-CB 3.2Å; F263-I267 VanDerWaalsContact O-CG1 3.25Å; F263-I267 WeakPolarHBondContact O-CG1 3.12Å; F263-I267 PolarHBondContact O-N 3.17Å |
| 264 | M | 55.8 | Low | 51.4 | Low | 148 Ų | 148 | 108.7 Ų | 108.7 | 73% | 0.729 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -68.6 | -39.9 | 169.2 | -100.8 | -168.3 | 86.2 | 0 | 0 | 111.9 | C260 R261 L268 | C260-M264 WeakPolarHBondContact O-CB 3.27Å; C260-M264 PolarHBondContact O-N 2.89Å; R261-M264 PolarHBondContact O-N 3.06Å; M264-L268 VanDerWaalsContact O-CB 3.28Å; M264-L268 WeakPolarHBondContact O-CB 3.38Å; M264-L268 PolarHBondContact O-N 3.43Å |
| 265 | E | 59.7 | Low | 51.2 | Low | 99 Ų | 99 | 113.6 Ų | 113.6 | 46% | 0.463 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -68.6 | -39.4 | 177.9 | -72.1 | 169.5 | -173.3 | 0 | 0 | 111.2 | R261 T262 L268 E269 | R261-E265 WeakPolarHBondContact CG-OE1 3.46Å; R261-E265 IonicContact NE-OE1 2.79Å; R261-E265 PolarHBondContact NE-OE1 2.95Å; R261-E265 WeakPolarHBondContact O-CB 3.44Å; R261-E265 WeakPolarHBondContact O-CG 3.32Å; R261-E265 PolarHBondContact O-N 2.82Å; T262-E265 PolarHBondContact O-N 2.77Å; E265-L268 PolarHBondContact O-N 2.05Å; E265-E269 PolarHBondContact O-N 2.83Å |
| 266 | E | 54.6 | Low | 50.8 | Low | 122 Ų | 122 | 117 Ų | 117 | 57% | 0.57 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -70.9 | -36.7 | 176.8 | -164.1 | 177.7 | -158.2 | 0 | 0 | 112.3 | T262 E269 V270 | T262-E266 WeakPolarHBondContact O-CB 3.46Å; T262-E266 PolarHBondContact O-N 3.18Å; E266-E269 PolarHBondContact O-N 3.17Å; E266-V270 WeakPolarHBondContact O-CB 3.15Å; E266-V270 VanDerWaalsContact O-CG2 3.23Å; E266-V270 WeakPolarHBondContact O-CG2 3.47Å; E266-V270 PolarHBondContact O-N 2.77Å |
| 267 | I | 56.8 | Low | 50.4 | Low | 83 Ų | 83 | 121 Ų | 121 | 43% | 0.426 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -68.3 | -36.3 | 170.6 | -73.2 | 172 | 0 | 0 | 0 | 111.2 | F263 E269 V270 V271 | F263-I267 HydrophobicContact CD1-CD1 3.54Å; F263-I267 HydrophobicContact CD1-CG1 4.43Å; F263-I267 HydrophobicContact CE1-CD1 3.26Å; F263-I267 HydrophobicContact CE1-CG1 4.33Å; F263-I267 HydrophobicContact CG-CD1 4.37Å; F263-I267 HydrophobicContact CZ-CD1 3.87Å; F263-I267 WeakPolarHBondContact O-CB 3.2Å; F263-I267 VanDerWaalsContact O-CG1 3.25Å; F263-I267 WeakPolarHBondContact O-CG1 3.12Å; F263-I267 PolarHBondContact O-N 3.17Å; I267-E269 VanDerWaalsContact C-N 3.31Å; I267-V270 PolarHBondContact O-N 2.66Å; I267-V271 HydrophobicContact CG2-CG2 4.11Å; I267-V271 WeakPolarHBondContact O-CB 3.32Å; I267-V271 WeakPolarHBondContact O-CG2 3.26Å; I267-V271 PolarHBondContact O-N 2.85Å |
| 268 | L | 50.4 | Low | 49.6 | Very low | 93 Ų | 93 | 122.6 Ų | 122.6 | 49% | 0.487 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -69.9 | -31.3 | 178.5 | -160.1 | 70.4 | 0 | 0 | 0 | 111.9 | M264 E265 G272 | M264-L268 VanDerWaalsContact O-CB 3.28Å; M264-L268 WeakPolarHBondContact O-CB 3.38Å; M264-L268 PolarHBondContact O-N 3.43Å; E265-L268 PolarHBondContact O-N 2.05Å; L268-G272 PolarHBondContact O-N 3.48Å |
| 269 | E | 53.6 | Low | 48.6 | Very low | 161 Ų | 161 | 122.9 Ų | 122.9 | 75% | 0.752 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -72 | -40.2 | 172.4 | -165 | 175 | -178.4 | 0 | 0 | 112 | E265 E266 I267 G272 | E265-E269 PolarHBondContact O-N 2.83Å; E266-E269 PolarHBondContact O-N 3.17Å; I267-E269 VanDerWaalsContact C-N 3.31Å; E269-G272 PolarHBondContact O-N 3.5Å |
| 270 | V | 48.6 | Very low | 47.4 | Very low | 125 Ų | 125 | 126.5 Ų | 126.5 | 76% | 0.758 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -72.8 | -26.5 | 176.8 | 173.6 | 0 | 0 | 0 | 0 | 112.8 | E266 I267 | E266-V270 WeakPolarHBondContact O-CB 3.15Å; E266-V270 VanDerWaalsContact O-CG2 3.23Å; E266-V270 WeakPolarHBondContact O-CG2 3.47Å; E266-V270 PolarHBondContact O-N 2.77Å; I267-V270 PolarHBondContact O-N 2.66Å |
| 271 | V | 45.9 | Very low | 46.4 | Very low | 87 Ų | 87 | 127.7 Ų | 127.7 | 53% | 0.527 | 64% | 0.642 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.5 | -7 | 177 | -179.8 | 0 | 0 | 0 | 0 | 112.3 | I267 V273 | I267-V271 HydrophobicContact CG2-CG2 4.11Å; I267-V271 WeakPolarHBondContact O-CB 3.32Å; I267-V271 WeakPolarHBondContact O-CG2 3.26Å; I267-V271 PolarHBondContact O-N 2.85Å; V271-V273 HydrophobicContact CG1-CG2 3.91Å; V271-V273 WeakPolarHBondContact O-CG2 3.24Å; V271-V273 PolarHBondContact O-N 2.9Å |
| 272 | G | 45.7 | Very low | 45.1 | Very low | 60 Ų | 60 | 131 Ų | 131 | 62% | 0.619 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 60.7 | 44.3 | 165.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | L268 E269 | L268-G272 PolarHBondContact O-N 3.48Å; E269-G272 PolarHBondContact O-N 3.5Å |
