| 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 | 40.5 | Very low | 49.6 | Very low | 186 Ų | 186 | 116 Ų | 116 | 92% | 0.916 | 66% | 0.658 | S | S | * | * | 0 | 146.1 | 0 | -64.2 | 167.6 | 74.8 | 0 | 0 | 108.8 | E5 | M1-E5 VanDerWaalsContact C-OE2 3.25Å; M1-E5 WeakPolarHBondContact CA-OE2 3.49Å; M1-E5 HydrophobicContact CB-CB 4.43Å; M1-E5 VanDerWaalsContact CB-OE2 3.3Å; M1-E5 WeakPolarHBondContact CB-OE2 3.42Å; M1-E5 HydrophobicContact CE-CB 4.28Å | |||
| 2 | S | 49.5 | Very low | 49 | Very low | 53 Ų | 53 | 116.1 Ų | 116.1 | 37% | 0.371 | 66% | 0.655 | S | S | . | * | trans | -85.8 | 165.2 | 172.5 | 79.4 | 0 | 0 | 0 | 0 | 111.4 | E4 E5 | S2-E4 PolarHBondContact O-N 3.08Å; S2-E4 PolarHBondContact OG-N 3.26Å; S2-E5 PolarHBondContact N-OE2 3.38Å; S2-E5 PolarHBondContact O-N 2.67Å; S2-E5 PolarHBondContact OG-N 3.31Å | ||
| 3 | A | 45.4 | Very low | 47.9 | Very low | 87 Ų | 87 | 117.5 Ų | 117.5 | 72% | 0.719 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -61.9 | -25.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | A7 | A3-A7 PolarHBondContact O-N 2.76Å |
| 4 | E | 58 | Low | 47.2 | Very low | 130 Ų | 130 | 119.5 Ų | 119.5 | 61% | 0.607 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -75 | -24.9 | 176.6 | -65 | -179.2 | 88.9 | 0 | 0 | 113.4 | S2 R8 | S2-E4 PolarHBondContact O-N 3.08Å; S2-E4 PolarHBondContact OG-N 3.26Å; E4-R8 WeakPolarHBondContact O-CG 3.4Å |
| 5 | E | 57.8 | Low | 46.4 | Very low | 99 Ų | 99 | 115.7 Ų | 115.7 | 46% | 0.463 | 67% | 0.674 | S | S | . | * | H | α-helix | trans | -72.2 | -40.1 | 173.3 | -70.3 | 176 | 113.1 | 0 | 0 | 110.8 | M1 S2 A7 R8 V9 | M1-E5 VanDerWaalsContact C-OE2 3.25Å; M1-E5 WeakPolarHBondContact CA-OE2 3.49Å; M1-E5 HydrophobicContact CB-CB 4.43Å; M1-E5 VanDerWaalsContact CB-OE2 3.3Å; M1-E5 WeakPolarHBondContact CB-OE2 3.42Å; M1-E5 HydrophobicContact CE-CB 4.28Å; S2-E5 PolarHBondContact N-OE2 3.38Å; S2-E5 PolarHBondContact O-N 2.67Å; S2-E5 PolarHBondContact OG-N 3.31Å; E5-A7 VanDerWaalsContact C-N 3.31Å; E5-A7 PolarHBondContact O-N 2.99Å; E5-R8 PolarHBondContact O-N 3.34Å; E5-V9 WeakPolarHBondContact O-CG2 3.35Å |
| 6 | V | 48.7 | Very low | 45.4 | Very low | 97 Ų | 97 | 116.7 Ų | 116.7 | 59% | 0.588 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -62 | -40.2 | 175.9 | -177.6 | 0 | 0 | 0 | 0 | 111.1 | R8 | V6-R8 PolarHBondContact O-N 3.13Å |
| 7 | A | 60.1 | Low | 44.6 | Very low | 83 Ų | 83 | 119.3 Ų | 119.3 | 69% | 0.686 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.3 | -11.8 | -177.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | A3 E5 | A3-A7 PolarHBondContact O-N 2.76Å; E5-A7 VanDerWaalsContact C-N 3.31Å; E5-A7 PolarHBondContact O-N 2.99Å |
| 8 | R | 56.3 | Low | 44 | Very low | 200 Ų | 200 | 118.6 Ų | 118.6 | 76% | 0.755 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.4 | -10.4 | -175.3 | -69.2 | -178.7 | -168.6 | -141.3 | 3.8 | 115.1 | E4 E5 V6 | E4-R8 WeakPolarHBondContact O-CG 3.4Å; E5-R8 PolarHBondContact O-N 3.34Å; V6-R8 PolarHBondContact O-N 3.13Å |
| 9 | V | 48.7 | Very low | 43.5 | Very low | 111 Ų | 111 | 119.4 Ų | 119.4 | 67% | 0.673 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.6 | -21.8 | -168.2 | 178.5 | 0 | 0 | 0 | 0 | 113.4 | E5 | E5-V9 WeakPolarHBondContact O-CG2 3.35Š|
| 10 | T | 43.7 | Very low | 43.1 | Very low | 105 Ų | 105 | 119.4 Ų | 119.4 | 64% | 0.644 | 70% | 0.702 | S | S | * | * | trans | -142.9 | 106.4 | -176.9 | 53.2 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 11 | P | 37 | Very low | 43.1 | Very low | 125 Ų | 125 | 121.1 Ų | 121.1 | 81% | 0.812 | 71% | 0.707 | S | S | * | * | trans | -120.6 | 41.2 | 166.2 | 40.5 | -29.6 | 0 | 0 | 0 | 112.9 | ||||
| 12 | D | 42.3 | Very low | 43 | Very low | 117 Ų | 117 | 117.2 Ų | 117.2 | 63% | 0.626 | 70% | 0.695 | S | S | * | * | trans | -151.3 | 56.2 | 174.2 | -147.1 | 11 | 0 | 0 | 0 | 113.6 | I130 | D12-I130 HydrophobicContact CB-CD1 4.31Å; D12-I130 WeakPolarHBondContact OD2-CD1 3.37Å | ||
| 13 | L | 35.3 | Very low | 42.4 | Very low | 135 Ų | 135 | 120.3 Ų | 120.3 | 71% | 0.707 | 71% | 0.714 | S | S | * | * | trans | -144.8 | 30.9 | 173.8 | -121.5 | 170.9 | 0 | 0 | 0 | 113.9 | ||||
| 14 | T | 38.1 | Very low | 41.9 | Very low | 145 Ų | 145 | 122.6 Ų | 122.6 | 89% | 0.89 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -127.3 | 78.7 | 170.9 | 46.3 | 0 | 0 | 0 | 0 | 109.4 | ||
| 15 | G | 34.8 | Very low | 40.9 | Very low | 63 Ų | 63 | 120 Ų | 120 | 65% | 0.649 | 73% | 0.729 | S | S | * | * | trans | -173.9 | -23.3 | -177 | 0 | 0 | 0 | 0 | 0 | 114.5 | L17 | G15-L17 VanDerWaalsContact C-N 3.3Å; G15-L17 PolarHBondContact O-N 2.87Å | ||
| 16 | L | 30.8 | Very low | 39.7 | Very low | 131 Ų | 131 | 125.2 Ų | 125.2 | 69% | 0.686 | 75% | 0.751 | S | S | * | * | trans | -81.4 | 69.6 | 170.8 | -73.3 | 178.1 | 0 | 0 | 0 | 112.1 | N127 | L16-N127 WeakPolarHBondContact CD1-ND2 3.37Š| ||
| 17 | L | 30.9 | Very low | 39 | Very low | 161 Ų | 161 | 125.6 Ų | 125.6 | 84% | 0.843 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -169.7 | 125.2 | 155.1 | -106.5 | 167.5 | 0 | 0 | 0 | 108.8 | G15 | G15-L17 VanDerWaalsContact C-N 3.3Å; G15-L17 PolarHBondContact O-N 2.87Å |
| 18 | S | 34.2 | Very low | 37.8 | Very low | 107 Ų | 107 | 128.1 Ų | 128.1 | 75% | 0.748 | 76% | 0.764 | S | S | * | * | S | Bend | trans | 63.3 | 131.4 | -162.3 | 81.2 | 0 | 0 | 0 | 0 | 112.9 | ||
| 19 | T | 34.8 | Very low | 36.8 | Very low | 133 Ų | 133 | 125.1 Ų | 125.1 | 82% | 0.816 | 77% | 0.768 | S | S | * | * | cis | -136.5 | 99.9 | 16.9 | 41.3 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 20 | S | 35.3 | Very low | 36.2 | Very low | 120 Ų | 120 | 123.6 Ų | 123.6 | 84% | 0.839 | 78% | 0.775 | S | S | * | * | trans | -91.9 | 111.6 | 164.3 | 41.9 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 21 | I | 42.4 | Very low | 35.6 | Very low | 156 Ų | 156 | 123.8 Ų | 123.8 | 80% | 0.8 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 123.8 | 174.3 | -62.3 | 171.4 | 0 | 0 | 0 | 108.3 | ||
| 22 | P | 39.8 | Very low | 35.5 | Very low | 104 Ų | 104 | 124 Ų | 124 | 68% | 0.675 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 145 | 176.9 | 29.6 | -34.3 | 0 | 0 | 0 | 111.1 | ||
| 23 | P | 36.1 | Very low | 35.2 | Very low | 118 Ų | 118 | 124.8 Ų | 124.8 | 77% | 0.766 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 152.3 | 175.3 | 27.9 | -34.4 | 0 | 0 | 0 | 111.6 | ||
| 24 | P | 34.7 | Very low | 35 | Very low | 135 Ų | 135 | 123.8 Ų | 123.8 | 88% | 0.877 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -70.6 | 136 | -175.3 | 29.2 | -35.3 | 0 | 0 | 0 | 112.1 | ||
| 25 | G | 36.6 | Very low | 34.9 | Very low | 75 Ų | 75 | 125.2 Ų | 125.2 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | trans | 164.7 | -37.2 | 167.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 26 | F | 33.7 | Very low | 34.9 | Very low | 209 Ų | 209 | 125.3 Ų | 125.3 | 92% | 0.917 | 80% | 0.796 | S | S | * | * | trans | -110.6 | 130.9 | -173 | -90.2 | -96.2 | 0 | 0 | 0 | 113.8 | ||||
| 27 | S | 33.8 | Very low | 35.1 | Very low | 105 Ų | 105 | 126.7 Ų | 126.7 | 73% | 0.734 | 80% | 0.803 | S | S | * | * | trans | -119.3 | 122.9 | 170.6 | 178.2 | 0 | 0 | 0 | 0 | 109 | ||||
| 28 | V | 35 | Very low | 35 | Very low | 135 Ų | 135 | 126.4 Ų | 126.4 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | trans | -131.3 | 122.6 | 168.1 | -179.9 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 29 | V | 35.5 | Very low | 35 | Very low | 138 Ų | 138 | 127.6 Ų | 127.6 | 84% | 0.836 | 81% | 0.805 | S | S | * | * | trans | -95.6 | 126.7 | -177.4 | 178.6 | 0 | 0 | 0 | 0 | 109 | ||||
| 30 | G | 35.8 | Very low | 34.9 | Very low | 79 Ų | 79 | 128 Ų | 128 | 81% | 0.814 | 80% | 0.801 | S | S | * | * | trans | -172.4 | 89.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 31 | S | 30.3 | Very low | 34.7 | Very low | 109 Ų | 109 | 128.5 Ų | 128.5 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | trans | -86.8 | 142.6 | 175.8 | 58 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 32 | T | 35.2 | Very low | 34.5 | Very low | 129 Ų | 129 | 127.1 Ų | 127.1 | 79% | 0.791 | 80% | 0.798 | S | S | * | * | trans | -168.6 | 142 | 136 | 18.9 | 0 | 0 | 0 | 0 | 115 | ||||
| 33 | T | 35 | Very low | 34.4 | Very low | 134 Ų | 134 | 128.1 Ų | 128.1 | 82% | 0.822 | 80% | 0.804 | S | S | * | * | trans | 53.6 | 129.5 | 148.2 | 54.4 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 34 | S | 32.4 | Very low | 34.1 | Very low | 113 Ų | 113 | 125.5 Ų | 125.5 | 79% | 0.79 | 80% | 0.799 | S | S | * | * | trans | -116.7 | 139.1 | 161.6 | 52.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 35 | L | 35.7 | Very low | 34.4 | Very low | 175 Ų | 175 | 124.9 Ų | 124.9 | 92% | 0.916 | 80% | 0.795 | S | S | * | * | trans | -114.3 | 158.8 | 150.7 | -86.7 | 75.6 | 0 | 0 | 0 | 106.4 | ||||
| 36 | G | 35.4 | Very low | 34.4 | Very low | 66 Ų | 66 | 126 Ų | 126 | 68% | 0.68 | 79% | 0.79 | S | S | * | * | cis | 145.8 | 102.4 | 2 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 37 | D | 33.4 | Very low | 34.5 | Very low | 159 Ų | 159 | 121 Ų | 121 | 85% | 0.85 | 78% | 0.781 | S | S | * | * | trans | 11.7 | 123.6 | 172.8 | -56.6 | -37.6 | 0 | 0 | 0 | 120.5 | ||||
| 38 | L | 30 | Very low | 34.5 | Very low | 155 Ų | 155 | 124.2 Ų | 124.2 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | trans | -149.3 | 78.7 | 154.5 | -129.5 | 164.8 | 0 | 0 | 0 | 112.1 | I40 | L38-I40 HydrophobicContact CD2-CD1 4.25Å; L38-I40 HydrophobicContact CD2-CG1 3.87Å | ||
| 39 | T | 34.1 | Very low | 34.4 | Very low | 132 Ų | 132 | 124.6 Ų | 124.6 | 81% | 0.81 | 79% | 0.786 | S | S | * | * | trans | -82.2 | 124.1 | 166.1 | 29.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 40 | I | 33.4 | Very low | 34.2 | Very low | 142 Ų | 142 | 123.4 Ų | 123.4 | 73% | 0.728 | 78% | 0.783 | S | S | * | * | trans | -103.8 | 112.5 | 170.7 | -61.8 | -179.4 | 0 | 0 | 0 | 108.9 | L38 T42 | L38-I40 HydrophobicContact CD2-CD1 4.25Å; L38-I40 HydrophobicContact CD2-CG1 3.87Å; I40-T42 HydrophobicContact CG2-CG2 4.46Å | ||
| 41 | T | 30.5 | Very low | 34 | Very low | 130 Ų | 130 | 129.3 Ų | 129.3 | 80% | 0.798 | 79% | 0.786 | S | S | * | * | trans | -110.1 | 140.2 | 165.5 | 47.2 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 42 | T | 37.9 | Very low | 34.1 | Very low | 127 Ų | 127 | 129.1 Ų | 129.1 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | trans | -132.9 | 138.3 | 171.8 | 48.3 | 0 | 0 | 0 | 0 | 110.1 | I40 | I40-T42 HydrophobicContact CG2-CG2 4.46Š| ||
| 43 | P | 38.3 | Very low | 33.8 | Very low | 126 Ų | 126 | 130.1 Ų | 130.1 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | -100.2 | 168.1 | -162.1 | 40.3 | -38.3 | 0 | 0 | 0 | 114.2 | ||||
| 44 | G | 29.6 | Very low | 33.5 | Very low | 63 Ų | 63 | 128.2 Ų | 128.2 | 65% | 0.649 | 78% | 0.777 | S | S | * | * | trans | -70.6 | 173.4 | 154.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 45 | P | 41.4 | Very low | 33.3 | Very low | 122 Ų | 122 | 131.3 Ų | 131.3 | 79% | 0.792 | 78% | 0.782 | S | S | * | * | -151.7 | 179.9 | 67.6 | 38.3 | -17.7 | 0 | 0 | 0 | 117.1 | |||||
| 46 | S | 36.9 | Very low | 33.1 | Very low | 97 Ų | 97 | 126.7 Ų | 126.7 | 68% | 0.678 | 78% | 0.777 | S | S | * | * | trans | 51.2 | 105.3 | 144.5 | 62.9 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 47 | S | 34.1 | Very low | 32.8 | Very low | 104 Ų | 104 | 134.5 Ų | 134.5 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | 40.3 | 127.5 | 126.5 | 64.3 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 48 | I | 33.6 | Very low | 32.8 | Very low | 174 Ų | 174 | 132.3 Ų | 132.3 | 89% | 0.892 | 78% | 0.782 | S | S | * | * | -165.6 | 165.4 | 107.9 | -98.9 | 158.4 | 0 | 0 | 0 | 109.9 | |||||
| 49 | N | 33.2 | Very low | 33.2 | Very low | 142 Ų | 142 | 130 Ų | 130 | 76% | 0.759 | 78% | 0.777 | S | S | * | * | trans | -103.2 | 175.2 | -167.7 | -168.2 | 11.7 | 0 | 0 | 0 | 113.1 | ||||
| 50 | C | 32.3 | Very low | 33.3 | Very low | 113 Ų | 113 | 132.8 Ų | 132.8 | 76% | 0.764 | 78% | 0.78 | S | S | * | * | trans | 97.6 | 136.3 | 159.6 | -63.2 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 51 | K | 31.5 | Very low | 33.1 | Very low | 204 Ų | 204 | 136.4 Ų | 136.4 | 89% | 0.887 | 79% | 0.785 | S | S | * | * | trans | -85.1 | 156.4 | -177.7 | -53.9 | 165.8 | -180 | 175.7 | 0 | 110.7 | ||||
| 52 | S | 31.4 | Very low | 33.5 | Very low | 105 Ų | 105 | 135.7 Ų | 135.7 | 73% | 0.734 | 78% | 0.782 | S | S | * | * | 143.8 | 155.4 | 111.2 | -153.9 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 53 | L | 29.8 | Very low | 33.2 | Very low | 149 Ų | 149 | 133.3 Ų | 133.3 | 78% | 0.78 | 78% | 0.776 | S | S | * | * | trans | 68.2 | 93 | 159 | -70.8 | 155.1 | 0 | 0 | 0 | 120.5 | ||||
| 54 | S | 28.3 | Very low | 33 | Very low | 95 Ų | 95 | 132.5 Ų | 132.5 | 66% | 0.664 | 78% | 0.78 | S | S | * | * | 63.3 | 129.6 | 105.9 | -61.4 | 0 | 0 | 0 | 0 | 123.7 | |||||
| 55 | I | 27.6 | Very low | 33.3 | Very low | 177 Ų | 177 | 136.2 Ų | 136.2 | 91% | 0.908 | 78% | 0.784 | S | S | * | * | trans | 77.9 | 117.9 | 148.2 | -59.6 | 155.5 | 0 | 0 | 0 | 117.4 | ||||
| 56 | G | 32.5 | Very low | 33.3 | Very low | 79 Ų | 79 | 135.8 Ų | 135.8 | 81% | 0.814 | 78% | 0.781 | S | S | * | * | trans | 170.7 | 94.5 | 169.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 57 | Y | 29.8 | Very low | 33.1 | Very low | 229 Ų | 229 | 136.3 Ų | 136.3 | 90% | 0.898 | 78% | 0.776 | S | S | * | * | trans | -87.8 | 169.5 | 166.3 | -95.9 | -72.5 | 0 | 0 | 0 | 110.3 | ||||
| 58 | P | 33.3 | Very low | 32.9 | Very low | 113 Ų | 113 | 139.1 Ų | 139.1 | 73% | 0.734 | 78% | 0.782 | S | S | * | * | cis | -130.9 | -128.4 | -12 | 42.2 | -20.1 | 0 | 0 | 0 | 111.9 | ||||
| 59 | P | 38.3 | Very low | 32.9 | Very low | 107 Ų | 107 | 137.1 Ų | 137.1 | 70% | 0.695 | 77% | 0.773 | S | S | * | * | trans | -122.9 | -175 | -148.9 | 34.6 | -9.3 | 0 | 0 | 0 | 115.7 | ||||
| 60 | H | 35.6 | Very low | 32.8 | Very low | 190 Ų | 190 | 136.4 Ų | 136.4 | 88% | 0.88 | 77% | 0.769 | S | S | * | * | trans | -167.2 | 151.5 | 139.2 | -109.8 | -77.2 | 0 | 0 | 0 | 113.3 | ||||
| 61 | W | 29.7 | Very low | 32.7 | Very low | 219 Ų | 219 | 136.4 Ų | 136.4 | 83% | 0.83 | 77% | 0.77 | S | S | * | * | trans | -92.5 | 179.7 | 175.7 | -99.6 | 52.1 | 0 | 0 | 0 | 111 | A63 | W61-A63 HydrophobicContact CE3-CB 4.49Å; W61-A63 HydrophobicContact CZ3-CB 4.44Å | ||
| 62 | P | 37.5 | Very low | 32.7 | Very low | 114 Ų | 114 | 132.3 Ų | 132.3 | 74% | 0.74 | 76% | 0.762 | S | S | * | * | cis | -146.7 | 164.3 | 26.2 | 43 | -22.6 | 0 | 0 | 0 | 121 | ||||
| 63 | A | 32.7 | Very low | 32.6 | Very low | 78 Ų | 78 | 135.2 Ų | 135.2 | 65% | 0.645 | 76% | 0.761 | S | S | * | * | trans | 18.1 | 136.8 | 141.7 | 0 | 0 | 0 | 0 | 0 | 124.2 | W61 | W61-A63 HydrophobicContact CE3-CB 4.49Å; W61-A63 HydrophobicContact CZ3-CB 4.44Å | ||
| 64 | A | 34.2 | Very low | 32.6 | Very low | 109 Ų | 109 | 134.8 Ų | 134.8 | 90% | 0.901 | 76% | 0.755 | S | S | * | * | trans | -152.8 | 93.1 | 135.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 65 | L | 35.9 | Very low | 32.6 | Very low | 141 Ų | 141 | 137 Ų | 137 | 74% | 0.738 | 76% | 0.76 | S | S | * | * | trans | -97.6 | 155.4 | 167 | -97.8 | 167.8 | 0 | 0 | 0 | 108.5 | ||||
| 66 | P | 40.2 | Very low | 32.7 | Very low | 112 Ų | 112 | 132.4 Ų | 132.4 | 73% | 0.727 | 76% | 0.756 | S | S | * | * | -149.4 | 179.2 | 77.8 | 39.3 | -20.4 | 0 | 0 | 0 | 115.1 | |||||
| 67 | D | 33.3 | Very low | 32.6 | Very low | 109 Ų | 109 | 133.2 Ų | 133.2 | 58% | 0.583 | 76% | 0.755 | S | S | * | * | cis | -164 | 150.3 | -36.7 | -92.8 | -32.4 | 0 | 0 | 0 | 107.9 | ||||
| 68 | L | 30.9 | Very low | 32.5 | Very low | 162 Ų | 162 | 127 Ų | 127 | 85% | 0.848 | 75% | 0.745 | S | S | * | * | -174.3 | 115.3 | 124.9 | -100.7 | 163.4 | 0 | 0 | 0 | 109.9 | |||||
| 69 | N | 32.6 | Very low | 32.3 | Very low | 133 Ų | 133 | 130.7 Ų | 130.7 | 71% | 0.711 | 75% | 0.753 | S | S | * | * | trans | -12.7 | 127.9 | 179.3 | -68.6 | -37.9 | 0 | 0 | 0 | 118.4 | ||||
| 70 | L | 30.8 | Very low | 31.8 | Very low | 126 Ų | 126 | 133 Ų | 133 | 66% | 0.66 | 76% | 0.759 | S | S | * | * | cis | 59.3 | 110.9 | 48.8 | -68.5 | 82.8 | 0 | 0 | 0 | 115.6 | ||||
| 71 | S | 30.7 | Very low | 31.8 | Very low | 114 Ų | 114 | 128.9 Ų | 128.9 | 80% | 0.797 | 75% | 0.749 | S | S | * | * | -156 | 125.2 | 110.1 | -13.8 | 0 | 0 | 0 | 0 | 107.1 | |||||
| 72 | V | 30.6 | Very low | 31.9 | Very low | 117 Ų | 117 | 125.7 Ų | 125.7 | 71% | 0.709 | 75% | 0.748 | S | S | * | * | 69.8 | 133.9 | 65.9 | 166.5 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 73 | F | 29.8 | Very low | 31.5 | Very low | 166 Ų | 166 | 124.5 Ų | 124.5 | 73% | 0.728 | 75% | 0.748 | S | S | * | * | cis | -177.9 | 150.3 | -31.6 | -132.8 | -84.2 | 0 | 0 | 0 | 105.5 | ||||
| 74 | Q | 29.9 | Very low | 31.3 | Very low | 140 Ų | 140 | 128.8 Ų | 128.8 | 65% | 0.654 | 76% | 0.759 | S | S | * | * | trans | 43.6 | 142.6 | 155.1 | -91.2 | 175.6 | -88.4 | 0 | 0 | 124.2 | ||||
| 75 | D | 29.3 | Very low | 31.1 | Very low | 142 Ų | 142 | 128.4 Ų | 128.4 | 76% | 0.759 | 75% | 0.748 | S | S | * | * | trans | 57.5 | 127.7 | 140.9 | -52.7 | -20.8 | 0 | 0 | 0 | 121.3 | ||||
| 76 | G | 29.6 | Very low | 30.8 | Very low | 81 Ų | 81 | 128.8 Ų | 128.8 | 84% | 0.835 | 75% | 0.75 | S | S | * | * | trans | 162.2 | 129.7 | 165.2 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 77 | A | 29.8 | Very low | 30.4 | Very low | 95 Ų | 95 | 128.4 Ų | 128.4 | 79% | 0.785 | 75% | 0.746 | S | S | * | * | trans | -88.7 | 136.7 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 78 | S | 27.1 | Very low | 30.6 | Very low | 99 Ų | 99 | 129.6 Ų | 129.6 | 69% | 0.692 | 75% | 0.753 | S | S | * | * | trans | 24.5 | 111 | 147.5 | 60.3 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 79 | Q | 30 | Very low | 30.9 | Very low | 191 Ų | 191 | 128.2 Ų | 128.2 | 89% | 0.893 | 75% | 0.746 | S | S | * | * | -172.2 | 164.1 | 126.5 | -103.4 | 151.8 | 107.9 | 0 | 0 | 113.2 | |||||
| 80 | L | 28.4 | Very low | 31 | Very low | 156 Ų | 156 | 124.6 Ų | 124.6 | 82% | 0.817 | 73% | 0.727 | S | S | * | * | trans | -93.2 | -174.7 | 175 | -67.2 | 87.9 | 0 | 0 | 0 | 110.4 | ||||
| 81 | P | 34.2 | Very low | 31.2 | Very low | 103 Ų | 103 | 121.5 Ų | 121.5 | 67% | 0.669 | 72% | 0.719 | S | S | * | * | cis | -132 | 173.9 | -9.9 | 18.6 | 7.5 | 0 | 0 | 0 | 116.2 | ||||
| 82 | D | 32 | Very low | 31.2 | Very low | 152 Ų | 152 | 122.6 Ų | 122.6 | 81% | 0.813 | 72% | 0.715 | S | S | * | * | trans | 21.3 | 133 | 141.6 | -42.4 | -30.6 | 0 | 0 | 0 | 122.5 | ||||
| 83 | A | 28.8 | Very low | 31.3 | Very low | 89 Ų | 89 | 122.5 Ų | 122.5 | 74% | 0.736 | 71% | 0.711 | S | S | * | * | 163.4 | 160.6 | 101.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 84 | L | 29.9 | Very low | 31.3 | Very low | 167 Ų | 167 | 121.1 Ų | 121.1 | 87% | 0.874 | 71% | 0.709 | S | S | * | * | trans | 72.9 | 145.9 | 164.9 | -54.9 | 174.4 | 0 | 0 | 0 | 118.9 | ||||
| 85 | C | 28.6 | Very low | 31.2 | Very low | 101 Ų | 101 | 118.8 Ų | 118.8 | 68% | 0.682 | 72% | 0.715 | S | S | * | * | cis | -171.1 | 172.8 | -27.8 | -157.4 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 86 | L | 31.3 | Very low | 31.2 | Very low | 149 Ų | 149 | 116.3 Ų | 116.3 | 78% | 0.78 | 71% | 0.714 | S | S | * | * | trans | 72.9 | 150.9 | 167.8 | -46.4 | -179.8 | 0 | 0 | 0 | 116.8 | ||||
| 87 | T | 31.4 | Very low | 31.2 | Very low | 104 Ų | 104 | 119.6 Ų | 119.6 | 64% | 0.638 | 71% | 0.712 | S | S | * | * | cis | -179.2 | 150.5 | -18.6 | 34.2 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 88 | D | 37.5 | Very low | 31 | Very low | 135 Ų | 135 | 120.7 Ų | 120.7 | 72% | 0.722 | 71% | 0.712 | S | S | * | * | cis | -148.5 | -149.5 | -14.9 | -77.2 | -33.4 | 0 | 0 | 0 | 105.9 | ||||
| 89 | D | 36.1 | Very low | 31.1 | Very low | 132 Ų | 132 | 120 Ų | 120 | 71% | 0.706 | 71% | 0.713 | S | S | * | * | cis | -162.1 | -173.8 | 14.5 | -166.1 | -1.3 | 0 | 0 | 0 | 109.5 | P913 | D89-P913 WeakPolarHBondContact O-CG 3.5Š| ||
| 90 | D | 36.4 | Very low | 31.1 | Very low | 58 Ų | 58 | 118.5 Ų | 118.5 | 31% | 0.31 | 71% | 0.711 | S | S | . | * | trans | -119.1 | 179.8 | -153.4 | -83.5 | -21.1 | 0 | 0 | 0 | 119.8 | P913 G914 M915 | D90-P913 VanDerWaalsContact C-CD 3.48Å; D90-G914 WeakPolarHBondContact CB-O 3.4Å; D90-G914 VanDerWaalsContact CG-O 3.27Å; D90-G914 WeakPolarHBondContact OD1-CA 3.49Å; D90-G914 PolarHBondContact OD1-N 3.18Å; D90-M915 VanDerWaalsContact CG-N 3.28Å; D90-M915 VanDerWaalsContact OD1-CB 3.3Å; D90-M915 WeakPolarHBondContact OD1-CB 3.16Å; D90-M915 WeakPolarHBondContact OD1-CG 3.12Å; D90-M915 PolarHBondContact OD1-N 3.4Å; D90-M915 VanDerWaalsContact OD1-N 3.15Å; D90-M915 VanDerWaalsContact OD2-CB 3.27Å; D90-M915 WeakPolarHBondContact OD2-CB 3.47Å; D90-M915 PolarHBondContact OD2-N 2.92Å; D90-M915 VanDerWaalsContact OD2-N 3.09Å | ||
| 91 | A | 33.4 | Very low | 31.2 | Very low | 61 Ų | 61 | 115.8 Ų | 115.8 | 50% | 0.504 | 71% | 0.705 | S | S | . | * | trans | 129.2 | 119.6 | 148.1 | 0 | 0 | 0 | 0 | 0 | 119.2 | P912 P913 | A91-P912 WeakPolarHBondContact O-CA 3.41Å; A91-P913 CarbonylContact C-O 3.07Å; A91-P913 PolarHBondContact N-O 2.98Å | ||
| 92 | L | 32.2 | Very low | 31 | Very low | 136 Ų | 136 | 117.3 Ų | 117.3 | 71% | 0.712 | 71% | 0.713 | S | S | * | * | trans | -73.3 | 174.6 | 177.2 | -97.4 | 51.5 | 0 | 0 | 0 | 115.6 | P913 | L92-P913 WeakPolarHBondContact CD1-O 3.43Å; L92-P913 PolarHBondContact N-O 3.35Å | ||
| 93 | D | 32.4 | Very low | 30.8 | Very low | 116 Ų | 116 | 113.3 Ų | 113.3 | 62% | 0.62 | 71% | 0.708 | S | S | * | * | cis | 171.5 | -178.9 | -36.9 | -168.9 | 13.9 | 0 | 0 | 0 | 109 | ||||
| 94 | I | 29.1 | Very low | 30.9 | Very low | 136 Ų | 136 | 115.5 Ų | 115.5 | 70% | 0.697 | 71% | 0.711 | S | S | * | * | trans | 82.5 | 107.4 | 154.3 | -71.7 | 164 | 0 | 0 | 0 | 120.4 | ||||
| 95 | A | 28.7 | Very low | 30.6 | Very low | 92 Ų | 92 | 113.3 Ų | 113.3 | 76% | 0.76 | 71% | 0.708 | S | S | * | * | 59.1 | 129.8 | 128.9 | 0 | 0 | 0 | 0 | 0 | 126 | |||||
| 96 | A | 29.2 | Very low | 30.7 | Very low | 90 Ų | 90 | 117.2 Ų | 117.2 | 74% | 0.744 | 72% | 0.722 | S | S | * | * | 93.2 | 147.5 | 129.5 | 0 | 0 | 0 | 0 | 0 | 123 | |||||
| 97 | N | 28.5 | Very low | 30.5 | Very low | 150 Ų | 150 | 115.3 Ų | 115.3 | 80% | 0.802 | 71% | 0.712 | S | S | * | * | trans | 80.6 | 101.4 | 161.6 | -68.2 | -16.9 | 0 | 0 | 0 | 122.1 | ||||
| 98 | C | 26.2 | Very low | 30.5 | Very low | 117 Ų | 117 | 119.6 Ų | 119.6 | 79% | 0.791 | 73% | 0.728 | S | S | * | * | 66.9 | 111.5 | 122.5 | -64.2 | 0 | 0 | 0 | 0 | 122.9 | |||||
| 99 | A | 29.8 | Very low | 30.1 | Very low | 85 Ų | 85 | 120 Ų | 120 | 70% | 0.702 | 73% | 0.725 | S | S | * | * | 82.2 | 126.2 | 125.9 | 0 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 100 | N | 30 | Very low | 30 | Very low | 160 Ų | 160 | 120.6 Ų | 120.6 | 86% | 0.856 | 73% | 0.734 | S | S | * | * | trans | 50.6 | 126.7 | 148.4 | -54.8 | -7.7 | 0 | 0 | 0 | 118.2 | ||||
| 101 | S | 29.9 | Very low | 29.6 | Very low | 98 Ų | 98 | 126.4 Ų | 126.4 | 69% | 0.685 | 76% | 0.756 | S | S | * | * | -177.8 | 148.2 | 61 | -169.5 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 102 | T | 29.4 | Very low | 29.6 | Very low | 136 Ų | 136 | 132.4 Ų | 132.4 | 83% | 0.834 | 77% | 0.774 | S | S | * | * | trans | 40.4 | 130.2 | 146.6 | 53 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 103 | G | 28.3 | Very low | 29.5 | Very low | 68 Ų | 68 | 132.3 Ų | 132.3 | 70% | 0.701 | 77% | 0.774 | S | S | * | * | trans | 161.7 | 116.4 | 132.8 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 104 | V | 30.4 | Very low | 29.4 | Very low | 134 Ų | 134 | 134.1 Ų | 134.1 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | trans | 53.8 | 95.5 | 147.2 | -170.3 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 105 | C | 24.3 | Very low | 29.4 | Very low | 121 Ų | 121 | 134.7 Ų | 134.7 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | 58.1 | 107.7 | 67.9 | -56.5 | 0 | 0 | 0 | 0 | 115.9 | |||||
| 106 | L | 31 | Very low | 29.3 | Very low | 183 Ų | 183 | 138.1 Ų | 138.1 | 96% | 0.958 | 79% | 0.792 | S | S | * | * | trans | -134.6 | 145.5 | 145.6 | -112.2 | 165.8 | 0 | 0 | 0 | 108.2 | ||||
| 107 | D | 26.2 | Very low | 29.1 | Very low | 109 Ų | 109 | 140.1 Ų | 140.1 | 58% | 0.583 | 80% | 0.799 | S | S | * | * | trans | -131.6 | 140.7 | -156.5 | 175.2 | 28.1 | 0 | 0 | 0 | 110.9 | Q109 | D107-Q109 WeakPolarHBondContact OD1-CG 3.46Å; D107-Q109 PolarHBondContact OD2-NE2 3.19Å | ||
| 108 | M | 32.2 | Very low | 29.1 | Very low | 195 Ų | 195 | 138.2 Ų | 138.2 | 96% | 0.961 | 80% | 0.798 | S | S | * | * | trans | -159 | 148.2 | 153.8 | -116.2 | 178.9 | -175.4 | 0 | 0 | 112.2 | ||||
| 109 | Q | 28.2 | Very low | 29.4 | Very low | 143 Ų | 143 | 137.7 Ų | 137.7 | 67% | 0.668 | 80% | 0.795 | S | S | * | * | trans | -133.5 | 129.9 | -152.8 | -52.6 | 167.9 | 10.7 | 0 | 0 | 113.2 | D107 | D107-Q109 WeakPolarHBondContact OD1-CG 3.46Å; D107-Q109 PolarHBondContact OD2-NE2 3.19Å | ||
| 110 | T | 33.2 | Very low | 29.4 | Very low | 145 Ų | 145 | 140.7 Ų | 140.7 | 89% | 0.89 | 80% | 0.799 | S | S | * | * | trans | -173.9 | 115.3 | 152.4 | 41 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 111 | K | 29.7 | Very low | 29.4 | Very low | 179 Ų | 179 | 140.7 Ų | 140.7 | 78% | 0.778 | 80% | 0.799 | S | S | * | * | cis | 82.5 | 76.4 | 15.1 | -157.2 | -172.2 | 177.5 | -179.6 | 0 | 117.6 | ||||
| 112 | E | 32.9 | Very low | 29.5 | Very low | 187 Ų | 187 | 141.6 Ų | 141.6 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | trans | -158.5 | 110.3 | 135.9 | -105.3 | 163.5 | -161.3 | 0 | 0 | 105.9 | ||||
| 113 | N | 29.9 | Very low | 29.5 | Very low | 134 Ų | 134 | 143.8 Ų | 143.8 | 72% | 0.717 | 80% | 0.803 | S | S | * | * | 62.4 | 95.6 | 79.2 | -82.7 | 15.3 | 0 | 0 | 0 | 114.7 | |||||
| 114 | I | 30.9 | Very low | 29.5 | Very low | 155 Ų | 155 | 149.1 Ų | 149.1 | 80% | 0.795 | 81% | 0.809 | S | S | * | * | -179.2 | 112.6 | 108.5 | -86.8 | 152.8 | 0 | 0 | 0 | 109.2 | |||||
| 115 | D | 28.2 | Very low | 29.4 | Very low | 147 Ų | 147 | 152.5 Ų | 152.5 | 79% | 0.786 | 81% | 0.813 | S | S | * | * | trans | 46.8 | 156.7 | 150.6 | -51.1 | -30.7 | 0 | 0 | 0 | 123.6 | ||||
| 116 | D | 26.5 | Very low | 29.8 | Very low | 164 Ų | 164 | 155.6 Ų | 155.6 | 88% | 0.877 | 82% | 0.815 | S | S | * | * | trans | 56.1 | 67.4 | 175.7 | -71.1 | -9 | 0 | 0 | 0 | 118.5 | ||||
| 117 | C | 26.5 | Very low | 29.6 | Very low | 133 Ų | 133 | 152.2 Ų | 152.2 | 90% | 0.899 | 80% | 0.798 | S | S | * | * | trans | -147.6 | 133.7 | 155.5 | -92.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 118 | S | 28 | Very low | 29.7 | Very low | 110 Ų | 110 | 155.4 Ų | 155.4 | 77% | 0.769 | 81% | 0.814 | S | S | * | * | trans | -146.9 | 114.4 | 158.1 | 58.3 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 119 | S | 31.3 | Very low | 29.6 | Very low | 105 Ų | 105 | 151.4 Ų | 151.4 | 73% | 0.734 | 81% | 0.805 | S | S | * | * | trans | 42.3 | 100.2 | 159.3 | 55.4 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 120 | D | 30.3 | Very low | 29.7 | Very low | 148 Ų | 148 | 151 Ų | 151 | 79% | 0.791 | 81% | 0.807 | S | S | * | * | 53.8 | 146.3 | 56 | -75 | -48.5 | 0 | 0 | 0 | 116.8 | |||||
| 121 | L | 30.4 | Very low | 29.6 | Very low | 161 Ų | 161 | 151.8 Ų | 151.8 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | trans | 76.1 | 130.9 | 175.1 | -92.6 | 65.7 | 0 | 0 | 0 | 117.7 | ||||
| 122 | P | 32.1 | Very low | 29.6 | Very low | 116 Ų | 116 | 144.6 Ų | 144.6 | 75% | 0.753 | 78% | 0.78 | S | S | * | * | -129.6 | 170.2 | -70 | 35 | -23.3 | 0 | 0 | 0 | 114.4 | |||||
| 123 | H | 29.3 | Very low | 29.3 | Very low | 183 Ų | 183 | 139.9 Ų | 139.9 | 85% | 0.847 | 77% | 0.768 | S | S | * | * | trans | -70.6 | 127.4 | 177.1 | -71.3 | -123.5 | 0 | 0 | 0 | 113.2 | ||||
| 124 | H | 27.9 | Very low | 29.4 | Very low | 180 Ų | 180 | 136 Ų | 136 | 83% | 0.833 | 75% | 0.751 | S | S | * | * | trans | -169.8 | 90.6 | 136.5 | -110.1 | 71.7 | 0 | 0 | 0 | 110.1 | ||||
| 125 | F | 29 | Very low | 29.4 | Very low | 204 Ų | 204 | 140.4 Ų | 140.4 | 90% | 0.895 | 76% | 0.757 | S | S | * | * | trans | 175.9 | 78.2 | 156.4 | -91.8 | -55.7 | 0 | 0 | 0 | 109.7 | ||||
| 126 | H | 31.4 | Very low | 29.4 | Very low | 186 Ų | 186 | 137.1 Ų | 137.1 | 86% | 0.861 | 75% | 0.751 | S | S | * | * | trans | -148.3 | 88.5 | 171.5 | -110.9 | 50.6 | 0 | 0 | 0 | 109.5 | ||||
| 127 | N | 28.5 | Very low | 29.7 | Very low | 112 Ų | 112 | 132.6 Ų | 132.6 | 60% | 0.599 | 73% | 0.727 | S | S | * | * | S | Bend | trans | 176.1 | 35.2 | 155.4 | -94 | 1.3 | 0 | 0 | 0 | 112.6 | L16 | L16-N127 WeakPolarHBondContact CD1-ND2 3.37Š|
| 128 | L | 27.9 | Very low | 30 | Very low | 177 Ų | 177 | 135.4 Ų | 135.4 | 93% | 0.927 | 73% | 0.727 | S | S | * | * | trans | -140 | 89.2 | 169.4 | -78.1 | 179 | 0 | 0 | 0 | 109.5 | ||||
| 129 | S | 28.9 | Very low | 30 | Very low | 111 Ų | 111 | 137.6 Ų | 137.6 | 78% | 0.776 | 73% | 0.728 | S | S | * | * | trans | -138.3 | 24.3 | 174.4 | -169.8 | 0 | 0 | 0 | 0 | 113.3 | I131 | S129-I131 PolarHBondContact O-N 2.82Š| ||
| 130 | I | 30.5 | Very low | 29.9 | Very low | 135 Ų | 135 | 137.3 Ų | 137.3 | 69% | 0.692 | 71% | 0.711 | S | S | * | * | trans | -95.8 | 75.3 | 169.1 | -59.7 | 172.9 | 0 | 0 | 0 | 108.7 | D12 | D12-I130 HydrophobicContact CB-CD1 4.31Å; D12-I130 WeakPolarHBondContact OD2-CD1 3.37Å | ||
| 131 | I | 30.9 | Very low | 29.8 | Very low | 160 Ų | 160 | 134 Ų | 134 | 82% | 0.821 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -172.4 | 125.1 | 153.4 | -95.9 | 151.3 | 0 | 0 | 0 | 105 | S129 | S129-I131 PolarHBondContact O-N 2.82Š|
| 132 | G | 30.1 | Very low | 29.6 | Very low | 28 Ų | 28 | 132.9 Ų | 132.9 | 29% | 0.289 | 70% | 0.704 | S | S | . | * | trans | -70 | 156.8 | -165.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | S134 | G132-S134 PolarHBondContact O-N 2.98Š| ||
| 133 | S | 26.9 | Very low | 29.3 | Very low | 89 Ų | 89 | 129 Ų | 129 | 62% | 0.622 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -72.7 | 24.8 | -169.5 | -63.7 | 0 | 0 | 0 | 0 | 116.3 | R135 | S133-R135 PolarHBondContact O-N 2.94Å; S133-R135 VanDerWaalsContact O-N 3.09Å |
| 134 | S | 32.6 | Very low | 29.1 | Very low | 51 Ų | 51 | 122.1 Ų | 122.1 | 36% | 0.357 | 66% | 0.659 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64.6 | -14.6 | -177.3 | -46.7 | 0 | 0 | 0 | 0 | 114.6 | G132 E1248 H1249 | G132-S134 PolarHBondContact O-N 2.98Å; S134-E1248 VanDerWaalsContact CA-OE1 3.32Å; S134-E1248 WeakPolarHBondContact CA-OE1 3.2Å; S134-E1248 VanDerWaalsContact CB-OE2 3.22Å; S134-E1248 WeakPolarHBondContact CB-OE2 3.3Å; S134-E1248 PolarHBondContact OG-OE2 3.1Å; S134-H1249 PolarHBondContact OG-CE1 3.38Å; S134-H1249 PolarHBondContact OG-NE2 3.47Å; S134-H1249 VanDerWaalsContact OG-NE2 3.15Å |
| 135 | R | 30.1 | Very low | 29.1 | Very low | 248 Ų | 248 | 120.5 Ų | 120.5 | 94% | 0.936 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.1 | 6.2 | -171.5 | -136.8 | 171.5 | -174.2 | 173.2 | 1.5 | 115.2 | S133 | S133-R135 PolarHBondContact O-N 2.94Å; S133-R135 VanDerWaalsContact O-N 3.09Å |
| 136 | A | 29.5 | Very low | 29 | Very low | 78 Ų | 78 | 121.4 Ų | 121.4 | 65% | 0.645 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -106.8 | 15.1 | -169.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 137 | N | 32.3 | Very low | 28.9 | Very low | 69 Ų | 69 | 123.7 Ų | 123.7 | 37% | 0.369 | 65% | 0.651 | S | S | . | * | trans | -130.8 | 14.5 | -177.7 | -96.1 | -62.6 | 0 | 0 | 0 | 116.5 | R1338 | N137-R1338 PolarHBondContact OD1-NE 3.29Å; N137-R1338 PolarHBondContact OD1-NH2 3.23Å | ||
| 138 | Q | 32.4 | Very low | 28.9 | Very low | 192 Ų | 192 | 125.7 Ų | 125.7 | 90% | 0.897 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -97.4 | 68.1 | 161.9 | -74.5 | -170.8 | -10 | 0 | 0 | 110.9 | ||
| 139 | I | 28.9 | Very low | 28.9 | Very low | 157 Ų | 157 | 121.7 Ų | 121.7 | 81% | 0.805 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -174 | 66.1 | 154.1 | -94.5 | 147.6 | 0 | 0 | 0 | 109.4 | ||
| 140 | W | 28.1 | Very low | 28.6 | Very low | 99 Ų | 99 | 121.4 Ų | 121.4 | 38% | 0.375 | 64% | 0.64 | S | S | . | * | trans | -152.2 | 33.8 | 157.9 | -122.2 | 96.8 | 0 | 0 | 0 | 115 | K1374 K1377 | W140-K1374 HydrophobicContact CE3-CD 3.93Å; W140-K1374 HydrophobicContact CH2-CD 3.36Å; W140-K1374 HydrophobicContact CZ2-CD 4.15Å; W140-K1374 HydrophobicContact CZ3-CD 3.26Å; W140-K1377 HydrophobicContact CH2-CD 3.59Å; W140-K1377 VanDerWaalsContact CH2-CE 3.49Å; W140-K1377 HydrophobicContact CZ2-CD 3.62Å | ||
| 141 | A | 28.9 | Very low | 28.6 | Very low | 79 Ų | 79 | 120.7 Ų | 120.7 | 65% | 0.653 | 64% | 0.642 | S | S | * | * | trans | -119.7 | 49.4 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y1334 | A141-Y1334 HydrophobicContact CB-CE1 4.38Š| ||
| 142 | V | 26.1 | Very low | 28.4 | Very low | 137 Ų | 137 | 118.4 Ų | 118.4 | 83% | 0.83 | 64% | 0.638 | S | S | * | * | trans | -128.1 | 103.4 | 172 | -177.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 143 | G | 24.5 | Very low | 28.1 | Very low | 35 Ų | 35 | 119.8 Ų | 119.8 | 36% | 0.361 | 65% | 0.653 | S | S | . | * | trans | 173.1 | 96 | -180 | 0 | 0 | 0 | 0 | 0 | 114.6 | H1370 | G143-H1370 PolarHBondContact O-ND1 3.35Š| ||
| 144 | A | 26.5 | Very low | 28 | Very low | 37 Ų | 37 | 120.3 Ų | 120.3 | 31% | 0.306 | 66% | 0.656 | S | S | . | * | trans | 68.4 | 119.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | K1369 H1370 | A144-K1369 HydrophobicContact CB-CD 4.43Å; A144-K1369 WeakPolarHBondContact O-CE 2.89Å; A144-H1370 PolarHBondContact O-CE1 3.32Å | ||
| 145 | E | 28.1 | Very low | 27.6 | Very low | 147 Ų | 147 | 123.2 Ų | 123.2 | 69% | 0.687 | 67% | 0.667 | S | S | * | * | cis | -63.6 | 148.3 | -0.7 | -76.4 | 71.6 | -124.4 | 0 | 0 | 112.7 | K1369 | E145-K1369 VanDerWaalsContact CD-NZ 3.32Å; E145-K1369 IonicContact OE1-NZ 2.68Å; E145-K1369 PolarHBondContact OE1-NZ 3.48Å; E145-K1369 IonicContact OE2-NZ 3.77Å; E145-K1369 PolarHBondContact OE2-NZ 2.78Å | ||
| 146 | R | 25.8 | Very low | 27.3 | Very low | 223 Ų | 223 | 113.9 Ų | 113.9 | 84% | 0.842 | 64% | 0.638 | S | S | * | * | cis | 59.9 | 64.7 | 10.3 | -77.5 | -154.5 | -171.3 | -161.7 | 8.2 | 116.5 | ||||
| 147 | R | 30.1 | Very low | 27.1 | Very low | 233 Ų | 233 | 114 Ų | 114 | 88% | 0.879 | 64% | 0.64 | S | S | * | * | -172.9 | 144.7 | 124.9 | -95.2 | 149.2 | -161.8 | -104.3 | 5 | 108.6 | |||||
| 148 | I | 28.9 | Very low | 26.8 | Very low | 155 Ų | 155 | 113.3 Ų | 113.3 | 80% | 0.795 | 65% | 0.648 | S | S | * | * | trans | 57.9 | 88.1 | 177.4 | -51.7 | 175.8 | 0 | 0 | 0 | 112.1 | ||||
| 149 | S | 26.6 | Very low | 26.5 | Very low | 93 Ų | 93 | 106.7 Ų | 106.7 | 65% | 0.65 | 63% | 0.632 | S | S | * | * | cis | 53.6 | 124.7 | 27.9 | -177.6 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 150 | T | 23.7 | Very low | 26.4 | Very low | 104 Ų | 104 | 103.3 Ų | 103.3 | 64% | 0.638 | 62% | 0.622 | S | S | * | * | trans | 61.5 | 122.4 | 163.7 | 46.6 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 151 | T | 30 | Very low | 26.3 | Very low | 120 Ų | 120 | 102.9 Ų | 102.9 | 74% | 0.736 | 63% | 0.627 | S | S | * | * | 48 | 142.7 | 72.8 | 72.4 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 152 | P | 27.5 | Very low | 26.2 | Very low | 113 Ų | 113 | 102.5 Ų | 102.5 | 73% | 0.734 | 62% | 0.619 | S | S | * | * | cis | -117.6 | -163.1 | 19.9 | 27 | -1.2 | 0 | 0 | 0 | 109.7 | ||||
| 153 | G | 23.5 | Very low | 26.2 | Very low | 57 Ų | 57 | 99 Ų | 99 | 59% | 0.588 | 60% | 0.601 | S | S | * | * | cis | 67.5 | 108 | 36.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 154 | S | 24.5 | Very low | 26.4 | Very low | 99 Ų | 99 | 100.8 Ų | 100.8 | 69% | 0.692 | 61% | 0.607 | S | S | * | * | trans | 58.8 | 166.9 | 178.7 | 84.4 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 155 | D | 23.6 | Very low | 26.7 | Very low | 112 Ų | 112 | 102.6 Ų | 102.6 | 60% | 0.599 | 63% | 0.629 | S | S | * | * | cis | -146.5 | 147.1 | 15.3 | -116.6 | -48 | 0 | 0 | 0 | 113.5 | ||||
| 156 | T | 24.1 | Very low | 26.9 | Very low | 53 Ų | 53 | 102.8 Ų | 102.8 | 33% | 0.325 | 63% | 0.634 | S | S | . | * | trans | 69 | 152.1 | 148.1 | 62.4 | 0 | 0 | 0 | 0 | 120.1 | T745 A746 | T156-T745 VanDerWaalsContact OG1-CA 3.3Å; T156-T745 WeakPolarHBondContact OG1-CA 3.31Å; T156-A746 WeakPolarHBondContact OG1-CA 3.32Å; T156-A746 PolarHBondContact OG1-N 3.02Å | ||
| 157 | A | 25.7 | Very low | 27 | Very low | 81 Ų | 81 | 99.3 Ų | 99.3 | 67% | 0.669 | 63% | 0.632 | S | S | * | * | S | Bend | cis | -120 | 152.5 | 3.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 158 | G | 26 | Very low | 26.9 | Very low | 53 Ų | 53 | 92.9 Ų | 92.9 | 55% | 0.546 | 62% | 0.623 | S | S | . | * | cis | 168.6 | 139.2 | -3.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 159 | G | 25.2 | Very low | 27 | Very low | 54 Ų | 54 | 90.2 Ų | 90.2 | 56% | 0.557 | 62% | 0.617 | S | S | * | * | trans | 75.9 | 148.8 | -171.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 160 | S | 26.1 | Very low | 26.9 | Very low | 85 Ų | 85 | 94 Ų | 94 | 59% | 0.594 | 62% | 0.622 | S | S | * | * | cis | -143.9 | 128.6 | -11.3 | -98 | 0 | 0 | 0 | 0 | 108.9 | G749 | S160-G749 PolarHBondContact OG-O 2.96Š| ||
| 161 | N | 25.9 | Very low | 27.1 | Very low | 91 Ų | 91 | 92 Ų | 92 | 49% | 0.487 | 62% | 0.622 | S | S | . | * | 67.2 | 135.1 | 80 | -65.3 | -64.1 | 0 | 0 | 0 | 111.1 | G749 G750 | N161-G749 PolarHBondContact ND2-O 3.41Å; N161-G750 WeakPolarHBondContact CB-O 3.36Å; N161-G750 PolarHBondContact ND2-N 3.49Å | |||
| 162 | C | 27.1 | Very low | 27 | Very low | 71 Ų | 71 | 92 Ų | 92 | 48% | 0.48 | 62% | 0.617 | S | S | . | * | cis | -163.6 | -176.7 | 12.2 | -134.8 | 0 | 0 | 0 | 0 | 113.8 | G750 | C162-G750 WeakPolarHBondContact CB-O 3.41Š| ||
| 163 | S | 26.6 | Very low | 27 | Very low | 64 Ų | 64 | 91.4 Ų | 91.4 | 45% | 0.448 | 62% | 0.615 | S | S | . | * | trans | 44.6 | 132 | 142 | -53.1 | 0 | 0 | 0 | 0 | 119 | S751 | S163-S751 PolarHBondContact OG-OG 3.39Š| ||
| 164 | S | 29.7 | Very low | 27.2 | Very low | 71 Ų | 71 | 94.4 Ų | 94.4 | 50% | 0.497 | 61% | 0.614 | S | S | . | * | cis | -155.8 | 117.7 | 44.6 | -57.4 | 0 | 0 | 0 | 0 | 114 | ||||
| 165 | G | 31.5 | Very low | 27.3 | Very low | 75 Ų | 75 | 96.2 Ų | 96.2 | 77% | 0.773 | 63% | 0.625 | S | S | * | * | trans | 65.2 | -163.1 | 134.2 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 166 | L | 32.2 | Very low | 27.5 | Very low | 152 Ų | 152 | 94.4 Ų | 94.4 | 80% | 0.796 | 62% | 0.621 | S | S | * | * | cis | -129.5 | 118.9 | -12.2 | -89 | 171.3 | 0 | 0 | 0 | 105.9 | ||||
| 167 | L | 27.8 | Very low | 27.6 | Very low | 150 Ų | 150 | 98.7 Ų | 98.7 | 79% | 0.785 | 65% | 0.647 | S | S | * | * | 100.1 | 155.3 | 88.3 | -168.6 | 83.4 | 0 | 0 | 0 | 109 | |||||
| 168 | S | 28.2 | Very low | 27.7 | Very low | 98 Ų | 98 | 97.9 Ų | 97.9 | 69% | 0.685 | 65% | 0.647 | S | S | * | * | trans | 64.3 | 120.4 | 153.3 | 172.6 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 169 | C | 31.1 | Very low | 27.8 | Very low | 99 Ų | 99 | 101 Ų | 101 | 67% | 0.669 | 66% | 0.66 | S | S | * | * | cis | -151 | 153.8 | -2.8 | -104.9 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 170 | F | 25.8 | Very low | 27.9 | Very low | 173 Ų | 173 | 101.6 Ų | 101.6 | 76% | 0.759 | 67% | 0.666 | S | S | * | * | 41.2 | 121.9 | 81.4 | -68.6 | -103.5 | 0 | 0 | 0 | 111.4 | |||||
| 171 | G | 27.5 | Very low | 27.9 | Very low | 62 Ų | 62 | 104.6 Ų | 104.6 | 64% | 0.639 | 68% | 0.675 | S | S | * | * | cis | 78.4 | 165.7 | 39.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 172 | D | 27 | Very low | 28.1 | Very low | 118 Ų | 118 | 109.2 Ų | 109.2 | 63% | 0.631 | 69% | 0.692 | S | S | * | * | trans | 62.8 | 166.4 | -168.8 | -46.3 | -45 | 0 | 0 | 0 | 110.3 | ||||
| 173 | S | 27.4 | Very low | 28 | Very low | 101 Ų | 101 | 111.5 Ų | 111.5 | 71% | 0.706 | 71% | 0.708 | S | S | * | * | cis | -133.9 | 130.9 | 17.4 | -73.5 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 174 | H | 27.7 | Very low | 28.2 | Very low | 121 Ų | 121 | 112 Ų | 112 | 56% | 0.56 | 72% | 0.716 | S | S | * | * | 36.6 | 114.5 | 127.3 | -51.7 | -71.3 | 0 | 0 | 0 | 120.1 | S176 | H174-S176 WeakPolarHBondContact ND1-CB 2.75Å; H174-S176 PolarHBondContact ND1-OG 3.35Å | |||
| 175 | C | 27.4 | Very low | 28.2 | Very low | 137 Ų | 137 | 116.7 Ų | 116.7 | 93% | 0.926 | 74% | 0.735 | S | S | * | * | -147 | 101.7 | 97.1 | -82.9 | 0 | 0 | 0 | 0 | 107.1 | |||||
| 176 | S | 27 | Very low | 28.2 | Very low | 74 Ų | 74 | 116.3 Ų | 116.3 | 52% | 0.517 | 73% | 0.732 | S | S | . | * | cis | 70.2 | 124.9 | 22.2 | -141.5 | 0 | 0 | 0 | 0 | 115.3 | H174 | H174-S176 WeakPolarHBondContact ND1-CB 2.75Å; H174-S176 PolarHBondContact ND1-OG 3.35Å | ||
| 177 | V | 26.1 | Very low | 28.2 | Very low | 143 Ų | 143 | 115.3 Ų | 115.3 | 87% | 0.867 | 73% | 0.732 | S | S | * | * | trans | 69.5 | 134.7 | 168.5 | -170.1 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 178 | G | 28.1 | Very low | 28.4 | Very low | 64 Ų | 64 | 114 Ų | 114 | 66% | 0.66 | 73% | 0.725 | S | S | * | * | trans | 141 | 60.7 | -170.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 179 | S | 28.5 | Very low | 28.6 | Very low | 118 Ų | 118 | 118 Ų | 118 | 83% | 0.825 | 73% | 0.727 | S | S | * | * | 55.8 | 105.1 | 93.3 | -55.5 | 0 | 0 | 0 | 0 | 111 | |||||
| 180 | G | 26.8 | Very low | 28.8 | Very low | 66 Ų | 66 | 119.3 Ų | 119.3 | 68% | 0.68 | 73% | 0.727 | S | S | * | * | cis | 122.1 | 161.2 | 21.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 181 | N | 27.2 | Very low | 29.3 | Very low | 148 Ų | 148 | 115.8 Ų | 115.8 | 79% | 0.791 | 72% | 0.724 | S | S | * | * | trans | 74.9 | 156.3 | -179 | -50.8 | -36.8 | 0 | 0 | 0 | 117.6 | ||||
| 182 | F | 28.9 | Very low | 29.6 | Very low | 189 Ų | 189 | 117.2 Ų | 117.2 | 83% | 0.829 | 73% | 0.73 | S | S | * | * | trans | 60.4 | 105.2 | 171.1 | -53.4 | -66.7 | 0 | 0 | 0 | 116.7 | ||||
| 183 | S | 26.3 | Very low | 30 | Very low | 119 Ų | 119 | 115.7 Ų | 115.7 | 83% | 0.832 | 73% | 0.733 | S | S | * | * | cis | 85.1 | 159.5 | 46 | -165.9 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 184 | A | 30.6 | Very low | 30.3 | Very low | 73 Ų | 73 | 116.5 Ų | 116.5 | 60% | 0.603 | 74% | 0.739 | S | S | * | * | trans | 72 | 101.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 185 | N | 30.3 | Very low | 30.5 | Very low | 170 Ų | 170 | 113.7 Ų | 113.7 | 91% | 0.909 | 74% | 0.743 | S | S | * | * | 59.6 | 127.7 | 122.7 | -54.2 | -17.7 | 0 | 0 | 0 | 121 | |||||
