| 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 | 37.9 | Very low | 35.1 | Very low | 249 Ų | 249 | 130.5 Ų | 130.5 | 100% | 1.227 | 85% | 0.853 | S | S | * | * | 0 | 125.9 | 0 | -64.3 | -177.7 | -169.3 | 0 | 0 | 106.6 | |||||
| 2 | A | 32.3 | Very low | 35.6 | Very low | 93 Ų | 93 | 131.2 Ų | 131.2 | 77% | 0.769 | 85% | 0.852 | S | S | * | * | cis | -149.2 | 134.4 | 6.4 | 0 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 3 | A | 31.4 | Very low | 36 | Very low | 107 Ų | 107 | 130.2 Ų | 130.2 | 88% | 0.884 | 84% | 0.842 | S | S | * | * | 84.5 | 129.7 | 100.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 4 | A | 33.8 | Very low | 36.6 | Very low | 97 Ų | 97 | 128.9 Ų | 128.9 | 80% | 0.802 | 83% | 0.833 | S | S | * | * | trans | -86.1 | 160.7 | -163.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 5 | A | 32.3 | Very low | 37.6 | Very low | 99 Ų | 99 | 131.7 Ų | 131.7 | 82% | 0.818 | 84% | 0.836 | S | S | * | * | trans | -150 | 93.8 | 148.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 6 | V | 36.5 | Very low | 38.8 | Very low | 133 Ų | 133 | 136.1 Ų | 136.1 | 81% | 0.806 | 83% | 0.832 | S | S | * | * | trans | -94.1 | 114.3 | 168.1 | 171.1 | 0 | 0 | 0 | 0 | 107.5 | R8 | V6-R8 PolarHBondContact O-N 2.68Š| ||
| 7 | V | 37.3 | Very low | 40.1 | Very low | 140 Ų | 140 | 131.3 Ų | 131.3 | 85% | 0.848 | 82% | 0.816 | S | S | * | * | trans | -68.8 | 110.4 | 170.4 | 173.6 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 8 | R | 36.9 | Very low | 40.6 | Very low | 236 Ų | 236 | 131.8 Ų | 131.8 | 89% | 0.891 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -82 | 123.4 | 169.5 | -100.9 | -176.5 | -176.3 | -174.2 | 1.7 | 109.1 | V6 | V6-R8 PolarHBondContact O-N 2.68Š|
| 9 | G | 34.8 | Very low | 41.3 | Very low | 74 Ų | 74 | 128.9 Ų | 128.9 | 76% | 0.763 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 139.9 | 169.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | A11 | G9-A11 PolarHBondContact O-N 3.02Š|
| 10 | S | 36.5 | Very low | 42.3 | Very low | 115 Ų | 115 | 127.9 Ų | 127.9 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -67 | 116.4 | 173.8 | 54.5 | 0 | 0 | 0 | 0 | 110.3 | T12 | S10-T12 PolarHBondContact O-N 3.32Š|
| 11 | A | 36 | Very low | 43 | Very low | 93 Ų | 93 | 125 Ų | 125 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | trans | -78.5 | 108.9 | 166.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | G9 V13 | G9-A11 PolarHBondContact O-N 3.02Å; A11-V13 PolarHBondContact O-N 3.28Å | ||
| 12 | T | 40.7 | Very low | 43.7 | Very low | 138 Ų | 138 | 119.9 Ų | 119.9 | 85% | 0.847 | 78% | 0.777 | S | S | * | * | trans | -66.3 | 114.3 | 169 | 8.1 | 0 | 0 | 0 | 0 | 109.3 | S10 | S10-T12 PolarHBondContact O-N 3.32Š| ||
| 13 | V | 41.9 | Very low | 45.4 | Very low | 119 Ų | 119 | 123.7 Ų | 123.7 | 72% | 0.721 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 133 | 171.1 | 178.1 | 0 | 0 | 0 | 0 | 108.4 | A11 I15 | A11-V13 PolarHBondContact O-N 3.28Å; V13-I15 PolarHBondContact O-N 2.85Å |
| 14 | P | 44 | Very low | 46.3 | Very low | 111 Ų | 111 | 124.8 Ų | 124.8 | 72% | 0.721 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 124.5 | 177.2 | 25.6 | -30.4 | 0 | 0 | 0 | 109.8 | R16 | P14-R16 PolarHBondContact O-N 3.02Š|
| 15 | I | 50.7 | Low | 46.8 | Very low | 171 Ų | 171 | 124.7 Ų | 124.7 | 88% | 0.877 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 118.1 | 175.5 | -63.4 | 169.9 | 0 | 0 | 0 | 107.6 | V13 | V13-I15 PolarHBondContact O-N 2.85Š|
| 16 | R | 58.1 | Low | 47.1 | Very low | 203 Ų | 203 | 129.4 Ų | 129.4 | 77% | 0.766 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 134.7 | 178.2 | -70 | -177.4 | -178.7 | -179.6 | -0.8 | 110.5 | P14 | P14-R16 PolarHBondContact O-N 3.02Š|
| 17 | G | 60.9 | Low | 47.1 | Very low | 54 Ų | 54 | 128.5 Ų | 128.5 | 56% | 0.557 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 161 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 18 | P | 48.7 | Very low | 47.1 | Very low | 140 Ų | 140 | 127.4 Ų | 127.4 | 91% | 0.909 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67 | 133.6 | 179.5 | 27 | -32.2 | 0 | 0 | 0 | 111.4 | ||
| 19 | G | 54.2 | Low | 47.1 | Very low | 77 Ų | 77 | 122.8 Ų | 122.8 | 79% | 0.794 | 77% | 0.767 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 132.6 | -5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 117 | G21 | G19-G21 VanDerWaalsContact C-N 3.33Å; G19-G21 PolarHBondContact O-N 2.86Å |
| 20 | D | 61.5 | Low | 46.8 | Very low | 109 Ų | 109 | 125.5 Ų | 125.5 | 58% | 0.583 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -86 | 6.7 | -174.9 | -166 | 24.2 | 0 | 0 | 0 | 114.5 | M22 | D20-M22 PolarHBondContact O-N 3.44Š|
| 21 | G | 57.3 | Low | 46.7 | Very low | 68 Ų | 68 | 127.5 Ų | 127.5 | 70% | 0.701 | 77% | 0.769 | S | S | * | * | S | Bend | trans | 59.2 | 13.9 | 172 | 0 | 0 | 0 | 0 | 0 | 116.3 | G19 | G19-G21 VanDerWaalsContact C-N 3.33Å; G19-G21 PolarHBondContact O-N 2.86Å |
| 22 | M | 51.2 | Low | 46.5 | Very low | 140 Ų | 140 | 131.5 Ų | 131.5 | 69% | 0.69 | 77% | 0.772 | S | S | * | * | trans | -114.2 | 29.5 | 179 | -72.8 | -122.8 | 72.1 | 0 | 0 | 112 | D20 T24 | D20-M22 PolarHBondContact O-N 3.44Å; M22-T24 PolarHBondContact O-N 3.37Å; M22-T24 VanDerWaalsContact O-N 3.1Å | ||
| 23 | E | 67.7 | Low | 46 | Very low | 173 Ų | 173 | 131.1 Ų | 131.1 | 81% | 0.808 | 77% | 0.77 | S | S | * | * | trans | -73.4 | 100.6 | 173.6 | 53 | -151.7 | 155.4 | 0 | 0 | 110.2 | A25 | E23-A25 PolarHBondContact O-N 3.44Š| ||
| 24 | T | 51.9 | Low | 45.6 | Very low | 130 Ų | 130 | 132.3 Ų | 132.3 | 80% | 0.798 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 117.2 | 164.5 | 43.4 | 0 | 0 | 0 | 0 | 107.9 | M22 K26 | M22-T24 PolarHBondContact O-N 3.37Å; M22-T24 VanDerWaalsContact O-N 3.1Å; T24-K26 PolarHBondContact O-N 3.36Å |
| 25 | A | 43.7 | Very low | 44.9 | Very low | 96 Ų | 96 | 133.4 Ų | 133.4 | 79% | 0.793 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -54 | 126.5 | 173 | 0 | 0 | 0 | 0 | 0 | 109.4 | E23 | E23-A25 PolarHBondContact O-N 3.44Š|
| 26 | K | 39.2 | Very low | 43.9 | Very low | 197 Ų | 197 | 132.3 Ų | 132.3 | 86% | 0.857 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 132.4 | 171.3 | -85.9 | 176.5 | 174.3 | 174.7 | 0 | 108.9 | T24 | T24-K26 PolarHBondContact O-N 3.36Š|
| 27 | P | 36.1 | Very low | 42.6 | Very low | 114 Ų | 114 | 127.3 Ų | 127.3 | 74% | 0.74 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 139.7 | 171.7 | 27.9 | -31.5 | 0 | 0 | 0 | 108.9 | V29 | P27-V29 PolarHBondContact O-N 2.92Š|
| 28 | P | 38 | Very low | 41.4 | Very low | 118 Ų | 118 | 130.3 Ų | 130.3 | 77% | 0.766 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 136.7 | 174.4 | 26.8 | -31.2 | 0 | 0 | 0 | 109.8 | T30 | P28-T30 PolarHBondContact O-N 3.37Å; P28-T30 VanDerWaalsContact O-N 3.16Å |
| 29 | V | 35.4 | Very low | 40.6 | Very low | 138 Ų | 138 | 129.5 Ų | 129.5 | 84% | 0.836 | 78% | 0.778 | S | S | * | * | trans | -60.4 | 112 | 171 | 175.2 | 0 | 0 | 0 | 0 | 108.2 | P27 L31 | P27-V29 PolarHBondContact O-N 2.92Å; V29-L31 PolarHBondContact O-N 3.3Å | ||
| 30 | T | 29.9 | Very low | 39.7 | Very low | 131 Ų | 131 | 131.2 Ų | 131.2 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | trans | -70.1 | 109 | 169.7 | 32.6 | 0 | 0 | 0 | 0 | 109.4 | P28 | P28-T30 PolarHBondContact O-N 3.37Å; P28-T30 VanDerWaalsContact O-N 3.16Å | ||
| 31 | L | 33.9 | Very low | 38 | Very low | 157 Ų | 157 | 135.1 Ų | 135.1 | 82% | 0.822 | 79% | 0.787 | S | S | * | * | trans | -79.2 | 117.1 | 160.9 | -103.5 | 153.4 | 0 | 0 | 0 | 107.8 | V29 | V29-L31 PolarHBondContact O-N 3.3Š| ||
| 32 | E | 31.6 | Very low | 36.7 | Very low | 177 Ų | 177 | 139.5 Ų | 139.5 | 83% | 0.827 | 79% | 0.794 | S | S | * | * | trans | -66.2 | 125.7 | 170.5 | -65 | -175.2 | 157.3 | 0 | 0 | 109.9 | ||||
| 33 | V | 30.4 | Very low | 35.7 | Very low | 131 Ų | 131 | 137.6 Ų | 137.6 | 79% | 0.794 | 79% | 0.794 | S | S | * | * | trans | -131 | 114.3 | 161.6 | 176 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 34 | I | 32.8 | Very low | 33.8 | Very low | 143 Ų | 143 | 138.1 Ų | 138.1 | 73% | 0.733 | 80% | 0.796 | S | S | * | * | trans | -82.1 | 127.3 | 171.7 | -63.4 | 164.6 | 0 | 0 | 0 | 107.9 | ||||
| 35 | T | 30.4 | Very low | 33 | Very low | 134 Ų | 134 | 138 Ų | 138 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | -166.5 | 144.2 | 138.3 | -0.8 | 0 | 0 | 0 | 0 | 113 | ||||
| 36 | D | 29.4 | Very low | 32.4 | Very low | 149 Ų | 149 | 139.4 Ų | 139.4 | 80% | 0.797 | 80% | 0.796 | S | S | * | * | trans | -74.6 | 155.2 | -169.7 | -66.3 | -62.7 | 0 | 0 | 0 | 116.8 | ||||
| 37 | A | 31.5 | Very low | 32.2 | Very low | 98 Ų | 98 | 137.6 Ų | 137.6 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | trans | 83.8 | 161.7 | 145.1 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 38 | P | 34.5 | Very low | 32 | Very low | 117 Ų | 117 | 140.6 Ų | 140.6 | 76% | 0.76 | 80% | 0.804 | S | S | * | * | -112.9 | 174.4 | -122.7 | 28.1 | -6.2 | 0 | 0 | 0 | 115.3 | |||||
| 39 | P | 32 | Very low | 31.6 | Very low | 123 Ų | 123 | 144.3 Ų | 144.3 | 80% | 0.799 | 81% | 0.808 | S | S | * | * | trans | -96.9 | 157 | -170.2 | 37.2 | -32.1 | 0 | 0 | 0 | 114.1 | ||||
| 40 | P | 34.8 | Very low | 31.4 | Very low | 112 Ų | 112 | 144.5 Ų | 144.5 | 73% | 0.727 | 81% | 0.809 | S | S | * | * | trans | -116.7 | 132.8 | 151.8 | 33 | -20 | 0 | 0 | 0 | 113.1 | ||||
| 41 | F | 27.3 | Very low | 31.3 | Very low | 191 Ų | 191 | 142.6 Ų | 142.6 | 84% | 0.838 | 81% | 0.807 | S | S | * | * | trans | 33.8 | 123.9 | 144.2 | -64.4 | -85.6 | 0 | 0 | 0 | 123 | ||||
| 42 | L | 30.1 | Very low | 31.1 | Very low | 161 Ų | 161 | 140.6 Ų | 140.6 | 84% | 0.843 | 81% | 0.806 | S | S | * | * | trans | 44.2 | 117.8 | 137 | -57.5 | 173.1 | 0 | 0 | 0 | 120 | ||||
| 43 | S | 28.3 | Very low | 31.2 | Very low | 100 Ų | 100 | 138.5 Ų | 138.5 | 70% | 0.699 | 81% | 0.807 | S | S | * | * | 178 | 139.5 | 107.9 | -143.5 | 0 | 0 | 0 | 0 | 113 | |||||
| 44 | E | 29.1 | Very low | 31.3 | Very low | 184 Ų | 184 | 142.6 Ų | 142.6 | 86% | 0.86 | 81% | 0.809 | S | S | * | * | trans | 61.3 | 143.2 | 144 | -76.1 | 170.6 | 148 | 0 | 0 | 124.6 | ||||
| 45 | V | 35.1 | Very low | 31.3 | Very low | 128 Ų | 128 | 144 Ų | 144 | 78% | 0.776 | 81% | 0.812 | S | S | * | * | trans | -85.3 | 155.5 | -167.5 | 179.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 46 | P | 29.8 | Very low | 31.2 | Very low | 124 Ų | 124 | 142.7 Ų | 142.7 | 81% | 0.805 | 81% | 0.808 | S | S | * | * | -138.6 | 137.1 | 117.3 | 14.3 | 7.9 | 0 | 0 | 0 | 115.6 | |||||
| 47 | L | 36.7 | Very low | 31.6 | Very low | 159 Ų | 159 | 141.8 Ų | 141.8 | 83% | 0.832 | 81% | 0.811 | S | S | * | * | trans | -40.8 | 130.5 | 162 | -93.7 | 140.6 | 0 | 0 | 0 | 113.9 | ||||
| 48 | L | 30 | Very low | 31.5 | Very low | 178 Ų | 178 | 147 Ų | 147 | 93% | 0.932 | 82% | 0.815 | S | S | * | * | trans | -137.8 | 145.5 | 151.4 | -83.1 | 176.6 | 0 | 0 | 0 | 112.2 | ||||
| 49 | K | 31.1 | Very low | 31.4 | Very low | 195 Ų | 195 | 146.6 Ų | 146.6 | 85% | 0.848 | 82% | 0.815 | S | S | * | * | trans | -118.4 | 122 | -151.6 | -177.9 | -173.2 | -167.8 | 178.1 | 0 | 107.5 | ||||
| 50 | V | 30.4 | Very low | 31.8 | Very low | 142 Ų | 142 | 145.5 Ų | 145.5 | 86% | 0.861 | 81% | 0.808 | S | S | * | * | trans | -146.1 | 89.6 | 168.3 | -174.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 51 | A | 27.6 | Very low | 31.6 | Very low | 92 Ų | 92 | 149 Ų | 149 | 76% | 0.76 | 81% | 0.814 | S | S | * | * | 73.7 | 95.4 | 94.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 52 | S | 30 | Very low | 32 | Very low | 115 Ų | 115 | 146.4 Ų | 146.4 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | trans | -78.3 | 142.3 | 159.6 | -54.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 53 | P | 33.7 | Very low | 32.1 | Very low | 132 Ų | 132 | 144.9 Ų | 144.9 | 86% | 0.857 | 81% | 0.811 | S | S | * | * | trans | -84.7 | 130.2 | 171.3 | 31.2 | -27.5 | 0 | 0 | 0 | 110.5 | ||||
| 54 | R | 32.8 | Very low | 32.6 | Very low | 217 Ų | 217 | 145.6 Ų | 145.6 | 82% | 0.819 | 81% | 0.813 | S | S | * | * | trans | -125.8 | 158 | 164.8 | -83.3 | -145 | -169.6 | -149 | 6.6 | 110.7 | ||||
| 55 | H | 32.9 | Very low | 33.1 | Very low | 173 Ų | 173 | 143.2 Ų | 143.2 | 80% | 0.801 | 81% | 0.814 | S | S | * | * | trans | 109 | 126.9 | 161.9 | -63.6 | -78.3 | 0 | 0 | 0 | 113.2 | ||||
| 56 | S | 27.4 | Very low | 33.1 | Very low | 106 Ų | 106 | 141.6 Ų | 141.6 | 74% | 0.741 | 81% | 0.814 | S | S | * | * | cis | -166.8 | -176.6 | 33.9 | -30.5 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 57 | P | 38.2 | Very low | 33.7 | Very low | 131 Ų | 131 | 141.6 Ų | 141.6 | 85% | 0.851 | 81% | 0.812 | S | S | * | * | cis | -126.5 | 178.3 | -23.7 | 30.1 | -8.7 | 0 | 0 | 0 | 113 | ||||
| 58 | K | 30.6 | Very low | 34 | Very low | 207 Ų | 207 | 140.3 Ų | 140.3 | 90% | 0.9 | 81% | 0.813 | S | S | * | * | trans | -107.1 | 146.4 | -174.1 | -126.8 | 157.7 | -178.4 | 174.9 | 0 | 111.3 | ||||
| 59 | S | 32.3 | Very low | 34.8 | Very low | 108 Ų | 108 | 139.5 Ų | 139.5 | 76% | 0.755 | 80% | 0.804 | S | S | * | * | 148.6 | 165.1 | 116.5 | -172.7 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 60 | P | 40.5 | Very low | 35.4 | Very low | 101 Ų | 101 | 135.8 Ų | 135.8 | 66% | 0.656 | 80% | 0.8 | S | S | * | * | cis | -130 | 150.4 | -50 | 35.9 | -20.8 | 0 | 0 | 0 | 112.4 | ||||
| 61 | H | 29.8 | Very low | 36.2 | Very low | 186 Ų | 186 | 137.9 Ų | 137.9 | 86% | 0.861 | 81% | 0.806 | S | S | * | * | trans | 177.4 | 130.8 | 132.6 | -108.8 | -78.9 | 0 | 0 | 0 | 109.4 | ||||
| 62 | V | 36.6 | Very low | 37 | Very low | 135 Ų | 135 | 137.2 Ų | 137.2 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | trans | -106.6 | 130.4 | 177.7 | 173 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 63 | T | 31.5 | Very low | 37.6 | Very low | 130 Ų | 130 | 136.7 Ų | 136.7 | 80% | 0.798 | 80% | 0.799 | S | S | * | * | trans | -147 | 152.4 | 154.8 | 7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 64 | P | 37.7 | Very low | 37.9 | Very low | 114 Ų | 114 | 138.8 Ų | 138.8 | 74% | 0.74 | 80% | 0.802 | S | S | * | * | trans | -86.7 | 172.2 | -150.9 | 36 | -35.6 | 0 | 0 | 0 | 114.4 | ||||
| 65 | P | 40.2 | Very low | 38.6 | Very low | 134 Ų | 134 | 135.3 Ų | 135.3 | 87% | 0.87 | 80% | 0.795 | S | S | * | * | trans | -87.2 | 137.2 | -156.2 | 34 | -31.4 | 0 | 0 | 0 | 113 | ||||
| 66 | A | 35.7 | Very low | 39.6 | Very low | 95 Ų | 95 | 135.2 Ų | 135.2 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | -107 | 144 | 160.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 67 | T | 41.9 | Very low | 40.6 | Very low | 124 Ų | 124 | 133 Ų | 133 | 76% | 0.761 | 79% | 0.793 | S | S | * | * | trans | -34.3 | 153.4 | -176.9 | 38.5 | 0 | 0 | 0 | 0 | 118.7 | Q69 | T67-Q69 PolarHBondContact O-N 3.06Š| ||
| 68 | P | 42.8 | Very low | 41.5 | Very low | 132 Ų | 132 | 137 Ų | 137 | 86% | 0.857 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 118.7 | -170.8 | 28.4 | -33.6 | 0 | 0 | 0 | 112.3 | ||
| 69 | Q | 47.8 | Very low | 42.6 | Very low | 160 Ų | 160 | 132.5 Ų | 132.5 | 75% | 0.748 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 144.3 | 171 | -77.6 | -171.1 | -36.7 | 0 | 0 | 111.3 | T67 L71 | T67-Q69 PolarHBondContact O-N 3.06Å; Q69-L71 PolarHBondContact O-N 2.98Å |
| 70 | P | 42.5 | Very low | 43.6 | Very low | 118 Ų | 118 | 131.8 Ų | 131.8 | 77% | 0.766 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -70 | 127.8 | 178.5 | 28.2 | -31.5 | 0 | 0 | 0 | 110.7 | G72 | P70-G72 PolarHBondContact O-N 3.36Š|
| 71 | L | 46.9 | Very low | 44.4 | Very low | 186 Ų | 186 | 137.5 Ų | 137.5 | 97% | 0.974 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64 | 116.3 | 173.9 | -71.6 | 158.7 | 0 | 0 | 0 | 109.5 | Q69 | Q69-L71 PolarHBondContact O-N 2.98Š|
| 72 | G | 44.9 | Very low | 45.7 | Very low | 78 Ų | 78 | 136.2 Ų | 136.2 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 157.6 | -5.5 | 173 | 0 | 0 | 0 | 0 | 0 | 117.9 | P70 | P70-G72 PolarHBondContact O-N 3.36Š|
| 73 | V | 43.6 | Very low | 46.5 | Very low | 103 Ų | 103 | 134 Ų | 134 | 62% | 0.624 | 77% | 0.773 | S | S | * | * | trans | -108.8 | 108.6 | 178.1 | -175.6 | 0 | 0 | 0 | 0 | 110 | H75 | V73-H75 PolarHBondContact O-N 2.91Å; V73-H75 PolarHBondContact O-ND1 3Å | ||
| 74 | L | 39.9 | Very low | 47.1 | Very low | 176 Ų | 176 | 131.4 Ų | 131.4 | 92% | 0.921 | 76% | 0.76 | S | S | * | * | trans | -69.1 | 99.8 | 165.5 | -69.7 | 174.2 | 0 | 0 | 0 | 107.7 | L76 | L74-L76 PolarHBondContact O-N 3.22Š| ||
| 75 | H | 47.2 | Very low | 47.9 | Very low | 144 Ų | 144 | 132.2 Ų | 132.2 | 67% | 0.667 | 76% | 0.763 | S | S | * | * | trans | -72.9 | 114 | 166.9 | -66.1 | 85.1 | 0 | 0 | 0 | 107.1 | V73 G77 | V73-H75 PolarHBondContact O-N 2.91Å; V73-H75 PolarHBondContact O-ND1 3Å; H75-G77 PolarHBondContact O-N 3.31Å | ||
| 76 | L | 52.6 | Low | 48.4 | Very low | 171 Ų | 171 | 135.1 Ų | 135.1 | 90% | 0.895 | 77% | 0.765 | S | S | * | * | trans | -51.8 | 118 | 162.2 | -80.4 | 154.2 | 0 | 0 | 0 | 106.6 | L74 | L74-L76 PolarHBondContact O-N 3.22Š| ||
| 77 | G | 49.9 | Very low | 48.8 | Very low | 59 Ų | 59 | 136.6 Ų | 136.6 | 61% | 0.608 | 76% | 0.764 | S | S | * | * | trans | -52.5 | 146.3 | -177.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | H75 V79 | H75-G77 PolarHBondContact O-N 3.31Å; G77-V79 PolarHBondContact O-N 3.3Å | ||
| 78 | K | 57.4 | Low | 49.1 | Very low | 216 Ų | 216 | 138.9 Ų | 138.9 | 94% | 0.939 | 77% | 0.766 | S | S | * | * | trans | -53.8 | 108.1 | 176.6 | -68.9 | 179.1 | -179.6 | 178.9 | 0 | 108.3 | N80 | K78-N80 PolarHBondContact O-N 3.43Š| ||
| 79 | V | 53.7 | Low | 49.4 | Very low | 113 Ų | 113 | 137.1 Ų | 137.1 | 69% | 0.685 | 76% | 0.762 | S | S | * | * | trans | -68.9 | 119.5 | 176.7 | -173.6 | 0 | 0 | 0 | 0 | 106.5 | G77 R81 | G77-V79 PolarHBondContact O-N 3.3Å; V79-R81 PolarHBondContact O-N 2.8Å | ||
| 80 | N | 52.1 | Low | 49.5 | Very low | 93 Ų | 93 | 134.7 Ų | 134.7 | 50% | 0.497 | 76% | 0.758 | S | S | . | * | trans | -69.8 | 122.5 | -179.9 | -159 | 8.7 | 0 | 0 | 0 | 108.6 | K78 E82 A83 | K78-N80 PolarHBondContact O-N 3.43Å; N80-E82 PolarHBondContact ND2-OE2 3.48Å; N80-E82 PolarHBondContact O-N 3.38Å; N80-E82 VanDerWaalsContact OD1-CD 3.24Å; N80-E82 PolarHBondContact OD1-OE1 2.82Å; N80-E82 VanDerWaalsContact OD1-OE1 3.08Å; N80-E82 PolarHBondContact OD1-OE2 2.8Å; N80-E82 VanDerWaalsContact OD1-OE2 3.14Å; N80-A83 PolarHBondContact O-N 3.3Å | ||
| 81 | R | 58.3 | Low | 49.7 | Very low | 220 Ų | 220 | 139.2 Ų | 139.2 | 83% | 0.83 | 76% | 0.76 | S | S | * | * | G | 310 helix | trans | -62.2 | -17.9 | -171.4 | -153.2 | 176.7 | 90.3 | 166.5 | 8.3 | 112.3 | V79 A83 | V79-R81 PolarHBondContact O-N 2.8Å; R81-A83 VanDerWaalsContact C-N 3.31Å; R81-A83 PolarHBondContact O-N 3.48Å |
| 82 | E | 56.4 | Low | 50.2 | Low | 159 Ų | 159 | 137.2 Ų | 137.2 | 74% | 0.743 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -73.5 | -14.6 | 176.5 | -59.4 | 116.8 | -135.8 | 0 | 0 | 114.4 | N80 | N80-E82 PolarHBondContact ND2-OE2 3.48Å; N80-E82 PolarHBondContact O-N 3.38Å; N80-E82 VanDerWaalsContact OD1-CD 3.24Å; N80-E82 PolarHBondContact OD1-OE1 2.82Å; N80-E82 VanDerWaalsContact OD1-OE1 3.08Å; N80-E82 PolarHBondContact OD1-OE2 2.8Å; N80-E82 VanDerWaalsContact OD1-OE2 3.14Å |
| 83 | A | 54.3 | Low | 50.7 | Low | 88 Ų | 88 | 139.6 Ų | 139.6 | 73% | 0.727 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | -104.3 | 1.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | N80 R81 | N80-A83 PolarHBondContact O-N 3.3Å; R81-A83 VanDerWaalsContact C-N 3.31Å; R81-A83 PolarHBondContact O-N 3.48Å |
| 84 | C | 44 | Very low | 51 | Low | 76 Ų | 76 | 138.7 Ų | 138.7 | 51% | 0.514 | 74% | 0.736 | S | S | . | * | trans | -94.6 | 115.4 | 175.6 | -65.4 | 0 | 0 | 0 | 0 | 109.6 | E86 | C84-E86 PolarHBondContact O-N 3.34Š| ||
| 85 | T | 53 | Low | 51.5 | Low | 131 Ų | 131 | 134.3 Ų | 134.3 | 80% | 0.804 | 72% | 0.719 | S | S | * | * | trans | -72.8 | 109.7 | 165.8 | 32 | 0 | 0 | 0 | 0 | 109 | V87 | T85-V87 PolarHBondContact O-N 3.12Š| ||
| 86 | E | 51.4 | Low | 51.5 | Low | 196 Ų | 196 | 138.7 Ų | 138.7 | 92% | 0.916 | 73% | 0.729 | S | S | * | * | trans | -71.4 | 110.1 | 172.2 | -165.2 | 168 | -158.8 | 0 | 0 | 108.3 | C84 | C84-E86 PolarHBondContact O-N 3.34Š| ||
| 87 | V | 44.6 | Very low | 51.4 | Low | 125 Ų | 125 | 135.3 Ų | 135.3 | 76% | 0.758 | 73% | 0.726 | S | S | * | * | trans | -93.5 | 100.8 | 177.4 | -175 | 0 | 0 | 0 | 0 | 108 | T85 A89 | T85-V87 PolarHBondContact O-N 3.12Å; V87-A89 PolarHBondContact O-N 3.08Å; V87-A89 VanDerWaalsContact O-N 3.14Å | ||
| 88 | E | 47 | Very low | 51.1 | Low | 172 Ų | 172 | 135.6 Ų | 135.6 | 80% | 0.804 | 72% | 0.722 | S | S | * | * | trans | -72.3 | 102.8 | 171.6 | -164.7 | 179.8 | -173.3 | 0 | 0 | 109.1 | V90 | E88-V90 HydrophobicContact CG-CG2 4.47Å; E88-V90 PolarHBondContact O-N 3.36Å | ||
| 89 | A | 49.1 | Very low | 50.7 | Low | 95 Ų | 95 | 129.9 Ų | 129.9 | 79% | 0.785 | 70% | 0.701 | S | S | * | * | trans | -75.6 | 91.7 | 176 | 0 | 0 | 0 | 0 | 0 | 109.8 | V87 R91 | V87-A89 PolarHBondContact O-N 3.08Å; V87-A89 VanDerWaalsContact O-N 3.14Å; A89-R91 PolarHBondContact O-N 2.86Å | ||
| 90 | V | 50.9 | Low | 50.1 | Low | 109 Ų | 109 | 130.9 Ų | 130.9 | 66% | 0.661 | 71% | 0.707 | S | S | * | * | trans | -73.4 | 117.7 | 174 | -179.1 | 0 | 0 | 0 | 0 | 109.5 | E88 I92 | E88-V90 HydrophobicContact CG-CG2 4.47Å; E88-V90 PolarHBondContact O-N 3.36Å; V90-I92 PolarHBondContact O-N 3.21Å | ||
| 91 | R | 46.9 | Very low | 49.7 | Very low | 214 Ų | 214 | 137.3 Ų | 137.3 | 81% | 0.808 | 73% | 0.725 | S | S | * | * | trans | -74 | 97.1 | 174.4 | -163.8 | 178 | -172.2 | -128.9 | 4 | 109.1 | A89 I93 | A89-R91 PolarHBondContact O-N 2.86Å; R91-I93 PolarHBondContact O-N 3.37Å | ||
| 92 | I | 56 | Low | 48.5 | Very low | 144 Ų | 144 | 132.6 Ų | 132.6 | 74% | 0.738 | 73% | 0.725 | S | S | * | * | trans | -69.9 | 103.8 | 174 | -56.8 | 175.4 | 0 | 0 | 0 | 108.4 | V90 V94 | V90-I92 PolarHBondContact O-N 3.21Å; I92-V94 HydrophobicContact CG2-CG2 4.12Å; I92-V94 PolarHBondContact O-N 3.24Å | ||
| 93 | I | 56.5 | Low | 47.5 | Very low | 128 Ų | 128 | 128.4 Ų | 128.4 | 66% | 0.656 | 73% | 0.725 | S | S | * | * | trans | -85.7 | 104.3 | 171.1 | -60 | 174.3 | 0 | 0 | 0 | 107 | R91 P95 | R91-I93 PolarHBondContact O-N 3.37Å; I93-P95 VanDerWaalsContact O-CD 3.28Å; I93-P95 WeakPolarHBondContact O-CD 3.28Å | ||