| 273 | V | 45.3 | Very low | 43.7 | Very low | 85 Ų | 85 | 135.7 Ų | 135.7 | 52% | 0.515 | 67% | 0.671 | S | S | . | * | trans | -108.6 | 26.6 | -179 | -168.9 | 0 | 0 | 0 | 0 | 112.5 | V271 | V271-V273 HydrophobicContact CG1-CG2 3.91Å; V271-V273 WeakPolarHBondContact O-CG2 3.24Å; V271-V273 PolarHBondContact O-N 2.9Å | ||
| 274 | E | 46.3 | Very low | 42.6 | Very low | 131 Ų | 131 | 135 Ų | 135 | 61% | 0.612 | 68% | 0.677 | S | S | * | * | trans | -115.5 | 26.4 | 176.2 | -145.6 | 62 | -148.6 | 0 | 0 | 113.7 | ||||
| 275 | E | 44.7 | Very low | 41.5 | Very low | 185 Ų | 185 | 133.1 Ų | 133.1 | 86% | 0.864 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -108.6 | 18.2 | 170 | -151.8 | 167.2 | -156.2 | 0 | 0 | 113.1 | ||
| 276 | M | 40.6 | Very low | 40.1 | Very low | 167 Ų | 167 | 137.6 Ų | 137.6 | 82% | 0.823 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -132.5 | 23 | -179.4 | -81.5 | -72.7 | 175.5 | 0 | 0 | 114.3 | ||
| 277 | R | 34.3 | Very low | 38.6 | Very low | 199 Ų | 199 | 142.9 Ų | 142.9 | 75% | 0.751 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -118.9 | 79.6 | 175 | -65.3 | -166.2 | 178.5 | -153.3 | 1.8 | 113.3 | ||
| 278 | H | 34.8 | Very low | 37.2 | Very low | 148 Ų | 148 | 150.3 Ų | 150.3 | 69% | 0.685 | 74% | 0.735 | S | S | * | * | trans | 42.2 | 94.1 | 138.4 | -65 | -98 | 0 | 0 | 0 | 118.2 | F280 | H278-F280 HydrophobicContact CB-CD2 4.24Å; H278-F280 AromaticContact CE1-CE2 3.87Å; H278-F280 AromaticContact ND1-CD2 3.21Å; H278-F280 WeakPolarHBondContact ND1-CD2 3.33Å; H278-F280 AromaticContact ND1-CE2 3.32Å; H278-F280 VanDerWaalsContact ND1-CE2 3.32Å; H278-F280 WeakPolarHBondContact ND1-CE2 3.46Å | ||
| 279 | T | 30.3 | Very low | 36.2 | Very low | 135 Ų | 135 | 157.2 Ų | 157.2 | 83% | 0.828 | 75% | 0.754 | S | S | * | * | trans | -95 | 71.3 | 145.2 | -36.3 | 0 | 0 | 0 | 0 | 108.9 | V281 | T279-V281 HydrophobicContact CG2-CG2 4.24Å; T279-V281 PolarHBondContact O-N 2.85Å | ||
| 280 | F | 28.2 | Very low | 35.2 | Very low | 176 Ų | 176 | 154.9 Ų | 154.9 | 77% | 0.772 | 75% | 0.747 | S | S | * | * | trans | -81.3 | 92.5 | 159.4 | -86.4 | -96.2 | 0 | 0 | 0 | 107.9 | H278 | H278-F280 HydrophobicContact CB-CD2 4.24Å; H278-F280 AromaticContact CE1-CE2 3.87Å; H278-F280 AromaticContact ND1-CD2 3.21Å; H278-F280 WeakPolarHBondContact ND1-CD2 3.33Å; H278-F280 AromaticContact ND1-CE2 3.32Å; H278-F280 VanDerWaalsContact ND1-CE2 3.32Å; H278-F280 WeakPolarHBondContact ND1-CE2 3.46Å | ||
| 281 | V | 30.6 | Very low | 34.5 | Very low | 110 Ų | 110 | 153.8 Ų | 153.8 | 67% | 0.667 | 75% | 0.751 | S | S | * | * | trans | -102.3 | 105.1 | 156.5 | 178.1 | 0 | 0 | 0 | 0 | 107.1 | T279 H283 | T279-V281 HydrophobicContact CG2-CG2 4.24Å; T279-V281 PolarHBondContact O-N 2.85Å; V281-H283 PolarHBondContact O-N 2.88Å | ||
| 282 | R | 29.8 | Very low | 34.1 | Very low | 235 Ų | 235 | 158.6 Ų | 158.6 | 89% | 0.887 | 77% | 0.768 | S | S | * | * | trans | -72.2 | 106 | 173.7 | -157 | -171.2 | -163.1 | -166.1 | 5.6 | 107.8 | ||||
| 283 | H | 27.2 | Very low | 33.4 | Very low | 170 Ų | 170 | 158.3 Ų | 158.3 | 79% | 0.787 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -101.8 | 119.5 | 165.6 | -114.3 | -84.4 | 0 | 0 | 0 | 110 | V281 | V281-H283 PolarHBondContact O-N 2.88Š|
| 284 | V | 32.1 | Very low | 32.6 | Very low | 116 Ų | 116 | 164.2 Ų | 164.2 | 70% | 0.703 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 136.3 | 173.3 | 172.9 | 0 | 0 | 0 | 0 | 108.9 | E286 | V284-E286 PolarHBondContact O-N 2.77Š|
| 285 | P | 32.3 | Very low | 31.9 | Very low | 108 Ų | 108 | 165.6 Ų | 165.6 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 117.9 | 173.7 | 29.5 | -29.1 | 0 | 0 | 0 | 109.6 | ||
| 286 | E | 29.3 | Very low | 31.3 | Very low | 193 Ų | 193 | 162.4 Ų | 162.4 | 90% | 0.902 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 124.5 | 166.4 | -135.1 | 174.6 | -166.8 | 0 | 0 | 108.8 | V284 | V284-E286 PolarHBondContact O-N 2.77Š|
| 287 | W | 23.8 | Very low | 30.9 | Very low | 233 Ų | 233 | 160.4 Ų | 160.4 | 88% | 0.883 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 133.5 | -174 | -65 | 76.9 | 0 | 0 | 0 | 112.4 | ||
| 288 | R | 26.3 | Very low | 30.8 | Very low | 239 Ų | 239 | 158.8 Ų | 158.8 | 90% | 0.902 | 79% | 0.79 | S | S | * | * | trans | -127.5 | 126.7 | 151.6 | -153.6 | -150.6 | -65 | -90 | 3.5 | 110.3 | ||||
| 289 | R | 30 | Very low | 30.7 | Very low | 239 Ų | 239 | 155.7 Ų | 155.7 | 90% | 0.902 | 79% | 0.79 | S | S | * | * | trans | -62.9 | 146.3 | -175.8 | -94.2 | 175.2 | -80 | -154.2 | -6 | 113.9 | ||||
| 290 | D | 33.8 | Very low | 30.8 | Very low | 111 Ų | 111 | 156 Ų | 156 | 59% | 0.594 | 79% | 0.792 | S | S | * | * | trans | -63.7 | 166.7 | 178.3 | -48.4 | -72.7 | 0 | 0 | 0 | 115 | ||||