| 186 | G | 30.9 | Very low | 30.6 | Very low | 67 Ų | 67 | 116.2 Ų | 116.2 | 69% | 0.691 | 74% | 0.741 | S | S | * | * | trans | 171.1 | 85.4 | 132.5 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 187 | V | 32.2 | Very low | 30.7 | Very low | 132 Ų | 132 | 116 Ų | 116 | 80% | 0.8 | 74% | 0.743 | S | S | * | * | trans | 51.7 | 109.7 | 134.5 | 179.9 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 188 | N | 31.3 | Very low | 30.8 | Very low | 121 Ų | 121 | 117.6 Ų | 117.6 | 65% | 0.647 | 74% | 0.741 | S | S | * | * | 61 | 154.5 | 85.5 | -87.1 | -25.2 | 0 | 0 | 0 | 114.9 | |||||
| 189 | Y | 32.5 | Very low | 30.7 | Very low | 184 Ų | 184 | 118.1 Ų | 118.1 | 72% | 0.722 | 74% | 0.735 | S | S | * | * | cis | -146.9 | 175.9 | 8.6 | -104.8 | -46.8 | 0 | 0 | 0 | 106.8 | ||||
| 190 | N | 35.4 | Very low | 30.6 | Very low | 126 Ų | 126 | 121.7 Ų | 121.7 | 67% | 0.674 | 74% | 0.736 | S | S | * | * | cis | -158.3 | -166.8 | 5.3 | -128.7 | -36.4 | 0 | 0 | 0 | 106.3 | ||||
| 191 | S | 36.4 | Very low | 30.6 | Very low | 98 Ų | 98 | 123.2 Ų | 123.2 | 69% | 0.685 | 74% | 0.742 | S | S | * | * | cis | -171.7 | 171.5 | -10.5 | -115.2 | 0 | 0 | 0 | 0 | 104.3 | ||||
| 192 | A | 34.6 | Very low | 30.6 | Very low | 93 Ų | 93 | 119.6 Ų | 119.6 | 77% | 0.769 | 74% | 0.74 | S | S | * | * | cis | -166.7 | 173.6 | -23.7 | 0 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 193 | A | 35.1 | Very low | 30.5 | Very low | 85 Ų | 85 | 116.9 Ų | 116.9 | 70% | 0.702 | 74% | 0.744 | S | S | * | * | cis | -148.5 | 144.7 | 4.7 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 194 | S | 32.6 | Very low | 30.6 | Very low | 118 Ų | 118 | 114.3 Ų | 114.3 | 83% | 0.825 | 74% | 0.736 | S | S | * | * | cis | 92.8 | 135.9 | 32.7 | 78.5 | 0 | 0 | 0 | 0 | 115 | ||||
| 195 | G | 33.2 | Very low | 30.5 | Very low | 63 Ų | 63 | 117 Ų | 117 | 65% | 0.649 | 75% | 0.745 | S | S | * | * | trans | 129.6 | 93 | -169.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 196 | E | 29.5 | Very low | 30.4 | Very low | 190 Ų | 190 | 115.1 Ų | 115.1 | 89% | 0.888 | 74% | 0.74 | S | S | * | * | cis | 66.6 | 145.7 | 47.9 | -46.2 | -173 | 144.3 | 0 | 0 | 112.2 | ||||
| 197 | A | 28.1 | Very low | 30.3 | Very low | 68 Ų | 68 | 115.1 Ų | 115.1 | 56% | 0.562 | 74% | 0.74 | S | S | * | * | cis | -164.9 | 165 | 6.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 198 | H | 29.1 | Very low | 30.1 | Very low | 177 Ų | 177 | 115.6 Ų | 115.6 | 82% | 0.819 | 74% | 0.738 | S | S | * | * | trans | 60.2 | 159.8 | 140.9 | -66.5 | -42.8 | 0 | 0 | 0 | 120 | ||||
| 199 | S | 26.1 | Very low | 29.9 | Very low | 76 Ų | 76 | 115.9 Ų | 115.9 | 53% | 0.531 | 74% | 0.738 | S | S | . | * | cis | -168 | 176.7 | -9.4 | -110.2 | 0 | 0 | 0 | 0 | 111 | ||||
| 200 | F | 26.3 | Very low | 29.9 | Very low | 193 Ų | 193 | 112.9 Ų | 112.9 | 85% | 0.846 | 74% | 0.739 | S | S | * | * | trans | 56.6 | 115.6 | 158 | -62.5 | -57.7 | 0 | 0 | 0 | 118.1 | ||||
| 201 | A | 26.4 | Very low | 30 | Very low | 98 Ų | 98 | 111.6 Ų | 111.6 | 81% | 0.81 | 74% | 0.738 | S | S | * | * | 87.2 | 148.4 | 62.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 202 | G | 27.6 | Very low | 29.7 | Very low | 72 Ų | 72 | 114.3 Ų | 114.3 | 74% | 0.742 | 74% | 0.744 | S | S | * | * | trans | 109 | 104.6 | -165.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 203 | S | 27.1 | Very low | 29.8 | Very low | 132 Ų | 132 | 115.6 Ų | 115.6 | 92% | 0.923 | 75% | 0.745 | S | S | * | * | cis | 78.8 | 127.7 | 44.2 | -158.8 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 204 | G | 28.2 | Very low | 29.7 | Very low | 64 Ų | 64 | 114.7 Ų | 114.7 | 66% | 0.66 | 74% | 0.743 | S | S | * | * | trans | 135.1 | 104.8 | -167 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 205 | V | 27.9 | Very low | 29.6 | Very low | 131 Ų | 131 | 117.3 Ų | 117.3 | 79% | 0.794 | 74% | 0.742 | S | S | * | * | cis | 66.3 | 118 | 32.4 | -177.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 206 | T | 27.6 | Very low | 29.3 | Very low | 129 Ų | 129 | 121.5 Ų | 121.5 | 79% | 0.791 | 75% | 0.749 | S | S | * | * | cis | -163.2 | 154.5 | -8.4 | 18.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 207 | G | 28.4 | Very low | 29.4 | Very low | 68 Ų | 68 | 116 Ų | 116 | 70% | 0.701 | 74% | 0.744 | S | S | * | * | trans | 70.5 | -177.3 | 153.4 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 208 | D | 27.9 | Very low | 29.5 | Very low | 141 Ų | 141 | 120.5 Ų | 120.5 | 75% | 0.754 | 75% | 0.753 | S | S | * | * | cis | -160.2 | 171 | -11.5 | -131 | -34.5 | 0 | 0 | 0 | 111.9 | ||||
| 209 | I | 28.8 | Very low | 29.4 | Very low | 127 Ų | 127 | 118.5 Ų | 118.5 | 65% | 0.651 | 75% | 0.748 | S | S | * | * | trans | 48.6 | 102.2 | 151.7 | -63.5 | 160.8 | 0 | 0 | 0 | 116.4 | ||||
| 210 | T | 32.5 | Very low | 29.5 | Very low | 121 Ų | 121 | 120.3 Ų | 120.3 | 74% | 0.742 | 76% | 0.755 | S | S | * | * | 51.5 | 168.5 | 66.5 | 81.5 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 211 | P | 37.1 | Very low | 29.6 | Very low | 100 Ų | 100 | 115.3 Ų | 115.3 | 65% | 0.649 | 75% | 0.75 | S | S | * | * | cis | -132 | -149.7 | -37.8 | 24.1 | 1.2 | 0 | 0 | 0 | 111 | ||||
| 212 | L | 28.9 | Very low | 29.7 | Very low | 154 Ų | 154 | 115.3 Ų | 115.3 | 81% | 0.806 | 74% | 0.744 | S | S | * | * | trans | 88.4 | 150.8 | 147.3 | -70.7 | 167.9 | 0 | 0 | 0 | 119.4 | ||||
| 213 | P | 38.5 | Very low | 29.8 | Very low | 121 Ų | 121 | 119.9 Ų | 119.9 | 79% | 0.786 | 75% | 0.751 | S | S | * | * | trans | -146.6 | -155.2 | -131.8 | 45.4 | -23.5 | 0 | 0 | 0 | 114.1 | ||||
| 214 | G | 31 | Very low | 30 | Very low | 66 Ų | 66 | 116.6 Ų | 116.6 | 68% | 0.68 | 74% | 0.738 | S | S | * | * | trans | 117.5 | 161.9 | 158.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 215 | Q | 30.7 | Very low | 30 | Very low | 172 Ų | 172 | 120.5 Ų | 120.5 | 80% | 0.804 | 75% | 0.749 | S | S | * | * | cis | -162.5 | 164.3 | -9.4 | -131.1 | -176.3 | 0.7 | 0 | 0 | 109 | ||||
| 216 | L | 28.3 | Very low | 30.1 | Very low | 152 Ų | 152 | 118.3 Ų | 118.3 | 80% | 0.796 | 75% | 0.745 | S | S | * | * | trans | 40.9 | 109.5 | 154.1 | -64.5 | 158.9 | 0 | 0 | 0 | 117.4 | ||||
| 217 | G | 30.8 | Very low | 30.2 | Very low | 75 Ų | 75 | 118.6 Ų | 118.6 | 77% | 0.773 | 75% | 0.746 | S | S | * | * | 121.6 | -176.8 | 69.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | |||||
| 218 | H | 30.5 | Very low | 30.6 | Very low | 161 Ų | 161 | 121.3 Ų | 121.3 | 75% | 0.745 | 75% | 0.752 | S | S | * | * | cis | -168.1 | 148 | -3.4 | -168.3 | -145.4 | 0 | 0 | 0 | 108.6 | ||||
| 219 | L | 27.6 | Very low | 30.8 | Very low | 136 Ų | 136 | 118.2 Ų | 118.2 | 71% | 0.712 | 75% | 0.753 | S | S | * | * | trans | 67.3 | 157.8 | 169.2 | -49.5 | 175.4 | 0 | 0 | 0 | 117.1 | ||||
| 220 | T | 28.2 | Very low | 30.7 | Very low | 113 Ų | 113 | 122.7 Ų | 122.7 | 69% | 0.693 | 76% | 0.761 | S | S | * | * | cis | -157.5 | 149.7 | -19 | 22.3 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 221 | A | 27.4 | Very low | 30.5 | Very low | 88 Ų | 88 | 122.5 Ų | 122.5 | 73% | 0.727 | 76% | 0.755 | S | S | * | * | 48.2 | 140.4 | 83.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 222 | S | 28.6 | Very low | 30.1 | Very low | 98 Ų | 98 | 124.4 Ų | 124.4 | 69% | 0.685 | 76% | 0.756 | S | S | * | * | cis | -168 | 161.5 | 14.2 | 54 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 223 | N | 29.3 | Very low | 30.1 | Very low | 169 Ų | 169 | 122.6 Ų | 122.6 | 90% | 0.904 | 75% | 0.747 | S | S | * | * | trans | 48.6 | 139.1 | 141.4 | -60.6 | -3.2 | 0 | 0 | 0 | 124.8 | ||||
| 224 | G | 32.3 | Very low | 29.6 | Very low | 63 Ų | 63 | 122.9 Ų | 122.9 | 65% | 0.649 | 74% | 0.737 | S | S | * | * | trans | 148.2 | 107.5 | 152.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 225 | T | 28.8 | Very low | 29.5 | Very low | 145 Ų | 145 | 125.5 Ų | 125.5 | 89% | 0.89 | 73% | 0.732 | S | S | * | * | 60.5 | 131.6 | 73.5 | 64.8 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 226 | A | 28.3 | Very low | 29.4 | Very low | 85 Ų | 85 | 121.6 Ų | 121.6 | 70% | 0.702 | 72% | 0.724 | S | S | * | * | cis | -162.7 | 151.4 | -11.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 227 | V | 30 | Very low | 29.3 | Very low | 135 Ų | 135 | 118.9 Ų | 118.9 | 82% | 0.818 | 71% | 0.707 | S | S | * | * | 55.7 | 137.8 | 94.9 | -175 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 228 | P | 37.4 | Very low | 29.1 | Very low | 126 Ų | 126 | 120.6 Ų | 120.6 | 82% | 0.818 | 70% | 0.695 | S | S | * | * | cis | -135.6 | -171.8 | -16.9 | 40.7 | -22.6 | 0 | 0 | 0 | 115.7 | ||||
| 229 | G | 32.6 | Very low | 29 | Very low | 75 Ų | 75 | 119.4 Ų | 119.4 | 77% | 0.773 | 69% | 0.694 | S | S | * | * | trans | 139 | 108.5 | 158.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 230 | R | 26.9 | Very low | 29.1 | Very low | 221 Ų | 221 | 117.6 Ų | 117.6 | 83% | 0.834 | 70% | 0.699 | S | S | * | * | cis | 107.5 | 127.9 | 18.6 | -161 | -152.3 | 171.1 | 179.9 | -5.8 | 112.1 | ||||
| 231 | L | 27.7 | Very low | 29.1 | Very low | 117 Ų | 117 | 119.7 Ų | 119.7 | 61% | 0.613 | 71% | 0.705 | S | S | * | * | trans | 83.1 | 138.5 | 173.9 | -48.3 | 177.6 | 0 | 0 | 0 | 115.1 | ||||
| 232 | E | 29.4 | Very low | 29.1 | Very low | 141 Ų | 141 | 124.1 Ų | 124.1 | 66% | 0.659 | 71% | 0.713 | S | S | * | * | cis | -162 | 154.3 | -5.9 | -123.1 | 171.4 | 135.4 | 0 | 0 | 112.8 | ||||
| 233 | N | 27.2 | Very low | 29.2 | Very low | 115 Ų | 115 | 123.8 Ų | 123.8 | 62% | 0.615 | 72% | 0.717 | S | S | * | * | trans | 47.2 | 149.4 | 142.1 | -66.8 | -14.9 | 0 | 0 | 0 | 122 | ||||
| 234 | Q | 28.2 | Very low | 29.5 | Very low | 127 Ų | 127 | 120.8 Ų | 120.8 | 59% | 0.593 | 71% | 0.706 | S | S | * | * | cis | -156.9 | 177.3 | 10.8 | -127.9 | 158.1 | 35.3 | 0 | 0 | 112.7 | ||||
| 235 | H | 28.7 | Very low | 29.1 | Very low | 121 Ų | 121 | 126.9 Ų | 126.9 | 56% | 0.56 | 72% | 0.715 | S | S | * | * | trans | -34.2 | 148.4 | 179.5 | -57.8 | -77.8 | 0 | 0 | 0 | 117.1 | ||||
| 236 | S | 28.5 | Very low | 29.2 | Very low | 91 Ų | 91 | 127 Ų | 127 | 64% | 0.636 | 71% | 0.71 | S | S | * | * | -170.5 | -177.4 | 57 | -67.3 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 237 | Q | 26.8 | Very low | 29.2 | Very low | 95 Ų | 95 | 129.7 Ų | 129.7 | 44% | 0.444 | 71% | 0.712 | S | S | . | * | -172 | 160.2 | -58.7 | -126.5 | 170.1 | -3.3 | 0 | 0 | 106.9 | V1021 | Q237-V1021 HydrophobicContact CB-CG1 3.96Å; Q237-V1021 HydrophobicContact CG-CG1 3.55Å; Q237-V1021 VanDerWaalsContact OE1-N 3.13Å | |||
| 238 | E | 27.7 | Very low | 28.9 | Very low | 110 Ų | 110 | 129.2 Ų | 129.2 | 51% | 0.514 | 70% | 0.704 | S | S | . | * | trans | 66.7 | 150.6 | 176.6 | -58.6 | -163.3 | -164.4 | 0 | 0 | 117.2 | V1021 S1022 | E238-V1021 HydrophobicContact CG-CG1 3.56Å; E238-V1021 WeakPolarHBondContact OE1-CA 3.37Å; E238-S1022 PolarHBondContact OE1-N 2.97Å | ||
| 239 | N | 27.5 | Very low | 28.4 | Very low | 137 Ų | 137 | 128.1 Ų | 128.1 | 73% | 0.733 | 70% | 0.7 | S | S | * | * | cis | -158.5 | 121.4 | -19 | -113.3 | -33 | 0 | 0 | 0 | 109.8 | ||||
| 240 | A | 28.9 | Very low | 28 | Very low | 98 Ų | 98 | 126.6 Ų | 126.6 | 81% | 0.81 | 67% | 0.674 | S | S | * | * | trans | -169.8 | 85.9 | 170 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 241 | N | 28.8 | Very low | 28.1 | Very low | 156 Ų | 156 | 122.3 Ų | 122.3 | 83% | 0.834 | 66% | 0.658 | S | S | * | * | trans | -103.1 | 119.9 | 168.6 | -86.8 | -10.7 | 0 | 0 | 0 | 111.8 | ||||
| 242 | M | 27.8 | Very low | 28 | Very low | 181 Ų | 181 | 123.8 Ų | 123.8 | 89% | 0.892 | 66% | 0.661 | S | S | * | * | 45.9 | 132.4 | 124 | -65.7 | -170 | 170.1 | 0 | 0 | 121.9 | |||||
| 243 | A | 29.7 | Very low | 28.1 | Very low | 92 Ų | 92 | 120.8 Ų | 120.8 | 76% | 0.76 | 65% | 0.654 | S | S | * | * | trans | -82 | -171.4 | 160.3 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 244 | P | 36.1 | Very low | 28 | Very low | 106 Ų | 106 | 122.7 Ų | 122.7 | 69% | 0.688 | 65% | 0.653 | S | S | * | * | cis | -148.3 | -168.4 | 23.9 | 46.1 | -24.6 | 0 | 0 | 0 | 117.7 | ||||
| 245 | F | 25 | Very low | 28.2 | Very low | 191 Ų | 191 | 123.2 Ų | 123.2 | 84% | 0.838 | 66% | 0.655 | S | S | * | * | trans | 41.8 | 111.2 | 154.6 | -71.5 | -68.1 | 0 | 0 | 0 | 121.9 | ||||
| 246 | D | 31 | Very low | 28.2 | Very low | 146 Ų | 146 | 122.5 Ų | 122.5 | 78% | 0.781 | 66% | 0.655 | S | S | * | * | -169.2 | 137.7 | 122.9 | -96.6 | -24.2 | 0 | 0 | 0 | 107.5 | |||||
| 247 | L | 27.3 | Very low | 28.2 | Very low | 142 Ų | 142 | 124.1 Ų | 124.1 | 74% | 0.743 | 66% | 0.657 | S | S | * | * | 76.4 | 111.4 | 56 | -71.9 | 179 | 0 | 0 | 0 | 115.8 | |||||
| 248 | L | 24.7 | Very low | 28.4 | Very low | 125 Ų | 125 | 125.4 Ų | 125.4 | 65% | 0.654 | 68% | 0.677 | S | S | * | * | trans | 31.6 | 86.9 | 148.3 | -74.2 | 161.4 | 0 | 0 | 0 | 119.8 | ||||
| 249 | S | 26.6 | Very low | 28.5 | Very low | 104 Ų | 104 | 127 Ų | 127 | 73% | 0.727 | 68% | 0.684 | S | S | * | * | trans | -162.4 | 110.2 | 141.8 | -83.9 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 250 | I | 24.7 | Very low | 28.5 | Very low | 42 Ų | 42 | 129.3 Ų | 129.3 | 22% | 0.215 | 69% | 0.69 | C | S | . | * | 67.9 | 48.1 | 57.8 | -44.6 | 173.5 | 0 | 0 | 0 | 113.7 | W314 H890 K891 | I250-W314 HydrophobicContact CB-CH2 4.46Å; I250-W314 HydrophobicContact CB-CZ3 4.24Å; I250-W314 HydrophobicContact CG2-CH2 3.84Å; I250-W314 HydrophobicContact CG2-CZ3 4.02Å; I250-W314 WeakPolarHBondContact O-CZ3 3.37Å; I250-H890 HydrophobicContact CD1-CB 4Å; I250-H890 HydrophobicContact CG1-CB 3.78Å; I250-H890 HydrophobicContact CG2-CB 4.25Å; I250-H890 WeakPolarHBondContact CG2-O 3.44Å; I250-K891 HydrophobicContact CG2-CD 3.74Å; I250-K891 VanDerWaalsContact CG2-CE 3.47Å; I250-K891 HydrophobicContact CG2-CG 3.96Å; I250-K891 PolarHBondContact O-NZ 3.44Å | |||
| 251 | W | 27.5 | Very low | 28.3 | Very low | 132 Ų | 132 | 129 Ų | 129 | 50% | 0.5 | 68% | 0.677 | S | S | . | * | trans | -152.5 | 111.6 | 150.3 | -131.8 | 7.4 | 0 | 0 | 0 | 114.2 | P253 W314 | W251-P253 HydrophobicContact CD2-CB 4.41Å; W251-P253 HydrophobicContact CD2-CG 4.34Å; W251-P253 HydrophobicContact CE3-CG 4.29Å; W251-W314 HydrophobicContact CD2-CB 4.17Å; W251-W314 HydrophobicContact CD2-CG 4.32Å; W251-W314 AromaticContact CE2-CG 3.79Å; W251-W314 HydrophobicContact CE3-CB 4.29Å; W251-W314 HydrophobicContact CH2-CB 3.78Å; W251-W314 HydrophobicContact CZ2-CB 3.62Å; W251-W314 AromaticContact CZ2-CG 3.94Å; W251-W314 HydrophobicContact CZ2-CG 3.94Å; W251-W314 HydrophobicContact CZ3-CB 4.11Å; W251-W314 AromaticContact NE1-CG 3.96Å | ||
| 252 | E | 26.3 | Very low | 28.3 | Very low | 147 Ų | 147 | 133.3 Ų | 133.3 | 69% | 0.687 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | -75.6 | 121.9 | 125.2 | -70.3 | -179.9 | 141.1 | 0 | 0 | 106.7 | R254 M889 | E252-R254 PolarHBondContact O-N 3.06Å; E252-M889 HydrophobicContact CG-CE 3.74Å | |
| 253 | P | 30.4 | Very low | 28.3 | Very low | 79 Ų | 79 | 130 Ų | 130 | 51% | 0.513 | 67% | 0.667 | S | S | . | * | P | Polyproline II helix | trans | -59.1 | 133 | 164.2 | -17.8 | 31.1 | 0 | 0 | 0 | 108.4 | W251 Q255 | W251-P253 HydrophobicContact CD2-CB 4.41Å; W251-P253 HydrophobicContact CD2-CG 4.34Å; W251-P253 HydrophobicContact CE3-CG 4.29Å; P253-Q255 PolarHBondContact O-N 3.28Å |
| 254 | R | 25.4 | Very low | 28.3 | Very low | 155 Ų | 155 | 130.4 Ų | 130.4 | 59% | 0.585 | 66% | 0.663 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 123 | 164.2 | -76.8 | 179.4 | 167.2 | -177.9 | -6.3 | 107.3 | E252 N256 | E252-R254 PolarHBondContact O-N 3.06Å; R254-N256 PolarHBondContact O-N 3.34Å |
| 255 | Q | 32.6 | Very low | 27.8 | Very low | 138 Ų | 138 | 131.7 Ų | 131.7 | 65% | 0.645 | 66% | 0.664 | S | S | * | * | trans | -68.7 | 94.2 | 149.8 | -73.4 | -156.2 | 2.9 | 0 | 0 | 107 | P253 E1104 | P253-Q255 PolarHBondContact O-N 3.28Å; Q255-E1104 PolarHBondContact NE2-OE1 2.97Å | ||
| 256 | N | 28.5 | Very low | 28.3 | Very low | 105 Ų | 105 | 126.2 Ų | 126.2 | 56% | 0.561 | 65% | 0.647 | S | S | * | * | trans | -76.1 | 157.6 | 165.6 | -109.3 | 34.9 | 0 | 0 | 0 | 109 | R254 | R254-N256 PolarHBondContact O-N 3.34Š| ||
| 257 | N | 29.4 | Very low | 28.2 | Very low | 125 Ų | 125 | 124.3 Ų | 124.3 | 67% | 0.668 | 65% | 0.645 | S | S | * | * | trans | 69.4 | 116.3 | 177.9 | -45.2 | -12.3 | 0 | 0 | 0 | 112 | ||||
| 258 | S | 30.4 | Very low | 28.2 | Very low | 123 Ų | 123 | 125.1 Ų | 125.1 | 86% | 0.86 | 65% | 0.645 | S | S | * | * | cis | -86.4 | 142.6 | 27.3 | -49.8 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 259 | H | 29 | Very low | 28.5 | Very low | 143 Ų | 143 | 124.6 Ų | 124.6 | 66% | 0.662 | 64% | 0.643 | S | S | * | * | trans | -71.8 | 132.2 | 165 | -77 | -134.5 | 0 | 0 | 0 | 110 | ||||
| 260 | H | 28.8 | Very low | 28.8 | Very low | 185 Ų | 185 | 125.6 Ų | 125.6 | 86% | 0.856 | 65% | 0.647 | S | S | * | * | trans | -136.5 | 131 | 144.1 | -110.3 | -77.8 | 0 | 0 | 0 | 109.7 | ||||
| 261 | V | 25.5 | Very low | 29 | Very low | 91 Ų | 91 | 128.8 Ų | 128.8 | 55% | 0.552 | 67% | 0.669 | S | S | * | * | trans | -93.4 | 128.2 | -172.3 | 176.3 | 0 | 0 | 0 | 0 | 109.8 | L263 | V261-L263 HydrophobicContact CG1-CB 3.96Å; V261-L263 HydrophobicContact CG1-CD1 4.01Å; V261-L263 HydrophobicContact CG1-CG 3.59Å | ||
| 262 | W | 26.9 | Very low | 29 | Very low | 247 Ų | 247 | 128.4 Ų | 128.4 | 94% | 0.936 | 68% | 0.681 | S | S | * | * | trans | -121.8 | 96.1 | 140.8 | -72.1 | 71.3 | 0 | 0 | 0 | 103.2 | ||||
| 263 | L | 28.6 | Very low | 29.1 | Very low | 111 Ų | 111 | 125.2 Ų | 125.2 | 58% | 0.581 | 68% | 0.679 | S | S | * | * | 43.9 | 129.2 | 71.7 | -88.6 | 164.9 | 0 | 0 | 0 | 111.4 | V261 | V261-L263 HydrophobicContact CG1-CB 3.96Å; V261-L263 HydrophobicContact CG1-CD1 4.01Å; V261-L263 HydrophobicContact CG1-CG 3.59Å | |||
| 264 | P | 29.7 | Very low | 28.9 | Very low | 102 Ų | 102 | 127.9 Ų | 127.9 | 66% | 0.662 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -61.3 | 167.2 | 158.2 | 33.2 | -35.9 | 0 | 0 | 0 | 108.6 | P266 | P264-P266 WeakPolarHBondContact O-CD 3.27Å; P264-P266 WeakPolarHBondContact O-CG 3.08Å |
| 265 | D | 26.1 | Very low | 29.2 | Very low | 132 Ų | 132 | 127 Ų | 127 | 71% | 0.706 | 70% | 0.702 | S | S | * | * | trans | -52.5 | 110.6 | 166 | -175.8 | -31 | 0 | 0 | 0 | 109.2 | S267 | D265-S267 VanDerWaalsContact OD1-CB 3.29Å; D265-S267 WeakPolarHBondContact OD1-CB 3.03Å; D265-S267 PolarHBondContact OD1-N 2.88Å; D265-S267 VanDerWaalsContact OD1-N 3.12Å; D265-S267 PolarHBondContact OD1-OG 3.49Å | ||
| 266 | P | 35.4 | Very low | 29 | Very low | 76 Ų | 76 | 125.7 Ų | 125.7 | 49% | 0.494 | 70% | 0.703 | S | S | . | * | trans | -106.5 | 61.2 | -178.2 | 33.7 | -14.9 | 0 | 0 | 0 | 107.9 | P264 Q268 | P264-P266 WeakPolarHBondContact O-CD 3.27Å; P264-P266 WeakPolarHBondContact O-CG 3.08Å; P266-Q268 CarbonylContact C-O 3.46Å; P266-Q268 CarbonylContact O-C 3.54Å; P266-Q268 PolarHBondContact O-N 3.43Å | ||
| 267 | S | 28.6 | Very low | 29.1 | Very low | 106 Ų | 106 | 128.1 Ų | 128.1 | 74% | 0.741 | 72% | 0.722 | S | S | * | * | trans | -75 | 25.8 | 169.8 | 35.2 | 0 | 0 | 0 | 0 | 113.2 | D265 | D265-S267 VanDerWaalsContact OD1-CB 3.29Å; D265-S267 WeakPolarHBondContact OD1-CB 3.03Å; D265-S267 PolarHBondContact OD1-N 2.88Å; D265-S267 VanDerWaalsContact OD1-N 3.12Å; D265-S267 PolarHBondContact OD1-OG 3.49Å | ||
| 268 | Q | 28 | Very low | 29.1 | Very low | 160 Ų | 160 | 125 Ų | 125 | 75% | 0.748 | 72% | 0.719 | S | S | * | * | trans | -135.5 | 120.9 | 152.3 | -65.9 | -175.7 | -6.1 | 0 | 0 | 103.3 | P266 | P266-Q268 CarbonylContact C-O 3.46Å; P266-Q268 CarbonylContact O-C 3.54Å; P266-Q268 PolarHBondContact O-N 3.43Å | ||
| 269 | D | 30.4 | Very low | 29.1 | Very low | 113 Ų | 113 | 126.5 Ų | 126.5 | 60% | 0.604 | 72% | 0.717 | S | S | * | * | cis | -142.9 | 164.8 | 29.7 | -83.5 | -44.1 | 0 | 0 | 0 | 111.1 | V271 | D269-V271 WeakPolarHBondContact OD1-CG2 3.3Å; D269-V271 PolarHBondContact OD1-N 2.75Å | ||
| 270 | P | 33.5 | Very low | 29.2 | Very low | 125 Ų | 125 | 125.8 Ų | 125.8 | 81% | 0.812 | 73% | 0.727 | S | S | * | * | -100.3 | 124.8 | 61.2 | -16 | 33.7 | 0 | 0 | 0 | 116.3 | T272 | P270-T272 PolarHBondContact O-N 3.15Å; P270-T272 VanDerWaalsContact O-N 3.08Å | |||
| 271 | V | 28.1 | Very low | 29.3 | Very low | 110 Ų | 110 | 121.2 Ų | 121.2 | 67% | 0.667 | 72% | 0.721 | S | S | * | * | trans | -55.9 | 104.9 | 139.9 | 173.8 | 0 | 0 | 0 | 0 | 107.9 | D269 | D269-V271 WeakPolarHBondContact OD1-CG2 3.3Å; D269-V271 PolarHBondContact OD1-N 2.75Å | ||
| 272 | T | 28.1 | Very low | 29.8 | Very low | 123 Ų | 123 | 122.8 Ų | 122.8 | 76% | 0.755 | 73% | 0.731 | S | S | * | * | -174.2 | 138.8 | 126 | 18.9 | 0 | 0 | 0 | 0 | 114.6 | P270 | P270-T272 PolarHBondContact O-N 3.15Å; P270-T272 VanDerWaalsContact O-N 3.08Å | |||
| 273 | A | 27.8 | Very low | 30.3 | Very low | 80 Ų | 80 | 117.7 Ų | 117.7 | 66% | 0.661 | 73% | 0.727 | S | S | * | * | trans | 55.9 | 102.1 | 142.8 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 274 | N | 27.3 | Very low | 30.7 | Very low | 135 Ų | 135 | 115.4 Ų | 115.4 | 72% | 0.722 | 73% | 0.731 | S | S | * | * | 52.3 | 105.8 | 118.2 | -57.7 | -16.8 | 0 | 0 | 0 | 120.4 | |||||
| 275 | T | 29.8 | Very low | 31.1 | Very low | 137 Ų | 137 | 117.1 Ų | 117.1 | 84% | 0.84 | 73% | 0.734 | S | S | * | * | -158.8 | 90.6 | 110.2 | 2.8 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 276 | T | 29.5 | Very low | 31.5 | Very low | 111 Ų | 111 | 117.2 Ų | 117.2 | 68% | 0.681 | 74% | 0.735 | S | S | * | * | 32.4 | 90.8 | 78.6 | 39.5 | 0 | 0 | 0 | 0 | 116 | |||||
| 277 | V | 29.9 | Very low | 31.6 | Very low | 156 Ų | 156 | 119.7 Ų | 119.7 | 95% | 0.945 | 75% | 0.752 | S | S | * | * | trans | -116 | 94.6 | 145.4 | -179.4 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 278 | G | 29.6 | Very low | 32.3 | Very low | 59 Ų | 59 | 120.3 Ų | 120.3 | 61% | 0.608 | 75% | 0.754 | S | S | * | * | S | Bend | trans | 175.9 | 26.8 | -167.2 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||
| 279 | N | 31 | Very low | 32.6 | Very low | 154 Ų | 154 | 121.9 Ų | 121.9 | 82% | 0.824 | 76% | 0.761 | S | S | * | * | trans | 70.2 | 95.3 | 166.2 | -50.7 | -26 | 0 | 0 | 0 | 118.9 | ||||
| 280 | C | 29.8 | Very low | 32.7 | Very low | 128 Ų | 128 | 124.1 Ų | 124.1 | 87% | 0.865 | 77% | 0.768 | S | S | * | * | 153 | 123.3 | 110.2 | -82.1 | 0 | 0 | 0 | 0 | 116.9 | |||||
| 281 | A | 32.4 | Very low | 32.8 | Very low | 89 Ų | 89 | 125.1 Ų | 125.1 | 74% | 0.736 | 76% | 0.762 | S | S | * | * | trans | 79.3 | 100.2 | 145.1 | 0 | 0 | 0 | 0 | 0 | 125.2 | ||||
| 282 | T | 34.8 | Very low | 33.1 | Very low | 124 Ų | 124 | 126 Ų | 126 | 76% | 0.761 | 76% | 0.763 | S | S | * | * | 70.6 | 106.8 | 126.2 | 56.3 | 0 | 0 | 0 | 0 | 126.6 | |||||
| 283 | T | 37.1 | Very low | 33.4 | Very low | 141 Ų | 141 | 125.7 Ų | 125.7 | 87% | 0.865 | 76% | 0.757 | S | S | * | * | trans | 62.6 | 156.5 | 138.4 | 49.5 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 284 | G | 37.8 | Very low | 33.8 | Very low | 63 Ų | 63 | 129.7 Ų | 129.7 | 65% | 0.649 | 76% | 0.761 | S | S | * | * | cis | 157.5 | 151.1 | -11.3 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 285 | N | 37.2 | Very low | 34 | Very low | 137 Ų | 137 | 129.9 Ų | 129.9 | 73% | 0.733 | 76% | 0.762 | S | S | * | * | trans | 73.4 | 155.4 | 154.2 | -51.3 | 89.2 | 0 | 0 | 0 | 121.3 | ||||
| 286 | D | 35.8 | Very low | 34.3 | Very low | 134 Ų | 134 | 131.2 Ų | 131.2 | 72% | 0.717 | 76% | 0.759 | S | S | * | * | cis | -168 | 151.1 | -23.5 | -90.4 | -17.6 | 0 | 0 | 0 | 115.3 | ||||
| 287 | C | 36.2 | Very low | 34.2 | Very low | 128 Ų | 128 | 133.9 Ų | 133.9 | 87% | 0.865 | 77% | 0.768 | S | S | * | * | trans | 53.2 | 152.5 | 152 | -67.9 | 0 | 0 | 0 | 0 | 129.3 | ||||
| 288 | P | 43.2 | Very low | 34.2 | Very low | 120 Ų | 120 | 130.1 Ų | 130.1 | 78% | 0.779 | 76% | 0.761 | S | S | * | * | trans | -134.1 | -179.4 | -174.9 | 46.5 | -29.8 | 0 | 0 | 0 | 118.7 | ||||
| 289 | E | 34.8 | Very low | 34.1 | Very low | 193 Ų | 193 | 136.2 Ų | 136.2 | 90% | 0.902 | 78% | 0.778 | S | S | * | * | trans | -178.1 | 158.5 | 164.8 | -103.8 | 164.1 | -153.1 | 0 | 0 | 110.6 | ||||
| 290 | E | 33.9 | Very low | 34.1 | Very low | 159 Ų | 159 | 132.3 Ų | 132.3 | 74% | 0.743 | 77% | 0.774 | S | S | * | * | cis | -148.1 | -95.6 | -23.3 | -140 | -150.3 | 163.2 | 0 | 0 | 116.7 | ||||
| 291 | Q | 34.1 | Very low | 34.2 | Very low | 146 Ų | 146 | 133.6 Ų | 133.6 | 68% | 0.682 | 77% | 0.771 | S | S | * | * | trans | -131.2 | 160.4 | -157.9 | -59.6 | 178.1 | 16.5 | 0 | 0 | 120 | ||||
| 292 | D | 35.3 | Very low | 34.1 | Very low | 130 Ų | 130 | 135.7 Ų | 135.7 | 70% | 0.695 | 77% | 0.77 | S | S | * | * | 122.9 | 122.9 | 119.4 | -134.9 | 28.5 | 0 | 0 | 0 | 124.7 | |||||
| 293 | N | 33.9 | Very low | 34 | Very low | 115 Ų | 115 | 137.1 Ų | 137.1 | 62% | 0.615 | 77% | 0.773 | S | S | * | * | trans | 72.4 | 141.2 | 139.1 | -98.3 | -48.3 | 0 | 0 | 0 | 129.8 | ||||
| 294 | H | 36.5 | Very low | 33.7 | Very low | 165 Ų | 165 | 134 Ų | 134 | 76% | 0.764 | 77% | 0.769 | S | S | * | * | trans | 102.4 | 162 | 144.6 | -67.9 | -5.6 | 0 | 0 | 0 | 124.7 | ||||
| 295 | N | 32.3 | Very low | 33.4 | Very low | 139 Ų | 139 | 135.9 Ų | 135.9 | 74% | 0.743 | 78% | 0.779 | S | S | * | * | trans | -117.7 | 157.5 | -158.3 | -42 | -80.9 | 0 | 0 | 0 | 115.4 | ||||
| 296 | H | 34.8 | Very low | 33.1 | Very low | 165 Ų | 165 | 138 Ų | 138 | 76% | 0.764 | 78% | 0.784 | S | S | * | * | 163.4 | 135.8 | 120.4 | -96.9 | -79.2 | 0 | 0 | 0 | 117.2 | |||||
| 297 | L | 27.7 | Very low | 33 | Very low | 166 Ų | 166 | 138.5 Ų | 138.5 | 87% | 0.869 | 79% | 0.787 | S | S | * | * | trans | 20.9 | 134 | 143.7 | -56.2 | 170.8 | 0 | 0 | 0 | 122.8 | ||||
| 298 | G | 30.6 | Very low | 32.7 | Very low | 77 Ų | 77 | 139.7 Ų | 139.7 | 79% | 0.794 | 78% | 0.78 | S | S | * | * | trans | 175.2 | 91.8 | 158.3 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 299 | L | 27.7 | Very low | 32.2 | Very low | 187 Ų | 187 | 140.6 Ų | 140.6 | 98% | 0.979 | 78% | 0.783 | S | S | * | * | trans | -8.8 | 140.8 | 158.3 | -56 | 164.9 | 0 | 0 | 0 | 121.5 | ||||
| 300 | G | 31.2 | Very low | 31.9 | Very low | 72 Ų | 72 | 138.1 Ų | 138.1 | 74% | 0.742 | 78% | 0.775 | S | S | * | * | trans | 153.8 | 92.9 | 142.9 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 301 | I | 31.5 | Very low | 31.9 | Very low | 156 Ų | 156 | 135.7 Ų | 135.7 | 80% | 0.8 | 77% | 0.773 | S | S | * | * | 58.8 | 115.1 | 129.8 | -63.4 | 172 | 0 | 0 | 0 | 122.1 | |||||
| 302 | D | 30.7 | Very low | 31.5 | Very low | 133 Ų | 133 | 137.7 Ų | 137.7 | 71% | 0.711 | 77% | 0.774 | S | S | * | * | trans | 67.3 | 130.7 | 139.1 | -67.7 | 12.6 | 0 | 0 | 0 | 127.1 | ||||
| 303 | N | 32.3 | Very low | 31.3 | Very low | 153 Ų | 153 | 136.8 Ų | 136.8 | 82% | 0.818 | 77% | 0.77 | S | S | * | * | trans | 73.6 | 103.5 | 139.5 | -65.5 | -33.1 | 0 | 0 | 0 | 123.4 | ||||
| 304 | G | 30.2 | Very low | 31 | Very low | 77 Ų | 77 | 136.3 Ų | 136.3 | 79% | 0.794 | 76% | 0.759 | S | S | * | * | 126.3 | 139.3 | 107.3 | 0 | 0 | 0 | 0 | 0 | 121 | |||||
| 305 | A | 32.2 | Very low | 30.7 | Very low | 102 Ų | 102 | 135 Ų | 135 | 84% | 0.843 | 76% | 0.758 | S | S | * | * | trans | 73.4 | 87.1 | 156 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 306 | E | 31 | Very low | 30.5 | Very low | 181 Ų | 181 | 134 Ų | 134 | 85% | 0.846 | 76% | 0.757 | S | S | * | * | trans | 5 | 134.3 | 134.2 | -55.3 | 172.3 | 150.1 | 0 | 0 | 120 | ||||
| 307 | N | 33.4 | Very low | 30.1 | Very low | 145 Ų | 145 | 131.2 Ų | 131.2 | 78% | 0.775 | 76% | 0.762 | S | S | * | * | -164.5 | 140.1 | 116.9 | -110.3 | -15.3 | 0 | 0 | 0 | 117 | |||||
| 308 | E | 30 | Very low | 30.1 | Very low | 152 Ų | 152 | 129.8 Ų | 129.8 | 71% | 0.71 | 77% | 0.765 | S | S | * | * | trans | 42.3 | 82.9 | 149.7 | -57.1 | -166 | 133.3 | 0 | 0 | 121.7 | ||||
| 309 | V | 31.7 | Very low | 29.9 | Very low | 139 Ų | 139 | 129.4 Ų | 129.4 | 84% | 0.842 | 76% | 0.761 | S | S | * | * | trans | -104 | 106.5 | 136.4 | 175.8 | 0 | 0 | 0 | 0 | 107.7 | P311 | V309-P311 WeakPolarHBondContact O-CD 3.48Š| ||
| 310 | L | 28.5 | Very low | 29.9 | Very low | 141 Ų | 141 | 129 Ų | 129 | 74% | 0.738 | 76% | 0.759 | S | S | * | * | trans | -66.6 | 112 | -170.6 | -75.4 | 170.8 | 0 | 0 | 0 | 113.9 | ||||
| 311 | P | 33.7 | Very low | 29.8 | Very low | 109 Ų | 109 | 129.8 Ų | 129.8 | 71% | 0.708 | 76% | 0.758 | S | S | * | * | trans | -86.6 | 153.7 | 167.6 | 1.9 | 20.6 | 0 | 0 | 0 | 109.8 | V309 N313 | V309-P311 WeakPolarHBondContact O-CD 3.48Å; P311-N313 PolarHBondContact O-N 3.18Å | ||
| 312 | W | 26.8 | Very low | 29.8 | Very low | 188 Ų | 188 | 129.6 Ų | 129.6 | 71% | 0.712 | 76% | 0.759 | S | S | * | * | trans | -74.7 | 73.9 | 174.3 | -83.2 | 41.3 | 0 | 0 | 0 | 111.9 | ||||
| 313 | N | 30.9 | Very low | 29.8 | Very low | 111 Ų | 111 | 130 Ų | 130 | 59% | 0.594 | 77% | 0.766 | S | S | * | * | trans | -66.3 | 145.2 | 170.6 | -170.2 | -0.5 | 0 | 0 | 0 | 110.6 | P311 D315 T316 | P311-N313 PolarHBondContact O-N 3.18Å; N313-D315 PolarHBondContact OD1-N 3.27Å; N313-D315 VanDerWaalsContact OD1-N 3.12Å; N313-T316 PolarHBondContact ND2-OG1 2.74Å | ||
| 314 | W | 27.4 | Very low | 29.7 | Very low | 104 Ų | 104 | 126.9 Ų | 126.9 | 39% | 0.394 | 75% | 0.753 | S | S | . | * | S | Bend | trans | -117.3 | 5.6 | -179.4 | -108.8 | 73.5 | 0 | 0 | 0 | 115.8 | I250 W251 K891 | I250-W314 HydrophobicContact CB-CH2 4.46Å; I250-W314 HydrophobicContact CB-CZ3 4.24Å; I250-W314 HydrophobicContact CG2-CH2 3.84Å; I250-W314 HydrophobicContact CG2-CZ3 4.02Å; I250-W314 WeakPolarHBondContact O-CZ3 3.37Å; W251-W314 HydrophobicContact CD2-CB 4.17Å; W251-W314 HydrophobicContact CD2-CG 4.32Å; W251-W314 AromaticContact CE2-CG 3.79Å; W251-W314 HydrophobicContact CE3-CB 4.29Å; W251-W314 HydrophobicContact CH2-CB 3.78Å; W251-W314 HydrophobicContact CZ2-CB 3.62Å; W251-W314 AromaticContact CZ2-CG 3.94Å; W251-W314 HydrophobicContact CZ2-CG 3.94Å; W251-W314 HydrophobicContact CZ3-CB 4.11Å; W251-W314 AromaticContact NE1-CG 3.96Å; W314-K891 VanDerWaalsContact CE2-CE 3.41Å |
| 315 | D | 30.1 | Very low | 29.5 | Very low | 137 Ų | 137 | 129 Ų | 129 | 73% | 0.733 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -122.2 | 62.3 | 174.7 | -84.1 | -56.3 | 0 | 0 | 0 | 112.4 | N313 | N313-D315 PolarHBondContact OD1-N 3.27Å; N313-D315 VanDerWaalsContact OD1-N 3.12Å |
| 316 | T | 29.2 | Very low | 29.3 | Very low | 120 Ų | 120 | 134.4 Ų | 134.4 | 74% | 0.736 | 75% | 0.754 | S | S | * | * | trans | -151.1 | 54.6 | 166.1 | -29.7 | 0 | 0 | 0 | 0 | 114 | N313 | N313-T316 PolarHBondContact ND2-OG1 2.74Š| ||
| 317 | A | 25.7 | Very low | 29.1 | Very low | 105 Ų | 105 | 136.6 Ų | 136.6 | 87% | 0.868 | 76% | 0.755 | S | S | * | * | trans | -135.7 | 10.6 | 169.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 318 | C | 26.7 | Very low | 28.9 | Very low | 137 Ų | 137 | 135.9 Ų | 135.9 | 93% | 0.926 | 75% | 0.751 | S | S | * | * | trans | -86.8 | 114 | 159.4 | -68.3 | 0 | 0 | 0 | 0 | 108 | ||||
| 319 | G | 27.6 | Very low | 28.7 | Very low | 69 Ų | 69 | 134.8 Ų | 134.8 | 71% | 0.711 | 75% | 0.749 | S | S | * | * | trans | 173.1 | 2.9 | -178.1 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 320 | L | 27.1 | Very low | 28.6 | Very low | 179 Ų | 179 | 136.8 Ų | 136.8 | 94% | 0.937 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -142.6 | 117.5 | 176.8 | -77.9 | 171.3 | 0 | 0 | 0 | 110.8 | ||
| 321 | A | 28.7 | Very low | 28.7 | Very low | 88 Ų | 88 | 135.1 Ų | 135.1 | 73% | 0.727 | 74% | 0.744 | S | S | * | * | cis | -151 | 155.4 | -15.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 322 | N | 31.6 | Very low | 28.3 | Very low | 151 Ų | 151 | 137.4 Ų | 137.4 | 81% | 0.807 | 75% | 0.746 | S | S | * | * | trans | -69 | 133.6 | 178.4 | -78 | -27.3 | 0 | 0 | 0 | 112.3 | ||||
| 323 | T | 30.2 | Very low | 28.1 | Very low | 142 Ų | 142 | 131.1 Ų | 131.1 | 87% | 0.871 | 73% | 0.73 | S | S | * | * | trans | -99.5 | 108.9 | 142.5 | 49.1 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 324 | T | 30.8 | Very low | 27.8 | Very low | 87 Ų | 87 | 131.2 Ų | 131.2 | 53% | 0.534 | 73% | 0.725 | S | S | . | * | trans | -67.9 | 171.5 | -167.1 | -29.9 | 0 | 0 | 0 | 0 | 113 | W326 | T324-W326 PolarHBondContact O-NE1 3.38Å; T324-W326 VanDerWaalsContact O-NE1 3.13Å | ||
| 325 | S | 27.2 | Very low | 27.7 | Very low | 122 Ų | 122 | 130.6 Ų | 130.6 | 85% | 0.853 | 73% | 0.73 | S | S | * | * | trans | -133.7 | 117.8 | 146.1 | -178 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 326 | W | 26.2 | Very low | 27.7 | Very low | 215 Ų | 215 | 128.8 Ų | 128.8 | 81% | 0.814 | 73% | 0.728 | S | S | * | * | cis | -150.5 | 18.1 | -40.8 | -124.1 | 107.1 | 0 | 0 | 0 | 109.6 | T324 | T324-W326 PolarHBondContact O-NE1 3.38Å; T324-W326 VanDerWaalsContact O-NE1 3.13Å | ||
| 327 | R | 28.7 | Very low | 27.5 | Very low | 227 Ų | 227 | 131.4 Ų | 131.4 | 86% | 0.857 | 73% | 0.732 | S | S | * | * | trans | -129.8 | -20.2 | -147.6 | -140 | -179.5 | -161.3 | 121 | 9.4 | 117 | ||||
| 328 | D | 28.9 | Very low | 27.6 | Very low | 131 Ų | 131 | 131 Ų | 131 | 70% | 0.701 | 72% | 0.72 | S | S | * | * | trans | -128 | 112.5 | -163.5 | -74.7 | -70.7 | 0 | 0 | 0 | 112.6 | ||||
| 329 | L | 25.6 | Very low | 27.7 | Very low | 129 Ų | 129 | 131 Ų | 131 | 68% | 0.675 | 71% | 0.71 | S | S | * | * | trans | 56.3 | 112.4 | 143.3 | -35.7 | 175.6 | 0 | 0 | 0 | 116.7 | ||||
| 330 | F | 29 | Very low | 27.8 | Very low | 181 Ų | 181 | 134.1 Ų | 134.1 | 79% | 0.794 | 71% | 0.71 | S | S | * | * | cis | -170.5 | -179.2 | 1.1 | -90.5 | -53.2 | 0 | 0 | 0 | 106.4 | ||||
| 331 | P | 30.7 | Very low | 27.9 | Very low | 105 Ų | 105 | 132.8 Ų | 132.8 | 68% | 0.682 | 70% | 0.703 | S | S | * | * | cis | -124.9 | 136.7 | -5.9 | 33 | -15.2 | 0 | 0 | 0 | 114.4 | C333 | P331-C333 HydrophobicContact CB-CB 4.33Š| ||
| 332 | E | 25.9 | Very low | 28.1 | Very low | 158 Ų | 158 | 133.6 Ų | 133.6 | 74% | 0.738 | 70% | 0.701 | S | S | * | * | trans | -84.9 | 148.3 | 134.1 | -161.3 | 179.7 | -136 | 0 | 0 | 107.5 | H928 | E332-H928 IonicContact OE1-CD2 2.74Å; E332-H928 IonicContact OE1-NE2 3.69Å | ||
| 333 | C | 22.4 | Very low | 27.8 | Very low | 56 Ų | 56 | 135.3 Ų | 135.3 | 38% | 0.378 | 70% | 0.697 | S | S | . | * | trans | -163.8 | 163.1 | -171 | -158.6 | 0 | 0 | 0 | 0 | 104.8 | P331 V926 N927 | P331-C333 HydrophobicContact CB-CB 4.33Å; C333-V926 HydrophobicContact CB-CB 4.29Å; C333-V926 HydrophobicContact CB-CG1 4.2Å; C333-V926 HydrophobicContact CB-CG2 3.62Å; C333-V926 VanDerWaalsContact O-CB 3.3Å; C333-V926 WeakPolarHBondContact O-CB 3.46Å; C333-N927 PolarHBondContact O-OD1 3.22Å; C333-N927 VanDerWaalsContact O-OD1 3.07Å | ||
| 334 | K | 25 | Very low | 27.8 | Very low | 113 Ų | 113 | 135.5 Ų | 135.5 | 49% | 0.491 | 69% | 0.693 | S | S | . | * | cis | -86.8 | -108.7 | 26 | -158.7 | -158.5 | -107 | 78.5 | 0 | 111.7 | G925 V926 N927 | K334-G925 PolarHBondContact NZ-O 3.25Å; K334-V926 HydrophobicContact CB-CB 4.31Å; K334-V926 HydrophobicContact CB-CG2 3.63Å; K334-V926 HydrophobicContact CG-CG2 4.07Å; K334-V926 PolarHBondContact NZ-O 2.97Å; K334-N927 HydrophobicContact CB-CB 3.79Å; K334-N927 PolarHBondContact N-OD1 3.17Å | ||
| 335 | D | 25.6 | Very low | 27.7 | Very low | 91 Ų | 91 | 137.4 Ų | 137.4 | 49% | 0.487 | 70% | 0.699 | S | S | . | * | cis | -150.5 | 161.9 | -15.1 | -145.1 | -33.2 | 0 | 0 | 0 | 109.8 | N927 | D335-N927 VanDerWaalsContact CB-ND2 3.33Å; D335-N927 WeakPolarHBondContact CB-ND2 3.1Å; D335-N927 WeakPolarHBondContact OD2-CB 3.34Å; D335-N927 VanDerWaalsContact OD2-CG 3.32Å; D335-N927 PolarHBondContact OD2-ND2 3.26Å | ||
| 336 | S | 28.6 | Very low | 27.7 | Very low | 99 Ų | 99 | 135.9 Ų | 135.9 | 69% | 0.692 | 69% | 0.689 | S | S | * | * | trans | 59.6 | 121.1 | -166.3 | 35.1 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 337 | E | 25.9 | Very low | 27.8 | Very low | 175 Ų | 175 | 133.3 Ų | 133.3 | 82% | 0.818 | 69% | 0.686 | S | S | * | * | 63 | 139.2 | 65.7 | -73.4 | -73.9 | 105.3 | 0 | 0 | 112.6 | |||||
| 338 | P | 28 | Very low | 27.8 | Very low | 96 Ų | 96 | 129.3 Ų | 129.3 | 62% | 0.623 | 68% | 0.682 | S | S | * | * | -121.7 | -139.6 | -125.5 | 31 | -12 | 0 | 0 | 0 | 112.9 | |||||
| 339 | I | 27.5 | Very low | 27.9 | Very low | 138 Ų | 138 | 126.5 Ų | 126.5 | 71% | 0.708 | 68% | 0.684 | S | S | * | * | trans | 104.8 | 136.6 | 155 | -60.2 | 156 | 0 | 0 | 0 | 118 | ||||
| 340 | N | 30.5 | Very low | 28.2 | Very low | 134 Ų | 134 | 127 Ų | 127 | 72% | 0.717 | 69% | 0.686 | S | S | * | * | trans | 72.2 | 115.6 | 170.6 | -64.2 | -20.1 | 0 | 0 | 0 | 118.1 | ||||
| 341 | L | 28.8 | Very low | 28.3 | Very low | 151 Ų | 151 | 124.4 Ų | 124.4 | 79% | 0.791 | 68% | 0.68 | S | S | * | * | cis | 92.7 | 147.9 | 49.3 | -81.5 | 179.5 | 0 | 0 | 0 | 112.8 | ||||
| 342 | P | 32.5 | Very low | 28.5 | Very low | 105 Ų | 105 | 127.3 Ų | 127.3 | 68% | 0.682 | 68% | 0.684 | S | S | * | * | cis | -120.4 | 175.1 | -19.6 | 44.6 | -31.3 | 0 | 0 | 0 | 110.3 | ||||
| 343 | Y | 25.5 | Very low | 29 | Very low | 187 Ų | 187 | 124.5 Ų | 124.5 | 73% | 0.733 | 68% | 0.682 | S | S | * | * | cis | 59.9 | 131 | 44.6 | -115.7 | -83.8 | 0 | 0 | 0 | 116.9 | N345 | Y343-N345 HydrophobicContact CD1-CB 4.2Å; Y343-N345 HydrophobicContact CE1-CB 4.22Å | ||
| 344 | N | 31.3 | Very low | 29.6 | Very low | 146 Ų | 146 | 129 Ų | 129 | 78% | 0.781 | 70% | 0.702 | S | S | * | * | trans | 125 | 100.7 | 175.2 | -71.1 | -2.2 | 0 | 0 | 0 | 110.5 | ||||
| 345 | N | 28.2 | Very low | 30.2 | Very low | 126 Ų | 126 | 127.7 Ų | 127.7 | 67% | 0.674 | 71% | 0.713 | S | S | * | * | cis | 71.1 | 145.6 | 19.2 | -147.1 | 31.1 | 0 | 0 | 0 | 114.6 | Y343 | Y343-N345 HydrophobicContact CD1-CB 4.2Å; Y343-N345 HydrophobicContact CE1-CB 4.22Å | ||
| 346 | S | 27.7 | Very low | 30.9 | Very low | 91 Ų | 91 | 128.4 Ų | 128.4 | 64% | 0.636 | 72% | 0.722 | S | S | * | * | trans | 71.5 | 154.8 | -170.6 | 83.6 | 0 | 0 | 0 | 0 | 115 | ||||
| 347 | E | 28.2 | Very low | 31.2 | Very low | 160 Ų | 160 | 131.3 Ų | 131.3 | 75% | 0.748 | 73% | 0.725 | S | S | * | * | cis | -154.8 | 143.7 | 7.6 | -150.8 | 142.4 | -122.4 | 0 | 0 | 115.3 | ||||
| 348 | N | 28.2 | Very low | 31.4 | Very low | 143 Ų | 143 | 131.7 Ų | 131.7 | 77% | 0.765 | 72% | 0.724 | S | S | * | * | trans | 19.5 | 143.3 | 150.5 | -56.1 | -30.6 | 0 | 0 | 0 | 124.6 | ||||
| 349 | G | 32.1 | Very low | 31.7 | Very low | 73 Ų | 73 | 130.2 Ų | 130.2 | 75% | 0.753 | 73% | 0.726 | S | S | * | * | trans | 145.5 | 88 | 158.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 350 | I | 30 | Very low | 31.9 | Very low | 139 Ų | 139 | 128 Ų | 128 | 71% | 0.713 | 73% | 0.729 | S | S | * | * | 77.6 | 105.8 | 58.3 | -56.7 | 179.6 | 0 | 0 | 0 | 114.5 | |||||
| 351 | N | 31.5 | Very low | 31.9 | Very low | 126 Ų | 126 | 130.6 Ų | 130.6 | 67% | 0.674 | 74% | 0.737 | S | S | * | * | trans | 64.8 | 118.2 | 153 | -61.5 | -2.7 | 0 | 0 | 0 | 122.9 | ||||
| 352 | H | 36 | Very low | 31.9 | Very low | 166 Ų | 166 | 127.3 Ų | 127.3 | 77% | 0.769 | 73% | 0.731 | S | S | * | * | 151.7 | 136.3 | 98.4 | -92.7 | -50.6 | 0 | 0 | 0 | 115.3 | |||||
| 353 | S | 36.3 | Very low | 32.2 | Very low | 99 Ų | 99 | 127.7 Ų | 127.7 | 69% | 0.692 | 73% | 0.734 | S | S | * | * | trans | 59.4 | 147.6 | 152.2 | 52.6 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 354 | N | 34.8 | Very low | 32.3 | Very low | 150 Ų | 150 | 124.1 Ų | 124.1 | 80% | 0.802 | 74% | 0.736 | S | S | * | * | cis | -156.5 | 128.9 | -9.8 | -94.8 | -11.3 | 0 | 0 | 0 | 105.8 | ||||
| 355 | A | 37.6 | Very low | 32.1 | Very low | 86 Ų | 86 | 120.5 Ų | 120.5 | 71% | 0.711 | 73% | 0.733 | S | S | * | * | 72.1 | 146.4 | 84.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 356 | P | 41 | Very low | 32.1 | Very low | 106 Ų | 106 | 121.6 Ų | 121.6 | 69% | 0.688 | 74% | 0.738 | S | S | * | * | cis | -141.8 | -170 | -25.3 | 41.4 | -23 | 0 | 0 | 0 | 114.9 | ||||
| 357 | E | 33 | Very low | 32 | Very low | 160 Ų | 160 | 128.5 Ų | 128.5 | 75% | 0.748 | 75% | 0.751 | S | S | * | * | trans | 70.3 | 146 | 156.1 | -75.8 | 169.8 | -163.5 | 0 | 0 | 119.4 | ||||
| 358 | F | 31.8 | Very low | 31.7 | Very low | 183 Ų | 183 | 126 Ų | 126 | 80% | 0.803 | 75% | 0.751 | S | S | * | * | cis | -148.8 | 146.9 | 3.6 | -129 | -62.8 | 0 | 0 | 0 | 111 | ||||
| 359 | G | 33.9 | Very low | 31.6 | Very low | 65 Ų | 65 | 124 Ų | 124 | 67% | 0.67 | 75% | 0.748 | S | S | * | * | trans | 84.1 | 105 | 169.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 360 | A | 31.4 | Very low | 31.2 | Very low | 93 Ų | 93 | 125.7 Ų | 125.7 | 77% | 0.769 | 75% | 0.748 | S | S | * | * | cis | 69.4 | 131 | 39 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 361 | H | 30.9 | Very low | 31 | Very low | 188 Ų | 188 | 126 Ų | 126 | 87% | 0.87 | 75% | 0.75 | S | S | * | * | cis | -160.8 | 163.9 | -15.2 | -125.3 | -84 | 0 | 0 | 0 | 108.6 | ||||
| 362 | A | 28.4 | Very low | 30.8 | Very low | 81 Ų | 81 | 127.5 Ų | 127.5 | 67% | 0.669 | 75% | 0.753 | S | S | * | * | trans | -92.1 | -174.5 | 166.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 363 | P | 38.4 | Very low | 30.4 | Very low | 114 Ų | 114 | 125.6 Ų | 125.6 | 74% | 0.74 | 75% | 0.748 | S | S | * | * | cis | -125.9 | -142.5 | -18.9 | 34.9 | -13.1 | 0 | 0 | 0 | 110.3 | ||||
| 364 | S | 28.5 | Very low | 29.9 | Very low | 111 Ų | 111 | 127.1 Ų | 127.1 | 78% | 0.776 | 75% | 0.753 | S | S | * | * | trans | 85.3 | 118.2 | 154.2 | -49.4 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 365 | G | 26.7 | Very low | 29.5 | Very low | 71 Ų | 71 | 125.9 Ų | 125.9 | 73% | 0.732 | 75% | 0.751 | S | S | * | * | 92.9 | 154.3 | 114.8 | 0 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 366 | L | 27.3 | Very low | 29 | Very low | 149 Ų | 149 | 127 Ų | 127 | 78% | 0.78 | 75% | 0.753 | S | S | * | * | trans | 70.3 | 121 | 149.5 | -55 | 171.8 | 0 | 0 | 0 | 120.5 | ||||
| 367 | W | 25.4 | Very low | 28.5 | Very low | 235 Ų | 235 | 126.4 Ų | 126.4 | 89% | 0.89 | 75% | 0.752 | S | S | * | * | trans | 70.7 | 119.3 | 138.7 | -63.8 | 14.6 | 0 | 0 | 0 | 116.5 | ||||
| 368 | S | 23.1 | Very low | 28.4 | Very low | 109 Ų | 109 | 127.4 Ų | 127.4 | 76% | 0.762 | 76% | 0.759 | S | S | * | * | 83.3 | 157.1 | 75.4 | -161.3 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 369 | S | 24.8 | Very low | 28.3 | Very low | 101 Ų | 101 | 122.8 Ų | 122.8 | 71% | 0.706 | 75% | 0.749 | S | S | * | * | trans | 77.9 | 111.1 | 171.8 | -50.8 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 370 | S | 24.7 | Very low | 28.1 | Very low | 107 Ų | 107 | 126.5 Ų | 126.5 | 75% | 0.748 | 75% | 0.752 | S | S | * | * | 54.9 | 125.1 | 122.6 | -52.4 | 0 | 0 | 0 | 0 | 122.2 | |||||
| 371 | I | 25.1 | Very low | 28 | Very low | 146 Ų | 146 | 127.6 Ų | 127.6 | 75% | 0.749 | 75% | 0.754 | S | S | * | * | 18.2 | 116.4 | 116.6 | -54.3 | 169.4 | 0 | 0 | 0 | 115.5 | |||||
| 372 | H | 27.9 | Very low | 28.1 | Very low | 158 Ų | 158 | 122.4 Ų | 122.4 | 73% | 0.731 | 74% | 0.744 | S | S | * | * | -171.9 | 148.7 | 120.8 | -105.1 | -67 | 0 | 0 | 0 | 113.6 | |||||