| 94 | V | 49.9 | Very low | 46.6 | Very low | 84 Ų | 84 | 135 Ų | 135 | 51% | 0.509 | 73% | 0.731 | S | S | . | * | trans | -79.3 | 113.6 | 170.6 | -176.6 | 0 | 0 | 0 | 0 | 107.8 | I92 R96 A98 I99 | I92-V94 HydrophobicContact CG2-CG2 4.12Å; I92-V94 PolarHBondContact O-N 3.24Å; V94-R96 PolarHBondContact O-N 2.79Å; V94-A98 HydrophobicContact CG1-CB 4.03Å; V94-I99 HydrophobicContact CG1-CG1 4.12Å | ||
| 95 | P | 50.7 | Low | 46 | Very low | 84 Ų | 84 | 138 Ų | 138 | 55% | 0.545 | 75% | 0.747 | S | S | . | * | trans | -59.6 | 138.6 | 176.5 | -19.9 | 32.6 | 0 | 0 | 0 | 109.6 | I93 A97 A98 | I93-P95 VanDerWaalsContact O-CD 3.28Å; I93-P95 WeakPolarHBondContact O-CD 3.28Å; P95-A97 PolarHBondContact O-N 3.28Å; P95-A98 WeakPolarHBondContact O-CB 3.24Å; P95-A98 PolarHBondContact O-N 2.92Å | ||
| 96 | R | 46.2 | Very low | 45.1 | Very low | 236 Ų | 236 | 134.6 Ų | 134.6 | 89% | 0.891 | 74% | 0.738 | S | S | * | * | G | 310 helix | trans | -54.4 | -21.7 | -179.8 | -86.8 | -176.8 | 161.5 | -172.7 | -4.6 | 113.9 | V94 A98 | V94-R96 PolarHBondContact O-N 2.79Å; R96-A98 VanDerWaalsContact C-N 3.33Å |
| 97 | A | 51.7 | Low | 44.6 | Very low | 99 Ų | 99 | 131.7 Ų | 131.7 | 82% | 0.818 | 74% | 0.736 | S | S | * | * | G | 310 helix | trans | -72.8 | -18.5 | 175 | 0 | 0 | 0 | 0 | 0 | 114.5 | P95 | P95-A97 PolarHBondContact O-N 3.28Š|
| 98 | A | 42.7 | Very low | 44.1 | Very low | 65 Ų | 65 | 132.5 Ų | 132.5 | 54% | 0.537 | 74% | 0.741 | S | S | . | * | G | 310 helix | trans | -89.9 | 0.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | V94 P95 R96 | V94-A98 HydrophobicContact CG1-CB 4.03Å; P95-A98 WeakPolarHBondContact O-CB 3.24Å; P95-A98 PolarHBondContact O-N 2.92Å; R96-A98 VanDerWaalsContact C-N 3.33Å |
| 99 | I | 48.5 | Very low | 43.8 | Very low | 97 Ų | 97 | 133.5 Ų | 133.5 | 50% | 0.497 | 75% | 0.746 | S | S | . | * | trans | -98.4 | 87 | 178.7 | -54.3 | 175.2 | 0 | 0 | 0 | 108.6 | V94 R101 | V94-I99 HydrophobicContact CG1-CG1 4.12Å; I99-R101 HydrophobicContact CG2-CG 4.38Å; I99-R101 PolarHBondContact O-N 2.82Å | ||
| 100 | T | 41 | Very low | 43.1 | Very low | 133 Ų | 133 | 133.9 Ų | 133.9 | 82% | 0.816 | 75% | 0.749 | S | S | * | * | trans | -82.2 | 103.2 | 174.2 | -33.9 | 0 | 0 | 0 | 0 | 109.6 | S102 | T100-S102 PolarHBondContact O-N 2.84Š| ||
| 101 | R | 44.4 | Very low | 42.6 | Very low | 229 Ų | 229 | 139 Ų | 139 | 86% | 0.864 | 76% | 0.763 | S | S | * | * | trans | -84.7 | 104.8 | 168.1 | -70.5 | -173.6 | 173.5 | -127.5 | -1.5 | 108.5 | I99 G103 | I99-R101 HydrophobicContact CG2-CG 4.38Å; I99-R101 PolarHBondContact O-N 2.82Å; R101-G103 VanDerWaalsContact C-N 3.34Å; R101-G103 PolarHBondContact O-N 2.89Å | ||
| 102 | S | 34 | Very low | 41.9 | Very low | 120 Ų | 120 | 132.5 Ų | 132.5 | 84% | 0.839 | 76% | 0.762 | S | S | * | * | trans | -69.3 | 89.3 | 171.9 | 167.6 | 0 | 0 | 0 | 0 | 110 | T100 | T100-S102 PolarHBondContact O-N 2.84Š| ||
| 103 | G | 35.7 | Very low | 40.7 | Very low | 71 Ų | 71 | 135.4 Ų | 135.4 | 73% | 0.732 | 77% | 0.773 | S | S | * | * | trans | -81.8 | 120.1 | 157.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | R101 | R101-G103 VanDerWaalsContact C-N 3.34Å; R101-G103 PolarHBondContact O-N 2.89Å | ||
| 104 | R | 34.1 | Very low | 39.5 | Very low | 226 Ų | 226 | 134.6 Ų | 134.6 | 85% | 0.853 | 79% | 0.785 | S | S | * | * | trans | -73 | 152.8 | 173.8 | -158.7 | 174.8 | -175 | -141.8 | 2.8 | 109.2 | ||||
| 105 | T | 31.3 | Very low | 38.6 | Very low | 140 Ų | 140 | 133.8 Ų | 133.8 | 86% | 0.859 | 79% | 0.793 | S | S | * | * | trans | 83.1 | 128.9 | 172.1 | 68.2 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 106 | G | 34.6 | Very low | 37.8 | Very low | 59 Ų | 59 | 139 Ų | 139 | 61% | 0.608 | 81% | 0.81 | S | S | * | * | cis | -157.8 | -175.5 | 0.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 107 | P | 39.8 | Very low | 37 | Very low | 136 Ų | 136 | 137.5 Ų | 137.5 | 88% | 0.883 | 81% | 0.813 | S | S | * | * | trans | -82.7 | 125 | -164.5 | 32 | -30.5 | 0 | 0 | 0 | 111.8 | ||||
| 108 | T | 34.7 | Very low | 36.1 | Very low | 141 Ų | 141 | 137.2 Ų | 137.2 | 87% | 0.865 | 81% | 0.811 | S | S | * | * | trans | -107.6 | 116.6 | 165 | -7.1 | 0 | 0 | 0 | 0 | 108.3 | A110 | T108-A110 PolarHBondContact O-N 2.89Š| ||
| 109 | E | 41.3 | Very low | 35.6 | Very low | 194 Ų | 194 | 142.6 Ų | 142.6 | 91% | 0.907 | 83% | 0.825 | S | S | * | * | trans | -52.9 | 126 | 176.4 | -64.8 | 175.5 | 137.3 | 0 | 0 | 111.4 | ||||
| 110 | A | 33.8 | Very low | 34.9 | Very low | 103 Ų | 103 | 145 Ų | 145 | 85% | 0.851 | 83% | 0.834 | S | S | * | * | trans | -99.8 | 102.2 | 167.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | T108 | T108-A110 PolarHBondContact O-N 2.89Š| ||
| 111 | K | 40.3 | Very low | 34.7 | Very low | 217 Ų | 217 | 146.8 Ų | 146.8 | 94% | 0.943 | 83% | 0.834 | S | S | * | * | trans | -60.3 | 126.1 | 167.8 | -162.3 | 176.6 | -173.7 | 178.3 | 0 | 109.6 | ||||
| 112 | G | 32.3 | Very low | 34.2 | Very low | 77 Ų | 77 | 139.1 Ų | 139.1 | 79% | 0.794 | 83% | 0.825 | S | S | * | * | trans | -167.1 | 71.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 113 | E | 31.6 | Very low | 34.1 | Very low | 205 Ų | 205 | 139.2 Ų | 139.2 | 96% | 0.958 | 83% | 0.826 | S | S | * | * | trans | -108.7 | 122.6 | 162.5 | -81.6 | -175 | 139.9 | 0 | 0 | 108.8 | ||||
| 114 | A | 30.9 | Very low | 35.1 | Very low | 111 Ų | 111 | 141.6 Ų | 141.6 | 92% | 0.917 | 83% | 0.829 | S | S | * | * | trans | -136.3 | 133.2 | 165 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 115 | G | 30.7 | Very low | 36 | Very low | 66 Ų | 66 | 136.2 Ų | 136.2 | 68% | 0.68 | 82% | 0.823 | S | S | * | * | trans | 132.9 | 77.2 | 174 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 116 | Q | 34.4 | Very low | 36.8 | Very low | 193 Ų | 193 | 135.3 Ų | 135.3 | 90% | 0.902 | 81% | 0.812 | S | S | * | * | 71.2 | 109.7 | 103.3 | -73.7 | 175.4 | 4.6 | 0 | 0 | 114 | |||||
| 117 | Q | 29.6 | Very low | 37.9 | Very low | 205 Ų | 205 | 137.1 Ų | 137.1 | 96% | 0.958 | 81% | 0.811 | S | S | * | * | trans | -154.6 | 131.2 | 137.2 | -110.7 | 173.7 | 5.8 | 0 | 0 | 110.3 | ||||
| 118 | A | 32.7 | Very low | 38.8 | Very low | 93 Ų | 93 | 137.7 Ų | 137.7 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | trans | -105.1 | 168.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 119 | E | 31.9 | Very low | 40.2 | Very low | 179 Ų | 179 | 136.6 Ų | 136.6 | 84% | 0.836 | 79% | 0.791 | S | S | * | * | trans | 91.4 | 97.6 | 163.4 | -64.1 | -166.1 | 134 | 0 | 0 | 119.8 | ||||
| 120 | E | 34.6 | Very low | 41.5 | Very low | 146 Ų | 146 | 135.8 Ų | 135.8 | 68% | 0.682 | 78% | 0.78 | S | S | * | * | 53.6 | 116.3 | 99.4 | -148.8 | 168 | -178.4 | 0 | 0 | 121.1 | |||||
| 121 | Q | 35.4 | Very low | 43.6 | Very low | 172 Ų | 172 | 138.2 Ų | 138.2 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | trans | 62.4 | 126.8 | 143.3 | -71.9 | 166 | 16.8 | 0 | 0 | 122.8 | ||||
| 122 | G | 34.9 | Very low | 45.6 | Very low | 67 Ų | 67 | 129.2 Ų | 129.2 | 69% | 0.691 | 74% | 0.735 | S | S | * | * | 92.1 | 84.8 | 111.2 | 0 | 0 | 0 | 0 | 0 | 119.5 | |||||
| 123 | S | 32.3 | Very low | 48.1 | Very low | 123 Ų | 123 | 129.5 Ų | 129.5 | 86% | 0.86 | 72% | 0.716 | S | S | * | * | trans | 61.8 | 146.5 | 144.2 | -45.8 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 124 | P | 56.4 | Low | 50.6 | Low | 121 Ų | 121 | 124.8 Ų | 124.8 | 79% | 0.786 | 70% | 0.697 | S | S | * | * | trans | -97.8 | -179.1 | -157 | 41.8 | -34.8 | 0 | 0 | 0 | 113.8 | ||||
| 125 | P | 53.3 | Low | 53.3 | Low | 113 Ų | 113 | 124.9 Ų | 124.9 | 73% | 0.734 | 68% | 0.679 | S | S | * | * | cis | -132.7 | 175.6 | 13.8 | 35.5 | -12.4 | 0 | 0 | 0 | 114.1 | ||||
| 126 | L | 48.5 | Very low | 56.1 | Low | 120 Ų | 120 | 128.8 Ų | 128.8 | 63% | 0.628 | 68% | 0.677 | S | S | * | * | 172.5 | 94.5 | 92.8 | -172.8 | 78.2 | 0 | 0 | 0 | 109.7 | E128 | L126-E128 VanDerWaalsContact C-N 3.26Å; L126-E128 PolarHBondContact O-N 3.23Å | |||
| 127 | V | 56.8 | Low | 58.7 | Low | 97 Ų | 97 | 124.8 Ų | 124.8 | 59% | 0.588 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 30.6 | -35.7 | 153.7 | -168.6 | 0 | 0 | 0 | 0 | 122.5 | R131 | V127-R131 PolarHBondContact O-N 3.4Š|
| 128 | E | 57.7 | Low | 61.6 | Low | 149 Ų | 149 | 119.9 Ų | 119.9 | 70% | 0.696 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -83.4 | -35.1 | -171.8 | -70.1 | 173.9 | 164.3 | 0 | 0 | 113.4 | L126 R131 G132 | L126-E128 VanDerWaalsContact C-N 3.26Å; L126-E128 PolarHBondContact O-N 3.23Å; E128-R131 WeakPolarHBondContact O-CB 3.43Å; E128-R131 PolarHBondContact O-N 3.43Å; E128-G132 PolarHBondContact O-N 3.26Å |
| 129 | D | 65.6 | Low | 64.4 | Low | 118 Ų | 118 | 118.5 Ų | 118.5 | 63% | 0.631 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -74.5 | -34.9 | 178.6 | -147.3 | 14.4 | 0 | 0 | 0 | 111.8 | R131 G132 Q133 | D129-R131 VanDerWaalsContact C-N 3.29Å; D129-R131 PolarHBondContact O-N 2.87Å; D129-G132 PolarHBondContact O-N 2.99Å; D129-Q133 WeakPolarHBondContact O-CG 3.24Å; D129-Q133 PolarHBondContact O-N 2.87Å |
| 130 | W | 67.1 | Low | 67.3 | Low | 176 Ų | 176 | 112 Ų | 112 | 67% | 0.667 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -63.8 | -33.5 | 170.1 | -68.6 | 108.3 | 0 | 0 | 0 | 112.6 | L134 | W130-L134 VanDerWaalsContact O-CB 3.24Å; W130-L134 WeakPolarHBondContact O-CB 3.48Å; W130-L134 PolarHBondContact O-N 3.43Å |
| 131 | R | 78.9 | Confident | 70 | Confident | 155 Ų | 155 | 110.6 Ų | 110.6 | 59% | 0.585 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -66.9 | -43.8 | 175.3 | -173.5 | -175.3 | -61.2 | -79.9 | -1.3 | 111.2 | V127 E128 D129 L134 E135 | V127-R131 PolarHBondContact O-N 3.4Å; E128-R131 WeakPolarHBondContact O-CB 3.43Å; E128-R131 PolarHBondContact O-N 3.43Å; D129-R131 VanDerWaalsContact C-N 3.29Å; D129-R131 PolarHBondContact O-N 2.87Å; R131-L134 PolarHBondContact O-N 3.38Å; R131-E135 PolarHBondContact O-N 3.31Å |
| 132 | G | 82 | Confident | 72.8 | Confident | 27 Ų | 27 | 109.2 Ų | 109.2 | 28% | 0.278 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -65.8 | -37.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | E128 D129 K136 | E128-G132 PolarHBondContact O-N 3.26Å; D129-G132 PolarHBondContact O-N 2.99Å; G132-K136 VanDerWaalsContact O-CG 3.28Å; G132-K136 WeakPolarHBondContact O-CG 3.43Å; G132-K136 PolarHBondContact O-N 3.31Å |
| 133 | Q | 85.4 | Confident | 75.6 | Confident | 84 Ų | 84 | 113.7 Ų | 113.7 | 39% | 0.393 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -67.8 | -39.2 | 173.5 | -69.6 | -179.8 | 27.1 | 0 | 0 | 112.3 | D129 K136 L137 | D129-Q133 WeakPolarHBondContact O-CG 3.24Å; D129-Q133 PolarHBondContact O-N 2.87Å; Q133-K136 PolarHBondContact O-N 3.11Å; Q133-L137 WeakPolarHBondContact O-CB 3.49Å; Q133-L137 WeakPolarHBondContact O-CG 3.38Å; Q133-L137 PolarHBondContact O-N 2.91Å |
| 134 | L | 84 | Confident | 78.5 | Confident | 106 Ų | 106 | 113.3 Ų | 113.3 | 56% | 0.555 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.7 | -41.5 | 175.9 | -170.4 | 69.7 | 0 | 0 | 0 | 112 | W130 R131 L137 Q138 | W130-L134 VanDerWaalsContact O-CB 3.24Å; W130-L134 WeakPolarHBondContact O-CB 3.48Å; W130-L134 PolarHBondContact O-N 3.43Å; R131-L134 PolarHBondContact O-N 3.38Å; L134-L137 PolarHBondContact O-N 3.48Å; L134-Q138 WeakPolarHBondContact O-CB 3.26Å; L134-Q138 PolarHBondContact O-N 3.41Å |
| 135 | E | 87.9 | Confident | 80.3 | Confident | 113 Ų | 113 | 112.2 Ų | 112.2 | 53% | 0.528 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -65.2 | -38.8 | 173.3 | -83.3 | -176.5 | 171.9 | 0 | 0 | 112.4 | R131 Q138 N139 | R131-E135 PolarHBondContact O-N 3.31Å; E135-Q138 PolarHBondContact O-N 2.93Å; E135-N139 VanDerWaalsContact O-CB 3.24Å; E135-N139 WeakPolarHBondContact O-CB 3.34Å; E135-N139 PolarHBondContact O-N 2.87Å; E135-N139 PolarHBondContact O-ND2 2.82Å |
| 136 | K | 88.8 | Confident | 82.3 | Confident | 148 Ų | 148 | 112.9 Ų | 112.9 | 64% | 0.643 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.9 | -42.5 | 174 | -74.2 | 170.2 | -173.8 | 173.8 | 0 | 111.5 | G132 Q133 N139 S140 | G132-K136 VanDerWaalsContact O-CG 3.28Å; G132-K136 WeakPolarHBondContact O-CG 3.43Å; G132-K136 PolarHBondContact O-N 3.31Å; Q133-K136 PolarHBondContact O-N 3.11Å; K136-N139 PolarHBondContact O-N 2.95Å; K136-S140 WeakPolarHBondContact O-CB 3.39Å; K136-S140 PolarHBondContact O-N 2.71Å; K136-S140 PolarHBondContact O-OG 3.35Å |
| 137 | L | 88.6 | Confident | 84.5 | Confident | 109 Ų | 109 | 111.6 Ų | 111.6 | 57% | 0.571 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -65.8 | -43 | 175.3 | -76.9 | 168.9 | 0 | 0 | 0 | 112.2 | Q133 L134 N139 S140 E141 | Q133-L137 WeakPolarHBondContact O-CB 3.49Å; Q133-L137 WeakPolarHBondContact O-CG 3.38Å; Q133-L137 PolarHBondContact O-N 2.91Å; L134-L137 PolarHBondContact O-N 3.48Å; L137-N139 VanDerWaalsContact C-N 3.31Å; L137-N139 PolarHBondContact O-N 3.46Å; L137-S140 WeakPolarHBondContact CA-OG 3.43Å; L137-S140 PolarHBondContact O-N 2.71Å; L137-S140 PolarHBondContact O-OG 2.96Å; L137-E141 VanDerWaalsContact O-CB 3.29Å; L137-E141 WeakPolarHBondContact O-CB 3.47Å; L137-E141 PolarHBondContact O-N 3Å |
| 138 | Q | 91 | Very high | 86.3 | Confident | 102 Ų | 102 | 114 Ų | 114 | 48% | 0.477 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.2 | -38.4 | 173.2 | -88.2 | -173.7 | -26.8 | 0 | 0 | 112.2 | L134 E135 R142 | L134-Q138 WeakPolarHBondContact O-CB 3.26Å; L134-Q138 PolarHBondContact O-N 3.41Å; E135-Q138 PolarHBondContact O-N 2.93Å; Q138-R142 VanDerWaalsContact O-CB 3.3Å; Q138-R142 WeakPolarHBondContact O-CB 3.3Å; Q138-R142 PolarHBondContact O-N 2.86Å |
| 139 | N | 91.6 | Very high | 88.1 | Confident | 64 Ų | 64 | 112.9 Ų | 112.9 | 34% | 0.342 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -73.5 | -28 | 177.4 | -72.6 | -34.3 | 0 | 0 | 0 | 112.7 | E135 K136 L137 R142 R143 | E135-N139 VanDerWaalsContact O-CB 3.24Å; E135-N139 WeakPolarHBondContact O-CB 3.34Å; E135-N139 PolarHBondContact O-N 2.87Å; E135-N139 PolarHBondContact O-ND2 2.82Å; K136-N139 PolarHBondContact O-N 2.95Å; L137-N139 VanDerWaalsContact C-N 3.31Å; L137-N139 PolarHBondContact O-N 3.46Å; N139-R142 PolarHBondContact OD1-NH1 3.26Å; N139-R143 PolarHBondContact O-N 3.46Å; N139-R143 PolarHBondContact O-NE 3.4Å |
| 140 | S | 91.8 | Very high | 89.5 | Confident | 43 Ų | 43 | 108.8 Ų | 108.8 | 30% | 0.301 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -77.7 | -39.7 | 172.1 | 67 | 0 | 0 | 0 | 0 | 111.4 | K136 L137 R143 L144 | K136-S140 WeakPolarHBondContact O-CB 3.39Å; K136-S140 PolarHBondContact O-N 2.71Å; K136-S140 PolarHBondContact O-OG 3.35Å; L137-S140 WeakPolarHBondContact CA-OG 3.43Å; L137-S140 PolarHBondContact O-N 2.71Å; L137-S140 PolarHBondContact O-OG 2.96Å; S140-R143 PolarHBondContact O-N 2.84Å; S140-L144 WeakPolarHBondContact O-CB 3.32Å; S140-L144 VanDerWaalsContact O-CG 3.32Å; S140-L144 WeakPolarHBondContact O-CG 3.42Å; S140-L144 PolarHBondContact O-N 3.14Å |
| 141 | E | 92.3 | Very high | 90.9 | Very high | 116 Ų | 116 | 105.7 Ų | 105.7 | 54% | 0.542 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.6 | -46.8 | 172.3 | -177.9 | -179.2 | -156.8 | 0 | 0 | 110.9 | L137 R143 L144 L145 | L137-E141 VanDerWaalsContact O-CB 3.29Å; L137-E141 WeakPolarHBondContact O-CB 3.47Å; L137-E141 PolarHBondContact O-N 3Å; E141-R143 VanDerWaalsContact C-N 3.3Å; E141-R143 PolarHBondContact O-N 3.32Å; E141-L144 PolarHBondContact O-N 2.93Å; E141-L145 HydrophobicContact CG-CD1 4.2Å; E141-L145 WeakPolarHBondContact O-CB 3.29Å; E141-L145 VanDerWaalsContact O-CG 3.31Å; E141-L145 WeakPolarHBondContact O-CG 3.49Å; E141-L145 PolarHBondContact O-N 2.95Å |
| 142 | R | 94.1 | Very high | 91.7 | Very high | 143 Ų | 143 | 101.8 Ų | 101.8 | 54% | 0.54 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.4 | -39.7 | 175.9 | -166.2 | -175.8 | -62.1 | 133.4 | 3.7 | 111.9 | Q138 N139 Q146 | Q138-R142 VanDerWaalsContact O-CB 3.3Å; Q138-R142 WeakPolarHBondContact O-CB 3.3Å; Q138-R142 PolarHBondContact O-N 2.86Å; N139-R142 PolarHBondContact OD1-NH1 3.26Å; R142-Q146 WeakPolarHBondContact O-CG 3.35Å; R142-Q146 PolarHBondContact O-N 2.9Å; R142-Q146 VanDerWaalsContact O-N 3.08Å |
| 143 | R | 93.8 | Very high | 92.4 | Very high | 160 Ų | 160 | 104 Ų | 104 | 60% | 0.604 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -67 | -46.8 | 174.9 | -88.3 | -175.5 | -89.9 | -162.1 | -5.4 | 112.3 | N139 S140 E141 L145 Q146 D147 | N139-R143 PolarHBondContact O-N 3.46Å; N139-R143 PolarHBondContact O-NE 3.4Å; S140-R143 PolarHBondContact O-N 2.84Å; E141-R143 VanDerWaalsContact C-N 3.3Å; E141-R143 PolarHBondContact O-N 3.32Å; R143-L145 VanDerWaalsContact C-N 3.28Å; R143-L145 PolarHBondContact O-N 2.92Å; R143-Q146 CarbonylContact O-C 3.57Å; R143-Q146 WeakPolarHBondContact O-CB 3.42Å; R143-Q146 PolarHBondContact O-N 3.45Å; R143-Q146 VanDerWaalsContact O-N 3.12Å; R143-D147 VanDerWaalsContact O-CG 3.3Å; R143-D147 PolarHBondContact O-N 3.34Å |
| 144 | L | 93.8 | Very high | 92.9 | Very high | 115 Ų | 115 | 106.2 Ų | 106.2 | 60% | 0.602 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.7 | -35.2 | 177.6 | -73.7 | 171.3 | 0 | 0 | 0 | 112.1 | S140 E141 D147 K148 | S140-L144 WeakPolarHBondContact O-CB 3.32Å; S140-L144 VanDerWaalsContact O-CG 3.32Å; S140-L144 WeakPolarHBondContact O-CG 3.42Å; S140-L144 PolarHBondContact O-N 3.14Å; E141-L144 PolarHBondContact O-N 2.93Å; L144-D147 PolarHBondContact O-N 2.9Å; L144-K148 WeakPolarHBondContact O-CB 3.49Å; L144-K148 PolarHBondContact O-N 3.48Å |
| 145 | L | 93.8 | Very high | 93.5 | Very high | 98 Ų | 98 | 106.5 Ų | 106.5 | 51% | 0.513 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.3 | -41.7 | 173.1 | -73.7 | 173.9 | 0 | 0 | 0 | 111.8 | E141 R143 K148 E149 | E141-L145 HydrophobicContact CG-CD1 4.2Å; E141-L145 WeakPolarHBondContact O-CB 3.29Å; E141-L145 VanDerWaalsContact O-CG 3.31Å; E141-L145 WeakPolarHBondContact O-CG 3.49Å; E141-L145 PolarHBondContact O-N 2.95Å; R143-L145 VanDerWaalsContact C-N 3.28Å; R143-L145 PolarHBondContact O-N 2.92Å; L145-K148 PolarHBondContact O-N 2.84Å; L145-E149 WeakPolarHBondContact O-CB 3.35Å; L145-E149 PolarHBondContact O-N 3.21Å |
| 146 | Q | 94.5 | Very high | 93.9 | Very high | 127 Ų | 127 | 109.7 Ų | 109.7 | 59% | 0.593 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.8 | -43.1 | 172.4 | -79.3 | -178.7 | -16.9 | 0 | 0 | 112 | R142 R143 E149 G150 | R142-Q146 WeakPolarHBondContact O-CG 3.35Å; R142-Q146 PolarHBondContact O-N 2.9Å; R142-Q146 VanDerWaalsContact O-N 3.08Å; R143-Q146 CarbonylContact O-C 3.57Å; R143-Q146 WeakPolarHBondContact O-CB 3.42Å; R143-Q146 PolarHBondContact O-N 3.45Å; R143-Q146 VanDerWaalsContact O-N 3.12Å; Q146-E149 PolarHBondContact O-N 3.03Å; Q146-G150 PolarHBondContact O-N 3.42Å |
| 147 | D | 95.4 | Very high | 94.3 | Very high | 94 Ų | 94 | 107 Ų | 107 | 50% | 0.503 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.7 | -41.1 | 178 | -68.9 | -20.8 | 0 | 0 | 0 | 111.1 | R143 L144 E149 G150 L151 | R143-D147 VanDerWaalsContact O-CG 3.3Å; R143-D147 PolarHBondContact O-N 3.34Å; L144-D147 PolarHBondContact O-N 2.9Å; D147-E149 VanDerWaalsContact C-N 3.35Å; D147-E149 PolarHBondContact O-N 2.68Å; D147-G150 PolarHBondContact O-N 2.86Å; D147-L151 WeakPolarHBondContact O-CB 3.39Å; D147-L151 VanDerWaalsContact O-CG 3.26Å; D147-L151 WeakPolarHBondContact O-CG 3.39Å; D147-L151 PolarHBondContact O-N 3.01Å |
| 148 | K | 95.1 | Very high | 94.8 | Very high | 146 Ų | 146 | 107.6 Ų | 107.6 | 64% | 0.635 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60 | -44.9 | 173.6 | 177.4 | -176 | 174.8 | 179.5 | 0 | 111.2 | L144 L145 S152 | L144-K148 WeakPolarHBondContact O-CB 3.49Å; L144-K148 PolarHBondContact O-N 3.48Å; L145-K148 PolarHBondContact O-N 2.84Å; K148-S152 WeakPolarHBondContact O-CB 3.16Å; K148-S152 PolarHBondContact O-N 3.16Å |
| 149 | E | 95.5 | Very high | 95 | Very high | 126 Ų | 126 | 106.8 Ų | 106.8 | 59% | 0.589 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -66.8 | -41.2 | 177.4 | -174.3 | 160.9 | -144.4 | 0 | 0 | 111.3 | L145 Q146 D147 S152 N153 | L145-E149 WeakPolarHBondContact O-CB 3.35Å; L145-E149 PolarHBondContact O-N 3.21Å; Q146-E149 PolarHBondContact O-N 3.03Å; D147-E149 VanDerWaalsContact C-N 3.35Å; D147-E149 PolarHBondContact O-N 2.68Å; E149-S152 PolarHBondContact O-N 3.39Å; E149-N153 WeakPolarHBondContact O-CB 3.41Å; E149-N153 VanDerWaalsContact O-CG 3.22Å; E149-N153 PolarHBondContact O-N 2.88Å; E149-N153 PolarHBondContact O-ND2 2.86Å; E149-N153 VanDerWaalsContact O-ND2 3.11Å |
| 150 | G | 95.2 | Very high | 95.3 | Very high | 32 Ų | 32 | 107.8 Ų | 107.8 | 33% | 0.33 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -59.4 | -48.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113 | Q146 D147 N153 Q154 | Q146-G150 PolarHBondContact O-N 3.42Å; D147-G150 PolarHBondContact O-N 2.86Å; G150-N153 PolarHBondContact O-N 3.49Å; G150-Q154 WeakPolarHBondContact O-CG 3.31Å; G150-Q154 PolarHBondContact O-N 2.95Å |
| 151 | L | 95.8 | Very high | 95.6 | Very high | 111 Ų | 111 | 109.5 Ų | 109.5 | 58% | 0.581 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.1 | -40.4 | 177.1 | -71.9 | 171.1 | 0 | 0 | 0 | 112.1 | D147 N153 Q154 L155 | D147-L151 WeakPolarHBondContact O-CB 3.39Å; D147-L151 VanDerWaalsContact O-CG 3.26Å; D147-L151 WeakPolarHBondContact O-CG 3.39Å; D147-L151 PolarHBondContact O-N 3.01Å; L151-N153 VanDerWaalsContact C-N 3.33Å; L151-N153 PolarHBondContact O-N 3.37Å; L151-Q154 PolarHBondContact O-N 3.47Å; L151-L155 WeakPolarHBondContact O-CB 3.45Å; L151-L155 PolarHBondContact O-N 3.4Å |
| 152 | S | 95.6 | Very high | 95.8 | Very high | 73 Ų | 73 | 108.5 Ų | 108.5 | 51% | 0.51 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.2 | -43.8 | 174.5 | -178.7 | 0 | 0 | 0 | 0 | 111.3 | K148 E149 L155 R156 | K148-S152 WeakPolarHBondContact O-CB 3.16Å; K148-S152 PolarHBondContact O-N 3.16Å; E149-S152 PolarHBondContact O-N 3.39Å; S152-L155 PolarHBondContact O-N 2.93Å; S152-R156 WeakPolarHBondContact O-CB 3.41Å; S152-R156 PolarHBondContact O-N 3.37Å |
| 153 | N | 96.2 | Very high | 96 | Very high | 73 Ų | 73 | 107.7 Ų | 107.7 | 39% | 0.39 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.5 | -42.2 | 176.1 | -74.2 | -32.3 | 0 | 0 | 0 | 112 | E149 G150 L151 R156 V157 | E149-N153 WeakPolarHBondContact O-CB 3.41Å; E149-N153 VanDerWaalsContact O-CG 3.22Å; E149-N153 PolarHBondContact O-N 2.88Å; E149-N153 PolarHBondContact O-ND2 2.86Å; E149-N153 VanDerWaalsContact O-ND2 3.11Å; G150-N153 PolarHBondContact O-N 3.49Å; L151-N153 VanDerWaalsContact C-N 3.33Å; L151-N153 PolarHBondContact O-N 3.37Å; N153-R156 WeakPolarHBondContact O-CB 3.19Å; N153-R156 PolarHBondContact O-N 3.25Å; N153-V157 WeakPolarHBondContact O-CG2 3.42Å; N153-V157 PolarHBondContact O-N 3.26Å |