| 291 | A | 33 | Very low | 31.1 | Very low | 103 Ų | 103 | 158.5 Ų | 158.5 | 85% | 0.851 | 80% | 0.796 | S | S | * | * | S | Bend | -122.9 | 112.9 | 124.7 | 0 | 0 | 0 | 0 | 0 | 108.3 | |||
| 292 | Q | 36.8 | Very low | 31.2 | Very low | 187 Ų | 187 | 159.6 Ų | 159.6 | 87% | 0.874 | 80% | 0.799 | S | S | * | * | S | Bend | trans | 79.3 | 87.1 | 175.3 | -133.7 | 67.7 | 23.5 | 0 | 0 | 117 | ||
| 293 | G | 32.8 | Very low | 31.4 | Very low | 55 Ų | 55 | 154.5 Ų | 154.5 | 57% | 0.567 | 79% | 0.793 | S | S | * | * | trans | -68.6 | -172.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 294 | W | 28.1 | Very low | 31.6 | Very low | 208 Ų | 208 | 155 Ų | 155 | 79% | 0.788 | 79% | 0.793 | S | S | * | * | cis | -157.8 | 113.4 | -17 | -117.2 | 32.1 | 0 | 0 | 0 | 104.6 | ||||
| 295 | I | 30.4 | Very low | 31.6 | Very low | 161 Ų | 161 | 156 Ų | 156 | 83% | 0.826 | 80% | 0.8 | S | S | * | * | trans | -144.8 | 126.3 | 157.1 | -56.8 | -176.8 | 0 | 0 | 0 | 107.5 | ||||
| 296 | P | 33.5 | Very low | 31.5 | Very low | 118 Ų | 118 | 158.7 Ų | 158.7 | 77% | 0.766 | 81% | 0.807 | S | S | * | * | trans | -79.4 | 122.5 | -177.6 | -7.2 | 24.4 | 0 | 0 | 0 | 112.3 | I298 | P296-I298 PolarHBondContact O-N 2.9Š| ||
| 297 | S | 31.8 | Very low | 31.5 | Very low | 125 Ų | 125 | 157.3 Ų | 157.3 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | trans | -65.1 | 115.8 | 168.7 | -53.6 | 0 | 0 | 0 | 0 | 110.7 | A299 | S297-A299 PolarHBondContact O-N 2.77Š| ||
| 298 | I | 32 | Very low | 31.9 | Very low | 164 Ų | 164 | 155.2 Ų | 155.2 | 84% | 0.841 | 81% | 0.805 | S | S | * | * | trans | -75.3 | 119 | 171.6 | -72.1 | 173.7 | 0 | 0 | 0 | 109.3 | P296 | P296-I298 PolarHBondContact O-N 2.9Š| ||
| 299 | A | 31.9 | Very low | 32 | Very low | 83 Ų | 83 | 150.7 Ų | 150.7 | 69% | 0.686 | 80% | 0.803 | S | S | * | * | trans | 48 | 97.2 | 150.5 | 0 | 0 | 0 | 0 | 0 | 119.1 | S297 R301 | S297-A299 PolarHBondContact O-N 2.77Å; A299-R301 PolarHBondContact O-N 2.95Å | ||
| 300 | V | 32.9 | Very low | 32 | Very low | 142 Ų | 142 | 150.4 Ų | 150.4 | 86% | 0.861 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 117.9 | 149.7 | 173.1 | 0 | 0 | 0 | 0 | 107.8 | ||
| 301 | R | 35.1 | Very low | 31.8 | Very low | 229 Ų | 229 | 154 Ų | 154 | 86% | 0.864 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 127.5 | 168.4 | -76.2 | 175.1 | 160.5 | 176.9 | -6.4 | 109.1 | A299 V303 | A299-R301 PolarHBondContact O-N 2.95Å; R301-V303 PolarHBondContact O-N 3.06Å |
| 302 | D | 32.8 | Very low | 31.6 | Very low | 133 Ų | 133 | 159.6 Ų | 159.6 | 71% | 0.711 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 128.2 | 166.8 | -73.5 | -42.7 | 0 | 0 | 0 | 110.2 | F304 | D302-F304 HydrophobicContact CB-CD2 4.22Å; D302-F304 HydrophobicContact CB-CE2 3.51Å; D302-F304 HydrophobicContact CB-CZ 3.89Å |
| 303 | V | 33 | Very low | 31.3 | Very low | 128 Ų | 128 | 159.8 Ų | 159.8 | 78% | 0.776 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 120.3 | 171.7 | 172.9 | 0 | 0 | 0 | 0 | 107.4 | R301 | R301-V303 PolarHBondContact O-N 3.06Š|
| 304 | F | 32 | Very low | 31 | Very low | 179 Ų | 179 | 167 Ų | 167 | 79% | 0.785 | 83% | 0.826 | S | S | * | * | trans | -113.6 | 119.9 | 168.8 | -62.5 | -85.5 | 0 | 0 | 0 | 109 | D302 | D302-F304 HydrophobicContact CB-CD2 4.22Å; D302-F304 HydrophobicContact CB-CE2 3.51Å; D302-F304 HydrophobicContact CB-CZ 3.89Å | ||
| 305 | T | 31.7 | Very low | 31.2 | Very low | 137 Ų | 137 | 162 Ų | 162 | 84% | 0.84 | 82% | 0.822 | S | S | * | * | trans | -99.3 | 122.2 | 170.2 | 17.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 306 | I | 30.6 | Very low | 31.1 | Very low | 166 Ų | 166 | 163.8 Ų | 163.8 | 85% | 0.851 | 83% | 0.827 | S | S | * | * | trans | -90.2 | 120.5 | 170.9 | -64.1 | 173.7 | 0 | 0 | 0 | 108.4 | Q308 | I306-Q308 PolarHBondContact O-N 3.38Š| ||
| 307 | L | 29.8 | Very low | 31.1 | Very low | 163 Ų | 163 | 164 Ų | 164 | 85% | 0.853 | 83% | 0.831 | S | S | * | * | trans | -72.2 | 113.8 | 167.8 | -95.7 | 152 | 0 | 0 | 0 | 109.2 | V309 | L307-V309 PolarHBondContact O-N 2.86Å; L307-V309 VanDerWaalsContact O-N 3.15Å | ||
| 308 | Q | 32 | Very low | 31.6 | Very low | 189 Ų | 189 | 164 Ų | 164 | 88% | 0.883 | 83% | 0.829 | S | S | * | * | trans | -64.4 | 109 | 167.8 | -111.9 | 173.3 | -20.9 | 0 | 0 | 109.4 | I306 R310 | I306-Q308 PolarHBondContact O-N 3.38Å; Q308-R310 PolarHBondContact O-N 3.17Å; Q308-R310 VanDerWaalsContact O-N 3.12Å | ||
| 309 | V | 28.9 | Very low | 31.6 | Very low | 145 Ų | 145 | 160.9 Ų | 160.9 | 88% | 0.879 | 83% | 0.827 | S | S | * | * | trans | -72.3 | 100.7 | 165.9 | 176.9 | 0 | 0 | 0 | 0 | 107.3 | L307 | L307-V309 PolarHBondContact O-N 2.86Å; L307-V309 VanDerWaalsContact O-N 3.15Å | ||