| 373 | N | 27.6 | Very low | 28.3 | Very low | 126 Ų | 126 | 123.6 Ų | 123.6 | 67% | 0.674 | 75% | 0.747 | S | S | * | * | trans | 51.5 | 125.1 | 148.6 | -60.7 | 0.4 | 0 | 0 | 0 | 119.3 | ||||
| 374 | V | 25.8 | Very low | 28 | Very low | 131 Ų | 131 | 123.6 Ų | 123.6 | 79% | 0.794 | 75% | 0.75 | S | S | * | * | cis | 59.2 | 89.4 | 42.3 | -167.7 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 375 | T | 27 | Very low | 28.4 | Very low | 124 Ų | 124 | 123.8 Ų | 123.8 | 76% | 0.761 | 75% | 0.748 | S | S | * | * | trans | -163 | 123.9 | 140.4 | 21.6 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 376 | S | 26.7 | Very low | 28.8 | Very low | 109 Ų | 109 | 127.9 Ų | 127.9 | 76% | 0.762 | 75% | 0.753 | S | S | * | * | trans | 64.2 | 156.1 | 140.8 | -43.4 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 377 | S | 30 | Very low | 28.8 | Very low | 94 Ų | 94 | 125.3 Ų | 125.3 | 66% | 0.657 | 75% | 0.747 | S | S | * | * | cis | -155.6 | 149.4 | 7.5 | -17.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 378 | M | 30.4 | Very low | 29.1 | Very low | 181 Ų | 181 | 120.3 Ų | 120.3 | 89% | 0.892 | 74% | 0.743 | S | S | * | * | trans | 66.3 | 148 | 146.2 | -64.3 | 176.3 | 179.6 | 0 | 0 | 118.3 | ||||
| 379 | S | 30 | Very low | 29.4 | Very low | 85 Ų | 85 | 123.2 Ų | 123.2 | 59% | 0.594 | 74% | 0.744 | S | S | * | * | cis | -164.7 | 141.9 | -9.7 | -105.5 | 0 | 0 | 0 | 0 | 113 | ||||
| 380 | I | 30.2 | Very low | 29.7 | Very low | 144 Ų | 144 | 123.3 Ų | 123.3 | 74% | 0.738 | 74% | 0.743 | S | S | * | * | trans | 63.4 | 105 | 134.2 | -56.8 | 167.5 | 0 | 0 | 0 | 119.6 | ||||
| 381 | S | 29.5 | Very low | 29.9 | Very low | 115 Ų | 115 | 122.4 Ų | 122.4 | 80% | 0.804 | 73% | 0.733 | S | S | * | * | trans | 72.8 | 161.6 | 142.2 | 86.2 | 0 | 0 | 0 | 0 | 119 | ||||
| 382 | A | 32.3 | Very low | 30.2 | Very low | 80 Ų | 80 | 123.3 Ų | 123.3 | 66% | 0.661 | 74% | 0.737 | S | S | * | * | cis | -153.9 | 171.7 | 2.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 383 | S | 33.9 | Very low | 30.2 | Very low | 106 Ų | 106 | 122.7 Ų | 122.7 | 74% | 0.741 | 74% | 0.738 | S | S | * | * | trans | 59.4 | 98 | 153.8 | 46.4 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 384 | S | 32 | Very low | 30.1 | Very low | 113 Ų | 113 | 125.7 Ų | 125.7 | 79% | 0.79 | 75% | 0.746 | S | S | * | * | 20 | 152.7 | 100.9 | -43.8 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 385 | P | 36.8 | Very low | 30.2 | Very low | 115 Ų | 115 | 122.8 Ų | 122.8 | 75% | 0.747 | 74% | 0.742 | S | S | * | * | cis | -139.5 | -162.2 | 28.3 | 44.8 | -24.6 | 0 | 0 | 0 | 113.3 | ||||
| 386 | L | 33.6 | Very low | 30 | Very low | 157 Ų | 157 | 121.9 Ų | 121.9 | 82% | 0.822 | 74% | 0.741 | S | S | * | * | cis | -151.4 | 164.8 | 6.2 | -165.9 | 56.6 | 0 | 0 | 0 | 111.7 | ||||
| 387 | S | 27.6 | Very low | 29.9 | Very low | 95 Ų | 95 | 121.2 Ų | 121.2 | 66% | 0.664 | 74% | 0.743 | S | S | * | * | trans | -31 | 152.9 | 156.4 | -135.6 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 388 | T | 32.9 | Very low | 29.8 | Very low | 130 Ų | 130 | 125.9 Ų | 125.9 | 80% | 0.798 | 76% | 0.756 | S | S | * | * | cis | -149.8 | 136.2 | 45.4 | 50.9 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 389 | Q | 28.6 | Very low | 29.5 | Very low | 171 Ų | 171 | 120.5 Ų | 120.5 | 80% | 0.799 | 75% | 0.747 | S | S | * | * | trans | -72.8 | 173.4 | 150.9 | -145.4 | -164.4 | 69 | 0 | 0 | 109 | ||||
| 390 | P | 31.2 | Very low | 29.2 | Very low | 103 Ų | 103 | 123.9 Ų | 123.9 | 67% | 0.669 | 76% | 0.758 | S | S | * | * | -163.1 | -172.9 | 79.4 | 45.2 | -23.4 | 0 | 0 | 0 | 117.4 | |||||
| 391 | T | 30.1 | Very low | 28.9 | Very low | 88 Ų | 88 | 122.6 Ų | 122.6 | 54% | 0.54 | 76% | 0.756 | S | S | . | * | trans | 76.6 | 110.7 | 137.4 | -65.9 | 0 | 0 | 0 | 0 | 120.5 | L393 | T391-L393 HydrophobicContact CG2-CB 3.5Å; T391-L393 HydrophobicContact CG2-CD1 3.74Å; T391-L393 HydrophobicContact CG2-CG 4.17Å | ||
| 392 | I | 30.9 | Very low | 28.7 | Very low | 164 Ų | 164 | 121.5 Ų | 121.5 | 84% | 0.841 | 75% | 0.749 | S | S | * | * | trans | -82.6 | 130.3 | 130.1 | -66.3 | 171.7 | 0 | 0 | 0 | 106.8 | ||||
| 393 | L | 26.5 | Very low | 28.5 | Very low | 145 Ų | 145 | 125.6 Ų | 125.6 | 76% | 0.759 | 75% | 0.754 | S | S | * | * | trans | -126.6 | 142.5 | 168.8 | -138.8 | 74.9 | 0 | 0 | 0 | 111.3 | T391 | T391-L393 HydrophobicContact CG2-CB 3.5Å; T391-L393 HydrophobicContact CG2-CD1 3.74Å; T391-L393 HydrophobicContact CG2-CG 4.17Å | ||
| 394 | F | 27.1 | Very low | 28.2 | Very low | 189 Ų | 189 | 125 Ų | 125 | 83% | 0.829 | 75% | 0.75 | S | S | * | * | trans | -77.2 | 146.7 | 162.5 | -98.4 | -115.1 | 0 | 0 | 0 | 111 | ||||
| 395 | G | 26.2 | Very low | 28.1 | Very low | 70 Ų | 70 | 126 Ų | 126 | 72% | 0.722 | 75% | 0.747 | S | S | * | * | trans | 179.4 | 79.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 396 | S | 24 | Very low | 27.9 | Very low | 105 Ų | 105 | 125.9 Ų | 125.9 | 73% | 0.734 | 74% | 0.74 | S | S | * | * | 71.6 | 131.9 | 64.7 | -56.9 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 397 | A | 23.6 | Very low | 27.8 | Very low | 96 Ų | 96 | 124.8 Ų | 124.8 | 79% | 0.793 | 73% | 0.733 | S | S | * | * | trans | 68.8 | 111.7 | 167.5 | 0 | 0 | 0 | 0 | 0 | 118.8 | G399 | A397-G399 PolarHBondContact O-N 3.5Š| ||
| 398 | M | 28.2 | Very low | 28 | Very low | 191 Ų | 191 | 126.5 Ų | 126.5 | 94% | 0.941 | 74% | 0.735 | S | S | * | * | -7.6 | 116 | 126.9 | -63.9 | -97.3 | -91.3 | 0 | 0 | 114.9 | |||||
| 399 | G | 24.5 | Very low | 27.8 | Very low | 68 Ų | 68 | 124.6 Ų | 124.6 | 70% | 0.701 | 72% | 0.723 | S | S | * | * | trans | -161.5 | 75.1 | 177 | 0 | 0 | 0 | 0 | 0 | 110 | A397 | A397-G399 PolarHBondContact O-N 3.5Š| ||
| 400 | L | 23.6 | Very low | 27.8 | Very low | 156 Ų | 156 | 122.8 Ų | 122.8 | 82% | 0.817 | 72% | 0.718 | S | S | * | * | 92.1 | 120.9 | 85.3 | -81.5 | 169 | 0 | 0 | 0 | 112.7 | |||||
| 401 | V | 23.9 | Very low | 27.7 | Very low | 117 Ų | 117 | 123.9 Ų | 123.9 | 71% | 0.709 | 72% | 0.715 | S | S | * | * | trans | 59.3 | 107.2 | 142.7 | -175.5 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 402 | S | 26.3 | Very low | 27.7 | Very low | 93 Ų | 93 | 125.7 Ų | 125.7 | 65% | 0.65 | 72% | 0.717 | S | S | * | * | -172.3 | 119.5 | 105.9 | -93.2 | 0 | 0 | 0 | 0 | 107.2 | |||||
| 403 | E | 26.9 | Very low | 27.7 | Very low | 166 Ų | 166 | 120.3 Ų | 120.3 | 78% | 0.776 | 69% | 0.694 | S | S | * | * | 69.9 | 130.3 | 91.9 | -68.9 | 166.7 | 130.1 | 0 | 0 | 112.8 | |||||
| 404 | S | 28.3 | Very low | 27.9 | Very low | 94 Ų | 94 | 120.1 Ų | 120.1 | 66% | 0.657 | 69% | 0.689 | S | S | * | * | cis | -165.1 | 156.6 | 5.4 | 45.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 405 | N | 29.2 | Very low | 28 | Very low | 134 Ų | 134 | 120.2 Ų | 120.2 | 72% | 0.717 | 68% | 0.684 | S | S | * | * | trans | 64.4 | 145.4 | 147 | -70.4 | 37.5 | 0 | 0 | 0 | 118.7 | ||||
| 406 | D | 32.8 | Very low | 28.1 | Very low | 112 Ų | 112 | 122.5 Ų | 122.5 | 60% | 0.599 | 68% | 0.683 | S | S | * | * | cis | -157.2 | 153.2 | 5.1 | -117.6 | -19.9 | 0 | 0 | 0 | 112 | ||||
| 407 | I | 31.6 | Very low | 28.2 | Very low | 134 Ų | 134 | 123.4 Ų | 123.4 | 69% | 0.687 | 68% | 0.679 | S | S | * | * | trans | 41.9 | 120.8 | 131.2 | -68.4 | 169.6 | 0 | 0 | 0 | 116.9 | ||||
| 408 | D | 31.8 | Very low | 28.4 | Very low | 131 Ų | 131 | 126.6 Ų | 126.6 | 70% | 0.701 | 68% | 0.678 | S | S | * | * | cis | -167.8 | 158.8 | 20.9 | -138.9 | -11.6 | 0 | 0 | 0 | 117.8 | ||||
| 409 | T | 29.2 | Very low | 28.3 | Very low | 90 Ų | 90 | 123 Ų | 123 | 55% | 0.552 | 66% | 0.662 | S | S | * | * | trans | 61.4 | 108.1 | 130.1 | -80.8 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 410 | L | 28.7 | Very low | 28.4 | Very low | 132 Ų | 132 | 127.1 Ų | 127.1 | 69% | 0.691 | 66% | 0.663 | S | S | * | * | 65.1 | 152.9 | 117.7 | -49.9 | -172.7 | 0 | 0 | 0 | 119.7 | |||||
| 411 | Q | 28.8 | Very low | 28.6 | Very low | 126 Ų | 126 | 123.9 Ų | 123.9 | 59% | 0.589 | 65% | 0.654 | S | S | * | * | cis | -165.8 | 147.7 | -13.8 | -118.4 | 177.1 | -31.4 | 0 | 0 | 111 | ||||
| 412 | H | 30.5 | Very low | 28.6 | Very low | 126 Ų | 126 | 125.4 Ų | 125.4 | 58% | 0.583 | 66% | 0.658 | S | S | * | * | trans | 62.7 | 159.3 | 135.1 | -70.9 | -1 | 0 | 0 | 0 | 120.5 | A577 | H412-A577 WeakPolarHBondContact O-CB 3.47Š| ||
| 413 | S | 30.2 | Very low | 28.6 | Very low | 52 Ų | 52 | 125 Ų | 125 | 36% | 0.364 | 66% | 0.661 | S | S | . | * | cis | -172.1 | 172.9 | -24.1 | 55.6 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 414 | H | 31.2 | Very low | 28.6 | Very low | 140 Ų | 140 | 127.3 Ų | 127.3 | 65% | 0.648 | 66% | 0.663 | S | S | * | * | trans | 73.9 | 149.1 | 139 | -78.3 | -18.4 | 0 | 0 | 0 | 118.4 | ||||
| 415 | R | 28.3 | Very low | 28.4 | Very low | 192 Ų | 192 | 128.7 Ų | 128.7 | 73% | 0.725 | 66% | 0.663 | S | S | * | * | cis | -174.5 | 178.6 | -11.4 | -173.6 | -175.4 | -146.5 | -179.9 | 8.7 | 106.9 | ||||
| 416 | V | 28.5 | Very low | 28.2 | Very low | 118 Ų | 118 | 128.3 Ų | 128.3 | 72% | 0.715 | 66% | 0.662 | S | S | * | * | trans | 76.9 | 137.5 | 162.9 | -171.2 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 417 | L | 27.1 | Very low | 27.8 | Very low | 124 Ų | 124 | 128.8 Ų | 128.8 | 65% | 0.649 | 67% | 0.668 | S | S | * | * | cis | 169.8 | 155.9 | -37.2 | -105.5 | 162.6 | 0 | 0 | 0 | 105.6 | ||||
| 418 | Q | 27 | Very low | 27.5 | Very low | 163 Ų | 163 | 127 Ų | 127 | 76% | 0.762 | 66% | 0.664 | S | S | * | * | trans | 65.3 | 165.4 | 154.3 | -72.7 | 163.3 | -69.5 | 0 | 0 | 115.9 | ||||
| 419 | D | 26.3 | Very low | 27.3 | Very low | 116 Ų | 116 | 128 Ų | 128 | 62% | 0.62 | 67% | 0.666 | S | S | * | * | cis | -171.3 | 172 | -31.3 | -174.4 | 21.6 | 0 | 0 | 0 | 106.1 | ||||
| 420 | Q | 27.1 | Very low | 27.5 | Very low | 154 Ų | 154 | 130.5 Ų | 130.5 | 72% | 0.72 | 68% | 0.684 | S | S | * | * | trans | 64.5 | 120.2 | 167.8 | -69.7 | 148.2 | 56.7 | 0 | 0 | 115.4 | ||||
| 421 | S | 26.3 | Very low | 27.5 | Very low | 88 Ų | 88 | 132.6 Ų | 132.6 | 62% | 0.615 | 68% | 0.683 | S | S | * | * | 85.6 | 133.7 | 57.5 | 87.1 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 422 | D | 25.3 | Very low | 27.4 | Very low | 148 Ų | 148 | 131.1 Ų | 131.1 | 79% | 0.791 | 69% | 0.686 | S | S | * | * | trans | 71.6 | 142.8 | 160.1 | -51.9 | -52.5 | 0 | 0 | 0 | 121.9 | ||||
| 423 | A | 25.9 | Very low | 27.3 | Very low | 86 Ų | 86 | 132.4 Ų | 132.4 | 71% | 0.711 | 70% | 0.697 | S | S | * | * | trans | 72.9 | 127.8 | 144 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 424 | Y | 26.2 | Very low | 27.1 | Very low | 213 Ų | 213 | 133.2 Ų | 133.2 | 84% | 0.835 | 71% | 0.707 | S | S | * | * | trans | 69.2 | 119.7 | 134.7 | -89.9 | -110 | 0 | 0 | 0 | 121.8 | ||||
| 425 | N | 25.2 | Very low | 26.9 | Very low | 123 Ų | 123 | 131.7 Ų | 131.7 | 66% | 0.658 | 71% | 0.712 | S | S | * | * | trans | 76.4 | 151.7 | 133 | -87.6 | 36.2 | 0 | 0 | 0 | 123.4 | ||||
| 426 | D | 24 | Very low | 26.8 | Very low | 127 Ų | 127 | 128.3 Ų | 128.3 | 68% | 0.679 | 71% | 0.708 | S | S | * | * | trans | 64 | 109.5 | 150.3 | -71.2 | -57.5 | 0 | 0 | 0 | 121.9 | ||||
| 427 | V | 25.6 | Very low | 26.7 | Very low | 122 Ų | 122 | 132 Ų | 132 | 74% | 0.739 | 72% | 0.715 | S | S | * | * | 36 | 113.6 | 117.3 | -174.4 | 0 | 0 | 0 | 0 | 117.7 | |||||
| 428 | T | 25 | Very low | 26.7 | Very low | 97 Ų | 97 | 130.2 Ų | 130.2 | 60% | 0.595 | 72% | 0.718 | S | S | * | * | -172.3 | 146.2 | 114.7 | -77.9 | 0 | 0 | 0 | 0 | 111.8 | R431 | T428-R431 HydrophobicContact CG2-CB 4.3Š| |||
| 429 | M | 26.4 | Very low | 27.1 | Very low | 151 Ų | 151 | 130.1 Ų | 130.1 | 74% | 0.744 | 72% | 0.717 | S | S | * | * | trans | -68.1 | 168 | 176.7 | -61.7 | 170.8 | 167.3 | 0 | 0 | 113.9 | R431 | M429-R431 HydrophobicContact CB-CB 4.21Å; M429-R431 PolarHBondContact O-N 2.85Å | ||
| 430 | P | 35.2 | Very low | 27.6 | Very low | 142 Ų | 142 | 130.4 Ų | 130.4 | 92% | 0.922 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -59.7 | 86.6 | 139.2 | 30.3 | -33.4 | 0 | 0 | 0 | 108.8 | ||
| 431 | R | 27.6 | Very low | 27.8 | Very low | 177 Ų | 177 | 129.2 Ų | 129.2 | 67% | 0.668 | 72% | 0.724 | S | S | * | * | trans | -92.1 | 165.3 | -170.1 | -164.9 | 176.7 | -174.8 | 161.2 | -0.5 | 110.4 | T428 M429 | T428-R431 HydrophobicContact CG2-CB 4.3Å; M429-R431 HydrophobicContact CB-CB 4.21Å; M429-R431 PolarHBondContact O-N 2.85Å | ||
| 432 | S | 27.4 | Very low | 27.9 | Very low | 95 Ų | 95 | 129.5 Ų | 129.5 | 66% | 0.664 | 73% | 0.726 | S | S | * | * | trans | 76.8 | 139 | 163.8 | 91 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 433 | N | 26.7 | Very low | 28.1 | Very low | 152 Ų | 152 | 128.3 Ų | 128.3 | 81% | 0.813 | 72% | 0.724 | S | S | * | * | cis | -144.7 | 158 | 5.4 | -80.3 | -62.5 | 0 | 0 | 0 | 110.9 | ||||
| 434 | A | 27.6 | Very low | 28.2 | Very low | 70 Ų | 70 | 130.8 Ų | 130.8 | 58% | 0.579 | 73% | 0.725 | S | S | * | * | cis | -171 | 135 | -23.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 435 | S | 26.8 | Very low | 28.4 | Very low | 107 Ų | 107 | 127.5 Ų | 127.5 | 75% | 0.748 | 72% | 0.72 | S | S | * | * | trans | 62.1 | 177.8 | 143.7 | 76.7 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 436 | L | 25.6 | Very low | 28.7 | Very low | 121 Ų | 121 | 128.7 Ų | 128.7 | 63% | 0.634 | 73% | 0.727 | S | S | * | * | cis | -156.2 | 118.1 | 2.6 | -148 | 139.3 | 0 | 0 | 0 | 111.2 | ||||
| 437 | F | 26.1 | Very low | 29.4 | Very low | 196 Ų | 196 | 126.8 Ų | 126.8 | 86% | 0.86 | 72% | 0.721 | S | S | * | * | trans | 61.9 | 168.5 | 157.7 | -73 | -128.5 | 0 | 0 | 0 | 117.5 | ||||
| 438 | A | 28.5 | Very low | 29.6 | Very low | 87 Ų | 87 | 131.8 Ų | 131.8 | 72% | 0.719 | 73% | 0.727 | S | S | * | * | cis | -145.8 | 167.8 | 2.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 439 | Q | 34 | Very low | 29.9 | Very low | 160 Ų | 160 | 131.2 Ų | 131.2 | 75% | 0.748 | 73% | 0.726 | S | S | * | * | trans | -79.1 | 167.4 | 154.5 | -51.7 | -177.8 | -30.3 | 0 | 0 | 110 | N441 | Q439-N441 HydrophobicContact CB-CB 4.45Š| ||
| 440 | P | 36.8 | Very low | 30.2 | Very low | 122 Ų | 122 | 130.4 Ų | 130.4 | 79% | 0.792 | 73% | 0.73 | S | S | * | * | -127.3 | 157.9 | 68.3 | 14.4 | 8.9 | 0 | 0 | 0 | 112.7 | |||||
| 441 | N | 30.9 | Very low | 30.1 | Very low | 130 Ų | 130 | 127.8 Ų | 127.8 | 70% | 0.695 | 72% | 0.721 | S | S | * | * | cis | 80.2 | 152.4 | 27.2 | -155.3 | 6.4 | 0 | 0 | 0 | 114.7 | Q439 | Q439-N441 HydrophobicContact CB-CB 4.45Š| ||
| 442 | S | 29.8 | Very low | 30.1 | Very low | 93 Ų | 93 | 128.4 Ų | 128.4 | 65% | 0.65 | 73% | 0.728 | S | S | * | * | trans | 77.5 | 144.3 | -175.2 | -24.6 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 443 | T | 28.9 | Very low | 30.4 | Very low | 124 Ų | 124 | 135.3 Ų | 135.3 | 76% | 0.761 | 74% | 0.74 | S | S | * | * | cis | -175.2 | 179.2 | -4.4 | 17.8 | 0 | 0 | 0 | 0 | 107 | ||||
| 444 | L | 27.7 | Very low | 30.6 | Very low | 138 Ų | 138 | 131.2 Ų | 131.2 | 72% | 0.723 | 73% | 0.734 | S | S | * | * | cis | -162.9 | 166.3 | 11.2 | -123.9 | 152.4 | 0 | 0 | 0 | 108.3 | ||||
| 445 | I | 32 | Very low | 30.8 | Very low | 144 Ų | 144 | 133.8 Ų | 133.8 | 74% | 0.738 | 75% | 0.747 | S | S | * | * | trans | 73.5 | 110 | 159.1 | -61.8 | 155.8 | 0 | 0 | 0 | 116 | ||||
| 446 | N | 29.6 | Very low | 30.9 | Very low | 147 Ų | 147 | 133.7 Ų | 133.7 | 79% | 0.786 | 75% | 0.747 | S | S | * | * | cis | 83.3 | 153 | 29.8 | -152.4 | 51.2 | 0 | 0 | 0 | 112.7 | ||||
| 447 | P | 39.9 | Very low | 31.1 | Very low | 87 Ų | 87 | 135.2 Ų | 135.2 | 57% | 0.565 | 76% | 0.761 | S | S | * | * | -137.1 | -156.3 | -50.6 | 38.5 | -21.3 | 0 | 0 | 0 | 113.8 | |||||
| 448 | R | 30 | Very low | 31.6 | Very low | 228 Ų | 228 | 131.1 Ų | 131.1 | 86% | 0.86 | 76% | 0.757 | S | S | * | * | trans | 84.8 | 146.7 | 156.4 | -78.9 | 170.1 | 172.7 | -179.8 | -2.6 | 117.2 | ||||
| 449 | S | 30.5 | Very low | 31.7 | Very low | 84 Ų | 84 | 134.2 Ų | 134.2 | 59% | 0.587 | 76% | 0.761 | S | S | * | * | cis | -165 | 153.7 | -4.1 | -128.4 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 450 | T | 32.6 | Very low | 31.9 | Very low | 134 Ų | 134 | 131.5 Ų | 131.5 | 82% | 0.822 | 76% | 0.76 | S | S | * | * | trans | 61 | 157.8 | 149.7 | 50.9 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 451 | A | 33.2 | Very low | 31.7 | Very low | 87 Ų | 87 | 132.1 Ų | 132.1 | 72% | 0.719 | 76% | 0.756 | S | S | * | * | cis | -170.1 | 170.5 | -4.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 452 | F | 28.3 | Very low | 31.8 | Very low | 190 Ų | 190 | 132.1 Ų | 132.1 | 83% | 0.833 | 76% | 0.755 | S | S | * | * | cis | -171.6 | 160.9 | -31.7 | -153.2 | -84.9 | 0 | 0 | 0 | 106.9 | ||||
| 453 | R | 32.3 | Very low | 31.9 | Very low | 241 Ų | 241 | 134.5 Ų | 134.5 | 91% | 0.909 | 76% | 0.761 | S | S | * | * | trans | 75.7 | 140.4 | 175.6 | -51 | -174.3 | 173.6 | -153.6 | -4.5 | 116.7 | ||||
| 454 | G | 32.2 | Very low | 32 | Very low | 66 Ų | 66 | 133.2 Ų | 133.2 | 68% | 0.68 | 76% | 0.757 | S | S | * | * | cis | 158.9 | 157.8 | -15.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 455 | S | 32 | Very low | 32.3 | Very low | 123 Ų | 123 | 135.6 Ų | 135.6 | 86% | 0.86 | 77% | 0.767 | S | S | * | * | trans | 68.4 | 150.6 | 157.8 | -55.7 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 456 | S | 28.5 | Very low | 32.3 | Very low | 106 Ų | 106 | 133.7 Ų | 133.7 | 74% | 0.741 | 77% | 0.766 | S | S | * | * | cis | -176.1 | 140.1 | -25.2 | 50 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 457 | V | 30.4 | Very low | 32.6 | Very low | 153 Ų | 153 | 134.6 Ų | 134.6 | 93% | 0.927 | 77% | 0.771 | S | S | * | * | trans | -135.3 | 147.5 | 168.3 | -176.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 458 | S | 35.2 | Very low | 32.1 | Very low | 110 Ų | 110 | 136 Ų | 136 | 77% | 0.769 | 78% | 0.778 | S | S | * | * | trans | -119.8 | 161.4 | -167.6 | 51.4 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 459 | N | 32.1 | Very low | 32.3 | Very low | 151 Ų | 151 | 132.8 Ų | 132.8 | 81% | 0.807 | 78% | 0.777 | S | S | * | * | trans | -73.5 | 162.1 | -175.8 | -55.4 | -23.8 | 0 | 0 | 0 | 114.6 | ||||
| 460 | S | 37 | Very low | 32.2 | Very low | 104 Ų | 104 | 134.3 Ų | 134.3 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | trans | 147.7 | 149.5 | 144 | 50.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 461 | D | 33.7 | Very low | 32.2 | Very low | 134 Ų | 134 | 132.2 Ų | 132.2 | 72% | 0.717 | 77% | 0.773 | S | S | * | * | cis | -156.2 | 139.3 | -22.5 | -103.2 | -26.5 | 0 | 0 | 0 | 111.5 | ||||
| 462 | L | 32.4 | Very low | 32.1 | Very low | 130 Ų | 130 | 134.8 Ų | 134.8 | 68% | 0.681 | 78% | 0.775 | S | S | * | * | 45.9 | 142.5 | 128.4 | -64 | 170.9 | 0 | 0 | 0 | 124.6 | |||||
| 463 | N | 31.8 | Very low | 32.2 | Very low | 144 Ų | 144 | 133.4 Ų | 133.4 | 77% | 0.77 | 78% | 0.775 | S | S | * | * | trans | 71.9 | 155.8 | 140 | -70.2 | -11.2 | 0 | 0 | 0 | 119 | ||||
| 464 | S | 31.6 | Very low | 32.3 | Very low | 96 Ų | 96 | 130.7 Ų | 130.7 | 67% | 0.671 | 77% | 0.77 | S | S | * | * | cis | -169.8 | 152 | -17.2 | 168.8 | 0 | 0 | 0 | 0 | 108 | ||||
| 465 | M | 33.5 | Very low | 32.5 | Very low | 189 Ų | 189 | 133.1 Ų | 133.1 | 93% | 0.931 | 77% | 0.774 | S | S | * | * | -178.1 | 124 | 128.1 | -101.7 | 168.6 | 177.5 | 0 | 0 | 112.3 | |||||
| 466 | S | 31.2 | Very low | 32.8 | Very low | 104 Ų | 104 | 133.7 Ų | 133.7 | 73% | 0.727 | 77% | 0.767 | S | S | * | * | trans | -92.6 | 159.4 | 151.1 | -56.2 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 467 | D | 35.8 | Very low | 33.2 | Very low | 165 Ų | 165 | 134.8 Ų | 134.8 | 88% | 0.882 | 77% | 0.771 | S | S | * | * | -162.6 | 166.7 | 123.9 | -109 | -29.2 | 0 | 0 | 0 | 113.2 | |||||
| 468 | T | 30.9 | Very low | 33.2 | Very low | 118 Ų | 118 | 132.5 Ų | 132.5 | 72% | 0.724 | 76% | 0.763 | S | S | * | * | trans | -125.5 | 158.8 | -173.8 | -58 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 469 | I | 32.7 | Very low | 33 | Very low | 160 Ų | 160 | 132.3 Ų | 132.3 | 82% | 0.821 | 76% | 0.761 | S | S | * | * | trans | 176.3 | 145.2 | 134.3 | -90.7 | 154 | 0 | 0 | 0 | 112.6 | ||||
| 470 | T | 29.1 | Very low | 32.9 | Very low | 115 Ų | 115 | 131 Ų | 131 | 71% | 0.706 | 76% | 0.759 | S | S | * | * | trans | -52.6 | 165 | -179.8 | 59.6 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 471 | S | 32.5 | Very low | 32.6 | Very low | 91 Ų | 91 | 130.3 Ų | 130.3 | 64% | 0.636 | 76% | 0.759 | S | S | * | * | 175.5 | 153.5 | 58.6 | 45.4 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 472 | N | 30.3 | Very low | 32.7 | Very low | 141 Ų | 141 | 132.4 Ų | 132.4 | 75% | 0.754 | 77% | 0.767 | S | S | * | * | trans | 70.9 | 118.1 | 134.8 | -69.3 | -3.6 | 0 | 0 | 0 | 125.2 | ||||
| 473 | L | 32.2 | Very low | 33 | Very low | 160 Ų | 160 | 131.3 Ų | 131.3 | 84% | 0.838 | 77% | 0.767 | S | S | * | * | 99.8 | 122 | 126.4 | -69.9 | 167.7 | 0 | 0 | 0 | 122.8 | |||||
| 474 | F | 32.8 | Very low | 33.1 | Very low | 184 Ų | 184 | 131.2 Ų | 131.2 | 81% | 0.807 | 77% | 0.767 | S | S | * | * | trans | -57.8 | 177.7 | 160.1 | -80.9 | -91.6 | 0 | 0 | 0 | 114.3 | ||||
| 475 | P | 36.8 | Very low | 33 | Very low | 117 Ų | 117 | 131.4 Ų | 131.4 | 76% | 0.76 | 77% | 0.768 | S | S | * | * | cis | -137.8 | 179.6 | 15.8 | 37.2 | -15.9 | 0 | 0 | 0 | 118.2 | ||||
| 476 | L | 38 | Very low | 32.9 | Very low | 136 Ų | 136 | 129 Ų | 129 | 71% | 0.712 | 76% | 0.758 | S | S | * | * | trans | -66.8 | 165 | 160.7 | -77.9 | 70.7 | 0 | 0 | 0 | 111.4 | ||||
| 477 | P | 36.7 | Very low | 32.9 | Very low | 128 Ų | 128 | 130.8 Ų | 130.8 | 83% | 0.831 | 76% | 0.759 | S | S | * | * | -133.6 | 177.7 | 110.3 | 39.3 | -31.9 | 0 | 0 | 0 | 114.3 | |||||
| 478 | S | 31.3 | Very low | 32.8 | Very low | 106 Ų | 106 | 126.3 Ų | 126.3 | 74% | 0.741 | 75% | 0.745 | S | S | * | * | trans | -107.2 | 169.4 | -164.2 | -44.7 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 479 | S | 30.3 | Very low | 33.1 | Very low | 105 Ų | 105 | 127.3 Ų | 127.3 | 73% | 0.734 | 75% | 0.745 | S | S | * | * | trans | 88.7 | 149.4 | 138.2 | -168.9 | 0 | 0 | 0 | 0 | 121 | ||||
| 480 | T | 29.8 | Very low | 33.4 | Very low | 125 Ų | 125 | 125.5 Ų | 125.5 | 77% | 0.767 | 74% | 0.743 | S | S | * | * | trans | 100.6 | 137 | 141.2 | -7.7 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 481 | A | 30.5 | Very low | 33.9 | Very low | 89 Ų | 89 | 125.2 Ų | 125.2 | 74% | 0.736 | 74% | 0.743 | S | S | * | * | trans | 76.6 | 104 | 151.5 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 482 | M | 36.8 | Very low | 34 | Very low | 178 Ų | 178 | 128.1 Ų | 128.1 | 88% | 0.877 | 75% | 0.751 | S | S | * | * | trans | -55.2 | 157.3 | 138.3 | -68 | -84.4 | -155 | 0 | 0 | 110 | ||||
| 483 | P | 38.5 | Very low | 34.2 | Very low | 106 Ų | 106 | 129.7 Ų | 129.7 | 69% | 0.688 | 75% | 0.751 | S | S | * | * | -149.1 | 139.3 | 100.9 | 36.6 | -20 | 0 | 0 | 0 | 117 | |||||
| 484 | N | 32.9 | Very low | 34.3 | Very low | 142 Ų | 142 | 127.6 Ų | 127.6 | 76% | 0.759 | 74% | 0.74 | S | S | * | * | 58.6 | 151 | 128.7 | -57.6 | -15.6 | 0 | 0 | 0 | 123.8 | |||||
| 485 | S | 31 | Very low | 34.3 | Very low | 101 Ų | 101 | 127 Ų | 127 | 71% | 0.706 | 74% | 0.738 | S | S | * | * | trans | 83.1 | 140.3 | 139.5 | -73.1 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 486 | L | 29.8 | Very low | 34.1 | Very low | 137 Ų | 137 | 124.6 Ų | 124.6 | 72% | 0.717 | 73% | 0.734 | S | S | * | * | cis | -172.4 | 170.7 | -9.4 | -119 | 175.5 | 0 | 0 | 0 | 109.5 | ||||
| 487 | L | 32.7 | Very low | 33.9 | Very low | 142 Ų | 142 | 126.4 Ų | 126.4 | 74% | 0.743 | 74% | 0.739 | S | S | * | * | trans | 70.2 | 150.9 | 155.3 | -68.1 | 158.2 | 0 | 0 | 0 | 117.2 | I489 | L487-I489 HydrophobicContact CD2-CD1 4.28Š| ||
| 488 | A | 32.1 | Very low | 33.6 | Very low | 71 Ų | 71 | 125.3 Ų | 125.3 | 59% | 0.587 | 73% | 0.734 | S | S | * | * | cis | -160.8 | 136.8 | 2.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 489 | I | 37.7 | Very low | 33.7 | Very low | 140 Ų | 140 | 124.2 Ų | 124.2 | 72% | 0.718 | 73% | 0.732 | S | S | * | * | 69.8 | 149 | 124.3 | -62.6 | 170.4 | 0 | 0 | 0 | 118.6 | L487 | L487-I489 HydrophobicContact CD2-CD1 4.28Š| |||
| 490 | P | 38.9 | Very low | 33.6 | Very low | 121 Ų | 121 | 128.3 Ų | 128.3 | 79% | 0.786 | 74% | 0.739 | S | S | * | * | cis | -117.6 | 152.4 | 1.8 | 18.8 | 3.5 | 0 | 0 | 0 | 116.5 | ||||
| 491 | P | 41 | Very low | 33.7 | Very low | 109 Ų | 109 | 128 Ų | 128 | 71% | 0.708 | 74% | 0.743 | S | S | * | * | trans | -110.3 | 178.4 | 168.1 | 41.8 | -33.9 | 0 | 0 | 0 | 112.9 | ||||
| 492 | L | 34.5 | Very low | 33.6 | Very low | 153 Ų | 153 | 132.3 Ų | 132.3 | 80% | 0.801 | 75% | 0.747 | S | S | * | * | trans | -144.5 | 120.2 | 149.1 | -72.5 | -178.4 | 0 | 0 | 0 | 114.1 | ||||
| 493 | F | 33.4 | Very low | 33.2 | Very low | 173 Ų | 173 | 129.5 Ų | 129.5 | 76% | 0.759 | 74% | 0.744 | S | S | * | * | trans | 57.5 | 137.9 | 135.5 | -73.9 | -105.8 | 0 | 0 | 0 | 121.1 | ||||
| 494 | L | 34.2 | Very low | 32.8 | Very low | 117 Ų | 117 | 130.2 Ų | 130.2 | 61% | 0.613 | 75% | 0.752 | S | S | * | * | cis | -168.6 | 147.6 | -1.7 | -174.3 | 63.6 | 0 | 0 | 0 | 113.9 | ||||
| 495 | F | 33.2 | Very low | 32.7 | Very low | 172 Ų | 172 | 126.7 Ų | 126.7 | 75% | 0.754 | 75% | 0.748 | S | S | * | * | trans | 48.3 | 143.4 | 161.9 | -67.9 | -43.5 | 0 | 0 | 0 | 122.6 | ||||
| 496 | G | 33.8 | Very low | 32.6 | Very low | 66 Ų | 66 | 130.1 Ų | 130.1 | 68% | 0.68 | 76% | 0.758 | S | S | * | * | cis | 157.4 | 167.2 | -12.7 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 497 | Q | 33.5 | Very low | 32.8 | Very low | 173 Ų | 173 | 131 Ų | 131 | 81% | 0.808 | 76% | 0.762 | S | S | * | * | trans | 73.8 | 152.5 | 158.9 | -63.9 | -174.8 | 40.5 | 0 | 0 | 120.3 | ||||
| 498 | S | 29 | Very low | 32.7 | Very low | 105 Ų | 105 | 130.4 Ų | 130.4 | 73% | 0.734 | 76% | 0.764 | S | S | * | * | cis | -177.4 | 177.8 | -30.4 | -100.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 499 | A | 33.7 | Very low | 32.7 | Very low | 84 Ų | 84 | 132.8 Ų | 132.8 | 69% | 0.694 | 77% | 0.773 | S | S | * | * | trans | 77.4 | 126.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 500 | E | 28.7 | Very low | 32.3 | Very low | 190 Ų | 190 | 131.9 Ų | 131.9 | 89% | 0.888 | 78% | 0.78 | S | S | * | * | cis | 80.7 | 142.9 | 47.9 | -63.9 | 163.8 | -144.7 | 0 | 0 | 112.3 | ||||
| 501 | S | 32.4 | Very low | 32.1 | Very low | 120 Ų | 120 | 130.9 Ų | 130.9 | 84% | 0.839 | 78% | 0.782 | S | S | * | * | cis | -143.3 | -179.5 | 28.2 | 65.7 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 502 | E | 27.3 | Very low | 31.5 | Very low | 179 Ų | 179 | 133.3 Ų | 133.3 | 84% | 0.836 | 79% | 0.789 | S | S | * | * | trans | -84.2 | 162.1 | -175.2 | -48.7 | 160.4 | 111.8 | 0 | 0 | 114.3 | ||||
| 503 | C | 29.7 | Very low | 31.4 | Very low | 119 Ų | 119 | 133.8 Ų | 133.8 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | -171.4 | 128.7 | 126.4 | -103.5 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 504 | S | 29.1 | Very low | 31.1 | Very low | 121 Ų | 121 | 130.7 Ų | 130.7 | 85% | 0.846 | 79% | 0.786 | S | S | * | * | trans | 32.5 | 126.4 | 135.6 | -50.7 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 505 | G | 31.9 | Very low | 30.8 | Very low | 67 Ų | 67 | 131 Ų | 131 | 69% | 0.691 | 79% | 0.792 | S | S | * | * | cis | 156.3 | -175.1 | -0.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 506 | L | 27 | Very low | 30.6 | Very low | 174 Ų | 174 | 130.7 Ų | 130.7 | 91% | 0.911 | 80% | 0.798 | S | S | * | * | trans | 46.4 | 126.1 | 155.3 | -59.6 | 165.5 | 0 | 0 | 0 | 117.7 | ||||
| 507 | I | 34.2 | Very low | 30.4 | Very low | 155 Ų | 155 | 132.9 Ų | 132.9 | 80% | 0.795 | 80% | 0.8 | S | S | * | * | cis | -154.3 | 145.2 | 46.7 | -71.6 | 176 | 0 | 0 | 0 | 109.4 | ||||
| 508 | T | 31.4 | Very low | 30.4 | Very low | 129 Ų | 129 | 129.3 Ų | 129.3 | 79% | 0.791 | 80% | 0.801 | S | S | * | * | trans | -100.5 | 157.9 | 162.3 | 56.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 509 | P | 33.1 | Very low | 30.5 | Very low | 121 Ų | 121 | 130 Ų | 130 | 79% | 0.786 | 81% | 0.805 | S | S | * | * | -144.2 | 158.5 | 105.4 | 38.1 | -25.2 | 0 | 0 | 0 | 114.9 | |||||
| 510 | S | 28.4 | Very low | 30.2 | Very low | 122 Ų | 122 | 130.5 Ų | 130.5 | 85% | 0.853 | 80% | 0.804 | S | S | * | * | trans | -84.7 | 150.7 | 162.3 | -49 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 511 | A | 33.8 | Very low | 30.2 | Very low | 100 Ų | 100 | 126.7 Ų | 126.7 | 83% | 0.826 | 79% | 0.793 | S | S | * | * | trans | -145.7 | 123.2 | 166.2 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 512 | N | 28.7 | Very low | 30 | Very low | 160 Ų | 160 | 127.1 Ų | 127.1 | 86% | 0.856 | 79% | 0.794 | S | S | * | * | trans | -92.2 | 124.5 | 172.4 | -79.3 | -25.4 | 0 | 0 | 0 | 110.4 | ||||
| 513 | I | 32.1 | Very low | 30.1 | Very low | 162 Ų | 162 | 125.6 Ų | 125.6 | 83% | 0.831 | 79% | 0.79 | S | S | * | * | trans | -142.6 | 99.7 | 149.7 | -60.1 | -173 | 0 | 0 | 0 | 105.4 | ||||
| 514 | T | 28.5 | Very low | 29.9 | Very low | 109 Ų | 109 | 129 Ų | 129 | 67% | 0.669 | 79% | 0.794 | S | S | * | * | 81.2 | 108.5 | 76.6 | -56.6 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 515 | T | 26.5 | Very low | 29.9 | Very low | 122 Ų | 122 | 130.2 Ų | 130.2 | 75% | 0.748 | 79% | 0.79 | S | S | * | * | trans | 51.9 | 127.5 | 158.9 | 59.5 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 516 | L | 30.2 | Very low | 29.7 | Very low | 166 Ų | 166 | 132.4 Ų | 132.4 | 87% | 0.869 | 79% | 0.792 | S | S | * | * | -166.6 | 123.4 | 109.7 | -106 | 169.5 | 0 | 0 | 0 | 111.6 | |||||
| 517 | P | 28.4 | Very low | 29.7 | Very low | 112 Ų | 112 | 129.7 Ų | 129.7 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | trans | -86.3 | 135.1 | 162.6 | 33.4 | -30.2 | 0 | 0 | 0 | 110.3 | ||||
| 518 | A | 33.5 | Very low | 29.5 | Very low | 99 Ų | 99 | 128.2 Ų | 128.2 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | -118.2 | 77.4 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 519 | S | 31 | Very low | 29.2 | Very low | 118 Ų | 118 | 130.6 Ų | 130.6 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | trans | -102.3 | 97 | 170.2 | 57.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 520 | S | 29.2 | Very low | 29.1 | Very low | 96 Ų | 96 | 132 Ų | 132 | 67% | 0.671 | 79% | 0.792 | S | S | * | * | trans | -163.9 | 144.4 | -179.5 | 46.6 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 521 | T | 28.8 | Very low | 29 | Very low | 109 Ų | 109 | 129.8 Ų | 129.8 | 67% | 0.669 | 79% | 0.788 | S | S | * | * | cis | -160.8 | 140.4 | -9.4 | 14.1 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 522 | P | 26.5 | Very low | 28.8 | Very low | 130 Ų | 130 | 128.5 Ų | 128.5 | 84% | 0.844 | 78% | 0.784 | S | S | * | * | trans | -78.6 | 119.7 | 164.6 | 31.5 | -30.4 | 0 | 0 | 0 | 109.9 | ||||
| 523 | L | 30 | Very low | 28.8 | Very low | 146 Ų | 146 | 130.4 Ų | 130.4 | 76% | 0.764 | 79% | 0.788 | S | S | * | * | trans | -101.4 | 109.7 | 179.1 | -85.3 | 169.7 | 0 | 0 | 0 | 112.2 | ||||
| 524 | Q | 24.8 | Very low | 28.6 | Very low | 191 Ų | 191 | 126.4 Ų | 126.4 | 89% | 0.893 | 79% | 0.786 | S | S | * | * | trans | -95.8 | 117.7 | 162.5 | -66.8 | -178.2 | -63 | 0 | 0 | 110.2 | ||||
| 525 | I | 28.9 | Very low | 28.7 | Very low | 147 Ų | 147 | 127.1 Ų | 127.1 | 75% | 0.754 | 80% | 0.796 | S | S | * | * | trans | -148.9 | 160.4 | 159.9 | 5.4 | 178.2 | 0 | 0 | 0 | 109.1 | ||||
| 526 | P | 27.8 | Very low | 28.7 | Very low | 112 Ų | 112 | 125.3 Ų | 125.3 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | -128.3 | 165.6 | -101.9 | 40.7 | -26.5 | 0 | 0 | 0 | 117.5 | |||||
| 527 | V | 27 | Very low | 28.7 | Very low | 117 Ų | 117 | 128 Ų | 128 | 71% | 0.709 | 80% | 0.799 | S | S | * | * | trans | -3.3 | 123.7 | 158.8 | -166.8 | 0 | 0 | 0 | 0 | 119.4 | F529 | V527-F529 HydrophobicContact CG1-CB 4.19Å; V527-F529 HydrophobicContact CG1-CD2 4Å | ||
| 528 | S | 30.1 | Very low | 28.7 | Very low | 124 Ų | 124 | 126 Ų | 126 | 87% | 0.867 | 80% | 0.799 | S | S | * | * | trans | -172.3 | 92.6 | 144.2 | -79 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 529 | F | 25.5 | Very low | 28.7 | Very low | 179 Ų | 179 | 126.9 Ų | 126.9 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | 69.4 | 71.5 | 58.8 | -133.7 | -60.5 | 0 | 0 | 0 | 115.2 | V527 | V527-F529 HydrophobicContact CG1-CB 4.19Å; V527-F529 HydrophobicContact CG1-CD2 4Å | |||
| 530 | V | 30.6 | Very low | 28.4 | Very low | 151 Ų | 151 | 127.1 Ų | 127.1 | 92% | 0.915 | 79% | 0.792 | S | S | * | * | trans | -139 | 140.2 | 139.7 | -179.1 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 531 | G | 26.4 | Very low | 28.4 | Very low | 76 Ų | 76 | 131.5 Ų | 131.5 | 78% | 0.784 | 80% | 0.8 | S | S | * | * | trans | -149.7 | 151.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 532 | G | 30.8 | Very low | 28.2 | Very low | 72 Ų | 72 | 131.3 Ų | 131.3 | 74% | 0.742 | 79% | 0.791 | S | S | * | * | trans | 165.9 | 104.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 533 | Q | 28.1 | Very low | 28.3 | Very low | 201 Ų | 201 | 133.2 Ų | 133.2 | 94% | 0.939 | 79% | 0.794 | S | S | * | * | 72 | 129.2 | 63.8 | -72.3 | -141.1 | 11.1 | 0 | 0 | 114.7 | |||||
| 534 | G | 29.2 | Very low | 28.1 | Very low | 77 Ų | 77 | 130.5 Ų | 130.5 | 79% | 0.794 | 79% | 0.786 | S | S | * | * | trans | 85.8 | 136.4 | 170.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 535 | S | 28.9 | Very low | 28.3 | Very low | 125 Ų | 125 | 130.3 Ų | 130.3 | 87% | 0.874 | 79% | 0.786 | S | S | * | * | cis | -158.5 | 162.7 | -9.8 | 51.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 536 | A | 27.6 | Very low | 28.2 | Very low | 84 Ų | 84 | 127.3 Ų | 127.3 | 69% | 0.694 | 78% | 0.783 | S | S | * | * | trans | -61.5 | 157.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 537 | F | 30.4 | Very low | 28.2 | Very low | 222 Ų | 222 | 130.1 Ų | 130.1 | 97% | 0.974 | 79% | 0.786 | S | S | * | * | -178.4 | 145.5 | 127.5 | -98.4 | -63.3 | 0 | 0 | 0 | 112.3 | |||||
| 538 | G | 27.9 | Very low | 28.2 | Very low | 71 Ų | 71 | 131.3 Ų | 131.3 | 73% | 0.732 | 79% | 0.787 | S | S | * | * | trans | 94.1 | 146.1 | 154.6 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 539 | P | 33.3 | Very low | 28 | Very low | 116 Ų | 116 | 133.6 Ų | 133.6 | 75% | 0.753 | 79% | 0.786 | S | S | * | * | trans | -103.3 | -177.8 | 178.4 | 41.2 | -36 | 0 | 0 | 0 | 113.8 | ||||
| 540 | T | 25.6 | Very low | 28.1 | Very low | 123 Ų | 123 | 132.4 Ų | 132.4 | 76% | 0.755 | 79% | 0.788 | S | S | * | * | trans | 62.8 | 125 | 170.6 | 39.9 | 0 | 0 | 0 | 0 | 116 | ||||
| 541 | F | 27.9 | Very low | 27.9 | Very low | 189 Ų | 189 | 131.9 Ų | 131.9 | 83% | 0.829 | 78% | 0.78 | S | S | * | * | -151.1 | 164.5 | 72.5 | -117.3 | -95.6 | 0 | 0 | 0 | 113.7 | |||||
| 542 | Q | 24.9 | Very low | 28 | Very low | 104 Ų | 104 | 135.4 Ų | 135.4 | 49% | 0.486 | 78% | 0.779 | S | S | . | * | trans | -79.2 | 151.4 | 163.6 | -91.9 | -150.5 | -4.3 | 0 | 0 | 111.7 | I1307 | Q542-I1307 HydrophobicContact CB-CG2 3.86Å; Q542-I1307 HydrophobicContact CG-CG1 4.2Å; Q542-I1307 HydrophobicContact CG-CG2 3.99Å; Q542-I1307 VanDerWaalsContact OE1-CD1 3.27Å | ||
| 543 | L | 29.3 | Very low | 27.9 | Very low | 171 Ų | 171 | 142.8 Ų | 142.8 | 90% | 0.895 | 79% | 0.786 | S | S | * | * | trans | -116.3 | 103.6 | 147.1 | -94.4 | 167.1 | 0 | 0 | 0 | 109 | E545 | L543-E545 PolarHBondContact O-N 3.29Š| ||
| 544 | S | 24.7 | Very low | 27.9 | Very low | 88 Ų | 88 | 138.7 Ų | 138.7 | 62% | 0.615 | 78% | 0.775 | S | S | * | * | trans | -87.6 | 90.8 | 170.5 | 56.7 | 0 | 0 | 0 | 0 | 109.9 | A546 | S544-A546 VanDerWaalsContact C-N 3.26Å; S544-A546 PolarHBondContact O-N 3.44Å | ||
| 545 | E | 30.7 | Very low | 27.9 | Very low | 187 Ų | 187 | 144.5 Ų | 144.5 | 87% | 0.874 | 78% | 0.778 | S | S | * | * | trans | -85.5 | 73.9 | 162.2 | -73.6 | -156.9 | 132.8 | 0 | 0 | 110.5 | L543 | L543-E545 PolarHBondContact O-N 3.29Š| ||
| 546 | A | 24.9 | Very low | 28.1 | Very low | 85 Ų | 85 | 149.1 Ų | 149.1 | 70% | 0.702 | 78% | 0.778 | S | S | * | * | trans | -85.7 | 103.4 | 154.1 | 0 | 0 | 0 | 0 | 0 | 107.8 | S544 | S544-A546 VanDerWaalsContact C-N 3.26Å; S544-A546 PolarHBondContact O-N 3.44Å | ||
| 547 | H | 27.6 | Very low | 28.4 | Very low | 171 Ų | 171 | 150.8 Ų | 150.8 | 79% | 0.792 | 78% | 0.782 | S | S | * | * | trans | -147.5 | 137 | 164.6 | -103.1 | 84.7 | 0 | 0 | 0 | 112.1 | ||||
| 548 | I | 28.6 | Very low | 28.3 | Very low | 141 Ų | 141 | 143 Ų | 143 | 72% | 0.723 | 77% | 0.765 | S | S | * | * | trans | 67.8 | 93.4 | 157.9 | -56.2 | 170.7 | 0 | 0 | 0 | 115.7 | ||||
| 549 | M | 24.5 | Very low | 28.3 | Very low | 173 Ų | 173 | 146.9 Ų | 146.9 | 85% | 0.852 | 77% | 0.767 | S | S | * | * | trans | -49.5 | 145.8 | 146.5 | -62.7 | 154.1 | 143.7 | 0 | 0 | 111 | ||||
| 550 | N | 27.8 | Very low | 28.2 | Very low | 153 Ų | 153 | 148.7 Ų | 148.7 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | trans | -155.5 | 122.3 | 138.2 | -106.1 | -35 | 0 | 0 | 0 | 111.1 | ||||
| 551 | D | 26.7 | Very low | 28.7 | Very low | 140 Ų | 140 | 147.5 Ų | 147.5 | 75% | 0.749 | 76% | 0.764 | S | S | * | * | trans | -69.2 | 131.1 | 169.4 | -61.6 | -86.5 | 0 | 0 | 0 | 111 | ||||
| 552 | I | 29.1 | Very low | 29.1 | Very low | 151 Ų | 151 | 144.7 Ų | 144.7 | 77% | 0.774 | 76% | 0.764 | S | S | * | * | trans | -132.8 | 98.6 | 144 | -58.4 | -174.1 | 0 | 0 | 0 | 109.6 | T554 | I552-T554 HydrophobicContact CG2-CG2 4.35Š| ||
| 553 | Y | 27.9 | Very low | 29.6 | Very low | 227 Ų | 227 | 145.7 Ų | 145.7 | 89% | 0.89 | 78% | 0.78 | S | S | * | * | trans | -78.8 | 108.4 | 163.9 | -121.5 | -89.8 | 0 | 0 | 0 | 109.4 | ||||
| 554 | T | 28.6 | Very low | 29.6 | Very low | 114 Ų | 114 | 141 Ų | 141 | 70% | 0.699 | 77% | 0.773 | S | S | * | * | trans | -143.6 | 99.8 | 167.6 | 33.8 | 0 | 0 | 0 | 0 | 115.1 | I552 | I552-T554 HydrophobicContact CG2-CG2 4.35Š| ||
| 555 | K | 28.2 | Very low | 29.8 | Very low | 199 Ų | 199 | 145.1 Ų | 145.1 | 87% | 0.865 | 79% | 0.788 | S | S | * | * | trans | 41.1 | 126.7 | 135.1 | -65.5 | -178.5 | 176.4 | 177.4 | 0 | 121.6 | ||||
| 556 | Y | 34.2 | Very low | 29.7 | Very low | 222 Ų | 222 | 142.4 Ų | 142.4 | 87% | 0.871 | 79% | 0.788 | S | S | * | * | trans | -49.2 | 154.1 | 147.8 | -80.8 | -90.5 | 0 | 0 | 0 | 113.5 | ||||
| 557 | P | 34 | Very low | 29.8 | Very low | 119 Ų | 119 | 142.5 Ų | 142.5 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | -116.8 | 177.2 | 91.7 | 39.3 | -37.3 | 0 | 0 | 0 | 111.2 | |||||
| 558 | G | 28.4 | Very low | 29.7 | Very low | 59 Ų | 59 | 140.9 Ų | 140.9 | 61% | 0.608 | 79% | 0.79 | S | S | * | * | cis | 88.4 | 130.6 | 24.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 559 | I | 27.8 | Very low | 29.7 | Very low | 153 Ų | 153 | 139.5 Ų | 139.5 | 79% | 0.785 | 79% | 0.793 | S | S | * | * | cis | -163 | 137.7 | 4.6 | -126.6 | 165.8 | 0 | 0 | 0 | 110 | ||||
| 560 | L | 30 | Very low | 29.9 | Very low | 153 Ų | 153 | 136.7 Ų | 136.7 | 80% | 0.801 | 79% | 0.79 | S | S | * | * | trans | 55.4 | 177.1 | 162.5 | -83.1 | 80.7 | 0 | 0 | 0 | 119.2 | ||||
| 561 | P | 36.4 | Very low | 30.3 | Very low | 98 Ų | 98 | 134.7 Ų | 134.7 | 64% | 0.636 | 79% | 0.786 | S | S | * | * | -132.9 | 173.7 | -56.4 | 39.9 | -25.1 | 0 | 0 | 0 | 113.5 | P563 | P561-P563 WeakPolarHBondContact O-CD 3.33Š| |||
| 562 | P | 36.9 | Very low | 30.4 | Very low | 130 Ų | 130 | 133 Ų | 133 | 84% | 0.844 | 79% | 0.785 | S | S | * | * | trans | -95 | 125.8 | 169 | 34.5 | -30.2 | 0 | 0 | 0 | 113.7 | ||||
| 563 | P | 36 | Very low | 30.3 | Very low | 126 Ų | 126 | 130.5 Ų | 130.5 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | trans | -109.6 | 165.3 | 155.3 | 37.3 | -28.8 | 0 | 0 | 0 | 111.1 | P561 | P561-P563 WeakPolarHBondContact O-CD 3.33Š| ||
| 564 | G | 29.7 | Very low | 30.4 | Very low | 73 Ų | 73 | 124.8 Ų | 124.8 | 75% | 0.753 | 77% | 0.774 | S | S | * | * | trans | -156.3 | -172.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 565 | L | 28.6 | Very low | 30.4 | Very low | 174 Ų | 174 | 125.9 Ų | 125.9 | 91% | 0.911 | 78% | 0.775 | S | S | * | * | trans | 77.8 | 147.5 | 176.6 | -61.4 | 175.8 | 0 | 0 | 0 | 118.7 | ||||
| 566 | C | 27.3 | Very low | 30.3 | Very low | 130 Ų | 130 | 120.3 Ų | 120.3 | 88% | 0.878 | 76% | 0.761 | S | S | * | * | trans | 73.3 | 143.8 | 177.3 | -57.5 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 567 | A | 27 | Very low | 30.1 | Very low | 86 Ų | 86 | 113.2 Ų | 113.2 | 71% | 0.711 | 75% | 0.748 | S | S | * | * | cis | -167.5 | 158 | -23.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 568 | V | 25.6 | Very low | 30.4 | Very low | 138 Ų | 138 | 113.8 Ų | 113.8 | 84% | 0.836 | 75% | 0.75 | S | S | * | * | trans | -5.4 | 117.5 | 163 | -159.3 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 569 | S | 28.5 | Very low | 30.7 | Very low | 111 Ų | 111 | 116.4 Ų | 116.4 | 78% | 0.776 | 76% | 0.756 | S | S | * | * | -172 | 159.5 | 88.6 | -64.2 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 570 | S | 29.1 | Very low | 31.1 | Very low | 114 Ų | 114 | 114.8 Ų | 114.8 | 80% | 0.797 | 75% | 0.753 | S | S | * | * | trans | -96.5 | -172.7 | 174.6 | -22.4 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 571 | P | 36.4 | Very low | 31.3 | Very low | 111 Ų | 111 | 114.7 Ų | 114.7 | 72% | 0.721 | 75% | 0.753 | S | S | * | * | cis | -132.4 | -160.8 | -26 | 38.7 | -20.3 | 0 | 0 | 0 | 112.3 | ||||
| 572 | S | 27.8 | Very low | 31.6 | Very low | 106 Ų | 106 | 115.9 Ų | 115.9 | 74% | 0.741 | 76% | 0.761 | S | S | * | * | trans | 72.6 | 161.6 | 157.1 | 74.9 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 573 | S | 27.4 | Very low | 31.6 | Very low | 97 Ų | 97 | 115 Ų | 115 | 68% | 0.678 | 76% | 0.757 | S | S | * | * | -177.8 | 129.5 | -64.8 | 48.4 | 0 | 0 | 0 | 0 | 112 | |||||
| 574 | S | 30.4 | Very low | 31.7 | Very low | 107 Ų | 107 | 113.1 Ų | 113.1 | 75% | 0.748 | 75% | 0.752 | S | S | * | * | trans | 67.9 | 160.4 | 166.3 | 85 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 575 | N | 28.9 | Very low | 31.9 | Very low | 137 Ų | 137 | 114.5 Ų | 114.5 | 73% | 0.733 | 76% | 0.757 | S | S | * | * | cis | -166 | 159 | 14.9 | -134.6 | -18.6 | 0 | 0 | 0 | 113.2 | ||||
| 576 | C | 26.7 | Very low | 32.1 | Very low | 82 Ų | 82 | 111 Ų | 111 | 55% | 0.554 | 75% | 0.753 | S | S | * | * | trans | 63.5 | 153.1 | 155.5 | -64.5 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 577 | A | 29.5 | Very low | 32.5 | Very low | 74 Ų | 74 | 108.8 Ų | 108.8 | 61% | 0.612 | 74% | 0.744 | S | S | * | * | cis | -159.5 | 169.1 | -6.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | H412 | H412-A577 WeakPolarHBondContact O-CB 3.47Š| ||