| 154 | Q | 96.3 | Very high | 96.1 | Very high | 132 Ų | 132 | 103.5 Ų | 103.5 | 62% | 0.617 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60.8 | -47 | 174.4 | -77.1 | 179.2 | -1.3 | 0 | 0 | 112 | G150 L151 R156 V157 Q158 | G150-Q154 WeakPolarHBondContact O-CG 3.31Å; G150-Q154 PolarHBondContact O-N 2.95Å; L151-Q154 PolarHBondContact O-N 3.47Å; Q154-R156 VanDerWaalsContact C-N 3.28Å; Q154-R156 PolarHBondContact O-N 3.04Å; Q154-V157 PolarHBondContact O-N 3.4Å; Q154-Q158 WeakPolarHBondContact O-CB 3.31Å; Q154-Q158 PolarHBondContact O-N 3.01Å |
| 155 | L | 96.3 | Very high | 96.3 | Very high | 111 Ų | 111 | 102.6 Ų | 102.6 | 58% | 0.581 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -59.9 | -41.3 | 177.2 | -178.2 | 64.1 | 0 | 0 | 0 | 111.1 | L151 S152 Q158 T159 | L151-L155 WeakPolarHBondContact O-CB 3.45Å; L151-L155 PolarHBondContact O-N 3.4Å; S152-L155 PolarHBondContact O-N 2.93Å; L155-Q158 PolarHBondContact O-N 2.88Å; L155-T159 WeakPolarHBondContact O-CB 3.48Å; L155-T159 PolarHBondContact O-N 2.79Å; L155-T159 PolarHBondContact O-OG1 3.14Å |
| 156 | R | 97.3 | Very high | 96.4 | Very high | 181 Ų | 181 | 105.1 Ų | 105.1 | 68% | 0.683 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61 | -49.4 | 176.5 | -167 | -177.3 | 105.5 | -168.5 | 6.2 | 111.5 | S152 N153 Q154 T159 E160 | S152-R156 WeakPolarHBondContact O-CB 3.41Å; S152-R156 PolarHBondContact O-N 3.37Å; N153-R156 WeakPolarHBondContact O-CB 3.19Å; N153-R156 PolarHBondContact O-N 3.25Å; Q154-R156 VanDerWaalsContact C-N 3.28Å; Q154-R156 PolarHBondContact O-N 3.04Å; R156-T159 PolarHBondContact O-N 3.46Å; R156-E160 PolarHBondContact O-N 2.67Å |
| 157 | V | 97.6 | Very high | 96.5 | Very high | 91 Ų | 91 | 103.6 Ų | 103.6 | 55% | 0.552 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.9 | -45.4 | 178.3 | 172.8 | 0 | 0 | 0 | 0 | 110.8 | N153 Q154 T159 E160 V161 | N153-V157 WeakPolarHBondContact O-CG2 3.42Å; N153-V157 PolarHBondContact O-N 3.26Å; Q154-V157 PolarHBondContact O-N 3.4Å; V157-T159 VanDerWaalsContact C-N 3.31Å; V157-T159 PolarHBondContact O-N 3.38Å; V157-E160 PolarHBondContact O-N 3.09Å; V157-V161 HydrophobicContact CG1-CG2 4.3Å; V157-V161 WeakPolarHBondContact O-CG2 3.27Å; V157-V161 PolarHBondContact O-N 3.47Å |
| 158 | Q | 97.1 | Very high | 96.5 | Very high | 122 Ų | 122 | 104.5 Ų | 104.5 | 57% | 0.57 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.6 | -37.9 | 179.2 | -171.6 | 175.3 | 6.5 | 0 | 0 | 112.2 | Q154 L155 N162 | Q154-Q158 WeakPolarHBondContact O-CB 3.31Å; Q154-Q158 PolarHBondContact O-N 3.01Å; L155-Q158 PolarHBondContact O-N 2.88Å; Q158-N162 WeakPolarHBondContact O-CB 3.36Å; Q158-N162 PolarHBondContact O-N 3.44Å |
| 159 | T | 96.6 | Very high | 96.5 | Very high | 84 Ų | 84 | 103 Ų | 103 | 52% | 0.515 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.4 | -41.7 | 176.2 | -53.2 | 0 | 0 | 0 | 0 | 110.9 | L155 R156 V157 R163 | L155-T159 WeakPolarHBondContact O-CB 3.48Å; L155-T159 PolarHBondContact O-N 2.79Å; L155-T159 PolarHBondContact O-OG1 3.14Å; R156-T159 PolarHBondContact O-N 3.46Å; V157-T159 VanDerWaalsContact C-N 3.31Å; V157-T159 PolarHBondContact O-N 3.38Å; T159-R163 WeakPolarHBondContact O-CB 3.48Å; T159-R163 PolarHBondContact O-N 2.75Å |
| 160 | E | 97.4 | Very high | 96.5 | Very high | 86 Ų | 86 | 101.3 Ų | 101.3 | 40% | 0.402 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.6 | -45.4 | 177 | -166.4 | 59.8 | -141.9 | 0 | 0 | 111.5 | R156 V157 N162 R163 E164 | R156-E160 PolarHBondContact O-N 2.67Å; V157-E160 PolarHBondContact O-N 3.09Å; E160-N162 PolarHBondContact O-N 3.15Å; E160-R163 WeakPolarHBondContact O-CB 3.49Å; E160-R163 PolarHBondContact O-N 2.95Å; E160-R163 VanDerWaalsContact O-N 3.14Å; E160-R163 IonicContact OE1-CZ 3.73Å; E160-R163 IonicContact OE1-NE 3.47Å; E160-R163 PolarHBondContact OE1-NE 3.08Å; E160-R163 IonicContact OE1-NH2 3.54Å; E160-R163 PolarHBondContact OE1-NH2 2.85Å; E160-R163 IonicContact OE2-NE 3.77Å; E160-E164 WeakPolarHBondContact O-CG 3.32Å; E160-E164 PolarHBondContact O-N 3.15Å |
| 161 | V | 97.8 | Very high | 96.3 | Very high | 78 Ų | 78 | 102.5 Ų | 102.5 | 47% | 0.473 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.7 | -45.4 | 176.5 | 171.7 | 0 | 0 | 0 | 0 | 111 | V157 R163 E164 L165 | V157-V161 HydrophobicContact CG1-CG2 4.3Å; V157-V161 WeakPolarHBondContact O-CG2 3.27Å; V157-V161 PolarHBondContact O-N 3.47Å; V161-R163 VanDerWaalsContact C-N 3.29Å; V161-R163 PolarHBondContact O-N 3.41Å; V161-E164 PolarHBondContact O-N 3.36Å; V161-L165 HydrophobicContact CG1-CD1 3.8Å; V161-L165 HydrophobicContact CG1-CG 4.23Å; V161-L165 WeakPolarHBondContact O-CB 3.37Å; V161-L165 VanDerWaalsContact O-CG 3.27Å; V161-L165 WeakPolarHBondContact O-CG 3.35Å; V161-L165 PolarHBondContact O-N 3.34Å |
| 162 | N | 96.9 | Very high | 96 | Very high | 96 Ų | 96 | 101 Ų | 101 | 51% | 0.513 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.4 | -35.5 | 175.7 | -92.9 | -33 | 0 | 0 | 0 | 112.6 | Q158 E160 K166 | Q158-N162 WeakPolarHBondContact O-CB 3.36Å; Q158-N162 PolarHBondContact O-N 3.44Å; E160-N162 PolarHBondContact O-N 3.15Å; N162-K166 VanDerWaalsContact O-CB 3.32Å; N162-K166 WeakPolarHBondContact O-CB 3.36Å; N162-K166 PolarHBondContact O-N 2.74Å |
| 163 | R | 97.6 | Very high | 96 | Very high | 126 Ų | 126 | 100.7 Ų | 100.7 | 48% | 0.475 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.8 | -48.2 | 175.5 | -169.5 | -175.3 | 80.7 | 137.2 | -1.2 | 110.9 | T159 E160 V161 K166 K167 | T159-R163 WeakPolarHBondContact O-CB 3.48Å; T159-R163 PolarHBondContact O-N 2.75Å; E160-R163 WeakPolarHBondContact O-CB 3.49Å; E160-R163 PolarHBondContact O-N 2.95Å; E160-R163 VanDerWaalsContact O-N 3.14Å; E160-R163 IonicContact OE1-CZ 3.73Å; E160-R163 IonicContact OE1-NE 3.47Å; E160-R163 PolarHBondContact OE1-NE 3.08Å; E160-R163 IonicContact OE1-NH2 3.54Å; E160-R163 PolarHBondContact OE1-NH2 2.85Å; E160-R163 IonicContact OE2-NE 3.77Å; V161-R163 VanDerWaalsContact C-N 3.29Å; V161-R163 PolarHBondContact O-N 3.41Å; R163-K166 PolarHBondContact O-N 3.5Å; R163-K167 VanDerWaalsContact CZ-NZ 3.31Å; R163-K167 WeakPolarHBondContact O-CG 3.39Å; R163-K167 PolarHBondContact O-N 3.35Å |
| 164 | E | 96.8 | Very high | 95.8 | Very high | 71 Ų | 71 | 98.5 Ų | 98.5 | 33% | 0.332 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68.4 | -39.3 | 179 | -65.9 | -51.8 | 128.1 | 0 | 0 | 112.1 | E160 V161 K166 K167 L168 | E160-E164 WeakPolarHBondContact O-CG 3.32Å; E160-E164 PolarHBondContact O-N 3.15Å; V161-E164 PolarHBondContact O-N 3.36Å; E164-K166 PolarHBondContact O-N 2.95Å; E164-K167 PolarHBondContact O-N 3.44Å; E164-K167 IonicContact OE1-NZ 2.88Å; E164-K167 PolarHBondContact OE1-NZ 2.89Å; E164-K167 IonicContact OE2-NZ 3.58Å; E164-L168 WeakPolarHBondContact O-CB 3.46Å; E164-L168 WeakPolarHBondContact O-CG 3.47Å; E164-L168 PolarHBondContact O-N 3.01Å |
| 165 | L | 97 | Very high | 95.6 | Very high | 96 Ų | 96 | 97.8 Ų | 97.8 | 50% | 0.503 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.1 | -42.7 | 173.1 | -75.1 | 172.6 | 0 | 0 | 0 | 111.9 | V161 L168 L169 | V161-L165 HydrophobicContact CG1-CD1 3.8Å; V161-L165 HydrophobicContact CG1-CG 4.23Å; V161-L165 WeakPolarHBondContact O-CB 3.37Å; V161-L165 VanDerWaalsContact O-CG 3.27Å; V161-L165 WeakPolarHBondContact O-CG 3.35Å; V161-L165 PolarHBondContact O-N 3.34Å; L165-L168 PolarHBondContact O-N 3Å; L165-L169 WeakPolarHBondContact O-CB 3.34Å; L165-L169 PolarHBondContact O-N 2.94Å |
| 166 | K | 97.2 | Very high | 95.6 | Very high | 151 Ų | 151 | 96.5 Ų | 96.5 | 66% | 0.657 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.1 | -41.3 | 176.5 | -173.8 | 176.7 | 179.5 | 178.7 | 0 | 111.5 | N162 R163 E164 L169 V170 | N162-K166 VanDerWaalsContact O-CB 3.32Å; N162-K166 WeakPolarHBondContact O-CB 3.36Å; N162-K166 PolarHBondContact O-N 2.74Å; R163-K166 PolarHBondContact O-N 3.5Å; E164-K166 PolarHBondContact O-N 2.95Å; K166-L169 PolarHBondContact O-N 3.49Å; K166-V170 HydrophobicContact CG-CG2 4.45Å; K166-V170 WeakPolarHBondContact O-CB 3.36Å; K166-V170 VanDerWaalsContact O-CG2 3.22Å; K166-V170 WeakPolarHBondContact O-CG2 3.35Å; K166-V170 PolarHBondContact O-N 3.31Å |
| 167 | K | 95.8 | Very high | 95.5 | Very high | 95 Ų | 95 | 91.7 Ų | 91.7 | 41% | 0.413 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.6 | -47.7 | 174.7 | -73 | 174.1 | -176.7 | 172.1 | 0 | 111.4 | R163 E164 L169 V170 A171 | R163-K167 VanDerWaalsContact CZ-NZ 3.31Å; R163-K167 WeakPolarHBondContact O-CG 3.39Å; R163-K167 PolarHBondContact O-N 3.35Å; E164-K167 PolarHBondContact O-N 3.44Å; E164-K167 IonicContact OE1-NZ 2.88Å; E164-K167 PolarHBondContact OE1-NZ 2.89Å; E164-K167 IonicContact OE2-NZ 3.58Å; K167-L169 PolarHBondContact O-N 2.89Å; K167-V170 PolarHBondContact O-N 3.46Å; K167-A171 WeakPolarHBondContact O-CB 3.22Å; K167-A171 PolarHBondContact O-N 3.26Å |
| 168 | L | 94.9 | Very high | 95.4 | Very high | 114 Ų | 114 | 93.9 Ų | 93.9 | 60% | 0.597 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -61.5 | -43.1 | 178.1 | -78.6 | 168 | 0 | 0 | 0 | 111.7 | E164 L165 A171 S172 | E164-L168 WeakPolarHBondContact O-CB 3.46Å; E164-L168 WeakPolarHBondContact O-CG 3.47Å; E164-L168 PolarHBondContact O-N 3.01Å; L165-L168 PolarHBondContact O-N 3Å; L168-A171 PolarHBondContact O-N 3.26Å; L168-S172 VanDerWaalsContact O-CB 3.31Å; L168-S172 WeakPolarHBondContact O-CB 3.4Å; L168-S172 PolarHBondContact O-N 3.02Å; L168-S172 PolarHBondContact O-OG 3.26Å |
| 169 | L | 95.3 | Very high | 95.4 | Very high | 113 Ų | 113 | 94.4 Ų | 94.4 | 59% | 0.592 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -62.2 | -49.7 | 177.1 | -172.5 | 73.3 | 0 | 0 | 0 | 111 | L165 K166 K167 A171 S172 V173 | L165-L169 WeakPolarHBondContact O-CB 3.34Å; L165-L169 PolarHBondContact O-N 2.94Å; K166-L169 PolarHBondContact O-N 3.49Å; K167-L169 PolarHBondContact O-N 2.89Å; L169-A171 VanDerWaalsContact C-N 3.32Å; L169-A171 PolarHBondContact O-N 3.14Å; L169-S172 WeakPolarHBondContact CA-OG 3.35Å; L169-S172 PolarHBondContact O-N 3.34Å; L169-S172 PolarHBondContact O-OG 3.05Å; L169-V173 HydrophobicContact CD1-CG2 4.26Å; L169-V173 WeakPolarHBondContact O-CG2 3.42Å; L169-V173 PolarHBondContact O-N 3.05Å |
| 170 | V | 95.7 | Very high | 95.4 | Very high | 92 Ų | 92 | 94.1 Ų | 94.1 | 56% | 0.558 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.8 | -41.5 | 178.3 | 171 | 0 | 0 | 0 | 0 | 111.1 | K166 K167 G174 | K166-V170 HydrophobicContact CG-CG2 4.45Å; K166-V170 WeakPolarHBondContact O-CB 3.36Å; K166-V170 VanDerWaalsContact O-CG2 3.22Å; K166-V170 WeakPolarHBondContact O-CG2 3.35Å; K166-V170 PolarHBondContact O-N 3.31Å; K167-V170 PolarHBondContact O-N 3.46Å; V170-G174 VanDerWaalsContact O-CA 3.23Å; V170-G174 WeakPolarHBondContact O-CA 3.35Å; V170-G174 PolarHBondContact O-N 3.32Å |
| 171 | A | 91.2 | Very high | 95.4 | Very high | 56 Ų | 56 | 97 Ų | 97 | 46% | 0.463 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.5 | -42.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | K167 L168 L169 V173 | K167-A171 WeakPolarHBondContact O-CB 3.22Å; K167-A171 PolarHBondContact O-N 3.26Å; L168-A171 PolarHBondContact O-N 3.26Å; L169-A171 VanDerWaalsContact C-N 3.32Å; L169-A171 PolarHBondContact O-N 3.14Å; A171-V173 PolarHBondContact O-N 3.42Å |
| 172 | S | 89.1 | Confident | 95.4 | Very high | 80 Ų | 80 | 98.1 Ų | 98.1 | 56% | 0.559 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -69.5 | -32 | -177.4 | 66.6 | 0 | 0 | 0 | 0 | 114.2 | L168 L169 | L168-S172 VanDerWaalsContact O-CB 3.31Å; L168-S172 WeakPolarHBondContact O-CB 3.4Å; L168-S172 PolarHBondContact O-N 3.02Å; L168-S172 PolarHBondContact O-OG 3.26Å; L169-S172 WeakPolarHBondContact CA-OG 3.35Å; L169-S172 PolarHBondContact O-N 3.34Å; L169-S172 PolarHBondContact O-OG 3.05Å |
| 173 | V | 95.1 | Very high | 95.5 | Very high | 66 Ų | 66 | 98.9 Ų | 98.9 | 40% | 0.4 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -106 | -27.2 | -174.9 | -171.1 | 0 | 0 | 0 | 0 | 111.9 | L169 A171 L177 | L169-V173 HydrophobicContact CD1-CG2 4.26Å; L169-V173 WeakPolarHBondContact O-CG2 3.42Å; L169-V173 PolarHBondContact O-N 3.05Å; A171-V173 PolarHBondContact O-N 3.42Å; V173-L177 HydrophobicContact CG1-CD1 3.78Å; V173-L177 HydrophobicContact CG1-CG 4.02Å; V173-L177 WeakPolarHBondContact O-CB 3.31Å; V173-L177 VanDerWaalsContact O-CG 3.31Å; V173-L177 WeakPolarHBondContact O-CG 3.28Å; V173-L177 PolarHBondContact O-N 2.89Å; V173-L177 VanDerWaalsContact O-N 3.09Å |
| 174 | G | 93.5 | Very high | 95.5 | Very high | 27 Ų | 27 | 97.3 Ų | 97.3 | 28% | 0.278 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.6 | -49.5 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | V170 D176 L177 E178 | V170-G174 VanDerWaalsContact O-CA 3.23Å; V170-G174 WeakPolarHBondContact O-CA 3.35Å; V170-G174 PolarHBondContact O-N 3.32Å; G174-D176 PolarHBondContact O-N 2.93Å; G174-L177 PolarHBondContact O-N 3.26Å; G174-E178 WeakPolarHBondContact O-CB 3.23Å; G174-E178 PolarHBondContact O-N 3.43Å |
| 175 | D | 91.4 | Very high | 95.6 | Very high | 117 Ų | 117 | 96.2 Ų | 96.2 | 63% | 0.626 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.3 | -39.9 | -176.8 | -65.1 | -0.2 | 0 | 0 | 0 | 112.2 | Y179 | D175-Y179 WeakPolarHBondContact O-CB 3.46Å; D175-Y179 PolarHBondContact O-N 3.46Å |
| 176 | D | 95.8 | Very high | 95.7 | Very high | 84 Ų | 84 | 97.6 Ų | 97.6 | 45% | 0.449 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68.1 | -43.5 | 177.7 | -176.3 | 54.2 | 0 | 0 | 0 | 111.6 | G174 Y179 Q180 | G174-D176 PolarHBondContact O-N 2.93Å; D176-Y179 PolarHBondContact O-N 2.85Å; D176-Q180 WeakPolarHBondContact O-CG 3.49Å; D176-Q180 PolarHBondContact O-N 2.92Å; D176-Q180 PolarHBondContact OD2-NE2 3.45Å |
| 177 | L | 96.1 | Very high | 95.8 | Very high | 81 Ų | 81 | 94.8 Ų | 94.8 | 42% | 0.424 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.8 | -44.5 | 176.1 | -72 | 177.2 | 0 | 0 | 0 | 111.5 | V173 G174 Y179 Q180 F181 | V173-L177 HydrophobicContact CG1-CD1 3.78Å; V173-L177 HydrophobicContact CG1-CG 4.02Å; V173-L177 WeakPolarHBondContact O-CB 3.31Å; V173-L177 VanDerWaalsContact O-CG 3.31Å; V173-L177 WeakPolarHBondContact O-CG 3.28Å; V173-L177 PolarHBondContact O-N 2.89Å; V173-L177 VanDerWaalsContact O-N 3.09Å; G174-L177 PolarHBondContact O-N 3.26Å; L177-Y179 VanDerWaalsContact C-N 3.34Å; L177-Y179 PolarHBondContact O-N 3.45Å; L177-Q180 PolarHBondContact O-N 3.49Å; L177-F181 WeakPolarHBondContact O-CB 3.42Å; L177-F181 WeakPolarHBondContact O-CD2 3.46Å; L177-F181 PolarHBondContact O-N 3.2Å |
| 178 | E | 95.2 | Very high | 95.9 | Very high | 136 Ų | 136 | 96.8 Ų | 96.8 | 64% | 0.636 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -57.9 | -47.5 | 177.1 | -175.7 | 170.9 | 179.2 | 0 | 0 | 110.9 | G174 Q180 F181 E182 | G174-E178 WeakPolarHBondContact O-CB 3.23Å; G174-E178 PolarHBondContact O-N 3.43Å; E178-Q180 PolarHBondContact O-N 2.91Å; E178-F181 PolarHBondContact O-N 3.09Å; E178-E182 WeakPolarHBondContact O-CB 3.33Å; E178-E182 PolarHBondContact O-N 3.02Å |
| 179 | Y | 96.3 | Very high | 96.1 | Very high | 133 Ų | 133 | 96 Ų | 96 | 52% | 0.522 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59.8 | -45.8 | 175.7 | 175.7 | -102.7 | 0 | 0 | 0 | 112.5 | D175 D176 L177 F181 E182 R183 | D175-Y179 WeakPolarHBondContact O-CB 3.46Å; D175-Y179 PolarHBondContact O-N 3.46Å; D176-Y179 PolarHBondContact O-N 2.85Å; L177-Y179 VanDerWaalsContact C-N 3.34Å; L177-Y179 PolarHBondContact O-N 3.45Å; Y179-F181 PolarHBondContact O-N 3.26Å; Y179-E182 PolarHBondContact O-N 3.46Å; Y179-R183 WeakPolarHBondContact O-CB 3.36Å; Y179-R183 PolarHBondContact O-N 2.86Å |
| 180 | Q | 97.6 | Very high | 96.2 | Very high | 79 Ų | 79 | 95.3 Ų | 95.3 | 37% | 0.369 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.7 | -42.2 | 179.2 | -73 | -166.1 | 26.3 | 0 | 0 | 112.2 | D176 L177 E178 R183 L184 | D176-Q180 WeakPolarHBondContact O-CG 3.49Å; D176-Q180 PolarHBondContact O-N 2.92Å; D176-Q180 PolarHBondContact OD2-NE2 3.45Å; L177-Q180 PolarHBondContact O-N 3.49Å; E178-Q180 PolarHBondContact O-N 2.91Å; Q180-R183 PolarHBondContact O-N 2.88Å; Q180-L184 WeakPolarHBondContact O-CB 3.45Å; Q180-L184 WeakPolarHBondContact O-CG 3.5Å; Q180-L184 PolarHBondContact O-N 3.35Å |
| 181 | F | 98.2 | Very high | 96.3 | Very high | 147 Ų | 147 | 96.1 Ų | 96.1 | 65% | 0.645 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.1 | -45.2 | 175.1 | -88.2 | -67.3 | 0 | 0 | 0 | 111.8 | L177 E178 Y179 L184 A185 | L177-F181 WeakPolarHBondContact O-CB 3.42Å; L177-F181 WeakPolarHBondContact O-CD2 3.46Å; L177-F181 PolarHBondContact O-N 3.2Å; E178-F181 PolarHBondContact O-N 3.09Å; Y179-F181 PolarHBondContact O-N 3.26Å; F181-L184 PolarHBondContact O-N 3.31Å; F181-A185 VanDerWaalsContact O-CB 3.29Å; F181-A185 WeakPolarHBondContact O-CB 3.18Å; F181-A185 PolarHBondContact O-N 2.99Å |
| 182 | E | 97.9 | Very high | 96.7 | Very high | 101 Ų | 101 | 96.9 Ų | 96.9 | 47% | 0.472 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -67.2 | -38.3 | -179.3 | -152 | -165.9 | 173.1 | 0 | 0 | 111.5 | E178 Y179 A185 R186 | E178-E182 WeakPolarHBondContact O-CB 3.33Å; E178-E182 PolarHBondContact O-N 3.02Å; Y179-E182 PolarHBondContact O-N 3.46Å; E182-A185 PolarHBondContact O-N 2.9Å; E182-R186 VanDerWaalsContact CD-CZ 3.41Å; E182-R186 WeakPolarHBondContact O-CG 3.47Å; E182-R186 PolarHBondContact O-N 3.47Å; E182-R186 VanDerWaalsContact O-N 3.09Å; E182-R186 PolarHBondContact O-NH1 3.23Å; E182-R186 VanDerWaalsContact O-NH1 3.15Å; E182-R186 IonicContact OE1-CZ 3.19Å; E182-R186 IonicContact OE1-NH2 3.72Å; E182-R186 PolarHBondContact OE1-NH2 3.06Å; E182-R186 IonicContact OE2-CZ 2.71Å; E182-R186 IonicContact OE2-NH1 3Å; E182-R186 IonicContact OE2-NH2 3.71Å; E182-R186 PolarHBondContact OE2-NH2 3.29Å |
| 183 | R | 98.1 | Very high | 97.1 | Very high | 112 Ų | 112 | 97.9 Ų | 97.9 | 42% | 0.423 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.5 | -50.5 | 173.6 | -172.8 | -178.3 | 73 | 172.7 | 0.9 | 111.3 | Y179 Q180 A185 R186 E187 | Y179-R183 WeakPolarHBondContact O-CB 3.36Å; Y179-R183 PolarHBondContact O-N 2.86Å; Q180-R183 PolarHBondContact O-N 2.88Å; R183-A185 VanDerWaalsContact C-N 3.28Å; R183-A185 PolarHBondContact O-N 2.95Å; R183-R186 PolarHBondContact O-N 2.99Å; R183-R186 VanDerWaalsContact O-N 3.15Å; R183-E187 WeakPolarHBondContact CG-OE1 3.36Å; R183-E187 IonicContact NE-OE1 2.71Å; R183-E187 WeakPolarHBondContact O-CG 3.47Å; R183-E187 PolarHBondContact O-N 3.44Å |
| 184 | L | 98.5 | Very high | 97.3 | Very high | 92 Ų | 92 | 99 Ų | 99 | 48% | 0.482 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.1 | -38.1 | 177.9 | -78.2 | 165.3 | 0 | 0 | 0 | 112 | Q180 F181 E187 K188 | Q180-L184 WeakPolarHBondContact O-CB 3.45Å; Q180-L184 WeakPolarHBondContact O-CG 3.5Å; Q180-L184 PolarHBondContact O-N 3.35Å; F181-L184 PolarHBondContact O-N 3.31Å; L184-E187 PolarHBondContact O-N 2.83Å; L184-K188 VanDerWaalsContact O-CB 3.28Å; L184-K188 WeakPolarHBondContact O-CB 3.49Å; L184-K188 PolarHBondContact O-N 3.28Å |
| 185 | A | 98.4 | Very high | 97.5 | Very high | 48 Ų | 48 | 103.3 Ų | 103.3 | 40% | 0.397 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.8 | -42.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | F181 E182 R183 N189 | F181-A185 VanDerWaalsContact O-CB 3.29Å; F181-A185 WeakPolarHBondContact O-CB 3.18Å; F181-A185 PolarHBondContact O-N 2.99Å; E182-A185 PolarHBondContact O-N 2.9Å; R183-A185 VanDerWaalsContact C-N 3.28Å; R183-A185 PolarHBondContact O-N 2.95Å; A185-N189 PolarHBondContact O-N 3.31Å; A185-N189 PolarHBondContact O-ND2 3.19Å |
| 186 | R | 98.4 | Very high | 97.9 | Very high | 125 Ų | 125 | 102.8 Ų | 102.8 | 47% | 0.472 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.9 | -47.1 | 175.2 | -68.6 | 179.8 | -159.3 | 101.3 | -15.4 | 112 | E182 R183 K188 N189 Q190 | E182-R186 VanDerWaalsContact CD-CZ 3.41Å; E182-R186 WeakPolarHBondContact O-CG 3.47Å; E182-R186 PolarHBondContact O-N 3.47Å; E182-R186 VanDerWaalsContact O-N 3.09Å; E182-R186 PolarHBondContact O-NH1 3.23Å; E182-R186 VanDerWaalsContact O-NH1 3.15Å; E182-R186 IonicContact OE1-CZ 3.19Å; E182-R186 IonicContact OE1-NH2 3.72Å; E182-R186 PolarHBondContact OE1-NH2 3.06Å; E182-R186 IonicContact OE2-CZ 2.71Å; E182-R186 IonicContact OE2-NH1 3Å; E182-R186 IonicContact OE2-NH2 3.71Å; E182-R186 PolarHBondContact OE2-NH2 3.29Å; R183-R186 PolarHBondContact O-N 2.99Å; R183-R186 VanDerWaalsContact O-N 3.15Å; R186-K188 VanDerWaalsContact C-N 3.34Å; R186-K188 PolarHBondContact O-N 2.88Å; R186-N189 PolarHBondContact O-N 3.17Å; R186-Q190 PolarHBondContact O-N 3.31Å |
| 187 | E | 98.4 | Very high | 98 | Very high | 92 Ų | 92 | 100.8 Ų | 100.8 | 43% | 0.43 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59.7 | -44 | 177.3 | -72.6 | 172.3 | -174.3 | 0 | 0 | 111.4 | R183 L184 N189 Q190 L191 | R183-E187 WeakPolarHBondContact CG-OE1 3.36Å; R183-E187 IonicContact NE-OE1 2.71Å; R183-E187 WeakPolarHBondContact O-CG 3.47Å; R183-E187 PolarHBondContact O-N 3.44Å; L184-E187 PolarHBondContact O-N 2.83Å; E187-N189 PolarHBondContact O-N 3.22Å; E187-Q190 WeakPolarHBondContact O-CB 3.29Å; E187-Q190 PolarHBondContact O-N 3.45Å; E187-L191 WeakPolarHBondContact O-CG 3.48Å; E187-L191 PolarHBondContact O-N 2.8Å |
| 188 | K | 98.5 | Very high | 98.1 | Very high | 137 Ų | 137 | 102.8 Ų | 102.8 | 60% | 0.596 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -59.2 | -46.2 | 174.7 | -179.2 | -173.7 | 172.6 | -176.9 | 0 | 111.7 | L184 R186 Q190 L191 I192 | L184-K188 VanDerWaalsContact O-CB 3.28Å; L184-K188 WeakPolarHBondContact O-CB 3.49Å; L184-K188 PolarHBondContact O-N 3.28Å; R186-K188 VanDerWaalsContact C-N 3.34Å; R186-K188 PolarHBondContact O-N 2.88Å; K188-Q190 VanDerWaalsContact C-N 3.31Å; K188-Q190 PolarHBondContact O-N 2.99Å; K188-L191 PolarHBondContact O-N 3.21Å; K188-I192 HydrophobicContact CG-CD1 4.14Å; K188-I192 VanDerWaalsContact O-CG1 3.3Å; K188-I192 WeakPolarHBondContact O-CG1 3.39Å; K188-I192 PolarHBondContact O-N 3.48Å |