| 310 | R | 29.8 | Very low | 31.7 | Very low | 233 Ų | 233 | 161.1 Ų | 161.1 | 88% | 0.879 | 83% | 0.829 | S | S | * | * | trans | -66.1 | 141.2 | 171.9 | -156.4 | 172.4 | 177.1 | 154.2 | -1.6 | 109.4 | Q308 | Q308-R310 PolarHBondContact O-N 3.17Å; Q308-R310 VanDerWaalsContact O-N 3.12Å | ||
| 311 | E | 30 | Very low | 31.7 | Very low | 186 Ų | 186 | 161.8 Ų | 161.8 | 87% | 0.869 | 83% | 0.828 | S | S | * | * | trans | -46.1 | 134.4 | -176.1 | -71 | 174.3 | 135.1 | 0 | 0 | 113.7 | E313 | E311-E313 PolarHBondContact O-N 2.92Š| ||
| 312 | R | 26.8 | Very low | 31.7 | Very low | 221 Ų | 221 | 155.8 Ų | 155.8 | 83% | 0.834 | 82% | 0.821 | S | S | * | * | trans | -82.8 | 87 | 176.1 | -173.9 | 179.5 | -169.7 | 168.1 | 4.6 | 109.4 | ||||
| 313 | E | 30.8 | Very low | 31.9 | Very low | 190 Ų | 190 | 157 Ų | 157 | 89% | 0.888 | 83% | 0.828 | S | S | * | * | trans | -74.4 | 135.6 | 158.2 | -79.7 | -174.5 | 138.4 | 0 | 0 | 109.8 | E311 | E311-E313 PolarHBondContact O-N 2.92Š| ||
| 314 | R | 27.5 | Very low | 32 | Very low | 207 Ų | 207 | 157.9 Ų | 157.9 | 78% | 0.781 | 83% | 0.828 | S | S | * | * | trans | -108.4 | 129.2 | -179.5 | -171.1 | 177.5 | -175 | 104.9 | 1.9 | 109.9 | ||||
| 315 | S | 31.1 | Very low | 32.1 | Very low | 102 Ų | 102 | 154.3 Ų | 154.3 | 71% | 0.713 | 83% | 0.825 | S | S | * | * | trans | 72.7 | 112 | 153.7 | 54.9 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 316 | E | 29.5 | Very low | 32.3 | Very low | 199 Ų | 199 | 152.8 Ų | 152.8 | 93% | 0.93 | 82% | 0.82 | S | S | * | * | -158.3 | 151.5 | 110.6 | -102.1 | 174.8 | 172.1 | 0 | 0 | 110.8 | |||||
| 317 | S | 32.5 | Very low | 32.5 | Very low | 122 Ų | 122 | 151.8 Ų | 151.8 | 85% | 0.853 | 82% | 0.821 | S | S | * | * | trans | -79.8 | 169 | -160 | -59.5 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 318 | P | 44 | Very low | 32.8 | Very low | 127 Ų | 127 | 151.8 Ų | 151.8 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | -99.1 | 146.5 | -165.2 | 36.7 | -29.6 | 0 | 0 | 0 | 114.7 | ||||
| 319 | A | 31.8 | Very low | 32.9 | Very low | 98 Ų | 98 | 152 Ų | 152 | 81% | 0.81 | 82% | 0.817 | S | S | * | * | trans | -160.6 | 126.8 | 149.5 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 320 | A | 32.6 | Very low | 33.2 | Very low | 88 Ų | 88 | 152.6 Ų | 152.6 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | trans | 66.2 | 117.8 | 141.1 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 321 | D | 32.8 | Very low | 33.5 | Very low | 155 Ų | 155 | 147.2 Ų | 147.2 | 83% | 0.829 | 81% | 0.806 | S | S | * | * | 87.7 | 127.1 | 126.4 | -80.3 | -16.3 | 0 | 0 | 0 | 123.5 | |||||
| 322 | S | 35.7 | Very low | 33.8 | Very low | 104 Ų | 104 | 147.3 Ų | 147.3 | 73% | 0.727 | 81% | 0.807 | S | S | * | * | trans | 96.2 | 97 | 140.9 | -59.1 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 323 | D | 37.8 | Very low | 34.1 | Very low | 159 Ų | 159 | 146.1 Ų | 146.1 | 85% | 0.85 | 81% | 0.81 | S | S | * | * | 48.5 | 126.9 | 119.8 | -72.5 | -15.2 | 0 | 0 | 0 | 123.8 | |||||
| 324 | N | 34.6 | Very low | 34.6 | Very low | 146 Ų | 146 | 144.2 Ų | 144.2 | 78% | 0.781 | 81% | 0.805 | S | S | * | * | trans | 83.5 | 104.4 | 132.2 | -162.6 | 64.3 | 0 | 0 | 0 | 119.7 | ||||
| 325 | S | 34.2 | Very low | 34.8 | Very low | 103 Ų | 103 | 139.2 Ų | 139.2 | 72% | 0.72 | 81% | 0.807 | S | S | * | * | 177.9 | 129.1 | 109.4 | -73.7 | 0 | 0 | 0 | 0 | 112 | |||||
| 326 | S | 36.4 | Very low | 34.9 | Very low | 105 Ų | 105 | 141.6 Ų | 141.6 | 73% | 0.734 | 81% | 0.811 | S | S | * | * | trans | -62.7 | 144.8 | 163.6 | 54 | 0 | 0 | 0 | 0 | 112 | ||||
| 327 | V | 34.5 | Very low | 34.9 | Very low | 145 Ų | 145 | 140.8 Ų | 140.8 | 88% | 0.879 | 81% | 0.807 | S | S | * | * | -159.5 | 141 | 116 | -156.5 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 328 | H | 36.6 | Very low | 34.7 | Very low | 163 Ų | 163 | 139.1 Ų | 139.1 | 76% | 0.755 | 80% | 0.8 | S | S | * | * | trans | -46.6 | 131.8 | 175.4 | -158.7 | 58.2 | 0 | 0 | 0 | 116.6 | ||||
| 329 | E | 34 | Very low | 34.1 | Very low | 193 Ų | 193 | 138.5 Ų | 138.5 | 90% | 0.902 | 80% | 0.799 | S | S | * | * | trans | -131.3 | 131.2 | 156.7 | -126.3 | 177 | 145.4 | 0 | 0 | 109.4 | ||||
| 330 | Q | 34.6 | Very low | 34.3 | Very low | 159 Ų | 159 | 140.1 Ų | 140.1 | 74% | 0.743 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -89 | 131.8 | -165.9 | -157.3 | 160.3 | 0.5 | 0 | 0 | 109.3 | Q332 | Q330-Q332 PolarHBondContact O-N 2.87Š|
| 331 | P | 35.1 | Very low | 34.2 | Very low | 119 Ų | 119 | 144.3 Ų | 144.3 | 77% | 0.773 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 117.9 | -178.1 | 28.1 | -30.6 | 0 | 0 | 0 | 110.2 | Q333 | P331-Q333 PolarHBondContact O-N 2.91Š|