| 578 | T | 40.8 | Very low | 32.8 | Very low | 131 Ų | 131 | 110.6 Ų | 110.6 | 80% | 0.804 | 75% | 0.751 | S | S | * | * | trans | -99.5 | 174.5 | 178.5 | 54.2 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 579 | P | 34.9 | Very low | 33.2 | Very low | 114 Ų | 114 | 108 Ų | 108 | 74% | 0.74 | 75% | 0.745 | S | S | * | * | -151.2 | 136.6 | 117.8 | 36.6 | -18.7 | 0 | 0 | 0 | 120.1 | |||||
| 580 | T | 34.2 | Very low | 33.5 | Very low | 118 Ų | 118 | 108.9 Ų | 108.9 | 72% | 0.724 | 75% | 0.746 | S | S | * | * | trans | 61.7 | 117 | 133.1 | 62.9 | 0 | 0 | 0 | 0 | 126.9 | ||||
| 581 | L | 36.2 | Very low | 33.8 | Very low | 152 Ų | 152 | 108.6 Ų | 108.6 | 80% | 0.796 | 74% | 0.743 | S | S | * | * | 57.7 | 166.5 | 125.5 | -87.5 | 80.3 | 0 | 0 | 0 | 121.9 | |||||
| 582 | P | 41.6 | Very low | 33.7 | Very low | 123 Ų | 123 | 108.4 Ų | 108.4 | 80% | 0.799 | 75% | 0.745 | S | S | * | * | cis | -127.2 | -163.2 | 9.7 | 23.9 | 2.3 | 0 | 0 | 0 | 114.4 | ||||
| 583 | S | 37.3 | Very low | 34 | Very low | 110 Ų | 110 | 109.1 Ų | 109.1 | 77% | 0.769 | 75% | 0.745 | S | S | * | * | cis | -174.3 | -173.6 | -42.3 | -169.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 584 | A | 36.9 | Very low | 34.2 | Very low | 87 Ų | 87 | 109.4 Ų | 109.4 | 72% | 0.719 | 75% | 0.747 | S | S | * | * | trans | 75.1 | 127.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 585 | A | 34.3 | Very low | 34.1 | Very low | 103 Ų | 103 | 112.6 Ų | 112.6 | 85% | 0.851 | 75% | 0.75 | S | S | * | * | cis | 86.2 | 146.5 | 12.4 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 586 | A | 33.6 | Very low | 34.2 | Very low | 99 Ų | 99 | 113.2 Ų | 113.2 | 82% | 0.818 | 75% | 0.752 | S | S | * | * | cis | -178.6 | 176.7 | -11.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 587 | A | 35.5 | Very low | 34.8 | Very low | 85 Ų | 85 | 114.3 Ų | 114.3 | 70% | 0.702 | 76% | 0.758 | S | S | * | * | cis | -171 | -178.7 | -10.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 588 | S | 33.6 | Very low | 35.5 | Very low | 123 Ų | 123 | 116.8 Ų | 116.8 | 86% | 0.86 | 77% | 0.768 | S | S | * | * | trans | 70 | 156 | 155.2 | 60.3 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 589 | A | 33.8 | Very low | 35.2 | Very low | 84 Ų | 84 | 113.8 Ų | 113.8 | 69% | 0.694 | 76% | 0.763 | S | S | * | * | cis | -172.1 | -178.8 | -23 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 590 | T | 34.3 | Very low | 34.9 | Very low | 130 Ų | 130 | 115.3 Ų | 115.3 | 80% | 0.798 | 77% | 0.765 | S | S | * | * | trans | 79.6 | 118.1 | 153.1 | 49.8 | 0 | 0 | 0 | 0 | 125.9 | ||||
| 591 | S | 35 | Very low | 34.8 | Very low | 107 Ų | 107 | 117.7 Ų | 117.7 | 75% | 0.748 | 77% | 0.766 | S | S | * | * | 81.4 | 136.5 | 127.3 | 63.4 | 0 | 0 | 0 | 0 | 127.7 | |||||
| 592 | S | 36.1 | Very low | 34.3 | Very low | 108 Ų | 108 | 119 Ų | 119 | 76% | 0.755 | 77% | 0.767 | S | S | * | * | trans | 85.7 | 101.4 | 138.1 | 48.1 | 0 | 0 | 0 | 0 | 126 | ||||
| 593 | V | 32.3 | Very low | 33.9 | Very low | 121 Ų | 121 | 116.9 Ų | 116.9 | 73% | 0.733 | 77% | 0.769 | S | S | * | * | 37.3 | 125 | 122.3 | -174.4 | 0 | 0 | 0 | 0 | 122.3 | |||||
| 594 | S | 31.5 | Very low | 33.4 | Very low | 103 Ų | 103 | 119.4 Ų | 119.4 | 72% | 0.72 | 77% | 0.773 | S | S | * | * | 175.8 | 135.5 | 123.3 | -78.6 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 595 | Q | 28.7 | Very low | 33.4 | Very low | 174 Ų | 174 | 120.5 Ų | 120.5 | 81% | 0.813 | 77% | 0.773 | S | S | * | * | trans | 24.5 | 155.7 | 136.1 | -57 | -175.9 | 4 | 0 | 0 | 122.8 | ||||
| 596 | L | 31 | Very low | 33 | Very low | 149 Ų | 149 | 123.1 Ų | 123.1 | 78% | 0.78 | 77% | 0.772 | S | S | * | * | cis | -166.6 | 173.4 | -13.9 | -99.5 | 171.5 | 0 | 0 | 0 | 108.6 | ||||
| 597 | P | 39.9 | Very low | 32.6 | Very low | 106 Ų | 106 | 123.2 Ų | 123.2 | 69% | 0.688 | 77% | 0.766 | S | S | * | * | trans | -110 | -144.1 | -168.7 | 46.7 | -39 | 0 | 0 | 0 | 112.4 | ||||
| 598 | P | 44.3 | Very low | 32.2 | Very low | 126 Ų | 126 | 127.1 Ų | 127.1 | 82% | 0.818 | 77% | 0.77 | S | S | * | * | cis | -136.9 | -173.1 | -18.7 | 41.8 | -23.9 | 0 | 0 | 0 | 116.1 | ||||
| 599 | G | 33.5 | Very low | 31.9 | Very low | 68 Ų | 68 | 126.1 Ų | 126.1 | 70% | 0.701 | 76% | 0.762 | S | S | * | * | trans | 110.7 | 168.9 | 154.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 600 | N | 29.1 | Very low | 31.7 | Very low | 145 Ų | 145 | 127.6 Ų | 127.6 | 78% | 0.775 | 76% | 0.763 | S | S | * | * | cis | -170 | 177.7 | -24.6 | -137.3 | 32.6 | 0 | 0 | 0 | 108.2 | ||||
| 601 | F | 31.6 | Very low | 31.4 | Very low | 169 Ų | 169 | 127.4 Ų | 127.4 | 74% | 0.741 | 76% | 0.761 | S | S | * | * | trans | 71.8 | 126.2 | -178.7 | -60.7 | -86.8 | 0 | 0 | 0 | 114.4 | ||||
| 602 | E | 26.6 | Very low | 31.5 | Very low | 178 Ų | 178 | 129 Ų | 129 | 83% | 0.832 | 77% | 0.766 | S | S | * | * | 72.3 | 127.4 | 54.6 | -66.5 | -168.1 | 135.4 | 0 | 0 | 114.3 | |||||
| 603 | G | 32.4 | Very low | 31.1 | Very low | 80 Ų | 80 | 129 Ų | 129 | 83% | 0.825 | 76% | 0.758 | S | S | * | * | trans | 150.5 | 69.5 | 165.1 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 604 | N | 28.3 | Very low | 31 | Very low | 162 Ų | 162 | 129.2 Ų | 129.2 | 87% | 0.866 | 76% | 0.755 | S | S | * | * | trans | 42.7 | 152 | 151.3 | -83.7 | -16.7 | 0 | 0 | 0 | 123.9 | ||||
| 605 | P | 35.6 | Very low | 30.8 | Very low | 111 Ų | 111 | 129.7 Ų | 129.7 | 72% | 0.721 | 75% | 0.749 | S | S | * | * | trans | -86 | 156.9 | 164.5 | 37.2 | -34.8 | 0 | 0 | 0 | 112.8 | ||||
| 606 | L | 27.3 | Very low | 31 | Very low | 157 Ų | 157 | 128.2 Ų | 128.2 | 82% | 0.822 | 75% | 0.747 | S | S | * | * | trans | -175.9 | 139.1 | 150 | -95.3 | 157.4 | 0 | 0 | 0 | 106.5 | ||||
| 607 | C | 24.2 | Very low | 31.1 | Very low | 102 Ų | 102 | 129.8 Ų | 129.8 | 69% | 0.689 | 75% | 0.748 | S | S | * | * | 44.1 | 133.7 | 97.7 | -66.9 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 608 | E | 26.7 | Very low | 30.6 | Very low | 167 Ų | 167 | 129.9 Ų | 129.9 | 78% | 0.78 | 75% | 0.749 | S | S | * | * | cis | -165.7 | 155.5 | 12.3 | -140.8 | -178.2 | 126.2 | 0 | 0 | 112.3 | ||||
| 609 | S | 28.2 | Very low | 29.8 | Very low | 101 Ų | 101 | 132.7 Ų | 132.7 | 71% | 0.706 | 75% | 0.748 | S | S | * | * | trans | 61.8 | 156.7 | 152.2 | -123.2 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 610 | T | 29.8 | Very low | 29.4 | Very low | 115 Ų | 115 | 132.3 Ų | 132.3 | 71% | 0.706 | 74% | 0.744 | S | S | * | * | cis | -149.5 | 147.8 | 29 | 45.6 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 611 | V | 27.8 | Very low | 29.1 | Very low | 127 Ų | 127 | 135.4 Ų | 135.4 | 77% | 0.77 | 75% | 0.746 | S | S | * | * | trans | 61.8 | 122.9 | 143 | 175.1 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 612 | V | 36.7 | Very low | 28.8 | Very low | 140 Ų | 140 | 133.5 Ų | 133.5 | 85% | 0.848 | 74% | 0.744 | S | S | * | * | cis | -113.8 | 122 | 41.6 | 180 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 613 | N | 26.6 | Very low | 28.8 | Very low | 109 Ų | 109 | 132.6 Ų | 132.6 | 58% | 0.583 | 74% | 0.741 | S | S | * | * | trans | -85.6 | 143.1 | 161.9 | -179.6 | 25.7 | 0 | 0 | 0 | 109.5 | ||||
| 614 | N | 31.6 | Very low | 28.6 | Very low | 125 Ų | 125 | 133.6 Ų | 133.6 | 67% | 0.668 | 73% | 0.733 | S | S | * | * | 175.3 | 119.8 | 127.2 | -87.9 | -18.6 | 0 | 0 | 0 | 112.7 | |||||
| 615 | N | 27.3 | Very low | 28.5 | Very low | 112 Ų | 112 | 130.5 Ų | 130.5 | 60% | 0.599 | 72% | 0.722 | S | S | * | * | 48.1 | 114.8 | 120 | -44.6 | -19.3 | 0 | 0 | 0 | 116.8 | |||||
| 616 | N | 31.8 | Very low | 28.1 | Very low | 143 Ų | 143 | 131.4 Ų | 131.4 | 77% | 0.765 | 73% | 0.726 | S | S | * | * | cis | -160.8 | 138.8 | 36 | -90.6 | -30.1 | 0 | 0 | 0 | 113.1 | ||||
| 617 | F | 34.5 | Very low | 28.1 | Very low | 183 Ų | 183 | 129 Ų | 129 | 80% | 0.803 | 72% | 0.723 | S | S | * | * | trans | -78.5 | 147.6 | 132.7 | -88 | -100.5 | 0 | 0 | 0 | 108 | ||||
| 618 | P | 28.9 | Very low | 28.2 | Very low | 108 Ų | 108 | 130.9 Ų | 130.9 | 70% | 0.701 | 72% | 0.721 | S | S | * | * | -128.5 | 144.7 | 102.2 | 37.5 | -31.5 | 0 | 0 | 0 | 111.3 | |||||
| 619 | F | 27 | Very low | 28.2 | Very low | 185 Ų | 185 | 130.8 Ų | 130.8 | 81% | 0.811 | 73% | 0.725 | S | S | * | * | 58.6 | 88.7 | 64.8 | -89.7 | -78 | 0 | 0 | 0 | 114.2 | |||||
| 620 | G | 24.4 | Very low | 28.2 | Very low | 59 Ų | 59 | 132.7 Ų | 132.7 | 61% | 0.608 | 73% | 0.727 | S | S | * | * | trans | -167.6 | 114.2 | 163.1 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 621 | Y | 24.6 | Very low | 27.9 | Very low | 210 Ų | 210 | 133.5 Ų | 133.5 | 82% | 0.824 | 73% | 0.725 | S | S | * | * | 49.1 | 125.5 | 77.3 | -60.5 | -53.4 | 0 | 0 | 0 | 111.9 | |||||
| 622 | N | 24.5 | Very low | 27.7 | Very low | 129 Ų | 129 | 134.8 Ų | 134.8 | 69% | 0.69 | 72% | 0.724 | S | S | * | * | cis | -175 | 158.4 | -8.5 | -135.8 | -11.4 | 0 | 0 | 0 | 105.8 | ||||
| 623 | M | 27.3 | Very low | 27.3 | Very low | 159 Ų | 159 | 131 Ų | 131 | 78% | 0.783 | 70% | 0.699 | S | S | * | * | trans | 63.7 | 169.2 | 167.5 | -59.4 | -70.7 | -177.9 | 0 | 0 | 116.3 | ||||
| 624 | P | 26.4 | Very low | 27.5 | Very low | 101 Ų | 101 | 132.2 Ų | 132.2 | 66% | 0.656 | 71% | 0.713 | S | S | * | * | cis | -108.2 | 166.3 | -12.8 | 39.3 | -29.9 | 0 | 0 | 0 | 113 | ||||
| 625 | P | 26.9 | Very low | 27.4 | Very low | 98 Ų | 98 | 133.4 Ų | 133.4 | 64% | 0.636 | 71% | 0.714 | S | S | * | * | trans | -65.2 | 157.1 | 157.2 | 31.8 | -35.3 | 0 | 0 | 0 | 110.8 | ||||
| 626 | T | 27.7 | Very low | 27.4 | Very low | 129 Ų | 129 | 129 Ų | 129 | 79% | 0.791 | 69% | 0.693 | S | S | * | * | trans | 56 | 105.7 | 170 | 53.2 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 627 | S | 26.8 | Very low | 27.3 | Very low | 108 Ų | 108 | 130.4 Ų | 130.4 | 76% | 0.755 | 70% | 0.696 | S | S | * | * | trans | -143.6 | 76.1 | 153.7 | -68.6 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 628 | Q | 26.1 | Very low | 26.9 | Very low | 141 Ų | 141 | 125.8 Ų | 125.8 | 66% | 0.659 | 69% | 0.692 | S | S | * | * | 26.8 | 107.9 | 102.9 | -69.7 | -150.2 | 20.8 | 0 | 0 | 114.8 | |||||
| 629 | L | 27 | Very low | 26.8 | Very low | 165 Ų | 165 | 127.8 Ų | 127.8 | 86% | 0.864 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -111 | 96.7 | 147.2 | -98.8 | 169.1 | 0 | 0 | 0 | 108.5 | ||
| 630 | N | 28.1 | Very low | 26.7 | Very low | 140 Ų | 140 | 121.9 Ų | 121.9 | 75% | 0.749 | 68% | 0.679 | S | S | * | * | S | Bend | trans | 61 | 69 | 156.6 | -57.9 | -4.9 | 0 | 0 | 0 | 117.8 | ||
| 631 | M | 24.5 | Very low | 26.9 | Very low | 133 Ų | 133 | 128.4 Ų | 128.4 | 66% | 0.655 | 70% | 0.696 | S | S | * | * | 32.2 | 114.5 | 127.2 | -55.1 | -155.6 | 79.3 | 0 | 0 | 119.4 | |||||
| 632 | M | 23.9 | Very low | 27 | Very low | 154 Ų | 154 | 122.3 Ų | 122.3 | 76% | 0.759 | 68% | 0.681 | S | S | * | * | -128.9 | 137.4 | 112 | -101.9 | -179.3 | -177.3 | 0 | 0 | 108.2 | S636 A640 | M632-S636 WeakPolarHBondContact CB-OG 3.49Å; M632-A640 HydrophobicContact CE-CB 4.31Å; M632-A640 HydrophobicContact SD-CB 4Å | |||
| 633 | D | 28.4 | Very low | 27 | Very low | 61 Ų | 61 | 123.9 Ų | 123.9 | 33% | 0.326 | 69% | 0.689 | S | S | . | * | trans | -79.7 | 158.4 | -170.5 | 114.3 | 89.4 | 0 | 0 | 0 | 112.7 | Q635 S636 | D633-Q635 PolarHBondContact O-N 3.09Å; D633-Q635 PolarHBondContact OD1-N 3.17Å; D633-Q635 WeakPolarHBondContact OD2-CA 3.39Å; D633-Q635 PolarHBondContact OD2-N 3.29Å; D633-S636 PolarHBondContact N-OG 3.12Å; D633-S636 PolarHBondContact O-N 2.89Å; D633-S636 PolarHBondContact O-OG 3.29Å; D633-S636 VanDerWaalsContact OD2-CB 3.28Å; D633-S636 WeakPolarHBondContact OD2-CB 3.22Å; D633-S636 PolarHBondContact OD2-N 3.06Å | ||
| 634 | P | 28.9 | Very low | 27 | Very low | 133 Ų | 133 | 126.7 Ų | 126.7 | 86% | 0.864 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.2 | -13.8 | 175.3 | -26.7 | 36.5 | 0 | 0 | 0 | 116.9 | ||
| 635 | Q | 30.6 | Very low | 26.9 | Very low | 150 Ų | 150 | 129.4 Ų | 129.4 | 70% | 0.701 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.2 | -10.4 | 171.4 | -52.6 | -165.8 | -85.1 | 0 | 0 | 113.4 | D633 A638 | D633-Q635 PolarHBondContact O-N 3.09Å; D633-Q635 PolarHBondContact OD1-N 3.17Å; D633-Q635 WeakPolarHBondContact OD2-CA 3.39Å; D633-Q635 PolarHBondContact OD2-N 3.29Å; Q635-A638 WeakPolarHBondContact O-CB 2.97Å; Q635-A638 PolarHBondContact O-N 2.74Å |
| 636 | S | 27 | Very low | 26.9 | Very low | 21 Ų | 21 | 129.7 Ų | 129.7 | 15% | 0.147 | 71% | 0.707 | C | S | . | * | G | 310 helix | trans | -88.2 | -18.1 | -175.2 | 70.8 | 0 | 0 | 0 | 0 | 115 | M632 D633 A638 M639 A640 | M632-S636 WeakPolarHBondContact CB-OG 3.49Å; D633-S636 PolarHBondContact N-OG 3.12Å; D633-S636 PolarHBondContact O-N 2.89Å; D633-S636 PolarHBondContact O-OG 3.29Å; D633-S636 VanDerWaalsContact OD2-CB 3.28Å; D633-S636 WeakPolarHBondContact OD2-CB 3.22Å; D633-S636 PolarHBondContact OD2-N 3.06Å; S636-A638 PolarHBondContact O-N 3.23Å; S636-A638 VanDerWaalsContact O-N 3.13Å; S636-M639 CarbonylContact O-C 3.57Å; S636-M639 PolarHBondContact O-N 2.63Å; S636-A640 WeakPolarHBondContact O-CB 3.29Å; S636-A640 PolarHBondContact O-N 3.04Å |
| 637 | M | 28.8 | Very low | 26.9 | Very low | 171 Ų | 171 | 132.1 Ų | 132.1 | 84% | 0.842 | 71% | 0.709 | S | S | * | * | G | 310 helix | trans | -66.4 | -7.7 | 163.6 | -157.5 | 163.9 | 108.2 | 0 | 0 | 112 | ||
| 638 | A | 27.8 | Very low | 26.8 | Very low | 87 Ų | 87 | 130.5 Ų | 130.5 | 72% | 0.719 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -98.9 | 6.1 | 166.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | Q635 S636 | Q635-A638 WeakPolarHBondContact O-CB 2.97Å; Q635-A638 PolarHBondContact O-N 2.74Å; S636-A638 PolarHBondContact O-N 3.23Å; S636-A638 VanDerWaalsContact O-N 3.13Å |
| 639 | M | 27.1 | Very low | 26.7 | Very low | 150 Ų | 150 | 127.3 Ų | 127.3 | 74% | 0.739 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133.7 | -6.5 | 174.5 | -65 | -163.6 | -166.1 | 0 | 0 | 115.2 | S636 M641 | S636-M639 CarbonylContact O-C 3.57Å; S636-M639 PolarHBondContact O-N 2.63Å; M639-M641 PolarHBondContact O-N 3.29Å |
| 640 | A | 24.2 | Very low | 26.6 | Very low | 60 Ų | 60 | 124.7 Ų | 124.7 | 50% | 0.496 | 72% | 0.717 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.2 | 3.7 | -173.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | M632 S636 | M632-A640 HydrophobicContact CE-CB 4.31Å; M632-A640 HydrophobicContact SD-CB 4Å; S636-A640 WeakPolarHBondContact O-CB 3.29Å; S636-A640 PolarHBondContact O-N 3.04Å |
| 641 | M | 27.3 | Very low | 26.6 | Very low | 196 Ų | 196 | 122.7 Ų | 122.7 | 97% | 0.966 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.2 | 30.7 | 167.4 | -101.8 | -157.8 | 173.1 | 0 | 0 | 113.6 | M639 | M639-M641 PolarHBondContact O-N 3.29Š|
| 642 | T | 27.4 | Very low | 26.7 | Very low | 83 Ų | 83 | 123.2 Ų | 123.2 | 51% | 0.509 | 73% | 0.725 | S | S | . | * | trans | -123.4 | 56.5 | 177.8 | -46.5 | 0 | 0 | 0 | 0 | 112.1 | M645 | T642-M645 HydrophobicContact CG2-CE 4.45Å; T642-M645 HydrophobicContact CG2-CG 3.9Å; T642-M645 HydrophobicContact CG2-SD 3.59Å; T642-M645 VanDerWaalsContact CG2-SD 3.59Å | ||
| 643 | L | 25.1 | Very low | 26.9 | Very low | 161 Ų | 161 | 122 Ų | 122 | 84% | 0.843 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -144.4 | 34.6 | 169.8 | -112.1 | -178 | 0 | 0 | 0 | 115.6 | ||
| 644 | F | 27.9 | Very low | 27 | Very low | 219 Ų | 219 | 124.7 Ų | 124.7 | 96% | 0.961 | 74% | 0.737 | S | S | * | * | trans | -130.1 | 51.1 | 148.8 | -111.3 | -74.1 | 0 | 0 | 0 | 110.5 | S646 | F644-S646 PolarHBondContact O-N 3.24Š| ||
| 645 | M | 23.9 | Very low | 27 | Very low | 157 Ų | 157 | 125.5 Ų | 125.5 | 77% | 0.773 | 73% | 0.734 | S | S | * | * | trans | -71.5 | 116.6 | 167.2 | -62.7 | -176 | 93 | 0 | 0 | 109.4 | T642 | T642-M645 HydrophobicContact CG2-CE 4.45Å; T642-M645 HydrophobicContact CG2-CG 3.9Å; T642-M645 HydrophobicContact CG2-SD 3.59Å; T642-M645 VanDerWaalsContact CG2-SD 3.59Å | ||
| 646 | S | 26.7 | Very low | 27 | Very low | 105 Ų | 105 | 122.1 Ų | 122.1 | 73% | 0.734 | 73% | 0.726 | S | S | * | * | trans | -130.6 | 102.4 | 148.4 | -165.1 | 0 | 0 | 0 | 0 | 108.5 | F644 | F644-S646 PolarHBondContact O-N 3.24Š| ||
| 647 | Q | 26.7 | Very low | 27.1 | Very low | 179 Ų | 179 | 127.5 Ų | 127.5 | 84% | 0.836 | 75% | 0.754 | S | S | * | * | trans | 11.7 | 134 | 150.3 | -33.9 | -171.8 | 61.3 | 0 | 0 | 116.7 | ||||
| 648 | G | 24.8 | Very low | 27.1 | Very low | 75 Ų | 75 | 126.4 Ų | 126.4 | 77% | 0.773 | 75% | 0.751 | S | S | * | * | cis | 72.5 | 123.4 | 38.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 649 | G | 25.2 | Very low | 27.2 | Very low | 74 Ų | 74 | 126.8 Ų | 126.8 | 76% | 0.763 | 75% | 0.749 | S | S | * | * | cis | 176.9 | 176.5 | -6.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 650 | A | 25.1 | Very low | 27.3 | Very low | 109 Ų | 109 | 128.3 Ų | 128.3 | 90% | 0.901 | 75% | 0.754 | S | S | * | * | trans | 40 | 103.2 | 158.1 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 651 | A | 26.7 | Very low | 27.5 | Very low | 99 Ų | 99 | 133.4 Ų | 133.4 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | trans | -179.3 | 114.2 | 135.3 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 652 | N | 26.4 | Very low | 27.8 | Very low | 143 Ų | 143 | 129.3 Ų | 129.3 | 77% | 0.765 | 76% | 0.759 | S | S | * | * | cis | 71.3 | 91.1 | 35.8 | -156.3 | 38.7 | 0 | 0 | 0 | 114.9 | ||||
| 653 | N | 29.1 | Very low | 28 | Very low | 128 Ų | 128 | 131.4 Ų | 131.4 | 68% | 0.684 | 77% | 0.774 | S | S | * | * | -176.4 | 124.1 | 129.5 | -95.7 | -22.5 | 0 | 0 | 0 | 114.2 | |||||
| 654 | N | 29.7 | Very low | 28.1 | Very low | 119 Ų | 119 | 129 Ų | 129 | 64% | 0.636 | 77% | 0.768 | S | S | * | * | trans | 61.9 | 133.8 | 130.7 | -52.6 | -19.9 | 0 | 0 | 0 | 123.4 | ||||
| 655 | N | 29.7 | Very low | 28.1 | Very low | 149 Ų | 149 | 126.8 Ų | 126.8 | 80% | 0.797 | 77% | 0.765 | S | S | * | * | trans | 68.6 | 141.3 | 140.1 | -65.5 | 6.1 | 0 | 0 | 0 | 118.7 | ||||
| 656 | S | 30 | Very low | 28.2 | Very low | 79 Ų | 79 | 125 Ų | 125 | 55% | 0.552 | 77% | 0.769 | S | S | * | * | cis | -165.8 | 152.8 | 7.6 | -121.3 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 657 | N | 29.7 | Very low | 28.3 | Very low | 134 Ų | 134 | 128.9 Ų | 128.9 | 72% | 0.717 | 78% | 0.775 | S | S | * | * | trans | 65.2 | 134 | 142.5 | -52 | -1 | 0 | 0 | 0 | 121.4 | ||||
| 658 | N | 28.5 | Very low | 28.5 | Very low | 148 Ų | 148 | 124.4 Ų | 124.4 | 79% | 0.791 | 77% | 0.769 | S | S | * | * | trans | 47.8 | 124.6 | 142.5 | -53.2 | 0.2 | 0 | 0 | 0 | 118.6 | ||||
| 659 | S | 30.8 | Very low | 28.7 | Very low | 96 Ų | 96 | 126.6 Ų | 126.6 | 67% | 0.671 | 77% | 0.769 | S | S | * | * | cis | -169.7 | 146.1 | 43.6 | -48.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 660 | Q | 27.8 | Very low | 28.8 | Very low | 182 Ų | 182 | 131.5 Ų | 131.5 | 85% | 0.85 | 77% | 0.772 | S | S | * | * | trans | 55.7 | 164.4 | 145.6 | -64.6 | 175.3 | -49.2 | 0 | 0 | 121.3 | ||||
| 661 | I | 30 | Very low | 29 | Very low | 167 Ų | 167 | 137.1 Ų | 137.1 | 86% | 0.856 | 77% | 0.771 | S | S | * | * | trans | 84.9 | 138.6 | 170.3 | -57.9 | 169.3 | 0 | 0 | 0 | 114.2 | ||||
| 662 | P | 31.8 | Very low | 29.5 | Very low | 109 Ų | 109 | 137.7 Ų | 137.7 | 71% | 0.708 | 76% | 0.76 | S | S | * | * | trans | -89.8 | 169.7 | -151.3 | 36.4 | -36.8 | 0 | 0 | 0 | 115.7 | ||||
| 663 | P | 31.9 | Very low | 29.9 | Very low | 127 Ų | 127 | 138.6 Ų | 138.6 | 83% | 0.825 | 76% | 0.759 | S | S | * | * | trans | -88.9 | 134.7 | -149.8 | 32.6 | -35.8 | 0 | 0 | 0 | 116.2 | ||||
| 664 | P | 28.7 | Very low | 30.2 | Very low | 111 Ų | 111 | 136.5 Ų | 136.5 | 72% | 0.721 | 75% | 0.751 | S | S | * | * | trans | -104.1 | 149.4 | 161.2 | 37 | -30.1 | 0 | 0 | 0 | 113.2 | ||||
| 665 | L | 26.2 | Very low | 30.3 | Very low | 172 Ų | 172 | 133.8 Ų | 133.8 | 90% | 0.901 | 75% | 0.745 | S | S | * | * | trans | 21.4 | 112.7 | 147.3 | -68.1 | 158.2 | 0 | 0 | 0 | 119.1 | ||||
| 666 | S | 27.7 | Very low | 30.7 | Very low | 121 Ų | 121 | 133.5 Ų | 133.5 | 85% | 0.846 | 74% | 0.737 | S | S | * | * | trans | -126.7 | 125.7 | 159.9 | 61.3 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 667 | Q | 28.3 | Very low | 30.8 | Very low | 185 Ų | 185 | 135.2 Ų | 135.2 | 86% | 0.864 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 145.1 | -174.5 | -64 | 170.5 | -7.6 | 0 | 0 | 112.5 | ||
| 668 | A | 29.5 | Very low | 31.1 | Very low | 85 Ų | 85 | 133.4 Ų | 133.4 | 70% | 0.702 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -95.5 | 154.1 | 162.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||
| 669 | P | 30.3 | Very low | 31.4 | Very low | 121 Ų | 121 | 133.2 Ų | 133.2 | 79% | 0.786 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 131.5 | -159.7 | 26.3 | -34.9 | 0 | 0 | 0 | 114.5 | ||
| 670 | Q | 27.7 | Very low | 31.6 | Very low | 177 Ų | 177 | 134 Ų | 134 | 83% | 0.827 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 134.2 | 172.8 | -66.6 | 179.5 | -22.6 | 0 | 0 | 112 | ||
| 671 | W | 29.3 | Very low | 31.8 | Very low | 228 Ų | 228 | 132.6 Ų | 132.6 | 86% | 0.864 | 71% | 0.709 | S | S | * | * | trans | -136.3 | 96 | 158.2 | -82.8 | 97.3 | 0 | 0 | 0 | 111.4 | ||||
| 672 | N | 37 | Very low | 32 | Very low | 110 Ų | 110 | 131.4 Ų | 131.4 | 59% | 0.588 | 70% | 0.704 | S | S | * | * | trans | 48.6 | 80.3 | 159.5 | -68.1 | -23.2 | 0 | 0 | 0 | 119.7 | V674 A675 | N672-V674 PolarHBondContact O-N 3.22Å; N672-A675 PolarHBondContact O-N 3.37Å | ||
| 673 | H | 35.2 | Very low | 32 | Very low | 163 Ų | 163 | 129.8 Ų | 129.8 | 76% | 0.755 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -48.9 | -22.2 | 156.1 | -99 | -99.5 | 0 | 0 | 0 | 114.5 | A675 F676 M677 | H673-A675 VanDerWaalsContact C-N 3.31Å; H673-A675 PolarHBondContact O-N 2.91Å; H673-F676 WeakPolarHBondContact O-CB 2.88Å; H673-F676 PolarHBondContact O-N 3.47Å; H673-M677 PolarHBondContact O-N 2.97Å |
| 674 | V | 34 | Very low | 31.8 | Very low | 83 Ų | 83 | 130.4 Ų | 130.4 | 50% | 0.503 | 70% | 0.696 | S | S | . | * | H | α-helix | trans | -61.1 | -35.4 | -178.4 | -176 | 0 | 0 | 0 | 0 | 112.5 | N672 F676 M677 I678 | N672-V674 PolarHBondContact O-N 3.22Å; V674-F676 VanDerWaalsContact C-N 3.31Å; V674-F676 PolarHBondContact O-N 2.84Å; V674-M677 PolarHBondContact O-N 3.06Å; V674-I678 HydrophobicContact CG1-CD1 3.84Å; V674-I678 HydrophobicContact CG1-CG1 4.38Å; V674-I678 WeakPolarHBondContact O-CG1 3.44Å; V674-I678 PolarHBondContact O-N 2.98Å |
| 675 | A | 32.9 | Very low | 31.8 | Very low | 63 Ų | 63 | 128.3 Ų | 128.3 | 52% | 0.521 | 69% | 0.694 | S | S | . | * | H | α-helix | trans | -66 | -35.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | N672 H673 M679 | N672-A675 PolarHBondContact O-N 3.37Å; H673-A675 VanDerWaalsContact C-N 3.31Å; H673-A675 PolarHBondContact O-N 2.91Å; A675-M679 WeakPolarHBondContact O-CG 3.29Å; A675-M679 PolarHBondContact O-N 3.03Å |
| 676 | F | 36.9 | Very low | 31.9 | Very low | 143 Ų | 143 | 129.4 Ų | 129.4 | 63% | 0.627 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -68.5 | -42.7 | 176.1 | -157.6 | -92.8 | 0 | 0 | 0 | 111.1 | H673 V674 M679 Q680 | H673-F676 WeakPolarHBondContact O-CB 2.88Å; H673-F676 PolarHBondContact O-N 3.47Å; V674-F676 VanDerWaalsContact C-N 3.31Å; V674-F676 PolarHBondContact O-N 2.84Å; F676-M679 PolarHBondContact O-N 2.98Å; F676-Q680 WeakPolarHBondContact O-CB 3.35Å; F676-Q680 PolarHBondContact O-N 3.35Å |
| 677 | M | 33 | Very low | 31.9 | Very low | 114 Ų | 114 | 128.1 Ų | 128.1 | 56% | 0.562 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -63.4 | -40.1 | 175.5 | -69.8 | -176.1 | 68.1 | 0 | 0 | 113.1 | H673 V674 Q680 Q681 | H673-M677 PolarHBondContact O-N 2.97Å; V674-M677 PolarHBondContact O-N 3.06Å; M677-Q680 PolarHBondContact O-N 3.33Å; M677-Q681 WeakPolarHBondContact O-CB 3.21Å; M677-Q681 WeakPolarHBondContact O-CG 3.42Å; M677-Q681 PolarHBondContact O-N 2.81Å |
| 678 | I | 35.3 | Very low | 32.1 | Very low | 97 Ų | 97 | 127 Ų | 127 | 50% | 0.497 | 69% | 0.694 | S | S | . | * | H | α-helix | trans | -67.5 | -41.4 | 179.4 | -70.7 | 171 | 0 | 0 | 0 | 111.3 | V674 Q680 Q681 L682 | V674-I678 HydrophobicContact CG1-CD1 3.84Å; V674-I678 HydrophobicContact CG1-CG1 4.38Å; V674-I678 WeakPolarHBondContact O-CG1 3.44Å; V674-I678 PolarHBondContact O-N 2.98Å; I678-Q680 VanDerWaalsContact C-N 3.35Å; I678-Q681 PolarHBondContact O-N 3.27Å; I678-L682 PolarHBondContact O-N 3.27Å |
| 679 | M | 35 | Very low | 32.2 | Very low | 143 Ų | 143 | 130.2 Ų | 130.2 | 70% | 0.704 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -65.5 | -38.1 | 174.1 | -69.3 | -76.9 | -87.8 | 0 | 0 | 111.7 | A675 F676 L682 | A675-M679 WeakPolarHBondContact O-CG 3.29Å; A675-M679 PolarHBondContact O-N 3.03Å; F676-M679 PolarHBondContact O-N 2.98Å; M679-L682 PolarHBondContact O-N 3.44Å |
| 680 | Q | 36 | Very low | 32.3 | Very low | 112 Ų | 112 | 129.8 Ų | 129.8 | 52% | 0.523 | 70% | 0.697 | S | S | . | * | H | α-helix | trans | -75.6 | -22.8 | 179.4 | -162.2 | 152.5 | 43.5 | 0 | 0 | 113.6 | F676 M677 I678 | F676-Q680 WeakPolarHBondContact O-CB 3.35Å; F676-Q680 PolarHBondContact O-N 3.35Å; M677-Q680 PolarHBondContact O-N 3.33Å; I678-Q680 VanDerWaalsContact C-N 3.35Å |
| 681 | Q | 31.4 | Very low | 32.3 | Very low | 153 Ų | 153 | 125 Ų | 125 | 72% | 0.715 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -79.4 | -16 | 168.9 | -76.6 | -172.3 | -17.8 | 0 | 0 | 114 | M677 I678 | M677-Q681 WeakPolarHBondContact O-CB 3.21Å; M677-Q681 WeakPolarHBondContact O-CG 3.42Å; M677-Q681 PolarHBondContact O-N 2.81Å; I678-Q681 PolarHBondContact O-N 3.27Å |
| 682 | L | 32.9 | Very low | 32.2 | Very low | 143 Ų | 143 | 120 Ų | 120 | 75% | 0.749 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | -8.1 | 172.8 | -85.1 | 162.8 | 0 | 0 | 0 | 114 | I678 M679 | I678-L682 PolarHBondContact O-N 3.27Å; M679-L682 PolarHBondContact O-N 3.44Å |
| 683 | A | 31.9 | Very low | 31.6 | Very low | 74 Ų | 74 | 120.7 Ų | 120.7 | 61% | 0.612 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.6 | -17.7 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 684 | N | 28.8 | Very low | 31.2 | Very low | 141 Ų | 141 | 119.4 Ų | 119.4 | 75% | 0.754 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -117.1 | 78.8 | -172.4 | -83.6 | -26.4 | 0 | 0 | 0 | 112.7 | ||
| 685 | G | 28.6 | Very low | 30.9 | Very low | 66 Ų | 66 | 120.6 Ų | 120.6 | 68% | 0.68 | 72% | 0.716 | S | S | * | * | trans | 162.6 | 121 | 171.7 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 686 | M | 28.1 | Very low | 30.8 | Very low | 195 Ų | 195 | 122.4 Ų | 122.4 | 96% | 0.961 | 73% | 0.725 | S | S | * | * | cis | -133.3 | 128.6 | 20.2 | -58.8 | 165.4 | -74.9 | 0 | 0 | 111.6 | ||||
| 687 | A | 27.7 | Very low | 30.4 | Very low | 94 Ų | 94 | 121.7 Ų | 121.7 | 78% | 0.777 | 73% | 0.733 | S | S | * | * | trans | -149.3 | 90.1 | 167.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 688 | N | 32.5 | Very low | 30.7 | Very low | 163 Ų | 163 | 121.5 Ų | 121.5 | 87% | 0.872 | 74% | 0.74 | S | S | * | * | trans | -159.9 | 133.8 | 164.7 | -83.3 | -46.9 | 0 | 0 | 0 | 104 | ||||
| 689 | N | 31.1 | Very low | 30.5 | Very low | 152 Ų | 152 | 123.7 Ų | 123.7 | 81% | 0.813 | 75% | 0.753 | S | S | * | * | -157.4 | 156.9 | 51.7 | -158.4 | 39.7 | 0 | 0 | 0 | 110.7 | |||||
| 690 | P | 32.8 | Very low | 30.3 | Very low | 112 Ų | 112 | 122.7 Ų | 122.7 | 73% | 0.727 | 76% | 0.755 | S | S | * | * | trans | -103.9 | 160.9 | -176.7 | 37.9 | -32.6 | 0 | 0 | 0 | 115.9 | ||||
| 691 | G | 28.3 | Very low | 29.8 | Very low | 77 Ų | 77 | 122.6 Ų | 122.6 | 79% | 0.794 | 76% | 0.762 | S | S | * | * | trans | 89.7 | 159 | 169.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 692 | C | 26.3 | Very low | 29.6 | Very low | 123 Ų | 123 | 122.1 Ų | 122.1 | 83% | 0.831 | 76% | 0.763 | S | S | * | * | cis | -165.8 | 160.7 | -6.6 | -150 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 693 | V | 25.8 | Very low | 29.4 | Very low | 124 Ų | 124 | 121.2 Ų | 121.2 | 75% | 0.752 | 76% | 0.758 | S | S | * | * | trans | 65.6 | 126.2 | 161.3 | -156.6 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 694 | V | 25.9 | Very low | 29.1 | Very low | 135 Ų | 135 | 124 Ų | 124 | 82% | 0.818 | 76% | 0.763 | S | S | * | * | trans | -9.9 | 143.5 | 143.2 | -151.2 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 695 | S | 27.4 | Very low | 29.1 | Very low | 108 Ų | 108 | 125 Ų | 125 | 76% | 0.755 | 77% | 0.767 | S | S | * | * | -161.2 | 177.3 | 52.1 | 65.2 | 0 | 0 | 0 | 0 | 118 | |||||
| 696 | S | 30.3 | Very low | 29.1 | Very low | 101 Ų | 101 | 127.9 Ų | 127.9 | 71% | 0.706 | 77% | 0.772 | S | S | * | * | trans | -57.3 | 168.9 | 173.9 | 55.3 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 697 | T | 29.7 | Very low | 29.6 | Very low | 129 Ų | 129 | 124.2 Ų | 124.2 | 79% | 0.791 | 76% | 0.762 | S | S | * | * | cis | -145.4 | 168.7 | 28.2 | 40.4 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 698 | P | 39 | Very low | 29.5 | Very low | 110 Ų | 110 | 125 Ų | 125 | 71% | 0.714 | 76% | 0.762 | S | S | * | * | trans | -107.1 | 162.6 | 177.2 | 40.1 | -33.6 | 0 | 0 | 0 | 115 | ||||
| 699 | N | 31.3 | Very low | 29.4 | Very low | 142 Ų | 142 | 121.3 Ų | 121.3 | 76% | 0.759 | 75% | 0.754 | S | S | * | * | trans | 178 | 137.4 | 135.1 | -103.8 | -19.4 | 0 | 0 | 0 | 115.4 | ||||
| 700 | T | 30.1 | Very low | 29.3 | Very low | 123 Ų | 123 | 122 Ų | 122 | 76% | 0.755 | 76% | 0.758 | S | S | * | * | trans | 63.1 | 150.1 | 142.6 | 62.7 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 701 | V | 26.7 | Very low | 29.2 | Very low | 109 Ų | 109 | 119.7 Ų | 119.7 | 66% | 0.661 | 75% | 0.754 | S | S | * | * | cis | -167.2 | 141.6 | 2 | 110 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 702 | I | 27.2 | Very low | 29.3 | Very low | 144 Ų | 144 | 122.7 Ų | 122.7 | 74% | 0.738 | 75% | 0.752 | S | S | * | * | trans | 58.7 | 143.6 | 141.4 | -69.1 | 173.7 | 0 | 0 | 0 | 118.8 | ||||
| 703 | D | 28.1 | Very low | 29.8 | Very low | 123 Ų | 123 | 124.9 Ų | 124.9 | 66% | 0.658 | 76% | 0.755 | S | S | * | * | cis | -153.4 | 174.1 | 16 | -140.5 | 1.6 | 0 | 0 | 0 | 115.1 | ||||
| 704 | N | 26.3 | Very low | 29.8 | Very low | 133 Ų | 133 | 126.2 Ų | 126.2 | 71% | 0.711 | 76% | 0.757 | S | S | * | * | trans | 11.3 | 152 | 151.7 | -61.1 | -44.5 | 0 | 0 | 0 | 122 | ||||
| 705 | I | 28.1 | Very low | 30.2 | Very low | 162 Ų | 162 | 126.8 Ų | 126.8 | 83% | 0.831 | 76% | 0.76 | S | S | * | * | cis | -155 | 158.3 | 44.6 | -68.8 | 170.7 | 0 | 0 | 0 | 111.7 | ||||
| 706 | T | 29.2 | Very low | 30.3 | Very low | 127 Ų | 127 | 126 Ų | 126 | 78% | 0.779 | 75% | 0.748 | S | S | * | * | trans | -123.8 | 179.2 | 175.4 | 45.7 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 707 | P | 37.6 | Very low | 30.4 | Very low | 118 Ų | 118 | 129.7 Ų | 129.7 | 77% | 0.766 | 75% | 0.754 | S | S | * | * | cis | -134.1 | -166.8 | -42 | 38.3 | -20.3 | 0 | 0 | 0 | 112.9 | ||||
| 708 | S | 26.7 | Very low | 30.5 | Very low | 110 Ų | 110 | 127.9 Ų | 127.9 | 77% | 0.769 | 75% | 0.746 | S | S | * | * | trans | 139.4 | 137.8 | 130.1 | -163.4 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 709 | A | 29.5 | Very low | 30.1 | Very low | 86 Ų | 86 | 132.3 Ų | 132.3 | 71% | 0.711 | 75% | 0.749 | S | S | * | * | trans | 55.4 | 153.4 | 152.2 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 710 | N | 28.8 | Very low | 30.3 | Very low | 166 Ų | 166 | 132.7 Ų | 132.7 | 89% | 0.888 | 75% | 0.75 | S | S | * | * | cis | -157.9 | 171 | -7.7 | -133.8 | -16.6 | 0 | 0 | 0 | 110.5 | ||||
| 711 | G | 31.4 | Very low | 30.4 | Very low | 63 Ų | 63 | 130.3 Ų | 130.3 | 65% | 0.649 | 74% | 0.743 | S | S | * | * | trans | 117.9 | 80 | 150.1 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 712 | N | 31 | Very low | 30.8 | Very low | 141 Ų | 141 | 128.1 Ų | 128.1 | 75% | 0.754 | 74% | 0.736 | S | S | * | * | trans | 13.9 | 135.5 | 141.1 | -53 | -10.5 | 0 | 0 | 0 | 121.6 | ||||
| 713 | N | 35 | Very low | 31 | Very low | 168 Ų | 168 | 123.2 Ų | 123.2 | 90% | 0.898 | 72% | 0.721 | S | S | * | * | -164.6 | 161.6 | 107.5 | -103.7 | -46.3 | 0 | 0 | 0 | 114 | |||||
| 714 | I | 27.7 | Very low | 31.3 | Very low | 153 Ų | 153 | 120.4 Ų | 120.4 | 79% | 0.785 | 72% | 0.715 | S | S | * | * | trans | -114 | 137.9 | -161.1 | -62.6 | 162.8 | 0 | 0 | 0 | 112 | ||||
| 715 | V | 32.3 | Very low | 31.9 | Very low | 146 Ų | 146 | 121.8 Ų | 121.8 | 89% | 0.885 | 72% | 0.715 | S | S | * | * | trans | -138 | 138.4 | 160.1 | -177.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 716 | D | 30.9 | Very low | 32.3 | Very low | 92 Ų | 92 | 116.6 Ų | 116.6 | 49% | 0.492 | 70% | 0.696 | S | S | . | * | trans | -81.1 | 119 | -165.5 | 177.4 | 26.1 | 0 | 0 | 0 | 114.3 | S718 | D716-S718 WeakPolarHBondContact OD1-CB 3.18Å; D716-S718 PolarHBondContact OD1-N 2.79Å; D716-S718 PolarHBondContact OD1-OG 2.72Å | ||
| 717 | Q | 32.9 | Very low | 32.7 | Very low | 179 Ų | 179 | 117.4 Ų | 117.4 | 84% | 0.836 | 69% | 0.689 | S | S | * | * | trans | -86.3 | -6 | 174.1 | -71.4 | -167.9 | -6.4 | 0 | 0 | 114.1 | R719 L720 | Q717-R719 PolarHBondContact O-N 2.99Å; Q717-L720 PolarHBondContact O-N 3.11Å | ||
| 718 | S | 31.6 | Very low | 32.6 | Very low | 90 Ų | 90 | 118.5 Ų | 118.5 | 63% | 0.629 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -63.2 | -12.6 | -171.5 | -48.8 | 0 | 0 | 0 | 0 | 114.6 | D716 | D716-S718 WeakPolarHBondContact OD1-CB 3.18Å; D716-S718 PolarHBondContact OD1-N 2.79Å; D716-S718 PolarHBondContact OD1-OG 2.72Å |
| 719 | R | 30.7 | Very low | 33.6 | Very low | 203 Ų | 203 | 118.9 Ų | 118.9 | 77% | 0.766 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -91.9 | -20.5 | -174.7 | -68.4 | -173.8 | 170.2 | -131.9 | -4.8 | 115.5 | Q717 G723 | Q717-R719 PolarHBondContact O-N 2.99Å; R719-G723 PolarHBondContact O-N 2.87Å |
| 720 | L | 33.8 | Very low | 34 | Very low | 151 Ų | 151 | 117.2 Ų | 117.2 | 79% | 0.791 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -77.9 | -38.1 | 179.5 | -107.9 | 73 | 0 | 0 | 0 | 112.9 | Q717 A722 G723 A724 | Q717-L720 PolarHBondContact O-N 3.11Å; L720-A722 VanDerWaalsContact C-N 3.34Å; L720-A722 PolarHBondContact O-N 3.45Å; L720-G723 PolarHBondContact O-N 3Å; L720-G723 VanDerWaalsContact O-N 3.12Å; L720-A724 PolarHBondContact O-N 3.21Å |
| 721 | A | 33.8 | Very low | 34.6 | Very low | 73 Ų | 73 | 113 Ų | 113 | 60% | 0.603 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -61.9 | -41.4 | 179 | 0 | 0 | 0 | 0 | 0 | 112.1 | G723 A724 F725 | A721-G723 VanDerWaalsContact C-N 3.34Å; A721-G723 PolarHBondContact O-N 3.31Å; A721-A724 PolarHBondContact O-N 3.37Å; A721-F725 PolarHBondContact O-N 3.43Å; A721-F725 VanDerWaalsContact O-N 3.09Å |
| 722 | A | 33.5 | Very low | 35.4 | Very low | 62 Ų | 62 | 115.3 Ų | 115.3 | 51% | 0.512 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -63.1 | -38.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | L720 F725 A726 | L720-A722 VanDerWaalsContact C-N 3.34Å; L720-A722 PolarHBondContact O-N 3.45Å; A722-F725 PolarHBondContact O-N 2.93Å; A722-A726 VanDerWaalsContact O-CB 3.28Å; A722-A726 WeakPolarHBondContact O-CB 3.41Å; A722-A726 PolarHBondContact O-N 3.22Å |
| 723 | G | 32.4 | Very low | 36.1 | Very low | 42 Ų | 42 | 113.7 Ų | 113.7 | 43% | 0.433 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -64.4 | -42.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | R719 L720 A721 A726 F727 | R719-G723 PolarHBondContact O-N 2.87Å; L720-G723 PolarHBondContact O-N 3Å; L720-G723 VanDerWaalsContact O-N 3.12Å; A721-G723 VanDerWaalsContact C-N 3.34Å; A721-G723 PolarHBondContact O-N 3.31Å; G723-A726 PolarHBondContact O-N 2.89Å; G723-F727 WeakPolarHBondContact O-CB 3.46Å; G723-F727 PolarHBondContact O-N 3.33Å |
| 724 | A | 34.7 | Very low | 36.4 | Very low | 63 Ų | 63 | 111.7 Ų | 111.7 | 52% | 0.521 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -65.9 | -41.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | L720 A721 F727 F728 | L720-A724 PolarHBondContact O-N 3.21Å; A721-A724 PolarHBondContact O-N 3.37Å; A724-F727 PolarHBondContact O-N 3.34Å; A724-F728 PolarHBondContact O-N 2.99Å |
| 725 | F | 37.5 | Very low | 37 | Very low | 162 Ų | 162 | 110.1 Ų | 110.1 | 71% | 0.711 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -66.3 | -41.5 | 176.7 | -136.6 | -88.9 | 0 | 0 | 0 | 111.8 | A721 A722 F728 Q729 | A721-F725 PolarHBondContact O-N 3.43Å; A721-F725 VanDerWaalsContact O-N 3.09Å; A722-F725 PolarHBondContact O-N 2.93Å; F725-F728 PolarHBondContact O-N 3.5Å; F725-Q729 VanDerWaalsContact O-CB 3.3Å; F725-Q729 WeakPolarHBondContact O-CB 3.5Å; F725-Q729 PolarHBondContact O-N 3.4Å |
| 726 | A | 37.6 | Very low | 37.5 | Very low | 54 Ų | 54 | 107.9 Ų | 107.9 | 45% | 0.446 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.9 | -37.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | A722 G723 A730 | A722-A726 VanDerWaalsContact O-CB 3.28Å; A722-A726 WeakPolarHBondContact O-CB 3.41Å; A722-A726 PolarHBondContact O-N 3.22Å; G723-A726 PolarHBondContact O-N 2.89Å; A726-A730 WeakPolarHBondContact O-CB 3.07Å; A726-A730 PolarHBondContact O-N 2.93Å |
| 727 | F | 36.5 | Very low | 37.8 | Very low | 143 Ų | 143 | 106.6 Ų | 106.6 | 63% | 0.627 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -64.8 | -44.5 | 174.8 | -175 | -89.5 | 0 | 0 | 0 | 111.8 | G723 A724 A730 Q731 | G723-F727 WeakPolarHBondContact O-CB 3.46Å; G723-F727 PolarHBondContact O-N 3.33Å; A724-F727 PolarHBondContact O-N 3.34Å; F727-A730 PolarHBondContact O-N 3.15Å; F727-Q731 WeakPolarHBondContact O-CB 3.03Å; F727-Q731 PolarHBondContact O-N 3.31Å |
| 728 | F | 37.2 | Very low | 37.9 | Very low | 142 Ų | 142 | 102.2 Ų | 102.2 | 62% | 0.623 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -68.3 | -38.7 | 177.6 | -130.4 | -88.4 | 0 | 0 | 0 | 112.1 | A724 F725 Q731 Q732 | A724-F728 PolarHBondContact O-N 2.99Å; F725-F728 PolarHBondContact O-N 3.5Å; F728-Q731 PolarHBondContact O-N 3.17Å; F728-Q732 WeakPolarHBondContact O-CB 3.37Å; F728-Q732 PolarHBondContact O-N 2.84Å |
| 729 | Q | 46.5 | Very low | 38.5 | Very low | 118 Ų | 118 | 106 Ų | 106 | 55% | 0.551 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -65.4 | -39.6 | 173.3 | -170.7 | 171.3 | 44.7 | 0 | 0 | 111.6 | F725 Q733 | F725-Q729 VanDerWaalsContact O-CB 3.3Å; F725-Q729 WeakPolarHBondContact O-CB 3.5Å; F725-Q729 PolarHBondContact O-N 3.4Å; Q729-Q733 WeakPolarHBondContact O-CB 3.41Å; Q729-Q733 VanDerWaalsContact O-CG 3.23Å; Q729-Q733 WeakPolarHBondContact O-CG 3.29Å; Q729-Q733 PolarHBondContact O-N 3.08Å |
| 730 | A | 39.2 | Very low | 38.5 | Very low | 51 Ų | 51 | 104.3 Ų | 104.3 | 42% | 0.421 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -67.4 | -36.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | A726 F727 Q733 L734 | A726-A730 WeakPolarHBondContact O-CB 3.07Å; A726-A730 PolarHBondContact O-N 2.93Å; F727-A730 PolarHBondContact O-N 3.15Å; A730-Q733 CarbonylContact O-C 3.53Å; A730-Q733 PolarHBondContact O-N 3.45Å; A730-L734 VanDerWaalsContact O-CB 3.29Å; A730-L734 WeakPolarHBondContact O-CB 3.33Å; A730-L734 PolarHBondContact O-N 3.02Å |
| 731 | Q | 41.2 | Very low | 38.4 | Very low | 76 Ų | 76 | 105.9 Ų | 105.9 | 36% | 0.355 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -70.6 | -39 | 176.5 | -170.4 | 172.9 | 9 | 0 | 0 | 111.8 | F727 F728 Q733 L734 M735 | F727-Q731 WeakPolarHBondContact O-CB 3.03Å; F727-Q731 PolarHBondContact O-N 3.31Å; F728-Q731 PolarHBondContact O-N 3.17Å; Q731-Q733 VanDerWaalsContact C-N 3.34Å; Q731-L734 PolarHBondContact O-N 3.24Å; Q731-M735 PolarHBondContact O-N 3.39Å |
| 732 | Q | 47.2 | Very low | 38.4 | Very low | 112 Ų | 112 | 113.3 Ų | 113.3 | 52% | 0.523 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -61.5 | -42.8 | 169.9 | -168.6 | 74 | 75.6 | 0 | 0 | 111 | F728 N736 | F728-Q732 WeakPolarHBondContact O-CB 3.37Å; F728-Q732 PolarHBondContact O-N 2.84Å; Q732-N736 WeakPolarHBondContact O-CB 3.25Å; Q732-N736 PolarHBondContact O-N 2.82Å; Q732-N736 VanDerWaalsContact O-N 3.1Å; Q732-N736 PolarHBondContact O-OD1 2.79Å |
| 733 | Q | 45.9 | Very low | 38.5 | Very low | 107 Ų | 107 | 118.9 Ų | 118.9 | 50% | 0.5 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -67.3 | -34 | 173.7 | -73.7 | 169.9 | 1.9 | 0 | 0 | 112.5 | Q729 A730 Q731 N736 A737 | Q729-Q733 WeakPolarHBondContact O-CB 3.41Å; Q729-Q733 VanDerWaalsContact O-CG 3.23Å; Q729-Q733 WeakPolarHBondContact O-CG 3.29Å; Q729-Q733 PolarHBondContact O-N 3.08Å; A730-Q733 CarbonylContact O-C 3.53Å; A730-Q733 PolarHBondContact O-N 3.45Å; Q731-Q733 VanDerWaalsContact C-N 3.34Å; Q733-N736 PolarHBondContact O-N 2.96Å; Q733-A737 WeakPolarHBondContact O-CB 3.25Å; Q733-A737 PolarHBondContact O-N 2.96Å |
| 734 | L | 41 | Very low | 38.4 | Very low | 127 Ų | 127 | 121.6 Ų | 121.6 | 67% | 0.665 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -71.4 | -42.4 | 179.3 | -160.4 | 79 | 0 | 0 | 0 | 111.7 | A730 Q731 N736 A737 A738 | A730-L734 VanDerWaalsContact O-CB 3.29Å; A730-L734 WeakPolarHBondContact O-CB 3.33Å; A730-L734 PolarHBondContact O-N 3.02Å; Q731-L734 PolarHBondContact O-N 3.24Å; L734-N736 VanDerWaalsContact C-N 3.35Å; L734-A737 PolarHBondContact O-N 3.46Å; L734-A738 WeakPolarHBondContact O-CB 3.49Å; L734-A738 PolarHBondContact O-N 2.8Å |
| 735 | M | 40.9 | Very low | 38.1 | Very low | 119 Ų | 119 | 124 Ų | 124 | 59% | 0.586 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -64.2 | -40.2 | 172.8 | -72.6 | -169.7 | 175.4 | 0 | 0 | 111.6 | Q731 A738 | Q731-M735 PolarHBondContact O-N 3.39Å; M735-A738 PolarHBondContact O-N 3.39Å |
| 736 | N | 43.6 | Very low | 37.9 | Very low | 99 Ų | 99 | 119 Ų | 119 | 53% | 0.529 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -70.3 | -31.2 | 176.2 | -66.7 | 5.7 | 0 | 0 | 0 | 112.5 | Q732 Q733 L734 | Q732-N736 WeakPolarHBondContact O-CB 3.25Å; Q732-N736 PolarHBondContact O-N 2.82Å; Q732-N736 VanDerWaalsContact O-N 3.1Å; Q732-N736 PolarHBondContact O-OD1 2.79Å; Q733-N736 PolarHBondContact O-N 2.96Å; L734-N736 VanDerWaalsContact C-N 3.35Å |
| 737 | A | 36.4 | Very low | 37.5 | Very low | 66 Ų | 66 | 122.8 Ų | 122.8 | 55% | 0.545 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -78.5 | -27.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q733 L734 Q739 Q740 | Q733-A737 WeakPolarHBondContact O-CB 3.25Å; Q733-A737 PolarHBondContact O-N 2.96Å; L734-A737 PolarHBondContact O-N 3.46Å; A737-Q739 PolarHBondContact O-N 3.48Å; A737-Q739 VanDerWaalsContact O-N 3.09Å; A737-Q740 PolarHBondContact O-N 3.27Å |
| 738 | A | 35.8 | Very low | 37.2 | Very low | 86 Ų | 86 | 120.2 Ų | 120.2 | 71% | 0.711 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.9 | -7.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | L734 M735 | L734-A738 WeakPolarHBondContact O-CB 3.49Å; L734-A738 PolarHBondContact O-N 2.8Å; M735-A738 PolarHBondContact O-N 3.39Å |
| 739 | Q | 42.7 | Very low | 36.9 | Very low | 171 Ų | 171 | 116.3 Ų | 116.3 | 80% | 0.799 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109 | 6.3 | -177.6 | -65 | -170.3 | -29.1 | 0 | 0 | 114.7 | A737 | A737-Q739 PolarHBondContact O-N 3.48Å; A737-Q739 VanDerWaalsContact O-N 3.09Å |