| 189 | N | 98.5 | Very high | 98.3 | Very high | 97 Ų | 97 | 98.1 Ų | 98.1 | 52% | 0.519 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.4 | -39.3 | 178.7 | -71.1 | -21.7 | 0 | 0 | 0 | 111.6 | A185 R186 E187 I192 L193 | A185-N189 PolarHBondContact O-N 3.31Å; A185-N189 PolarHBondContact O-ND2 3.19Å; R186-N189 PolarHBondContact O-N 3.17Å; E187-N189 PolarHBondContact O-N 3.22Å; N189-I192 PolarHBondContact O-N 3.44Å; N189-L193 WeakPolarHBondContact O-CG 3.3Å; N189-L193 PolarHBondContact O-N 3.34Å; N189-L193 VanDerWaalsContact O-N 3.17Å |
| 190 | Q | 98.5 | Very high | 98.4 | Very high | 99 Ų | 99 | 99.8 Ų | 99.8 | 46% | 0.463 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.7 | -47 | 174.7 | -177.9 | 60.2 | 26 | 0 | 0 | 111.5 | R186 E187 K188 I192 L193 E194 | R186-Q190 PolarHBondContact O-N 3.31Å; E187-Q190 WeakPolarHBondContact O-CB 3.29Å; E187-Q190 PolarHBondContact O-N 3.45Å; K188-Q190 VanDerWaalsContact C-N 3.31Å; K188-Q190 PolarHBondContact O-N 2.99Å; Q190-I192 VanDerWaalsContact C-N 3.28Å; Q190-I192 PolarHBondContact O-N 2.92Å; Q190-L193 PolarHBondContact O-N 3.43Å; Q190-E194 WeakPolarHBondContact CG-OE1 3.47Å; Q190-E194 PolarHBondContact NE2-OE1 3.06Å; Q190-E194 WeakPolarHBondContact O-CG 3.48Å; Q190-E194 PolarHBondContact O-N 3.24Å |
| 191 | L | 98.6 | Very high | 98.5 | Very high | 110 Ų | 110 | 99.3 Ų | 99.3 | 58% | 0.576 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62.2 | -34.4 | 177 | -71.9 | 174.1 | 0 | 0 | 0 | 112.7 | E187 K188 N195 | E187-L191 WeakPolarHBondContact O-CG 3.48Å; E187-L191 PolarHBondContact O-N 2.8Å; K188-L191 PolarHBondContact O-N 3.21Å; L191-N195 VanDerWaalsContact O-CB 3.25Å; L191-N195 WeakPolarHBondContact O-CB 3.28Å; L191-N195 PolarHBondContact O-N 2.97Å |
| 192 | I | 98.6 | Very high | 98.5 | Very high | 72 Ų | 72 | 98 Ų | 98 | 37% | 0.369 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.4 | -48.3 | 174.6 | -70.9 | 164.5 | 0 | 0 | 0 | 110.3 | K188 N189 Q190 E194 N195 E196 | K188-I192 HydrophobicContact CG-CD1 4.14Å; K188-I192 VanDerWaalsContact O-CG1 3.3Å; K188-I192 WeakPolarHBondContact O-CG1 3.39Å; K188-I192 PolarHBondContact O-N 3.48Å; N189-I192 PolarHBondContact O-N 3.44Å; Q190-I192 VanDerWaalsContact C-N 3.28Å; Q190-I192 PolarHBondContact O-N 2.92Å; I192-E194 VanDerWaalsContact C-N 3.34Å; I192-E194 PolarHBondContact O-N 3.44Å; I192-N195 PolarHBondContact O-N 3.42Å; I192-E196 WeakPolarHBondContact O-CG 3.25Å; I192-E196 PolarHBondContact O-N 3.45Å |
| 193 | L | 98.6 | Very high | 98.5 | Very high | 100 Ų | 100 | 96 Ų | 96 | 52% | 0.524 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.4 | -39.9 | 179.4 | -66.3 | 174.1 | 0 | 0 | 0 | 112.2 | N189 Q190 E196 A197 | N189-L193 WeakPolarHBondContact O-CG 3.3Å; N189-L193 PolarHBondContact O-N 3.34Å; N189-L193 VanDerWaalsContact O-N 3.17Å; Q190-L193 PolarHBondContact O-N 3.43Å; L193-E196 PolarHBondContact O-N 3.25Å; L193-A197 WeakPolarHBondContact O-CB 3.36Å; L193-A197 PolarHBondContact O-N 2.96Å |
| 194 | E | 98.5 | Very high | 98.5 | Very high | 91 Ų | 91 | 95.7 Ų | 95.7 | 43% | 0.425 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.2 | -42.5 | 175.3 | -73.2 | 174.3 | -167.2 | 0 | 0 | 111.7 | Q190 I192 E196 A197 L198 | Q190-E194 WeakPolarHBondContact CG-OE1 3.47Å; Q190-E194 PolarHBondContact NE2-OE1 3.06Å; Q190-E194 WeakPolarHBondContact O-CG 3.48Å; Q190-E194 PolarHBondContact O-N 3.24Å; I192-E194 VanDerWaalsContact C-N 3.34Å; I192-E194 PolarHBondContact O-N 3.44Å; E194-E196 VanDerWaalsContact C-N 3.35Å; E194-E196 PolarHBondContact O-N 3.3Å; E194-A197 PolarHBondContact O-N 3.39Å; E194-L198 WeakPolarHBondContact O-CG 3.37Å; E194-L198 PolarHBondContact O-N 2.96Å |
| 195 | N | 98.4 | Very high | 98.5 | Very high | 116 Ų | 116 | 95 Ų | 95 | 62% | 0.62 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.9 | -43.4 | 176 | -164.6 | -55.8 | 0 | 0 | 0 | 111.3 | L191 I192 A197 L198 G199 | L191-N195 VanDerWaalsContact O-CB 3.25Å; L191-N195 WeakPolarHBondContact O-CB 3.28Å; L191-N195 PolarHBondContact O-N 2.97Å; I192-N195 PolarHBondContact O-N 3.42Å; N195-A197 VanDerWaalsContact C-N 3.33Å; N195-A197 PolarHBondContact O-N 3.37Å; N195-L198 PolarHBondContact O-N 3.08Å; N195-G199 PolarHBondContact O-N 2.87Å |
| 196 | E | 98.6 | Very high | 98.5 | Very high | 106 Ų | 106 | 95.1 Ų | 95.1 | 50% | 0.495 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.6 | -38.2 | 174.7 | -72.9 | 175.9 | 179.4 | 0 | 0 | 112.6 | I192 L193 E194 R200 | I192-E196 WeakPolarHBondContact O-CG 3.25Å; I192-E196 PolarHBondContact O-N 3.45Å; L193-E196 PolarHBondContact O-N 3.25Å; E194-E196 VanDerWaalsContact C-N 3.35Å; E194-E196 PolarHBondContact O-N 3.3Å; E196-R200 WeakPolarHBondContact O-CG 3.43Å; E196-R200 PolarHBondContact O-N 3.37Å; E196-R200 VanDerWaalsContact O-N 3.08Å; E196-R200 PolarHBondContact O-NE 3.32Å |
| 197 | A | 98.5 | Very high | 98.6 | Very high | 43 Ų | 43 | 93.2 Ų | 93.2 | 36% | 0.355 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.8 | -44.5 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | L193 E194 N195 G199 R200 S201 | L193-A197 WeakPolarHBondContact O-CB 3.36Å; L193-A197 PolarHBondContact O-N 2.96Å; E194-A197 PolarHBondContact O-N 3.39Å; N195-A197 VanDerWaalsContact C-N 3.33Å; N195-A197 PolarHBondContact O-N 3.37Å; A197-G199 VanDerWaalsContact C-N 3.35Å; A197-R200 PolarHBondContact O-N 3.22Å; A197-S201 PolarHBondContact O-N 3.09Å |
| 198 | L | 98.6 | Very high | 98.6 | Very high | 122 Ų | 122 | 92.7 Ų | 92.7 | 64% | 0.639 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -63.4 | -40.8 | 175.3 | -70.6 | 174.1 | 0 | 0 | 0 | 111.6 | E194 N195 R200 S201 L202 | E194-L198 WeakPolarHBondContact O-CG 3.37Å; E194-L198 PolarHBondContact O-N 2.96Å; N195-L198 PolarHBondContact O-N 3.08Å; L198-R200 PolarHBondContact O-N 3.4Å; L198-S201 PolarHBondContact O-N 2.97Å; L198-L202 WeakPolarHBondContact O-CB 3.35Å; L198-L202 PolarHBondContact O-N 2.85Å |
| 199 | G | 98.6 | Very high | 98.6 | Very high | 38 Ų | 38 | 92.2 Ų | 92.2 | 39% | 0.392 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.3 | -43.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | N195 A197 L202 S203 | N195-G199 PolarHBondContact O-N 2.87Å; A197-G199 VanDerWaalsContact C-N 3.35Å; G199-L202 PolarHBondContact O-N 3.41Å; G199-S203 PolarHBondContact O-N 3.45Å; G199-S203 PolarHBondContact O-OG 2.91Å |
| 200 | R | 98.6 | Very high | 98.6 | Very high | 169 Ų | 169 | 93.3 Ų | 93.3 | 64% | 0.638 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.8 | -39.4 | 174.4 | -73.5 | -178 | -71.5 | 140.2 | -7 | 112.9 | E196 A197 L198 S203 H204 | E196-R200 WeakPolarHBondContact O-CG 3.43Å; E196-R200 PolarHBondContact O-N 3.37Å; E196-R200 VanDerWaalsContact O-N 3.08Å; E196-R200 PolarHBondContact O-NE 3.32Å; A197-R200 PolarHBondContact O-N 3.22Å; L198-R200 PolarHBondContact O-N 3.4Å; R200-S203 PolarHBondContact O-OG 3.05Å; R200-H204 WeakPolarHBondContact O-CB 3.39Å; R200-H204 PolarHBondContact O-N 3.47Å; R200-H204 VanDerWaalsContact O-N 3.09Å |
| 201 | S | 98.6 | Very high | 98.6 | Very high | 69 Ų | 69 | 94.4 Ų | 94.4 | 48% | 0.483 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.2 | -42.5 | 175.5 | -173 | 0 | 0 | 0 | 0 | 111.1 | A197 L198 H204 T205 | A197-S201 PolarHBondContact O-N 3.09Å; L198-S201 PolarHBondContact O-N 2.97Å; S201-H204 PolarHBondContact O-N 3.37Å; S201-T205 WeakPolarHBondContact O-CG2 3.38Å; S201-T205 PolarHBondContact O-N 3.27Å; S201-T205 PolarHBondContact O-OG1 3.46Å |
| 202 | L | 98.7 | Very high | 98.6 | Very high | 120 Ų | 120 | 95.2 Ų | 95.2 | 63% | 0.628 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.8 | -47.5 | 179.6 | -175.1 | 141.4 | 0 | 0 | 0 | 111.1 | L198 G199 H204 T205 A206 | L198-L202 WeakPolarHBondContact O-CB 3.35Å; L198-L202 PolarHBondContact O-N 2.85Å; G199-L202 PolarHBondContact O-N 3.41Å; L202-H204 VanDerWaalsContact C-N 3.32Å; L202-H204 PolarHBondContact O-N 2.94Å; L202-T205 WeakPolarHBondContact CA-OG1 3.35Å; L202-T205 PolarHBondContact O-N 2.95Å; L202-T205 PolarHBondContact O-OG1 2.87Å; L202-A206 WeakPolarHBondContact O-CB 3.42Å; L202-A206 PolarHBondContact O-N 3.01Å |
| 203 | S | 98.6 | Very high | 98.6 | Very high | 58 Ų | 58 | 94.7 Ų | 94.7 | 41% | 0.406 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.2 | -44.4 | 176.4 | 64.7 | 0 | 0 | 0 | 0 | 111.5 | G199 R200 T205 A206 E207 | G199-S203 PolarHBondContact O-N 3.45Å; G199-S203 PolarHBondContact O-OG 2.91Å; R200-S203 PolarHBondContact O-OG 3.05Å; S203-T205 PolarHBondContact O-N 3.12Å; S203-A206 PolarHBondContact O-N 3.26Å; S203-E207 WeakPolarHBondContact O-CG 3.49Å; S203-E207 PolarHBondContact O-N 3.34Å |
| 204 | H | 98.7 | Very high | 98.6 | Very high | 105 Ų | 105 | 94.3 Ų | 94.3 | 49% | 0.486 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.3 | -47.6 | 176.5 | -175.3 | 70.3 | 0 | 0 | 0 | 112.2 | R200 S201 L202 A206 E207 Q208 | R200-H204 WeakPolarHBondContact O-CB 3.39Å; R200-H204 PolarHBondContact O-N 3.47Å; R200-H204 VanDerWaalsContact O-N 3.09Å; S201-H204 PolarHBondContact O-N 3.37Å; L202-H204 VanDerWaalsContact C-N 3.32Å; L202-H204 PolarHBondContact O-N 2.94Å; H204-A206 VanDerWaalsContact C-N 3.33Å; H204-A206 PolarHBondContact O-N 3.37Å; H204-E207 PolarHBondContact O-N 2.83Å; H204-Q208 WeakPolarHBondContact O-CG 3.48Å; H204-Q208 PolarHBondContact O-N 2.91Å |
| 205 | T | 98.4 | Very high | 98.6 | Very high | 79 Ų | 79 | 95.1 Ų | 95.1 | 49% | 0.485 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.8 | -35.2 | 178.4 | 56.8 | 0 | 0 | 0 | 0 | 112.9 | S201 L202 S203 Q208 L209 | S201-T205 WeakPolarHBondContact O-CG2 3.38Å; S201-T205 PolarHBondContact O-N 3.27Å; S201-T205 PolarHBondContact O-OG1 3.46Å; L202-T205 WeakPolarHBondContact CA-OG1 3.35Å; L202-T205 PolarHBondContact O-N 2.95Å; L202-T205 PolarHBondContact O-OG1 2.87Å; S203-T205 PolarHBondContact O-N 3.12Å; T205-Q208 PolarHBondContact O-N 3.37Å; T205-L209 WeakPolarHBondContact O-CB 3.45Å; T205-L209 PolarHBondContact O-N 2.84Å |
| 206 | A | 98.6 | Very high | 98.6 | Very high | 50 Ų | 50 | 93.4 Ų | 93.4 | 41% | 0.413 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.9 | -44.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | L202 S203 H204 Q208 L209 E210 | L202-A206 WeakPolarHBondContact O-CB 3.42Å; L202-A206 PolarHBondContact O-N 3.01Å; S203-A206 PolarHBondContact O-N 3.26Å; H204-A206 VanDerWaalsContact C-N 3.33Å; H204-A206 PolarHBondContact O-N 3.37Å; A206-Q208 PolarHBondContact O-N 3.38Å; A206-L209 PolarHBondContact O-N 3.39Å; A206-E210 PolarHBondContact O-N 3.18Å |
| 207 | E | 98.6 | Very high | 98.6 | Very high | 85 Ų | 85 | 93 Ų | 93 | 40% | 0.397 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.2 | -37.9 | 175.3 | -65 | 179 | -168 | 0 | 0 | 112.5 | S203 H204 L209 E210 R211 | S203-E207 WeakPolarHBondContact O-CG 3.49Å; S203-E207 PolarHBondContact O-N 3.34Å; H204-E207 PolarHBondContact O-N 2.83Å; E207-L209 VanDerWaalsContact C-N 3.31Å; E207-E210 PolarHBondContact O-N 2.81Å; E207-R211 WeakPolarHBondContact O-CB 3.28Å; E207-R211 VanDerWaalsContact O-CG 3.28Å; E207-R211 WeakPolarHBondContact O-CG 3.48Å; E207-R211 PolarHBondContact O-N 3.01Å; E207-R211 IonicContact OE2-CZ 3.48Å; E207-R211 IonicContact OE2-NH1 3.58Å; E207-R211 PolarHBondContact OE2-NH1 2.93Å; E207-R211 IonicContact OE2-NH2 3.51Å; E207-R211 PolarHBondContact OE2-NH2 3.46Å |
| 208 | Q | 98.7 | Very high | 98.6 | Very high | 81 Ų | 81 | 93.3 Ų | 93.3 | 38% | 0.379 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.9 | -41.3 | 175 | -69.3 | -57.2 | -31.9 | 0 | 0 | 111.3 | H204 T205 A206 R211 M212 | H204-Q208 WeakPolarHBondContact O-CG 3.48Å; H204-Q208 PolarHBondContact O-N 2.91Å; T205-Q208 PolarHBondContact O-N 3.37Å; A206-Q208 PolarHBondContact O-N 3.38Å; Q208-R211 PolarHBondContact O-N 3.23Å; Q208-M212 WeakPolarHBondContact O-CB 3.41Å; Q208-M212 WeakPolarHBondContact O-CG 3.26Å; Q208-M212 PolarHBondContact O-N 3.07Å |
| 209 | L | 98.6 | Very high | 98.6 | Very high | 126 Ų | 126 | 95.2 Ų | 95.2 | 66% | 0.66 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.7 | -42.1 | 176.3 | -174.4 | 140.4 | 0 | 0 | 0 | 111.5 | T205 A206 E207 M212 S213 | T205-L209 WeakPolarHBondContact O-CB 3.45Å; T205-L209 PolarHBondContact O-N 2.84Å; A206-L209 PolarHBondContact O-N 3.39Å; E207-L209 VanDerWaalsContact C-N 3.31Å; L209-M212 PolarHBondContact O-N 2.9Å; L209-S213 WeakPolarHBondContact O-CB 3.36Å; L209-S213 PolarHBondContact O-N 3.26Å |
| 210 | E | 98.5 | Very high | 98.6 | Very high | 121 Ų | 121 | 101.8 Ų | 101.8 | 57% | 0.565 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.8 | -46.3 | 175.1 | -171.8 | 178.6 | -176.9 | 0 | 0 | 111.6 | A206 E207 M212 S213 I214 | A206-E210 PolarHBondContact O-N 3.18Å; E207-E210 PolarHBondContact O-N 2.81Å; E210-M212 VanDerWaalsContact C-N 3.33Å; E210-M212 PolarHBondContact O-N 3.41Å; E210-S213 WeakPolarHBondContact O-CB 3.46Å; E210-S213 PolarHBondContact O-N 3.27Å; E210-S213 VanDerWaalsContact O-N 3.15Å; E210-I214 HydrophobicContact CG-CD1 4.14Å; E210-I214 WeakPolarHBondContact O-CG1 3.32Å; E210-I214 PolarHBondContact O-N 3.11Å |
| 211 | R | 98.6 | Very high | 98.6 | Very high | 121 Ų | 121 | 97 Ų | 97 | 46% | 0.457 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -57.5 | -45.2 | 175.1 | -72.7 | 176.5 | -173.1 | 104.8 | 8.2 | 111.6 | E207 Q208 Q215 | E207-R211 WeakPolarHBondContact O-CB 3.28Å; E207-R211 VanDerWaalsContact O-CG 3.28Å; E207-R211 WeakPolarHBondContact O-CG 3.48Å; E207-R211 PolarHBondContact O-N 3.01Å; E207-R211 IonicContact OE2-CZ 3.48Å; E207-R211 IonicContact OE2-NH1 3.58Å; E207-R211 PolarHBondContact OE2-NH1 2.93Å; E207-R211 IonicContact OE2-NH2 3.51Å; E207-R211 PolarHBondContact OE2-NH2 3.46Å; Q208-R211 PolarHBondContact O-N 3.23Å; R211-Q215 VanDerWaalsContact O-CG 3.32Å; R211-Q215 WeakPolarHBondContact O-CG 3.38Å; R211-Q215 PolarHBondContact O-N 2.94Å; R211-Q215 VanDerWaalsContact O-N 3.11Å |
| 212 | M | 98.4 | Very high | 98.6 | Very high | 128 Ų | 128 | 99.3 Ų | 99.3 | 63% | 0.631 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.8 | -39.7 | 176.5 | -73 | -172 | 71.4 | 0 | 0 | 112.2 | Q208 L209 E210 Q215 C216 | Q208-M212 WeakPolarHBondContact O-CB 3.41Å; Q208-M212 WeakPolarHBondContact O-CG 3.26Å; Q208-M212 PolarHBondContact O-N 3.07Å; L209-M212 PolarHBondContact O-N 2.9Å; E210-M212 VanDerWaalsContact C-N 3.33Å; E210-M212 PolarHBondContact O-N 3.41Å; M212-Q215 PolarHBondContact O-N 3.15Å; M212-C216 PolarHBondContact O-N 3.48Å; M212-C216 PolarHBondContact O-SG 2.91Å; M212-C216 VanDerWaalsContact O-SG 3.34Å |
| 213 | S | 98.5 | Very high | 98.6 | Very high | 61 Ų | 61 | 99.9 Ų | 99.9 | 43% | 0.427 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.5 | -47 | 176.8 | -170.8 | 0 | 0 | 0 | 0 | 111.4 | L209 E210 Q215 C216 D217 | L209-S213 WeakPolarHBondContact O-CB 3.36Å; L209-S213 PolarHBondContact O-N 3.26Å; E210-S213 WeakPolarHBondContact O-CB 3.46Å; E210-S213 PolarHBondContact O-N 3.27Å; E210-S213 VanDerWaalsContact O-N 3.15Å; S213-Q215 VanDerWaalsContact C-N 3.31Å; S213-Q215 PolarHBondContact O-N 3.39Å; S213-C216 WeakPolarHBondContact O-CB 3.33Å; S213-C216 PolarHBondContact O-N 3.45Å; S213-D217 PolarHBondContact O-N 3.5Å |
| 214 | I | 98.5 | Very high | 98.6 | Very high | 91 Ų | 91 | 100.2 Ų | 100.2 | 47% | 0.467 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.5 | -43.6 | 177.1 | -65.7 | 164.9 | 0 | 0 | 0 | 110.4 | E210 C216 D217 V218 | E210-I214 HydrophobicContact CG-CD1 4.14Å; E210-I214 WeakPolarHBondContact O-CG1 3.32Å; E210-I214 PolarHBondContact O-N 3.11Å; I214-C216 VanDerWaalsContact C-N 3.35Å; I214-C216 PolarHBondContact O-N 3.46Å; I214-D217 PolarHBondContact O-N 2.98Å; I214-V218 HydrophobicContact CG2-CG2 4.48Å; I214-V218 WeakPolarHBondContact O-CG2 3.47Å; I214-V218 PolarHBondContact O-N 3.37Å |
| 215 | Q | 98.6 | Very high | 98.5 | Very high | 108 Ų | 108 | 97.8 Ų | 97.8 | 51% | 0.505 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.7 | -43.7 | 176.4 | -71.5 | -69.5 | -29.7 | 0 | 0 | 111.7 | R211 M212 S213 D217 V218 W219 | R211-Q215 VanDerWaalsContact O-CG 3.32Å; R211-Q215 WeakPolarHBondContact O-CG 3.38Å; R211-Q215 PolarHBondContact O-N 2.94Å; R211-Q215 VanDerWaalsContact O-N 3.11Å; M212-Q215 PolarHBondContact O-N 3.15Å; S213-Q215 VanDerWaalsContact C-N 3.31Å; S213-Q215 PolarHBondContact O-N 3.39Å; Q215-D217 VanDerWaalsContact C-N 3.3Å; Q215-D217 PolarHBondContact O-N 2.85Å; Q215-V218 PolarHBondContact O-N 3.35Å; Q215-W219 PolarHBondContact O-N 2.89Å |
| 216 | C | 98.6 | Very high | 98.5 | Very high | 80 Ų | 80 | 97.2 Ų | 97.2 | 54% | 0.541 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -57 | -43 | 175.4 | -73.8 | 0 | 0 | 0 | 0 | 112 | M212 S213 I214 W219 R220 | M212-C216 PolarHBondContact O-N 3.48Å; M212-C216 PolarHBondContact O-SG 2.91Å; M212-C216 VanDerWaalsContact O-SG 3.34Å; S213-C216 WeakPolarHBondContact O-CB 3.33Å; S213-C216 PolarHBondContact O-N 3.45Å; I214-C216 VanDerWaalsContact C-N 3.35Å; I214-C216 PolarHBondContact O-N 3.46Å; C216-W219 PolarHBondContact O-N 2.96Å; C216-R220 VanDerWaalsContact O-CB 3.26Å; C216-R220 WeakPolarHBondContact O-CB 3.44Å; C216-R220 PolarHBondContact O-N 3.42Å |
| 217 | D | 98.5 | Very high | 98.5 | Very high | 98 Ų | 98 | 100.3 Ų | 100.3 | 52% | 0.524 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -68.4 | -39 | 178.5 | -72.5 | -22.9 | 0 | 0 | 0 | 112.7 | S213 I214 Q215 R220 S221 | S213-D217 PolarHBondContact O-N 3.5Å; I214-D217 PolarHBondContact O-N 2.98Å; Q215-D217 VanDerWaalsContact C-N 3.3Å; Q215-D217 PolarHBondContact O-N 2.85Å; D217-R220 PolarHBondContact O-N 2.89Å; D217-S221 WeakPolarHBondContact O-CB 3.36Å; D217-S221 PolarHBondContact O-N 2.89Å; D217-S221 PolarHBondContact O-OG 3.26Å |
| 218 | V | 98.7 | Very high | 98.5 | Very high | 50 Ų | 50 | 99.3 Ų | 99.3 | 30% | 0.303 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.2 | -45.2 | 173.6 | 171.4 | 0 | 0 | 0 | 0 | 110.7 | I214 Q215 S221 K222 | I214-V218 HydrophobicContact CG2-CG2 4.48Å; I214-V218 WeakPolarHBondContact O-CG2 3.47Å; I214-V218 PolarHBondContact O-N 3.37Å; Q215-V218 PolarHBondContact O-N 3.35Å; V218-S221 WeakPolarHBondContact CA-OG 3.3Å; V218-S221 PolarHBondContact O-N 2.98Å; V218-S221 PolarHBondContact O-OG 3.33Å; V218-K222 HydrophobicContact CG1-CD 3.96Å; V218-K222 HydrophobicContact CG1-CG 4.49Å; V218-K222 WeakPolarHBondContact O-CB 3.26Å; V218-K222 VanDerWaalsContact O-CG 3.26Å; V218-K222 WeakPolarHBondContact O-CG 3.37Å; V218-K222 PolarHBondContact O-N 2.81Å |
| 219 | W | 98.6 | Very high | 98.5 | Very high | 162 Ų | 162 | 101.2 Ų | 101.2 | 61% | 0.614 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -67.8 | -40.3 | 177.8 | -78.1 | 111.7 | 0 | 0 | 0 | 112.4 | Q215 C216 K222 F223 | Q215-W219 PolarHBondContact O-N 2.89Å; C216-W219 PolarHBondContact O-N 2.96Å; W219-K222 HydrophobicContact CE3-CD 4.45Å; W219-K222 PolarHBondContact O-N 3.5Å; W219-F223 VanDerWaalsContact O-CB 3.3Å; W219-F223 WeakPolarHBondContact O-CB 3.39Å; W219-F223 PolarHBondContact O-N 3.42Å |
| 220 | R | 98.7 | Very high | 98.5 | Very high | 176 Ų | 176 | 97.6 Ų | 97.6 | 66% | 0.664 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60 | -47.9 | 175.4 | -172.5 | -177.1 | -173.8 | 111.1 | 0.6 | 111.2 | C216 D217 F223 L224 | C216-R220 VanDerWaalsContact O-CB 3.26Å; C216-R220 WeakPolarHBondContact O-CB 3.44Å; C216-R220 PolarHBondContact O-N 3.42Å; D217-R220 PolarHBondContact O-N 2.89Å; R220-F223 PolarHBondContact O-N 3.47Å; R220-L224 HydrophobicContact CG-CD1 4.17Å; R220-L224 WeakPolarHBondContact O-CB 3.36Å; R220-L224 VanDerWaalsContact O-CG 3.24Å; R220-L224 WeakPolarHBondContact O-CG 3.47Å; R220-L224 PolarHBondContact O-N 2.96Å |
| 221 | S | 98.5 | Very high | 98.4 | Very high | 68 Ų | 68 | 96.1 Ų | 96.1 | 48% | 0.476 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.7 | -43.8 | 179.1 | 56 | 0 | 0 | 0 | 0 | 112.4 | D217 V218 F223 L224 A225 | D217-S221 WeakPolarHBondContact O-CB 3.36Å; D217-S221 PolarHBondContact O-N 2.89Å; D217-S221 PolarHBondContact O-OG 3.26Å; V218-S221 WeakPolarHBondContact CA-OG 3.3Å; V218-S221 PolarHBondContact O-N 2.98Å; V218-S221 PolarHBondContact O-OG 3.33Å; S221-F223 PolarHBondContact O-N 2.87Å; S221-L224 PolarHBondContact O-N 3.45Å; S221-A225 WeakPolarHBondContact O-CB 3.39Å; S221-A225 PolarHBondContact O-N 2.9Å |
| 222 | K | 98.6 | Very high | 98.4 | Very high | 117 Ų | 117 | 96.2 Ų | 96.2 | 51% | 0.509 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59 | -46 | 174.2 | -75.9 | 174.9 | 179.6 | 176.4 | 0 | 112.2 | V218 W219 A225 S226 | V218-K222 HydrophobicContact CG1-CD 3.96Å; V218-K222 HydrophobicContact CG1-CG 4.49Å; V218-K222 WeakPolarHBondContact O-CB 3.26Å; V218-K222 VanDerWaalsContact O-CG 3.26Å; V218-K222 WeakPolarHBondContact O-CG 3.37Å; V218-K222 PolarHBondContact O-N 2.81Å; W219-K222 HydrophobicContact CE3-CD 4.45Å; W219-K222 PolarHBondContact O-N 3.5Å; K222-A225 PolarHBondContact O-N 3.38Å; K222-S226 VanDerWaalsContact O-CB 3.31Å; K222-S226 WeakPolarHBondContact O-CB 3.36Å; K222-S226 PolarHBondContact O-N 3.18Å |
| 223 | F | 98.6 | Very high | 98.4 | Very high | 133 Ų | 133 | 96.2 Ų | 96.2 | 58% | 0.583 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.5 | -45.2 | 178.2 | 177 | -99.3 | 0 | 0 | 0 | 111.6 | W219 R220 S221 S226 R227 | W219-F223 VanDerWaalsContact O-CB 3.3Å; W219-F223 WeakPolarHBondContact O-CB 3.39Å; W219-F223 PolarHBondContact O-N 3.42Å; R220-F223 PolarHBondContact O-N 3.47Å; S221-F223 PolarHBondContact O-N 2.87Å; F223-S226 PolarHBondContact O-N 3.42Å; F223-R227 WeakPolarHBondContact O-CB 3.44Å; F223-R227 PolarHBondContact O-N 3.45Å |
| 224 | L | 98.6 | Very high | 98.4 | Very high | 65 Ų | 65 | 97.3 Ų | 97.3 | 34% | 0.34 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.8 | -44.1 | 178.5 | -71.1 | 172.3 | 0 | 0 | 0 | 112 | R220 S221 R227 V228 | R220-L224 HydrophobicContact CG-CD1 4.17Å; R220-L224 WeakPolarHBondContact O-CB 3.36Å; R220-L224 VanDerWaalsContact O-CG 3.24Å; R220-L224 WeakPolarHBondContact O-CG 3.47Å; R220-L224 PolarHBondContact O-N 2.96Å; S221-L224 PolarHBondContact O-N 3.45Å; L224-R227 PolarHBondContact O-N 2.91Å; L224-V228 WeakPolarHBondContact O-CG2 3.24Å; L224-V228 PolarHBondContact O-N 3.15Å |
| 225 | A | 98.3 | Very high | 98.3 | Very high | 53 Ų | 53 | 98.1 Ų | 98.1 | 44% | 0.438 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62 | -45.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | S221 K222 R227 V228 M229 | S221-A225 WeakPolarHBondContact O-CB 3.39Å; S221-A225 PolarHBondContact O-N 2.9Å; K222-A225 PolarHBondContact O-N 3.38Å; A225-R227 VanDerWaalsContact C-N 3.31Å; A225-R227 PolarHBondContact O-N 3.24Å; A225-V228 PolarHBondContact O-N 2.91Å; A225-M229 WeakPolarHBondContact O-CG 3.48Å; A225-M229 PolarHBondContact O-N 3.21Å |