| 332 | Q | 37.3 | Very low | 34.7 | Very low | 189 Ų | 189 | 141.6 Ų | 141.6 | 88% | 0.883 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 120.1 | 167 | -72 | -179.3 | -29.8 | 0 | 0 | 109.3 | Q330 | Q330-Q332 PolarHBondContact O-N 2.87Š|
| 333 | Q | 33.7 | Very low | 34.5 | Very low | 195 Ų | 195 | 142.8 Ų | 142.8 | 91% | 0.911 | 80% | 0.799 | S | S | * | * | trans | -81.1 | 115.7 | 171.8 | -82 | 171.5 | -25.9 | 0 | 0 | 109.6 | P331 | P331-Q333 PolarHBondContact O-N 2.91Š| ||
| 334 | I | 39.8 | Very low | 34.3 | Very low | 151 Ų | 151 | 143.4 Ų | 143.4 | 77% | 0.774 | 80% | 0.801 | S | S | * | * | trans | -88.2 | 113 | 165.8 | -62.4 | 167 | 0 | 0 | 0 | 106.8 | I336 | I334-I336 HydrophobicContact CG2-CG1 4.24Š| ||
| 335 | A | 32.3 | Very low | 34 | Very low | 101 Ų | 101 | 144.2 Ų | 144.2 | 84% | 0.835 | 81% | 0.805 | S | S | * | * | trans | -85.2 | 117.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 336 | I | 33.1 | Very low | 34 | Very low | 152 Ų | 152 | 147.3 Ų | 147.3 | 78% | 0.779 | 81% | 0.814 | S | S | * | * | trans | -102.4 | 114.1 | 169.6 | -56.8 | 176.1 | 0 | 0 | 0 | 107.3 | I334 | I334-I336 HydrophobicContact CG2-CG1 4.24Š| ||
| 337 | Q | 29.2 | Very low | 33.7 | Very low | 183 Ų | 183 | 145.7 Ų | 145.7 | 86% | 0.855 | 81% | 0.814 | S | S | * | * | trans | -89.3 | 110.3 | 171.7 | -173.3 | 175 | 1.4 | 0 | 0 | 108.7 | ||||
| 338 | A | 29.3 | Very low | 33.4 | Very low | 86 Ų | 86 | 146.2 Ų | 146.2 | 71% | 0.711 | 81% | 0.811 | S | S | * | * | trans | -100.2 | 113.5 | 170.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 339 | S | 29.8 | Very low | 32.9 | Very low | 115 Ų | 115 | 143.1 Ų | 143.1 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 122.6 | 166 | -101.2 | 0 | 0 | 0 | 0 | 108.9 | ||
| 340 | V | 36.5 | Very low | 32.7 | Very low | 132 Ų | 132 | 140.2 Ų | 140.2 | 80% | 0.8 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -101.1 | 116.8 | 168.1 | -178.8 | 0 | 0 | 0 | 0 | 107.5 | ||
| 341 | H | 31.9 | Very low | 32.3 | Very low | 176 Ų | 176 | 135.8 Ų | 135.8 | 82% | 0.815 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 129 | 170.1 | -126.9 | -81.4 | 0 | 0 | 0 | 108.6 | ||
| 342 | P | 41.3 | Very low | 32 | Very low | 97 Ų | 97 | 136.6 Ų | 136.6 | 63% | 0.63 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 150.7 | 172.4 | 28.3 | -29.7 | 0 | 0 | 0 | 110.8 | ||
| 343 | P | 33.2 | Very low | 31.6 | Very low | 129 Ų | 129 | 138.4 Ų | 138.4 | 84% | 0.838 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 138.6 | 179.3 | 30.2 | -31.9 | 0 | 0 | 0 | 110.2 | ||
| 344 | L | 31.9 | Very low | 31.4 | Very low | 173 Ų | 173 | 137.5 Ų | 137.5 | 91% | 0.906 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -84.6 | 135.9 | 176.4 | -78.4 | 168.2 | 0 | 0 | 0 | 110.9 | ||
| 345 | D | 30 | Very low | 30.6 | Very low | 162 Ų | 162 | 139.7 Ų | 139.7 | 87% | 0.866 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 146.7 | 178.7 | -129.2 | -104.4 | 0 | 0 | 0 | 112.3 | ||
| 346 | D | 32.9 | Very low | 30.6 | Very low | 169 Ų | 169 | 139.3 Ų | 139.3 | 90% | 0.904 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 121.1 | 171.9 | -114.9 | -67 | 0 | 0 | 0 | 109.7 | ||
| 347 | G | 31.1 | Very low | 30.8 | Very low | 70 Ų | 70 | 137.9 Ų | 137.9 | 72% | 0.722 | 80% | 0.801 | S | S | * | * | trans | 160.6 | 85 | 168.4 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 348 | D | 27.5 | Very low | 31.2 | Very low | 156 Ų | 156 | 135.5 Ų | 135.5 | 83% | 0.834 | 80% | 0.802 | S | S | * | * | trans | 78.8 | 127.7 | 134.7 | -138.3 | 21.2 | 0 | 0 | 0 | 124.6 | ||||
| 349 | C | 27.1 | Very low | 31.5 | Very low | 98 Ų | 98 | 136.8 Ų | 136.8 | 66% | 0.662 | 81% | 0.805 | S | S | * | * | trans | 65.3 | 115.6 | 152.5 | -79.6 | 0 | 0 | 0 | 0 | 125.9 | ||||
| 350 | C | 28.8 | Very low | 32 | Very low | 133 Ų | 133 | 137 Ų | 137 | 90% | 0.899 | 80% | 0.804 | S | S | * | * | trans | 64.7 | 116.2 | 135.6 | -65.3 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 351 | G | 26.9 | Very low | 32.1 | Very low | 66 Ų | 66 | 136.7 Ų | 136.7 | 68% | 0.68 | 81% | 0.805 | S | S | * | * | trans | 177.2 | 103.5 | 159 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 352 | V | 29.1 | Very low | 32.8 | Very low | 135 Ų | 135 | 134.5 Ų | 134.5 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | -70.3 | 129.5 | -175 | 171.5 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 353 | Y | 28.2 | Very low | 32.2 | Very low | 227 Ų | 227 | 135.4 Ų | 135.4 | 89% | 0.89 | 82% | 0.815 | S | S | * | * | trans | -159.9 | 114.7 | 134.1 | 11 | -102.1 | 0 | 0 | 0 | 110.6 | ||||