| 740 | Q | 32.4 | Very low | 36 | Very low | 167 Ų | 167 | 112.7 Ų | 112.7 | 78% | 0.78 | 63% | 0.629 | S | S | * | * | trans | -131.7 | 51.9 | -173.2 | -64.7 | -166 | -11.8 | 0 | 0 | 115.2 | A737 | A737-Q740 PolarHBondContact O-N 3.27Š| ||
| 741 | Q | 31.4 | Very low | 35.5 | Very low | 184 Ų | 184 | 114 Ų | 114 | 86% | 0.86 | 64% | 0.635 | S | S | * | * | trans | -136.5 | 144.6 | 162.7 | -73.7 | -160.5 | -8.8 | 0 | 0 | 113.5 | ||||
| 742 | R | 32.9 | Very low | 34.9 | Very low | 228 Ų | 228 | 115.8 Ų | 115.8 | 86% | 0.86 | 65% | 0.65 | S | S | * | * | trans | 75.2 | 140.1 | -173.9 | -47.3 | -179.5 | -178.8 | -179.6 | 1.6 | 115.6 | ||||
| 743 | H | 36.7 | Very low | 34 | Very low | 180 Ų | 180 | 115.2 Ų | 115.2 | 83% | 0.833 | 66% | 0.655 | S | S | * | * | cis | -164.3 | 175.1 | -33.3 | -102.2 | -44 | 0 | 0 | 0 | 107.5 | ||||
| 744 | S | 29.5 | Very low | 33.1 | Very low | 98 Ų | 98 | 113.7 Ų | 113.7 | 69% | 0.685 | 66% | 0.656 | S | S | * | * | trans | -135.1 | 168.6 | -174.2 | -47 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 745 | T | 29.1 | Very low | 32.5 | Very low | 114 Ų | 114 | 113.6 Ų | 113.6 | 70% | 0.699 | 66% | 0.656 | S | S | * | * | trans | 77.4 | 149.4 | 169.1 | 72.5 | 0 | 0 | 0 | 0 | 117 | T156 | T156-T745 VanDerWaalsContact OG1-CA 3.3Å; T156-T745 WeakPolarHBondContact OG1-CA 3.31Å | ||
| 746 | A | 31.6 | Very low | 31.9 | Very low | 57 Ų | 57 | 114.3 Ų | 114.3 | 47% | 0.471 | 66% | 0.662 | S | S | . | * | cis | -153.5 | 143 | -11.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | T156 | T156-A746 WeakPolarHBondContact OG1-CA 3.32Å; T156-A746 PolarHBondContact OG1-N 3.02Å | ||
| 747 | L | 31 | Very low | 31.3 | Very low | 133 Ų | 133 | 114.5 Ų | 114.5 | 70% | 0.696 | 67% | 0.671 | S | S | * | * | trans | 42.1 | 133.3 | 150.4 | -61.4 | 165.3 | 0 | 0 | 0 | 122.9 | ||||
| 748 | S | 30.2 | Very low | 31.1 | Very low | 89 Ų | 89 | 116.1 Ų | 116.1 | 62% | 0.622 | 68% | 0.679 | S | S | * | * | 166.9 | 136 | 111.7 | 49.2 | 0 | 0 | 0 | 0 | 117.7 | |||||
| 749 | G | 29.1 | Very low | 30.8 | Very low | 61 Ų | 61 | 118.9 Ų | 118.9 | 63% | 0.629 | 68% | 0.681 | S | S | * | * | 59.5 | 125.7 | 128 | 0 | 0 | 0 | 0 | 0 | 125 | S160 N161 | S160-G749 PolarHBondContact OG-O 2.96Å; N161-G749 PolarHBondContact ND2-O 3.41Å | |||
| 750 | G | 28.7 | Very low | 30.1 | Very low | 42 Ų | 42 | 115.5 Ų | 115.5 | 43% | 0.433 | 68% | 0.675 | S | S | . | * | trans | 154.7 | 75.7 | 156.2 | 0 | 0 | 0 | 0 | 0 | 118.3 | N161 C162 | N161-G750 WeakPolarHBondContact CB-O 3.36Å; N161-G750 PolarHBondContact ND2-N 3.49Å; C162-G750 WeakPolarHBondContact CB-O 3.41Å | ||
| 751 | S | 27.7 | Very low | 30.1 | Very low | 78 Ų | 78 | 114.9 Ų | 114.9 | 55% | 0.545 | 68% | 0.676 | S | S | . | * | trans | -58.1 | 164.3 | 176.2 | -161 | 0 | 0 | 0 | 0 | 113.7 | S163 | S163-S751 PolarHBondContact OG-OG 3.39Š| ||
| 752 | V | 28.3 | Very low | 29.9 | Very low | 113 Ų | 113 | 110.2 Ų | 110.2 | 69% | 0.685 | 67% | 0.669 | S | S | * | * | 178.5 | 133.7 | 96.9 | 145.7 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 753 | V | 28.3 | Very low | 30 | Very low | 101 Ų | 101 | 104.7 Ų | 104.7 | 61% | 0.612 | 66% | 0.663 | S | S | * | * | trans | 53.3 | 118 | 146.1 | 177.2 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 754 | S | 27.4 | Very low | 29.6 | Very low | 75 Ų | 75 | 102.4 Ų | 102.4 | 52% | 0.524 | 66% | 0.661 | S | S | . | * | 68.3 | 162.4 | 74.8 | -28.8 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 755 | N | 28.7 | Very low | 29.7 | Very low | 124 Ų | 124 | 103.1 Ų | 103.1 | 66% | 0.663 | 66% | 0.662 | S | S | * | * | cis | -163.6 | 156.9 | 17.1 | -141.3 | 2 | 0 | 0 | 0 | 112.9 | ||||
| 756 | N | 29.1 | Very low | 29.7 | Very low | 134 Ų | 134 | 103.3 Ų | 103.3 | 72% | 0.717 | 66% | 0.662 | S | S | * | * | trans | 40.9 | 146.4 | 141.2 | -66.2 | -9 | 0 | 0 | 0 | 122.1 | ||||
| 757 | S | 30.1 | Very low | 29.6 | Very low | 103 Ų | 103 | 105.8 Ų | 105.8 | 72% | 0.72 | 68% | 0.677 | S | S | * | * | -176.4 | 163.3 | 63.4 | 43.2 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 758 | S | 31.5 | Very low | 29.6 | Very low | 101 Ų | 101 | 104.9 Ų | 104.9 | 71% | 0.706 | 68% | 0.681 | S | S | * | * | trans | 83.9 | 149.2 | 178 | -48.5 | 0 | 0 | 0 | 0 | 115 | ||||
| 759 | N | 31.3 | Very low | 29.7 | Very low | 143 Ų | 143 | 106.7 Ų | 106.7 | 77% | 0.765 | 69% | 0.689 | S | S | * | * | cis | -171 | 157.4 | -20.9 | -103.4 | -22.2 | 0 | 0 | 0 | 108.2 | ||||
| 760 | C | 27.9 | Very low | 30 | Very low | 100 Ų | 100 | 108.5 Ų | 108.5 | 68% | 0.676 | 69% | 0.689 | S | S | * | * | cis | -168.4 | 172.1 | -21.7 | -142.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 761 | I | 31.4 | Very low | 30.1 | Very low | 155 Ų | 155 | 114 Ų | 114 | 80% | 0.795 | 71% | 0.708 | S | S | * | * | trans | 65.1 | 108.4 | 163.5 | -58.7 | 159 | 0 | 0 | 0 | 114.6 | ||||
| 762 | A | 27.2 | Very low | 30.3 | Very low | 86 Ų | 86 | 116.5 Ų | 116.5 | 71% | 0.711 | 72% | 0.72 | S | S | * | * | cis | 68.3 | 155.6 | 45.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 763 | P | 35.6 | Very low | 30.5 | Very low | 112 Ų | 112 | 115.9 Ų | 115.9 | 73% | 0.727 | 72% | 0.72 | S | S | * | * | cis | -116.4 | 159.4 | -3.1 | 11.8 | 14.9 | 0 | 0 | 0 | 113.8 | ||||
| 764 | T | 28.8 | Very low | 30.9 | Very low | 131 Ų | 131 | 115.4 Ų | 115.4 | 80% | 0.804 | 72% | 0.72 | S | S | * | * | 84 | 155.1 | 69.3 | -40.5 | 0 | 0 | 0 | 0 | 116.4 | |||||
| 765 | V | 30.5 | Very low | 31.2 | Very low | 114 Ų | 114 | 120.3 Ų | 120.3 | 69% | 0.691 | 73% | 0.732 | S | S | * | * | trans | 116.6 | 83.4 | 152.1 | -169.8 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 766 | T | 29.2 | Very low | 31.3 | Very low | 117 Ų | 117 | 120 Ų | 120 | 72% | 0.718 | 73% | 0.734 | S | S | * | * | trans | 65.1 | 149 | 132.6 | 65.6 | 0 | 0 | 0 | 0 | 127.4 | ||||
| 767 | S | 30.2 | Very low | 31.4 | Very low | 110 Ų | 110 | 118.2 Ų | 118.2 | 77% | 0.769 | 73% | 0.733 | S | S | * | * | trans | 78.8 | 149.1 | 141.5 | 67.6 | 0 | 0 | 0 | 0 | 120 | ||||
| 768 | S | 31.3 | Very low | 31.2 | Very low | 113 Ų | 113 | 118.2 Ų | 118.2 | 79% | 0.79 | 73% | 0.733 | S | S | * | * | cis | -162.6 | 168.5 | -8.5 | 36.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 769 | T | 31.8 | Very low | 31.1 | Very low | 128 Ų | 128 | 119.3 Ų | 119.3 | 79% | 0.785 | 73% | 0.734 | S | S | * | * | trans | -89.5 | -160.7 | 175.4 | 58 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 770 | P | 35.9 | Very low | 30.9 | Very low | 99 Ų | 99 | 118.6 Ų | 118.6 | 64% | 0.643 | 74% | 0.735 | S | S | * | * | cis | -144.1 | -156.4 | 0 | 30.1 | -1.6 | 0 | 0 | 0 | 116.2 | ||||
| 771 | L | 30.4 | Very low | 31 | Very low | 156 Ų | 156 | 119.8 Ų | 119.8 | 82% | 0.817 | 74% | 0.74 | S | S | * | * | trans | 86.2 | 146 | 160.2 | -49.3 | 172.7 | 0 | 0 | 0 | 117.1 | ||||
| 772 | V | 31.8 | Very low | 30.9 | Very low | 131 Ų | 131 | 119.5 Ų | 119.5 | 79% | 0.794 | 74% | 0.739 | S | S | * | * | cis | -151.6 | 169 | -3.3 | 105.7 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 773 | S | 31.5 | Very low | 31.3 | Very low | 100 Ų | 100 | 120.8 Ų | 120.8 | 70% | 0.699 | 74% | 0.741 | S | S | * | * | trans | -106.7 | -152 | -176.7 | 60.1 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 774 | P | 37.5 | Very low | 30.9 | Very low | 92 Ų | 92 | 119.9 Ų | 119.9 | 60% | 0.597 | 74% | 0.737 | S | S | * | * | cis | -142.4 | -149.8 | 4.6 | 43.5 | -19.9 | 0 | 0 | 0 | 116.1 | ||||
| 775 | F | 32.7 | Very low | 30.7 | Very low | 178 Ų | 178 | 120.3 Ų | 120.3 | 78% | 0.781 | 73% | 0.734 | S | S | * | * | trans | 91.7 | 92.1 | 174.2 | -58 | -69.9 | 0 | 0 | 0 | 116.5 | ||||
| 776 | T | 31.8 | Very low | 30.6 | Very low | 117 Ų | 117 | 124 Ų | 124 | 72% | 0.718 | 74% | 0.737 | S | S | * | * | 75.1 | 142.9 | 67.5 | 65.3 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 777 | S | 30.3 | Very low | 30.5 | Very low | 97 Ų | 97 | 127.2 Ų | 127.2 | 68% | 0.678 | 74% | 0.742 | S | S | * | * | cis | -168.8 | 137.7 | -7 | -104.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 778 | S | 27.4 | Very low | 30.4 | Very low | 103 Ų | 103 | 125.8 Ų | 125.8 | 72% | 0.72 | 74% | 0.744 | S | S | * | * | 78 | 159.7 | 95.3 | -46.1 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 779 | V | 28.9 | Very low | 30.4 | Very low | 123 Ų | 123 | 123.9 Ų | 123.9 | 75% | 0.745 | 74% | 0.743 | S | S | * | * | trans | 73.6 | 121.3 | 173.9 | -158 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 780 | V | 26.3 | Very low | 30.4 | Very low | 129 Ų | 129 | 124.5 Ų | 124.5 | 78% | 0.782 | 74% | 0.74 | S | S | * | * | cis | 84.1 | 155.2 | 36.5 | -173.7 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 781 | T | 29.7 | Very low | 30.3 | Very low | 125 Ų | 125 | 129.4 Ų | 129.4 | 77% | 0.767 | 75% | 0.747 | S | S | * | * | trans | 85.4 | 131.8 | 175.9 | 73.4 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 782 | N | 29.9 | Very low | 30.5 | Very low | 148 Ų | 148 | 126.3 Ų | 126.3 | 79% | 0.791 | 74% | 0.739 | S | S | * | * | trans | -91.8 | 146.3 | 154.4 | -162.6 | 15.3 | 0 | 0 | 0 | 105.3 | ||||
| 783 | P | 35.1 | Very low | 30.7 | Very low | 113 Ų | 113 | 125.8 Ų | 125.8 | 73% | 0.734 | 74% | 0.741 | S | S | * | * | -153 | -173.9 | 84.1 | 41.9 | -22.7 | 0 | 0 | 0 | 116 | |||||
| 784 | S | 27.6 | Very low | 30.8 | Very low | 93 Ų | 93 | 124.3 Ų | 124.3 | 65% | 0.65 | 74% | 0.741 | S | S | * | * | trans | -56.3 | 166.5 | 178 | -38.2 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 785 | N | 26 | Very low | 30.5 | Very low | 141 Ų | 141 | 125.3 Ų | 125.3 | 75% | 0.754 | 75% | 0.751 | S | S | * | * | trans | 113 | 124.4 | 139.9 | -73.4 | -15.8 | 0 | 0 | 0 | 120.5 | ||||
| 786 | Y | 26.4 | Very low | 30.5 | Very low | 191 Ų | 191 | 122.7 Ų | 122.7 | 75% | 0.749 | 75% | 0.749 | S | S | * | * | trans | 94.2 | 108.8 | 135.3 | -87.1 | -132 | 0 | 0 | 0 | 122.1 | ||||
| 787 | F | 27.3 | Very low | 30.3 | Very low | 185 Ų | 185 | 123.6 Ų | 123.6 | 81% | 0.811 | 75% | 0.754 | S | S | * | * | 101.4 | 124.6 | 124.9 | -106.2 | -109.3 | 0 | 0 | 0 | 122.8 | |||||
| 788 | G | 28.8 | Very low | 30.2 | Very low | 80 Ų | 80 | 122.5 Ų | 122.5 | 83% | 0.825 | 76% | 0.758 | S | S | * | * | trans | 76.3 | 134 | 162.4 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 789 | G | 30.5 | Very low | 30.2 | Very low | 73 Ų | 73 | 120.9 Ų | 120.9 | 75% | 0.753 | 76% | 0.758 | S | S | * | * | cis | 165 | 158.2 | -1 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 790 | L | 32.3 | Very low | 30.1 | Very low | 141 Ų | 141 | 123.4 Ų | 123.4 | 74% | 0.738 | 77% | 0.766 | S | S | * | * | cis | -159.1 | 165.8 | 3.1 | -95.5 | 162.5 | 0 | 0 | 0 | 109.8 | ||||
| 791 | Y | 33.5 | Very low | 30.3 | Very low | 202 Ų | 202 | 124.7 Ų | 124.7 | 79% | 0.792 | 77% | 0.769 | S | S | * | * | trans | 75.4 | 133 | 161.4 | -60 | -57 | 0 | 0 | 0 | 120.3 | ||||
| 792 | S | 34 | Very low | 30.5 | Very low | 90 Ų | 90 | 124.3 Ų | 124.3 | 63% | 0.629 | 77% | 0.768 | S | S | * | * | cis | -162.4 | 148.9 | -16.5 | -150 | 0 | 0 | 0 | 0 | 114 | ||||
| 793 | S | 36.3 | Very low | 30.3 | Very low | 120 Ų | 120 | 120.5 Ų | 120.5 | 84% | 0.839 | 76% | 0.764 | S | S | * | * | trans | 52 | 134.9 | 149.2 | -47.1 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 794 | G | 34.1 | Very low | 29.9 | Very low | 69 Ų | 69 | 122.4 Ų | 122.4 | 71% | 0.711 | 77% | 0.768 | S | S | * | * | cis | 172.5 | 132.7 | -4.6 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 795 | S | 32.4 | Very low | 29.9 | Very low | 114 Ų | 114 | 127 Ų | 127 | 80% | 0.797 | 78% | 0.777 | S | S | * | * | 63.7 | 139.1 | 66.5 | -137.7 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 796 | V | 31 | Very low | 30 | Very low | 123 Ų | 123 | 125.3 Ų | 125.3 | 75% | 0.745 | 78% | 0.776 | S | S | * | * | cis | -152 | 146.7 | 41.7 | 175.9 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 797 | V | 29.3 | Very low | 30.4 | Very low | 136 Ų | 136 | 122.7 Ų | 122.7 | 82% | 0.824 | 77% | 0.773 | S | S | * | * | trans | -3.7 | 153.4 | 142.4 | -168.7 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 798 | G | 27.7 | Very low | 30.7 | Very low | 73 Ų | 73 | 119.4 Ų | 119.4 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | cis | 137.9 | 149.7 | 13.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 799 | G | 27.2 | Very low | 30.7 | Very low | 70 Ų | 70 | 122.3 Ų | 122.3 | 72% | 0.722 | 77% | 0.767 | S | S | * | * | 143.1 | 176.3 | 53 | 0 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 800 | L | 27.2 | Very low | 30.7 | Very low | 176 Ų | 176 | 122.3 Ų | 122.3 | 92% | 0.921 | 77% | 0.767 | S | S | * | * | trans | 67.8 | 144.3 | -178.8 | -45.9 | 176.3 | 0 | 0 | 0 | 114 | ||||
| 801 | N | 29.3 | Very low | 30.4 | Very low | 156 Ų | 156 | 122.2 Ų | 122.2 | 83% | 0.834 | 77% | 0.766 | S | S | * | * | cis | -161.9 | 168.9 | 44.8 | -151.1 | 23.2 | 0 | 0 | 0 | 110.5 | ||||
| 802 | P | 33.7 | Very low | 30.1 | Very low | 116 Ų | 116 | 119 Ų | 119 | 75% | 0.753 | 76% | 0.763 | S | S | * | * | trans | -112.2 | 163.8 | -176.4 | 39.8 | -31.1 | 0 | 0 | 0 | 116.1 | ||||
| 803 | G | 27.2 | Very low | 29.8 | Very low | 69 Ų | 69 | 121.6 Ų | 121.6 | 71% | 0.711 | 77% | 0.769 | S | S | * | * | trans | 128.4 | 119.3 | 145.8 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 804 | N | 26.7 | Very low | 29.9 | Very low | 152 Ų | 152 | 122.9 Ų | 122.9 | 81% | 0.813 | 77% | 0.765 | S | S | * | * | trans | 58.1 | 165.7 | 145.5 | -73.5 | 8.3 | 0 | 0 | 0 | 123.3 | ||||
| 805 | F | 26.7 | Very low | 29.8 | Very low | 191 Ų | 191 | 125 Ų | 125 | 84% | 0.838 | 77% | 0.766 | S | S | * | * | trans | 73.7 | 134.2 | 173.6 | -62.3 | -85.3 | 0 | 0 | 0 | 116.6 | ||||
| 806 | S | 29.2 | Very low | 29.8 | Very low | 105 Ų | 105 | 124.5 Ų | 124.5 | 73% | 0.734 | 76% | 0.761 | S | S | * | * | cis | -158.6 | 162.3 | -13.5 | -142.3 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 807 | I | 33 | Very low | 29.5 | Very low | 135 Ų | 135 | 125.1 Ų | 125.1 | 69% | 0.692 | 76% | 0.764 | S | S | * | * | trans | -96.3 | 150 | 170.4 | -39.2 | 169 | 0 | 0 | 0 | 109.1 | ||||
| 808 | P | 35.2 | Very low | 29.4 | Very low | 117 Ų | 117 | 121.3 Ų | 121.3 | 76% | 0.76 | 75% | 0.753 | S | S | * | * | -129.2 | 140.5 | 111 | 6.2 | 15.5 | 0 | 0 | 0 | 111.3 | |||||
| 809 | N | 28.7 | Very low | 29.3 | Very low | 140 Ų | 140 | 125.7 Ų | 125.7 | 75% | 0.749 | 76% | 0.758 | S | S | * | * | 65.1 | 118.3 | 60.1 | -65.9 | -19.6 | 0 | 0 | 0 | 113 | |||||
| 810 | G | 29 | Very low | 29.3 | Very low | 73 Ų | 73 | 130.6 Ų | 130.6 | 75% | 0.753 | 77% | 0.767 | S | S | * | * | trans | 166.5 | 59 | -176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 811 | I | 27.1 | Very low | 29.4 | Very low | 139 Ų | 139 | 130.1 Ų | 130.1 | 71% | 0.713 | 76% | 0.76 | S | S | * | * | 71.6 | 103.8 | 85.6 | -65.4 | 171.9 | 0 | 0 | 0 | 112.4 | |||||
| 812 | N | 26.5 | Very low | 29.6 | Very low | 135 Ų | 135 | 127.2 Ų | 127.2 | 72% | 0.722 | 75% | 0.749 | S | S | * | * | trans | 69.9 | 159.6 | 144.4 | -68.7 | 0.1 | 0 | 0 | 0 | 119.2 | ||||
| 813 | L | 27.7 | Very low | 29.2 | Very low | 144 Ų | 144 | 130.2 Ų | 130.2 | 75% | 0.754 | 75% | 0.753 | S | S | * | * | cis | -150.4 | 141.7 | -5.8 | -121 | 158.3 | 0 | 0 | 0 | 109.3 | ||||
| 814 | L | 38.5 | Very low | 29.3 | Very low | 147 Ų | 147 | 129.8 Ų | 129.8 | 77% | 0.77 | 74% | 0.743 | S | S | * | * | trans | -57 | 152.5 | 148.3 | -91 | 162.4 | 0 | 0 | 0 | 108.5 | ||||
| 815 | P | 31.9 | Very low | 29.3 | Very low | 113 Ų | 113 | 128.9 Ų | 128.9 | 73% | 0.734 | 75% | 0.748 | S | S | * | * | -152.8 | -143.5 | 75 | 45.9 | -22.6 | 0 | 0 | 0 | 112.3 | |||||
| 816 | P | 33.2 | Very low | 29.4 | Very low | 105 Ų | 105 | 123.1 Ų | 123.1 | 68% | 0.682 | 74% | 0.743 | S | S | * | * | -134.5 | -151.2 | -125 | 35.5 | -8.5 | 0 | 0 | 0 | 113 | |||||
| 817 | V | 25.5 | Very low | 29.8 | Very low | 135 Ų | 135 | 123.7 Ų | 123.7 | 82% | 0.818 | 75% | 0.747 | S | S | * | * | trans | 73.8 | 142.7 | 170.6 | -165.9 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 818 | G | 26.9 | Very low | 30.2 | Very low | 57 Ų | 57 | 122.1 Ų | 122.1 | 59% | 0.588 | 75% | 0.746 | S | S | * | * | cis | -143 | 166.8 | 1.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 819 | L | 24.3 | Very low | 30 | Very low | 165 Ų | 165 | 123.3 Ų | 123.3 | 86% | 0.864 | 75% | 0.746 | S | S | * | * | 46.2 | 92 | 83.1 | -70.3 | 168.8 | 0 | 0 | 0 | 112.7 | |||||
| 820 | L | 27.1 | Very low | 30.1 | Very low | 172 Ų | 172 | 121 Ų | 121 | 90% | 0.901 | 74% | 0.741 | S | S | * | * | -171.9 | 122.9 | 108.9 | -96.9 | 162.2 | 0 | 0 | 0 | 112.3 | |||||
| 821 | H | 30.8 | Very low | 30.2 | Very low | 166 Ų | 166 | 124.3 Ų | 124.3 | 77% | 0.769 | 75% | 0.746 | S | S | * | * | trans | -62.6 | 164.7 | 146.8 | -132.4 | -115.7 | 0 | 0 | 0 | 107.8 | ||||
| 822 | P | 33.3 | Very low | 30.4 | Very low | 95 Ų | 95 | 121.9 Ų | 121.9 | 62% | 0.617 | 75% | 0.747 | S | S | * | * | cis | -150.8 | -171.5 | 24.1 | 46 | -26.2 | 0 | 0 | 0 | 116.5 | ||||
| 823 | E | 25.7 | Very low | 30.8 | Very low | 179 Ų | 179 | 118.7 Ų | 118.7 | 84% | 0.836 | 75% | 0.746 | S | S | * | * | trans | 62.4 | 174.1 | 145.6 | -65.1 | -104.5 | 119 | 0 | 0 | 118.4 | ||||
| 824 | A | 27.8 | Very low | 30.8 | Very low | 61 Ų | 61 | 118.9 Ų | 118.9 | 50% | 0.504 | 75% | 0.748 | S | S | . | * | cis | -165.8 | 164.8 | -46.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 825 | S | 27.9 | Very low | 30.3 | Very low | 132 Ų | 132 | 117.3 Ų | 117.3 | 92% | 0.923 | 74% | 0.744 | S | S | * | * | trans | 65.2 | 148.5 | 176 | 77.6 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 826 | G | 28.3 | Very low | 30.2 | Very low | 70 Ų | 70 | 116.6 Ų | 116.6 | 72% | 0.722 | 74% | 0.741 | S | S | * | * | cis | -171 | 155 | -6.8 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 827 | S | 37.2 | Very low | 29.8 | Very low | 117 Ų | 117 | 115.7 Ų | 115.7 | 82% | 0.818 | 74% | 0.738 | S | S | * | * | trans | -37.4 | 161.9 | 148.8 | -47.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 828 | P | 41.8 | Very low | 29.8 | Very low | 102 Ų | 102 | 119.5 Ų | 119.5 | 66% | 0.662 | 74% | 0.739 | S | S | * | * | cis | -160.6 | -172.1 | 49.2 | 44.5 | -21.8 | 0 | 0 | 0 | 119.9 | ||||
| 829 | N | 30.8 | Very low | 29.7 | Very low | 142 Ų | 142 | 121.5 Ų | 121.5 | 76% | 0.759 | 74% | 0.744 | S | S | * | * | trans | 82.8 | 146.8 | 142.2 | -78.3 | -12.8 | 0 | 0 | 0 | 120.1 | ||||
| 830 | S | 31.1 | Very low | 29.8 | Very low | 93 Ų | 93 | 124.9 Ų | 124.9 | 65% | 0.65 | 75% | 0.745 | S | S | * | * | cis | -175.7 | -173.7 | -23.7 | -114.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 831 | V | 31.9 | Very low | 30 | Very low | 141 Ų | 141 | 125 Ų | 125 | 86% | 0.855 | 74% | 0.743 | S | S | * | * | trans | 87.9 | 133.1 | 155.1 | -169.3 | 0 | 0 | 0 | 0 | 116 | ||||
| 832 | A | 31.2 | Very low | 30.1 | Very low | 89 Ų | 89 | 122.3 Ų | 122.3 | 74% | 0.736 | 74% | 0.74 | S | S | * | * | cis | -173.1 | 176.9 | -26.5 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 833 | G | 33.1 | Very low | 29.7 | Very low | 68 Ų | 68 | 124.9 Ų | 124.9 | 70% | 0.701 | 75% | 0.747 | S | S | * | * | trans | 114.9 | 75 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 834 | D | 29 | Very low | 29.7 | Very low | 148 Ų | 148 | 121.4 Ų | 121.4 | 79% | 0.791 | 74% | 0.742 | S | S | * | * | 63.5 | 131.9 | 53.3 | -76.6 | -14.3 | 0 | 0 | 0 | 113.4 | |||||
| 835 | V | 28.4 | Very low | 29.8 | Very low | 114 Ų | 114 | 127 Ų | 127 | 69% | 0.691 | 76% | 0.759 | S | S | * | * | cis | -160.6 | 146.4 | -0.7 | 90.5 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 836 | S | 28.5 | Very low | 30.7 | Very low | 97 Ų | 97 | 126.5 Ų | 126.5 | 68% | 0.678 | 75% | 0.752 | S | S | * | * | trans | 64.1 | 169.7 | 146.7 | -75.9 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 837 | S | 26.2 | Very low | 31 | Very low | 87 Ų | 87 | 129 Ų | 129 | 61% | 0.608 | 76% | 0.756 | S | S | * | * | cis | -179.2 | 172.5 | -32.3 | -85.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 838 | Y | 25.1 | Very low | 30.7 | Very low | 215 Ų | 215 | 126.7 Ų | 126.7 | 84% | 0.843 | 75% | 0.75 | S | S | * | * | trans | 79.6 | 126.3 | 149.2 | -80.1 | -64.9 | 0 | 0 | 0 | 121.3 | ||||
| 839 | S | 25.1 | Very low | 30.1 | Very low | 98 Ų | 98 | 126.2 Ų | 126.2 | 69% | 0.685 | 75% | 0.754 | S | S | * | * | trans | 90.8 | 100.7 | 130.2 | -69.7 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 840 | R | 24.6 | Very low | 29.9 | Very low | 237 Ų | 237 | 127.7 Ų | 127.7 | 89% | 0.894 | 76% | 0.761 | S | S | * | * | 84.1 | 127.1 | 107.6 | -153 | -179.7 | -158.1 | -174 | 5.4 | 119 | |||||
| 841 | M | 32.3 | Very low | 29.7 | Very low | 174 Ų | 174 | 127 Ų | 127 | 86% | 0.857 | 76% | 0.761 | S | S | * | * | trans | -24.8 | 149.7 | 153.4 | -77.4 | 177.7 | 166.3 | 0 | 0 | 115.9 | ||||
| 842 | P | 33.6 | Very low | 29.5 | Very low | 109 Ų | 109 | 126.9 Ų | 126.9 | 71% | 0.708 | 76% | 0.761 | S | S | * | * | -157.3 | 160.1 | 59.9 | 42 | -20.9 | 0 | 0 | 0 | 121.8 | |||||
| 843 | I | 24.8 | Very low | 29.3 | Very low | 149 Ų | 149 | 127.7 Ų | 127.7 | 76% | 0.764 | 76% | 0.761 | S | S | * | * | trans | 39.4 | 123.5 | 130.8 | -49.5 | 165.1 | 0 | 0 | 0 | 121.5 | ||||
| 844 | S | 25.7 | Very low | 29.1 | Very low | 106 Ų | 106 | 132.6 Ų | 132.6 | 74% | 0.741 | 77% | 0.768 | S | S | * | * | trans | 150.7 | 133.7 | 138.6 | -65.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 845 | Q | 29.9 | Very low | 29.1 | Very low | 180 Ų | 180 | 133.4 Ų | 133.4 | 84% | 0.841 | 77% | 0.766 | S | S | * | * | cis | 68.4 | 148.7 | 43.5 | -73.7 | -162.2 | -13.9 | 0 | 0 | 115.7 | ||||
| 846 | P | 46.5 | Very low | 29.2 | Very low | 120 Ų | 120 | 135.1 Ų | 135.1 | 78% | 0.779 | 77% | 0.77 | S | S | * | * | cis | -109.7 | -143.3 | -24.8 | 41.8 | -27 | 0 | 0 | 0 | 108.9 | ||||
| 847 | P | 34.9 | Very low | 29.4 | Very low | 124 Ų | 124 | 135 Ų | 135 | 81% | 0.805 | 77% | 0.769 | S | S | * | * | cis | -102.7 | -148.2 | -24.9 | 43 | -29.9 | 0 | 0 | 0 | 110.5 | ||||
| 848 | G | 29.9 | Very low | 29.8 | Very low | 67 Ų | 67 | 136.1 Ų | 136.1 | 69% | 0.691 | 77% | 0.774 | S | S | * | * | cis | 108.7 | 147.7 | -1.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 849 | A | 28.9 | Very low | 29.9 | Very low | 92 Ų | 92 | 131.9 Ų | 131.9 | 76% | 0.76 | 77% | 0.771 | S | S | * | * | cis | -163.6 | 172.1 | -0.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 850 | L | 27.7 | Very low | 30.7 | Very low | 174 Ų | 174 | 132.4 Ų | 132.4 | 91% | 0.911 | 78% | 0.775 | S | S | * | * | trans | 74.1 | 148.1 | 165 | -53.6 | 177.5 | 0 | 0 | 0 | 118.6 | ||||
| 851 | A | 26.7 | Very low | 31.2 | Very low | 78 Ų | 78 | 127.3 Ų | 127.3 | 65% | 0.645 | 77% | 0.772 | S | S | * | * | cis | -169.4 | 174.5 | -23 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 852 | V | 27.8 | Very low | 31.1 | Very low | 139 Ų | 139 | 124.8 Ų | 124.8 | 84% | 0.842 | 77% | 0.772 | S | S | * | * | trans | 88.1 | 105 | 159.4 | -167 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 853 | S | 26.9 | Very low | 31 | Very low | 105 Ų | 105 | 123 Ų | 123 | 73% | 0.734 | 77% | 0.773 | S | S | * | * | trans | -56.5 | 172.5 | 165.4 | -38.2 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 854 | M | 29.4 | Very low | 31.1 | Very low | 172 Ų | 172 | 123.4 Ų | 123.4 | 85% | 0.847 | 78% | 0.776 | S | S | * | * | cis | -145.3 | 139.1 | 46.7 | -59.2 | -172.9 | -166 | 0 | 0 | 110.7 | ||||
| 855 | H | 28 | Very low | 31.3 | Very low | 164 Ų | 164 | 126.7 Ų | 126.7 | 76% | 0.759 | 78% | 0.78 | S | S | * | * | 55.4 | 122 | 84.1 | -133 | -100.2 | 0 | 0 | 0 | 111.5 | |||||
| 856 | I | 31.4 | Very low | 31.3 | Very low | 150 Ų | 150 | 129.1 Ų | 129.1 | 77% | 0.769 | 78% | 0.781 | S | S | * | * | -145.5 | 136.3 | 58.3 | -73.1 | 151.6 | 0 | 0 | 0 | 112.3 | |||||
| 857 | S | 32.1 | Very low | 30.9 | Very low | 96 Ų | 96 | 128.1 Ų | 128.1 | 67% | 0.671 | 78% | 0.775 | S | S | * | * | trans | -101.6 | 163.1 | 157.3 | -50.1 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 858 | P | 34.5 | Very low | 31 | Very low | 109 Ų | 109 | 126.9 Ų | 126.9 | 71% | 0.708 | 77% | 0.767 | S | S | * | * | -152.8 | 126.8 | 92.6 | 37 | -17 | 0 | 0 | 0 | 117.8 | |||||
| 859 | T | 28 | Very low | 31.1 | Very low | 127 Ų | 127 | 131 Ų | 131 | 78% | 0.779 | 77% | 0.772 | S | S | * | * | 52 | 123.5 | 124.5 | 68.2 | 0 | 0 | 0 | 0 | 122.9 | |||||
| 860 | S | 40.8 | Very low | 31.2 | Very low | 109 Ų | 109 | 131.3 Ų | 131.3 | 76% | 0.762 | 77% | 0.768 | S | S | * | * | trans | -77.8 | 150.6 | 133.6 | -39.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 861 | P | 35.8 | Very low | 31.2 | Very low | 130 Ų | 130 | 129 Ų | 129 | 84% | 0.844 | 76% | 0.761 | S | S | * | * | trans | -101 | 133 | 167.4 | 34.1 | -27.2 | 0 | 0 | 0 | 112.3 | ||||
| 862 | S | 30.5 | Very low | 31.2 | Very low | 121 Ų | 121 | 130 Ų | 130 | 85% | 0.846 | 76% | 0.764 | S | S | * | * | trans | -112 | 156.3 | -176.9 | -56 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 863 | G | 30.3 | Very low | 31.2 | Very low | 72 Ų | 72 | 130.2 Ų | 130.2 | 74% | 0.742 | 77% | 0.766 | S | S | * | * | trans | 104 | 174.1 | 149.4 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 864 | L | 28.2 | Very low | 31.1 | Very low | 157 Ų | 157 | 129 Ų | 129 | 82% | 0.822 | 77% | 0.769 | S | S | * | * | cis | -165.1 | 175.8 | -4.3 | -121.9 | 172.5 | 0 | 0 | 0 | 111.7 | ||||
| 865 | Q | 28.7 | Very low | 30.9 | Very low | 175 Ų | 175 | 130.8 Ų | 130.8 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | trans | 68.4 | 115.5 | 168.4 | -66.1 | 165 | -23.4 | 0 | 0 | 116.3 | ||||
| 866 | R | 31.4 | Very low | 30.8 | Very low | 230 Ų | 230 | 128.5 Ų | 128.5 | 87% | 0.868 | 78% | 0.775 | S | S | * | * | cis | 70.7 | 150.2 | 29 | -135.8 | -162.3 | -167.3 | -105.6 | 1.5 | 113.1 | ||||
| 867 | P | 37.8 | Very low | 30.6 | Very low | 99 Ų | 99 | 126.2 Ų | 126.2 | 64% | 0.643 | 77% | 0.773 | S | S | * | * | cis | -118.7 | -140.1 | -7.6 | 44 | -26.1 | 0 | 0 | 0 | 110.5 | ||||
| 868 | P | 36.4 | Very low | 30.3 | Very low | 98 Ų | 98 | 126.6 Ų | 126.6 | 64% | 0.636 | 78% | 0.782 | S | S | * | * | cis | -133.3 | 165.5 | -23.7 | 37 | -18.8 | 0 | 0 | 0 | 117.1 | ||||
| 869 | L | 32.1 | Very low | 30.1 | Very low | 155 Ų | 155 | 126.8 Ų | 126.8 | 81% | 0.812 | 78% | 0.781 | S | S | * | * | trans | 31.5 | 142.6 | 136.8 | -53.8 | 173.9 | 0 | 0 | 0 | 121.4 | ||||
| 870 | S | 30.3 | Very low | 30.1 | Very low | 97 Ų | 97 | 126.4 Ų | 126.4 | 68% | 0.678 | 78% | 0.781 | S | S | * | * | cis | -164.8 | -166.8 | 2.4 | -120.7 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 871 | V | 28.8 | Very low | 29.5 | Very low | 126 Ų | 126 | 131 Ų | 131 | 76% | 0.764 | 78% | 0.782 | S | S | * | * | cis | -155.6 | 161.7 | 17 | -133.9 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 872 | S | 26.7 | Very low | 29.3 | Very low | 99 Ų | 99 | 129.6 Ų | 129.6 | 69% | 0.692 | 77% | 0.774 | S | S | * | * | trans | 56.1 | 127.4 | 145.9 | -70.9 | 0 | 0 | 0 | 0 | 125.8 | ||||
| 873 | T | 26.2 | Very low | 29.2 | Very low | 144 Ų | 144 | 132.1 Ų | 132.1 | 88% | 0.883 | 77% | 0.77 | S | S | * | * | trans | 69.9 | 113.7 | 138.2 | 55 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 874 | G | 26.1 | Very low | 29 | Very low | 78 Ų | 78 | 136.3 Ų | 136.3 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | trans | -179.9 | 117.3 | 159.7 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 875 | F | 24.6 | Very low | 29.1 | Very low | 210 Ų | 210 | 137 Ų | 137 | 92% | 0.921 | 77% | 0.772 | S | S | * | * | trans | -93.5 | 168.4 | 177.2 | -101.1 | -103.2 | 0 | 0 | 0 | 111.6 | ||||
| 876 | S | 26.7 | Very low | 29 | Very low | 117 Ų | 117 | 136.3 Ų | 136.3 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | 85.1 | 153.2 | 178.1 | -29.4 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 877 | S | 27.1 | Very low | 28.9 | Very low | 102 Ų | 102 | 128.9 Ų | 128.9 | 71% | 0.713 | 76% | 0.762 | S | S | * | * | cis | -147.4 | 159.9 | 4.6 | 65.7 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 878 | A | 25.8 | Very low | 28.4 | Very low | 104 Ų | 104 | 127.7 Ų | 127.7 | 86% | 0.86 | 76% | 0.755 | S | S | * | * | trans | -152.2 | 61.4 | 170.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 879 | T | 28.8 | Very low | 28 | Very low | 112 Ų | 112 | 129.9 Ų | 129.9 | 69% | 0.687 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -89 | 134.5 | 179.7 | 45.6 | 0 | 0 | 0 | 0 | 111.8 | ||
| 880 | P | 29.7 | Very low | 28 | Very low | 120 Ų | 120 | 128 Ų | 128 | 78% | 0.779 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 142.2 | 174 | 30.3 | -34.3 | 0 | 0 | 0 | 111.8 | ||
| 881 | Y | 28.2 | Very low | 28 | Very low | 204 Ų | 204 | 127.7 Ų | 127.7 | 80% | 0.8 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 133.3 | 179.1 | -64.4 | -91.8 | 0 | 0 | 0 | 112 | F883 | Y881-F883 PolarHBondContact O-N 3.34Š|
| 882 | P | 29.9 | Very low | 28.1 | Very low | 102 Ų | 102 | 127.2 Ų | 127.2 | 66% | 0.662 | 73% | 0.726 | S | S | * | * | trans | -81.4 | 105.4 | 163.4 | 31.7 | -29.6 | 0 | 0 | 0 | 109.6 | N884 | P882-N884 PolarHBondContact O-N 2.99Š| ||
| 883 | F | 28.7 | Very low | 28.1 | Very low | 174 Ų | 174 | 134.2 Ų | 134.2 | 76% | 0.763 | 74% | 0.737 | S | S | * | * | trans | -73 | 113.3 | 170.9 | -91.5 | -86 | 0 | 0 | 0 | 110.4 | Y881 F885 | Y881-F883 PolarHBondContact O-N 3.34Å; F883-F885 PolarHBondContact O-N 3.47Å | ||
| 884 | N | 27 | Very low | 28.1 | Very low | 159 Ų | 159 | 131.6 Ų | 131.6 | 85% | 0.85 | 73% | 0.73 | S | S | * | * | trans | -76.5 | 118.9 | 172 | -151.6 | 15.1 | 0 | 0 | 0 | 108.3 | P882 | P882-N884 PolarHBondContact O-N 2.99Š| ||
| 885 | F | 29 | Very low | 28.1 | Very low | 173 Ų | 173 | 137.8 Ų | 137.8 | 76% | 0.759 | 74% | 0.735 | S | S | * | * | trans | -132.6 | 87 | -175.6 | -137.3 | -72.2 | 0 | 0 | 0 | 110.8 | F883 | F883-F885 PolarHBondContact O-N 3.47Š| ||
| 886 | D | 27.6 | Very low | 28.2 | Very low | 159 Ų | 159 | 131.9 Ų | 131.9 | 85% | 0.85 | 73% | 0.725 | S | S | * | * | trans | -129.3 | 89 | 171.8 | -176.1 | 11.4 | 0 | 0 | 0 | 108.7 | ||||
| 887 | A | 29.1 | Very low | 28.1 | Very low | 75 Ų | 75 | 131.1 Ų | 131.1 | 62% | 0.62 | 73% | 0.726 | S | S | * | * | trans | -166.4 | 119.6 | 169.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 888 | S | 28.3 | Very low | 28.1 | Very low | 73 Ų | 73 | 130.6 Ų | 130.6 | 51% | 0.51 | 73% | 0.728 | S | S | . | * | trans | 58.2 | 103.4 | 145.4 | -154.5 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 889 | M | 27.7 | Very low | 28.1 | Very low | 144 Ų | 144 | 134.7 Ų | 134.7 | 71% | 0.709 | 73% | 0.726 | S | S | * | * | -111 | 138.3 | 114.8 | -96.6 | -68 | -163.9 | 0 | 0 | 107.6 | E252 | E252-M889 HydrophobicContact CG-CE 3.74Š| |||
| 890 | H | 32 | Very low | 28 | Very low | 117 Ų | 117 | 134.5 Ų | 134.5 | 54% | 0.542 | 74% | 0.736 | S | S | . | * | trans | -131 | 122.9 | -168.1 | -126.3 | 65.7 | 0 | 0 | 0 | 110.2 | I250 | I250-H890 HydrophobicContact CD1-CB 4Å; I250-H890 HydrophobicContact CG1-CB 3.78Å; I250-H890 HydrophobicContact CG2-CB 4.25Å; I250-H890 WeakPolarHBondContact CG2-O 3.44Å | ||
| 891 | K | 28.7 | Very low | 27.9 | Very low | 90 Ų | 90 | 132.4 Ų | 132.4 | 39% | 0.391 | 73% | 0.729 | S | S | . | * | trans | 168.3 | 138.1 | 158.8 | -97.5 | 154.9 | 174.6 | 160.6 | 0 | 107.3 | I250 W314 | I250-K891 HydrophobicContact CG2-CD 3.74Å; I250-K891 VanDerWaalsContact CG2-CE 3.47Å; I250-K891 HydrophobicContact CG2-CG 3.96Å; I250-K891 PolarHBondContact O-NZ 3.44Å; W314-K891 VanDerWaalsContact CE2-CE 3.41Å | ||
| 892 | N | 31.7 | Very low | 27.9 | Very low | 116 Ų | 116 | 126.8 Ų | 126.8 | 62% | 0.62 | 73% | 0.725 | S | S | * | * | cis | -117 | 168.5 | 6.7 | -80 | -31.3 | 0 | 0 | 0 | 113.2 | ||||
| 893 | R | 26.8 | Very low | 27.9 | Very low | 245 Ų | 245 | 128 Ų | 128 | 93% | 0.925 | 74% | 0.736 | S | S | * | * | trans | -126.3 | 107.2 | -174.2 | 172.9 | -163.5 | -168.6 | -179.4 | 4.9 | 109.4 | ||||
| 894 | A | 26.4 | Very low | 28 | Very low | 90 Ų | 90 | 123.3 Ų | 123.3 | 74% | 0.744 | 74% | 0.737 | S | S | * | * | trans | 172.1 | 99.9 | 154 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 895 | F | 27 | Very low | 28.2 | Very low | 207 Ų | 207 | 122.8 Ų | 122.8 | 91% | 0.908 | 74% | 0.739 | S | S | * | * | -169.3 | 161.8 | 102.5 | -124.6 | -96.1 | 0 | 0 | 0 | 109.7 | |||||
| 896 | A | 25.3 | Very low | 28.3 | Very low | 87 Ų | 87 | 118.5 Ų | 118.5 | 72% | 0.719 | 74% | 0.735 | S | S | * | * | trans | -147.8 | 169.9 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 897 | A | 26 | Very low | 28.4 | Very low | 100 Ų | 100 | 117.1 Ų | 117.1 | 83% | 0.826 | 73% | 0.733 | S | S | * | * | trans | 85.5 | 127.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 898 | A | 25.2 | Very low | 28.5 | Very low | 92 Ų | 92 | 120 Ų | 120 | 76% | 0.76 | 74% | 0.742 | S | S | * | * | trans | 51.6 | 116.6 | 150.8 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 899 | F | 26.9 | Very low | 28.7 | Very low | 189 Ų | 189 | 120.1 Ų | 120.1 | 83% | 0.829 | 75% | 0.748 | S | S | * | * | -138.8 | 121.5 | 115.1 | -135.4 | -90.3 | 0 | 0 | 0 | 111.5 | A901 | F899-A901 HydrophobicContact CE1-CB 4.39Å; F899-A901 WeakPolarHBondContact CE1-O 3.35Å | |||
| 900 | A | 25.8 | Very low | 29.1 | Very low | 108 Ų | 108 | 119.8 Ų | 119.8 | 89% | 0.893 | 75% | 0.754 | S | S | * | * | trans | -153 | 50.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 901 | A | 29 | Very low | 29.4 | Very low | 76 Ų | 76 | 119.4 Ų | 119.4 | 63% | 0.628 | 76% | 0.762 | S | S | * | * | trans | -141.4 | 157.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | F899 | F899-A901 HydrophobicContact CE1-CB 4.39Å; F899-A901 WeakPolarHBondContact CE1-O 3.35Å | ||
| 902 | A | 28.6 | Very low | 30 | Very low | 87 Ų | 87 | 119 Ų | 119 | 72% | 0.719 | 77% | 0.769 | S | S | * | * | trans | -103.4 | 153.1 | -178 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 903 | S | 29 | Very low | 30.3 | Very low | 127 Ų | 127 | 116.8 Ų | 116.8 | 89% | 0.888 | 76% | 0.761 | S | S | * | * | trans | 41.2 | 109 | 150.1 | -52.3 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 904 | G | 31.6 | Very low | 30.8 | Very low | 76 Ų | 76 | 107 Ų | 107 | 78% | 0.784 | 74% | 0.735 | S | S | * | * | trans | 169.8 | 68 | 165.7 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 905 | V | 30.5 | Very low | 31.2 | Very low | 147 Ų | 147 | 109.4 Ų | 109.4 | 89% | 0.891 | 73% | 0.733 | S | S | * | * | trans | 32.9 | 119.5 | 135.4 | -176.5 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 906 | A | 30.6 | Very low | 31.6 | Very low | 83 Ų | 83 | 102.9 Ų | 102.9 | 69% | 0.686 | 72% | 0.724 | S | S | * | * | trans | 85.2 | 105.6 | 139.3 | 0 | 0 | 0 | 0 | 0 | 125.9 | ||||
| 907 | V | 30 | Very low | 32.4 | Very low | 131 Ų | 131 | 105.4 Ų | 105.4 | 79% | 0.794 | 73% | 0.733 | S | S | * | * | 46 | 143.6 | 127.1 | -135.5 | 0 | 0 | 0 | 0 | 125.1 | |||||
| 908 | T | 31 | Very low | 32.8 | Very low | 134 Ų | 134 | 107.7 Ų | 107.7 | 82% | 0.822 | 73% | 0.732 | S | S | * | * | trans | 78.9 | 147.9 | 160.1 | 65.9 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 909 | A | 32.8 | Very low | 33.7 | Very low | 76 Ų | 76 | 107.3 Ų | 107.3 | 63% | 0.628 | 72% | 0.721 | S | S | * | * | cis | -171.4 | 139 | -28.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 910 | T | 36.5 | Very low | 34 | Very low | 138 Ų | 138 | 104.7 Ų | 104.7 | 85% | 0.847 | 72% | 0.716 | S | S | * | * | trans | 61.3 | 164.9 | 152.3 | 54.9 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 911 | P | 38.7 | Very low | 34.4 | Very low | 109 Ų | 109 | 106.3 Ų | 106.3 | 71% | 0.708 | 71% | 0.709 | S | S | * | * | -140.2 | 177.1 | -53.2 | 42.2 | -25.3 | 0 | 0 | 0 | 116.4 | |||||
| 912 | P | 40.6 | Very low | 34.6 | Very low | 81 Ų | 81 | 113.8 Ų | 113.8 | 53% | 0.526 | 72% | 0.721 | S | S | . | * | trans | -126.6 | 162.6 | 169.8 | 42.4 | -30.9 | 0 | 0 | 0 | 116 | A91 | A91-P912 WeakPolarHBondContact O-CA 3.41Š| ||
| 913 | P | 39.1 | Very low | 35 | Very low | 70 Ų | 70 | 114.3 Ų | 114.3 | 46% | 0.455 | 72% | 0.717 | S | S | . | * | -144.4 | -125.4 | 102.4 | 41.5 | -26.3 | 0 | 0 | 0 | 119.7 | D89 D90 A91 L92 | D89-P913 WeakPolarHBondContact O-CG 3.5Å; D90-P913 VanDerWaalsContact C-CD 3.48Å; A91-P913 CarbonylContact C-O 3.07Å; A91-P913 PolarHBondContact N-O 2.98Å; L92-P913 WeakPolarHBondContact CD1-O 3.43Å; L92-P913 PolarHBondContact N-O 3.35Å | |||
| 914 | G | 36.2 | Very low | 35.3 | Very low | 38 Ų | 38 | 115 Ų | 115 | 39% | 0.392 | 72% | 0.716 | S | S | . | * | trans | -91.5 | -143.8 | -143.9 | 0 | 0 | 0 | 0 | 0 | 121.4 | D90 | D90-G914 WeakPolarHBondContact CB-O 3.4Å; D90-G914 VanDerWaalsContact CG-O 3.27Å; D90-G914 WeakPolarHBondContact OD1-CA 3.49Å; D90-G914 PolarHBondContact OD1-N 3.18Å | ||
| 915 | M | 35.5 | Very low | 35.5 | Very low | 141 Ų | 141 | 113.6 Ų | 113.6 | 70% | 0.695 | 70% | 0.702 | S | S | * | * | cis | -141.8 | -179.6 | 0.4 | -94.9 | 174.1 | -6.3 | 0 | 0 | 114.8 | D90 | D90-M915 VanDerWaalsContact CG-N 3.28Å; D90-M915 VanDerWaalsContact OD1-CB 3.3Å; D90-M915 WeakPolarHBondContact OD1-CB 3.16Å; D90-M915 WeakPolarHBondContact OD1-CG 3.12Å; D90-M915 PolarHBondContact OD1-N 3.4Å; D90-M915 VanDerWaalsContact OD1-N 3.15Å; D90-M915 VanDerWaalsContact OD2-CB 3.27Å; D90-M915 WeakPolarHBondContact OD2-CB 3.47Å; D90-M915 PolarHBondContact OD2-N 2.92Å; D90-M915 VanDerWaalsContact OD2-N 3.09Å | ||
| 916 | G | 34.8 | Very low | 35.6 | Very low | 70 Ų | 70 | 110.5 Ų | 110.5 | 72% | 0.722 | 68% | 0.683 | S | S | * | * | trans | -96.9 | -144.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 917 | P | 41.3 | Very low | 35.8 | Very low | 140 Ų | 140 | 110.6 Ų | 110.6 | 91% | 0.909 | 67% | 0.672 | S | S | * | * | cis | -136.8 | -136.1 | 19.7 | 43.1 | -21.9 | 0 | 0 | 0 | 116.2 | ||||
| 918 | N | 36.4 | Very low | 36.1 | Very low | 149 Ų | 149 | 111 Ų | 111 | 80% | 0.797 | 67% | 0.665 | S | S | * | * | trans | -129.8 | -146 | -150.3 | -155.1 | 7 | 0 | 0 | 0 | 112.4 | ||||
| 919 | P | 42.9 | Very low | 36.3 | Very low | 83 Ų | 83 | 110.2 Ų | 110.2 | 54% | 0.539 | 66% | 0.662 | S | S | . | * | -113.6 | 172.4 | -69.7 | 20.8 | -0.5 | 0 | 0 | 0 | 115.3 | |||||
| 920 | N | 34.3 | Very low | 36.3 | Very low | 134 Ų | 134 | 110.6 Ų | 110.6 | 72% | 0.717 | 67% | 0.665 | S | S | * | * | 167.8 | 138.9 | 112.4 | -90.8 | -57.9 | 0 | 0 | 0 | 118.8 | |||||
| 921 | L | 32.7 | Very low | 36 | Very low | 143 Ų | 143 | 111.4 Ų | 111.4 | 75% | 0.749 | 66% | 0.664 | S | S | * | * | trans | 53.7 | 105 | 143.1 | -60.9 | 168.8 | 0 | 0 | 0 | 124.1 | ||||
| 922 | R | 34.1 | Very low | 35.6 | Very low | 232 Ų | 232 | 114.2 Ų | 114.2 | 88% | 0.875 | 67% | 0.672 | S | S | * | * | 37.4 | 157.7 | 114.7 | -82.1 | -172.9 | 141.5 | -163.8 | -3.4 | 122.4 | |||||
| 923 | P | 37.3 | Very low | 35.3 | Very low | 98 Ų | 98 | 114.1 Ų | 114.1 | 64% | 0.636 | 69% | 0.686 | S | S | * | * | cis | -144.9 | -168.9 | -28.9 | 41 | -20.9 | 0 | 0 | 0 | 116.1 | ||||
| 924 | T | 34.8 | Very low | 34.9 | Very low | 141 Ų | 141 | 117.3 Ų | 117.3 | 87% | 0.865 | 70% | 0.704 | S | S | * | * | trans | 76.8 | 106.5 | 156.9 | 52.5 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 925 | G | 34.9 | Very low | 34.8 | Very low | 48 Ų | 48 | 127.3 Ų | 127.3 | 50% | 0.495 | 73% | 0.73 | S | S | . | * | 132.5 | 85.4 | 108.8 | 0 | 0 | 0 | 0 | 0 | 124.9 | K334 | K334-G925 PolarHBondContact NZ-O 3.25Š| |||
| 926 | V | 33.9 | Very low | 34.7 | Very low | 81 Ų | 81 | 124.4 Ų | 124.4 | 49% | 0.491 | 73% | 0.729 | S | S | . | * | 53.5 | 150.1 | 127.1 | -79.3 | 0 | 0 | 0 | 0 | 126.9 | C333 K334 | C333-V926 HydrophobicContact CB-CB 4.29Å; C333-V926 HydrophobicContact CB-CG1 4.2Å; C333-V926 HydrophobicContact CB-CG2 3.62Å; C333-V926 VanDerWaalsContact O-CB 3.3Å; C333-V926 WeakPolarHBondContact O-CB 3.46Å; K334-V926 HydrophobicContact CB-CB 4.31Å; K334-V926 HydrophobicContact CB-CG2 3.63Å; K334-V926 HydrophobicContact CG-CG2 4.07Å; K334-V926 PolarHBondContact NZ-O 2.97Å | |||
| 927 | N | 34.3 | Very low | 34.8 | Very low | 86 Ų | 86 | 126.8 Ų | 126.8 | 46% | 0.46 | 73% | 0.732 | S | S | . | * | 151.9 | 165.9 | 127.1 | -149.9 | 36.5 | 0 | 0 | 0 | 116 | C333 K334 D335 | C333-N927 PolarHBondContact O-OD1 3.22Å; C333-N927 VanDerWaalsContact O-OD1 3.07Å; K334-N927 HydrophobicContact CB-CB 3.79Å; K334-N927 PolarHBondContact N-OD1 3.17Å; D335-N927 VanDerWaalsContact CB-ND2 3.33Å; D335-N927 WeakPolarHBondContact CB-ND2 3.1Å; D335-N927 WeakPolarHBondContact OD2-CB 3.34Å; D335-N927 VanDerWaalsContact OD2-CG 3.32Å; D335-N927 PolarHBondContact OD2-ND2 3.26Å | |||
| 928 | H | 35.1 | Very low | 34.5 | Very low | 139 Ų | 139 | 126.4 Ų | 126.4 | 64% | 0.644 | 73% | 0.726 | S | S | * | * | trans | -107 | -173.7 | -169.3 | -92.3 | -47 | 0 | 0 | 0 | 114 | E332 | E332-H928 IonicContact OE1-CD2 2.74Å; E332-H928 IonicContact OE1-NE2 3.69Å | ||
| 929 | P | 36.3 | Very low | 34.5 | Very low | 117 Ų | 117 | 125 Ų | 125 | 76% | 0.76 | 73% | 0.725 | S | S | * | * | cis | -147.3 | 167.7 | 18.9 | 44.1 | -23 | 0 | 0 | 0 | 121.9 | ||||
| 930 | A | 31.8 | Very low | 34.4 | Very low | 84 Ų | 84 | 125.9 Ų | 125.9 | 69% | 0.694 | 73% | 0.731 | S | S | * | * | trans | 33.3 | 140.3 | 143 | 0 | 0 | 0 | 0 | 0 | 126.4 | ||||
| 931 | L | 30.6 | Very low | 34.7 | Very low | 156 Ų | 156 | 125.4 Ų | 125.4 | 82% | 0.817 | 74% | 0.735 | S | S | * | * | 169 | 142.3 | 111.5 | -89.3 | 165.3 | 0 | 0 | 0 | 117.1 | |||||
| 932 | L | 31.2 | Very low | 34.7 | Very low | 168 Ų | 168 | 125.5 Ų | 125.5 | 88% | 0.88 | 74% | 0.736 | S | S | * | * | trans | 59.5 | 138.3 | 148.6 | -68.8 | 162.8 | 0 | 0 | 0 | 124.3 | ||||
| 933 | G | 33.1 | Very low | 34.7 | Very low | 79 Ų | 79 | 122.1 Ų | 122.1 | 81% | 0.814 | 73% | 0.732 | S | S | * | * | trans | 158.1 | 113.3 | 157.9 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 934 | T | 32.2 | Very low | 34.6 | Very low | 137 Ų | 137 | 122.8 Ų | 122.8 | 84% | 0.84 | 74% | 0.736 | S | S | * | * | trans | -108.9 | 159.5 | -167.9 | 56.4 | 0 | 0 | 0 | 0 | 117 | ||||
| 935 | R | 32.7 | Very low | 34.2 | Very low | 247 Ų | 247 | 121.9 Ų | 121.9 | 93% | 0.932 | 73% | 0.73 | S | S | * | * | trans | 115.7 | 139.9 | 136.1 | -160.4 | 169.4 | 176.9 | 168.9 | -1.7 | 119.3 | ||||
| 936 | A | 33.1 | Very low | 34 | Very low | 81 Ų | 81 | 126 Ų | 126 | 67% | 0.669 | 75% | 0.745 | S | S | * | * | trans | -108.6 | -163.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 937 | P | 38.7 | Very low | 33.7 | Very low | 120 Ų | 120 | 128.3 Ų | 128.3 | 78% | 0.779 | 76% | 0.76 | S | S | * | * | cis | -153.5 | -157 | 31.8 | 40.1 | -13.2 | 0 | 0 | 0 | 118.2 | ||||