| 226 | S | 98.3 | Very high | 98.2 | Very high | 68 Ų | 68 | 95.2 Ų | 95.2 | 48% | 0.476 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.5 | -40 | 176.2 | 178.4 | 0 | 0 | 0 | 0 | 112.3 | K222 F223 M229 A230 | K222-S226 VanDerWaalsContact O-CB 3.31Å; K222-S226 WeakPolarHBondContact O-CB 3.36Å; K222-S226 PolarHBondContact O-N 3.18Å; F223-S226 PolarHBondContact O-N 3.42Å; S226-M229 PolarHBondContact O-N 2.77Å; S226-A230 WeakPolarHBondContact O-CB 3.16Å; S226-A230 PolarHBondContact O-N 3.29Å |
| 227 | R | 98.3 | Very high | 98.2 | Very high | 115 Ų | 115 | 99.2 Ų | 99.2 | 43% | 0.434 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.2 | -45.2 | 176.3 | -172.4 | -177.1 | 68.6 | -174.2 | 0.2 | 111.8 | F223 L224 A225 M229 A230 E231 | F223-R227 WeakPolarHBondContact O-CB 3.44Å; F223-R227 PolarHBondContact O-N 3.45Å; L224-R227 PolarHBondContact O-N 2.91Å; A225-R227 VanDerWaalsContact C-N 3.31Å; A225-R227 PolarHBondContact O-N 3.24Å; R227-M229 PolarHBondContact O-N 3.42Å; R227-A230 PolarHBondContact O-N 2.86Å; R227-E231 HydrophobicContact CG-CG 4.48Å; R227-E231 WeakPolarHBondContact CG-OE1 3.45Å; R227-E231 IonicContact NE-OE1 3.48Å; R227-E231 WeakPolarHBondContact O-CG 3.31Å; R227-E231 PolarHBondContact O-N 3.49Å |
| 228 | V | 98.3 | Very high | 98.1 | Very high | 64 Ų | 64 | 96.5 Ų | 96.5 | 39% | 0.388 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.4 | -46.1 | 176.9 | 171.8 | 0 | 0 | 0 | 0 | 110.7 | L224 A225 A230 E231 E232 | L224-V228 WeakPolarHBondContact O-CG2 3.24Å; L224-V228 PolarHBondContact O-N 3.15Å; A225-V228 PolarHBondContact O-N 2.91Å; V228-A230 VanDerWaalsContact C-N 3.31Å; V228-A230 PolarHBondContact O-N 3.37Å; V228-E231 PolarHBondContact O-N 3Å; V228-E232 HydrophobicContact CG1-CG 4.44Å; V228-E232 WeakPolarHBondContact O-CG 3.31Å; V228-E232 PolarHBondContact O-N 3.32Å |
| 229 | M | 97.8 | Very high | 98 | Very high | 120 Ų | 120 | 95.9 Ų | 95.9 | 59% | 0.591 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.3 | -40.4 | 176.1 | -69.9 | -173 | -67.9 | 0 | 0 | 112.3 | A225 S226 R227 L233 | A225-M229 WeakPolarHBondContact O-CG 3.48Å; A225-M229 PolarHBondContact O-N 3.21Å; S226-M229 PolarHBondContact O-N 2.77Å; R227-M229 PolarHBondContact O-N 3.42Å; M229-L233 WeakPolarHBondContact O-CB 3.35Å; M229-L233 PolarHBondContact O-N 2.93Å |
| 230 | A | 98.2 | Very high | 97.8 | Very high | 50 Ų | 50 | 92.9 Ų | 92.9 | 41% | 0.413 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.4 | -43.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | S226 R227 V228 L233 T234 | S226-A230 WeakPolarHBondContact O-CB 3.16Å; S226-A230 PolarHBondContact O-N 3.29Å; R227-A230 PolarHBondContact O-N 2.86Å; V228-A230 VanDerWaalsContact C-N 3.31Å; V228-A230 PolarHBondContact O-N 3.37Å; A230-L233 PolarHBondContact O-N 3.22Å; A230-T234 VanDerWaalsContact O-CG2 3.31Å; A230-T234 WeakPolarHBondContact O-CG2 3.38Å; A230-T234 PolarHBondContact O-N 2.88Å; A230-T234 PolarHBondContact O-OG1 2.84Å |
| 231 | E | 98 | Very high | 97.7 | Very high | 91 Ų | 91 | 88.2 Ų | 88.2 | 43% | 0.425 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.4 | -47.3 | 175.6 | -74.3 | 170.8 | -167.1 | 0 | 0 | 111.1 | R227 V228 L233 T234 N235 | R227-E231 HydrophobicContact CG-CG 4.48Å; R227-E231 WeakPolarHBondContact CG-OE1 3.45Å; R227-E231 IonicContact NE-OE1 3.48Å; R227-E231 WeakPolarHBondContact O-CG 3.31Å; R227-E231 PolarHBondContact O-N 3.49Å; V228-E231 PolarHBondContact O-N 3Å; E231-L233 VanDerWaalsContact C-N 3.35Å; E231-L233 PolarHBondContact O-N 3.28Å; E231-T234 WeakPolarHBondContact CA-OG1 3.44Å; E231-T234 PolarHBondContact O-N 2.99Å; E231-T234 PolarHBondContact O-OG1 3.21Å; E231-N235 WeakPolarHBondContact O-CB 3.42Å; E231-N235 VanDerWaalsContact O-CG 3.24Å; E231-N235 PolarHBondContact O-N 3.41Å; E231-N235 PolarHBondContact O-ND2 3.32Å; E231-N235 VanDerWaalsContact O-ND2 3.15Å |
| 232 | E | 97.9 | Very high | 97.6 | Very high | 123 Ų | 123 | 90.6 Ų | 90.6 | 58% | 0.575 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -58.1 | -44.8 | 175.3 | -73.4 | 177.7 | 175.6 | 0 | 0 | 112.1 | V228 N235 A236 | V228-E232 HydrophobicContact CG1-CG 4.44Å; V228-E232 WeakPolarHBondContact O-CG 3.31Å; V228-E232 PolarHBondContact O-N 3.32Å; E232-N235 PolarHBondContact O-N 2.88Å; E232-A236 WeakPolarHBondContact O-CB 3.4Å; E232-A236 PolarHBondContact O-N 3.16Å |
| 233 | L | 98.2 | Very high | 97.4 | Very high | 128 Ų | 128 | 86.8 Ų | 86.8 | 67% | 0.67 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -63.3 | -43.3 | 177.1 | -175.9 | 65.9 | 0 | 0 | 0 | 112.1 | M229 A230 E231 N235 A236 R237 | M229-L233 WeakPolarHBondContact O-CB 3.35Å; M229-L233 PolarHBondContact O-N 2.93Å; A230-L233 PolarHBondContact O-N 3.22Å; E231-L233 VanDerWaalsContact C-N 3.35Å; E231-L233 PolarHBondContact O-N 3.28Å; L233-N235 VanDerWaalsContact C-N 3.35Å; L233-A236 PolarHBondContact O-N 3.24Å; L233-R237 WeakPolarHBondContact O-CB 3.25Å; L233-R237 PolarHBondContact O-N 3.17Å |
| 234 | T | 98.2 | Very high | 97.3 | Very high | 84 Ų | 84 | 84.9 Ų | 84.9 | 52% | 0.515 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -65 | -39.4 | 177.5 | 58.8 | 0 | 0 | 0 | 0 | 112.1 | A230 E231 R237 A238 | A230-T234 VanDerWaalsContact O-CG2 3.31Å; A230-T234 WeakPolarHBondContact O-CG2 3.38Å; A230-T234 PolarHBondContact O-N 2.88Å; A230-T234 PolarHBondContact O-OG1 2.84Å; E231-T234 WeakPolarHBondContact CA-OG1 3.44Å; E231-T234 PolarHBondContact O-N 2.99Å; E231-T234 PolarHBondContact O-OG1 3.21Å; T234-R237 PolarHBondContact O-N 2.92Å; T234-A238 WeakPolarHBondContact O-CB 3.43Å; T234-A238 PolarHBondContact O-N 3.4Å |
| 235 | N | 97.9 | Very high | 97.2 | Very high | 107 Ų | 107 | 88.4 Ų | 88.4 | 57% | 0.572 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -66.4 | -44.4 | 176.2 | -72.3 | -31.7 | 0 | 0 | 0 | 111.8 | E231 E232 L233 A238 S239 | E231-N235 WeakPolarHBondContact O-CB 3.42Å; E231-N235 VanDerWaalsContact O-CG 3.24Å; E231-N235 PolarHBondContact O-N 3.41Å; E231-N235 PolarHBondContact O-ND2 3.32Å; E231-N235 VanDerWaalsContact O-ND2 3.15Å; E232-N235 PolarHBondContact O-N 2.88Å; L233-N235 VanDerWaalsContact C-N 3.35Å; N235-A238 PolarHBondContact O-N 2.9Å; N235-S239 WeakPolarHBondContact O-CB 3.45Å; N235-S239 PolarHBondContact O-N 2.92Å |
| 236 | A | 96.6 | Very high | 97.1 | Very high | 48 Ų | 48 | 90.1 Ų | 90.1 | 40% | 0.397 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.5 | -46.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | E232 L233 A238 S239 L240 | E232-A236 WeakPolarHBondContact O-CB 3.4Å; E232-A236 PolarHBondContact O-N 3.16Å; L233-A236 PolarHBondContact O-N 3.24Å; A236-A238 PolarHBondContact O-N 3.45Å; A236-S239 PolarHBondContact O-N 3.37Å; A236-L240 WeakPolarHBondContact O-CG 3.36Å; A236-L240 PolarHBondContact O-N 3.1Å |
| 237 | R | 97.7 | Very high | 96.9 | Very high | 163 Ų | 163 | 88 Ų | 88 | 62% | 0.615 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -58.4 | -47.6 | 174.9 | -179.8 | 179.3 | 177.4 | 168.4 | 2.2 | 111.7 | L233 T234 S239 L240 Q241 | L233-R237 WeakPolarHBondContact O-CB 3.25Å; L233-R237 PolarHBondContact O-N 3.17Å; T234-R237 PolarHBondContact O-N 2.92Å; R237-S239 VanDerWaalsContact C-N 3.28Å; R237-S239 PolarHBondContact O-N 3.46Å; R237-L240 PolarHBondContact O-N 3.3Å; R237-Q241 HydrophobicContact CG-CG 4.41Å; R237-Q241 WeakPolarHBondContact O-CB 3.37Å; R237-Q241 VanDerWaalsContact O-CG 3.25Å; R237-Q241 WeakPolarHBondContact O-CG 3.41Å; R237-Q241 PolarHBondContact O-N 3.4Å |
| 238 | A | 97.4 | Very high | 96.9 | Very high | 42 Ų | 42 | 88.3 Ų | 88.3 | 35% | 0.347 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62.1 | -37.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | T234 N235 A236 R242 | T234-A238 WeakPolarHBondContact O-CB 3.43Å; T234-A238 PolarHBondContact O-N 3.4Å; N235-A238 PolarHBondContact O-N 2.9Å; A236-A238 PolarHBondContact O-N 3.45Å; A238-R242 PolarHBondContact O-N 3.13Å; A238-R242 VanDerWaalsContact O-N 3.08Å |
| 239 | S | 95.6 | Very high | 96.8 | Very high | 36 Ų | 36 | 86.6 Ų | 86.6 | 25% | 0.252 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -66.3 | -49.4 | 175.7 | -164.9 | 0 | 0 | 0 | 0 | 112.5 | N235 A236 R237 Q241 R242 Q243 | N235-S239 WeakPolarHBondContact O-CB 3.45Å; N235-S239 PolarHBondContact O-N 2.92Å; A236-S239 PolarHBondContact O-N 3.37Å; R237-S239 VanDerWaalsContact C-N 3.28Å; R237-S239 PolarHBondContact O-N 3.46Å; S239-Q241 VanDerWaalsContact C-N 3.3Å; S239-Q241 PolarHBondContact O-N 2.98Å; S239-R242 WeakPolarHBondContact O-CB 3.37Å; S239-R242 PolarHBondContact O-N 2.91Å; S239-R242 VanDerWaalsContact O-N 3.13Å; S239-R242 PolarHBondContact OG-NH2 3.44Å; S239-Q243 WeakPolarHBondContact O-CG 3.27Å; S239-Q243 PolarHBondContact O-N 3.1Å |
| 240 | L | 94.9 | Very high | 96.7 | Very high | 99 Ų | 99 | 81 Ų | 81 | 52% | 0.518 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -60.6 | -40.9 | 176.3 | -71.8 | 171.7 | 0 | 0 | 0 | 111.5 | A236 R237 R242 Q243 I244 | A236-L240 WeakPolarHBondContact O-CG 3.36Å; A236-L240 PolarHBondContact O-N 3.1Å; R237-L240 PolarHBondContact O-N 3.3Å; L240-R242 VanDerWaalsContact C-N 3.32Å; L240-R242 PolarHBondContact O-N 2.87Å; L240-Q243 PolarHBondContact O-N 3.34Å; L240-I244 VanDerWaalsContact O-CG1 3.29Å; L240-I244 WeakPolarHBondContact O-CG1 3.42Å; L240-I244 PolarHBondContact O-N 3.28Å |
| 241 | Q | 96.9 | Very high | 96.6 | Very high | 78 Ų | 78 | 83.4 Ų | 83.4 | 36% | 0.364 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -63.3 | -35.5 | 175.9 | -76.1 | 178.9 | -21.7 | 0 | 0 | 112.9 | R237 S239 R245 | R237-Q241 HydrophobicContact CG-CG 4.41Å; R237-Q241 WeakPolarHBondContact O-CB 3.37Å; R237-Q241 VanDerWaalsContact O-CG 3.25Å; R237-Q241 WeakPolarHBondContact O-CG 3.41Å; R237-Q241 PolarHBondContact O-N 3.4Å; S239-Q241 VanDerWaalsContact C-N 3.3Å; S239-Q241 PolarHBondContact O-N 2.98Å; Q241-R245 WeakPolarHBondContact O-CG 3.41Å; Q241-R245 PolarHBondContact O-N 3.08Å |
| 242 | R | 95.9 | Very high | 96.6 | Very high | 118 Ų | 118 | 84.3 Ų | 84.3 | 45% | 0.445 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -65.5 | -47.8 | 172 | -79.5 | -174.2 | -73.6 | 96.7 | -2 | 111.1 | A238 S239 L240 I244 R245 E246 | A238-R242 PolarHBondContact O-N 3.13Å; A238-R242 VanDerWaalsContact O-N 3.08Å; S239-R242 WeakPolarHBondContact O-CB 3.37Å; S239-R242 PolarHBondContact O-N 2.91Å; S239-R242 VanDerWaalsContact O-N 3.13Å; S239-R242 PolarHBondContact OG-NH2 3.44Å; L240-R242 VanDerWaalsContact C-N 3.32Å; L240-R242 PolarHBondContact O-N 2.87Å; R242-I244 VanDerWaalsContact C-N 3.32Å; R242-I244 PolarHBondContact O-N 3.16Å; R242-R245 WeakPolarHBondContact O-CB 3.29Å; R242-R245 PolarHBondContact O-N 3.27Å; R242-R245 VanDerWaalsContact O-N 3.11Å; R242-E246 WeakPolarHBondContact O-CG 3.47Å; R242-E246 PolarHBondContact O-N 3.36Å |
| 243 | Q | 94.8 | Very high | 96.6 | Very high | 38 Ų | 38 | 81.4 Ų | 81.4 | 18% | 0.178 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -60.2 | -40.1 | 178 | -69.8 | 174.9 | -5.7 | 0 | 0 | 112.5 | S239 L240 E246 A247 V350 L351 | S239-Q243 WeakPolarHBondContact O-CG 3.27Å; S239-Q243 PolarHBondContact O-N 3.1Å; L240-Q243 PolarHBondContact O-N 3.34Å; Q243-E246 PolarHBondContact O-N 2.89Å; Q243-A247 WeakPolarHBondContact O-CB 3.48Å; Q243-A247 PolarHBondContact O-N 3.34Å; Q243-V350 HydrophobicContact CG-CG1 4.21Å; Q243-L351 HydrophobicContact CB-CD2 3.87Å; Q243-L351 HydrophobicContact CG-CD2 4.41Å |
| 244 | I | 95.4 | Very high | 96.5 | Very high | 92 Ų | 92 | 78.2 Ų | 78.2 | 47% | 0.472 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -61.6 | -44.1 | 174.7 | -71 | 166.2 | 0 | 0 | 0 | 110.7 | L240 R242 A247 Q248 | L240-I244 VanDerWaalsContact O-CG1 3.29Å; L240-I244 WeakPolarHBondContact O-CG1 3.42Å; L240-I244 PolarHBondContact O-N 3.28Å; R242-I244 VanDerWaalsContact C-N 3.32Å; R242-I244 PolarHBondContact O-N 3.16Å; I244-A247 PolarHBondContact O-N 3.49Å; I244-Q248 HydrophobicContact CG2-CG 4.38Å; I244-Q248 WeakPolarHBondContact O-CB 3.43Å; I244-Q248 VanDerWaalsContact O-CG 3.27Å; I244-Q248 WeakPolarHBondContact O-CG 3.49Å; I244-Q248 PolarHBondContact O-N 3.32Å |
| 245 | R | 96.9 | Very high | 96.4 | Very high | 139 Ų | 139 | 78.7 Ų | 78.7 | 53% | 0.525 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -63.6 | -42.2 | 177.1 | -76.2 | -172 | -67.8 | -90.3 | 3.3 | 112.1 | Q241 R242 Q248 G249 | Q241-R245 WeakPolarHBondContact O-CG 3.41Å; Q241-R245 PolarHBondContact O-N 3.08Å; R242-R245 WeakPolarHBondContact O-CB 3.29Å; R242-R245 PolarHBondContact O-N 3.27Å; R242-R245 VanDerWaalsContact O-N 3.11Å; R245-Q248 PolarHBondContact O-N 3.38Å; R245-G249 PolarHBondContact O-N 2.85Å |
| 246 | E | 95.8 | Very high | 96.3 | Very high | 89 Ų | 89 | 76.4 Ų | 76.4 | 42% | 0.416 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -62.7 | -42.5 | 176.3 | -70.8 | 165.8 | -162.4 | 0 | 0 | 111.4 | R242 Q243 G249 A250 V347 | R242-E246 WeakPolarHBondContact O-CG 3.47Å; R242-E246 PolarHBondContact O-N 3.36Å; Q243-E246 PolarHBondContact O-N 2.89Å; E246-G249 PolarHBondContact O-N 3.4Å; E246-A250 PolarHBondContact O-N 2.89Å; E246-V347 HydrophobicContact CB-CG2 4.15Å |
| 247 | A | 95.3 | Very high | 96.3 | Very high | 24 Ų | 24 | 76.3 Ų | 76.3 | 20% | 0.198 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65.2 | -42.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113 | Q243 I244 G249 A250 I251 V347 L351 | Q243-A247 WeakPolarHBondContact O-CB 3.48Å; Q243-A247 PolarHBondContact O-N 3.34Å; I244-A247 PolarHBondContact O-N 3.49Å; A247-G249 VanDerWaalsContact C-N 3.32Å; A247-G249 PolarHBondContact O-N 3.24Å; A247-A250 PolarHBondContact O-N 3.21Å; A247-I251 VanDerWaalsContact O-CG1 3.31Å; A247-I251 WeakPolarHBondContact O-CG1 3.42Å; A247-I251 PolarHBondContact O-N 3.49Å; A247-V347 HydrophobicContact CB-CG1 3.76Å; A247-L351 HydrophobicContact CB-CD1 4.45Å |
| 248 | Q | 96.9 | Very high | 96.1 | Very high | 121 Ų | 121 | 75.4 Ų | 75.4 | 57% | 0.565 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -61.5 | -41.8 | 174.7 | -74.9 | 173.9 | -21.4 | 0 | 0 | 111.5 | I244 R245 I251 Q252 | I244-Q248 HydrophobicContact CG2-CG 4.38Å; I244-Q248 WeakPolarHBondContact O-CB 3.43Å; I244-Q248 VanDerWaalsContact O-CG 3.27Å; I244-Q248 WeakPolarHBondContact O-CG 3.49Å; I244-Q248 PolarHBondContact O-N 3.32Å; R245-Q248 PolarHBondContact O-N 3.38Å; Q248-I251 PolarHBondContact O-N 3.36Å; Q248-Q252 WeakPolarHBondContact O-CB 3.47Å; Q248-Q252 PolarHBondContact O-N 3.11Å |
| 249 | G | 96.3 | Very high | 96 | Very high | 29 Ų | 29 | 78.7 Ų | 78.7 | 30% | 0.299 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -59.4 | -50.1 | 174 | 0 | 0 | 0 | 0 | 0 | 112.2 | R245 E246 A247 I251 Q252 D253 | R245-G249 PolarHBondContact O-N 2.85Å; E246-G249 PolarHBondContact O-N 3.4Å; A247-G249 VanDerWaalsContact C-N 3.32Å; A247-G249 PolarHBondContact O-N 3.24Å; G249-I251 VanDerWaalsContact C-N 3.32Å; G249-I251 PolarHBondContact O-N 3.41Å; G249-Q252 WeakPolarHBondContact O-CB 3.31Å; G249-Q252 PolarHBondContact O-N 2.9Å; G249-Q252 VanDerWaalsContact O-N 3.08Å; G249-D253 PolarHBondContact O-N 3.11Å |
| 250 | A | 96.4 | Very high | 95.9 | Very high | 3 Ų | 3 | 81.8 Ų | 81.8 | 3% | 0.025 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -61 | -38.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | E246 A247 L254 M343 A344 V347 | E246-A250 PolarHBondContact O-N 2.89Å; A247-A250 PolarHBondContact O-N 3.21Å; A250-L254 WeakPolarHBondContact O-CG 3.41Å; A250-L254 PolarHBondContact O-N 2.92Å; A250-M343 HydrophobicContact CB-CG 4.22Å; A250-M343 HydrophobicContact CB-SD 4.32Å; A250-A344 HydrophobicContact CB-CB 4.22Å; A250-V347 HydrophobicContact CB-CG2 4.17Å |
| 251 | I | 96.4 | Very high | 95.8 | Very high | 100 Ų | 100 | 82.4 Ų | 82.4 | 51% | 0.513 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.8 | -43.4 | 174 | -68.4 | 166.3 | 0 | 0 | 0 | 110.6 | A247 Q248 G249 D253 L254 L255 | A247-I251 VanDerWaalsContact O-CG1 3.31Å; A247-I251 WeakPolarHBondContact O-CG1 3.42Å; A247-I251 PolarHBondContact O-N 3.49Å; Q248-I251 PolarHBondContact O-N 3.36Å; G249-I251 VanDerWaalsContact C-N 3.32Å; G249-I251 PolarHBondContact O-N 3.41Å; I251-D253 VanDerWaalsContact C-N 3.34Å; I251-D253 PolarHBondContact O-N 2.86Å; I251-L254 PolarHBondContact O-N 3.35Å; I251-L255 HydrophobicContact CG2-CD1 4.07Å; I251-L255 HydrophobicContact CG2-CG 4.39Å; I251-L255 WeakPolarHBondContact O-CG 3.43Å; I251-L255 PolarHBondContact O-N 2.93Å |
| 252 | Q | 97.8 | Very high | 95.6 | Very high | 109 Ų | 109 | 80.4 Ų | 80.4 | 51% | 0.509 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.1 | -44.8 | 178.8 | -175.5 | 59.3 | 58.5 | 0 | 0 | 111.1 | Q248 G249 L254 L255 V256 | Q248-Q252 WeakPolarHBondContact O-CB 3.47Å; Q248-Q252 PolarHBondContact O-N 3.11Å; G249-Q252 WeakPolarHBondContact O-CB 3.31Å; G249-Q252 PolarHBondContact O-N 2.9Å; G249-Q252 VanDerWaalsContact O-N 3.08Å; Q252-L254 PolarHBondContact O-N 2.99Å; Q252-L255 PolarHBondContact O-N 3.45Å; Q252-V256 WeakPolarHBondContact O-CG2 3.46Å; Q252-V256 PolarHBondContact O-N 3.41Å |
| 253 | D | 96.6 | Very high | 95.5 | Very high | 63 Ų | 63 | 81.2 Ų | 81.2 | 34% | 0.337 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -62.6 | -42.5 | 178.1 | -66.7 | -15.3 | 0 | 0 | 0 | 111.4 | G249 I251 L255 V256 E257 A340 M343 | G249-D253 PolarHBondContact O-N 3.11Å; I251-D253 VanDerWaalsContact C-N 3.34Å; I251-D253 PolarHBondContact O-N 2.86Å; D253-L255 VanDerWaalsContact C-N 3.33Å; D253-L255 PolarHBondContact O-N 3.3Å; D253-V256 PolarHBondContact O-N 3.26Å; D253-E257 PolarHBondContact O-N 2.88Å; D253-A340 HydrophobicContact CB-CB 3.63Å; D253-M343 WeakPolarHBondContact OD2-CE 3.35Å; D253-M343 VanDerWaalsContact OD2-SD 3.4Å |
| 254 | L | 96.5 | Very high | 95.4 | Very high | 60 Ų | 60 | 84 Ų | 84 | 31% | 0.314 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -61.3 | -39.9 | 175.3 | -77.6 | 172.4 | 0 | 0 | 0 | 112.5 | A250 I251 Q252 R258 A340 E341 A344 | A250-L254 WeakPolarHBondContact O-CG 3.41Å; A250-L254 PolarHBondContact O-N 2.92Å; I251-L254 PolarHBondContact O-N 3.35Å; Q252-L254 PolarHBondContact O-N 2.99Å; L254-R258 WeakPolarHBondContact O-CB 3.33Å; L254-R258 PolarHBondContact O-N 3.48Å; L254-A340 HydrophobicContact CD2-CB 3.86Å; L254-A340 HydrophobicContact CG-CB 4.02Å; L254-E341 HydrophobicContact CD2-CB 4.49Å; L254-E341 HydrophobicContact CD2-CG 3.78Å; L254-A344 HydrophobicContact CD1-CB 3.75Å; L254-A344 HydrophobicContact CG-CB 4.43Å |
| 255 | L | 96.5 | Very high | 95.3 | Very high | 94 Ų | 94 | 80.9 Ų | 80.9 | 49% | 0.492 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -68.5 | -36.9 | 178.2 | -70.4 | 176 | 0 | 0 | 0 | 111.8 | I251 Q252 D253 E259 | I251-L255 HydrophobicContact CG2-CD1 4.07Å; I251-L255 HydrophobicContact CG2-CG 4.39Å; I251-L255 WeakPolarHBondContact O-CG 3.43Å; I251-L255 PolarHBondContact O-N 2.93Å; Q252-L255 PolarHBondContact O-N 3.45Å; D253-L255 VanDerWaalsContact C-N 3.33Å; D253-L255 PolarHBondContact O-N 3.3Å; L255-E259 PolarHBondContact O-N 3.49Å |
| 256 | V | 96.6 | Very high | 95.1 | Very high | 60 Ų | 60 | 76.6 Ų | 76.6 | 36% | 0.364 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -65.5 | -51.7 | 175.7 | 171.9 | 0 | 0 | 0 | 0 | 110.5 | Q252 D253 R258 E259 E260 | Q252-V256 WeakPolarHBondContact O-CG2 3.46Å; Q252-V256 PolarHBondContact O-N 3.41Å; D253-V256 PolarHBondContact O-N 3.26Å; V256-R258 VanDerWaalsContact C-N 3.27Å; V256-R258 PolarHBondContact O-N 3.02Å; V256-E259 WeakPolarHBondContact O-CB 3.49Å; V256-E259 PolarHBondContact O-N 3.25Å; V256-E260 PolarHBondContact O-N 2.99Å |
| 257 | E | 95.3 | Very high | 95 | Very high | 46 Ų | 46 | 76.6 Ų | 76.6 | 22% | 0.215 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -60.6 | -37.5 | 177.6 | -73.6 | -175.7 | 174.5 | 0 | 0 | 111.9 | D253 E259 E260 F261 T338 P339 A340 | D253-E257 PolarHBondContact O-N 2.88Å; E257-E259 VanDerWaalsContact C-N 3.32Å; E257-E259 PolarHBondContact O-N 3.08Å; E257-E260 PolarHBondContact O-N 3.06Å; E257-F261 WeakPolarHBondContact O-CB 3.33Å; E257-F261 PolarHBondContact O-N 2.99Å; E257-T338 WeakPolarHBondContact OE2-CB 3.45Å; E257-T338 PolarHBondContact OE2-OG1 3.42Å; E257-P339 WeakPolarHBondContact OE1-CD 3.33Å; E257-A340 HydrophobicContact CG-CB 4.11Å; E257-A340 WeakPolarHBondContact OE1-CB 3.15Å; E257-A340 PolarHBondContact OE1-N 2.97Å; E257-A340 WeakPolarHBondContact OE2-CB 3.42Å |
| 258 | R | 94.4 | Very high | 94.9 | Very high | 143 Ų | 143 | 78.1 Ų | 78.1 | 54% | 0.54 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -61.9 | -39.4 | 174.2 | -179.3 | -174.3 | 178.2 | -78.9 | -1 | 112 | L254 V256 S262 I296 | L254-R258 WeakPolarHBondContact O-CB 3.33Å; L254-R258 PolarHBondContact O-N 3.48Å; V256-R258 VanDerWaalsContact C-N 3.27Å; V256-R258 PolarHBondContact O-N 3.02Å; R258-S262 WeakPolarHBondContact O-CB 3.35Å; R258-S262 PolarHBondContact O-N 2.93Å; R258-I296 HydrophobicContact CG-CD1 3.52Å; R258-I296 VanDerWaalsContact CZ-CD1 3.42Å |
| 259 | E | 94.4 | Very high | 94.7 | Very high | 112 Ų | 112 | 73.1 Ų | 73.1 | 52% | 0.523 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -67.4 | -43.1 | 177.7 | -164 | -168.4 | 145.6 | 0 | 0 | 111.2 | L255 V256 E257 S262 R263 | L255-E259 PolarHBondContact O-N 3.49Å; V256-E259 WeakPolarHBondContact O-CB 3.49Å; V256-E259 PolarHBondContact O-N 3.25Å; E257-E259 VanDerWaalsContact C-N 3.32Å; E257-E259 PolarHBondContact O-N 3.08Å; E259-S262 PolarHBondContact O-N 2.95Å; E259-R263 WeakPolarHBondContact O-CB 3.41Å; E259-R263 PolarHBondContact O-N 3.36Å; E259-R263 IonicContact OE1-NH2 3.39Å; E259-R263 PolarHBondContact OE1-NH2 3.33Å |
| 260 | E | 94.1 | Very high | 94.5 | Very high | 101 Ų | 101 | 78.5 Ų | 78.5 | 47% | 0.472 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -58.3 | -51.2 | 174.3 | -68.5 | 177.8 | 170.8 | 0 | 0 | 110.9 | V256 E257 S262 R263 D264 | V256-E260 PolarHBondContact O-N 2.99Å; E257-E260 PolarHBondContact O-N 3.06Å; E260-S262 VanDerWaalsContact C-N 3.32Å; E260-S262 PolarHBondContact O-N 3.34Å; E260-R263 WeakPolarHBondContact O-CB 3.21Å; E260-R263 PolarHBondContact O-N 2.97Å; E260-D264 PolarHBondContact O-N 3.41Å |