| 354 | E | 29.5 | Very low | 32.7 | Very low | 176 Ų | 176 | 134.8 Ų | 134.8 | 82% | 0.822 | 81% | 0.811 | S | S | * | * | trans | -116.7 | 126.7 | 172.6 | -172.4 | 178.5 | -176.9 | 0 | 0 | 106.7 | ||||
| 355 | E | 23.9 | Very low | 33 | Very low | 197 Ų | 197 | 131.8 Ų | 131.8 | 92% | 0.921 | 80% | 0.804 | S | S | * | * | trans | -131.1 | 114.5 | 169.7 | -160.2 | 163.8 | 158.8 | 0 | 0 | 109.4 | ||||
| 356 | S | 31.5 | Very low | 33.4 | Very low | 93 Ų | 93 | 130.4 Ų | 130.4 | 65% | 0.65 | 80% | 0.804 | S | S | * | * | trans | -105.6 | 158.1 | 177.3 | -79.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 357 | P | 38.2 | Very low | 33.4 | Very low | 122 Ų | 122 | 127.7 Ų | 127.7 | 79% | 0.792 | 80% | 0.798 | S | S | * | * | trans | -85.1 | 167.5 | -161.4 | 33.9 | -35.5 | 0 | 0 | 0 | 115.4 | ||||
| 358 | P | 36.2 | Very low | 34.2 | Very low | 134 Ų | 134 | 130 Ų | 130 | 87% | 0.87 | 80% | 0.801 | S | S | * | * | trans | -88.5 | 152.5 | -165.6 | 34.9 | -34.2 | 0 | 0 | 0 | 115 | ||||
| 359 | S | 36.8 | Very low | 34.6 | Very low | 113 Ų | 113 | 128 Ų | 128 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | trans | -110.9 | 162.9 | 173.8 | 54.3 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 360 | P | 39.3 | Very low | 35.4 | Very low | 120 Ų | 120 | 129.2 Ų | 129.2 | 78% | 0.779 | 81% | 0.806 | S | S | * | * | trans | -88.3 | 169.3 | -166.6 | 36 | -33.8 | 0 | 0 | 0 | 114.7 | ||||
| 361 | P | 39.5 | Very low | 36.4 | Very low | 125 Ų | 125 | 128.2 Ų | 128.2 | 81% | 0.812 | 80% | 0.797 | S | S | * | * | trans | -89.7 | 171.1 | -157.9 | 36.4 | -35.6 | 0 | 0 | 0 | 116 | ||||
| 362 | P | 45.2 | Very low | 36.7 | Very low | 129 Ų | 129 | 132.4 Ų | 132.4 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | trans | -111.4 | 177.4 | -152.1 | 41.1 | -32.2 | 0 | 0 | 0 | 115.6 | ||||
| 363 | S | 30.1 | Very low | 36.7 | Very low | 116 Ų | 116 | 130.9 Ų | 130.9 | 81% | 0.811 | 80% | 0.799 | S | S | * | * | trans | -130.4 | 155.5 | 162.2 | 56.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 364 | P | 43.2 | Very low | 37.5 | Very low | 117 Ų | 117 | 125.4 Ų | 125.4 | 76% | 0.76 | 79% | 0.791 | S | S | * | * | trans | -108.9 | 142.9 | -145 | 37.8 | -29.9 | 0 | 0 | 0 | 117.1 | ||||
| 365 | S | 38 | Very low | 37.4 | Very low | 109 Ų | 109 | 124.9 Ų | 124.9 | 76% | 0.762 | 79% | 0.793 | S | S | * | * | trans | 23.2 | 150.4 | 140.9 | 64.4 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 366 | P | 37.8 | Very low | 38.3 | Very low | 133 Ų | 133 | 120 Ų | 120 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | -140.6 | 169.3 | 90.3 | 34 | -16.2 | 0 | 0 | 0 | 116.2 | |||||
| 367 | S | 34.4 | Very low | 38.1 | Very low | 112 Ų | 112 | 122.9 Ų | 122.9 | 78% | 0.783 | 79% | 0.786 | S | S | * | * | trans | -100.7 | -164.8 | -171.5 | 48.8 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 368 | P | 47.3 | Very low | 37.6 | Very low | 120 Ų | 120 | 124.1 Ų | 124.1 | 78% | 0.779 | 78% | 0.781 | S | S | * | * | -122.7 | 177.4 | -73.7 | 36.5 | -19.5 | 0 | 0 | 0 | 114 | |||||
| 369 | S | 35.9 | Very low | 37.2 | Very low | 112 Ų | 112 | 124.3 Ų | 124.3 | 78% | 0.783 | 77% | 0.77 | S | S | * | * | trans | -71.6 | 172.2 | -177.2 | 32 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 370 | P | 43.8 | Very low | 36.7 | Very low | 125 Ų | 125 | 125.1 Ų | 125.1 | 81% | 0.812 | 76% | 0.761 | S | S | * | * | -151.6 | -164.5 | 110.1 | 49 | -30.8 | 0 | 0 | 0 | 113.9 | |||||
| 371 | P | 50.1 | Low | 36.2 | Very low | 112 Ų | 112 | 127 Ų | 127 | 73% | 0.727 | 76% | 0.76 | S | S | * | * | -133.4 | -179.3 | -121.7 | 28.2 | 0.4 | 0 | 0 | 0 | 118.8 | |||||
| 372 | L | 31.8 | Very low | 35.5 | Very low | 153 Ų | 153 | 127.2 Ų | 127.2 | 80% | 0.801 | 76% | 0.758 | S | S | * | * | trans | 89.6 | 115.5 | 144.2 | -88.1 | 146.6 | 0 | 0 | 0 | 125.2 | ||||
| 373 | S | 30.8 | Very low | 34.7 | Very low | 104 Ų | 104 | 125.5 Ų | 125.5 | 73% | 0.727 | 76% | 0.755 | S | S | * | * | trans | 85.1 | 165.9 | 131.7 | 65.4 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 374 | P | 44.7 | Very low | 34.5 | Very low | 111 Ų | 111 | 128.9 Ų | 128.9 | 72% | 0.721 | 76% | 0.758 | S | S | * | * | -136.2 | 156 | -75.3 | 38.8 | -21.1 | 0 | 0 | 0 | 117.7 | |||||
| 375 | L | 26.8 | Very low | 33.7 | Very low | 166 Ų | 166 | 132.7 Ų | 132.7 | 87% | 0.869 | 77% | 0.766 | S | S | * | * | trans | 53.8 | 168.9 | 149 | -84.7 | 171.2 | 0 | 0 | 0 | 121.2 | ||||
| 376 | P | 43.3 | Very low | 33.2 | Very low | 95 Ų | 95 | 136.7 Ų | 136.7 | 62% | 0.617 | 77% | 0.773 | S | S | * | * | cis | -144.5 | -171.9 | -8.3 | 42.1 | -21.3 | 0 | 0 | 0 | 117.7 | ||||
| 377 | L | 26.8 | Very low | 32.7 | Very low | 153 Ų | 153 | 139.6 Ų | 139.6 | 80% | 0.801 | 78% | 0.775 | S | S | * | * | trans | 70.7 | 144.1 | 155.3 | -67.3 | 163.2 | 0 | 0 | 0 | 118.4 | ||||