| 938 | V | 35 | Very low | 33.4 | Very low | 131 Ų | 131 | 127.5 Ų | 127.5 | 79% | 0.794 | 77% | 0.772 | S | S | * | * | trans | 105.7 | 125.1 | 157.5 | -168.3 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 939 | P | 35.5 | Very low | 33.1 | Very low | 120 Ų | 120 | 132.9 Ų | 132.9 | 78% | 0.779 | 79% | 0.787 | S | S | * | * | trans | -123.4 | -140.7 | 177 | 36.1 | -13.5 | 0 | 0 | 0 | 114.7 | ||||
| 940 | P | 41 | Very low | 32.9 | Very low | 101 Ų | 101 | 132.6 Ų | 132.6 | 66% | 0.656 | 79% | 0.788 | S | S | * | * | -126.8 | -168.2 | -107.1 | 43.8 | -25.6 | 0 | 0 | 0 | 115.3 | |||||
| 941 | P | 39.6 | Very low | 33.1 | Very low | 124 Ų | 124 | 134.8 Ų | 134.8 | 81% | 0.805 | 80% | 0.795 | S | S | * | * | trans | -108.9 | 166.5 | 158.6 | 37.3 | -28.9 | 0 | 0 | 0 | 114 | ||||
| 942 | L | 33.8 | Very low | 32.9 | Very low | 146 Ų | 146 | 130.4 Ų | 130.4 | 76% | 0.764 | 79% | 0.787 | S | S | * | * | trans | -143.2 | 176.1 | -170.3 | -77.2 | 169.8 | 0 | 0 | 0 | 113.3 | ||||
| 943 | M | 33.7 | Very low | 32.8 | Very low | 160 Ų | 160 | 130.2 Ų | 130.2 | 79% | 0.788 | 79% | 0.786 | S | S | * | * | trans | 84.2 | 156.2 | 156.2 | -58.4 | -48 | -175.4 | 0 | 0 | 119 | ||||
| 944 | P | 34.7 | Very low | 32.6 | Very low | 112 Ų | 112 | 134 Ų | 134 | 73% | 0.727 | 79% | 0.787 | S | S | * | * | cis | -121.2 | 149.9 | 3 | 38.1 | -24.6 | 0 | 0 | 0 | 116.8 | ||||
| 945 | V | 27.1 | Very low | 32.5 | Very low | 123 Ų | 123 | 132.8 Ų | 132.8 | 75% | 0.745 | 78% | 0.784 | S | S | * | * | trans | -89.1 | 145.3 | 151.5 | 169.7 | 0 | 0 | 0 | 0 | 108.2 | T947 | V945-T947 HydrophobicContact CG1-CG2 4.26Š| ||
| 946 | V | 31 | Very low | 32.3 | Very low | 134 Ų | 134 | 124.8 Ų | 124.8 | 81% | 0.812 | 77% | 0.771 | S | S | * | * | trans | -112.1 | 110.9 | 175 | 179.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 947 | T | 27.4 | Very low | 32.3 | Very low | 129 Ų | 129 | 127 Ų | 127 | 79% | 0.791 | 78% | 0.776 | S | S | * | * | trans | -146.5 | 120.7 | 168.6 | 52.4 | 0 | 0 | 0 | 0 | 109.7 | V945 | V945-T947 HydrophobicContact CG1-CG2 4.26Š| ||
| 948 | G | 27.9 | Very low | 31.8 | Very low | 70 Ų | 70 | 128.9 Ų | 128.9 | 72% | 0.722 | 77% | 0.774 | S | S | * | * | trans | 147.9 | 115.2 | 162.1 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 949 | R | 28 | Very low | 31.7 | Very low | 251 Ų | 251 | 126.6 Ų | 126.6 | 95% | 0.947 | 76% | 0.763 | S | S | * | * | trans | 65.6 | 135.6 | 134.7 | -71.6 | 178.5 | 162 | 172.6 | -6.3 | 122.1 | ||||
| 950 | S | 32.3 | Very low | 31.4 | Very low | 112 Ų | 112 | 128.5 Ų | 128.5 | 78% | 0.783 | 76% | 0.762 | S | S | * | * | trans | -54.9 | 164.6 | 158.8 | -13.6 | 0 | 0 | 0 | 0 | 113 | ||||
| 951 | P | 35.6 | Very low | 30.8 | Very low | 130 Ų | 130 | 129.7 Ų | 129.7 | 84% | 0.844 | 77% | 0.768 | S | S | * | * | -152 | 175.5 | 64.2 | 42.3 | -23.5 | 0 | 0 | 0 | 117.8 | |||||
| 952 | G | 28.2 | Very low | 30.2 | Very low | 64 Ų | 64 | 128.9 Ų | 128.9 | 66% | 0.66 | 76% | 0.76 | S | S | * | * | 119.8 | 112.8 | 129 | 0 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 953 | L | 28.2 | Very low | 29.8 | Very low | 163 Ų | 163 | 129.4 Ų | 129.4 | 85% | 0.853 | 76% | 0.759 | S | S | * | * | 75.5 | 125.9 | 126.1 | -70.8 | 165.8 | 0 | 0 | 0 | 122.6 | |||||
| 954 | L | 28.1 | Very low | 29.5 | Very low | 159 Ų | 159 | 129.4 Ų | 129.4 | 83% | 0.832 | 76% | 0.757 | S | S | * | * | trans | 71.9 | 135.4 | 152.3 | -55.5 | 162.9 | 0 | 0 | 0 | 116.5 | ||||
| 955 | S | 30.2 | Very low | 29.4 | Very low | 112 Ų | 112 | 129.2 Ų | 129.2 | 78% | 0.783 | 76% | 0.758 | S | S | * | * | cis | -147.7 | 169.6 | 23.3 | -162.4 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 956 | A | 28.9 | Very low | 29.8 | Very low | 79 Ų | 79 | 128.8 Ų | 128.8 | 65% | 0.653 | 76% | 0.758 | S | S | * | * | trans | -32.3 | 165.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 957 | V | 32.4 | Very low | 29.8 | Very low | 127 Ų | 127 | 129.1 Ų | 129.1 | 77% | 0.77 | 76% | 0.755 | S | S | * | * | cis | -151.7 | 146.3 | 46.6 | 169.5 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 958 | H | 30.2 | Very low | 29.8 | Very low | 160 Ų | 160 | 133.5 Ų | 133.5 | 74% | 0.741 | 76% | 0.759 | S | S | * | * | trans | -2.7 | 151.6 | 152.5 | -56.7 | 86.1 | 0 | 0 | 0 | 119.8 | ||||
| 959 | S | 31.9 | Very low | 29.9 | Very low | 82 Ų | 82 | 134 Ų | 134 | 57% | 0.573 | 76% | 0.756 | S | S | * | * | cis | -158.3 | 141.9 | 29.9 | -140.9 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 960 | Q | 29.3 | Very low | 29.9 | Very low | 160 Ų | 160 | 127 Ų | 127 | 75% | 0.748 | 75% | 0.751 | S | S | * | * | trans | 58.8 | 120.2 | 138.1 | -67.1 | 162.3 | 8.3 | 0 | 0 | 120.8 | ||||
| 961 | T | 27.6 | Very low | 29.6 | Very low | 127 Ų | 127 | 125.2 Ų | 125.2 | 78% | 0.779 | 74% | 0.744 | S | S | * | * | 66.6 | 120.3 | 79.1 | -37.4 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 962 | V | 27.2 | Very low | 29.2 | Very low | 107 Ų | 107 | 126.3 Ų | 126.3 | 65% | 0.648 | 74% | 0.742 | S | S | * | * | -179.3 | 126.3 | 89.4 | 153.1 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 963 | Q | 26.9 | Very low | 29.2 | Very low | 156 Ų | 156 | 131 Ų | 131 | 73% | 0.729 | 75% | 0.746 | S | S | * | * | trans | 51.2 | 166.3 | 143.8 | -61.1 | 175.1 | -22 | 0 | 0 | 120.3 | ||||
| 964 | Q | 26.2 | Very low | 29.1 | Very low | 161 Ų | 161 | 128 Ų | 128 | 75% | 0.752 | 74% | 0.739 | S | S | * | * | cis | -155.5 | 171.8 | -25.7 | -110.4 | 163.1 | 0.3 | 0 | 0 | 109.7 | ||||
| 965 | S | 33.3 | Very low | 29.3 | Very low | 108 Ų | 108 | 127.7 Ų | 127.7 | 76% | 0.755 | 73% | 0.733 | S | S | * | * | trans | -42.7 | 166.2 | 160.7 | -43.1 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 966 | P | 34.8 | Very low | 29.3 | Very low | 113 Ų | 113 | 128.4 Ų | 128.4 | 73% | 0.734 | 72% | 0.724 | S | S | * | * | cis | -149.9 | -175.9 | 31 | 44.1 | -23.1 | 0 | 0 | 0 | 119.1 | ||||
| 967 | N | 31.2 | Very low | 29.3 | Very low | 141 Ų | 141 | 130.7 Ų | 130.7 | 75% | 0.754 | 73% | 0.725 | S | S | * | * | trans | -59.4 | 147.4 | 162.9 | -47.7 | -59.4 | 0 | 0 | 0 | 112.7 | ||||
| 968 | Y | 27.5 | Very low | 29.3 | Very low | 222 Ų | 222 | 131.4 Ų | 131.4 | 87% | 0.871 | 72% | 0.723 | S | S | * | * | trans | -157 | 127.3 | 130.5 | -87.2 | -73.4 | 0 | 0 | 0 | 106.1 | ||||
| 969 | A | 29.7 | Very low | 29.3 | Very low | 81 Ų | 81 | 129.8 Ų | 129.8 | 67% | 0.669 | 72% | 0.72 | S | S | * | * | cis | 77.9 | 141.1 | 22.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 970 | A | 27.5 | Very low | 29.1 | Very low | 102 Ų | 102 | 133.3 Ų | 133.3 | 84% | 0.843 | 73% | 0.727 | S | S | * | * | trans | 73.9 | 156 | 179.7 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 971 | A | 26.1 | Very low | 29 | Very low | 76 Ų | 76 | 136 Ų | 136 | 63% | 0.628 | 73% | 0.731 | S | S | * | * | cis | -174.2 | 150.1 | -31.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 972 | L | 28.8 | Very low | 29.4 | Very low | 152 Ų | 152 | 136.8 Ų | 136.8 | 80% | 0.796 | 73% | 0.729 | S | S | * | * | trans | -162.5 | 115.4 | 137.1 | -90.1 | 132.8 | 0 | 0 | 0 | 105 | ||||
| 973 | Q | 27.9 | Very low | 29.6 | Very low | 163 Ų | 163 | 137.8 Ų | 137.8 | 76% | 0.762 | 74% | 0.738 | S | S | * | * | 59.1 | 132 | 76.2 | -60.9 | 174.1 | 33 | 0 | 0 | 112.1 | |||||
| 974 | S | 26.3 | Very low | 29.7 | Very low | 100 Ų | 100 | 134.5 Ų | 134.5 | 70% | 0.699 | 74% | 0.738 | S | S | * | * | cis | -159.6 | 176.6 | -9.4 | 57.2 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 975 | H | 31.1 | Very low | 30.4 | Very low | 153 Ų | 153 | 132.1 Ų | 132.1 | 71% | 0.708 | 74% | 0.736 | S | S | * | * | cis | -174.6 | 163.4 | 31.1 | -144.4 | 17.3 | 0 | 0 | 0 | 109.6 | ||||
| 976 | Q | 30.7 | Very low | 30.2 | Very low | 127 Ų | 127 | 134.1 Ų | 134.1 | 59% | 0.593 | 74% | 0.738 | S | S | * | * | trans | 58.5 | 112.3 | 157.7 | -51.8 | -59.5 | -23.4 | 0 | 0 | 118.7 | ||||
| 977 | N | 28.9 | Very low | 29.9 | Very low | 126 Ų | 126 | 135.5 Ų | 135.5 | 67% | 0.674 | 74% | 0.738 | S | S | * | * | 71.1 | 133.4 | 89.9 | -88.3 | -40.8 | 0 | 0 | 0 | 115 | |||||
| 978 | I | 32.4 | Very low | 30.1 | Very low | 142 Ų | 142 | 133.9 Ų | 133.9 | 73% | 0.728 | 74% | 0.738 | S | S | * | * | cis | -145.8 | 143.7 | 26.1 | -105.2 | 138.5 | 0 | 0 | 0 | 112.6 | ||||
| 979 | N | 30.2 | Very low | 30.5 | Very low | 127 Ų | 127 | 129 Ų | 129 | 68% | 0.679 | 73% | 0.733 | S | S | * | * | trans | 24.7 | 134.9 | 154.2 | -47.9 | -27.3 | 0 | 0 | 0 | 121.2 | ||||
| 980 | Q | 27.3 | Very low | 30.7 | Very low | 155 Ų | 155 | 132.6 Ų | 132.6 | 72% | 0.724 | 74% | 0.741 | S | S | * | * | cis | 63 | 149.1 | 43.8 | -55.1 | -163.1 | 13.6 | 0 | 0 | 113.8 | ||||
| 981 | R | 27.5 | Very low | 31.2 | Very low | 216 Ų | 216 | 132.4 Ų | 132.4 | 82% | 0.815 | 73% | 0.731 | S | S | * | * | cis | -160.2 | 163.9 | 20.4 | -150.8 | 173.1 | -122.1 | -152.4 | -2.5 | 112.1 | ||||
| 982 | L | 36.2 | Very low | 31.2 | Very low | 144 Ų | 144 | 136 Ų | 136 | 75% | 0.754 | 74% | 0.739 | S | S | * | * | trans | -74 | 166.9 | 164 | -65.2 | 81.8 | 0 | 0 | 0 | 111.2 | ||||
| 983 | P | 30.3 | Very low | 31.1 | Very low | 128 Ų | 128 | 134.4 Ų | 134.4 | 83% | 0.831 | 74% | 0.735 | S | S | * | * | -149.9 | -179.1 | 105.5 | 41.8 | -26.4 | 0 | 0 | 0 | 116 | |||||
| 984 | A | 30.2 | Very low | 31.2 | Very low | 88 Ų | 88 | 134.2 Ų | 134.2 | 73% | 0.727 | 74% | 0.738 | S | S | * | * | trans | -120.7 | -164.6 | 160.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 985 | P | 41.4 | Very low | 31.3 | Very low | 110 Ų | 110 | 134.8 Ų | 134.8 | 71% | 0.714 | 74% | 0.743 | S | S | * | * | cis | -124.4 | -164.8 | -43.5 | 27.7 | -5.6 | 0 | 0 | 0 | 112.1 | ||||
| 986 | L | 28.5 | Very low | 31.4 | Very low | 150 Ų | 150 | 130.9 Ų | 130.9 | 79% | 0.785 | 74% | 0.744 | S | S | * | * | trans | 86.8 | 128 | 156.8 | -61.4 | 170 | 0 | 0 | 0 | 122.4 | ||||
| 987 | L | 29.3 | Very low | 31.5 | Very low | 143 Ų | 143 | 131.5 Ų | 131.5 | 75% | 0.749 | 76% | 0.757 | S | S | * | * | trans | 62.9 | 99.7 | 137.6 | -65.1 | 168.5 | 0 | 0 | 0 | 123.5 | ||||
| 988 | S | 33.7 | Very low | 31.9 | Very low | 107 Ų | 107 | 129.7 Ų | 129.7 | 75% | 0.748 | 76% | 0.759 | S | S | * | * | 58.5 | 163.6 | 128.2 | 67.1 | 0 | 0 | 0 | 0 | 122.4 | |||||
| 989 | P | 37.3 | Very low | 32.1 | Very low | 119 Ų | 119 | 128.4 Ų | 128.4 | 77% | 0.773 | 76% | 0.762 | S | S | * | * | cis | -128.2 | -162 | -21.4 | 36.6 | -16.3 | 0 | 0 | 0 | 113.9 | ||||
| 990 | L | 33.2 | Very low | 32.6 | Very low | 157 Ų | 157 | 127.2 Ų | 127.2 | 82% | 0.822 | 76% | 0.764 | S | S | * | * | trans | -44.4 | 173.5 | 167.6 | -69.5 | 160 | 0 | 0 | 0 | 117.3 | ||||
| 991 | P | 38.1 | Very low | 32.9 | Very low | 98 Ų | 98 | 130.7 Ų | 130.7 | 64% | 0.636 | 77% | 0.771 | S | S | * | * | cis | -137.4 | -165.4 | -22.7 | 28.2 | -3.3 | 0 | 0 | 0 | 114.3 | ||||
| 992 | L | 26.7 | Very low | 33.5 | Very low | 152 Ų | 152 | 125.4 Ų | 125.4 | 80% | 0.796 | 77% | 0.765 | S | S | * | * | trans | 74.5 | 158 | 161.8 | -47.3 | 176 | 0 | 0 | 0 | 117.8 | ||||
| 993 | T | 26.5 | Very low | 33.4 | Very low | 117 Ų | 117 | 123.9 Ų | 123.9 | 72% | 0.718 | 77% | 0.766 | S | S | * | * | cis | -164.8 | 146.2 | -28.9 | 29.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 994 | L | 28.6 | Very low | 33.7 | Very low | 159 Ų | 159 | 122.5 Ų | 122.5 | 83% | 0.832 | 76% | 0.759 | S | S | * | * | trans | 71.4 | 150.5 | 147.3 | -133.4 | 72.6 | 0 | 0 | 0 | 122.8 | ||||
| 995 | S | 30.4 | Very low | 33.9 | Very low | 113 Ų | 113 | 124.4 Ų | 124.4 | 79% | 0.79 | 76% | 0.761 | S | S | * | * | trans | 70 | 140.8 | 162.6 | -57.2 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 996 | G | 31.2 | Very low | 33.6 | Very low | 71 Ų | 71 | 125.7 Ų | 125.7 | 73% | 0.732 | 77% | 0.767 | S | S | * | * | cis | 157.3 | 166.5 | 0.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 997 | T | 34.2 | Very low | 33.7 | Very low | 140 Ų | 140 | 121.6 Ų | 121.6 | 86% | 0.859 | 76% | 0.761 | S | S | * | * | cis | -150.5 | 171 | -10.1 | 66.3 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 998 | A | 36.1 | Very low | 34.1 | Very low | 87 Ų | 87 | 121.3 Ų | 121.3 | 72% | 0.719 | 77% | 0.765 | S | S | * | * | cis | -140.4 | -156.4 | 4.7 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 999 | S | 37.3 | Very low | 34 | Very low | 115 Ų | 115 | 123.4 Ų | 123.4 | 80% | 0.804 | 77% | 0.768 | S | S | * | * | cis | -159.9 | 170.4 | 2.6 | -139.4 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 1000 | S | 39.9 | Very low | 34.2 | Very low | 103 Ų | 103 | 124.9 Ų | 124.9 | 72% | 0.72 | 77% | 0.768 | S | S | * | * | cis | -137.5 | -113.8 | 4.2 | 60.6 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 1001 | R | 34 | Very low | 34.3 | Very low | 227 Ų | 227 | 123.7 Ų | 123.7 | 86% | 0.857 | 77% | 0.767 | S | S | * | * | trans | 178.2 | 174.7 | -169 | -110 | 174 | 177.7 | -165.1 | -2 | 109.4 | ||||
| 1002 | P | 39.7 | Very low | 34.4 | Very low | 106 Ų | 106 | 125 Ų | 125 | 69% | 0.688 | 77% | 0.774 | S | S | * | * | cis | -133.9 | 162.9 | -11.9 | 29.6 | -8.4 | 0 | 0 | 0 | 116.1 | ||||
| 1003 | S | 34.9 | Very low | 34.9 | Very low | 112 Ų | 112 | 123.5 Ų | 123.5 | 78% | 0.783 | 78% | 0.776 | S | S | * | * | trans | 33.8 | 167.1 | 130.6 | -32.5 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 1004 | S | 36.1 | Very low | 35.8 | Very low | 98 Ų | 98 | 124.2 Ų | 124.2 | 69% | 0.685 | 78% | 0.78 | S | S | * | * | cis | -163.6 | 145.3 | 9.9 | 83.8 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 1005 | V | 34.3 | Very low | 36.4 | Very low | 128 Ų | 128 | 122.5 Ų | 122.5 | 78% | 0.776 | 78% | 0.778 | S | S | * | * | trans | 75.8 | 143.5 | 131.8 | 173.6 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 1006 | V | 36 | Very low | 37 | Very low | 137 Ų | 137 | 124 Ų | 124 | 83% | 0.83 | 78% | 0.777 | S | S | * | * | trans | 64.3 | 130.5 | -178.2 | -147 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 1007 | G | 30 | Very low | 37.6 | Very low | 65 Ų | 65 | 126.7 Ų | 126.7 | 67% | 0.67 | 78% | 0.779 | S | S | * | * | cis | 129.1 | 117.7 | -10.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 1008 | V | 38.6 | Very low | 38.1 | Very low | 137 Ų | 137 | 123.4 Ų | 123.4 | 83% | 0.83 | 76% | 0.758 | S | S | * | * | trans | -171 | 146.7 | 158.5 | 132.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 1009 | N | 32.3 | Very low | 38.2 | Very low | 151 Ų | 151 | 124.3 Ų | 124.3 | 81% | 0.807 | 76% | 0.755 | S | S | * | * | trans | -83.6 | 136.6 | 177.5 | -69.7 | -17.1 | 0 | 0 | 0 | 112 | ||||
| 1010 | I | 40.2 | Very low | 38.5 | Very low | 149 Ų | 149 | 124.1 Ų | 124.1 | 76% | 0.764 | 75% | 0.749 | S | S | * | * | trans | -133.3 | 118.2 | 147.7 | -60.3 | -177.7 | 0 | 0 | 0 | 107.7 | T1012 | I1010-T1012 HydrophobicContact CG2-CG2 4.43Š| ||
| 1011 | T | 36 | Very low | 38.8 | Very low | 133 Ų | 133 | 121.4 Ų | 121.4 | 82% | 0.816 | 73% | 0.728 | S | S | * | * | trans | -101.1 | 110.7 | 175.8 | 48.1 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 1012 | T | 39.5 | Very low | 39.7 | Very low | 126 Ų | 126 | 115.9 Ų | 115.9 | 77% | 0.773 | 72% | 0.724 | S | S | * | * | trans | -124.7 | 113.7 | 167.9 | 41.9 | 0 | 0 | 0 | 0 | 109.3 | I1010 | I1010-T1012 HydrophobicContact CG2-CG2 4.43Š| ||
| 1013 | S | 37.5 | Very low | 41.3 | Very low | 120 Ų | 120 | 114.8 Ų | 114.8 | 84% | 0.839 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 121.7 | -176.2 | 51.7 | 0 | 0 | 0 | 0 | 112.1 | ||
| 1014 | T | 44.5 | Very low | 43.9 | Very low | 132 Ų | 132 | 114.7 Ų | 114.7 | 81% | 0.81 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -96.5 | 134.2 | 161 | 43.4 | 0 | 0 | 0 | 0 | 109.8 | ||
| 1015 | P | 42 | Very low | 46.7 | Very low | 122 Ų | 122 | 111.2 Ų | 111.2 | 79% | 0.792 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 138.3 | 178.7 | 30.7 | -33.8 | 0 | 0 | 0 | 111 | ||
| 1016 | L | 42.7 | Very low | 49.5 | Very low | 145 Ų | 145 | 111.4 Ų | 111.4 | 76% | 0.759 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -91.1 | 116.8 | 179.7 | -149.7 | 161.6 | 0 | 0 | 0 | 109 | V1018 | L1016-V1018 PolarHBondContact O-N 3.27Š|
| 1017 | V | 44 | Very low | 52.2 | Low | 128 Ų | 128 | 107 Ų | 107 | 78% | 0.776 | 64% | 0.642 | S | S | * | * | trans | -73.9 | 110.1 | -178.7 | 178.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 1018 | V | 44.3 | Very low | 55.2 | Low | 70 Ų | 70 | 104.1 Ų | 104.1 | 42% | 0.424 | 61% | 0.611 | S | S | . | * | trans | -82.4 | 115.1 | 171.1 | 178.6 | 0 | 0 | 0 | 0 | 108.5 | L1016 T1020 | L1016-V1018 PolarHBondContact O-N 3.27Å; V1018-T1020 PolarHBondContact O-N 2.61Å | ||
| 1019 | T | 39.4 | Very low | 57.7 | Low | 106 Ų | 106 | 100.1 Ų | 100.1 | 65% | 0.65 | 58% | 0.583 | S | S | * | * | trans | -70.5 | 109.2 | 167.9 | 45.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 1020 | T | 42.8 | Very low | 60.5 | Low | 111 Ų | 111 | 96.2 Ų | 96.2 | 68% | 0.681 | 56% | 0.562 | S | S | * | * | trans | -71.2 | 148 | 173.1 | 51.8 | 0 | 0 | 0 | 0 | 111.5 | V1018 | V1018-T1020 PolarHBondContact O-N 2.61Š| ||
| 1021 | V | 46.3 | Very low | 62.9 | Low | 46 Ų | 46 | 89.5 Ų | 89.5 | 28% | 0.279 | 53% | 0.527 | S | S | . | . | trans | -33.8 | 152.2 | 148.8 | -95.2 | 0 | 0 | 0 | 0 | 113 | Q237 E238 S1023 | Q237-V1021 HydrophobicContact CB-CG1 3.96Å; Q237-V1021 HydrophobicContact CG-CG1 3.55Å; Q237-V1021 VanDerWaalsContact OE1-N 3.13Å; E238-V1021 HydrophobicContact CG-CG1 3.56Å; E238-V1021 WeakPolarHBondContact OE1-CA 3.37Å; V1021-S1023 PolarHBondContact O-N 3.25Å | ||
| 1022 | S | 53.1 | Low | 65.5 | Low | 111 Ų | 111 | 86.5 Ų | 86.5 | 78% | 0.776 | 50% | 0.501 | S | S | * | . | trans | -72.2 | 66.4 | 160 | -176.9 | 0 | 0 | 0 | 0 | 110.7 | E238 | E238-S1022 PolarHBondContact OE1-N 2.97Š| ||
| 1023 | S | 72.7 | Confident | 67.7 | Low | 84 Ų | 84 | 85.8 Ų | 85.8 | 59% | 0.587 | 49% | 0.493 | S | S | * | . | P | Polyproline II helix | trans | -58.5 | 138.3 | 166.2 | 52.1 | 0 | 0 | 0 | 0 | 109.9 | V1021 | V1021-S1023 PolarHBondContact O-N 3.25Š|
| 1024 | R | 90.4 | Very high | 69.6 | Low | 110 Ų | 110 | 81.8 Ų | 81.8 | 42% | 0.415 | 46% | 0.464 | S | S | . | . | P | Polyproline II helix | trans | -55.7 | 151.4 | 172.9 | -60 | -170 | -168 | 79.8 | 11.2 | 110.7 | L1028 E1029 E1052 D1056 | R1024-L1028 HydrophobicContact CB-CB 4.4Å; R1024-L1028 HydrophobicContact CB-CD2 4.23Å; R1024-L1028 HydrophobicContact CB-CG 4.46Å; R1024-L1028 HydrophobicContact CG-CD2 4.06Å; R1024-E1029 HydrophobicContact CB-CB 4.48Å; R1024-E1029 WeakPolarHBondContact CD-OE2 3.31Å; R1024-E1029 IonicContact CZ-OE2 3.18Å; R1024-E1029 IonicContact NE-OE2 3.58Å; R1024-E1029 IonicContact NH1-OE2 2.72Å; R1024-E1029 PolarHBondContact NH1-OE2 2.89Å; R1024-E1052 WeakPolarHBondContact CA-OE1 3.08Å; R1024-D1056 IonicContact NE-OD1 3.83Å; R1024-D1056 PolarHBondContact NE-OD1 3.04Å |
| 1025 | S | 94.6 | Very high | 70.8 | Confident | 24 Ų | 24 | 78.4 Ų | 78.4 | 17% | 0.168 | 45% | 0.446 | C | S | . | . | P | Polyproline II helix | trans | -59.4 | 153.1 | 167.4 | 65.6 | 0 | 0 | 0 | 0 | 111 | L1027 L1028 E1029 H1049 E1052 | S1025-L1027 PolarHBondContact O-N 2.95Å; S1025-L1028 PolarHBondContact O-N 3.16Å; S1025-L1028 VanDerWaalsContact O-N 3.17Å; S1025-L1028 WeakPolarHBondContact OG-CB 3.04Å; S1025-L1028 PolarHBondContact OG-N 2.78Å; S1025-E1029 PolarHBondContact O-N 3.48Å; S1025-H1049 WeakPolarHBondContact CB-CE1 3.47Å; S1025-H1049 PolarHBondContact OG-ND1 3.1Å; S1025-E1052 WeakPolarHBondContact CB-OE2 3.37Å; S1025-E1052 PolarHBondContact N-OE1 3.37Å; S1025-E1052 VanDerWaalsContact OG-CD 3.3Å; S1025-E1052 PolarHBondContact OG-OE1 2.66Å; S1025-E1052 PolarHBondContact OG-OE2 2.74Å |
| 1026 | Q | 92.1 | Very high | 72 | Confident | 132 Ų | 132 | 76.2 Ų | 76.2 | 62% | 0.617 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -57.9 | -36.9 | 175.3 | -168.8 | 63.5 | 47 | 0 | 0 | 111.1 | L1028 E1029 D1030 | Q1026-L1028 PolarHBondContact O-N 2.87Å; Q1026-E1029 PolarHBondContact O-N 2.93Å; Q1026-D1030 PolarHBondContact NE2-OD1 3.37Å; Q1026-D1030 VanDerWaalsContact O-CB 3.23Å; Q1026-D1030 WeakPolarHBondContact O-CB 3.43Å; Q1026-D1030 PolarHBondContact O-N 2.94Å |
| 1027 | L | 92.7 | Very high | 73.1 | Confident | 46 Ų | 46 | 78.4 Ų | 78.4 | 24% | 0.241 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -59.9 | -45.8 | 176.6 | -177.5 | 63.5 | 0 | 0 | 0 | 112.3 | S1025 F1031 M1041 L1046 H1049 F1053 | S1025-L1027 PolarHBondContact O-N 2.95Å; L1027-F1031 WeakPolarHBondContact O-CB 3.23Å; L1027-F1031 PolarHBondContact O-N 3.14Å; L1027-M1041 HydrophobicContact CD1-CE 3.89Å; L1027-L1046 HydrophobicContact CD2-CD2 4.19Å; L1027-H1049 HydrophobicContact CD2-CB 4.1Å; L1027-F1053 HydrophobicContact CD2-CE2 4.18Å; L1027-F1053 HydrophobicContact CD2-CZ 4.48Å; L1027-F1053 HydrophobicContact CG-CE2 4.02Å; L1027-F1053 HydrophobicContact CG-CZ 4.02Å |
| 1028 | L | 93.3 | Very high | 74.3 | Confident | 3 Ų | 3 | 74.3 Ų | 74.3 | 2% | 0.016 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -72.5 | -37.5 | 178.7 | -179.6 | 59.4 | 0 | 0 | 0 | 112.3 | R1024 S1025 Q1026 F1031 R1032 E1052 F1053 D1056 | R1024-L1028 HydrophobicContact CB-CB 4.4Å; R1024-L1028 HydrophobicContact CB-CD2 4.23Å; R1024-L1028 HydrophobicContact CB-CG 4.46Å; R1024-L1028 HydrophobicContact CG-CD2 4.06Å; S1025-L1028 PolarHBondContact O-N 3.16Å; S1025-L1028 VanDerWaalsContact O-N 3.17Å; S1025-L1028 WeakPolarHBondContact OG-CB 3.04Å; S1025-L1028 PolarHBondContact OG-N 2.78Å; Q1026-L1028 PolarHBondContact O-N 2.87Å; L1028-F1031 HydrophobicContact CD1-CD1 4.44Å; L1028-F1031 PolarHBondContact O-N 3.23Å; L1028-R1032 HydrophobicContact CD1-CG 4.33Å; L1028-R1032 WeakPolarHBondContact O-CB 3.21Å; L1028-R1032 WeakPolarHBondContact O-CD 3.41Å; L1028-R1032 WeakPolarHBondContact O-CG 3.35Å; L1028-R1032 PolarHBondContact O-N 3.21Å; L1028-E1052 HydrophobicContact CD2-CG 3.81Å; L1028-E1052 WeakPolarHBondContact CD2-OE1 3.37Å; L1028-F1053 HydrophobicContact CB-CD2 4.15Å; L1028-F1053 HydrophobicContact CB-CE2 3.57Å; L1028-F1053 HydrophobicContact CB-CZ 4Å; L1028-F1053 HydrophobicContact CD1-CD1 3.98Å; L1028-F1053 HydrophobicContact CD1-CD2 3.9Å; L1028-F1053 HydrophobicContact CD1-CE1 3.87Å; L1028-F1053 HydrophobicContact CD1-CE2 3.8Å; L1028-F1053 HydrophobicContact CD1-CG 3.99Å; L1028-F1053 HydrophobicContact CD1-CZ 3.77Å; L1028-F1053 HydrophobicContact CG-CD2 4.45Å; L1028-F1053 HydrophobicContact CG-CE2 4.22Å; L1028-F1053 HydrophobicContact CG-CZ 4.5Å; L1028-D1056 HydrophobicContact CD1-CB 3.9Å; L1028-D1056 HydrophobicContact CD2-CB 3.8Å; L1028-D1056 HydrophobicContact CG-CB 4.41Å |
| 1029 | E | 91.9 | Very high | 75.5 | Confident | 54 Ų | 54 | 76.9 Ų | 76.9 | 25% | 0.252 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -71.3 | -38.6 | 178 | -161.4 | 57.7 | -127.9 | 0 | 0 | 111.4 | R1024 S1025 Q1026 R1032 N1033 | R1024-E1029 HydrophobicContact CB-CB 4.48Å; R1024-E1029 WeakPolarHBondContact CD-OE2 3.31Å; R1024-E1029 IonicContact CZ-OE2 3.18Å; R1024-E1029 IonicContact NE-OE2 3.58Å; R1024-E1029 IonicContact NH1-OE2 2.72Å; R1024-E1029 PolarHBondContact NH1-OE2 2.89Å; S1025-E1029 PolarHBondContact O-N 3.48Å; Q1026-E1029 PolarHBondContact O-N 2.93Å; E1029-R1032 PolarHBondContact O-N 2.92Å; E1029-N1033 WeakPolarHBondContact O-CB 3.38Å; E1029-N1033 PolarHBondContact O-N 3.49Å; E1029-N1033 PolarHBondContact O-ND2 3.1Å; E1029-N1033 PolarHBondContact OE1-ND2 3.44Å |
| 1030 | D | 90.5 | Very high | 77.1 | Confident | 69 Ų | 69 | 79.1 Ų | 79.1 | 37% | 0.369 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -63.1 | -44.5 | 170.6 | -73.3 | -16.8 | 0 | 0 | 0 | 111.2 | Q1026 R1032 N1033 S1034 F1038 | Q1026-D1030 PolarHBondContact NE2-OD1 3.37Å; Q1026-D1030 VanDerWaalsContact O-CB 3.23Å; Q1026-D1030 WeakPolarHBondContact O-CB 3.43Å; Q1026-D1030 PolarHBondContact O-N 2.94Å; D1030-R1032 VanDerWaalsContact C-N 3.32Å; D1030-R1032 PolarHBondContact O-N 3.16Å; D1030-N1033 PolarHBondContact O-N 3.47Å; D1030-S1034 PolarHBondContact O-N 3.07Å; D1030-F1038 HydrophobicContact CB-CE2 4.15Å; D1030-F1038 HydrophobicContact CB-CZ 4.24Å; D1030-F1038 WeakPolarHBondContact O-CE2 3.33Å |
| 1031 | F | 91.1 | Very high | 79.1 | Confident | 8 Ų | 8 | 74 Ų | 74 | 4% | 0.035 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -55.8 | -46.9 | 175.9 | 177.6 | -97.2 | 0 | 0 | 0 | 111.9 | L1027 L1028 S1035 F1038 M1041 F1053 H1058 F1062 | L1027-F1031 WeakPolarHBondContact O-CB 3.23Å; L1027-F1031 PolarHBondContact O-N 3.14Å; L1028-F1031 HydrophobicContact CD1-CD1 4.44Å; L1028-F1031 PolarHBondContact O-N 3.23Å; F1031-S1035 WeakPolarHBondContact O-CA 3.49Å; F1031-S1035 PolarHBondContact O-N 2.91Å; F1031-S1035 VanDerWaalsContact O-N 3.13Å; F1031-F1038 HydrophobicContact CB-CD2 4.46Å; F1031-F1038 HydrophobicContact CD2-CB 3.54Å; F1031-F1038 HydrophobicContact CD2-CD2 4.27Å; F1031-F1038 HydrophobicContact CD2-CG 4.03Å; F1031-F1038 HydrophobicContact CE2-CB 3.77Å; F1031-M1041 HydrophobicContact CD2-CE 4.14Å; F1031-M1041 HydrophobicContact CD2-SD 4.19Å; F1031-F1053 HydrophobicContact CB-CE1 3.87Å; F1031-F1053 HydrophobicContact CB-CZ 3.82Å; F1031-F1053 HydrophobicContact CD1-CD1 4.46Å; F1031-F1053 AromaticContact CD1-CE1 3.71Å; F1031-F1053 HydrophobicContact CD1-CE1 3.71Å; F1031-F1053 HydrophobicContact CD1-CZ 4.45Å; F1031-F1053 HydrophobicContact CD2-CE1 4.03Å; F1031-F1053 HydrophobicContact CE1-CE1 4.32Å; F1031-F1053 AromaticContact CG-CE1 3.57Å; F1031-F1053 HydrophobicContact CG-CE1 3.57Å; F1031-F1053 HydrophobicContact CG-CZ 4.06Å; F1031-H1058 HydrophobicContact CD1-CB 4.43Å; F1031-H1058 HydrophobicContact CE1-CB 3.87Å; F1031-F1062 HydrophobicContact CE1-CB 4.27Å; F1031-F1062 HydrophobicContact CE2-CB 4.4Å; F1031-F1062 AromaticContact CE2-CD2 3.67Å; F1031-F1062 HydrophobicContact CE2-CD2 3.67Å; F1031-F1062 HydrophobicContact CE2-CE2 4.02Å; F1031-F1062 HydrophobicContact CE2-CG 4Å; F1031-F1062 HydrophobicContact CZ-CB 3.64Å; F1031-F1062 AromaticContact CZ-CD2 3.68Å; F1031-F1062 HydrophobicContact CZ-CD2 3.68Å; F1031-F1062 HydrophobicContact CZ-CE2 4.48Å; F1031-F1062 AromaticContact CZ-CG 3.74Å; F1031-F1062 HydrophobicContact CZ-CG 3.74Å |
| 1032 | R | 89.3 | Confident | 81 | Confident | 69 Ų | 69 | 76.7 Ų | 76.7 | 26% | 0.26 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -64.5 | -43.5 | 177.2 | -71.3 | 167.1 | 57.9 | 76.6 | 28.4 | 112.3 | L1028 E1029 D1030 D1056 H1058 | L1028-R1032 HydrophobicContact CD1-CG 4.33Å; L1028-R1032 WeakPolarHBondContact O-CB 3.21Å; L1028-R1032 WeakPolarHBondContact O-CD 3.41Å; L1028-R1032 WeakPolarHBondContact O-CG 3.35Å; L1028-R1032 PolarHBondContact O-N 3.21Å; E1029-R1032 PolarHBondContact O-N 2.92Å; D1030-R1032 VanDerWaalsContact C-N 3.32Å; D1030-R1032 PolarHBondContact O-N 3.16Å; R1032-D1056 IonicContact CZ-OD1 2.76Å; R1032-D1056 IonicContact NE-OD1 3.92Å; R1032-D1056 IonicContact NH1-OD1 3.71Å; R1032-D1056 PolarHBondContact NH1-OD1 3.41Å; R1032-D1056 IonicContact NH1-OD2 2.76Å; R1032-D1056 PolarHBondContact NH1-OD2 3.43Å; R1032-H1058 PolarHBondContact NH1-CD2 2.9Å |
| 1033 | N | 86 | Confident | 82.9 | Confident | 112 Ų | 112 | 71.5 Ų | 71.5 | 60% | 0.599 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -83.2 | -6.5 | -176.5 | -69.6 | -60.4 | 0 | 0 | 0 | 114.4 | E1029 D1030 | E1029-N1033 WeakPolarHBondContact O-CB 3.38Å; E1029-N1033 PolarHBondContact O-N 3.49Å; E1029-N1033 PolarHBondContact O-ND2 3.1Å; E1029-N1033 PolarHBondContact OE1-ND2 3.44Å; D1030-N1033 PolarHBondContact O-N 3.47Å |
| 1034 | S | 77.3 | Confident | 83.7 | Confident | 35 Ų | 35 | 70.8 Ų | 70.8 | 25% | 0.245 | 36% | 0.355 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -147.2 | 40.8 | -178.7 | -79.4 | 0 | 0 | 0 | 0 | 113.2 | D1030 A1036 R1037 F1038 | D1030-S1034 PolarHBondContact O-N 3.07Å; S1034-A1036 PolarHBondContact O-N 3.38Å; S1034-R1037 WeakPolarHBondContact O-CB 3.35Å; S1034-R1037 PolarHBondContact O-N 3.02Å; S1034-F1038 VanDerWaalsContact O-CD2 3.31Å; S1034-F1038 WeakPolarHBondContact O-CD2 3.16Å |
| 1035 | S | 69.9 | Low | 83.7 | Confident | 62 Ų | 62 | 70.2 Ų | 70.2 | 43% | 0.434 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -43.8 | -38.3 | -179.9 | 176.8 | 0 | 0 | 0 | 0 | 114.3 | F1031 R1037 F1038 Q1039 | F1031-S1035 WeakPolarHBondContact O-CA 3.49Å; F1031-S1035 PolarHBondContact O-N 2.91Å; F1031-S1035 VanDerWaalsContact O-N 3.13Å; S1035-R1037 PolarHBondContact O-N 3.37Å; S1035-F1038 CarbonylContact O-C 3.56Å; S1035-F1038 PolarHBondContact O-N 2.75Å; S1035-Q1039 PolarHBondContact O-N 2.98Å; S1035-Q1039 VanDerWaalsContact O-N 3.08Å |
| 1036 | A | 67.3 | Low | 83.6 | Confident | 75 Ų | 75 | 69 Ų | 69 | 62% | 0.62 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -59 | -37.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | S1034 F1038 | S1034-A1036 PolarHBondContact O-N 3.38Å; A1036-F1038 VanDerWaalsContact C-N 3.26Å; A1036-F1038 PolarHBondContact O-N 2.96Å |
| 1037 | R | 65.7 | Low | 83.6 | Confident | 192 Ų | 192 | 69.9 Ų | 69.9 | 73% | 0.725 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -66.9 | -31.2 | 173.6 | -63.6 | -174.3 | -172.5 | 167.1 | 3.9 | 112 | S1034 S1035 | S1034-R1037 WeakPolarHBondContact O-CB 3.35Å; S1034-R1037 PolarHBondContact O-N 3.02Å; S1035-R1037 PolarHBondContact O-N 3.37Å |
| 1038 | F | 70.2 | Confident | 83.7 | Confident | 41 Ų | 41 | 74.4 Ų | 74.4 | 18% | 0.18 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -103 | 9 | -169.3 | -60.5 | -67.9 | 0 | 0 | 0 | 114 | D1030 F1031 S1034 S1035 A1036 H1040 M1041 | D1030-F1038 HydrophobicContact CB-CE2 4.15Å; D1030-F1038 HydrophobicContact CB-CZ 4.24Å; D1030-F1038 WeakPolarHBondContact O-CE2 3.33Å; F1031-F1038 HydrophobicContact CB-CD2 4.46Å; F1031-F1038 HydrophobicContact CD2-CB 3.54Å; F1031-F1038 HydrophobicContact CD2-CD2 4.27Å; F1031-F1038 HydrophobicContact CD2-CG 4.03Å; F1031-F1038 HydrophobicContact CE2-CB 3.77Å; S1034-F1038 VanDerWaalsContact O-CD2 3.31Å; S1034-F1038 WeakPolarHBondContact O-CD2 3.16Å; S1035-F1038 CarbonylContact O-C 3.56Å; S1035-F1038 PolarHBondContact O-N 2.75Å; A1036-F1038 VanDerWaalsContact C-N 3.26Å; A1036-F1038 PolarHBondContact O-N 2.96Å; F1038-H1040 PolarHBondContact O-N 2.97Å; F1038-M1041 HydrophobicContact CB-CB 4.14Å; F1038-M1041 HydrophobicContact CB-CE 4.4Å; F1038-M1041 HydrophobicContact CD1-CB 4.38Å; F1038-M1041 HydrophobicContact CD1-CE 3.58Å; F1038-M1041 HydrophobicContact CE1-CE 4.01Å; F1038-M1041 HydrophobicContact CG-CE 4.12Å; F1038-M1041 VanDerWaalsContact O-CB 3.22Å; F1038-M1041 WeakPolarHBondContact O-CB 3.34Å; F1038-M1041 PolarHBondContact O-N 3.16Å |
| 1039 | Q | 69.7 | Low | 83.8 | Confident | 124 Ų | 124 | 77.1 Ų | 77.1 | 58% | 0.579 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.3 | -37.2 | 167.9 | -66.7 | -176.5 | -13.7 | 0 | 0 | 111.3 | S1035 K1066 | S1035-Q1039 PolarHBondContact O-N 2.98Å; S1035-Q1039 VanDerWaalsContact O-N 3.08Å; Q1039-K1066 PolarHBondContact O-NZ 3.29Å |
| 1040 | H | 73.3 | Confident | 84 | Confident | 154 Ų | 154 | 74.6 Ų | 74.6 | 71% | 0.713 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85 | -1.9 | 177.3 | -56.7 | -65.4 | 0 | 0 | 0 | 114.7 | F1038 H1042 | F1038-H1040 PolarHBondContact O-N 2.97Å; H1040-H1042 PolarHBondContact O-CD2 3.23Å; H1040-H1042 VanDerWaalsContact O-CD2 3.31Å |
| 1041 | M | 83.1 | Confident | 84.4 | Confident | 4 Ų | 4 | 72.9 Ų | 72.9 | 2% | 0.02 | 36% | 0.363 | C | S | . | . | trans | -60 | 140.1 | 175.9 | -177.9 | -163.6 | -94 | 0 | 0 | 110.3 | L1027 F1031 F1038 E1045 L1046 F1062 K1066 | L1027-M1041 HydrophobicContact CD1-CE 3.89Å; F1031-M1041 HydrophobicContact CD2-CE 4.14Å; F1031-M1041 HydrophobicContact CD2-SD 4.19Å; F1038-M1041 HydrophobicContact CB-CB 4.14Å; F1038-M1041 HydrophobicContact CB-CE 4.4Å; F1038-M1041 HydrophobicContact CD1-CB 4.38Å; F1038-M1041 HydrophobicContact CD1-CE 3.58Å; F1038-M1041 HydrophobicContact CE1-CE 4.01Å; F1038-M1041 HydrophobicContact CG-CE 4.12Å; F1038-M1041 VanDerWaalsContact O-CB 3.22Å; F1038-M1041 WeakPolarHBondContact O-CB 3.34Å; F1038-M1041 PolarHBondContact O-N 3.16Å; M1041-E1045 WeakPolarHBondContact CA-OE1 3.46Å; M1041-E1045 HydrophobicContact CG-CB 3.89Å; M1041-E1045 HydrophobicContact CG-CG 4.41Å; M1041-L1046 HydrophobicContact CE-CD2 4.08Å; M1041-L1046 HydrophobicContact SD-CD2 3.47Å; M1041-L1046 WeakPolarHBondContact SD-CD2 3.44Å; M1041-L1046 HydrophobicContact SD-CG 3.97Å; M1041-F1062 HydrophobicContact CB-CE2 4.07Å; M1041-F1062 HydrophobicContact CB-CZ 3.75Å; M1041-F1062 HydrophobicContact CG-CZ 3.9Å; M1041-F1062 WeakPolarHBondContact O-CZ 3.34Å; M1041-F1062 HydrophobicContact SD-CE1 4.08Å; M1041-F1062 HydrophobicContact SD-CE2 4.49Å; M1041-F1062 HydrophobicContact SD-CZ 3.8Å; M1041-K1066 WeakPolarHBondContact O-CE 3.18Å; M1041-K1066 PolarHBondContact O-NZ 3.07Å | ||
| 1042 | H | 87.1 | Confident | 84.7 | Confident | 102 Ų | 102 | 75.2 Ų | 75.2 | 47% | 0.472 | 37% | 0.374 | S | S | . | . | trans | -97.5 | 155.3 | 174.8 | -75.8 | -98.8 | 0 | 0 | 0 | 111.9 | H1040 S1044 E1045 | H1040-H1042 PolarHBondContact O-CD2 3.23Å; H1040-H1042 VanDerWaalsContact O-CD2 3.31Å; H1042-S1044 WeakPolarHBondContact CB-OG 3.23Å; H1042-S1044 PolarHBondContact O-N 3.14Å; H1042-S1044 VanDerWaalsContact O-N 3.13Å; H1042-E1045 PolarHBondContact N-OE1 3.03Å; H1042-E1045 WeakPolarHBondContact O-CB 3.31Å; H1042-E1045 PolarHBondContact O-N 3.07Å | ||
| 1043 | L | 92.2 | Very high | 85 | Confident | 2 Ų | 2 | 72 Ų | 72 | 1% | 0.01 | 36% | 0.362 | C | S | . | . | G | 310 helix | trans | -59.2 | -26.4 | 177.5 | -72.7 | 167.3 | 0 | 0 | 0 | 112.8 | E1045 L1046 M1050 F1062 I1063 K1066 A1070 E1074 V1078 | L1043-E1045 PolarHBondContact O-N 3.47Å; L1043-L1046 PolarHBondContact O-N 3.2Å; L1043-M1050 WeakPolarHBondContact O-CE 3.39Å; L1043-F1062 HydrophobicContact CD2-CE1 4.46Å; L1043-I1063 HydrophobicContact CD2-CG1 4.31Å; L1043-K1066 HydrophobicContact CD1-CB 3.79Å; L1043-K1066 HydrophobicContact CD2-CB 3.88Å; L1043-K1066 HydrophobicContact CG-CB 3.74Å; L1043-K1066 HydrophobicContact CG-CG 4.45Å; L1043-A1070 HydrophobicContact CD1-CB 3.7Å; L1043-E1074 HydrophobicContact CD1-CB 4.23Å; L1043-V1078 HydrophobicContact CB-CG2 4.04Å; L1043-V1078 HydrophobicContact CD1-CG2 3.95Å; L1043-V1078 HydrophobicContact CD2-CG2 3.92Å; L1043-V1078 HydrophobicContact CG-CG2 4.19Å |
| 1044 | S | 90.5 | Very high | 85.6 | Confident | 68 Ų | 68 | 66.6 Ų | 66.6 | 48% | 0.476 | 33% | 0.333 | S | S | . | . | G | 310 helix | trans | -64.5 | -22.8 | 174.5 | 49.8 | 0 | 0 | 0 | 0 | 114.6 | H1042 L1046 | H1042-S1044 WeakPolarHBondContact CB-OG 3.23Å; H1042-S1044 PolarHBondContact O-N 3.14Å; H1042-S1044 VanDerWaalsContact O-N 3.13Å; S1044-L1046 VanDerWaalsContact C-N 3.33Å |
| 1045 | E | 90.9 | Very high | 86.6 | Confident | 98 Ų | 98 | 71.7 Ų | 71.7 | 46% | 0.458 | 35% | 0.347 | S | S | . | . | G | 310 helix | trans | -81.2 | -15.1 | 177.6 | -64.7 | 170.3 | -106.2 | 0 | 0 | 112.4 | M1041 H1042 L1043 R1047 | M1041-E1045 WeakPolarHBondContact CA-OE1 3.46Å; M1041-E1045 HydrophobicContact CG-CB 3.89Å; M1041-E1045 HydrophobicContact CG-CG 4.41Å; H1042-E1045 PolarHBondContact N-OE1 3.03Å; H1042-E1045 WeakPolarHBondContact O-CB 3.31Å; H1042-E1045 PolarHBondContact O-N 3.07Å; L1043-E1045 PolarHBondContact O-N 3.47Å; E1045-R1047 VanDerWaalsContact C-N 3.32Å |
| 1046 | L | 92.5 | Very high | 87.9 | Confident | 0 Ų | 0 | 69.2 Ų | 69.2 | 0% | 0 | 33% | 0.329 | C | S | . | . | G | 310 helix | trans | -89.7 | 10.1 | 177 | -63.9 | -170.1 | 0 | 0 | 0 | 114 | L1027 M1041 L1043 S1044 D1048 H1049 M1050 F1053 F1062 I1063 | L1027-L1046 HydrophobicContact CD2-CD2 4.19Å; M1041-L1046 HydrophobicContact CE-CD2 4.08Å; M1041-L1046 HydrophobicContact SD-CD2 3.47Å; M1041-L1046 WeakPolarHBondContact SD-CD2 3.44Å; M1041-L1046 HydrophobicContact SD-CG 3.97Å; L1043-L1046 PolarHBondContact O-N 3.2Å; S1044-L1046 VanDerWaalsContact C-N 3.33Å; L1046-D1048 PolarHBondContact O-N 3.08Å; L1046-H1049 CarbonylContact O-C 3.47Å; L1046-H1049 WeakPolarHBondContact O-CA 3.48Å; L1046-H1049 PolarHBondContact O-N 3.2Å; L1046-M1050 HydrophobicContact CB-CE 3.6Å; L1046-M1050 HydrophobicContact CB-SD 4.08Å; L1046-M1050 HydrophobicContact CD1-SD 4.34Å; L1046-M1050 PolarHBondContact O-N 3.35Å; L1046-F1053 HydrophobicContact CD1-CB 4.24Å; L1046-F1053 HydrophobicContact CD1-CD1 3.6Å; L1046-F1053 HydrophobicContact CD1-CE1 4.12Å; L1046-F1053 HydrophobicContact CD1-CG 3.94Å; L1046-F1053 HydrophobicContact CD2-CD1 3.63Å; L1046-F1053 HydrophobicContact CD2-CD2 3.97Å; L1046-F1053 HydrophobicContact CD2-CE1 3.36Å; L1046-F1053 HydrophobicContact CD2-CE2 3.71Å; L1046-F1053 HydrophobicContact CD2-CG 3.95Å; L1046-F1053 HydrophobicContact CD2-CZ 3.4Å; L1046-F1053 HydrophobicContact CG-CD1 4.28Å; L1046-F1053 HydrophobicContact CG-CE1 4.4Å; L1046-F1062 HydrophobicContact CD1-CD1 3.77Å; L1046-F1062 HydrophobicContact CD1-CE1 3.58Å; L1046-F1062 HydrophobicContact CG-CE1 4.25Å; L1046-I1063 HydrophobicContact CD1-CD1 4.33Å; L1046-I1063 HydrophobicContact CD1-CG1 3.99Å |
| 1047 | R | 92.2 | Very high | 89.3 | Confident | 150 Ų | 150 | 70.2 Ų | 70.2 | 57% | 0.566 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.7 | 138.7 | 179.1 | -174 | -176.2 | -66.9 | 169.9 | 1.4 | 111 | E1045 H1049 | E1045-R1047 VanDerWaalsContact C-N 3.32Å; R1047-H1049 PolarHBondContact O-N 3Å |
| 1048 | D | 93.9 | Very high | 90.6 | Very high | 140 Ų | 140 | 64.9 Ų | 64.9 | 75% | 0.749 | 30% | 0.304 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.7 | -11.5 | -176.3 | -53.1 | -56.8 | 0 | 0 | 0 | 114.1 | L1046 E1081 | L1046-D1048 PolarHBondContact O-N 3.08Å; D1048-E1081 WeakPolarHBondContact CA-OE2 3.44Å; D1048-E1081 PolarHBondContact N-OE2 3.05Å |
| 1049 | H | 95.5 | Very high | 91.8 | Very high | 61 Ų | 61 | 62.9 Ų | 62.9 | 28% | 0.282 | 30% | 0.295 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.5 | -2.4 | 175.4 | -71.7 | -81.6 | 0 | 0 | 0 | 113.7 | S1025 L1027 L1046 R1047 V1051 E1052 F1053 | S1025-H1049 WeakPolarHBondContact CB-CE1 3.47Å; S1025-H1049 PolarHBondContact OG-ND1 3.1Å; L1027-H1049 HydrophobicContact CD2-CB 4.1Å; L1046-H1049 CarbonylContact O-C 3.47Å; L1046-H1049 WeakPolarHBondContact O-CA 3.48Å; L1046-H1049 PolarHBondContact O-N 3.2Å; R1047-H1049 PolarHBondContact O-N 3Å; H1049-V1051 VanDerWaalsContact C-N 3.27Å; H1049-V1051 PolarHBondContact O-N 3.09Å; H1049-V1051 VanDerWaalsContact O-N 3.16Å; H1049-E1052 IonicContact CE1-OE2 3.98Å; H1049-E1052 IonicContact CG-OE2 2.97Å; H1049-E1052 IonicContact ND1-OE2 3.71Å; H1049-E1052 PolarHBondContact ND1-OE2 3.12Å; H1049-E1052 WeakPolarHBondContact O-CA 3.47Å; H1049-E1052 VanDerWaalsContact O-CB 3.31Å; H1049-E1052 WeakPolarHBondContact O-CB 3.48Å; H1049-E1052 PolarHBondContact O-N 3.08Å; H1049-F1053 HydrophobicContact CB-CD2 4.02Å; H1049-F1053 HydrophobicContact CB-CE2 4.21Å; H1049-F1053 PolarHBondContact O-N 3.41Å |
| 1050 | M | 96.4 | Very high | 93.2 | Very high | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -57.2 | -38.3 | -171.1 | -160.7 | 66.6 | 60.6 | 0 | 0 | 113.5 | L1043 L1046 A1054 I1063 V1078 E1081 I1082 | L1043-M1050 WeakPolarHBondContact O-CE 3.39Å; L1046-M1050 HydrophobicContact CB-CE 3.6Å; L1046-M1050 HydrophobicContact CB-SD 4.08Å; L1046-M1050 HydrophobicContact CD1-SD 4.34Å; L1046-M1050 PolarHBondContact O-N 3.35Å; M1050-A1054 VanDerWaalsContact O-CB 3.23Å; M1050-A1054 WeakPolarHBondContact O-CB 2.99Å; M1050-A1054 PolarHBondContact O-N 3.28Å; M1050-I1063 HydrophobicContact CG-CD1 4.37Å; M1050-I1063 HydrophobicContact SD-CD1 3.7Å; M1050-I1063 HydrophobicContact SD-CG1 4.07Å; M1050-V1078 HydrophobicContact CE-CB 4.36Å; M1050-V1078 HydrophobicContact CE-CG2 3.72Å; M1050-V1078 HydrophobicContact CG-CB 4.41Å; M1050-V1078 HydrophobicContact CG-CG1 3.85Å; M1050-V1078 HydrophobicContact SD-CB 4.23Å; M1050-V1078 HydrophobicContact SD-CG1 3.84Å; M1050-V1078 HydrophobicContact SD-CG2 3.82Å; M1050-E1081 HydrophobicContact CB-CB 3.88Å; M1050-E1081 HydrophobicContact CB-CG 4.44Å; M1050-E1081 WeakPolarHBondContact CB-OE2 3.3Å; M1050-E1081 HydrophobicContact CG-CB 4.44Å; M1050-I1082 HydrophobicContact CG-CG2 3.96Å |
| 1051 | V | 97.6 | Very high | 94.3 | Very high | 33 Ų | 33 | 57.2 Ų | 57.2 | 20% | 0.2 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -74.7 | -28.1 | 179.1 | -176 | 0 | 0 | 0 | 0 | 111.8 | H1049 R1055 E1081 I1082 H1085 | H1049-V1051 VanDerWaalsContact C-N 3.27Å; H1049-V1051 PolarHBondContact O-N 3.09Å; H1049-V1051 VanDerWaalsContact O-N 3.16Å; V1051-R1055 VanDerWaalsContact O-CG 3.27Å; V1051-R1055 WeakPolarHBondContact O-CG 3.48Å; V1051-E1081 VanDerWaalsContact CG2-O 3.3Å; V1051-E1081 WeakPolarHBondContact CG2-O 3.49Å; V1051-I1082 HydrophobicContact CG2-CG2 4.39Å; V1051-H1085 HydrophobicContact CG1-CB 3.98Å; V1051-H1085 HydrophobicContact CG2-CB 4.31Å; V1051-H1085 WeakPolarHBondContact CG2-ND1 3.43Å |
| 1052 | E | 97.7 | Very high | 94.8 | Very high | 58 Ų | 58 | 57.5 Ų | 57.5 | 27% | 0.271 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -72 | -51.1 | 173.6 | -165.9 | -164 | 176.3 | 0 | 0 | 109.9 | R1024 S1025 L1028 H1049 A1054 R1055 D1056 | R1024-E1052 WeakPolarHBondContact CA-OE1 3.08Å; S1025-E1052 WeakPolarHBondContact CB-OE2 3.37Å; S1025-E1052 PolarHBondContact N-OE1 3.37Å; S1025-E1052 VanDerWaalsContact OG-CD 3.3Å; S1025-E1052 PolarHBondContact OG-OE1 2.66Å; S1025-E1052 PolarHBondContact OG-OE2 2.74Å; L1028-E1052 HydrophobicContact CD2-CG 3.81Å; L1028-E1052 WeakPolarHBondContact CD2-OE1 3.37Å; H1049-E1052 IonicContact CE1-OE2 3.98Å; H1049-E1052 IonicContact CG-OE2 2.97Å; H1049-E1052 IonicContact ND1-OE2 3.71Å; H1049-E1052 PolarHBondContact ND1-OE2 3.12Å; H1049-E1052 WeakPolarHBondContact O-CA 3.47Å; H1049-E1052 VanDerWaalsContact O-CB 3.31Å; H1049-E1052 WeakPolarHBondContact O-CB 3.48Å; H1049-E1052 PolarHBondContact O-N 3.08Å; E1052-A1054 PolarHBondContact O-N 3.48Å; E1052-R1055 CarbonylContact O-C 3.18Å; E1052-R1055 PolarHBondContact O-N 2.95Å; E1052-D1056 PolarHBondContact O-N 3.45Å |