| 261 | F | 92 | Very high | 94.3 | Very high | 112 Ų | 112 | 81.7 Ų | 81.7 | 49% | 0.491 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -58.4 | -43 | 176.5 | -178.1 | -99.8 | 0 | 0 | 0 | 112.4 | E257 R263 D264 M265 I296 | E257-F261 WeakPolarHBondContact O-CB 3.33Å; E257-F261 PolarHBondContact O-N 2.99Å; F261-R263 VanDerWaalsContact C-N 3.27Å; F261-R263 PolarHBondContact O-N 3.03Å; F261-D264 PolarHBondContact O-N 3.38Å; F261-M265 HydrophobicContact CD1-CG 4.05Å; F261-M265 HydrophobicContact CE1-CG 3.6Å; F261-M265 HydrophobicContact CE1-SD 4.47Å; F261-M265 HydrophobicContact CE2-CG 4.14Å; F261-M265 HydrophobicContact CE2-SD 4.49Å; F261-M265 HydrophobicContact CZ-CG 3.65Å; F261-M265 HydrophobicContact CZ-SD 4.01Å; F261-M265 WeakPolarHBondContact O-CB 3.44Å; F261-M265 VanDerWaalsContact O-CG 3.32Å; F261-M265 WeakPolarHBondContact O-CG 3.33Å; F261-M265 PolarHBondContact O-N 3.06Å; F261-I296 HydrophobicContact CD1-CG2 3.79Å; F261-I296 HydrophobicContact CE1-CG2 3.57Å |
| 262 | S | 93.1 | Very high | 94.1 | Very high | 35 Ų | 35 | 79.1 Ų | 79.1 | 25% | 0.245 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -60.7 | -39.5 | 176.6 | -171.4 | 0 | 0 | 0 | 0 | 111.6 | R258 E259 E260 V266 | R258-S262 WeakPolarHBondContact O-CB 3.35Å; R258-S262 PolarHBondContact O-N 2.93Å; E259-S262 PolarHBondContact O-N 2.95Å; E260-S262 VanDerWaalsContact C-N 3.32Å; E260-S262 PolarHBondContact O-N 3.34Å; S262-V266 WeakPolarHBondContact O-CG2 3.5Å; S262-V266 PolarHBondContact O-N 2.97Å; S262-V266 VanDerWaalsContact O-N 3.13Å |
| 263 | R | 93.8 | Very high | 93.8 | Very high | 136 Ų | 136 | 75.1 Ų | 75.1 | 51% | 0.513 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -65.9 | -46.6 | 179.6 | -158.8 | -179.1 | -62 | 147.2 | 0.9 | 110.7 | E259 E260 F261 M265 V266 L267 | E259-R263 WeakPolarHBondContact O-CB 3.41Å; E259-R263 PolarHBondContact O-N 3.36Å; E259-R263 IonicContact OE1-NH2 3.39Å; E259-R263 PolarHBondContact OE1-NH2 3.33Å; E260-R263 WeakPolarHBondContact O-CB 3.21Å; E260-R263 PolarHBondContact O-N 2.97Å; F261-R263 VanDerWaalsContact C-N 3.27Å; F261-R263 PolarHBondContact O-N 3.03Å; R263-M265 VanDerWaalsContact C-N 3.34Å; R263-M265 PolarHBondContact O-N 3.38Å; R263-V266 PolarHBondContact O-N 3.02Å; R263-L267 WeakPolarHBondContact O-CG 3.19Å; R263-L267 PolarHBondContact O-N 3.02Å |
| 264 | D | 93.6 | Very high | 93.4 | Very high | 95 Ų | 95 | 78.3 Ų | 78.3 | 51% | 0.508 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -63.9 | -38.6 | 178 | -71.2 | -13.1 | 0 | 0 | 0 | 112.3 | E260 F261 V266 L267 S268 | E260-D264 PolarHBondContact O-N 3.41Å; F261-D264 PolarHBondContact O-N 3.38Å; D264-V266 VanDerWaalsContact C-N 3.34Å; D264-V266 PolarHBondContact O-N 3.35Å; D264-L267 PolarHBondContact O-N 3.3Å; D264-S268 WeakPolarHBondContact O-CB 3.49Å; D264-S268 PolarHBondContact O-N 3.04Å; D264-S268 PolarHBondContact O-OG 3.35Å |
| 265 | M | 92.8 | Very high | 93.1 | Very high | 28 Ų | 28 | 79.4 Ų | 79.4 | 14% | 0.138 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -64.8 | -36.5 | 175.4 | -77.4 | -63 | -71.7 | 0 | 0 | 112.7 | F261 R263 H269 L299 A300 N303 | F261-M265 HydrophobicContact CD1-CG 4.05Å; F261-M265 HydrophobicContact CE1-CG 3.6Å; F261-M265 HydrophobicContact CE1-SD 4.47Å; F261-M265 HydrophobicContact CE2-CG 4.14Å; F261-M265 HydrophobicContact CE2-SD 4.49Å; F261-M265 HydrophobicContact CZ-CG 3.65Å; F261-M265 HydrophobicContact CZ-SD 4.01Å; F261-M265 WeakPolarHBondContact O-CB 3.44Å; F261-M265 VanDerWaalsContact O-CG 3.32Å; F261-M265 WeakPolarHBondContact O-CG 3.33Å; F261-M265 PolarHBondContact O-N 3.06Å; R263-M265 VanDerWaalsContact C-N 3.34Å; R263-M265 PolarHBondContact O-N 3.38Å; M265-H269 WeakPolarHBondContact O-CB 3.38Å; M265-H269 PolarHBondContact O-N 3.05Å; M265-L299 HydrophobicContact CB-CD2 3.55Å; M265-L299 HydrophobicContact CB-CG 4.11Å; M265-A300 HydrophobicContact CE-CB 3.7Å; M265-N303 HydrophobicContact CE-CB 4.38Å; M265-N303 VanDerWaalsContact CE-ND2 3.26Å; M265-N303 WeakPolarHBondContact CE-ND2 3.27Å; M265-N303 PolarHBondContact O-ND2 3.45Å; M265-N303 VanDerWaalsContact O-ND2 3.14Å |
| 266 | V | 92.9 | Very high | 92.7 | Very high | 48 Ų | 48 | 75.3 Ų | 75.3 | 29% | 0.291 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -69.1 | -41.3 | 175.8 | 169.8 | 0 | 0 | 0 | 0 | 110.6 | S262 R263 D264 S268 H269 R270 L299 | S262-V266 WeakPolarHBondContact O-CG2 3.5Å; S262-V266 PolarHBondContact O-N 2.97Å; S262-V266 VanDerWaalsContact O-N 3.13Å; R263-V266 PolarHBondContact O-N 3.02Å; D264-V266 VanDerWaalsContact C-N 3.34Å; D264-V266 PolarHBondContact O-N 3.35Å; V266-S268 VanDerWaalsContact C-N 3.35Å; V266-H269 WeakPolarHBondContact O-CB 3.36Å; V266-H269 PolarHBondContact O-N 2.89Å; V266-R270 WeakPolarHBondContact O-CG 3.42Å; V266-R270 PolarHBondContact O-N 3.35Å; V266-L299 HydrophobicContact CB-CD2 4.31Å; V266-L299 HydrophobicContact CG2-CD2 3.48Å; V266-L299 VanDerWaalsContact CG2-CD2 3.48Å |
| 267 | L | 93.4 | Very high | 92.3 | Very high | 90 Ų | 90 | 75 Ų | 75 | 47% | 0.471 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.6 | -42 | 175.8 | -68 | 176.3 | 0 | 0 | 0 | 111.7 | R263 D264 H269 R270 S271 | R263-L267 WeakPolarHBondContact O-CG 3.19Å; R263-L267 PolarHBondContact O-N 3.02Å; D264-L267 PolarHBondContact O-N 3.3Å; L267-H269 VanDerWaalsContact C-N 3.35Å; L267-R270 PolarHBondContact O-N 3.49Å; L267-S271 WeakPolarHBondContact O-CB 3.31Å; L267-S271 PolarHBondContact O-N 2.91Å; L267-S271 PolarHBondContact O-OG 3.44Å |
| 268 | S | 93.4 | Very high | 91.8 | Very high | 55 Ų | 55 | 76.8 Ų | 76.8 | 39% | 0.385 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -61.4 | -44.5 | 174.5 | -59.7 | 0 | 0 | 0 | 0 | 111.2 | D264 V266 S271 L272 | D264-S268 WeakPolarHBondContact O-CB 3.49Å; D264-S268 PolarHBondContact O-N 3.04Å; D264-S268 PolarHBondContact O-OG 3.35Å; V266-S268 VanDerWaalsContact C-N 3.35Å; S268-S271 PolarHBondContact O-N 3.09Å; S268-L272 WeakPolarHBondContact O-CG 2.99Å; S268-L272 PolarHBondContact O-N 3.14Å |
| 269 | H | 92.5 | Very high | 91.4 | Very high | 17 Ų | 17 | 72.7 Ų | 72.7 | 8% | 0.079 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -56.5 | -53.5 | 175.9 | -171.2 | 68.9 | 0 | 0 | 0 | 112.1 | M265 V266 L267 S271 L272 E273 L299 N303 L306 | M265-H269 WeakPolarHBondContact O-CB 3.38Å; M265-H269 PolarHBondContact O-N 3.05Å; V266-H269 WeakPolarHBondContact O-CB 3.36Å; V266-H269 PolarHBondContact O-N 2.89Å; L267-H269 VanDerWaalsContact C-N 3.35Å; H269-S271 VanDerWaalsContact C-N 3.26Å; H269-S271 PolarHBondContact O-N 3.4Å; H269-L272 PolarHBondContact O-N 2.93Å; H269-L272 VanDerWaalsContact O-N 3.17Å; H269-E273 IonicContact CD2-OE2 3.86Å; H269-E273 IonicContact NE2-OE1 2.74Å; H269-E273 PolarHBondContact NE2-OE1 2.96Å; H269-E273 IonicContact NE2-OE2 3.87Å; H269-E273 WeakPolarHBondContact O-CG 3.39Å; H269-E273 PolarHBondContact O-N 3.32Å; H269-L299 HydrophobicContact CB-CD1 3.63Å; H269-N303 WeakPolarHBondContact CA-OD1 3.21Å; H269-N303 WeakPolarHBondContact CB-OD1 3.49Å; H269-N303 VanDerWaalsContact CG-OD1 3.3Å; H269-N303 PolarHBondContact ND1-OD1 2.83Å; H269-L306 VanDerWaalsContact CE1-CD1 3.47Å; H269-L306 WeakPolarHBondContact CE1-CD1 3.21Å |
| 270 | R | 91.6 | Very high | 90.7 | Very high | 142 Ų | 142 | 68.2 Ų | 68.2 | 54% | 0.536 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -58.5 | -39.7 | 178.7 | -71.7 | 177.8 | -176.3 | 168.5 | 2.6 | 112 | V266 L267 E273 Q274 | V266-R270 WeakPolarHBondContact O-CG 3.42Å; V266-R270 PolarHBondContact O-N 3.35Å; L267-R270 PolarHBondContact O-N 3.49Å; R270-E273 PolarHBondContact O-N 3.49Å; R270-Q274 WeakPolarHBondContact O-CB 3.38Å; R270-Q274 WeakPolarHBondContact O-CG 3.34Å; R270-Q274 PolarHBondContact O-N 3.12Å |
| 271 | S | 93 | Very high | 89.6 | Confident | 69 Ų | 69 | 74.8 Ų | 74.8 | 48% | 0.483 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -65.9 | -42.8 | 178.8 | -56.8 | 0 | 0 | 0 | 0 | 111.6 | L267 S268 H269 Q274 L275 | L267-S271 WeakPolarHBondContact O-CB 3.31Å; L267-S271 PolarHBondContact O-N 2.91Å; L267-S271 PolarHBondContact O-OG 3.44Å; S268-S271 PolarHBondContact O-N 3.09Å; H269-S271 VanDerWaalsContact C-N 3.26Å; H269-S271 PolarHBondContact O-N 3.4Å; S271-Q274 PolarHBondContact O-N 3.31Å; S271-L275 WeakPolarHBondContact O-CB 3.45Å; S271-L275 PolarHBondContact O-N 2.95Å |
| 272 | L | 92.1 | Very high | 88.2 | Confident | 47 Ų | 47 | 73.3 Ų | 73.3 | 25% | 0.246 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -67.3 | -41.6 | 175.8 | -68.7 | 172.9 | 0 | 0 | 0 | 112 | S268 H269 L275 L276 N303 L306 I310 | S268-L272 WeakPolarHBondContact O-CG 2.99Å; S268-L272 PolarHBondContact O-N 3.14Å; H269-L272 PolarHBondContact O-N 2.93Å; H269-L272 VanDerWaalsContact O-N 3.17Å; L272-L275 PolarHBondContact O-N 3.38Å; L272-L276 WeakPolarHBondContact O-CB 3.31Å; L272-L276 PolarHBondContact O-N 3.16Å; L272-N303 HydrophobicContact CD1-CB 4.02Å; L272-L306 HydrophobicContact CB-CB 3.99Å; L272-L306 HydrophobicContact CB-CD1 4.02Å; L272-L306 HydrophobicContact CD1-CB 4.41Å; L272-I310 HydrophobicContact CB-CD1 4.22Å; L272-I310 HydrophobicContact CD2-CD1 3.78Å |
| 273 | E | 90.4 | Very high | 87.1 | Confident | 25 Ų | 25 | 81.1 Ų | 81.1 | 12% | 0.117 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -59 | -49 | 173.8 | -74.2 | -172.2 | 122 | 0 | 0 | 111.1 | H269 R270 L275 L276 V277 Y287 L306 | H269-E273 IonicContact CD2-OE2 3.86Å; H269-E273 IonicContact NE2-OE1 2.74Å; H269-E273 PolarHBondContact NE2-OE1 2.96Å; H269-E273 IonicContact NE2-OE2 3.87Å; H269-E273 WeakPolarHBondContact O-CG 3.39Å; H269-E273 PolarHBondContact O-N 3.32Å; R270-E273 PolarHBondContact O-N 3.49Å; E273-L275 VanDerWaalsContact C-N 3.32Å; E273-L275 PolarHBondContact O-N 2.52Å; E273-L276 PolarHBondContact O-N 2.94Å; E273-V277 VanDerWaalsContact O-CG2 3.3Å; E273-V277 WeakPolarHBondContact O-CG2 3.34Å; E273-V277 PolarHBondContact O-N 3.25Å; E273-Y287 HydrophobicContact CB-CE1 4.35Å; E273-Y287 HydrophobicContact CG-CE1 3.99Å; E273-Y287 PolarHBondContact OE1-OH 3.33Å; E273-L306 HydrophobicContact CB-CD1 4.47Å; E273-L306 HydrophobicContact CG-CD1 3.54Å |
| 274 | Q | 89.8 | Confident | 86 | Confident | 130 Ų | 130 | 83.2 Ų | 83.2 | 61% | 0.607 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -59.8 | -42.3 | 177.6 | -75.9 | 173.1 | 2.2 | 0 | 0 | 111.9 | R270 S271 V277 S278 | R270-Q274 WeakPolarHBondContact O-CB 3.38Å; R270-Q274 WeakPolarHBondContact O-CG 3.34Å; R270-Q274 PolarHBondContact O-N 3.12Å; S271-Q274 PolarHBondContact O-N 3.31Å; Q274-V277 PolarHBondContact O-N 2.88Å; Q274-S278 WeakPolarHBondContact O-CB 3.42Å; Q274-S278 PolarHBondContact O-N 3.16Å; Q274-S278 PolarHBondContact O-OG 3.41Å |
| 275 | L | 89.5 | Confident | 85 | Confident | 83 Ų | 83 | 83 Ų | 83 | 44% | 0.435 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -66.4 | -44.7 | 178.8 | -172.3 | 136 | 0 | 0 | 0 | 111.5 | S271 L272 E273 V277 S278 L279 I310 | S271-L275 WeakPolarHBondContact O-CB 3.45Å; S271-L275 PolarHBondContact O-N 2.95Å; L272-L275 PolarHBondContact O-N 3.38Å; E273-L275 VanDerWaalsContact C-N 3.32Å; E273-L275 PolarHBondContact O-N 2.52Å; L275-V277 PolarHBondContact O-N 2.99Å; L275-S278 PolarHBondContact O-N 3.07Å; L275-L279 HydrophobicContact CD2-CD1 3.67Å; L275-L279 HydrophobicContact CD2-CG 4.4Å; L275-L279 HydrophobicContact CG-CD1 4.49Å; L275-L279 WeakPolarHBondContact O-CG 3.4Å; L275-L279 PolarHBondContact O-N 3.41Å; L275-I310 HydrophobicContact CD2-CB 4.27Å; L275-I310 HydrophobicContact CD2-CD1 3.53Å; L275-I310 HydrophobicContact CD2-CG1 3.75Å; L275-I310 HydrophobicContact CD2-CG2 3.48Å; L275-I310 VanDerWaalsContact CD2-CG2 3.48Å |
| 276 | L | 88.3 | Confident | 84.1 | Confident | 8 Ų | 8 | 87 Ų | 87 | 4% | 0.042 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -61.2 | -44.2 | 176.2 | -178.2 | 62.8 | 0 | 0 | 0 | 111.8 | L272 E273 L279 Q280 Y287 L306 A309 I310 | L272-L276 WeakPolarHBondContact O-CB 3.31Å; L272-L276 PolarHBondContact O-N 3.16Å; E273-L276 PolarHBondContact O-N 2.94Å; L276-L279 PolarHBondContact O-N 3.43Å; L276-Q280 WeakPolarHBondContact O-CG 3.45Å; L276-Q280 PolarHBondContact O-N 2.89Å; L276-Y287 HydrophobicContact CD2-CD1 4.1Å; L276-Y287 HydrophobicContact CD2-CD2 3.9Å; L276-Y287 HydrophobicContact CD2-CE2 4.48Å; L276-Y287 HydrophobicContact CD2-CG 3.69Å; L276-L306 HydrophobicContact CD2-CD2 3.55Å; L276-A309 HydrophobicContact CD1-CB 4.33Å; L276-A309 HydrophobicContact CD2-CB 4.34Å; L276-I310 HydrophobicContact CB-CD1 4.28Å; L276-I310 HydrophobicContact CB-CG1 3.98Å; L276-I310 HydrophobicContact CD1-CG1 3.99Å |
| 277 | V | 87.2 | Confident | 83.4 | Confident | 52 Ų | 52 | 87.3 Ų | 87.3 | 32% | 0.315 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -62.5 | -42.8 | 176 | 171.5 | 0 | 0 | 0 | 0 | 111.1 | E273 Q274 L275 L279 Q280 Y287 | E273-V277 VanDerWaalsContact O-CG2 3.3Å; E273-V277 WeakPolarHBondContact O-CG2 3.34Å; E273-V277 PolarHBondContact O-N 3.25Å; Q274-V277 PolarHBondContact O-N 2.88Å; L275-V277 PolarHBondContact O-N 2.99Å; V277-L279 VanDerWaalsContact C-N 3.31Å; V277-L279 PolarHBondContact O-N 3.14Å; V277-Q280 PolarHBondContact O-N 3.34Å; V277-Q280 VanDerWaalsContact O-N 3.13Å; V277-Y287 HydrophobicContact CG2-CD1 4.21Å |
| 278 | S | 85.8 | Confident | 82.5 | Confident | 85 Ų | 85 | 91.3 Ų | 91.3 | 59% | 0.594 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -63.7 | -35.1 | 178.8 | -58.5 | 0 | 0 | 0 | 0 | 112.4 | Q274 L275 Q280 W281 | Q274-S278 WeakPolarHBondContact O-CB 3.42Å; Q274-S278 PolarHBondContact O-N 3.16Å; Q274-S278 PolarHBondContact O-OG 3.41Å; L275-S278 PolarHBondContact O-N 3.07Å; S278-Q280 VanDerWaalsContact C-N 3.26Å; S278-Q280 PolarHBondContact O-N 3.47Å; S278-W281 PolarHBondContact O-N 3.1Å |
| 279 | L | 85.1 | Confident | 81.7 | Confident | 56 Ų | 56 | 92.5 Ų | 92.5 | 29% | 0.293 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -70.8 | -17.9 | 176.2 | -71.4 | 174 | 0 | 0 | 0 | 113.7 | L275 L276 V277 I310 H313 L314 | L275-L279 HydrophobicContact CD2-CD1 3.67Å; L275-L279 HydrophobicContact CD2-CG 4.4Å; L275-L279 HydrophobicContact CG-CD1 4.49Å; L275-L279 WeakPolarHBondContact O-CG 3.4Å; L275-L279 PolarHBondContact O-N 3.41Å; L276-L279 PolarHBondContact O-N 3.43Å; V277-L279 VanDerWaalsContact C-N 3.31Å; V277-L279 PolarHBondContact O-N 3.14Å; L279-I310 HydrophobicContact CD1-CG2 4.05Å; L279-H313 PolarHBondContact O-CE1 2.99Å; L279-H313 VanDerWaalsContact O-CE1 3.3Å; L279-L314 HydrophobicContact CD1-CD2 4.01Å; L279-L314 HydrophobicContact CD1-CG 4.19Å; L279-L314 HydrophobicContact CD2-CD2 3.89Å |
| 280 | Q | 81.3 | Confident | 80.8 | Confident | 18 Ų | 18 | 95 Ų | 95 | 8% | 0.084 | 48% | 0.48 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.9 | 2.6 | 179.1 | -67.3 | -179.2 | 6.3 | 0 | 0 | 113.6 | L276 V277 S278 G282 R283 T286 | L276-Q280 WeakPolarHBondContact O-CG 3.45Å; L276-Q280 PolarHBondContact O-N 2.89Å; V277-Q280 PolarHBondContact O-N 3.34Å; V277-Q280 VanDerWaalsContact O-N 3.13Å; S278-Q280 VanDerWaalsContact C-N 3.26Å; S278-Q280 PolarHBondContact O-N 3.47Å; Q280-G282 PolarHBondContact O-N 3.25Å; Q280-R283 PolarHBondContact O-N 3.26Å; Q280-R283 VanDerWaalsContact O-N 3.1Å; Q280-T286 PolarHBondContact NE2-OG1 3.37Å; Q280-T286 VanDerWaalsContact NE2-OG1 3.09Å; Q280-T286 VanDerWaalsContact OE1-N 3.09Å |
| 281 | W | 69.3 | Low | 79.9 | Confident | 240 Ų | 240 | 93.3 Ų | 93.3 | 91% | 0.909 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.3 | 123.9 | -177.4 | -141.6 | 73.3 | 0 | 0 | 0 | 111.6 | S278 | S278-W281 PolarHBondContact O-N 3.1Š|
| 282 | G | 64.1 | Low | 79.1 | Confident | 80 Ų | 80 | 97 Ų | 97 | 83% | 0.825 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86.5 | 4.6 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | Q280 | Q280-G282 PolarHBondContact O-N 3.25Š|
| 283 | R | 68.3 | Low | 78.3 | Confident | 199 Ų | 199 | 100.9 Ų | 100.9 | 75% | 0.751 | 54% | 0.535 | S | S | * | . | S | Bend | trans | -122.4 | 170.6 | 170.4 | -64.9 | -175.1 | -179.2 | -120.2 | 1.8 | 110.6 | Q280 Q285 | Q280-R283 PolarHBondContact O-N 3.26Å; Q280-R283 VanDerWaalsContact O-N 3.1Å; R283-Q285 PolarHBondContact O-N 3.43Å |
| 284 | Q | 71.6 | Confident | 78 | Confident | 180 Ų | 180 | 103 Ų | 103 | 84% | 0.841 | 55% | 0.547 | S | S | * | . | trans | -66.8 | 123.5 | 173.8 | -170.2 | 165.3 | 12.3 | 0 | 0 | 109.7 | T286 | Q284-T286 PolarHBondContact O-N 3.11Š| ||
| 285 | Q | 72.8 | Confident | 77.9 | Confident | 90 Ų | 90 | 99.7 Ų | 99.7 | 42% | 0.421 | 54% | 0.538 | S | S | . | . | trans | -65.1 | 123.9 | -179.2 | -173.1 | 169.5 | 11 | 0 | 0 | 110.6 | R283 Y287 | R283-Q285 PolarHBondContact O-N 3.43Å; Q285-Y287 WeakPolarHBondContact CG-O 3.42Å; Q285-Y287 PolarHBondContact NE2-O 3.23Å | ||
| 286 | T | 72.8 | Confident | 77.9 | Confident | 114 Ų | 114 | 97.2 Ų | 97.2 | 70% | 0.699 | 53% | 0.525 | S | S | * | . | trans | -111.5 | -9.5 | -178.3 | 56.2 | 0 | 0 | 0 | 0 | 113.1 | Q280 Q284 | Q280-T286 PolarHBondContact NE2-OG1 3.37Å; Q280-T286 VanDerWaalsContact NE2-OG1 3.09Å; Q280-T286 VanDerWaalsContact OE1-N 3.09Å; Q284-T286 PolarHBondContact O-N 3.11Å | ||
| 287 | Y | 78.4 | Confident | 77.9 | Confident | 53 Ų | 53 | 99.5 Ų | 99.5 | 21% | 0.208 | 55% | 0.551 | C | S | . | * | trans | -115.6 | 132.4 | 179.6 | -175.6 | -100.6 | 0 | 0 | 0 | 111.8 | E273 L276 V277 Q285 P289 L306 | E273-Y287 HydrophobicContact CB-CE1 4.35Å; E273-Y287 HydrophobicContact CG-CE1 3.99Å; E273-Y287 PolarHBondContact OE1-OH 3.33Å; L276-Y287 HydrophobicContact CD2-CD1 4.1Å; L276-Y287 HydrophobicContact CD2-CD2 3.9Å; L276-Y287 HydrophobicContact CD2-CE2 4.48Å; L276-Y287 HydrophobicContact CD2-CG 3.69Å; V277-Y287 HydrophobicContact CG2-CD1 4.21Å; Q285-Y287 WeakPolarHBondContact CG-O 3.42Å; Q285-Y287 PolarHBondContact NE2-O 3.23Å; Y287-P289 HydrophobicContact CE1-CG 4.21Å; Y287-L306 HydrophobicContact CD2-CD2 4.32Å; Y287-L306 HydrophobicContact CE1-CD2 4.23Å; Y287-L306 HydrophobicContact CE2-CD2 3.69Å | ||
| 288 | Y | 75.8 | Confident | 78 | Confident | 174 Ų | 174 | 102.4 Ų | 102.4 | 68% | 0.682 | 56% | 0.561 | S | S | * | * | trans | -121.9 | 118.5 | 176 | -68.6 | -83.2 | 0 | 0 | 0 | 109.3 | S290 | Y288-S290 PolarHBondContact O-N 3.05Š| ||
| 289 | P | 77.1 | Confident | 78.2 | Confident | 80 Ų | 80 | 98.6 Ų | 98.6 | 52% | 0.519 | 53% | 0.534 | S | S | . | . | trans | -57.6 | 134.7 | 176.8 | -25.2 | 34.5 | 0 | 0 | 0 | 111.5 | Y287 | Y287-P289 HydrophobicContact CE1-CG 4.21Š| ||
| 290 | S | 73.3 | Confident | 78.6 | Confident | 69 Ų | 69 | 98 Ų | 98 | 48% | 0.483 | 54% | 0.537 | S | S | . | . | trans | -97.1 | 132.7 | 176.6 | -179 | 0 | 0 | 0 | 0 | 110.2 | Y288 Q292 | Y288-S290 PolarHBondContact O-N 3.05Å; S290-Q292 VanDerWaalsContact C-N 3.26Å; S290-Q292 PolarHBondContact O-N 2.99Å; S290-Q292 PolarHBondContact OG-N 3.33Å | ||
| 291 | A | 71.3 | Confident | 79 | Confident | 108 Ų | 108 | 98.7 Ų | 98.7 | 89% | 0.893 | 55% | 0.549 | S | S | * | . | trans | -86.1 | 10.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 292 | Q | 77.3 | Confident | 80 | Confident | 145 Ų | 145 | 88.1 Ų | 88.1 | 68% | 0.678 | 51% | 0.512 | S | S | * | . | P | Polyproline II helix | trans | -75.7 | 138.4 | -176.4 | -73.7 | -179.1 | -11.6 | 0 | 0 | 111.8 | S290 L294 | S290-Q292 VanDerWaalsContact C-N 3.26Å; S290-Q292 PolarHBondContact O-N 2.99Å; S290-Q292 PolarHBondContact OG-N 3.33Å; Q292-L294 VanDerWaalsContact O-CD1 3.32Å; Q292-L294 WeakPolarHBondContact O-CD1 3.32Å; Q292-L294 PolarHBondContact O-N 3.21Å |
| 293 | P | 75.7 | Confident | 81.4 | Confident | 130 Ų | 130 | 85 Ų | 85 | 84% | 0.844 | 48% | 0.477 | S | S | * | . | P | Polyproline II helix | trans | -67 | 122.8 | 170.8 | 28 | -31.8 | 0 | 0 | 0 | 109.2 | ||
| 294 | L | 82.4 | Confident | 82.5 | Confident | 70 Ų | 70 | 81.2 Ų | 81.2 | 37% | 0.366 | 47% | 0.467 | S | S | . | . | P | Polyproline II helix | trans | -100.8 | 141 | 174.9 | -62.9 | 108.5 | 0 | 0 | 0 | 110 | Q292 E298 L299 A302 | Q292-L294 VanDerWaalsContact O-CD1 3.32Å; Q292-L294 WeakPolarHBondContact O-CD1 3.32Å; Q292-L294 PolarHBondContact O-N 3.21Å; L294-E298 HydrophobicContact CB-CB 4.02Å; L294-E298 HydrophobicContact CD2-CB 3.9Å; L294-L299 HydrophobicContact CB-CB 4.26Å; L294-L299 HydrophobicContact CD1-CD1 4.44Å; L294-A302 HydrophobicContact CD2-CB 4.2Å |
| 295 | S | 88.3 | Confident | 83.5 | Confident | 60 Ų | 60 | 80 Ų | 80 | 42% | 0.42 | 46% | 0.459 | S | S | . | . | P | Polyproline II helix | trans | -65.1 | 162.1 | 164.7 | 67.6 | 0 | 0 | 0 | 0 | 110.9 | G297 E298 L299 | S295-G297 VanDerWaalsContact C-N 3.26Å; S295-G297 PolarHBondContact O-N 2.94Å; S295-E298 VanDerWaalsContact CB-OE2 3.27Å; S295-E298 WeakPolarHBondContact CB-OE2 3.4Å; S295-E298 PolarHBondContact N-OE2 2.86Å; S295-E298 PolarHBondContact O-N 3.13Å; S295-E298 VanDerWaalsContact O-N 3.1Å; S295-E298 WeakPolarHBondContact OG-CB 3.4Å; S295-E298 WeakPolarHBondContact OG-CG 3.45Å; S295-E298 PolarHBondContact OG-N 3.47Å; S295-E298 PolarHBondContact OG-OE2 2.84Å; S295-L299 WeakPolarHBondContact O-CB 3.49Å; S295-L299 PolarHBondContact O-N 3.36Å |
| 296 | I | 89.1 | Confident | 84.3 | Confident | 30 Ų | 30 | 76.1 Ų | 76.1 | 15% | 0.154 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -55.4 | -41.3 | -179.6 | -64.8 | 176.5 | 0 | 0 | 0 | 111.8 | R258 F261 L299 A300 | R258-I296 HydrophobicContact CG-CD1 3.52Å; R258-I296 VanDerWaalsContact CZ-CD1 3.42Å; F261-I296 HydrophobicContact CD1-CG2 3.79Å; F261-I296 HydrophobicContact CE1-CG2 3.57Å; I296-L299 PolarHBondContact O-N 3.4Å; I296-A300 PolarHBondContact O-N 3.46Å |
| 297 | G | 89.1 | Confident | 85.2 | Confident | 57 Ų | 57 | 72 Ų | 72 | 59% | 0.588 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -68 | -40.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.9 | S295 A300 G301 | S295-G297 VanDerWaalsContact C-N 3.26Å; S295-G297 PolarHBondContact O-N 2.94Å; G297-A300 PolarHBondContact O-N 3.38Å; G297-G301 PolarHBondContact O-N 2.89Å |
| 298 | E | 90.1 | Very high | 85.8 | Confident | 113 Ų | 113 | 73.1 Ų | 73.1 | 53% | 0.528 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -67.9 | -37 | 176 | -69.1 | 164.4 | 147.7 | 0 | 0 | 111.8 | L294 S295 G301 A302 | L294-E298 HydrophobicContact CB-CB 4.02Å; L294-E298 HydrophobicContact CD2-CB 3.9Å; S295-E298 VanDerWaalsContact CB-OE2 3.27Å; S295-E298 WeakPolarHBondContact CB-OE2 3.4Å; S295-E298 PolarHBondContact N-OE2 2.86Å; S295-E298 PolarHBondContact O-N 3.13Å; S295-E298 VanDerWaalsContact O-N 3.1Å; S295-E298 WeakPolarHBondContact OG-CB 3.4Å; S295-E298 WeakPolarHBondContact OG-CG 3.45Å; S295-E298 PolarHBondContact OG-N 3.47Å; S295-E298 PolarHBondContact OG-OE2 2.84Å; E298-G301 PolarHBondContact O-N 2.8Å; E298-A302 WeakPolarHBondContact O-CB 3.17Å; E298-A302 PolarHBondContact O-N 2.96Å |