| 378 | E | 28.2 | Very low | 32.4 | Very low | 148 Ų | 148 | 142.6 Ų | 142.6 | 69% | 0.692 | 78% | 0.78 | S | S | * | * | cis | -169 | 153.1 | 40.2 | -132.7 | 157.6 | 143.7 | 0 | 0 | 112 | ||||
| 379 | E | 27.5 | Very low | 31.5 | Very low | 138 Ų | 138 | 140.3 Ų | 140.3 | 65% | 0.645 | 78% | 0.778 | S | S | * | * | trans | 57.2 | 146.5 | 143.3 | -76.7 | 175.9 | 139 | 0 | 0 | 122.3 | ||||
| 380 | Q | 26.6 | Very low | 31.2 | Very low | 130 Ų | 130 | 140.3 Ų | 140.3 | 61% | 0.607 | 78% | 0.778 | S | S | * | * | cis | -172.9 | 149.6 | 8.3 | -125.4 | 153.5 | -6.3 | 0 | 0 | 110.8 | ||||
| 381 | Q | 27.8 | Very low | 30.5 | Very low | 160 Ų | 160 | 143.6 Ų | 143.6 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | trans | 54.8 | 153.8 | 139.5 | -80.1 | 170.6 | -46.2 | 0 | 0 | 122.2 | ||||
| 382 | V | 25.3 | Very low | 29.7 | Very low | 128 Ų | 128 | 143.5 Ų | 143.5 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | cis | -175.5 | 158.2 | -16.5 | 131.6 | 0 | 0 | 0 | 0 | 106 | ||||
| 383 | A | 28.1 | Very low | 29.5 | Very low | 94 Ų | 94 | 140.8 Ų | 140.8 | 78% | 0.777 | 79% | 0.791 | S | S | * | * | trans | 110.7 | 132.4 | 150.8 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 384 | Q | 25.3 | Very low | 29.6 | Very low | 187 Ų | 187 | 140.9 Ų | 140.9 | 87% | 0.874 | 80% | 0.798 | S | S | * | * | trans | -73.5 | 154.1 | 174.5 | -65.8 | 157.8 | -70.1 | 0 | 0 | 112.3 | ||||
| 385 | E | 27.3 | Very low | 28.8 | Very low | 196 Ų | 196 | 144.3 Ų | 144.3 | 92% | 0.916 | 80% | 0.804 | S | S | * | * | -168.7 | 143.6 | 122.2 | -110.5 | 167.7 | 172.6 | 0 | 0 | 111.7 | |||||
| 386 | E | 28.3 | Very low | 28.8 | Very low | 194 Ų | 194 | 145 Ų | 145 | 91% | 0.907 | 80% | 0.803 | S | S | * | * | trans | -66.2 | 139.1 | 172.3 | -69.7 | 173.7 | 127.9 | 0 | 0 | 110.9 | ||||
| 387 | E | 26.4 | Very low | 28.1 | Very low | 194 Ų | 194 | 148 Ų | 148 | 91% | 0.907 | 81% | 0.812 | S | S | * | * | trans | -156.7 | 145.7 | 136.1 | -125.6 | -174.8 | -179.2 | 0 | 0 | 113 | ||||
| 388 | I | 29.1 | Very low | 28.1 | Very low | 175 Ų | 175 | 147.4 Ų | 147.4 | 90% | 0.897 | 81% | 0.808 | S | S | * | * | trans | -68.4 | 129.1 | -175.8 | -69.9 | 158.1 | 0 | 0 | 0 | 110.3 | ||||
| 389 | G | 28.4 | Very low | 28.1 | Very low | 71 Ų | 71 | 145 Ų | 145 | 73% | 0.732 | 81% | 0.808 | S | S | * | * | trans | -153.4 | 100.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q391 | G389-Q391 PolarHBondContact O-N 3.21Š| ||
| 390 | S | 28.6 | Very low | 28.3 | Very low | 113 Ų | 113 | 147.7 Ų | 147.7 | 79% | 0.79 | 82% | 0.818 | S | S | * | * | trans | -50.6 | 128.5 | 169.9 | 54.5 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 391 | Q | 28.7 | Very low | 28.6 | Very low | 194 Ų | 194 | 146.5 Ų | 146.5 | 91% | 0.907 | 82% | 0.819 | S | S | * | * | trans | -158.7 | 127.2 | 150.2 | -112.4 | 161.6 | 12.6 | 0 | 0 | 111.5 | G389 | G389-Q391 PolarHBondContact O-N 3.21Š| ||
| 392 | A | 34.6 | Very low | 28.9 | Very low | 109 Ų | 109 | 143.7 Ų | 143.7 | 90% | 0.901 | 82% | 0.815 | S | S | * | * | trans | -60.1 | 131.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 393 | A | 27.6 | Very low | 29.5 | Very low | 96 Ų | 96 | 143.5 Ų | 143.5 | 79% | 0.793 | 82% | 0.816 | S | S | * | * | trans | -130.1 | 125.8 | 164 | 0 | 0 | 0 | 0 | 0 | 108.1 | E395 | A393-E395 PolarHBondContact O-N 3.3Š| ||
| 394 | A | 32.4 | Very low | 30.5 | Very low | 107 Ų | 107 | 141.2 Ų | 141.2 | 88% | 0.884 | 79% | 0.794 | S | S | * | * | trans | -63.1 | 118.5 | -177.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 395 | E | 26.9 | Very low | 31.2 | Very low | 183 Ų | 183 | 139.8 Ų | 139.8 | 86% | 0.855 | 79% | 0.788 | S | S | * | * | trans | -89.1 | 119.3 | 159.5 | -91 | 179.3 | 128 | 0 | 0 | 109.2 | A393 I397 | A393-E395 PolarHBondContact O-N 3.3Å; E395-I397 PolarHBondContact O-N 3.08Å; E395-I397 VanDerWaalsContact O-N 3.09Å | ||
| 396 | Q | 27.6 | Very low | 32.1 | Very low | 181 Ų | 181 | 132.7 Ų | 132.7 | 85% | 0.846 | 76% | 0.757 | S | S | * | * | trans | -61.6 | 105.6 | 166.9 | -74.2 | -176.2 | -15.3 | 0 | 0 | 108.9 | I398 | Q396-I398 VanDerWaalsContact C-N 3.34Å; Q396-I398 PolarHBondContact O-N 2.74Å | ||
| 397 | I | 28.2 | Very low | 32.9 | Very low | 157 Ų | 157 | 129.7 Ų | 129.7 | 81% | 0.805 | 74% | 0.742 | S | S | * | * | trans | -71.9 | 96.7 | 164.2 | -58.8 | 173.6 | 0 | 0 | 0 | 106.2 | E395 S399 | E395-I397 PolarHBondContact O-N 3.08Å; E395-I397 VanDerWaalsContact O-N 3.09Å; I397-S399 PolarHBondContact O-N 3.02Å | ||