| 1053 | F | 97.2 | Very high | 95.3 | Very high | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -59.4 | -43.7 | 177 | -89.2 | -113.7 | 0 | 0 | 0 | 111.8 | L1027 L1028 F1031 L1046 H1049 R1055 D1056 G1059 S1060 I1063 | L1027-F1053 HydrophobicContact CD2-CE2 4.18Å; L1027-F1053 HydrophobicContact CD2-CZ 4.48Å; L1027-F1053 HydrophobicContact CG-CE2 4.02Å; L1027-F1053 HydrophobicContact CG-CZ 4.02Å; L1028-F1053 HydrophobicContact CB-CD2 4.15Å; L1028-F1053 HydrophobicContact CB-CE2 3.57Å; L1028-F1053 HydrophobicContact CB-CZ 4Å; L1028-F1053 HydrophobicContact CD1-CD1 3.98Å; L1028-F1053 HydrophobicContact CD1-CD2 3.9Å; L1028-F1053 HydrophobicContact CD1-CE1 3.87Å; L1028-F1053 HydrophobicContact CD1-CE2 3.8Å; L1028-F1053 HydrophobicContact CD1-CG 3.99Å; L1028-F1053 HydrophobicContact CD1-CZ 3.77Å; L1028-F1053 HydrophobicContact CG-CD2 4.45Å; L1028-F1053 HydrophobicContact CG-CE2 4.22Å; L1028-F1053 HydrophobicContact CG-CZ 4.5Å; F1031-F1053 HydrophobicContact CB-CE1 3.87Å; F1031-F1053 HydrophobicContact CB-CZ 3.82Å; F1031-F1053 HydrophobicContact CD1-CD1 4.46Å; F1031-F1053 AromaticContact CD1-CE1 3.71Å; F1031-F1053 HydrophobicContact CD1-CE1 3.71Å; F1031-F1053 HydrophobicContact CD1-CZ 4.45Å; F1031-F1053 HydrophobicContact CD2-CE1 4.03Å; F1031-F1053 HydrophobicContact CE1-CE1 4.32Å; F1031-F1053 AromaticContact CG-CE1 3.57Å; F1031-F1053 HydrophobicContact CG-CE1 3.57Å; F1031-F1053 HydrophobicContact CG-CZ 4.06Å; L1046-F1053 HydrophobicContact CD1-CB 4.24Å; L1046-F1053 HydrophobicContact CD1-CD1 3.6Å; L1046-F1053 HydrophobicContact CD1-CE1 4.12Å; L1046-F1053 HydrophobicContact CD1-CG 3.94Å; L1046-F1053 HydrophobicContact CD2-CD1 3.63Å; L1046-F1053 HydrophobicContact CD2-CD2 3.97Å; L1046-F1053 HydrophobicContact CD2-CE1 3.36Å; L1046-F1053 HydrophobicContact CD2-CE2 3.71Å; L1046-F1053 HydrophobicContact CD2-CG 3.95Å; L1046-F1053 HydrophobicContact CD2-CZ 3.4Å; L1046-F1053 HydrophobicContact CG-CD1 4.28Å; L1046-F1053 HydrophobicContact CG-CE1 4.4Å; H1049-F1053 HydrophobicContact CB-CD2 4.02Å; H1049-F1053 HydrophobicContact CB-CE2 4.21Å; H1049-F1053 PolarHBondContact O-N 3.41Å; F1053-R1055 PolarHBondContact O-N 3.18Å; F1053-R1055 VanDerWaalsContact O-N 3.07Å; F1053-D1056 PolarHBondContact O-N 3.15Å; F1053-G1059 CarbonylContact O-C 3.47Å; F1053-G1059 VanDerWaalsContact O-CA 3.32Å; F1053-G1059 WeakPolarHBondContact O-CA 3.44Å; F1053-S1060 PolarHBondContact O-N 2.82Å; F1053-I1063 HydrophobicContact CB-CD1 3.67Å |
| 1054 | A | 98.1 | Very high | 95.5 | Very high | 0 Ų | 0 | 54.2 Ų | 54.2 | 0% | 0 | 25% | 0.248 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.5 | -20.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | M1050 E1052 S1060 I1063 L1089 F1094 G1095 V1098 | M1050-A1054 VanDerWaalsContact O-CB 3.23Å; M1050-A1054 WeakPolarHBondContact O-CB 2.99Å; M1050-A1054 PolarHBondContact O-N 3.28Å; E1052-A1054 PolarHBondContact O-N 3.48Å; A1054-S1060 WeakPolarHBondContact O-CB 3.36Å; A1054-I1063 HydrophobicContact CB-CD1 4.21Å; A1054-L1089 HydrophobicContact CB-CD2 3.98Å; A1054-F1094 CarbonylContact O-C 3.41Å; A1054-F1094 VanDerWaalsContact O-C 3.25Å; A1054-G1095 WeakPolarHBondContact O-CA 3.28Å; A1054-G1095 PolarHBondContact O-N 3.37Å; A1054-V1098 HydrophobicContact CB-CB 4.49Å; A1054-V1098 HydrophobicContact CB-CG2 3.97Å |
| 1055 | R | 97.9 | Very high | 95.8 | Very high | 141 Ų | 141 | 57.3 Ų | 57.3 | 53% | 0.532 | 26% | 0.255 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.3 | 8 | 178.2 | -62.1 | -177.3 | 70.7 | -128.9 | -12.9 | 113.6 | V1051 E1052 F1053 L1089 D1092 F1094 | V1051-R1055 VanDerWaalsContact O-CG 3.27Å; V1051-R1055 WeakPolarHBondContact O-CG 3.48Å; E1052-R1055 CarbonylContact O-C 3.18Å; E1052-R1055 PolarHBondContact O-N 2.95Å; F1053-R1055 PolarHBondContact O-N 3.18Å; F1053-R1055 VanDerWaalsContact O-N 3.07Å; R1055-L1089 HydrophobicContact CG-CD2 3.48Å; R1055-L1089 VanDerWaalsContact CG-CD2 3.48Å; R1055-D1092 IonicContact CZ-OD1 3.12Å; R1055-D1092 IonicContact NE-OD1 2.71Å; R1055-D1092 PolarHBondContact NE-OD1 3.09Å; R1055-D1092 IonicContact NH2-OD1 2.78Å; R1055-D1092 PolarHBondContact NH2-OD1 2.78Å; R1055-F1094 WeakPolarHBondContact O-CD2 3.23Å |
| 1056 | D | 97.1 | Very high | 95.9 | Very high | 11 Ų | 11 | 55 Ų | 55 | 6% | 0.059 | 24% | 0.244 | C | C | . | . | S | Bend | trans | -106.6 | 148.5 | 169.2 | -174.7 | 87.6 | 0 | 0 | 0 | 111.3 | R1024 L1028 R1032 E1052 F1053 H1058 G1059 S1060 | R1024-D1056 IonicContact NE-OD1 3.83Å; R1024-D1056 PolarHBondContact NE-OD1 3.04Å; L1028-D1056 HydrophobicContact CD1-CB 3.9Å; L1028-D1056 HydrophobicContact CD2-CB 3.8Å; L1028-D1056 HydrophobicContact CG-CB 4.41Å; R1032-D1056 IonicContact CZ-OD1 2.76Å; R1032-D1056 IonicContact NE-OD1 3.92Å; R1032-D1056 IonicContact NH1-OD1 3.71Å; R1032-D1056 PolarHBondContact NH1-OD1 3.41Å; R1032-D1056 IonicContact NH1-OD2 2.76Å; R1032-D1056 PolarHBondContact NH1-OD2 3.43Å; E1052-D1056 PolarHBondContact O-N 3.45Å; F1053-D1056 PolarHBondContact O-N 3.15Å; D1056-H1058 VanDerWaalsContact C-N 3.34Å; D1056-H1058 PolarHBondContact O-N 3.43Å; D1056-H1058 IonicContact OD2-CD2 2.69Å; D1056-H1058 PolarHBondContact OD2-N 3.12Å; D1056-G1059 PolarHBondContact OD2-N 2.96Å; D1056-S1060 WeakPolarHBondContact O-CB 3.48Å; D1056-S1060 PolarHBondContact O-N 2.77Å |
| 1057 | Q | 96.8 | Very high | 96.1 | Very high | 95 Ų | 95 | 55.1 Ų | 55.1 | 44% | 0.444 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -61.4 | -37.7 | -178.6 | -171.8 | 177.9 | 6.2 | 0 | 0 | 113.5 | R1061 F1094 | Q1057-R1061 WeakPolarHBondContact O-CD 3.43Å; Q1057-R1061 WeakPolarHBondContact O-CG 3.3Å; Q1057-F1094 HydrophobicContact CB-CD1 4.22Å; Q1057-F1094 HydrophobicContact CB-CD2 4.35Å; Q1057-F1094 HydrophobicContact CB-CE1 3.81Å; Q1057-F1094 HydrophobicContact CB-CE2 3.94Å; Q1057-F1094 HydrophobicContact CB-CG 4.49Å; Q1057-F1094 HydrophobicContact CB-CZ 3.65Å; Q1057-F1094 HydrophobicContact CG-CD1 4.35Å; Q1057-F1094 HydrophobicContact CG-CE1 3.76Å; Q1057-F1094 HydrophobicContact CG-CZ 3.98Å |
| 1058 | H | 93.8 | Very high | 96.3 | Very high | 80 Ų | 80 | 52.2 Ų | 52.2 | 37% | 0.37 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -88.9 | -42.3 | 178.8 | -54 | -94 | 0 | 0 | 0 | 110.5 | F1031 R1032 D1056 S1060 R1061 F1062 | F1031-H1058 HydrophobicContact CD1-CB 4.43Å; F1031-H1058 HydrophobicContact CE1-CB 3.87Å; R1032-H1058 PolarHBondContact NH1-CD2 2.9Å; D1056-H1058 VanDerWaalsContact C-N 3.34Å; D1056-H1058 PolarHBondContact O-N 3.43Å; D1056-H1058 IonicContact OD2-CD2 2.69Å; D1056-H1058 PolarHBondContact OD2-N 3.12Å; H1058-S1060 VanDerWaalsContact C-N 3.34Å; H1058-S1060 PolarHBondContact O-N 3.13Å; H1058-R1061 PolarHBondContact O-N 3.41Å; H1058-F1062 PolarHBondContact O-N 2.96Å |
| 1059 | G | 95.5 | Very high | 96.3 | Very high | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -59.1 | -42.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | F1053 D1056 F1062 I1063 | F1053-G1059 CarbonylContact O-C 3.47Å; F1053-G1059 VanDerWaalsContact O-CA 3.32Å; F1053-G1059 WeakPolarHBondContact O-CA 3.44Å; D1056-G1059 PolarHBondContact OD2-N 2.96Å; G1059-F1062 PolarHBondContact O-N 3.25Å; G1059-I1063 WeakPolarHBondContact O-CG1 3.26Å; G1059-I1063 PolarHBondContact O-N 3.47Å |
| 1060 | S | 97.8 | Very high | 96.2 | Very high | 1 Ų | 1 | 49.1 Ų | 49.1 | 1% | 0.007 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65.6 | -42.6 | 176.7 | 178.6 | 0 | 0 | 0 | 0 | 111.6 | F1053 A1054 D1056 H1058 F1062 I1063 Q1064 F1094 | F1053-S1060 PolarHBondContact O-N 2.82Å; A1054-S1060 WeakPolarHBondContact O-CB 3.36Å; D1056-S1060 WeakPolarHBondContact O-CB 3.48Å; D1056-S1060 PolarHBondContact O-N 2.77Å; H1058-S1060 VanDerWaalsContact C-N 3.34Å; H1058-S1060 PolarHBondContact O-N 3.13Å; S1060-F1062 VanDerWaalsContact C-N 3.34Å; S1060-F1062 PolarHBondContact O-N 3.39Å; S1060-I1063 PolarHBondContact O-N 3.23Å; S1060-Q1064 VanDerWaalsContact C-NE2 3.34Å; S1060-Q1064 WeakPolarHBondContact O-CB 3.49Å; S1060-Q1064 WeakPolarHBondContact O-CG 3.37Å; S1060-Q1064 PolarHBondContact O-N 3.41Å; S1060-Q1064 PolarHBondContact O-NE2 3.32Å; S1060-Q1064 VanDerWaalsContact O-NE2 3.13Å; S1060-Q1064 PolarHBondContact OG-NE2 2.76Å; S1060-F1094 PolarHBondContact OG-O 3.39Å |
| 1061 | R | 96 | Very high | 96.2 | Very high | 157 Ų | 157 | 52.9 Ų | 52.9 | 59% | 0.592 | 25% | 0.252 | S | S | * | . | H | α-helix | trans | -62 | -41.8 | 176.9 | -77.2 | 176.7 | 174.9 | -87.5 | 2.9 | 112 | Q1057 H1058 Q1064 Q1065 | Q1057-R1061 WeakPolarHBondContact O-CD 3.43Å; Q1057-R1061 WeakPolarHBondContact O-CG 3.3Å; H1058-R1061 PolarHBondContact O-N 3.41Å; R1061-Q1064 PolarHBondContact O-N 2.99Å; R1061-Q1065 WeakPolarHBondContact O-CG 3.5Å; R1061-Q1065 PolarHBondContact O-N 3.4Å |
| 1062 | F | 95 | Very high | 96.1 | Very high | 11 Ų | 11 | 55.4 Ų | 55.4 | 5% | 0.048 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62.3 | -48 | 175.2 | 173.4 | -89.1 | 0 | 0 | 0 | 112.1 | F1031 M1041 L1043 L1046 H1058 G1059 S1060 Q1064 Q1065 K1066 | F1031-F1062 HydrophobicContact CE1-CB 4.27Å; F1031-F1062 HydrophobicContact CE2-CB 4.4Å; F1031-F1062 AromaticContact CE2-CD2 3.67Å; F1031-F1062 HydrophobicContact CE2-CD2 3.67Å; F1031-F1062 HydrophobicContact CE2-CE2 4.02Å; F1031-F1062 HydrophobicContact CE2-CG 4Å; F1031-F1062 HydrophobicContact CZ-CB 3.64Å; F1031-F1062 AromaticContact CZ-CD2 3.68Å; F1031-F1062 HydrophobicContact CZ-CD2 3.68Å; F1031-F1062 HydrophobicContact CZ-CE2 4.48Å; F1031-F1062 AromaticContact CZ-CG 3.74Å; F1031-F1062 HydrophobicContact CZ-CG 3.74Å; M1041-F1062 HydrophobicContact CB-CE2 4.07Å; M1041-F1062 HydrophobicContact CB-CZ 3.75Å; M1041-F1062 HydrophobicContact CG-CZ 3.9Å; M1041-F1062 WeakPolarHBondContact O-CZ 3.34Å; M1041-F1062 HydrophobicContact SD-CE1 4.08Å; M1041-F1062 HydrophobicContact SD-CE2 4.49Å; M1041-F1062 HydrophobicContact SD-CZ 3.8Å; L1043-F1062 HydrophobicContact CD2-CE1 4.46Å; L1046-F1062 HydrophobicContact CD1-CD1 3.77Å; L1046-F1062 HydrophobicContact CD1-CE1 3.58Å; L1046-F1062 HydrophobicContact CG-CE1 4.25Å; H1058-F1062 PolarHBondContact O-N 2.96Å; G1059-F1062 PolarHBondContact O-N 3.25Å; S1060-F1062 VanDerWaalsContact C-N 3.34Å; S1060-F1062 PolarHBondContact O-N 3.39Å; F1062-Q1064 VanDerWaalsContact C-N 3.33Å; F1062-Q1064 PolarHBondContact O-N 2.96Å; F1062-Q1065 PolarHBondContact O-N 2.9Å; F1062-K1066 HydrophobicContact CD1-CG 4.33Å; F1062-K1066 HydrophobicContact CD2-CG 4.43Å; F1062-K1066 HydrophobicContact CE1-CG 4.06Å; F1062-K1066 HydrophobicContact CE2-CD 4.38Å; F1062-K1066 VanDerWaalsContact CE2-CE 3.48Å; F1062-K1066 HydrophobicContact CE2-CG 4.18Å; F1062-K1066 HydrophobicContact CZ-CD 4.26Å; F1062-K1066 HydrophobicContact CZ-CG 3.98Å; F1062-K1066 WeakPolarHBondContact O-CB 3.44Å; F1062-K1066 VanDerWaalsContact O-CG 3.29Å; F1062-K1066 WeakPolarHBondContact O-CG 3.39Å; F1062-K1066 PolarHBondContact O-N 2.87Å |
| 1063 | I | 96.6 | Very high | 96 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60 | -45 | 175.9 | -69.4 | 168.3 | 0 | 0 | 0 | 110.4 | L1043 L1046 M1050 F1053 A1054 G1059 S1060 Q1065 K1066 L1067 V1078 V1098 | L1043-I1063 HydrophobicContact CD2-CG1 4.31Å; L1046-I1063 HydrophobicContact CD1-CD1 4.33Å; L1046-I1063 HydrophobicContact CD1-CG1 3.99Å; M1050-I1063 HydrophobicContact CG-CD1 4.37Å; M1050-I1063 HydrophobicContact SD-CD1 3.7Å; M1050-I1063 HydrophobicContact SD-CG1 4.07Å; F1053-I1063 HydrophobicContact CB-CD1 3.67Å; A1054-I1063 HydrophobicContact CB-CD1 4.21Å; G1059-I1063 WeakPolarHBondContact O-CG1 3.26Å; G1059-I1063 PolarHBondContact O-N 3.47Å; S1060-I1063 PolarHBondContact O-N 3.23Å; I1063-Q1065 PolarHBondContact O-N 3.13Å; I1063-K1066 PolarHBondContact O-N 3.01Å; I1063-L1067 HydrophobicContact CG2-CD1 3.65Å; I1063-L1067 HydrophobicContact CG2-CG 4.1Å; I1063-L1067 WeakPolarHBondContact O-CB 3.45Å; I1063-L1067 WeakPolarHBondContact O-CG 3.32Å; I1063-L1067 PolarHBondContact O-N 3.02Å; I1063-V1078 HydrophobicContact CG2-CG1 4.39Å; I1063-V1098 HydrophobicContact CB-CG2 4.29Å; I1063-V1098 HydrophobicContact CG2-CB 4.5Å; I1063-V1098 HydrophobicContact CG2-CG1 3.75Å; I1063-V1098 HydrophobicContact CG2-CG2 3.95Å |
| 1064 | Q | 97.6 | Very high | 96 | Very high | 35 Ų | 35 | 58.5 Ų | 58.5 | 16% | 0.164 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -56.6 | -50.9 | 177.2 | -72.2 | 165.1 | 62.3 | 0 | 0 | 111.9 | S1060 R1061 F1062 L1067 E1068 Y1097 K1101 | S1060-Q1064 VanDerWaalsContact C-NE2 3.34Å; S1060-Q1064 WeakPolarHBondContact O-CB 3.49Å; S1060-Q1064 WeakPolarHBondContact O-CG 3.37Å; S1060-Q1064 PolarHBondContact O-N 3.41Å; S1060-Q1064 PolarHBondContact O-NE2 3.32Å; S1060-Q1064 VanDerWaalsContact O-NE2 3.13Å; S1060-Q1064 PolarHBondContact OG-NE2 2.76Å; R1061-Q1064 PolarHBondContact O-N 2.99Å; F1062-Q1064 VanDerWaalsContact C-N 3.33Å; F1062-Q1064 PolarHBondContact O-N 2.96Å; Q1064-L1067 PolarHBondContact O-N 3.07Å; Q1064-E1068 WeakPolarHBondContact O-CG 3.32Å; Q1064-Y1097 VanDerWaalsContact NE2-CB 3.32Å; Q1064-K1101 HydrophobicContact CB-CG 4.11Å; Q1064-K1101 HydrophobicContact CG-CG 3.96Å |
| 1065 | Q | 95.1 | Very high | 95.9 | Very high | 132 Ų | 132 | 59.8 Ų | 59.8 | 62% | 0.617 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -62.2 | -45.2 | 179.9 | -73.8 | 171.6 | -33.8 | 0 | 0 | 112.2 | R1061 F1062 I1063 L1067 E1068 | R1061-Q1065 WeakPolarHBondContact O-CG 3.5Å; R1061-Q1065 PolarHBondContact O-N 3.4Å; F1062-Q1065 PolarHBondContact O-N 2.9Å; I1063-Q1065 PolarHBondContact O-N 3.13Å; Q1065-L1067 VanDerWaalsContact C-N 3.35Å; Q1065-L1067 PolarHBondContact O-N 2.73Å; Q1065-E1068 PolarHBondContact O-N 2.89Å |
| 1066 | K | 94.5 | Very high | 95.9 | Very high | 50 Ų | 50 | 56.1 Ų | 56.1 | 22% | 0.217 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -68 | -34 | 179.7 | -63.9 | -82.9 | 171.4 | 163 | 0 | 111.5 | Q1039 M1041 L1043 F1062 I1063 E1068 T1069 A1070 | Q1039-K1066 PolarHBondContact O-NZ 3.29Å; M1041-K1066 WeakPolarHBondContact O-CE 3.18Å; M1041-K1066 PolarHBondContact O-NZ 3.07Å; L1043-K1066 HydrophobicContact CD1-CB 3.79Å; L1043-K1066 HydrophobicContact CD2-CB 3.88Å; L1043-K1066 HydrophobicContact CG-CB 3.74Å; L1043-K1066 HydrophobicContact CG-CG 4.45Å; F1062-K1066 HydrophobicContact CD1-CG 4.33Å; F1062-K1066 HydrophobicContact CD2-CG 4.43Å; F1062-K1066 HydrophobicContact CE1-CG 4.06Å; F1062-K1066 HydrophobicContact CE2-CD 4.38Å; F1062-K1066 VanDerWaalsContact CE2-CE 3.48Å; F1062-K1066 HydrophobicContact CE2-CG 4.18Å; F1062-K1066 HydrophobicContact CZ-CD 4.26Å; F1062-K1066 HydrophobicContact CZ-CG 3.98Å; F1062-K1066 WeakPolarHBondContact O-CB 3.44Å; F1062-K1066 VanDerWaalsContact O-CG 3.29Å; F1062-K1066 WeakPolarHBondContact O-CG 3.39Å; F1062-K1066 PolarHBondContact O-N 2.87Å; I1063-K1066 PolarHBondContact O-N 3.01Å; K1066-E1068 PolarHBondContact O-N 3.15Å; K1066-T1069 PolarHBondContact O-N 3.34Å; K1066-A1070 WeakPolarHBondContact O-CA 3.5Å; K1066-A1070 WeakPolarHBondContact O-CB 3.38Å; K1066-A1070 PolarHBondContact O-N 3.23Å |
| 1067 | L | 96.5 | Very high | 95.8 | Very high | 2 Ų | 2 | 57.4 Ų | 57.4 | 1% | 0.01 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.8 | -19.8 | 178.2 | -78.1 | 172.6 | 0 | 0 | 0 | 114.5 | I1063 Q1064 Q1065 K1075 V1078 V1098 K1101 F1102 | I1063-L1067 HydrophobicContact CG2-CD1 3.65Å; I1063-L1067 HydrophobicContact CG2-CG 4.1Å; I1063-L1067 WeakPolarHBondContact O-CB 3.45Å; I1063-L1067 WeakPolarHBondContact O-CG 3.32Å; I1063-L1067 PolarHBondContact O-N 3.02Å; Q1064-L1067 PolarHBondContact O-N 3.07Å; Q1065-L1067 VanDerWaalsContact C-N 3.35Å; Q1065-L1067 PolarHBondContact O-N 2.73Å; L1067-K1075 HydrophobicContact CD2-CG 3.95Å; L1067-K1075 WeakPolarHBondContact O-CE 3.44Å; L1067-K1075 PolarHBondContact O-NZ 3.42Å; L1067-V1078 HydrophobicContact CD2-CG1 4.34Å; L1067-V1098 HydrophobicContact CD1-CG1 4.19Å; L1067-K1101 HydrophobicContact CD1-CB 4.06Å; L1067-F1102 HydrophobicContact CD1-CD2 3.97Å; L1067-F1102 HydrophobicContact CD1-CE2 3.54Å; L1067-F1102 HydrophobicContact CD1-CZ 4.18Å; L1067-F1102 HydrophobicContact CD2-CE1 4.26Å; L1067-F1102 HydrophobicContact CD2-CE2 3.82Å; L1067-F1102 HydrophobicContact CD2-CZ 3.57Å; L1067-F1102 HydrophobicContact CG-CE2 4.36Å |
| 1068 | E | 95.6 | Very high | 95.8 | Very high | 90 Ų | 90 | 52.9 Ų | 52.9 | 42% | 0.421 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -72 | -38.5 | 176.9 | -52.3 | -167 | 148.7 | 0 | 0 | 111.2 | Q1064 Q1065 K1066 K1101 F1105 | Q1064-E1068 WeakPolarHBondContact O-CG 3.32Å; Q1065-E1068 PolarHBondContact O-N 2.89Å; K1066-E1068 PolarHBondContact O-N 3.15Å; E1068-K1101 HydrophobicContact CG-CD 4.39Å; E1068-K1101 WeakPolarHBondContact OE1-CE 3.37Å; E1068-K1101 IonicContact OE1-NZ 3.87Å; E1068-K1101 PolarHBondContact OE1-NZ 3.01Å; E1068-F1105 HydrophobicContact CB-CE2 4.33Å; E1068-F1105 HydrophobicContact CG-CD2 4.18Å; E1068-F1105 HydrophobicContact CG-CE2 3.7Å; E1068-F1105 HydrophobicContact CG-CZ 4.28Å |
| 1069 | T | 94.3 | Very high | 96 | Very high | 124 Ų | 124 | 49.2 Ų | 49.2 | 76% | 0.761 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -103.2 | -12.8 | -178.5 | 52.7 | 0 | 0 | 0 | 0 | 114.6 | K1066 | K1066-T1069 PolarHBondContact O-N 3.34Å |
| 1070 | A | 94 | Very high | 96.1 | Very high | 11 Ų | 11 | 54.5 Ų | 54.5 | 9% | 0.091 | 29% | 0.291 | C | S | . | . | trans | -59.2 | 141.2 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | L1043 K1066 E1074 K1075 | L1043-A1070 HydrophobicContact CD1-CB 3.7Å; K1066-A1070 WeakPolarHBondContact O-CA 3.5Å; K1066-A1070 WeakPolarHBondContact O-CB 3.38Å; K1066-A1070 PolarHBondContact O-N 3.23Å; A1070-E1074 HydrophobicContact CB-CB 4.03Å; A1070-K1075 HydrophobicContact CB-CG 3.98Å; A1070-K1075 WeakPolarHBondContact O-CE 3.17Å | ||
| 1071 | T | 95.8 | Very high | 96.1 | Very high | 79 Ų | 79 | 56 Ų | 56 | 49% | 0.485 | 30% | 0.298 | S | S | . | . | trans | -63.2 | 159.4 | 171.8 | 63.3 | 0 | 0 | 0 | 0 | 111.8 | A1073 E1074 K1075 | T1071-A1073 PolarHBondContact O-N 3.48Å; T1071-E1074 WeakPolarHBondContact CB-OE2 3.44Å; T1071-E1074 WeakPolarHBondContact CG2-OE2 3.14Å; T1071-E1074 PolarHBondContact N-OE2 3.1Å; T1071-E1074 PolarHBondContact O-N 2.97Å; T1071-E1074 WeakPolarHBondContact OG1-CG 3.34Å; T1071-E1074 PolarHBondContact OG1-N 3.34Å; T1071-E1074 PolarHBondContact OG1-OE2 3.34Å; T1071-K1075 WeakPolarHBondContact O-CB 3.11Å; T1071-K1075 WeakPolarHBondContact O-CG 3.5Å; T1071-K1075 PolarHBondContact O-N 3.44Å | ||
| 1072 | T | 96 | Very high | 96.2 | Very high | 87 Ų | 87 | 48.6 Ų | 48.6 | 53% | 0.534 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -56 | -32.6 | 174.1 | -48.4 | 0 | 0 | 0 | 0 | 112.5 | N1076 T1107 | T1072-N1076 WeakPolarHBondContact O-CB 3.27Å; T1072-N1076 PolarHBondContact O-N 3.25Å; T1072-N1076 PolarHBondContact O-ND2 2.86Å; T1072-T1107 HydrophobicContact CG2-CG2 3.77Å |
| 1073 | A | 95.6 | Very high | 96.3 | Very high | 73 Ų | 73 | 49.8 Ų | 49.8 | 60% | 0.603 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -69.1 | -46.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | T1071 N1076 S1077 | T1071-A1073 PolarHBondContact O-N 3.48Å; A1073-N1076 PolarHBondContact O-N 3.28Å; A1073-S1077 PolarHBondContact O-N 3Å |
| 1074 | E | 95.7 | Very high | 96.3 | Very high | 50 Ų | 50 | 53.6 Ų | 53.6 | 23% | 0.234 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63.2 | -44.9 | 174.2 | -71.1 | 163.1 | 112 | 0 | 0 | 111.2 | L1043 A1070 T1071 N1076 S1077 V1078 | L1043-E1074 HydrophobicContact CD1-CB 4.23Å; A1070-E1074 HydrophobicContact CB-CB 4.03Å; T1071-E1074 WeakPolarHBondContact CB-OE2 3.44Å; T1071-E1074 WeakPolarHBondContact CG2-OE2 3.14Å; T1071-E1074 PolarHBondContact N-OE2 3.1Å; T1071-E1074 PolarHBondContact O-N 2.97Å; T1071-E1074 WeakPolarHBondContact OG1-CG 3.34Å; T1071-E1074 PolarHBondContact OG1-N 3.34Å; T1071-E1074 PolarHBondContact OG1-OE2 3.34Å; E1074-N1076 VanDerWaalsContact C-N 3.31Å; E1074-N1076 PolarHBondContact O-N 2.69Å; E1074-S1077 WeakPolarHBondContact O-CB 3.27Å; E1074-S1077 PolarHBondContact O-N 2.76Å; E1074-S1077 VanDerWaalsContact O-N 3.1Å; E1074-V1078 WeakPolarHBondContact O-CG2 3.34Å; E1074-V1078 PolarHBondContact O-N 3.35Å |
| 1075 | K | 96.9 | Very high | 96.4 | Very high | 27 Ų | 27 | 55.9 Ų | 55.9 | 12% | 0.117 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -55.8 | -44.9 | 174.6 | -73.8 | 174.9 | 173.9 | 177.2 | 0 | 111.6 | L1067 A1070 T1071 V1078 F1079 F1102 F1105 | L1067-K1075 HydrophobicContact CD2-CG 3.95Å; L1067-K1075 WeakPolarHBondContact O-CE 3.44Å; L1067-K1075 PolarHBondContact O-NZ 3.42Å; A1070-K1075 HydrophobicContact CB-CG 3.98Å; A1070-K1075 WeakPolarHBondContact O-CE 3.17Å; T1071-K1075 WeakPolarHBondContact O-CB 3.11Å; T1071-K1075 WeakPolarHBondContact O-CG 3.5Å; T1071-K1075 PolarHBondContact O-N 3.44Å; K1075-V1078 PolarHBondContact O-N 2.97Å; K1075-F1079 WeakPolarHBondContact O-CB 3.16Å; K1075-F1079 PolarHBondContact O-N 2.94Å; K1075-F1102 HydrophobicContact CB-CE1 4.31Å; K1075-F1105 PolarHBondContact NZ-O 3.22Å |
| 1076 | N | 96.9 | Very high | 96.5 | Very high | 63 Ų | 63 | 49.6 Ų | 49.6 | 34% | 0.337 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -62.5 | -41.1 | 175.2 | -77.4 | -13.2 | 0 | 0 | 0 | 112.5 | T1072 A1073 E1074 F1079 N1080 Q1110 | T1072-N1076 WeakPolarHBondContact O-CB 3.27Å; T1072-N1076 PolarHBondContact O-N 3.25Å; T1072-N1076 PolarHBondContact O-ND2 2.86Å; A1073-N1076 PolarHBondContact O-N 3.28Å; E1074-N1076 VanDerWaalsContact C-N 3.31Å; E1074-N1076 PolarHBondContact O-N 2.69Å; N1076-F1079 PolarHBondContact O-N 2.79Å; N1076-N1080 PolarHBondContact O-N 3.13Å; N1076-N1080 PolarHBondContact O-ND2 3.12Å; N1076-Q1110 PolarHBondContact OD1-NE2 2.89Å |
| 1077 | S | 95.5 | Very high | 96.6 | Very high | 38 Ų | 38 | 48.2 Ų | 48.2 | 27% | 0.266 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -60.9 | -50.7 | 176.8 | -163.4 | 0 | 0 | 0 | 0 | 111.4 | A1073 E1074 F1079 N1080 | A1073-S1077 PolarHBondContact O-N 3Å; E1074-S1077 WeakPolarHBondContact O-CB 3.27Å; E1074-S1077 PolarHBondContact O-N 2.76Å; E1074-S1077 VanDerWaalsContact O-N 3.1Å; S1077-F1079 VanDerWaalsContact C-N 3.33Å; S1077-F1079 PolarHBondContact O-N 3.18Å; S1077-N1080 PolarHBondContact O-N 3.23Å |
| 1078 | V | 97.2 | Very high | 96.7 | Very high | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -58.3 | -45.7 | 175.8 | 175.5 | 0 | 0 | 0 | 0 | 110.9 | L1043 M1050 I1063 L1067 E1074 K1075 N1080 E1081 I1082 F1102 | L1043-V1078 HydrophobicContact CB-CG2 4.04Å; L1043-V1078 HydrophobicContact CD1-CG2 3.95Å; L1043-V1078 HydrophobicContact CD2-CG2 3.92Å; L1043-V1078 HydrophobicContact CG-CG2 4.19Å; M1050-V1078 HydrophobicContact CE-CB 4.36Å; M1050-V1078 HydrophobicContact CE-CG2 3.72Å; M1050-V1078 HydrophobicContact CG-CB 4.41Å; M1050-V1078 HydrophobicContact CG-CG1 3.85Å; M1050-V1078 HydrophobicContact SD-CB 4.23Å; M1050-V1078 HydrophobicContact SD-CG1 3.84Å; M1050-V1078 HydrophobicContact SD-CG2 3.82Å; I1063-V1078 HydrophobicContact CG2-CG1 4.39Å; L1067-V1078 HydrophobicContact CD2-CG1 4.34Å; E1074-V1078 WeakPolarHBondContact O-CG2 3.34Å; E1074-V1078 PolarHBondContact O-N 3.35Å; K1075-V1078 PolarHBondContact O-N 2.97Å; V1078-N1080 PolarHBondContact O-N 3.22Å; V1078-E1081 PolarHBondContact O-N 3.11Å; V1078-I1082 HydrophobicContact CG1-CD1 4.5Å; V1078-I1082 WeakPolarHBondContact O-CG1 3.41Å; V1078-I1082 PolarHBondContact O-N 3.42Å; V1078-F1102 HydrophobicContact CB-CE2 4.41Å; V1078-F1102 HydrophobicContact CB-CZ 3.94Å; V1078-F1102 HydrophobicContact CG1-CE2 3.63Å; V1078-F1102 HydrophobicContact CG1-CZ 3.68Å |
| 1079 | F | 98 | Very high | 96.8 | Very high | 4 Ų | 4 | 51.3 Ų | 51.3 | 2% | 0.018 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -61.4 | -43.3 | -175.4 | -167.9 | -107.5 | 0 | 0 | 0 | 112.7 | K1075 N1076 S1077 E1081 I1082 L1083 F1102 Q1110 L1113 L1114 | K1075-F1079 WeakPolarHBondContact O-CB 3.16Å; K1075-F1079 PolarHBondContact O-N 2.94Å; N1076-F1079 PolarHBondContact O-N 2.79Å; S1077-F1079 VanDerWaalsContact C-N 3.33Å; S1077-F1079 PolarHBondContact O-N 3.18Å; F1079-E1081 VanDerWaalsContact C-N 3.28Å; F1079-E1081 PolarHBondContact O-N 3.26Å; F1079-I1082 WeakPolarHBondContact O-CG1 3.21Å; F1079-I1082 PolarHBondContact O-N 3.37Å; F1079-L1083 HydrophobicContact CD1-CB 4.42Å; F1079-L1083 HydrophobicContact CD1-CD2 4.38Å; F1079-L1083 HydrophobicContact CE1-CB 4.26Å; F1079-L1083 HydrophobicContact CE1-CD1 4.1Å; F1079-L1083 HydrophobicContact CE1-CD2 3.78Å; F1079-L1083 HydrophobicContact CE1-CG 4.26Å; F1079-L1083 HydrophobicContact CZ-CD1 3.86Å; F1079-L1083 HydrophobicContact CZ-CD2 4.39Å; F1079-L1083 HydrophobicContact CZ-CG 4.48Å; F1079-L1083 VanDerWaalsContact O-CB 3.25Å; F1079-L1083 WeakPolarHBondContact O-CB 3.48Å; F1079-L1083 PolarHBondContact O-N 2.85Å; F1079-F1102 HydrophobicContact CB-CE1 3.78Å; F1079-F1102 HydrophobicContact CB-CZ 3.98Å; F1079-F1102 AromaticContact CD2-CD1 3.51Å; F1079-F1102 HydrophobicContact CD2-CD1 3.51Å; F1079-F1102 HydrophobicContact CD2-CD2 4.43Å; F1079-F1102 AromaticContact CD2-CE1 3.63Å; F1079-F1102 HydrophobicContact CD2-CE1 3.63Å; F1079-F1102 AromaticContact CD2-CG 3.93Å; F1079-F1102 HydrophobicContact CD2-CG 3.93Å; F1079-F1102 HydrophobicContact CD2-CZ 4.16Å; F1079-F1102 HydrophobicContact CE2-CD1 4.12Å; F1079-F1102 HydrophobicContact CE2-CG 4.35Å; F1079-F1102 HydrophobicContact CG-CD1 4.4Å; F1079-F1102 HydrophobicContact CG-CE1 4.14Å; F1079-Q1110 HydrophobicContact CB-CG 4.48Å; F1079-Q1110 HydrophobicContact CD1-CB 4.43Å; F1079-Q1110 HydrophobicContact CD1-CG 3.78Å; F1079-Q1110 HydrophobicContact CD2-CB 4.12Å; F1079-Q1110 HydrophobicContact CD2-CG 3.98Å; F1079-Q1110 HydrophobicContact CE1-CB 4.09Å; F1079-Q1110 HydrophobicContact CE1-CG 3.86Å; F1079-Q1110 HydrophobicContact CE2-CB 3.75Å; F1079-Q1110 HydrophobicContact CE2-CG 4.07Å; F1079-Q1110 HydrophobicContact CG-CB 4.43Å; F1079-Q1110 HydrophobicContact CG-CG 3.82Å; F1079-Q1110 HydrophobicContact CZ-CB 3.73Å; F1079-Q1110 HydrophobicContact CZ-CG 4Å; F1079-Q1110 VanDerWaalsContact CZ-O 3.29Å; F1079-Q1110 WeakPolarHBondContact CZ-O 3.45Å; F1079-L1113 HydrophobicContact CE1-CB 4.14Å; F1079-L1113 HydrophobicContact CE1-CD1 3.89Å; F1079-L1113 HydrophobicContact CZ-CB 4.03Å; F1079-L1114 HydrophobicContact CE2-CD1 3.96Å; F1079-L1114 HydrophobicContact CE2-CD2 4.1Å; F1079-L1114 HydrophobicContact CE2-CG 3.74Å; F1079-L1114 HydrophobicContact CZ-CD2 4.41Å; F1079-L1114 HydrophobicContact CZ-CG 4Å |
| 1080 | N | 97.4 | Very high | 97 | Very high | 110 Ų | 110 | 45.4 Ų | 45.4 | 59% | 0.588 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -61.9 | -34.6 | -178.2 | -71.2 | -18.7 | 0 | 0 | 0 | 112.7 | N1076 S1077 V1078 P1084 | N1076-N1080 PolarHBondContact O-N 3.13Å; N1076-N1080 PolarHBondContact O-ND2 3.12Å; S1077-N1080 PolarHBondContact O-N 3.23Å; V1078-N1080 PolarHBondContact O-N 3.22Å; N1080-P1084 WeakPolarHBondContact O-CD 3.44Å |
| 1081 | E | 97.6 | Very high | 97.3 | Very high | 34 Ų | 34 | 46.8 Ų | 46.8 | 16% | 0.159 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -76.7 | -37.3 | 178.2 | -64.7 | -179.4 | -130.8 | 0 | 0 | 112.3 | D1048 M1050 V1051 V1078 F1079 H1085 | D1048-E1081 WeakPolarHBondContact CA-OE2 3.44Å; D1048-E1081 PolarHBondContact N-OE2 3.05Å; M1050-E1081 HydrophobicContact CB-CB 3.88Å; M1050-E1081 HydrophobicContact CB-CG 4.44Å; M1050-E1081 WeakPolarHBondContact CB-OE2 3.3Å; M1050-E1081 HydrophobicContact CG-CB 4.44Å; V1051-E1081 VanDerWaalsContact CG2-O 3.3Å; V1051-E1081 WeakPolarHBondContact CG2-O 3.49Å; V1078-E1081 PolarHBondContact O-N 3.11Å; F1079-E1081 VanDerWaalsContact C-N 3.28Å; F1079-E1081 PolarHBondContact O-N 3.26Å; E1081-H1085 PolarHBondContact O-ND1 2.96Å |
| 1082 | I | 97.8 | Very high | 97.4 | Very high | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -86 | -26.4 | -177.4 | 70.6 | 172.6 | 0 | 0 | 0 | 114.3 | M1050 V1051 V1078 F1079 H1085 S1086 L1089 V1098 I1099 F1102 | M1050-I1082 HydrophobicContact CG-CG2 3.96Å; V1051-I1082 HydrophobicContact CG2-CG2 4.39Å; V1078-I1082 HydrophobicContact CG1-CD1 4.5Å; V1078-I1082 WeakPolarHBondContact O-CG1 3.41Å; V1078-I1082 PolarHBondContact O-N 3.42Å; F1079-I1082 WeakPolarHBondContact O-CG1 3.21Å; F1079-I1082 PolarHBondContact O-N 3.37Å; I1082-H1085 CarbonylContact O-C 3.48Å; I1082-H1085 WeakPolarHBondContact O-CA 3.39Å; I1082-H1085 PolarHBondContact O-N 3.42Å; I1082-S1086 PolarHBondContact O-N 3.19Å; I1082-L1089 HydrophobicContact CB-CD1 3.65Å; I1082-L1089 HydrophobicContact CG2-CD1 3.96Å; I1082-V1098 HydrophobicContact CD1-CG1 3.92Å; I1082-I1099 HydrophobicContact CD1-CD1 4.14Å; I1082-F1102 HydrophobicContact CD1-CD2 3.54Å; I1082-F1102 HydrophobicContact CD1-CE2 3.41Å; I1082-F1102 VanDerWaalsContact CD1-CE2 3.41Å; I1082-F1102 HydrophobicContact CD1-CZ 4.32Å |
| 1083 | L | 98.1 | Very high | 97.5 | Very high | 36 Ų | 36 | 42.5 Ų | 42.5 | 19% | 0.188 | 24% | 0.238 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.8 | -41.3 | -174.4 | 178.3 | 66.8 | 0 | 0 | 0 | 114.3 | F1079 H1085 S1086 L1113 L1114 R1117 | F1079-L1083 HydrophobicContact CD1-CB 4.42Å; F1079-L1083 HydrophobicContact CD1-CD2 4.38Å; F1079-L1083 HydrophobicContact CE1-CB 4.26Å; F1079-L1083 HydrophobicContact CE1-CD1 4.1Å; F1079-L1083 HydrophobicContact CE1-CD2 3.78Å; F1079-L1083 HydrophobicContact CE1-CG 4.26Å; F1079-L1083 HydrophobicContact CZ-CD1 3.86Å; F1079-L1083 HydrophobicContact CZ-CD2 4.39Å; F1079-L1083 HydrophobicContact CZ-CG 4.48Å; F1079-L1083 VanDerWaalsContact O-CB 3.25Å; F1079-L1083 WeakPolarHBondContact O-CB 3.48Å; F1079-L1083 PolarHBondContact O-N 2.85Å; L1083-H1085 PolarHBondContact O-N 3.26Å; L1083-S1086 WeakPolarHBondContact O-CB 3.47Å; L1083-S1086 PolarHBondContact O-N 2.98Å; L1083-S1086 PolarHBondContact O-OG 3.49Å; L1083-S1086 VanDerWaalsContact O-OG 3.08Å; L1083-L1113 HydrophobicContact CD1-CB 4.38Å; L1083-L1113 HydrophobicContact CD2-CD1 4.4Å; L1083-L1114 HydrophobicContact CD1-CD2 4.26Å; L1083-R1117 HydrophobicContact CD1-CG 3.83Å; L1083-R1117 PolarHBondContact O-NE 3.07Å |
| 1084 | P | 97.4 | Very high | 97.6 | Very high | 81 Ų | 81 | 41.8 Ų | 41.8 | 53% | 0.526 | 22% | 0.222 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -59.5 | -39.8 | 172.9 | -23.3 | 34.4 | 0 | 0 | 0 | 111.5 | N1080 R1117 | N1080-P1084 WeakPolarHBondContact O-CD 3.44Å; P1084-R1117 PolarHBondContact O-NH2 3.29Å |
| 1085 | H | 97.7 | Very high | 97.8 | Very high | 82 Ų | 82 | 39.4 Ų | 39.4 | 38% | 0.38 | 21% | 0.211 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | -2.1 | -174.6 | -58 | 101.3 | 0 | 0 | 0 | 114.3 | V1051 E1081 I1082 L1083 G1087 K1088 L1089 | V1051-H1085 HydrophobicContact CG1-CB 3.98Å; V1051-H1085 HydrophobicContact CG2-CB 4.31Å; V1051-H1085 WeakPolarHBondContact CG2-ND1 3.43Å; E1081-H1085 PolarHBondContact O-ND1 2.96Å; I1082-H1085 CarbonylContact O-C 3.48Å; I1082-H1085 WeakPolarHBondContact O-CA 3.39Å; I1082-H1085 PolarHBondContact O-N 3.42Å; L1083-H1085 PolarHBondContact O-N 3.26Å; H1085-G1087 PolarHBondContact O-N 3Å; H1085-K1088 WeakPolarHBondContact O-CB 3.5Å; H1085-K1088 PolarHBondContact O-N 2.82Å; H1085-L1089 HydrophobicContact CB-CD1 4.3Å; H1085-L1089 PolarHBondContact O-N 3.05Å |
| 1086 | S | 98 | Very high | 97.8 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -53.2 | -47.5 | -165.1 | 61.5 | 0 | 0 | 0 | 0 | 114 | I1082 L1083 K1088 L1089 M1090 R1117 | I1082-S1086 PolarHBondContact O-N 3.19Å; L1083-S1086 WeakPolarHBondContact O-CB 3.47Å; L1083-S1086 PolarHBondContact O-N 2.98Å; L1083-S1086 PolarHBondContact O-OG 3.49Å; L1083-S1086 VanDerWaalsContact O-OG 3.08Å; S1086-K1088 VanDerWaalsContact C-N 3.26Å; S1086-K1088 PolarHBondContact O-N 3Å; S1086-L1089 CarbonylContact O-C 3.36Å; S1086-L1089 WeakPolarHBondContact O-CA 3.24Å; S1086-L1089 PolarHBondContact O-N 3.46Å; S1086-M1090 WeakPolarHBondContact O-CG 3.33Å; S1086-M1090 PolarHBondContact O-N 3.45Å; S1086-R1117 PolarHBondContact OG-NE 3.19Å |
| 1087 | G | 97.4 | Very high | 97.9 | Very high | 21 Ų | 21 | 40.2 Ų | 40.2 | 22% | 0.216 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -60.4 | -29.9 | 179 | 0 | 0 | 0 | 0 | 0 | 114.8 | H1085 T1091 | H1085-G1087 PolarHBondContact O-N 3Å; G1087-T1091 PolarHBondContact O-OG1 3.47Å |
| 1088 | K | 97.9 | Very high | 98.1 | Very high | 157 Ų | 157 | 38.4 Ų | 38.4 | 68% | 0.683 | 20% | 0.197 | S | C | * | . | H | α-helix | trans | -73.5 | -42.2 | 171.4 | -67.4 | -177.8 | 178.1 | 178 | 0 | 110.9 | H1085 S1086 T1091 D1092 | H1085-K1088 WeakPolarHBondContact O-CB 3.5Å; H1085-K1088 PolarHBondContact O-N 2.82Å; S1086-K1088 VanDerWaalsContact C-N 3.26Å; S1086-K1088 PolarHBondContact O-N 3Å; K1088-T1091 PolarHBondContact O-N 3.44Å; K1088-T1091 PolarHBondContact O-OG1 3.24Å; K1088-T1091 VanDerWaalsContact O-OG1 3.12Å; K1088-D1092 WeakPolarHBondContact O-CB 3.34Å; K1088-D1092 PolarHBondContact O-N 3.37Å; K1088-D1092 VanDerWaalsContact O-N 3.12Å |
| 1089 | L | 98.6 | Very high | 98.1 | Very high | 1 Ų | 1 | 38.4 Ų | 38.4 | 1% | 0.005 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -66.1 | -39.1 | 178 | -64.7 | 171.6 | 0 | 0 | 0 | 111.8 | A1054 R1055 I1082 H1085 S1086 T1091 D1092 G1095 N1096 I1099 | A1054-L1089 HydrophobicContact CB-CD2 3.98Å; R1055-L1089 HydrophobicContact CG-CD2 3.48Å; R1055-L1089 VanDerWaalsContact CG-CD2 3.48Å; I1082-L1089 HydrophobicContact CB-CD1 3.65Å; I1082-L1089 HydrophobicContact CG2-CD1 3.96Å; H1085-L1089 HydrophobicContact CB-CD1 4.3Å; H1085-L1089 PolarHBondContact O-N 3.05Å; S1086-L1089 CarbonylContact O-C 3.36Å; S1086-L1089 WeakPolarHBondContact O-CA 3.24Å; S1086-L1089 PolarHBondContact O-N 3.46Å; L1089-T1091 PolarHBondContact O-N 3.27Å; L1089-T1091 VanDerWaalsContact O-N 3.13Å; L1089-D1092 PolarHBondContact O-N 2.84Å; L1089-D1092 VanDerWaalsContact O-N 3.12Å; L1089-G1095 CarbonylContact O-C 3.06Å; L1089-N1096 VanDerWaalsContact O-CA 3.27Å; L1089-N1096 WeakPolarHBondContact O-CA 3.21Å; L1089-N1096 PolarHBondContact O-N 2.72Å; L1089-I1099 HydrophobicContact CB-CD1 4Å; L1089-I1099 HydrophobicContact CB-CG1 3.82Å; L1089-I1099 HydrophobicContact CD1-CD1 4.25Å |
| 1090 | M | 98.6 | Very high | 98.2 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -56.7 | -27.7 | 175 | -71.2 | 171 | 172.9 | 0 | 0 | 113.4 | S1086 I1099 L1114 L1118 F1125 Y1130 G1131 V1134 | S1086-M1090 WeakPolarHBondContact O-CG 3.33Å; S1086-M1090 PolarHBondContact O-N 3.45Å; M1090-I1099 HydrophobicContact CE-CG2 3.83Å; M1090-I1099 HydrophobicContact CG-CB 4.36Å; M1090-I1099 HydrophobicContact CG-CG1 4.11Å; M1090-I1099 HydrophobicContact CG-CG2 3.9Å; M1090-L1114 HydrophobicContact CE-CD2 4.2Å; M1090-L1118 HydrophobicContact CE-CD2 3.58Å; M1090-L1118 HydrophobicContact CE-CG 4.17Å; M1090-L1118 HydrophobicContact SD-CD2 3.59Å; M1090-L1118 VanDerWaalsContact SD-CD2 3.59Å; M1090-F1125 HydrophobicContact CB-CD1 4.25Å; M1090-F1125 HydrophobicContact CB-CE1 4.02Å; M1090-F1125 HydrophobicContact SD-CD2 4.48Å; M1090-F1125 HydrophobicContact SD-CE1 4.23Å; M1090-F1125 HydrophobicContact SD-CE2 3.96Å; M1090-F1125 HydrophobicContact SD-CZ 3.84Å; M1090-Y1130 CarbonylContact O-C 3.07Å; M1090-G1131 VanDerWaalsContact O-CA 3.31Å; M1090-G1131 WeakPolarHBondContact O-CA 3.04Å; M1090-G1131 PolarHBondContact O-N 3.34Å; M1090-V1134 HydrophobicContact CB-CG2 4.21Å; M1090-V1134 HydrophobicContact CE-CG1 4.36Å; M1090-V1134 HydrophobicContact CG-CG1 4.09Å; M1090-V1134 HydrophobicContact CG-CG2 4.23Å |
| 1091 | T | 98.4 | Very high | 98.2 | Very high | 40 Ų | 40 | 36 Ų | 36 | 25% | 0.245 | 18% | 0.181 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -107.4 | 1.9 | -177.8 | 49.9 | 0 | 0 | 0 | 0 | 113.4 | G1087 K1088 L1089 F1125 Q1128 Y1130 | G1087-T1091 PolarHBondContact O-OG1 3.47Å; K1088-T1091 PolarHBondContact O-N 3.44Å; K1088-T1091 PolarHBondContact O-OG1 3.24Å; K1088-T1091 VanDerWaalsContact O-OG1 3.12Å; L1089-T1091 PolarHBondContact O-N 3.27Å; L1089-T1091 VanDerWaalsContact O-N 3.13Å; T1091-F1125 HydrophobicContact CG2-CD1 3.73Å; T1091-F1125 HydrophobicContact CG2-CE1 3.76Å; T1091-Q1128 HydrophobicContact CG2-CG 3.96Å; T1091-Q1128 PolarHBondContact O-NE2 2.86Å; T1091-Q1128 VanDerWaalsContact O-NE2 3.09Å; T1091-Y1130 WeakPolarHBondContact O-CD2 3.38Å |
| 1092 | D | 98.6 | Very high | 98.3 | Very high | 19 Ų | 19 | 34.4 Ų | 34.4 | 10% | 0.102 | 17% | 0.174 | C | C | . | . | S | Bend | trans | -91.3 | 142.5 | 179 | -173.6 | 104.6 | 0 | 0 | 0 | 111.5 | R1055 K1088 L1089 F1094 G1095 N1096 | R1055-D1092 IonicContact CZ-OD1 3.12Å; R1055-D1092 IonicContact NE-OD1 2.71Å; R1055-D1092 PolarHBondContact NE-OD1 3.09Å; R1055-D1092 IonicContact NH2-OD1 2.78Å; R1055-D1092 PolarHBondContact NH2-OD1 2.78Å; K1088-D1092 WeakPolarHBondContact O-CB 3.34Å; K1088-D1092 PolarHBondContact O-N 3.37Å; K1088-D1092 VanDerWaalsContact O-N 3.12Å; L1089-D1092 PolarHBondContact O-N 2.84Å; L1089-D1092 VanDerWaalsContact O-N 3.12Å; D1092-F1094 PolarHBondContact O-N 3.41Å; D1092-F1094 PolarHBondContact OD2-N 3.33Å; D1092-G1095 PolarHBondContact OD2-N 3.15Å; D1092-N1096 WeakPolarHBondContact O-CB 3.3Å; D1092-N1096 PolarHBondContact O-N 2.79Å; D1092-N1096 PolarHBondContact O-ND2 3.39Å |
| 1093 | V | 98.2 | Very high | 98.3 | Very high | 56 Ų | 56 | 34.4 Ų | 34.4 | 34% | 0.339 | 17% | 0.174 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -60.2 | -28.9 | -176.3 | 59.8 | 0 | 0 | 0 | 0 | 113.7 | N1096 Y1097 Y1130 | V1093-N1096 PolarHBondContact O-ND2 2.84Å; V1093-N1096 VanDerWaalsContact O-ND2 3.12Å; V1093-Y1097 VanDerWaalsContact O-CE2 3.32Å; V1093-Y1097 WeakPolarHBondContact O-CE2 3.27Å; V1093-Y1130 HydrophobicContact CB-CE1 4.05Å; V1093-Y1130 HydrophobicContact CB-CE2 3.97Å; V1093-Y1130 WeakPolarHBondContact CB-OH 3.43Å; V1093-Y1130 HydrophobicContact CG2-CE1 3.87Å; V1093-Y1130 WeakPolarHBondContact CG2-OH 3.44Å |
| 1094 | F | 98.4 | Very high | 98.3 | Very high | 59 Ų | 59 | 34.9 Ų | 34.9 | 26% | 0.259 | 18% | 0.175 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -112.2 | -31.4 | 176.4 | -52.8 | -53.7 | 0 | 0 | 0 | 112.3 | A1054 R1055 Q1057 S1060 D1092 N1096 | A1054-F1094 CarbonylContact O-C 3.41Å; A1054-F1094 VanDerWaalsContact O-C 3.25Å; R1055-F1094 WeakPolarHBondContact O-CD2 3.23Å; Q1057-F1094 HydrophobicContact CB-CD1 4.22Å; Q1057-F1094 HydrophobicContact CB-CD2 4.35Å; Q1057-F1094 HydrophobicContact CB-CE1 3.81Å; Q1057-F1094 HydrophobicContact CB-CE2 3.94Å; Q1057-F1094 HydrophobicContact CB-CG 4.49Å; Q1057-F1094 HydrophobicContact CB-CZ 3.65Å; Q1057-F1094 HydrophobicContact CG-CD1 4.35Å; Q1057-F1094 HydrophobicContact CG-CE1 3.76Å; Q1057-F1094 HydrophobicContact CG-CZ 3.98Å; S1060-F1094 PolarHBondContact OG-O 3.39Å; D1092-F1094 PolarHBondContact O-N 3.41Å; D1092-F1094 PolarHBondContact OD2-N 3.33Å; F1094-N1096 VanDerWaalsContact C-N 3.3Å; F1094-N1096 PolarHBondContact O-N 2.71Å |
| 1095 | G | 98.5 | Very high | 98.2 | Very high | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -64.3 | -30.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | A1054 L1089 D1092 Y1097 V1098 I1099 | A1054-G1095 WeakPolarHBondContact O-CA 3.28Å; A1054-G1095 PolarHBondContact O-N 3.37Å; L1089-G1095 CarbonylContact O-C 3.06Å; D1092-G1095 PolarHBondContact OD2-N 3.15Å; G1095-Y1097 PolarHBondContact O-N 3.32Å; G1095-V1098 PolarHBondContact O-N 3.34Å; G1095-V1098 VanDerWaalsContact O-N 3.15Å; G1095-I1099 PolarHBondContact O-N 2.92Å |
| 1096 | N | 98.7 | Very high | 98.2 | Very high | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -63.7 | -30.9 | -174.7 | 74.7 | 88.6 | 0 | 0 | 0 | 112.4 | L1089 D1092 V1093 F1094 I1099 Q1100 V1134 | L1089-N1096 VanDerWaalsContact O-CA 3.27Å; L1089-N1096 WeakPolarHBondContact O-CA 3.21Å; L1089-N1096 PolarHBondContact O-N 2.72Å; D1092-N1096 WeakPolarHBondContact O-CB 3.3Å; D1092-N1096 PolarHBondContact O-N 2.79Å; D1092-N1096 PolarHBondContact O-ND2 3.39Å; V1093-N1096 PolarHBondContact O-ND2 2.84Å; V1093-N1096 VanDerWaalsContact O-ND2 3.12Å; F1094-N1096 VanDerWaalsContact C-N 3.3Å; F1094-N1096 PolarHBondContact O-N 2.71Å; N1096-I1099 PolarHBondContact O-N 3.39Å; N1096-Q1100 WeakPolarHBondContact O-CG 3.45Å; N1096-Q1100 PolarHBondContact O-N 2.74Å; N1096-Q1100 PolarHBondContact O-NE2 2.73Å; N1096-Q1100 PolarHBondContact OD1-NE2 3.12Å; N1096-V1134 HydrophobicContact CB-CG2 4.06Å |
| 1097 | Y | 98.7 | Very high | 98.1 | Very high | 107 Ų | 107 | 32.4 Ų | 32.4 | 42% | 0.42 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -70.8 | -34.1 | 178.5 | -60.3 | -75.8 | 0 | 0 | 0 | 112.5 | Q1064 V1093 G1095 Q1100 K1101 | Q1064-Y1097 VanDerWaalsContact NE2-CB 3.32Å; V1093-Y1097 VanDerWaalsContact O-CE2 3.32Å; V1093-Y1097 WeakPolarHBondContact O-CE2 3.27Å; G1095-Y1097 PolarHBondContact O-N 3.32Å; Y1097-Q1100 PolarHBondContact O-N 2.75Å; Y1097-K1101 WeakPolarHBondContact O-CG 3.2Å; Y1097-K1101 PolarHBondContact O-N 2.81Å |
| 1098 | V | 98.6 | Very high | 98 | Very high | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -65.2 | -43.9 | 174.4 | 179.8 | 0 | 0 | 0 | 0 | 110.1 | A1054 I1063 L1067 I1082 G1095 Q1100 K1101 F1102 | A1054-V1098 HydrophobicContact CB-CB 4.49Å; A1054-V1098 HydrophobicContact CB-CG2 3.97Å; I1063-V1098 HydrophobicContact CB-CG2 4.29Å; I1063-V1098 HydrophobicContact CG2-CB 4.5Å; I1063-V1098 HydrophobicContact CG2-CG1 3.75Å; I1063-V1098 HydrophobicContact CG2-CG2 3.95Å; L1067-V1098 HydrophobicContact CD1-CG1 4.19Å; I1082-V1098 HydrophobicContact CD1-CG1 3.92Å; G1095-V1098 PolarHBondContact O-N 3.34Å; G1095-V1098 VanDerWaalsContact O-N 3.15Å; V1098-Q1100 VanDerWaalsContact C-N 3.34Å; V1098-Q1100 PolarHBondContact O-N 2.86Å; V1098-K1101 PolarHBondContact O-N 2.96Å; V1098-F1102 HydrophobicContact CG1-CD2 4.33Å; V1098-F1102 HydrophobicContact CG1-CE2 4.29Å; V1098-F1102 WeakPolarHBondContact O-CD2 3.36Å; V1098-F1102 PolarHBondContact O-N 2.7Å; V1098-F1102 VanDerWaalsContact O-N 3.14Å |
| 1099 | I | 98.7 | Very high | 97.9 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.7 | -39.9 | 175.4 | -54.4 | -63.8 | 0 | 0 | 0 | 111.2 | I1082 L1089 M1090 G1095 N1096 K1101 F1102 F1103 L1114 V1134 | I1082-I1099 HydrophobicContact CD1-CD1 4.14Å; L1089-I1099 HydrophobicContact CB-CD1 4Å; L1089-I1099 HydrophobicContact CB-CG1 3.82Å; L1089-I1099 HydrophobicContact CD1-CD1 4.25Å; M1090-I1099 HydrophobicContact CE-CG2 3.83Å; M1090-I1099 HydrophobicContact CG-CB 4.36Å; M1090-I1099 HydrophobicContact CG-CG1 4.11Å; M1090-I1099 HydrophobicContact CG-CG2 3.9Å; G1095-I1099 PolarHBondContact O-N 2.92Å; N1096-I1099 PolarHBondContact O-N 3.39Å; I1099-K1101 PolarHBondContact O-N 3.22Å; I1099-F1102 PolarHBondContact O-N 3.37Å; I1099-F1103 HydrophobicContact CG2-CD2 4.11Å; I1099-F1103 HydrophobicContact CG2-CE2 3.97Å; I1099-F1103 WeakPolarHBondContact O-CD2 3.33Å; I1099-F1103 PolarHBondContact O-N 3.1Å; I1099-L1114 HydrophobicContact CD1-CD2 4.45Å; I1099-L1114 HydrophobicContact CG2-CD1 4.17Å; I1099-L1114 HydrophobicContact CG2-CD2 4.28Å; I1099-V1134 HydrophobicContact CG2-CG1 3.73Å |
| 1100 | Q | 98.7 | Very high | 97.9 | Very high | 31 Ų | 31 | 37.1 Ų | 37.1 | 15% | 0.145 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -60.7 | -41.7 | 173.2 | -75.4 | 178.7 | 84.4 | 0 | 0 | 112.3 | N1096 Y1097 V1098 F1102 F1103 E1104 V1134 K1137 | N1096-Q1100 WeakPolarHBondContact O-CG 3.45Å; N1096-Q1100 PolarHBondContact O-N 2.74Å; N1096-Q1100 PolarHBondContact O-NE2 2.73Å; N1096-Q1100 PolarHBondContact OD1-NE2 3.12Å; Y1097-Q1100 PolarHBondContact O-N 2.75Å; V1098-Q1100 VanDerWaalsContact C-N 3.34Å; V1098-Q1100 PolarHBondContact O-N 2.86Å; Q1100-F1102 VanDerWaalsContact C-N 3.28Å; Q1100-F1102 PolarHBondContact O-N 3.21Å; Q1100-F1103 PolarHBondContact O-N 3.23Å; Q1100-F1103 VanDerWaalsContact O-N 3.16Å; Q1100-E1104 WeakPolarHBondContact O-CB 3.3Å; Q1100-E1104 PolarHBondContact O-N 2.93Å; Q1100-V1134 HydrophobicContact CG-CG2 4.3Å; Q1100-K1137 HydrophobicContact CB-CB 4.33Å; Q1100-K1137 HydrophobicContact CB-CG 4.05Å; Q1100-K1137 HydrophobicContact CG-CB 3.88Å; Q1100-K1137 HydrophobicContact CG-CG 4.17Å |