| 299 | L | 89.7 | Confident | 86.3 | Confident | 5 Ų | 5 | 66.5 Ų | 66.5 | 3% | 0.026 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -65.9 | -39.4 | 176 | -169.8 | 61.6 | 0 | 0 | 0 | 111.6 | M265 V266 H269 L294 S295 I296 A302 N303 | M265-L299 HydrophobicContact CB-CD2 3.55Å; M265-L299 HydrophobicContact CB-CG 4.11Å; V266-L299 HydrophobicContact CB-CD2 4.31Å; V266-L299 HydrophobicContact CG2-CD2 3.48Å; V266-L299 VanDerWaalsContact CG2-CD2 3.48Å; H269-L299 HydrophobicContact CB-CD1 3.63Å; L294-L299 HydrophobicContact CB-CB 4.26Å; L294-L299 HydrophobicContact CD1-CD1 4.44Å; S295-L299 WeakPolarHBondContact O-CB 3.49Å; S295-L299 PolarHBondContact O-N 3.36Å; I296-L299 PolarHBondContact O-N 3.4Å; L299-A302 PolarHBondContact O-N 3.32Å; L299-N303 WeakPolarHBondContact O-CB 3.18Å; L299-N303 VanDerWaalsContact O-CG 3.23Å; L299-N303 PolarHBondContact O-N 2.7Å; L299-N303 PolarHBondContact O-OD1 3.23Å |
| 300 | A | 92.5 | Very high | 86.9 | Confident | 43 Ų | 43 | 63.2 Ų | 63.2 | 36% | 0.355 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -60.6 | -47.2 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | M265 I296 G297 A302 N303 H304 | M265-A300 HydrophobicContact CE-CB 3.7Å; I296-A300 PolarHBondContact O-N 3.46Å; G297-A300 PolarHBondContact O-N 3.38Å; A300-A302 VanDerWaalsContact C-N 3.33Å; A300-A302 PolarHBondContact O-N 3.27Å; A300-N303 PolarHBondContact O-N 2.81Å; A300-H304 PolarHBondContact O-N 3Å |
| 301 | G | 90.9 | Very high | 87.6 | Confident | 32 Ų | 32 | 63.8 Ų | 63.8 | 33% | 0.33 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -62 | -38.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113 | G297 E298 H304 K305 | G297-G301 PolarHBondContact O-N 2.89Å; E298-G301 PolarHBondContact O-N 2.8Å; G301-H304 PolarHBondContact O-N 3.1Å; G301-K305 WeakPolarHBondContact O-CG 3.2Å; G301-K305 PolarHBondContact O-N 3.29Å |
| 302 | A | 89.9 | Confident | 88.3 | Confident | 18 Ų | 18 | 61.6 Ų | 61.6 | 15% | 0.149 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -67.5 | -42.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | L294 E298 L299 A300 H304 K305 L306 | L294-A302 HydrophobicContact CD2-CB 4.2Å; E298-A302 WeakPolarHBondContact O-CB 3.17Å; E298-A302 PolarHBondContact O-N 2.96Å; L299-A302 PolarHBondContact O-N 3.32Å; A300-A302 VanDerWaalsContact C-N 3.33Å; A300-A302 PolarHBondContact O-N 3.27Å; A302-H304 VanDerWaalsContact C-N 3.33Å; A302-H304 PolarHBondContact O-N 3.43Å; A302-K305 PolarHBondContact O-N 3.3Å; A302-L306 WeakPolarHBondContact O-CG 3.35Å; A302-L306 PolarHBondContact O-N 3.42Å |
| 303 | N | 92.7 | Very high | 88.6 | Confident | 14 Ų | 14 | 58.6 Ų | 58.6 | 8% | 0.075 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -60.9 | -42.5 | 174.5 | -73 | -2.8 | 0 | 0 | 0 | 111.5 | M265 H269 L272 L299 A300 L306 A307 | M265-N303 HydrophobicContact CE-CB 4.38Å; M265-N303 VanDerWaalsContact CE-ND2 3.26Å; M265-N303 WeakPolarHBondContact CE-ND2 3.27Å; M265-N303 PolarHBondContact O-ND2 3.45Å; M265-N303 VanDerWaalsContact O-ND2 3.14Å; H269-N303 WeakPolarHBondContact CA-OD1 3.21Å; H269-N303 WeakPolarHBondContact CB-OD1 3.49Å; H269-N303 VanDerWaalsContact CG-OD1 3.3Å; H269-N303 PolarHBondContact ND1-OD1 2.83Å; L272-N303 HydrophobicContact CD1-CB 4.02Å; L299-N303 WeakPolarHBondContact O-CB 3.18Å; L299-N303 VanDerWaalsContact O-CG 3.23Å; L299-N303 PolarHBondContact O-N 2.7Å; L299-N303 PolarHBondContact O-OD1 3.23Å; A300-N303 PolarHBondContact O-N 2.81Å; N303-L306 PolarHBondContact O-N 3.38Å; N303-A307 WeakPolarHBondContact O-CB 3.32Å; N303-A307 PolarHBondContact O-N 3.47Å |
| 304 | H | 92.3 | Very high | 89.1 | Confident | 120 Ų | 120 | 57.3 Ų | 57.3 | 56% | 0.556 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -62.1 | -46.8 | 175.8 | -169.8 | 62.8 | 0 | 0 | 0 | 111.9 | A300 G301 A302 L306 A307 D308 | A300-H304 PolarHBondContact O-N 3Å; G301-H304 PolarHBondContact O-N 3.1Å; A302-H304 VanDerWaalsContact C-N 3.33Å; A302-H304 PolarHBondContact O-N 3.43Å; H304-L306 VanDerWaalsContact C-N 3.34Å; H304-L306 PolarHBondContact O-N 2.81Å; H304-A307 PolarHBondContact O-N 2.93Å; H304-D308 IonicContact CD2-OD2 2.75Å; H304-D308 PolarHBondContact CD2-OD2 3.26Å; H304-D308 IonicContact CE1-OD1 3.01Å; H304-D308 IonicContact CE1-OD2 2.81Å; H304-D308 IonicContact NE2-OD2 3.38Å; H304-D308 PolarHBondContact NE2-OD2 3Å; H304-D308 WeakPolarHBondContact O-CB 3.33Å; H304-D308 PolarHBondContact O-N 3.49Å |
| 305 | K | 91.3 | Very high | 89.1 | Confident | 155 Ų | 155 | 60.1 Ų | 60.1 | 67% | 0.674 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -59.9 | -41.3 | 176.4 | -72.1 | 172 | -175.6 | 176.5 | 0 | 112.8 | G301 A302 A309 | G301-K305 WeakPolarHBondContact O-CG 3.2Å; G301-K305 PolarHBondContact O-N 3.29Å; A302-K305 PolarHBondContact O-N 3.3Å; K305-A309 WeakPolarHBondContact O-CB 3.05Å; K305-A309 PolarHBondContact O-N 3.49Å |
| 306 | L | 90.1 | Very high | 88 | Confident | 8 Ų | 8 | 59 Ų | 59 | 4% | 0.042 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -65.7 | -45.1 | 176 | -73.5 | 174.3 | 0 | 0 | 0 | 111.3 | H269 L272 E273 L276 Y287 A302 N303 H304 D308 A309 I310 | H269-L306 VanDerWaalsContact CE1-CD1 3.47Å; H269-L306 WeakPolarHBondContact CE1-CD1 3.21Å; L272-L306 HydrophobicContact CB-CB 3.99Å; L272-L306 HydrophobicContact CB-CD1 4.02Å; L272-L306 HydrophobicContact CD1-CB 4.41Å; E273-L306 HydrophobicContact CB-CD1 4.47Å; E273-L306 HydrophobicContact CG-CD1 3.54Å; L276-L306 HydrophobicContact CD2-CD2 3.55Å; Y287-L306 HydrophobicContact CD2-CD2 4.32Å; Y287-L306 HydrophobicContact CE1-CD2 4.23Å; Y287-L306 HydrophobicContact CE2-CD2 3.69Å; A302-L306 WeakPolarHBondContact O-CG 3.35Å; A302-L306 PolarHBondContact O-N 3.42Å; N303-L306 PolarHBondContact O-N 3.38Å; H304-L306 VanDerWaalsContact C-N 3.34Å; H304-L306 PolarHBondContact O-N 2.81Å; L306-D308 VanDerWaalsContact C-N 3.35Å; L306-D308 PolarHBondContact O-N 3.44Å; L306-A309 PolarHBondContact O-N 2.85Å; L306-I310 WeakPolarHBondContact O-CB 3.44Å; L306-I310 WeakPolarHBondContact O-CD1 3.35Å; L306-I310 VanDerWaalsContact O-CG1 3.22Å; L306-I310 WeakPolarHBondContact O-CG1 3.33Å; L306-I310 PolarHBondContact O-N 3.17Å |
| 307 | A | 92.4 | Very high | 86.6 | Confident | 29 Ų | 29 | 66.5 Ų | 66.5 | 24% | 0.24 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -60.2 | -43.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | N303 H304 I310 N311 | N303-A307 WeakPolarHBondContact O-CB 3.32Å; N303-A307 PolarHBondContact O-N 3.47Å; H304-A307 PolarHBondContact O-N 2.93Å; A307-I310 PolarHBondContact O-N 2.91Å; A307-N311 WeakPolarHBondContact O-CB 3.05Å; A307-N311 VanDerWaalsContact O-CG 3.31Å; A307-N311 PolarHBondContact O-N 2.93Å; A307-N311 PolarHBondContact O-ND2 3.41Å |
| 308 | D | 89.8 | Confident | 84.9 | Confident | 75 Ų | 75 | 70.1 Ų | 70.1 | 40% | 0.401 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -63.5 | -42.1 | 175.2 | -73.2 | -20.3 | 0 | 0 | 0 | 112.1 | H304 L306 N311 S312 | H304-D308 IonicContact CD2-OD2 2.75Å; H304-D308 PolarHBondContact CD2-OD2 3.26Å; H304-D308 IonicContact CE1-OD1 3.01Å; H304-D308 IonicContact CE1-OD2 2.81Å; H304-D308 IonicContact NE2-OD2 3.38Å; H304-D308 PolarHBondContact NE2-OD2 3Å; H304-D308 WeakPolarHBondContact O-CB 3.33Å; H304-D308 PolarHBondContact O-N 3.49Å; L306-D308 VanDerWaalsContact C-N 3.35Å; L306-D308 PolarHBondContact O-N 3.44Å; D308-N311 PolarHBondContact O-N 2.72Å; D308-S312 WeakPolarHBondContact O-CB 3.47Å; D308-S312 PolarHBondContact O-N 3.46Å; D308-S312 PolarHBondContact O-OG 2.81Å |
| 309 | A | 87.5 | Confident | 82.8 | Confident | 35 Ų | 35 | 72.1 Ų | 72.1 | 29% | 0.289 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -62 | -46.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | L276 K305 L306 S312 H313 | L276-A309 HydrophobicContact CD1-CB 4.33Å; L276-A309 HydrophobicContact CD2-CB 4.34Å; K305-A309 WeakPolarHBondContact O-CB 3.05Å; K305-A309 PolarHBondContact O-N 3.49Å; L306-A309 PolarHBondContact O-N 2.85Å; A309-S312 PolarHBondContact O-N 3.26Å; A309-S312 PolarHBondContact O-OG 3.44Å; A309-H313 WeakPolarHBondContact O-CB 3.3Å; A309-H313 PolarHBondContact O-N 3.34Å |
| 310 | I | 88.9 | Confident | 80.9 | Confident | 11 Ų | 11 | 75.7 Ų | 75.7 | 6% | 0.056 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -59.9 | -48.4 | 175 | -69 | 159.7 | 0 | 0 | 0 | 110.5 | L272 L275 L276 L279 L306 A307 S312 H313 L314 | L272-I310 HydrophobicContact CB-CD1 4.22Å; L272-I310 HydrophobicContact CD2-CD1 3.78Å; L275-I310 HydrophobicContact CD2-CB 4.27Å; L275-I310 HydrophobicContact CD2-CD1 3.53Å; L275-I310 HydrophobicContact CD2-CG1 3.75Å; L275-I310 HydrophobicContact CD2-CG2 3.48Å; L275-I310 VanDerWaalsContact CD2-CG2 3.48Å; L276-I310 HydrophobicContact CB-CD1 4.28Å; L276-I310 HydrophobicContact CB-CG1 3.98Å; L276-I310 HydrophobicContact CD1-CG1 3.99Å; L279-I310 HydrophobicContact CD1-CG2 4.05Å; L306-I310 WeakPolarHBondContact O-CB 3.44Å; L306-I310 WeakPolarHBondContact O-CD1 3.35Å; L306-I310 VanDerWaalsContact O-CG1 3.22Å; L306-I310 WeakPolarHBondContact O-CG1 3.33Å; L306-I310 PolarHBondContact O-N 3.17Å; A307-I310 PolarHBondContact O-N 2.91Å; I310-S312 VanDerWaalsContact C-N 3.35Å; I310-S312 PolarHBondContact O-N 3.14Å; I310-H313 WeakPolarHBondContact O-CB 3.38Å; I310-H313 PolarHBondContact O-N 2.95Å; I310-H313 VanDerWaalsContact O-N 3.11Å; I310-L314 HydrophobicContact CG2-CD1 3.78Å; I310-L314 HydrophobicContact CG2-CG 4.32Å; I310-L314 WeakPolarHBondContact O-CG 3.26Å; I310-L314 PolarHBondContact O-N 2.95Å |
| 311 | N | 89.3 | Confident | 78.6 | Confident | 82 Ų | 82 | 78.7 Ų | 78.7 | 44% | 0.439 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -58.9 | -45.8 | 178 | -80.2 | -24.8 | 0 | 0 | 0 | 111.5 | A307 D308 H313 L314 L315 | A307-N311 WeakPolarHBondContact O-CB 3.05Å; A307-N311 VanDerWaalsContact O-CG 3.31Å; A307-N311 PolarHBondContact O-N 2.93Å; A307-N311 PolarHBondContact O-ND2 3.41Å; D308-N311 PolarHBondContact O-N 2.72Å; N311-H313 PolarHBondContact O-N 3.29Å; N311-L314 PolarHBondContact O-N 3.07Å; N311-L315 WeakPolarHBondContact O-CB 3.41Å; N311-L315 PolarHBondContact O-N 3.42Å |
| 312 | S | 86.2 | Confident | 76.5 | Confident | 62 Ų | 62 | 81.9 Ų | 81.9 | 43% | 0.434 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64.1 | -29.9 | 177.4 | 76.2 | 0 | 0 | 0 | 0 | 113 | D308 A309 I310 G316 | D308-S312 WeakPolarHBondContact O-CB 3.47Å; D308-S312 PolarHBondContact O-N 3.46Å; D308-S312 PolarHBondContact O-OG 2.81Å; A309-S312 PolarHBondContact O-N 3.26Å; A309-S312 PolarHBondContact O-OG 3.44Å; I310-S312 VanDerWaalsContact C-N 3.35Å; I310-S312 PolarHBondContact O-N 3.14Å; S312-G316 CarbonylContact O-C 3.59Å; S312-G316 VanDerWaalsContact O-C 3.25Å; S312-G316 WeakPolarHBondContact O-CA 3.36Å; S312-G316 PolarHBondContact O-N 2.92Å; S312-G316 VanDerWaalsContact O-N 3.1Å |
| 313 | H | 83.6 | Confident | 74.1 | Confident | 81 Ų | 81 | 87.2 Ų | 87.2 | 38% | 0.375 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -77.5 | -39.1 | 177.9 | -169.5 | -88.2 | 0 | 0 | 0 | 112.3 | L279 A309 I310 N311 | L279-H313 PolarHBondContact O-CE1 2.99Å; L279-H313 VanDerWaalsContact O-CE1 3.3Å; A309-H313 WeakPolarHBondContact O-CB 3.3Å; A309-H313 PolarHBondContact O-N 3.34Å; I310-H313 WeakPolarHBondContact O-CB 3.38Å; I310-H313 PolarHBondContact O-N 2.95Å; I310-H313 VanDerWaalsContact O-N 3.11Å; N311-H313 PolarHBondContact O-N 3.29Å |
| 314 | L | 84.8 | Confident | 71.9 | Confident | 104 Ų | 104 | 92.7 Ų | 92.7 | 55% | 0.545 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -80 | -40.9 | -179.5 | -67.2 | 176.9 | 0 | 0 | 0 | 113 | L279 I310 N311 | L279-L314 HydrophobicContact CD1-CD2 4.01Å; L279-L314 HydrophobicContact CD1-CG 4.19Å; L279-L314 HydrophobicContact CD2-CD2 3.89Å; I310-L314 HydrophobicContact CG2-CD1 3.78Å; I310-L314 HydrophobicContact CG2-CG 4.32Å; I310-L314 WeakPolarHBondContact O-CG 3.26Å; I310-L314 PolarHBondContact O-N 2.95Å; N311-L314 PolarHBondContact O-N 3.07Å |
| 315 | L | 82.2 | Confident | 69.3 | Low | 129 Ų | 129 | 91.9 Ų | 91.9 | 68% | 0.675 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -96.4 | -9.1 | -175.8 | -58.9 | 174.3 | 0 | 0 | 0 | 113 | N311 | N311-L315 WeakPolarHBondContact O-CB 3.41Å; N311-L315 PolarHBondContact O-N 3.42Å |
| 316 | G | 66.1 | Low | 67.1 | Low | 36 Ų | 36 | 94.1 Ų | 94.1 | 37% | 0.371 | 55% | 0.548 | S | S | . | . | trans | 79 | 160 | -173.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | S312 N318 | S312-G316 CarbonylContact O-C 3.59Å; S312-G316 VanDerWaalsContact O-C 3.25Å; S312-G316 WeakPolarHBondContact O-CA 3.36Å; S312-G316 PolarHBondContact O-N 2.92Å; S312-G316 VanDerWaalsContact O-N 3.1Å; G316-N318 VanDerWaalsContact C-N 3.33Å; G316-N318 PolarHBondContact O-N 3.13Å | ||
| 317 | K | 60.1 | Low | 64.7 | Low | 188 Ų | 188 | 97 Ų | 97 | 82% | 0.817 | 58% | 0.579 | S | S | * | * | trans | -73.1 | 88.5 | 176.3 | -149.1 | 172.5 | -168.4 | 174.5 | 0 | 108 | N319 | K317-N319 VanDerWaalsContact C-N 3.3Å; K317-N319 PolarHBondContact O-N 3.4Å | ||
| 318 | N | 51.9 | Low | 62 | Low | 133 Ų | 133 | 100.3 Ų | 100.3 | 71% | 0.711 | 60% | 0.6 | S | S | * | * | trans | -63 | 95.2 | 172.5 | -75.3 | 3.7 | 0 | 0 | 0 | 108.2 | G316 A320 | G316-N318 VanDerWaalsContact C-N 3.33Å; G316-N318 PolarHBondContact O-N 3.13Å; N318-A320 PolarHBondContact O-N 3.27Å | ||
| 319 | N | 47.9 | Very low | 59.7 | Low | 154 Ų | 154 | 102.4 Ų | 102.4 | 82% | 0.824 | 62% | 0.621 | S | S | * | * | trans | -67.8 | 63.3 | 161.3 | -81.2 | -5.9 | 0 | 0 | 0 | 108.7 | K317 | K317-N319 VanDerWaalsContact C-N 3.3Å; K317-N319 PolarHBondContact O-N 3.4Å | ||
| 320 | A | 48.3 | Very low | 57.6 | Low | 80 Ų | 80 | 104 Ų | 104 | 66% | 0.661 | 63% | 0.634 | S | S | * | * | trans | -96 | 78.8 | 161.7 | 0 | 0 | 0 | 0 | 0 | 106.6 | N318 S322 | N318-A320 PolarHBondContact O-N 3.27Å; A320-S322 PolarHBondContact O-N 2.92Å | ||
| 321 | S | 43.9 | Very low | 55.5 | Low | 106 Ų | 106 | 108.5 Ų | 108.5 | 74% | 0.741 | 66% | 0.664 | S | S | * | * | trans | -56.7 | 130.3 | 154.6 | 177.1 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 322 | S | 48.4 | Very low | 53.5 | Low | 100 Ų | 100 | 109.1 Ų | 109.1 | 70% | 0.699 | 68% | 0.681 | S | S | * | * | trans | 53.1 | 89.1 | 163.4 | 61.5 | 0 | 0 | 0 | 0 | 116.5 | A320 | A320-S322 PolarHBondContact O-N 2.92Š| ||
| 323 | T | 38.3 | Very low | 51.8 | Low | 130 Ų | 130 | 114.3 Ų | 114.3 | 80% | 0.798 | 70% | 0.698 | S | S | * | * | -151.2 | 115.5 | 117.8 | 26.4 | 0 | 0 | 0 | 0 | 107.2 | S325 | T323-S325 PolarHBondContact O-N 2.94Š| |||
| 324 | V | 46.8 | Very low | 50.5 | Low | 128 Ų | 128 | 118.6 Ų | 118.6 | 78% | 0.776 | 72% | 0.718 | S | S | * | * | trans | -55.9 | 99 | 157.2 | 179.9 | 0 | 0 | 0 | 0 | 105.6 | K326 | V324-K326 HydrophobicContact CG1-CG 3.9Å; V324-K326 PolarHBondContact O-N 3.48Å | ||
| 325 | S | 38.6 | Very low | 49.8 | Very low | 104 Ų | 104 | 120.8 Ų | 120.8 | 73% | 0.727 | 73% | 0.729 | S | S | * | * | trans | -65.4 | 81.8 | 156.1 | 45.1 | 0 | 0 | 0 | 0 | 106.7 | T323 G327 | T323-S325 PolarHBondContact O-N 2.94Å; S325-G327 PolarHBondContact O-N 3.49Å | ||
| 326 | K | 44.4 | Very low | 49.6 | Very low | 202 Ų | 202 | 119.7 Ų | 119.7 | 88% | 0.878 | 73% | 0.731 | S | S | * | * | trans | -56.6 | 86.3 | 151.7 | -84.7 | -180 | 174.2 | 177 | 0 | 105.7 | V324 | V324-K326 HydrophobicContact CG1-CG 3.9Å; V324-K326 PolarHBondContact O-N 3.48Å | ||
| 327 | G | 39 | Very low | 50.5 | Low | 69 Ų | 69 | 119.9 Ų | 119.9 | 71% | 0.711 | 73% | 0.727 | S | S | * | * | trans | 173.9 | 39 | -166.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | S325 | S325-G327 PolarHBondContact O-N 3.49Š| ||
| 328 | S | 36.3 | Very low | 52 | Low | 97 Ų | 97 | 113.1 Ų | 113.1 | 68% | 0.678 | 70% | 0.702 | S | S | * | * | trans | -157.9 | 100.6 | 144.8 | -171.1 | 0 | 0 | 0 | 0 | 105.9 | A330 | S328-A330 PolarHBondContact O-N 3.34Å; S328-A330 PolarHBondContact OG-N 3.42Å | ||
| 329 | S | 41.2 | Very low | 53.8 | Low | 119 Ų | 119 | 111.4 Ų | 111.4 | 83% | 0.832 | 70% | 0.698 | S | S | * | * | trans | -60.2 | 71.4 | 144.3 | 54.4 | 0 | 0 | 0 | 0 | 106.8 | P331 | S329-P331 WeakPolarHBondContact O-CD 3.4Å; S329-P331 VanDerWaalsContact O-N 3.15Å | ||
| 330 | A | 44.5 | Very low | 56 | Low | 68 Ų | 68 | 104.1 Ų | 104.1 | 56% | 0.562 | 66% | 0.659 | S | S | * | * | trans | -58.3 | 118.9 | 158.9 | 0 | 0 | 0 | 0 | 0 | 103.1 | S328 A332 | S328-A330 PolarHBondContact O-N 3.34Å; S328-A330 PolarHBondContact OG-N 3.42Å; A330-A332 PolarHBondContact O-N 2.89Å | ||
| 331 | P | 44.9 | Very low | 58.1 | Low | 107 Ų | 107 | 104.4 Ų | 104.4 | 70% | 0.695 | 65% | 0.646 | S | S | * | * | trans | -54 | 123.8 | 175 | 24.9 | -30.6 | 0 | 0 | 0 | 104.3 | S329 E333 | S329-P331 WeakPolarHBondContact O-CD 3.4Å; S329-P331 VanDerWaalsContact O-N 3.15Å; P331-E333 VanDerWaalsContact C-N 3.3Å; P331-E333 WeakPolarHBondContact O-CA 3.34Å; P331-E333 PolarHBondContact O-N 3.34Å | ||
| 332 | A | 46.2 | Very low | 60.5 | Low | 95 Ų | 95 | 104.1 Ų | 104.1 | 79% | 0.785 | 63% | 0.632 | S | S | * | * | trans | -46.3 | 107.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 105.3 | A330 H334 | A330-A332 PolarHBondContact O-N 2.89Å; A332-H334 PolarHBondContact O-N 3.38Å | ||
| 333 | E | 50.5 | Low | 62.6 | Low | 170 Ų | 170 | 103.1 Ų | 103.1 | 79% | 0.794 | 62% | 0.617 | S | S | * | * | trans | -56.4 | 113.3 | -168 | -76.2 | -178.5 | 163.7 | 0 | 0 | 105.2 | P331 L335 | P331-E333 VanDerWaalsContact C-N 3.3Å; P331-E333 WeakPolarHBondContact O-CA 3.34Å; P331-E333 PolarHBondContact O-N 3.34Å; E333-L335 PolarHBondContact O-N 2.89Å | ||
| 334 | H | 56.1 | Low | 65.2 | Low | 172 Ų | 172 | 97.9 Ų | 97.9 | 80% | 0.796 | 59% | 0.587 | S | S | * | * | trans | -71.2 | 86.3 | -173.7 | -171.7 | -73.9 | 0 | 0 | 0 | 105.5 | A332 C336 | A332-H334 PolarHBondContact O-N 3.38Å; H334-C336 PolarHBondContact O-N 2.94Å | ||
| 335 | L | 70.9 | Confident | 67.3 | Low | 150 Ų | 150 | 95.8 Ų | 95.8 | 79% | 0.785 | 57% | 0.568 | S | S | * | * | trans | -51.8 | 112.9 | 177.8 | -68.3 | 172.9 | 0 | 0 | 0 | 106.5 | E333 S337 | E333-L335 PolarHBondContact O-N 2.89Å; L335-S337 PolarHBondContact O-N 3.31Å | ||
| 336 | C | 78 | Confident | 69.9 | Low | 106 Ų | 106 | 97.7 Ų | 97.7 | 72% | 0.716 | 56% | 0.564 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 121.2 | 178.6 | -76.6 | 0 | 0 | 0 | 0 | 107.4 | H334 T338 | H334-C336 PolarHBondContact O-N 2.94Å; C336-T338 PolarHBondContact O-N 3.01Å |
| 337 | S | 85 | Confident | 72.2 | Confident | 39 Ų | 39 | 88.8 Ų | 88.8 | 27% | 0.273 | 53% | 0.526 | S | S | . | . | P | Polyproline II helix | trans | -56.2 | 138.4 | 175 | -36.4 | 0 | 0 | 0 | 0 | 110.1 | L335 E341 K342 | L335-S337 PolarHBondContact O-N 3.31Å; S337-E341 WeakPolarHBondContact CA-OE2 3.48Å; S337-E341 WeakPolarHBondContact CB-OE2 3.42Å; S337-K342 WeakPolarHBondContact O-CE 3.42Å; S337-K342 PolarHBondContact O-NZ 3.47Å |
| 338 | T | 91 | Very high | 74.6 | Confident | 47 Ų | 47 | 90.4 Ų | 90.4 | 29% | 0.288 | 52% | 0.518 | S | S | . | . | P | Polyproline II helix | trans | -64.9 | 161.6 | 178.3 | 72.3 | 0 | 0 | 0 | 0 | 110.9 | E257 C336 A340 E341 K342 | E257-T338 WeakPolarHBondContact OE2-CB 3.45Å; E257-T338 PolarHBondContact OE2-OG1 3.42Å; C336-T338 PolarHBondContact O-N 3.01Å; T338-A340 VanDerWaalsContact C-N 3.3Å; T338-A340 PolarHBondContact O-N 3.45Å; T338-E341 PolarHBondContact N-OE2 2.72Å; T338-E341 PolarHBondContact O-N 3.37Å; T338-E341 WeakPolarHBondContact OG1-CB 3.33Å; T338-E341 WeakPolarHBondContact OG1-CG 3.38Å; T338-E341 PolarHBondContact OG1-N 2.88Å; T338-E341 VanDerWaalsContact OG1-N 3.12Å; T338-K342 WeakPolarHBondContact O-CG 3.34Å; T338-K342 PolarHBondContact O-N 3.39Å |
| 339 | P | 90.7 | Very high | 77.1 | Confident | 97 Ų | 97 | 91.6 Ų | 91.6 | 63% | 0.63 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -53.2 | -43.4 | 172.6 | -26.9 | 36 | 0 | 0 | 0 | 113.6 | E257 K342 M343 | E257-P339 WeakPolarHBondContact OE1-CD 3.33Å; P339-K342 PolarHBondContact O-N 2.99Å; P339-M343 PolarHBondContact O-N 2.84Å |
| 340 | A | 93.3 | Very high | 79.3 | Confident | 1 Ų | 1 | 89.4 Ų | 89.4 | 1% | 0.008 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -69 | -37.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | D253 L254 E257 T338 K342 M343 A344 | D253-A340 HydrophobicContact CB-CB 3.63Å; L254-A340 HydrophobicContact CD2-CB 3.86Å; L254-A340 HydrophobicContact CG-CB 4.02Å; E257-A340 HydrophobicContact CG-CB 4.11Å; E257-A340 WeakPolarHBondContact OE1-CB 3.15Å; E257-A340 PolarHBondContact OE1-N 2.97Å; E257-A340 WeakPolarHBondContact OE2-CB 3.42Å; T338-A340 VanDerWaalsContact C-N 3.3Å; T338-A340 PolarHBondContact O-N 3.45Å; A340-K342 VanDerWaalsContact C-N 3.35Å; A340-K342 PolarHBondContact O-N 2.73Å; A340-M343 PolarHBondContact O-N 3.34Å; A340-M343 VanDerWaalsContact O-N 3.16Å; A340-A344 WeakPolarHBondContact O-CB 3.49Å; A340-A344 PolarHBondContact O-N 3.1Å |
| 341 | E | 92.8 | Very high | 81.1 | Confident | 85 Ų | 85 | 89.6 Ų | 89.6 | 40% | 0.397 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.2 | -44.8 | 173.4 | -74.1 | 171.8 | 165.4 | 0 | 0 | 111.4 | L254 S337 T338 M343 A344 E345 | L254-E341 HydrophobicContact CD2-CB 4.49Å; L254-E341 HydrophobicContact CD2-CG 3.78Å; S337-E341 WeakPolarHBondContact CA-OE2 3.48Å; S337-E341 WeakPolarHBondContact CB-OE2 3.42Å; T338-E341 PolarHBondContact N-OE2 2.72Å; T338-E341 PolarHBondContact O-N 3.37Å; T338-E341 WeakPolarHBondContact OG1-CB 3.33Å; T338-E341 WeakPolarHBondContact OG1-CG 3.38Å; T338-E341 PolarHBondContact OG1-N 2.88Å; T338-E341 VanDerWaalsContact OG1-N 3.12Å; E341-M343 VanDerWaalsContact C-N 3.27Å; E341-M343 PolarHBondContact O-N 3.38Å; E341-A344 PolarHBondContact O-N 3.35Å; E341-E345 WeakPolarHBondContact O-CG 3.46Å; E341-E345 PolarHBondContact O-N 3.4Å |
| 342 | K | 93.1 | Very high | 82.7 | Confident | 100 Ų | 100 | 88.7 Ų | 88.7 | 44% | 0.435 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62 | -34.9 | 175.4 | -72.7 | 169.4 | 178.6 | 150.1 | 0 | 112.5 | S337 T338 P339 A340 K346 | S337-K342 WeakPolarHBondContact O-CE 3.42Å; S337-K342 PolarHBondContact O-NZ 3.47Å; T338-K342 WeakPolarHBondContact O-CG 3.34Å; T338-K342 PolarHBondContact O-N 3.39Å; P339-K342 PolarHBondContact O-N 2.99Å; A340-K342 VanDerWaalsContact C-N 3.35Å; A340-K342 PolarHBondContact O-N 2.73Å; K342-K346 VanDerWaalsContact O-CG 3.31Å; K342-K346 WeakPolarHBondContact O-CG 3.35Å; K342-K346 PolarHBondContact O-N 3.04Å |