| 398 | I | 28 | Very low | 33.7 | Very low | 140 Ų | 140 | 126.7 Ų | 126.7 | 72% | 0.718 | 72% | 0.723 | S | S | * | * | trans | -57.6 | 106.7 | 161.5 | -69.7 | 166.8 | 0 | 0 | 0 | 106 | Q396 K400 | Q396-I398 VanDerWaalsContact C-N 3.34Å; Q396-I398 PolarHBondContact O-N 2.74Å; I398-K400 VanDerWaalsContact C-N 3.27Å; I398-K400 PolarHBondContact O-N 2.8Å | ||
| 399 | S | 28.3 | Very low | 34.3 | Very low | 98 Ų | 98 | 124.4 Ų | 124.4 | 69% | 0.685 | 71% | 0.709 | S | S | * | * | trans | -63.7 | 89.4 | 173.7 | 57.3 | 0 | 0 | 0 | 0 | 108.7 | I397 T401 | I397-S399 PolarHBondContact O-N 3.02Å; S399-T401 PolarHBondContact O-N 3.12Å | ||
| 400 | K | 30.2 | Very low | 34.5 | Very low | 194 Ų | 194 | 125.4 Ų | 125.4 | 84% | 0.843 | 70% | 0.704 | S | S | * | * | trans | -70.9 | 88.1 | 161.6 | -111.2 | 177.7 | 176.3 | 174.6 | 0 | 106.9 | I398 | I398-K400 VanDerWaalsContact C-N 3.27Å; I398-K400 PolarHBondContact O-N 2.8Å | ||
| 401 | T | 33.5 | Very low | 34.7 | Very low | 105 Ų | 105 | 127.2 Ų | 127.2 | 64% | 0.644 | 70% | 0.7 | S | S | * | * | trans | -58.6 | 122.1 | 165.5 | -40.6 | 0 | 0 | 0 | 0 | 107.1 | S399 | S399-T401 PolarHBondContact O-N 3.12Š| ||
| 402 | P | 34.5 | Very low | 34.8 | Very low | 101 Ų | 101 | 127.5 Ų | 127.5 | 66% | 0.656 | 72% | 0.715 | S | S | * | * | trans | -64.5 | 149.1 | 176.4 | 26.8 | -31.9 | 0 | 0 | 0 | 109.2 | C404 | P402-C404 PolarHBondContact O-N 3.16Š| ||
| 403 | P | 38.3 | Very low | 34.8 | Very low | 124 Ų | 124 | 128.5 Ų | 128.5 | 81% | 0.805 | 71% | 0.705 | S | S | * | * | trans | -62.2 | 115 | 177 | 25.5 | -31.6 | 0 | 0 | 0 | 108.8 | Q405 | P403-Q405 PolarHBondContact O-N 3.31Š| ||
| 404 | C | 49.1 | Very low | 35.1 | Very low | 47 Ų | 47 | 130.2 Ų | 130.2 | 32% | 0.318 | 70% | 0.701 | S | S | . | * | trans | -63.4 | 102.9 | 172.8 | -89.5 | 0 | 0 | 0 | 0 | 108.8 | C78 P402 V406 | C78-C404 HydrophobicContact CB-CB 4.4Å; C78-C404 WeakPolarHBondContact CB-SG 3.38Å; C78-C404 VanDerWaalsContact SG-CA 3.55Å; C78-C404 WeakPolarHBondContact SG-CB 3.1Å; C78-C404 CovalentContact SG-SG 2.05Å; C78-C404 PolarHBondContact SG-SG 2.89Å; P402-C404 PolarHBondContact O-N 3.16Å; C404-V406 PolarHBondContact O-N 3.44Å | ||
| 405 | Q | 39.8 | Very low | 35.3 | Very low | 157 Ų | 157 | 131.4 Ų | 131.4 | 73% | 0.734 | 69% | 0.69 | S | S | * | * | trans | -71.8 | 107.9 | 168.3 | -92 | -177.5 | -22 | 0 | 0 | 108.5 | P403 F407 | P403-Q405 PolarHBondContact O-N 3.31Å; Q405-F407 HydrophobicContact CB-CE2 4.46Å | ||
| 406 | V | 45.9 | Very low | 35.8 | Very low | 46 Ų | 46 | 128.4 Ų | 128.4 | 28% | 0.279 | 68% | 0.681 | S | S | . | * | trans | -88.4 | 121.5 | 178.1 | -171.7 | 0 | 0 | 0 | 0 | 109.1 | L80 C404 Y408 | L80-V406 HydrophobicContact CD1-CG2 4.15Å; L80-V406 HydrophobicContact CG-CG2 4.49Å; C404-V406 PolarHBondContact O-N 3.44Å; V406-Y408 HydrophobicContact CB-CD2 4.25Å; V406-Y408 HydrophobicContact CB-CE2 3.77Å; V406-Y408 HydrophobicContact CG1-CD1 4.23Å; V406-Y408 HydrophobicContact CG1-CD2 3.7Å; V406-Y408 HydrophobicContact CG1-CE1 3.87Å; V406-Y408 HydrophobicContact CG1-CE2 3.3Å; V406-Y408 HydrophobicContact CG1-CG 4.15Å | ||
| 407 | F | 45.3 | Very low | 36.3 | Very low | 131 Ų | 131 | 125.1 Ų | 125.1 | 58% | 0.575 | 67% | 0.67 | S | S | * | * | trans | -94 | 102.8 | 169.1 | -66.5 | -85.8 | 0 | 0 | 0 | 108.4 | Q405 | Q405-F407 HydrophobicContact CB-CE2 4.46Š| ||
| 408 | Y | 43.5 | Very low | 36.8 | Very low | 131 Ų | 131 | 123 Ų | 123 | 51% | 0.514 | 66% | 0.661 | S | S | . | * | trans | -88 | 105.4 | 168.9 | -65.4 | -80.1 | 0 | 0 | 0 | 108.6 | V406 | V406-Y408 HydrophobicContact CB-CD2 4.25Å; V406-Y408 HydrophobicContact CB-CE2 3.77Å; V406-Y408 HydrophobicContact CG1-CD1 4.23Å; V406-Y408 HydrophobicContact CG1-CD2 3.7Å; V406-Y408 HydrophobicContact CG1-CE1 3.87Å; V406-Y408 HydrophobicContact CG1-CE2 3.3Å; V406-Y408 HydrophobicContact CG1-CG 4.15Å | ||
| 409 | E | 40.2 | Very low | 37.5 | Very low | 128 Ų | 128 | 121.8 Ų | 121.8 | 60% | 0.598 | 66% | 0.657 | S | S | * | * | trans | -108.9 | 88.5 | 166.7 | -159.4 | 148 | -157.9 | 0 | 0 | 108.3 | H411 | E409-H411 PolarHBondContact O-N 3.29Š| ||
| 410 | S | 34.3 | Very low | 38.2 | Very low | 91 Ų | 91 | 123.6 Ų | 123.6 | 64% | 0.636 | 66% | 0.655 | S | S | * | * | trans | -86 | 99.7 | 173.3 | 178.3 | 0 | 0 | 0 | 0 | 108.3 | V412 | S410-V412 PolarHBondContact O-N 3.37Š| ||
| 411 | H | 31.1 | Very low | 38.8 | Very low | 151 Ų | 151 | 117.8 Ų | 117.8 | 70% | 0.699 | 64% | 0.64 | S | S | * | * | trans | -80 | 107.4 | 164.5 | -72.4 | -70.3 | 0 | 0 | 0 | 108.5 | E409 | E409-H411 PolarHBondContact O-N 3.29Š| ||
| 412 | V | 30.7 | Very low | 39.3 | Very low | 201 Ų | 201 | 118.9 Ų | 118.9 | 100% | 1.218 | 64% | 0.639 | S | S | * | * | trans | -94.3 | 0 | 163.7 | 178.6 | 0 | 0 | 0 | 0 | 108.5 | S410 | S410-V412 PolarHBondContact O-N 3.37Š|
Retrieved 412 of 412 residues in 139.4 ms
(Link to these results)