| 343 | M | 92.1 | Very high | 83.6 | Confident | 80 Ų | 80 | 89 Ų | 89 | 39% | 0.394 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -70.2 | -45.6 | 175.8 | -167.6 | -174.8 | -56.4 | 0 | 0 | 111.2 | A250 D253 P339 A340 E341 E345 K346 V347 | A250-M343 HydrophobicContact CB-CG 4.22Å; A250-M343 HydrophobicContact CB-SD 4.32Å; D253-M343 WeakPolarHBondContact OD2-CE 3.35Å; D253-M343 VanDerWaalsContact OD2-SD 3.4Å; P339-M343 PolarHBondContact O-N 2.84Å; A340-M343 PolarHBondContact O-N 3.34Å; A340-M343 VanDerWaalsContact O-N 3.16Å; E341-M343 VanDerWaalsContact C-N 3.27Å; E341-M343 PolarHBondContact O-N 3.38Å; M343-E345 VanDerWaalsContact C-N 3.34Å; M343-E345 PolarHBondContact O-N 3.39Å; M343-K346 WeakPolarHBondContact O-CB 3.33Å; M343-K346 PolarHBondContact O-N 3.3Å; M343-K346 VanDerWaalsContact O-N 3.14Å; M343-V347 WeakPolarHBondContact O-CG2 3.43Å; M343-V347 PolarHBondContact O-N 3.45Å |
| 344 | A | 93.9 | Very high | 83.9 | Confident | 19 Ų | 19 | 88.4 Ų | 88.4 | 16% | 0.157 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -60 | -42.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | A250 L254 A340 E341 K346 V347 L348 | A250-A344 HydrophobicContact CB-CB 4.22Å; L254-A344 HydrophobicContact CD1-CB 3.75Å; L254-A344 HydrophobicContact CG-CB 4.43Å; A340-A344 WeakPolarHBondContact O-CB 3.49Å; A340-A344 PolarHBondContact O-N 3.1Å; E341-A344 PolarHBondContact O-N 3.35Å; A344-K346 VanDerWaalsContact C-N 3.34Å; A344-K346 PolarHBondContact O-N 3.48Å; A344-V347 PolarHBondContact O-N 3.3Å; A344-L348 WeakPolarHBondContact O-CB 3.47Å; A344-L348 WeakPolarHBondContact O-CG 3.47Å; A344-L348 PolarHBondContact O-N 3.11Å |
| 345 | E | 91.6 | Very high | 83.7 | Confident | 84 Ų | 84 | 84.3 Ų | 84.3 | 39% | 0.393 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -60 | -40.7 | 173.8 | -76.2 | 179.2 | -163 | 0 | 0 | 112.8 | E341 M343 L348 K349 | E341-E345 WeakPolarHBondContact O-CG 3.46Å; E341-E345 PolarHBondContact O-N 3.4Å; M343-E345 VanDerWaalsContact C-N 3.34Å; M343-E345 PolarHBondContact O-N 3.39Å; E345-L348 PolarHBondContact O-N 3.43Å; E345-K349 WeakPolarHBondContact O-CG 3.22Å; E345-K349 PolarHBondContact O-N 2.95Å; E345-K349 VanDerWaalsContact O-N 3.11Å |
| 346 | K | 91.6 | Very high | 82.5 | Confident | 145 Ų | 145 | 81.4 Ų | 81.4 | 63% | 0.63 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -64.4 | -44.7 | 175.9 | -74.8 | 172.3 | -176.8 | 177.6 | 0 | 111.1 | K342 M343 A344 L348 K349 V350 | K342-K346 VanDerWaalsContact O-CG 3.31Å; K342-K346 WeakPolarHBondContact O-CG 3.35Å; K342-K346 PolarHBondContact O-N 3.04Å; M343-K346 WeakPolarHBondContact O-CB 3.33Å; M343-K346 PolarHBondContact O-N 3.3Å; M343-K346 VanDerWaalsContact O-N 3.14Å; A344-K346 VanDerWaalsContact C-N 3.34Å; A344-K346 PolarHBondContact O-N 3.48Å; K346-L348 VanDerWaalsContact C-N 3.34Å; K346-L348 PolarHBondContact O-N 2.92Å; K346-K349 PolarHBondContact O-N 2.84Å; K346-V350 WeakPolarHBondContact O-CG2 3.35Å; K346-V350 PolarHBondContact O-N 3.22Å; K346-V350 VanDerWaalsContact O-N 3.1Å |
| 347 | V | 93.2 | Very high | 81.1 | Confident | 14 Ų | 14 | 81.5 Ų | 81.5 | 9% | 0.085 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -63.2 | -41.8 | 178.2 | 175.6 | 0 | 0 | 0 | 0 | 111.1 | E246 A247 A250 M343 A344 K349 V350 L351 | E246-V347 HydrophobicContact CB-CG2 4.15Å; A247-V347 HydrophobicContact CB-CG1 3.76Å; A250-V347 HydrophobicContact CB-CG2 4.17Å; M343-V347 WeakPolarHBondContact O-CG2 3.43Å; M343-V347 PolarHBondContact O-N 3.45Å; A344-V347 PolarHBondContact O-N 3.3Å; V347-K349 VanDerWaalsContact C-N 3.31Å; V347-K349 PolarHBondContact O-N 3.37Å; V347-V350 PolarHBondContact O-N 2.83Å; V347-V350 VanDerWaalsContact O-N 3.14Å; V347-L351 HydrophobicContact CG1-CD1 3.74Å; V347-L351 HydrophobicContact CG1-CG 4.2Å; V347-L351 WeakPolarHBondContact O-CG 3.45Å; V347-L351 PolarHBondContact O-N 3.37Å |
| 348 | L | 90.1 | Very high | 79.3 | Confident | 104 Ų | 104 | 87.3 Ų | 87.3 | 55% | 0.545 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -59.8 | -39.5 | 175.6 | -76.3 | 168.1 | 0 | 0 | 0 | 112.6 | A344 E345 K346 L351 N352 | A344-L348 WeakPolarHBondContact O-CB 3.47Å; A344-L348 WeakPolarHBondContact O-CG 3.47Å; A344-L348 PolarHBondContact O-N 3.11Å; E345-L348 PolarHBondContact O-N 3.43Å; K346-L348 VanDerWaalsContact C-N 3.34Å; K346-L348 PolarHBondContact O-N 2.92Å; L348-L351 PolarHBondContact O-N 2.88Å; L348-N352 PolarHBondContact O-N 3.26Å; L348-N352 VanDerWaalsContact O-N 3.09Å |
| 349 | K | 89.6 | Confident | 77 | Confident | 121 Ų | 121 | 92.5 Ų | 92.5 | 53% | 0.526 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.8 | -37.1 | 175.2 | -71.8 | 168.6 | -176.5 | 168.9 | 0 | 112.4 | E345 K346 V347 N352 | E345-K349 WeakPolarHBondContact O-CG 3.22Å; E345-K349 PolarHBondContact O-N 2.95Å; E345-K349 VanDerWaalsContact O-N 3.11Å; K346-K349 PolarHBondContact O-N 2.84Å; V347-K349 VanDerWaalsContact C-N 3.31Å; V347-K349 PolarHBondContact O-N 3.37Å; K349-N352 CarbonylContact O-C 3.25Å |
| 350 | V | 86.4 | Confident | 74.6 | Confident | 74 Ų | 74 | 97.9 Ų | 97.9 | 45% | 0.448 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -70.7 | -34.7 | 177 | 172.9 | 0 | 0 | 0 | 0 | 111.8 | Q243 K346 V347 | Q243-V350 HydrophobicContact CG-CG1 4.21Å; K346-V350 WeakPolarHBondContact O-CG2 3.35Å; K346-V350 PolarHBondContact O-N 3.22Å; K346-V350 VanDerWaalsContact O-N 3.1Å; V347-V350 PolarHBondContact O-N 2.83Å; V347-V350 VanDerWaalsContact O-N 3.14Å |
| 351 | L | 82.8 | Confident | 72.4 | Confident | 71 Ų | 71 | 102 Ų | 102 | 37% | 0.372 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -76.3 | -26.4 | 178.7 | -70.2 | 171.6 | 0 | 0 | 0 | 113.4 | Q243 A247 V347 L348 P353 | Q243-L351 HydrophobicContact CB-CD2 3.87Å; Q243-L351 HydrophobicContact CG-CD2 4.41Å; A247-L351 HydrophobicContact CB-CD1 4.45Å; V347-L351 HydrophobicContact CG1-CD1 3.74Å; V347-L351 HydrophobicContact CG1-CG 4.2Å; V347-L351 WeakPolarHBondContact O-CG 3.45Å; V347-L351 PolarHBondContact O-N 3.37Å; L348-L351 PolarHBondContact O-N 2.88Å; L351-P353 VanDerWaalsContact C-CD 3.45Å; L351-P353 VanDerWaalsContact O-CD 3.31Å; L351-P353 WeakPolarHBondContact O-CD 3.42Å |
| 352 | N | 78.9 | Confident | 69.8 | Low | 89 Ų | 89 | 106.2 Ų | 106.2 | 48% | 0.476 | 57% | 0.567 | S | S | . | * | trans | -118.8 | 72.4 | 178.9 | -75.4 | -43.2 | 0 | 0 | 0 | 112.5 | L348 K349 I354 S355 | L348-N352 PolarHBondContact O-N 3.26Å; L348-N352 VanDerWaalsContact O-N 3.09Å; K349-N352 CarbonylContact O-C 3.25Å; N352-I354 PolarHBondContact O-N 3.39Å; N352-I354 VanDerWaalsContact O-N 3.16Å; N352-S355 PolarHBondContact O-N 3.47Å | ||
| 353 | P | 63.4 | Low | 67.3 | Low | 101 Ų | 101 | 106.8 Ų | 106.8 | 66% | 0.656 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.2 | -19.7 | -178.6 | 24.5 | -32.6 | 0 | 0 | 0 | 114 | L351 | L351-P353 VanDerWaalsContact C-CD 3.45Å; L351-P353 VanDerWaalsContact O-CD 3.31Å; L351-P353 WeakPolarHBondContact O-CD 3.42Å |
| 354 | I | 58 | Low | 65.1 | Low | 157 Ų | 157 | 107.2 Ų | 107.2 | 81% | 0.805 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.9 | -21.1 | -175.2 | -56 | 170.3 | 0 | 0 | 0 | 111.9 | N352 | N352-I354 PolarHBondContact O-N 3.39Å; N352-I354 VanDerWaalsContact O-N 3.16Å |
| 355 | S | 51.1 | Low | 62.4 | Low | 86 Ų | 86 | 114.1 Ų | 114.1 | 60% | 0.601 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -90.8 | 0.2 | -173.6 | -47.6 | 0 | 0 | 0 | 0 | 114.2 | N352 S357 | N352-S355 PolarHBondContact O-N 3.47Å; S355-S357 VanDerWaalsContact C-N 3.33Å; S355-S357 PolarHBondContact O-N 3.39Å |
| 356 | C | 46 | Very low | 59.5 | Low | 90 Ų | 90 | 115.4 Ų | 115.4 | 61% | 0.608 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | 20.4 | -174.9 | -83 | 0 | 0 | 0 | 0 | 115.2 | ||
| 357 | S | 48.8 | Very low | 57 | Low | 107 Ų | 107 | 116.4 Ų | 116.4 | 75% | 0.748 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.7 | 4.7 | 178.5 | 84.7 | 0 | 0 | 0 | 0 | 116.1 | S355 | S355-S357 VanDerWaalsContact C-N 3.33Å; S355-S357 PolarHBondContact O-N 3.39Å |
| 358 | E | 46.4 | Very low | 54.1 | Low | 162 Ų | 162 | 121.1 Ų | 121.1 | 76% | 0.757 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -127.1 | 121 | 179.9 | -75.8 | -176.1 | 155.1 | 0 | 0 | 112.3 | ||
| 359 | N | 43.3 | Very low | 51.6 | Low | 156 Ų | 156 | 122.8 Ų | 122.8 | 83% | 0.834 | 71% | 0.709 | S | S | * | * | trans | 88.8 | 75.2 | 162.7 | -51.2 | -39.3 | 0 | 0 | 0 | 118.1 | ||||
| 360 | K | 40.8 | Very low | 49 | Very low | 210 Ų | 210 | 121 Ų | 121 | 91% | 0.913 | 71% | 0.713 | S | S | * | * | -150.6 | 106.6 | 126 | -141.3 | 178.2 | -177.1 | -178.9 | 0 | 110.4 | |||||
| 361 | A | 46.3 | Very low | 46.7 | Very low | 87 Ų | 87 | 122.7 Ų | 122.7 | 72% | 0.719 | 73% | 0.725 | S | S | * | * | trans | -78.8 | 149.6 | 168 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 362 | E | 37.5 | Very low | 44.4 | Very low | 173 Ų | 173 | 125.5 Ų | 125.5 | 81% | 0.808 | 74% | 0.74 | S | S | * | * | trans | 85.8 | 143.7 | 167.5 | -59.9 | -72.2 | 134.4 | 0 | 0 | 118.9 | ||||
| 363 | P | 42.3 | Very low | 42.6 | Very low | 112 Ų | 112 | 130.5 Ų | 130.5 | 73% | 0.727 | 76% | 0.758 | S | S | * | * | cis | -122 | 170.2 | -41.5 | 25.6 | -5.9 | 0 | 0 | 0 | 112.2 | ||||
| 364 | A | 44.2 | Very low | 41.8 | Very low | 89 Ų | 89 | 133.8 Ų | 133.8 | 74% | 0.736 | 77% | 0.77 | S | S | * | * | trans | -62.1 | 136.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 365 | L | 37.5 | Very low | 40.8 | Very low | 165 Ų | 165 | 131.1 Ų | 131.1 | 86% | 0.864 | 76% | 0.764 | S | S | * | * | 169.8 | 149.7 | 110.3 | -83.8 | 171.7 | 0 | 0 | 0 | 111.2 | |||||
| 366 | S | 30.8 | Very low | 40.2 | Very low | 110 Ų | 110 | 132.3 Ų | 132.3 | 77% | 0.769 | 77% | 0.773 | S | S | * | * | trans | 96 | 89.1 | 163.6 | -53.3 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 367 | D | 38.9 | Very low | 40 | Very low | 167 Ų | 167 | 137.8 Ų | 137.8 | 89% | 0.893 | 79% | 0.786 | S | S | * | * | trans | 24.7 | 102.6 | 138.1 | -75.4 | -26.5 | 0 | 0 | 0 | 118.3 | ||||
| 368 | S | 33.7 | Very low | 39.9 | Very low | 113 Ų | 113 | 141.4 Ų | 141.4 | 79% | 0.79 | 79% | 0.789 | S | S | * | * | trans | -162.2 | 110.7 | 131.9 | 44.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 369 | T | 36.6 | Very low | 39.6 | Very low | 138 Ų | 138 | 139.7 Ų | 139.7 | 85% | 0.847 | 79% | 0.794 | S | S | * | * | trans | 30.8 | 91.8 | 146.9 | -34.9 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 370 | S | 34.9 | Very low | 40 | Very low | 85 Ų | 85 | 139.1 Ų | 139.1 | 59% | 0.594 | 79% | 0.79 | S | S | * | * | trans | -62.5 | 137.8 | 157.2 | 44.4 | 0 | 0 | 0 | 0 | 110.4 | N372 | S370-N372 PolarHBondContact O-N 2.99Š| ||
| 371 | P | 38.8 | Very low | 40.3 | Very low | 109 Ų | 109 | 132 Ų | 132 | 71% | 0.708 | 78% | 0.776 | S | S | * | * | trans | -77.5 | 99.1 | 173.7 | 31.2 | -28.8 | 0 | 0 | 0 | 107.7 | F373 | P371-F373 VanDerWaalsContact C-N 3.3Å; P371-F373 PolarHBondContact O-N 3.09Å | ||
| 372 | N | 34.3 | Very low | 40.2 | Very low | 130 Ų | 130 | 139.1 Ų | 139.1 | 70% | 0.695 | 78% | 0.784 | S | S | * | * | trans | -59 | 92.5 | 164.9 | -79 | -39 | 0 | 0 | 0 | 109.3 | S370 L374 | S370-N372 PolarHBondContact O-N 2.99Å; N372-L374 PolarHBondContact O-N 3Å; N372-L374 VanDerWaalsContact O-N 3.11Å | ||
| 373 | F | 42 | Very low | 40.7 | Very low | 193 Ų | 193 | 137.7 Ų | 137.7 | 85% | 0.846 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | 23.9 | 178.1 | -130.9 | -87.2 | 0 | 0 | 0 | 113.6 | P371 | P371-F373 VanDerWaalsContact C-N 3.3Å; P371-F373 PolarHBondContact O-N 3.09Å |
| 374 | L | 45.1 | Very low | 41 | Very low | 171 Ų | 171 | 138.1 Ų | 138.1 | 90% | 0.895 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -143.3 | 42.6 | 171.6 | -67.2 | 176.2 | 0 | 0 | 0 | 110.6 | N372 S376 | N372-L374 PolarHBondContact O-N 3Å; N372-L374 VanDerWaalsContact O-N 3.11Å; L374-S376 PolarHBondContact O-N 3.34Å |
| 375 | S | 36.6 | Very low | 41.5 | Very low | 100 Ų | 100 | 139.2 Ų | 139.2 | 70% | 0.699 | 77% | 0.767 | S | S | * | * | trans | -71.6 | 120.4 | 163.8 | 61.7 | 0 | 0 | 0 | 0 | 109 | K377 | S375-K377 PolarHBondContact O-N 2.77Å; S375-K377 VanDerWaalsContact O-N 3.1Å | ||
| 376 | S | 39 | Very low | 42 | Very low | 112 Ų | 112 | 141 Ų | 141 | 78% | 0.783 | 76% | 0.764 | S | S | * | * | trans | -53.8 | 111.5 | -172.1 | 56.6 | 0 | 0 | 0 | 0 | 112.3 | L374 K378 | L374-S376 PolarHBondContact O-N 3.34Å; S376-K378 PolarHBondContact O-N 3.39Å | ||
| 377 | K | 41.7 | Very low | 43.1 | Very low | 204 Ų | 204 | 139.1 Ų | 139.1 | 89% | 0.887 | 75% | 0.748 | S | S | * | * | trans | -66 | 92.7 | 152.4 | -84.4 | -179.7 | 176.5 | 176.2 | 0 | 107.2 | S375 S379 | S375-K377 PolarHBondContact O-N 2.77Å; S375-K377 VanDerWaalsContact O-N 3.1Å; K377-S379 PolarHBondContact O-N 3.1Å | ||
| 378 | K | 47.3 | Very low | 43.6 | Very low | 184 Ų | 184 | 141.5 Ų | 141.5 | 80% | 0.8 | 75% | 0.745 | S | S | * | * | trans | 10 | 98 | 147.2 | -57.7 | 174.9 | -175.7 | -178.6 | 0 | 112.5 | S376 I380 | S376-K378 PolarHBondContact O-N 3.39Å; K378-I380 PolarHBondContact O-N 3.37Å | ||
| 379 | S | 40.2 | Very low | 44.7 | Very low | 125 Ų | 125 | 140.9 Ų | 140.9 | 87% | 0.874 | 73% | 0.725 | S | S | * | * | trans | -70.4 | 70.5 | 162.1 | 59.7 | 0 | 0 | 0 | 0 | 109 | K377 | K377-S379 PolarHBondContact O-N 3.1Š| ||
| 380 | I | 51.2 | Low | 45.3 | Very low | 144 Ų | 144 | 141.3 Ų | 141.3 | 74% | 0.738 | 72% | 0.718 | S | S | * | * | trans | -90.1 | 113.8 | 163 | -134.8 | 79.6 | 0 | 0 | 0 | 105.4 | K378 | K378-I380 PolarHBondContact O-N 3.37Š| ||
| 381 | G | 46.8 | Very low | 45.9 | Very low | 60 Ų | 60 | 144.8 Ų | 144.8 | 62% | 0.619 | 73% | 0.73 | S | S | * | * | trans | 135.5 | 47.3 | 177 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 382 | R | 45 | Very low | 46.7 | Very low | 237 Ų | 237 | 143.6 Ų | 143.6 | 89% | 0.894 | 72% | 0.717 | S | S | * | * | trans | -141.7 | 76.8 | 150.2 | -76.4 | -166.5 | -179.7 | -172.9 | -0.1 | 108 | ||||
| 383 | F | 48.3 | Very low | 47.4 | Very low | 143 Ų | 143 | 143 Ų | 143 | 63% | 0.627 | 72% | 0.718 | S | S | * | * | trans | -83.4 | 116.4 | 168 | -69.4 | -80.9 | 0 | 0 | 0 | 107.6 | Y389 | F383-Y389 AromaticContact CD1-CE2 3.73Å; F383-Y389 HydrophobicContact CD1-CE2 3.73Å; F383-Y389 AromaticContact CD1-CZ 3.67Å; F383-Y389 WeakPolarHBondContact CD1-OH 3.33Å; F383-Y389 HydrophobicContact CE1-CE2 4.26Å | ||
| 384 | H | 48.7 | Very low | 48.2 | Very low | 121 Ų | 121 | 139.5 Ų | 139.5 | 56% | 0.56 | 70% | 0.703 | S | S | * | * | trans | -96.7 | 137.1 | 174.5 | -168.7 | -81 | 0 | 0 | 0 | 107.9 | Y386 T387 | H384-Y386 AromaticContact CE1-CD2 3.91Å; H384-Y386 PolarHBondContact O-N 2.88Å; H384-T387 PolarHBondContact O-N 3.18Å; H384-T387 PolarHBondContact O-OG1 2.85Å | ||
| 385 | P | 53.2 | Low | 48.4 | Very low | 112 Ų | 112 | 139 Ų | 139 | 73% | 0.727 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.6 | -2.6 | -170.7 | -23.5 | 32.4 | 0 | 0 | 0 | 116.9 | ||
| 386 | Y | 48.5 | Very low | 49.4 | Very low | 202 Ų | 202 | 138.3 Ų | 138.3 | 79% | 0.792 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.5 | 6.5 | -172.8 | -61.3 | -71.3 | 0 | 0 | 0 | 113.8 | H384 R388 | H384-Y386 AromaticContact CE1-CD2 3.91Å; H384-Y386 PolarHBondContact O-N 2.88Å; Y386-R388 PolarHBondContact O-N 3.36Å |
| 387 | T | 53.6 | Low | 50.2 | Low | 71 Ų | 71 | 137 Ų | 137 | 44% | 0.436 | 69% | 0.685 | S | S | . | * | trans | -81.9 | 112.4 | 175.9 | -39.4 | 0 | 0 | 0 | 0 | 108.8 | H384 Y389 | H384-T387 PolarHBondContact O-N 3.18Å; H384-T387 PolarHBondContact O-OG1 2.85Å; T387-Y389 HydrophobicContact CG2-CD1 4.3Å; T387-Y389 HydrophobicContact CG2-CE1 3.88Å; T387-Y389 HydrophobicContact CG2-CE2 4.45Å; T387-Y389 WeakPolarHBondContact O-CD2 3.17Å; T387-Y389 WeakPolarHBondContact O-CE2 3.36Å; T387-Y389 PolarHBondContact O-N 2.91Å | ||
| 388 | R | 50.8 | Low | 50.7 | Low | 218 Ų | 218 | 137.1 Ų | 137.1 | 82% | 0.823 | 69% | 0.689 | S | S | * | * | trans | -72.7 | 107.4 | 169 | -65.1 | -168.5 | -159.7 | -179.5 | 5.4 | 108.2 | Y386 E390 | Y386-R388 PolarHBondContact O-N 3.36Å; R388-E390 VanDerWaalsContact C-N 3.32Å; R388-E390 PolarHBondContact O-N 2.8Å; R388-E390 VanDerWaalsContact O-N 3.16Å | ||
| 389 | Y | 56.4 | Low | 50.9 | Low | 99 Ų | 99 | 139.2 Ų | 139.2 | 39% | 0.388 | 69% | 0.692 | S | S | . | * | trans | -86.8 | 76.6 | 175.3 | -58.5 | -81.5 | 0 | 0 | 0 | 109.6 | F383 T387 N391 I392 | F383-Y389 AromaticContact CD1-CE2 3.73Å; F383-Y389 HydrophobicContact CD1-CE2 3.73Å; F383-Y389 AromaticContact CD1-CZ 3.67Å; F383-Y389 WeakPolarHBondContact CD1-OH 3.33Å; F383-Y389 HydrophobicContact CE1-CE2 4.26Å; T387-Y389 HydrophobicContact CG2-CD1 4.3Å; T387-Y389 HydrophobicContact CG2-CE1 3.88Å; T387-Y389 HydrophobicContact CG2-CE2 4.45Å; T387-Y389 WeakPolarHBondContact O-CD2 3.17Å; T387-Y389 WeakPolarHBondContact O-CE2 3.36Å; T387-Y389 PolarHBondContact O-N 2.91Å; Y389-N391 PolarHBondContact O-N 2.85Å; Y389-I392 VanDerWaalsContact CB-CD1 3.44Å; Y389-I392 HydrophobicContact CD2-CD1 4.36Å; Y389-I392 HydrophobicContact CG-CD1 3.94Å; Y389-I392 HydrophobicContact CG-CG1 4.36Å | ||
| 390 | E | 49.6 | Very low | 52.1 | Low | 147 Ų | 147 | 137 Ų | 137 | 69% | 0.687 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.9 | 120.1 | 165.2 | -69.4 | 173.3 | -167.6 | 0 | 0 | 106.8 | R388 | R388-E390 VanDerWaalsContact C-N 3.32Å; R388-E390 PolarHBondContact O-N 2.8Å; R388-E390 VanDerWaalsContact O-N 3.16Å |
| 391 | N | 47.2 | Very low | 52.7 | Low | 158 Ų | 158 | 137 Ų | 137 | 85% | 0.845 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 90.1 | 44 | -178.5 | -42.7 | -58.1 | 0 | 0 | 0 | 118.2 | Y389 T393 | Y389-N391 PolarHBondContact O-N 2.85Å; N391-T393 PolarHBondContact O-N 2.81Å |
| 392 | I | 56.3 | Low | 53.4 | Low | 84 Ų | 84 | 137.4 Ų | 137.4 | 43% | 0.431 | 69% | 0.687 | S | S | . | * | trans | -78.9 | 115.5 | 162 | -56.7 | 177.1 | 0 | 0 | 0 | 109.2 | Y389 F394 | Y389-I392 VanDerWaalsContact CB-CD1 3.44Å; Y389-I392 HydrophobicContact CD2-CD1 4.36Å; Y389-I392 HydrophobicContact CG-CD1 3.94Å; Y389-I392 HydrophobicContact CG-CG1 4.36Å; I392-F394 HydrophobicContact CB-CE2 4.14Å; I392-F394 HydrophobicContact CB-CZ 4.32Å; I392-F394 HydrophobicContact CG2-CD1 4.33Å; I392-F394 HydrophobicContact CG2-CD2 4.1Å; I392-F394 HydrophobicContact CG2-CE1 3.9Å; I392-F394 HydrophobicContact CG2-CE2 3.64Å; I392-F394 HydrophobicContact CG2-CG 4.43Å; I392-F394 HydrophobicContact CG2-CZ 3.53Å | ||
| 393 | T | 48.5 | Very low | 54 | Low | 118 Ų | 118 | 133.8 Ų | 133.8 | 72% | 0.724 | 69% | 0.685 | S | S | * | * | trans | -94.3 | 117.9 | 170.1 | 45.8 | 0 | 0 | 0 | 0 | 110.1 | N391 | N391-T393 PolarHBondContact O-N 2.81Š| ||
| 394 | F | 57.6 | Low | 54.5 | Low | 120 Ų | 120 | 132.1 Ų | 132.1 | 53% | 0.526 | 68% | 0.681 | S | S | . | * | trans | -91.4 | 113.9 | 174.9 | -63.4 | -84 | 0 | 0 | 0 | 109.4 | I392 C396 I404 | I392-F394 HydrophobicContact CB-CE2 4.14Å; I392-F394 HydrophobicContact CB-CZ 4.32Å; I392-F394 HydrophobicContact CG2-CD1 4.33Å; I392-F394 HydrophobicContact CG2-CD2 4.1Å; I392-F394 HydrophobicContact CG2-CE1 3.9Å; I392-F394 HydrophobicContact CG2-CE2 3.64Å; I392-F394 HydrophobicContact CG2-CG 4.43Å; I392-F394 HydrophobicContact CG2-CZ 3.53Å; F394-C396 PolarHBondContact O-N 2.77Å; F394-I404 HydrophobicContact CD2-CD1 4.32Å; F394-I404 HydrophobicContact CG-CD1 4.28Å | ||
| 395 | N | 49.6 | Very low | 54.6 | Low | 160 Ų | 160 | 133.3 Ų | 133.3 | 86% | 0.856 | 69% | 0.69 | S | S | * | * | trans | -85.9 | 97.5 | 171.8 | -70.1 | -53.9 | 0 | 0 | 0 | 108.9 | ||||
| 396 | C | 58 | Low | 54.5 | Low | 86 Ų | 86 | 133.7 Ų | 133.7 | 58% | 0.581 | 69% | 0.691 | S | S | * | * | trans | -95.3 | 145.9 | 174.4 | -67.9 | 0 | 0 | 0 | 0 | 110.7 | F394 C400 | F394-C396 PolarHBondContact O-N 2.77Å; C396-C400 HydrophobicContact CB-CB 4Å | ||
| 397 | C | 56.4 | Low | 54.2 | Low | 85 Ų | 85 | 135.1 Ų | 135.1 | 57% | 0.574 | 71% | 0.71 | S | S | * | * | trans | -83.4 | 166.2 | 170.5 | 77.4 | 0 | 0 | 0 | 0 | 111 | R399 C400 | C397-R399 PolarHBondContact O-N 3.39Å; C397-C400 PolarHBondContact O-N 2.86Å; C397-C400 VanDerWaalsContact O-N 3.12Å | ||
| 398 | E | 50.8 | Low | 54.2 | Low | 205 Ų | 205 | 138.3 Ų | 138.3 | 96% | 0.958 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.5 | -3.9 | -175.7 | -61.8 | -174.4 | 167.1 | 0 | 0 | 115.6 | ||
| 399 | R | 52.2 | Low | 54.4 | Low | 229 Ų | 229 | 134.1 Ų | 134.1 | 86% | 0.864 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.3 | 0.5 | -179.6 | -55.3 | -170 | -166.1 | -162.4 | 4.1 | 114.1 | C397 T401 | C397-R399 PolarHBondContact O-N 3.39Å; R399-T401 PolarHBondContact O-N 2.81Å |
| 400 | C | 66.3 | Low | 54.3 | Low | 79 Ų | 79 | 136.1 Ų | 136.1 | 53% | 0.534 | 74% | 0.737 | S | S | . | * | trans | -81.5 | 116 | 179.1 | -64.3 | 0 | 0 | 0 | 0 | 110.3 | C396 C397 | C396-C400 HydrophobicContact CB-CB 4Å; C397-C400 PolarHBondContact O-N 2.86Å; C397-C400 VanDerWaalsContact O-N 3.12Å | ||
| 401 | T | 62.3 | Low | 54.6 | Low | 142 Ų | 142 | 135.4 Ų | 135.4 | 87% | 0.871 | 74% | 0.74 | S | S | * | * | trans | -126.5 | 132.7 | 168.7 | 53.6 | 0 | 0 | 0 | 0 | 109.4 | R399 | R399-T401 PolarHBondContact O-N 2.81Š| ||
| 402 | G | 61.5 | Low | 55 | Low | 70 Ų | 70 | 134 Ų | 134 | 72% | 0.722 | 73% | 0.734 | S | S | * | * | S | Bend | trans | 145.6 | 157.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 403 | D | 57.6 | Low | 55 | Low | 161 Ų | 161 | 137.3 Ų | 137.3 | 86% | 0.861 | 75% | 0.754 | S | S | * | * | trans | -80.5 | 135.4 | 179.8 | -63.8 | -30.9 | 0 | 0 | 0 | 111.2 | ||||
| 404 | I | 59 | Low | 55.4 | Low | 107 Ų | 107 | 138.7 Ų | 138.7 | 55% | 0.549 | 76% | 0.756 | S | S | . | * | trans | -88.5 | 109.4 | 173.8 | -57.5 | 175.3 | 0 | 0 | 0 | 107.8 | F394 V406 | F394-I404 HydrophobicContact CD2-CD1 4.32Å; F394-I404 HydrophobicContact CG-CD1 4.28Å; I404-V406 HydrophobicContact CG2-CG2 4.3Å | ||
| 405 | I | 50.8 | Low | 55.3 | Low | 146 Ų | 146 | 140.2 Ų | 140.2 | 75% | 0.749 | 77% | 0.774 | S | S | * | * | trans | -94.8 | 117.8 | 174.9 | -55.8 | 173.1 | 0 | 0 | 0 | 108.1 | ||||
| 406 | V | 52.3 | Low | 55.7 | Low | 121 Ų | 121 | 138.5 Ų | 138.5 | 73% | 0.733 | 77% | 0.767 | S | S | * | * | trans | -99.6 | 121.2 | 172.2 | -174.4 | 0 | 0 | 0 | 0 | 107.2 | I404 | I404-V406 HydrophobicContact CG2-CG2 4.3Š| ||
| 407 | L | 41.7 | Very low | 55.5 | Low | 231 Ų | 231 | 143.3 Ų | 143.3 | 100% | 1.209 | 78% | 0.784 | S | S | * | * | trans | -91.3 | 0 | 174.8 | -77.5 | 169.3 | 0 | 0 | 0 | 111.2 |
Retrieved 407 of 407 residues in 89.2 ms
(Link to these results)