| 1101 | K | 98.5 | Very high | 97.8 | Very high | 31 Ų | 31 | 38.8 Ų | 38.8 | 14% | 0.135 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -65.1 | -27.3 | 175.9 | -73.6 | -72.6 | 163.7 | -164 | 0 | 113.5 | Q1064 L1067 E1068 Y1097 V1098 I1099 E1104 F1105 | Q1064-K1101 HydrophobicContact CB-CG 4.11Å; Q1064-K1101 HydrophobicContact CG-CG 3.96Å; L1067-K1101 HydrophobicContact CD1-CB 4.06Å; E1068-K1101 HydrophobicContact CG-CD 4.39Å; E1068-K1101 WeakPolarHBondContact OE1-CE 3.37Å; E1068-K1101 IonicContact OE1-NZ 3.87Å; E1068-K1101 PolarHBondContact OE1-NZ 3.01Å; Y1097-K1101 WeakPolarHBondContact O-CG 3.2Å; Y1097-K1101 PolarHBondContact O-N 2.81Å; V1098-K1101 PolarHBondContact O-N 2.96Å; I1099-K1101 PolarHBondContact O-N 3.22Å; K1101-E1104 WeakPolarHBondContact CD-OE2 3.32Å; K1101-E1104 WeakPolarHBondContact CE-OE2 3.33Å; K1101-E1104 IonicContact NZ-OE1 2.74Å; K1101-E1104 IonicContact NZ-OE2 2.66Å; K1101-E1104 PolarHBondContact NZ-OE2 2.77Å; K1101-E1104 PolarHBondContact O-N 2.9Å; K1101-F1105 HydrophobicContact CD-CD2 3.83Å; K1101-F1105 HydrophobicContact CD-CE2 3.72Å; K1101-F1105 PolarHBondContact O-N 3.25Å |
| 1102 | F | 98.5 | Very high | 97.7 | Very high | 2 Ų | 2 | 40.1 Ų | 40.1 | 1% | 0.009 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -75.6 | -36.1 | 169.6 | -86.3 | -78.2 | 0 | 0 | 0 | 113.6 | L1067 K1075 V1078 F1079 I1082 V1098 I1099 Q1100 E1104 G1106 L1114 | L1067-F1102 HydrophobicContact CD1-CD2 3.97Å; L1067-F1102 HydrophobicContact CD1-CE2 3.54Å; L1067-F1102 HydrophobicContact CD1-CZ 4.18Å; L1067-F1102 HydrophobicContact CD2-CE1 4.26Å; L1067-F1102 HydrophobicContact CD2-CE2 3.82Å; L1067-F1102 HydrophobicContact CD2-CZ 3.57Å; L1067-F1102 HydrophobicContact CG-CE2 4.36Å; K1075-F1102 HydrophobicContact CB-CE1 4.31Å; V1078-F1102 HydrophobicContact CB-CE2 4.41Å; V1078-F1102 HydrophobicContact CB-CZ 3.94Å; V1078-F1102 HydrophobicContact CG1-CE2 3.63Å; V1078-F1102 HydrophobicContact CG1-CZ 3.68Å; F1079-F1102 HydrophobicContact CB-CE1 3.78Å; F1079-F1102 HydrophobicContact CB-CZ 3.98Å; F1079-F1102 AromaticContact CD2-CD1 3.51Å; F1079-F1102 HydrophobicContact CD2-CD1 3.51Å; F1079-F1102 HydrophobicContact CD2-CD2 4.43Å; F1079-F1102 AromaticContact CD2-CE1 3.63Å; F1079-F1102 HydrophobicContact CD2-CE1 3.63Å; F1079-F1102 AromaticContact CD2-CG 3.93Å; F1079-F1102 HydrophobicContact CD2-CG 3.93Å; F1079-F1102 HydrophobicContact CD2-CZ 4.16Å; F1079-F1102 HydrophobicContact CE2-CD1 4.12Å; F1079-F1102 HydrophobicContact CE2-CG 4.35Å; F1079-F1102 HydrophobicContact CG-CD1 4.4Å; F1079-F1102 HydrophobicContact CG-CE1 4.14Å; I1082-F1102 HydrophobicContact CD1-CD2 3.54Å; I1082-F1102 HydrophobicContact CD1-CE2 3.41Å; I1082-F1102 VanDerWaalsContact CD1-CE2 3.41Å; I1082-F1102 HydrophobicContact CD1-CZ 4.32Å; V1098-F1102 HydrophobicContact CG1-CD2 4.33Å; V1098-F1102 HydrophobicContact CG1-CE2 4.29Å; V1098-F1102 WeakPolarHBondContact O-CD2 3.36Å; V1098-F1102 PolarHBondContact O-N 2.7Å; V1098-F1102 VanDerWaalsContact O-N 3.14Å; I1099-F1102 PolarHBondContact O-N 3.37Å; Q1100-F1102 VanDerWaalsContact C-N 3.28Å; Q1100-F1102 PolarHBondContact O-N 3.21Å; F1102-E1104 VanDerWaalsContact C-N 3.26Å; F1102-E1104 PolarHBondContact O-N 3.41Å; F1102-G1106 VanDerWaalsContact O-CA 3.25Å; F1102-G1106 WeakPolarHBondContact O-CA 3.36Å; F1102-G1106 PolarHBondContact O-N 3.17Å; F1102-L1114 HydrophobicContact CB-CD1 3.66Å |
| 1103 | F | 98.2 | Very high | 97.6 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -63.7 | -33.3 | 168 | -81.2 | -64.8 | 0 | 0 | 0 | 112 | I1099 Q1100 K1111 L1114 L1118 V1134 K1137 A1138 S1141 V1142 | I1099-F1103 HydrophobicContact CG2-CD2 4.11Å; I1099-F1103 HydrophobicContact CG2-CE2 3.97Å; I1099-F1103 WeakPolarHBondContact O-CD2 3.33Å; I1099-F1103 PolarHBondContact O-N 3.1Å; Q1100-F1103 PolarHBondContact O-N 3.23Å; Q1100-F1103 VanDerWaalsContact O-N 3.16Å; F1103-K1111 WeakPolarHBondContact O-CD 3.38Å; F1103-K1111 WeakPolarHBondContact O-CE 3.29Å; F1103-K1111 PolarHBondContact O-NZ 3Å; F1103-L1114 HydrophobicContact CD2-CD1 4.17Å; F1103-L1114 HydrophobicContact CE1-CB 3.81Å; F1103-L1114 HydrophobicContact CE2-CB 3.94Å; F1103-L1114 HydrophobicContact CE2-CD1 4.06Å; F1103-L1114 HydrophobicContact CG-CD1 4.48Å; F1103-L1114 HydrophobicContact CZ-CB 3.41Å; F1103-L1114 VanDerWaalsContact CZ-CB 3.41Å; F1103-L1114 HydrophobicContact CZ-CD1 4.26Å; F1103-L1114 HydrophobicContact CZ-CG 4.46Å; F1103-L1118 HydrophobicContact CE2-CD1 4.44Å; F1103-L1118 HydrophobicContact CZ-CD1 3.86Å; F1103-V1134 HydrophobicContact CD2-CG1 3.94Å; F1103-V1134 HydrophobicContact CE2-CG1 3.58Å; F1103-K1137 HydrophobicContact CB-CG 3.92Å; F1103-A1138 HydrophobicContact CD1-CB 3.94Å; F1103-A1138 HydrophobicContact CD2-CB 4.24Å; F1103-A1138 HydrophobicContact CE1-CB 3.7Å; F1103-A1138 HydrophobicContact CE2-CB 4.01Å; F1103-A1138 HydrophobicContact CG-CB 4.2Å; F1103-A1138 HydrophobicContact CZ-CB 3.72Å; F1103-S1141 WeakPolarHBondContact O-CB 3.47Å; F1103-S1141 PolarHBondContact O-OG 3.26Å; F1103-V1142 HydrophobicContact CD1-CG1 3.82Å; F1103-V1142 HydrophobicContact CE1-CG1 3.75Å |
| 1104 | E | 97.5 | Very high | 97.6 | Very high | 45 Ų | 45 | 39 Ų | 39 | 21% | 0.21 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -73.8 | -65.1 | 176.4 | -162.8 | 173.2 | -166.6 | 0 | 0 | 112 | Q255 Q1100 K1101 F1102 K1111 | Q255-E1104 PolarHBondContact NE2-OE1 2.97Å; Q1100-E1104 WeakPolarHBondContact O-CB 3.3Å; Q1100-E1104 PolarHBondContact O-N 2.93Å; K1101-E1104 WeakPolarHBondContact CD-OE2 3.32Å; K1101-E1104 WeakPolarHBondContact CE-OE2 3.33Å; K1101-E1104 IonicContact NZ-OE1 2.74Å; K1101-E1104 IonicContact NZ-OE2 2.66Å; K1101-E1104 PolarHBondContact NZ-OE2 2.77Å; K1101-E1104 PolarHBondContact O-N 2.9Å; F1102-E1104 VanDerWaalsContact C-N 3.26Å; F1102-E1104 PolarHBondContact O-N 3.41Å; E1104-K1111 PolarHBondContact O-NZ 3.2Å |
| 1105 | F | 96.7 | Very high | 97.5 | Very high | 61 Ų | 61 | 37 Ų | 37 | 27% | 0.268 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -110.3 | 5.5 | -167.5 | -56.9 | -69.8 | 0 | 0 | 0 | 116 | E1068 K1075 K1101 | E1068-F1105 HydrophobicContact CB-CE2 4.33Å; E1068-F1105 HydrophobicContact CG-CD2 4.18Å; E1068-F1105 HydrophobicContact CG-CE2 3.7Å; E1068-F1105 HydrophobicContact CG-CZ 4.28Å; K1075-F1105 PolarHBondContact NZ-O 3.22Å; K1101-F1105 HydrophobicContact CD-CD2 3.83Å; K1101-F1105 HydrophobicContact CD-CE2 3.72Å; K1101-F1105 PolarHBondContact O-N 3.25Å |
| 1106 | G | 96.9 | Very high | 97.3 | Very high | 11 Ų | 11 | 42.7 Ų | 42.7 | 11% | 0.113 | 20% | 0.2 | C | C | . | . | S | Bend | trans | -74.5 | 165.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | F1102 K1111 | F1102-G1106 VanDerWaalsContact O-CA 3.25Å; F1102-G1106 WeakPolarHBondContact O-CA 3.36Å; F1102-G1106 PolarHBondContact O-N 3.17Å; G1106-K1111 WeakPolarHBondContact O-CE 3.31Å |
| 1107 | T | 96.2 | Very high | 97.2 | Very high | 39 Ų | 39 | 47 Ų | 47 | 24% | 0.239 | 22% | 0.217 | C | C | . | . | trans | -68.2 | 162.5 | 174.4 | 74.4 | 0 | 0 | 0 | 0 | 111.4 | T1072 E1109 Q1110 K1111 | T1072-T1107 HydrophobicContact CG2-CG2 3.77Å; T1107-E1109 VanDerWaalsContact C-N 3.27Å; T1107-E1109 PolarHBondContact O-N 3.46Å; T1107-Q1110 PolarHBondContact O-N 3.27Å; T1107-Q1110 VanDerWaalsContact O-N 3.11Å; T1107-Q1110 VanDerWaalsContact OG1-CG 3.31Å; T1107-Q1110 WeakPolarHBondContact OG1-CG 3.4Å; T1107-Q1110 PolarHBondContact OG1-N 3.12Å; T1107-Q1110 VanDerWaalsContact OG1-N 3.15Å; T1107-K1111 WeakPolarHBondContact O-CG 3.46Å; T1107-K1111 PolarHBondContact O-N 3.12Å | ||
| 1108 | K | 95.3 | Very high | 97.1 | Very high | 148 Ų | 148 | 42 Ų | 42 | 64% | 0.643 | 20% | 0.197 | S | C | * | . | H | α-helix | trans | -51.6 | -47.8 | 174.7 | 178.7 | 179 | 167 | -179.8 | 0 | 111.6 | Q1110 K1111 E1112 | K1108-Q1110 PolarHBondContact O-N 2.95Å; K1108-K1111 PolarHBondContact O-N 2.95Å; K1108-E1112 WeakPolarHBondContact CE-OE1 3.09Å; K1108-E1112 IonicContact NZ-OE1 3.4Å; K1108-E1112 WeakPolarHBondContact O-CG 3.36Å; K1108-E1112 PolarHBondContact O-N 3.09Å |
| 1109 | E | 96.1 | Very high | 96.9 | Very high | 127 Ų | 127 | 48.1 Ų | 48.1 | 59% | 0.593 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -59.5 | -44.1 | 176.4 | 179.9 | -178.4 | -163.7 | 0 | 0 | 112.6 | T1107 K1111 E1112 L1113 | T1107-E1109 VanDerWaalsContact C-N 3.27Å; T1107-E1109 PolarHBondContact O-N 3.46Å; E1109-K1111 VanDerWaalsContact C-N 3.34Å; E1109-K1111 PolarHBondContact O-N 2.97Å; E1109-E1112 PolarHBondContact O-N 3.14Å; E1109-L1113 HydrophobicContact CG-CD1 4.05Å; E1109-L1113 WeakPolarHBondContact O-CB 3.42Å; E1109-L1113 VanDerWaalsContact O-CG 3.32Å; E1109-L1113 WeakPolarHBondContact O-CG 3.32Å; E1109-L1113 PolarHBondContact O-N 3.01Å |
| 1110 | Q | 97.5 | Very high | 96.8 | Very high | 3 Ų | 3 | 51.1 Ų | 51.1 | 1% | 0.014 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62.4 | -40.1 | 176.1 | -70.4 | 170.8 | -5.6 | 0 | 0 | 112 | N1076 F1079 T1107 K1108 L1114 | N1076-Q1110 PolarHBondContact OD1-NE2 2.89Å; F1079-Q1110 HydrophobicContact CB-CG 4.48Å; F1079-Q1110 HydrophobicContact CD1-CB 4.43Å; F1079-Q1110 HydrophobicContact CD1-CG 3.78Å; F1079-Q1110 HydrophobicContact CD2-CB 4.12Å; F1079-Q1110 HydrophobicContact CD2-CG 3.98Å; F1079-Q1110 HydrophobicContact CE1-CB 4.09Å; F1079-Q1110 HydrophobicContact CE1-CG 3.86Å; F1079-Q1110 HydrophobicContact CE2-CB 3.75Å; F1079-Q1110 HydrophobicContact CE2-CG 4.07Å; F1079-Q1110 HydrophobicContact CG-CB 4.43Å; F1079-Q1110 HydrophobicContact CG-CG 3.82Å; F1079-Q1110 HydrophobicContact CZ-CB 3.73Å; F1079-Q1110 HydrophobicContact CZ-CG 4Å; F1079-Q1110 VanDerWaalsContact CZ-O 3.29Å; F1079-Q1110 WeakPolarHBondContact CZ-O 3.45Å; T1107-Q1110 PolarHBondContact O-N 3.27Å; T1107-Q1110 VanDerWaalsContact O-N 3.11Å; T1107-Q1110 VanDerWaalsContact OG1-CG 3.31Å; T1107-Q1110 WeakPolarHBondContact OG1-CG 3.4Å; T1107-Q1110 PolarHBondContact OG1-N 3.12Å; T1107-Q1110 VanDerWaalsContact OG1-N 3.15Å; K1108-Q1110 PolarHBondContact O-N 2.95Å; Q1110-L1114 WeakPolarHBondContact O-CG 3.49Å; Q1110-L1114 PolarHBondContact O-N 2.96Å |
| 1111 | K | 97.5 | Very high | 96.8 | Very high | 35 Ų | 35 | 53.9 Ų | 53.9 | 15% | 0.152 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -66.2 | -42.3 | 175.9 | -62.8 | -176.4 | -165.1 | -154.3 | 0 | 111.3 | F1103 E1104 G1106 T1107 K1108 E1109 L1114 S1115 | F1103-K1111 WeakPolarHBondContact O-CD 3.38Å; F1103-K1111 WeakPolarHBondContact O-CE 3.29Å; F1103-K1111 PolarHBondContact O-NZ 3Å; E1104-K1111 PolarHBondContact O-NZ 3.2Å; G1106-K1111 WeakPolarHBondContact O-CE 3.31Å; T1107-K1111 WeakPolarHBondContact O-CG 3.46Å; T1107-K1111 PolarHBondContact O-N 3.12Å; K1108-K1111 PolarHBondContact O-N 2.95Å; E1109-K1111 VanDerWaalsContact C-N 3.34Å; E1109-K1111 PolarHBondContact O-N 2.97Å; K1111-L1114 PolarHBondContact O-N 3.36Å; K1111-S1115 PolarHBondContact O-N 2.96Å; K1111-S1115 PolarHBondContact O-OG 3.38Å |
| 1112 | E | 95.2 | Very high | 96.8 | Very high | 68 Ų | 68 | 52.4 Ų | 52.4 | 32% | 0.318 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -64.1 | -43.7 | 176.4 | -73.6 | 168 | 165.7 | 0 | 0 | 112.1 | K1108 E1109 L1114 S1115 Q1116 | K1108-E1112 WeakPolarHBondContact CE-OE1 3.09Å; K1108-E1112 IonicContact NZ-OE1 3.4Å; K1108-E1112 WeakPolarHBondContact O-CG 3.36Å; K1108-E1112 PolarHBondContact O-N 3.09Å; E1109-E1112 PolarHBondContact O-N 3.14Å; E1112-L1114 PolarHBondContact O-N 2.85Å; E1112-S1115 WeakPolarHBondContact O-CB 3.34Å; E1112-S1115 PolarHBondContact O-N 3.39Å; E1112-Q1116 WeakPolarHBondContact O-CG 3.43Å; E1112-Q1116 PolarHBondContact O-N 3.49Å |
| 1113 | L | 96.7 | Very high | 96.7 | Very high | 53 Ų | 53 | 53.1 Ų | 53.1 | 28% | 0.277 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -63.2 | -39.5 | 174.2 | -72.9 | 169.3 | 0 | 0 | 0 | 112 | F1079 L1083 E1109 Q1116 R1117 | F1079-L1113 HydrophobicContact CE1-CB 4.14Å; F1079-L1113 HydrophobicContact CE1-CD1 3.89Å; F1079-L1113 HydrophobicContact CZ-CB 4.03Å; L1083-L1113 HydrophobicContact CD1-CB 4.38Å; L1083-L1113 HydrophobicContact CD2-CD1 4.4Å; E1109-L1113 HydrophobicContact CG-CD1 4.05Å; E1109-L1113 WeakPolarHBondContact O-CB 3.42Å; E1109-L1113 VanDerWaalsContact O-CG 3.32Å; E1109-L1113 WeakPolarHBondContact O-CG 3.32Å; E1109-L1113 PolarHBondContact O-N 3.01Å; L1113-Q1116 PolarHBondContact O-N 3.36Å; L1113-R1117 WeakPolarHBondContact O-CG 3.46Å; L1113-R1117 PolarHBondContact O-N 3.21Å; L1113-R1117 VanDerWaalsContact O-N 3.17Å |
| 1114 | L | 97.7 | Very high | 96.7 | Very high | 0 Ų | 0 | 58.7 Ų | 58.7 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -67 | -38.7 | 172.6 | -72.9 | 176 | 0 | 0 | 0 | 112.5 | F1079 L1083 M1090 I1099 F1102 F1103 Q1110 K1111 E1112 Q1116 R1117 L1118 | F1079-L1114 HydrophobicContact CE2-CD1 3.96Å; F1079-L1114 HydrophobicContact CE2-CD2 4.1Å; F1079-L1114 HydrophobicContact CE2-CG 3.74Å; F1079-L1114 HydrophobicContact CZ-CD2 4.41Å; F1079-L1114 HydrophobicContact CZ-CG 4Å; L1083-L1114 HydrophobicContact CD1-CD2 4.26Å; M1090-L1114 HydrophobicContact CE-CD2 4.2Å; I1099-L1114 HydrophobicContact CD1-CD2 4.45Å; I1099-L1114 HydrophobicContact CG2-CD1 4.17Å; I1099-L1114 HydrophobicContact CG2-CD2 4.28Å; F1102-L1114 HydrophobicContact CB-CD1 3.66Å; F1103-L1114 HydrophobicContact CD2-CD1 4.17Å; F1103-L1114 HydrophobicContact CE1-CB 3.81Å; F1103-L1114 HydrophobicContact CE2-CB 3.94Å; F1103-L1114 HydrophobicContact CE2-CD1 4.06Å; F1103-L1114 HydrophobicContact CG-CD1 4.48Å; F1103-L1114 HydrophobicContact CZ-CB 3.41Å; F1103-L1114 VanDerWaalsContact CZ-CB 3.41Å; F1103-L1114 HydrophobicContact CZ-CD1 4.26Å; F1103-L1114 HydrophobicContact CZ-CG 4.46Å; Q1110-L1114 WeakPolarHBondContact O-CG 3.49Å; Q1110-L1114 PolarHBondContact O-N 2.96Å; K1111-L1114 PolarHBondContact O-N 3.36Å; E1112-L1114 PolarHBondContact O-N 2.85Å; L1114-Q1116 VanDerWaalsContact C-N 3.33Å; L1114-Q1116 PolarHBondContact O-N 3.37Å; L1114-R1117 WeakPolarHBondContact O-CB 3.29Å; L1114-R1117 PolarHBondContact O-N 3.43Å; L1114-L1118 PolarHBondContact O-N 2.81Å; L1114-L1118 VanDerWaalsContact O-N 3.14Å |
| 1115 | S | 96.5 | Very high | 96.8 | Very high | 17 Ų | 17 | 57 Ų | 57 | 12% | 0.119 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -60.3 | -40.3 | 172.8 | -74.5 | 0 | 0 | 0 | 0 | 112.3 | K1111 E1112 R1117 L1118 Q1119 | K1111-S1115 PolarHBondContact O-N 2.96Å; K1111-S1115 PolarHBondContact O-OG 3.38Å; E1112-S1115 WeakPolarHBondContact O-CB 3.34Å; E1112-S1115 PolarHBondContact O-N 3.39Å; S1115-R1117 VanDerWaalsContact C-N 3.26Å; S1115-R1117 PolarHBondContact O-N 3.16Å; S1115-L1118 WeakPolarHBondContact O-CB 3.4Å; S1115-L1118 PolarHBondContact O-N 3.08Å; S1115-L1118 VanDerWaalsContact O-N 3.08Å; S1115-Q1119 PolarHBondContact O-N 3.07Å |
| 1116 | Q | 95 | Very high | 96.8 | Very high | 118 Ų | 118 | 54 Ų | 54 | 55% | 0.551 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -61.8 | -33.4 | 172.5 | -68.1 | 167.4 | 28.1 | 0 | 0 | 112.2 | E1112 L1113 L1114 L1118 Q1119 | E1112-Q1116 WeakPolarHBondContact O-CG 3.43Å; E1112-Q1116 PolarHBondContact O-N 3.49Å; L1113-Q1116 PolarHBondContact O-N 3.36Å; L1114-Q1116 VanDerWaalsContact C-N 3.33Å; L1114-Q1116 PolarHBondContact O-N 3.37Å; Q1116-L1118 VanDerWaalsContact C-N 3.3Å; Q1116-L1118 PolarHBondContact O-N 3.37Å; Q1116-Q1119 WeakPolarHBondContact O-CB 3.38Å; Q1116-Q1119 PolarHBondContact O-N 3.22Å |
| 1117 | R | 96 | Very high | 96.9 | Very high | 92 Ų | 92 | 54.8 Ų | 54.8 | 35% | 0.347 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -74.3 | -17.1 | 174.9 | -60.2 | -70.4 | -75.2 | 112.1 | -9.3 | 113.5 | L1083 P1084 S1086 L1113 L1114 S1115 | L1083-R1117 HydrophobicContact CD1-CG 3.83Å; L1083-R1117 PolarHBondContact O-NE 3.07Å; P1084-R1117 PolarHBondContact O-NH2 3.29Å; S1086-R1117 PolarHBondContact OG-NE 3.19Å; L1113-R1117 WeakPolarHBondContact O-CG 3.46Å; L1113-R1117 PolarHBondContact O-N 3.21Å; L1113-R1117 VanDerWaalsContact O-N 3.17Å; L1114-R1117 WeakPolarHBondContact O-CB 3.29Å; L1114-R1117 PolarHBondContact O-N 3.43Å; S1115-R1117 VanDerWaalsContact C-N 3.26Å; S1115-R1117 PolarHBondContact O-N 3.16Å |
| 1118 | L | 96.6 | Very high | 97 | Very high | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -82.3 | -25.1 | 171.3 | -63.7 | 177.7 | 0 | 0 | 0 | 112.9 | M1090 F1103 L1114 S1115 Q1116 G1120 H1121 V1122 F1125 I1135 A1138 I1150 | M1090-L1118 HydrophobicContact CE-CD2 3.58Å; M1090-L1118 HydrophobicContact CE-CG 4.17Å; M1090-L1118 HydrophobicContact SD-CD2 3.59Å; M1090-L1118 VanDerWaalsContact SD-CD2 3.59Å; F1103-L1118 HydrophobicContact CE2-CD1 4.44Å; F1103-L1118 HydrophobicContact CZ-CD1 3.86Å; L1114-L1118 PolarHBondContact O-N 2.81Å; L1114-L1118 VanDerWaalsContact O-N 3.14Å; S1115-L1118 WeakPolarHBondContact O-CB 3.4Å; S1115-L1118 PolarHBondContact O-N 3.08Å; S1115-L1118 VanDerWaalsContact O-N 3.08Å; Q1116-L1118 VanDerWaalsContact C-N 3.3Å; Q1116-L1118 PolarHBondContact O-N 3.37Å; L1118-G1120 PolarHBondContact O-N 2.77Å; L1118-H1121 CarbonylContact O-C 3.47Å; L1118-H1121 WeakPolarHBondContact O-CA 3.47Å; L1118-H1121 PolarHBondContact O-N 2.82Å; L1118-V1122 HydrophobicContact CB-CG2 4.33Å; L1118-V1122 PolarHBondContact O-N 3.28Å; L1118-F1125 HydrophobicContact CD2-CD2 3.62Å; L1118-F1125 HydrophobicContact CD2-CE2 3.87Å; L1118-F1125 HydrophobicContact CD2-CG 4.45Å; L1118-I1135 HydrophobicContact CD1-CD1 3.82Å; L1118-I1135 HydrophobicContact CD2-CD1 3.7Å; L1118-I1135 HydrophobicContact CG-CD1 4.26Å; L1118-A1138 HydrophobicContact CD1-CB 4.04Å; L1118-I1150 HydrophobicContact CD1-CD1 4.1Å |
| 1119 | Q | 94.9 | Very high | 97.2 | Very high | 130 Ų | 130 | 53.3 Ų | 53.3 | 61% | 0.607 | 27% | 0.269 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.3 | 134.7 | -172.8 | -167.3 | 177.6 | 3.9 | 0 | 0 | 112.1 | S1115 Q1116 H1121 E1153 | S1115-Q1119 PolarHBondContact O-N 3.07Å; Q1116-Q1119 WeakPolarHBondContact O-CB 3.38Å; Q1116-Q1119 PolarHBondContact O-N 3.22Å; Q1119-H1121 PolarHBondContact O-N 2.83Å; Q1119-H1121 PolarHBondContact O-ND1 2.99Å; Q1119-E1153 WeakPolarHBondContact CA-OE1 3.24Å; Q1119-E1153 WeakPolarHBondContact CG-OE1 3.45Å |
| 1120 | G | 96.6 | Very high | 97.3 | Very high | 63 Ų | 63 | 50 Ų | 50 | 65% | 0.649 | 25% | 0.251 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76.8 | -7.2 | -173.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | L1118 E1153 | L1118-G1120 PolarHBondContact O-N 2.77Å; G1120-E1153 WeakPolarHBondContact CA-OE2 3.23Å; G1120-E1153 VanDerWaalsContact N-CD 3.26Å; G1120-E1153 PolarHBondContact N-OE1 3.35Å; G1120-E1153 PolarHBondContact N-OE2 3.02Å; G1120-E1153 VanDerWaalsContact N-OE2 3.09Å |
| 1121 | H | 97.7 | Very high | 97.3 | Very high | 88 Ų | 88 | 49.9 Ų | 49.9 | 41% | 0.407 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -125.8 | 3 | -171.9 | -56 | 81.3 | 0 | 0 | 0 | 112.6 | L1118 Q1119 V1123 E1124 F1125 E1153 | L1118-H1121 CarbonylContact O-C 3.47Å; L1118-H1121 WeakPolarHBondContact O-CA 3.47Å; L1118-H1121 PolarHBondContact O-N 2.82Å; Q1119-H1121 PolarHBondContact O-N 2.83Å; Q1119-H1121 PolarHBondContact O-ND1 2.99Å; H1121-V1123 PolarHBondContact O-N 3.15Å; H1121-V1123 VanDerWaalsContact O-N 3.16Å; H1121-E1124 IonicContact CD2-OE2 3.8Å; H1121-E1124 WeakPolarHBondContact O-CB 3.47Å; H1121-E1124 PolarHBondContact O-N 3.07Å; H1121-E1124 VanDerWaalsContact O-N 3.07Å; H1121-F1125 HydrophobicContact CB-CD2 3.87Å; H1121-F1125 HydrophobicContact CB-CE2 3.49Å; H1121-F1125 VanDerWaalsContact CB-CE2 3.49Å; H1121-F1125 HydrophobicContact CB-CZ 4.23Å; H1121-F1125 VanDerWaalsContact O-CD2 3.32Å; H1121-F1125 WeakPolarHBondContact O-CD2 3.08Å; H1121-F1125 PolarHBondContact O-N 2.78Å; H1121-F1125 VanDerWaalsContact O-N 3.08Å; H1121-E1153 PolarHBondContact N-OE2 2.74Å |
| 1122 | V | 98.3 | Very high | 97.4 | Very high | 1 Ų | 1 | 48.2 Ų | 48.2 | 1% | 0.006 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -56.7 | -39.4 | -173.4 | 175.4 | 0 | 0 | 0 | 0 | 111.7 | L1118 A1126 I1135 I1150 E1153 L1154 | L1118-V1122 HydrophobicContact CB-CG2 4.33Å; L1118-V1122 PolarHBondContact O-N 3.28Å; V1122-A1126 WeakPolarHBondContact O-CB 3.44Å; V1122-A1126 PolarHBondContact O-N 3.42Å; V1122-I1135 HydrophobicContact CG1-CD1 4.27Å; V1122-I1150 HydrophobicContact CG1-CG2 3.77Å; V1122-I1150 HydrophobicContact CG2-CB 4.47Å; V1122-I1150 HydrophobicContact CG2-CG2 4.09Å; V1122-E1153 HydrophobicContact CB-CB 3.98Å; V1122-E1153 WeakPolarHBondContact CB-OE2 3.32Å; V1122-E1153 HydrophobicContact CG2-CB 4.24Å; V1122-E1153 HydrophobicContact CG2-CG 4.39Å; V1122-E1153 VanDerWaalsContact CG2-OE2 3.3Å; V1122-E1153 WeakPolarHBondContact CG2-OE2 3.47Å; V1122-E1153 PolarHBondContact N-OE2 3.02Å; V1122-L1154 HydrophobicContact CG1-CD2 3.92Å; V1122-L1154 HydrophobicContact CG1-CG 4.16Å |
| 1123 | V | 97.9 | Very high | 97.5 | Very high | 17 Ų | 17 | 50.4 Ų | 50.4 | 10% | 0.103 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -71.1 | -34 | -178 | -177.6 | 0 | 0 | 0 | 0 | 112.1 | H1121 T1127 L1154 F1157 | H1121-V1123 PolarHBondContact O-N 3.15Å; H1121-V1123 VanDerWaalsContact O-N 3.16Å; V1123-T1127 PolarHBondContact O-N 3.45Å; V1123-T1127 PolarHBondContact O-OG1 2.99Å; V1123-L1154 HydrophobicContact CG2-CD2 4.11Å; V1123-F1157 HydrophobicContact CB-CD2 4.19Å; V1123-F1157 HydrophobicContact CB-CE2 4.5Å; V1123-F1157 HydrophobicContact CG1-CB 4.06Å; V1123-F1157 HydrophobicContact CG1-CD1 4.3Å; V1123-F1157 HydrophobicContact CG1-CD2 3.84Å; V1123-F1157 HydrophobicContact CG1-CE2 4.32Å; V1123-F1157 HydrophobicContact CG1-CG 3.81Å; V1123-F1157 HydrophobicContact CG2-CB 4.41Å; V1123-F1157 HydrophobicContact CG2-CD2 3.35Å; V1123-F1157 HydrophobicContact CG2-CE2 3.81Å; V1123-F1157 HydrophobicContact CG2-CG 4.1Å |
| 1124 | E | 98 | Very high | 97.6 | Very high | 117 Ų | 117 | 47.9 Ų | 47.9 | 55% | 0.547 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -65.3 | -56.4 | 174 | -175.3 | -175.5 | 157.5 | 0 | 0 | 109.4 | H1121 A1126 T1127 Q1128 | H1121-E1124 IonicContact CD2-OE2 3.8Å; H1121-E1124 WeakPolarHBondContact O-CB 3.47Å; H1121-E1124 PolarHBondContact O-N 3.07Å; H1121-E1124 VanDerWaalsContact O-N 3.07Å; E1124-A1126 VanDerWaalsContact C-N 3.35Å; E1124-A1126 PolarHBondContact O-N 3.25Å; E1124-T1127 PolarHBondContact O-N 2.88Å; E1124-T1127 PolarHBondContact O-OG1 2.69Å; E1124-Q1128 PolarHBondContact O-N 2.95Å |
| 1125 | F | 98.5 | Very high | 97.7 | Very high | 8 Ų | 8 | 47.9 Ų | 47.9 | 4% | 0.035 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -60.7 | -42 | 178.4 | -63.2 | -51.4 | 0 | 0 | 0 | 112.2 | M1090 T1091 L1118 H1121 T1127 Q1128 G1131 C1132 I1135 | M1090-F1125 HydrophobicContact CB-CD1 4.25Å; M1090-F1125 HydrophobicContact CB-CE1 4.02Å; M1090-F1125 HydrophobicContact SD-CD2 4.48Å; M1090-F1125 HydrophobicContact SD-CE1 4.23Å; M1090-F1125 HydrophobicContact SD-CE2 3.96Å; M1090-F1125 HydrophobicContact SD-CZ 3.84Å; T1091-F1125 HydrophobicContact CG2-CD1 3.73Å; T1091-F1125 HydrophobicContact CG2-CE1 3.76Å; L1118-F1125 HydrophobicContact CD2-CD2 3.62Å; L1118-F1125 HydrophobicContact CD2-CE2 3.87Å; L1118-F1125 HydrophobicContact CD2-CG 4.45Å; H1121-F1125 HydrophobicContact CB-CD2 3.87Å; H1121-F1125 HydrophobicContact CB-CE2 3.49Å; H1121-F1125 VanDerWaalsContact CB-CE2 3.49Å; H1121-F1125 HydrophobicContact CB-CZ 4.23Å; H1121-F1125 VanDerWaalsContact O-CD2 3.32Å; H1121-F1125 WeakPolarHBondContact O-CD2 3.08Å; H1121-F1125 PolarHBondContact O-N 2.78Å; H1121-F1125 VanDerWaalsContact O-N 3.08Å; F1125-T1127 PolarHBondContact O-N 3.4Å; F1125-Q1128 PolarHBondContact O-N 2.81Å; F1125-G1131 CarbonylContact O-C 3.46Å; F1125-G1131 WeakPolarHBondContact O-CA 3.43Å; F1125-C1132 PolarHBondContact O-N 3.12Å; F1125-I1135 HydrophobicContact CB-CD1 3.93Å; F1125-I1135 HydrophobicContact CB-CG1 3.82Å |
| 1126 | A | 98.6 | Very high | 97.8 | Very high | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.9 | -28.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | V1122 E1124 C1132 L1154 N1166 G1167 V1170 | V1122-A1126 WeakPolarHBondContact O-CB 3.44Å; V1122-A1126 PolarHBondContact O-N 3.42Å; E1124-A1126 VanDerWaalsContact C-N 3.35Å; E1124-A1126 PolarHBondContact O-N 3.25Å; A1126-C1132 WeakPolarHBondContact O-CB 3.45Å; A1126-L1154 HydrophobicContact CB-CD2 4.24Å; A1126-N1166 CarbonylContact O-C 3.59Å; A1126-G1167 VanDerWaalsContact O-CA 3.26Å; A1126-G1167 WeakPolarHBondContact O-CA 3.41Å; A1126-G1167 PolarHBondContact O-N 3.39Å; A1126-G1167 VanDerWaalsContact O-N 3.12Å; A1126-V1170 HydrophobicContact CB-CB 4.14Å; A1126-V1170 HydrophobicContact CB-CG1 4.03Å; A1126-V1170 HydrophobicContact CB-CG2 3.85Å |
| 1127 | T | 98.3 | Very high | 97.9 | Very high | 26 Ų | 26 | 44.8 Ų | 44.8 | 16% | 0.16 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -94.4 | -1.4 | 175.9 | 54.7 | 0 | 0 | 0 | 0 | 113.6 | V1123 E1124 F1125 D1164 N1166 | V1123-T1127 PolarHBondContact O-N 3.45Å; V1123-T1127 PolarHBondContact O-OG1 2.99Å; E1124-T1127 PolarHBondContact O-N 2.88Å; E1124-T1127 PolarHBondContact O-OG1 2.69Å; F1125-T1127 PolarHBondContact O-N 3.4Å; T1127-D1164 HydrophobicContact CG2-CB 4.17Å; T1127-N1166 PolarHBondContact O-ND2 2.83Å |
| 1128 | Q | 98.4 | Very high | 98 | Very high | 56 Ų | 56 | 40.4 Ų | 40.4 | 26% | 0.262 | 20% | 0.202 | S | C | . | . | S | Bend | trans | -95 | 143 | 177.5 | -152.6 | -87.4 | 2.4 | 0 | 0 | 111.5 | T1091 E1124 F1125 Y1130 G1131 C1132 | T1091-Q1128 HydrophobicContact CG2-CG 3.96Å; T1091-Q1128 PolarHBondContact O-NE2 2.86Å; T1091-Q1128 VanDerWaalsContact O-NE2 3.09Å; E1124-Q1128 PolarHBondContact O-N 2.95Å; F1125-Q1128 PolarHBondContact O-N 2.81Å; Q1128-Y1130 VanDerWaalsContact C-N 3.32Å; Q1128-Y1130 PolarHBondContact O-N 3.17Å; Q1128-G1131 PolarHBondContact O-N 2.81Å; Q1128-C1132 VanDerWaalsContact O-CB 3.27Å; Q1128-C1132 WeakPolarHBondContact O-CB 3.46Å; Q1128-C1132 PolarHBondContact O-N 3.21Å; Q1128-C1132 PolarHBondContact O-SG 3.24Å |
| 1129 | M | 98.2 | Very high | 98.1 | Very high | 100 Ų | 100 | 40.4 Ų | 40.4 | 49% | 0.493 | 20% | 0.202 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.1 | -29.3 | -167.7 | -170.1 | 168.9 | 69.9 | 0 | 0 | 115.5 | N1166 | M1129-N1166 WeakPolarHBondContact CA-OD1 3.32Å; M1129-N1166 PolarHBondContact N-ND2 3.05Å |
| 1130 | Y | 98.5 | Very high | 98.2 | Very high | 59 Ų | 59 | 37.6 Ų | 37.6 | 23% | 0.231 | 19% | 0.189 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -104.8 | -38.8 | 175.9 | -50 | -65.6 | 0 | 0 | 0 | 111.1 | M1090 T1091 V1093 Q1128 C1132 R1133 V1134 | M1090-Y1130 CarbonylContact O-C 3.07Å; T1091-Y1130 WeakPolarHBondContact O-CD2 3.38Å; V1093-Y1130 HydrophobicContact CB-CE1 4.05Å; V1093-Y1130 HydrophobicContact CB-CE2 3.97Å; V1093-Y1130 WeakPolarHBondContact CB-OH 3.43Å; V1093-Y1130 HydrophobicContact CG2-CE1 3.87Å; V1093-Y1130 WeakPolarHBondContact CG2-OH 3.44Å; Q1128-Y1130 VanDerWaalsContact C-N 3.32Å; Q1128-Y1130 PolarHBondContact O-N 3.17Å; Y1130-C1132 PolarHBondContact O-N 3.08Å; Y1130-R1133 VanDerWaalsContact O-CB 3.29Å; Y1130-R1133 WeakPolarHBondContact O-CB 3.25Å; Y1130-R1133 PolarHBondContact O-N 3.04Å; Y1130-V1134 PolarHBondContact O-N 3.31Å |
| 1131 | G | 98.6 | Very high | 98.2 | Very high | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -56.6 | -35.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | M1090 F1125 Q1128 R1133 V1134 I1135 | M1090-G1131 VanDerWaalsContact O-CA 3.31Å; M1090-G1131 WeakPolarHBondContact O-CA 3.04Å; M1090-G1131 PolarHBondContact O-N 3.34Å; F1125-G1131 CarbonylContact O-C 3.46Å; F1125-G1131 WeakPolarHBondContact O-CA 3.43Å; Q1128-G1131 PolarHBondContact O-N 2.81Å; G1131-R1133 PolarHBondContact O-N 3.2Å; G1131-V1134 WeakPolarHBondContact O-CB 3.25Å; G1131-V1134 PolarHBondContact O-N 2.96Å; G1131-V1134 VanDerWaalsContact O-N 3.1Å; G1131-I1135 PolarHBondContact O-N 3.13Å |
| 1132 | C | 98.6 | Very high | 98.1 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -63.7 | -29 | 178.2 | 74.2 | 0 | 0 | 0 | 0 | 112.2 | F1125 A1126 Q1128 Y1130 Q1136 N1166 V1170 | F1125-C1132 PolarHBondContact O-N 3.12Å; A1126-C1132 WeakPolarHBondContact O-CB 3.45Å; Q1128-C1132 VanDerWaalsContact O-CB 3.27Å; Q1128-C1132 WeakPolarHBondContact O-CB 3.46Å; Q1128-C1132 PolarHBondContact O-N 3.21Å; Q1128-C1132 PolarHBondContact O-SG 3.24Å; Y1130-C1132 PolarHBondContact O-N 3.08Å; C1132-Q1136 VanDerWaalsContact C-NE2 3.34Å; C1132-Q1136 WeakPolarHBondContact O-CB 3.32Å; C1132-Q1136 VanDerWaalsContact O-CG 3.29Å; C1132-Q1136 WeakPolarHBondContact O-CG 3.15Å; C1132-Q1136 PolarHBondContact O-N 2.97Å; C1132-Q1136 PolarHBondContact O-NE2 3.31Å; C1132-N1166 HydrophobicContact CB-CB 3.85Å; C1132-V1170 HydrophobicContact CB-CG2 4Å |
| 1133 | R | 98.7 | Very high | 97.9 | Very high | 113 Ų | 113 | 35.2 Ų | 35.2 | 43% | 0.426 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -71.8 | -39.7 | 175.6 | -52.3 | -59.5 | 178.2 | 167.6 | -0.4 | 110.8 | Y1130 G1131 Q1136 K1137 | Y1130-R1133 VanDerWaalsContact O-CB 3.29Å; Y1130-R1133 WeakPolarHBondContact O-CB 3.25Å; Y1130-R1133 PolarHBondContact O-N 3.04Å; G1131-R1133 PolarHBondContact O-N 3.2Å; R1133-Q1136 PolarHBondContact O-N 3.01Å; R1133-K1137 PolarHBondContact O-N 3.2Å |
| 1134 | V | 98.7 | Very high | 97.6 | Very high | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.5 | -47.1 | 172.4 | -174.5 | 0 | 0 | 0 | 0 | 111.2 | M1090 N1096 I1099 Q1100 F1103 Y1130 G1131 Q1136 K1137 A1138 | M1090-V1134 HydrophobicContact CB-CG2 4.21Å; M1090-V1134 HydrophobicContact CE-CG1 4.36Å; M1090-V1134 HydrophobicContact CG-CG1 4.09Å; M1090-V1134 HydrophobicContact CG-CG2 4.23Å; N1096-V1134 HydrophobicContact CB-CG2 4.06Å; I1099-V1134 HydrophobicContact CG2-CG1 3.73Å; Q1100-V1134 HydrophobicContact CG-CG2 4.3Å; F1103-V1134 HydrophobicContact CD2-CG1 3.94Å; F1103-V1134 HydrophobicContact CE2-CG1 3.58Å; Y1130-V1134 PolarHBondContact O-N 3.31Å; G1131-V1134 WeakPolarHBondContact O-CB 3.25Å; G1131-V1134 PolarHBondContact O-N 2.96Å; G1131-V1134 VanDerWaalsContact O-N 3.1Å; V1134-Q1136 VanDerWaalsContact C-N 3.32Å; V1134-Q1136 PolarHBondContact O-N 3.42Å; V1134-K1137 PolarHBondContact O-N 2.96Å; V1134-A1138 WeakPolarHBondContact O-CB 3.33Å; V1134-A1138 PolarHBondContact O-N 2.95Å |
| 1135 | I | 98.6 | Very high | 97.4 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -60.5 | -42.4 | 176.8 | -60.1 | -57.8 | 0 | 0 | 0 | 111.1 | L1118 V1122 F1125 G1131 A1138 L1139 I1150 V1170 | L1118-I1135 HydrophobicContact CD1-CD1 3.82Å; L1118-I1135 HydrophobicContact CD2-CD1 3.7Å; L1118-I1135 HydrophobicContact CG-CD1 4.26Å; V1122-I1135 HydrophobicContact CG1-CD1 4.27Å; F1125-I1135 HydrophobicContact CB-CD1 3.93Å; F1125-I1135 HydrophobicContact CB-CG1 3.82Å; G1131-I1135 PolarHBondContact O-N 3.13Å; I1135-A1138 PolarHBondContact O-N 3.27Å; I1135-L1139 HydrophobicContact CG2-CD1 4.05Å; I1135-L1139 HydrophobicContact CG2-CG 4.43Å; I1135-L1139 WeakPolarHBondContact O-CG 3.18Å; I1135-L1139 PolarHBondContact O-N 3.33Å; I1135-I1150 HydrophobicContact CG2-CG2 4.27Å; I1135-V1170 HydrophobicContact CB-CG2 4.05Å; I1135-V1170 HydrophobicContact CG2-CB 4.45Å; I1135-V1170 HydrophobicContact CG2-CG1 3.58Å; I1135-V1170 HydrophobicContact CG2-CG2 3.99Å |
| 1136 | Q | 98.7 | Very high | 97.1 | Very high | 24 Ų | 24 | 38.7 Ų | 38.7 | 11% | 0.112 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60 | -49.2 | 175.6 | -77.8 | 163.4 | 84 | 0 | 0 | 111.9 | C1132 R1133 V1134 A1138 L1139 E1140 V1170 K1173 | C1132-Q1136 VanDerWaalsContact C-NE2 3.34Å; C1132-Q1136 WeakPolarHBondContact O-CB 3.32Å; C1132-Q1136 VanDerWaalsContact O-CG 3.29Å; C1132-Q1136 WeakPolarHBondContact O-CG 3.15Å; C1132-Q1136 PolarHBondContact O-N 2.97Å; C1132-Q1136 PolarHBondContact O-NE2 3.31Å; R1133-Q1136 PolarHBondContact O-N 3.01Å; V1134-Q1136 VanDerWaalsContact C-N 3.32Å; V1134-Q1136 PolarHBondContact O-N 3.42Å; Q1136-A1138 VanDerWaalsContact C-N 3.33Å; Q1136-A1138 PolarHBondContact O-N 3.22Å; Q1136-L1139 PolarHBondContact O-N 3.22Å; Q1136-E1140 WeakPolarHBondContact O-CG 3.38Å; Q1136-E1140 PolarHBondContact O-N 3.31Å; Q1136-E1140 VanDerWaalsContact O-N 3.11Å; Q1136-V1170 HydrophobicContact CG-CG2 4.34Å; Q1136-K1173 HydrophobicContact CB-CG 4.18Å; Q1136-K1173 HydrophobicContact CG-CB 3.9Å; Q1136-K1173 HydrophobicContact CG-CG 4.08Å |
| 1137 | K | 98.5 | Very high | 97 | Very high | 46 Ų | 46 | 40.3 Ų | 40.3 | 20% | 0.2 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -65.4 | -34.9 | 178.5 | -172.5 | 55.9 | 60.7 | -166.7 | 0 | 112.5 | Q1100 F1103 R1133 V1134 E1140 S1141 | Q1100-K1137 HydrophobicContact CB-CB 4.33Å; Q1100-K1137 HydrophobicContact CB-CG 4.05Å; Q1100-K1137 HydrophobicContact CG-CB 3.88Å; Q1100-K1137 HydrophobicContact CG-CG 4.17Å; F1103-K1137 HydrophobicContact CB-CG 3.92Å; R1133-K1137 PolarHBondContact O-N 3.2Å; V1134-K1137 PolarHBondContact O-N 2.96Å; K1137-E1140 WeakPolarHBondContact CE-OE2 3.49Å; K1137-E1140 IonicContact NZ-OE2 2.75Å; K1137-E1140 PolarHBondContact NZ-OE2 2.94Å; K1137-E1140 PolarHBondContact O-N 3.3Å; K1137-S1141 WeakPolarHBondContact O-CB 3.33Å; K1137-S1141 PolarHBondContact O-N 3.11Å; K1137-S1141 VanDerWaalsContact O-N 3.1Å; K1137-S1141 PolarHBondContact O-OG 3.37Å; K1137-S1141 VanDerWaalsContact O-OG 3.1Å |
| 1138 | A | 98.3 | Very high | 96.8 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -61.3 | -51.2 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111 | F1103 L1118 V1134 I1135 Q1136 E1140 S1141 V1142 I1150 | F1103-A1138 HydrophobicContact CD1-CB 3.94Å; F1103-A1138 HydrophobicContact CD2-CB 4.24Å; F1103-A1138 HydrophobicContact CE1-CB 3.7Å; F1103-A1138 HydrophobicContact CE2-CB 4.01Å; F1103-A1138 HydrophobicContact CG-CB 4.2Å; F1103-A1138 HydrophobicContact CZ-CB 3.72Å; L1118-A1138 HydrophobicContact CD1-CB 4.04Å; V1134-A1138 WeakPolarHBondContact O-CB 3.33Å; V1134-A1138 PolarHBondContact O-N 2.95Å; I1135-A1138 PolarHBondContact O-N 3.27Å; Q1136-A1138 VanDerWaalsContact C-N 3.33Å; Q1136-A1138 PolarHBondContact O-N 3.22Å; A1138-E1140 PolarHBondContact O-N 2.88Å; A1138-E1140 VanDerWaalsContact O-N 3.16Å; A1138-S1141 PolarHBondContact O-N 2.95Å; A1138-V1142 HydrophobicContact CB-CG1 4.4Å; A1138-V1142 WeakPolarHBondContact O-CG1 3.38Å; A1138-V1142 VanDerWaalsContact O-CG2 3.28Å; A1138-V1142 WeakPolarHBondContact O-CG2 3.5Å; A1138-V1142 PolarHBondContact O-N 2.9Å; A1138-I1150 HydrophobicContact CB-CD1 4.32Å |
| 1139 | L | 97.9 | Very high | 96.6 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.2 | -27 | 177.5 | -70.9 | 169.5 | 0 | 0 | 0 | 113.6 | I1135 Q1136 K1147 I1150 V1151 V1170 K1173 C1174 C1177 | I1135-L1139 HydrophobicContact CG2-CD1 4.05Å; I1135-L1139 HydrophobicContact CG2-CG 4.43Å; I1135-L1139 WeakPolarHBondContact O-CG 3.18Å; I1135-L1139 PolarHBondContact O-N 3.33Å; Q1136-L1139 PolarHBondContact O-N 3.22Å; L1139-K1147 HydrophobicContact CD2-CB 4.36Å; L1139-K1147 WeakPolarHBondContact O-CD 3.49Å; L1139-K1147 WeakPolarHBondContact O-CE 3.24Å; L1139-K1147 PolarHBondContact O-NZ 3.29Å; L1139-I1150 HydrophobicContact CD2-CB 4.42Å; L1139-I1150 HydrophobicContact CD2-CG2 4.02Å; L1139-I1150 HydrophobicContact CG-CG2 4.46Å; L1139-V1151 HydrophobicContact CD2-CG2 3.69Å; L1139-V1170 HydrophobicContact CD1-CG1 4.31Å; L1139-K1173 HydrophobicContact CB-CG 4.03Å; L1139-K1173 HydrophobicContact CD1-CB 4.29Å; L1139-K1173 HydrophobicContact CD1-CG 4.19Å; L1139-C1174 VanDerWaalsContact CD1-SG 3.59Å; L1139-C1177 WeakPolarHBondContact O-CB 3.46Å |
| 1140 | E | 97.8 | Very high | 96.5 | Very high | 72 Ų | 72 | 40.6 Ų | 40.6 | 34% | 0.336 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -75 | -38.1 | 172.7 | -69.3 | 169.9 | 171 | 0 | 0 | 112.2 | Q1136 K1137 A1138 K1173 | Q1136-E1140 WeakPolarHBondContact O-CG 3.38Å; Q1136-E1140 PolarHBondContact O-N 3.31Å; Q1136-E1140 VanDerWaalsContact O-N 3.11Å; K1137-E1140 WeakPolarHBondContact CE-OE2 3.49Å; K1137-E1140 IonicContact NZ-OE2 2.75Å; K1137-E1140 PolarHBondContact NZ-OE2 2.94Å; K1137-E1140 PolarHBondContact O-N 3.3Å; A1138-E1140 PolarHBondContact O-N 2.88Å; A1138-E1140 VanDerWaalsContact O-N 3.16Å; E1140-K1173 HydrophobicContact CG-CD 3.86Å; E1140-K1173 WeakPolarHBondContact OE1-CE 3.26Å; E1140-K1173 IonicContact OE1-NZ 2.88Å; E1140-K1173 PolarHBondContact OE1-NZ 3.05Å |
| 1141 | S | 96.3 | Very high | 96.4 | Very high | 35 Ų | 35 | 37.9 Ų | 37.9 | 25% | 0.245 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -113.1 | -7.3 | -161.3 | -53.1 | 0 | 0 | 0 | 0 | 117.5 | F1103 K1137 A1138 | F1103-S1141 WeakPolarHBondContact O-CB 3.47Å; F1103-S1141 PolarHBondContact O-OG 3.26Å; K1137-S1141 WeakPolarHBondContact O-CB 3.33Å; K1137-S1141 PolarHBondContact O-N 3.11Å; K1137-S1141 VanDerWaalsContact O-N 3.1Å; K1137-S1141 PolarHBondContact O-OG 3.37Å; K1137-S1141 VanDerWaalsContact O-OG 3.1Å; A1138-S1141 PolarHBondContact O-N 2.95Å |
| 1142 | V | 95.5 | Very high | 96.3 | Very high | 7 Ų | 7 | 39.5 Ų | 39.5 | 4% | 0.042 | 21% | 0.211 | C | C | . | . | S | Bend | trans | -94.7 | 154.5 | 178.8 | -55.2 | 0 | 0 | 0 | 0 | 112.3 | F1103 A1138 A1146 K1147 I1150 | F1103-V1142 HydrophobicContact CD1-CG1 3.82Å; F1103-V1142 HydrophobicContact CE1-CG1 3.75Å; A1138-V1142 HydrophobicContact CB-CG1 4.4Å; A1138-V1142 WeakPolarHBondContact O-CG1 3.38Å; A1138-V1142 VanDerWaalsContact O-CG2 3.28Å; A1138-V1142 WeakPolarHBondContact O-CG2 3.5Å; A1138-V1142 PolarHBondContact O-N 2.9Å; V1142-A1146 HydrophobicContact CB-CB 3.98Å; V1142-A1146 HydrophobicContact CG2-CB 3.77Å; V1142-K1147 HydrophobicContact CG2-CB 4.48Å; V1142-K1147 HydrophobicContact CG2-CG 3.61Å; V1142-K1147 WeakPolarHBondContact O-CE 3.27Å; V1142-I1150 HydrophobicContact CG2-CD1 4.36Å |
| 1143 | P | 92.9 | Very high | 96.3 | Very high | 60 Ų | 60 | 41.8 Ų | 41.8 | 39% | 0.39 | 22% | 0.222 | S | C | . | . | trans | -60.6 | 156.2 | 174.9 | 25.5 | -36 | 0 | 0 | 0 | 112.6 | E1145 A1146 K1147 | P1143-E1145 VanDerWaalsContact C-N 3.32Å; P1143-E1145 PolarHBondContact O-N 3.2Å; P1143-A1146 HydrophobicContact CG-CB 4.23Å; P1143-A1146 WeakPolarHBondContact O-CB 3.26Å; P1143-A1146 PolarHBondContact O-N 2.88Å; P1143-K1147 PolarHBondContact O-N 3.36Å; P1143-K1147 VanDerWaalsContact O-N 3.09Å | ||
| 1144 | A | 92.9 | Very high | 96.3 | Very high | 56 Ų | 56 | 36.5 Ų | 36.5 | 46% | 0.463 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -53.7 | -42.1 | -170.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | A1146 K1147 I1148 | A1144-A1146 PolarHBondContact O-N 3.39Å; A1144-K1147 WeakPolarHBondContact O-CB 3.39Å; A1144-K1147 PolarHBondContact O-N 2.87Å; A1144-K1147 VanDerWaalsContact O-N 3.1Å; A1144-I1148 WeakPolarHBondContact O-CG1 3.45Å; A1144-I1148 PolarHBondContact O-N 2.71Å |
| 1145 | E | 92.6 | Very high | 96.2 | Very high | 142 Ų | 142 | 43.2 Ų | 43.2 | 66% | 0.664 | 23% | 0.227 | S | C | * | . | H | α-helix | trans | -55.2 | -48.4 | 174.8 | -178.1 | 174.9 | -153.8 | 0 | 0 | 112.2 | P1143 K1147 I1148 H1149 | P1143-E1145 VanDerWaalsContact C-N 3.32Å; P1143-E1145 PolarHBondContact O-N 3.2Å; E1145-K1147 VanDerWaalsContact C-N 3.32Å; E1145-K1147 PolarHBondContact O-N 2.84Å; E1145-I1148 PolarHBondContact O-N 3.03Å; E1145-H1149 PolarHBondContact O-CD2 3.27Å; E1145-H1149 PolarHBondContact O-N 3.1Å |
| 1146 | A | 93.3 | Very high | 96.1 | Very high | 17 Ų | 17 | 48.2 Ų | 48.2 | 14% | 0.14 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -65.9 | -32.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | V1142 P1143 A1144 I1150 | V1142-A1146 HydrophobicContact CB-CB 3.98Å; V1142-A1146 HydrophobicContact CG2-CB 3.77Å; P1143-A1146 HydrophobicContact CG-CB 4.23Å; P1143-A1146 WeakPolarHBondContact O-CB 3.26Å; P1143-A1146 PolarHBondContact O-N 2.88Å; A1144-A1146 PolarHBondContact O-N 3.39Å; A1146-I1150 VanDerWaalsContact O-CG1 3.3Å; A1146-I1150 WeakPolarHBondContact O-CG1 3.46Å; A1146-I1150 PolarHBondContact O-N 2.92Å; A1146-I1150 VanDerWaalsContact O-N 3.12Å |
| 1147 | K | 95.6 | Very high | 96.1 | Very high | 33 Ų | 33 | 51 Ų | 51 | 14% | 0.143 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -62.3 | -47.7 | 171 | -55 | -169.7 | -170.5 | -155.9 | 0 | 110.8 | L1139 V1142 P1143 A1144 E1145 H1149 I1150 V1151 C1177 V1178 | L1139-K1147 HydrophobicContact CD2-CB 4.36Å; L1139-K1147 WeakPolarHBondContact O-CD 3.49Å; L1139-K1147 WeakPolarHBondContact O-CE 3.24Å; L1139-K1147 PolarHBondContact O-NZ 3.29Å; V1142-K1147 HydrophobicContact CG2-CB 4.48Å; V1142-K1147 HydrophobicContact CG2-CG 3.61Å; V1142-K1147 WeakPolarHBondContact O-CE 3.27Å; P1143-K1147 PolarHBondContact O-N 3.36Å; P1143-K1147 VanDerWaalsContact O-N 3.09Å; A1144-K1147 WeakPolarHBondContact O-CB 3.39Å; A1144-K1147 PolarHBondContact O-N 2.87Å; A1144-K1147 VanDerWaalsContact O-N 3.1Å; E1145-K1147 VanDerWaalsContact C-N 3.32Å; E1145-K1147 PolarHBondContact O-N 2.84Å; K1147-H1149 VanDerWaalsContact C-N 3.33Å; K1147-H1149 PolarHBondContact O-N 3.41Å; K1147-I1150 PolarHBondContact O-N 3.35Å; K1147-V1151 WeakPolarHBondContact O-CB 3.48Å; K1147-V1151 WeakPolarHBondContact O-CG2 3.46Å; K1147-V1151 PolarHBondContact O-N 2.85Å; K1147-C1177 VanDerWaalsContact CD-O 3.26Å; K1147-C1177 WeakPolarHBondContact CD-O 3.38Å; K1147-C1177 PolarHBondContact NZ-O 3.46Å; K1147-V1178 HydrophobicContact CB-CG2 4.26Å; K1147-V1178 HydrophobicContact CD-CG2 4.48Å |
| 1148 | I | 94.6 | Very high | 96.1 | Very high | 61 Ų | 61 | 48.9 Ų | 48.9 | 31% | 0.313 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.3 | -42.2 | -179.4 | -66.6 | 168.5 | 0 | 0 | 0 | 110.8 | A1144 E1145 V1151 G1152 E1182 | A1144-I1148 WeakPolarHBondContact O-CG1 3.45Å; A1144-I1148 PolarHBondContact O-N 2.71Å; E1145-I1148 PolarHBondContact O-N 3.03Å; I1148-V1151 PolarHBondContact O-N 2.66Å; I1148-G1152 PolarHBondContact O-N 3.39Å; I1148-E1182 HydrophobicContact CD1-CG 3.98Å; I1148-E1182 HydrophobicContact CG1-CG 4Å |
| 1149 | H | 94.4 | Very high | 96 | Very high | 122 Ų | 122 | 51.1 Ų | 51.1 | 57% | 0.565 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -61.3 | -48.6 | 174.4 | -73.8 | -61.8 | 0 | 0 | 0 | 113 | E1145 K1147 V1151 G1152 | E1145-H1149 PolarHBondContact O-CD2 3.27Å; E1145-H1149 PolarHBondContact O-N 3.1Å; K1147-H1149 VanDerWaalsContact C-N 3.33Å; K1147-H1149 PolarHBondContact O-N 3.41Å; H1149-V1151 VanDerWaalsContact C-N 3.35Å; H1149-V1151 PolarHBondContact O-N 3.15Å; H1149-G1152 PolarHBondContact O-N 2.86Å |
| 1150 | I | 96.1 | Very high | 96 | Very high | 6 Ų | 6 | 58 Ų | 58 | 3% | 0.031 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -60.1 | -45.5 | 177.4 | -68.5 | 167.1 | 0 | 0 | 0 | 110.7 | L1118 V1122 I1135 A1138 L1139 V1142 A1146 K1147 G1152 E1153 | L1118-I1150 HydrophobicContact CD1-CD1 4.1Å; V1122-I1150 HydrophobicContact CG1-CG2 3.77Å; V1122-I1150 HydrophobicContact CG2-CB 4.47Å; V1122-I1150 HydrophobicContact CG2-CG2 4.09Å; I1135-I1150 HydrophobicContact CG2-CG2 4.27Å; A1138-I1150 HydrophobicContact CB-CD1 4.32Å; L1139-I1150 HydrophobicContact CD2-CB 4.42Å; L1139-I1150 HydrophobicContact CD2-CG2 4.02Å; L1139-I1150 HydrophobicContact CG-CG2 4.46Å; V1142-I1150 HydrophobicContact CG2-CD1 4.36Å; A1146-I1150 VanDerWaalsContact O-CG1 3.3Å; A1146-I1150 WeakPolarHBondContact O-CG1 3.46Å; A1146-I1150 PolarHBondContact O-N 2.92Å; A1146-I1150 VanDerWaalsContact O-N 3.12Å; K1147-I1150 PolarHBondContact O-N 3.35Å; I1150-G1152 VanDerWaalsContact C-N 3.33Å; I1150-G1152 PolarHBondContact O-N 2.81Å; I1150-E1153 PolarHBondContact O-N 3.09Å |
| 1151 | V | 96.8 | Very high | 96.1 | Very high | 2 Ų | 2 | 54.6 Ų | 54.6 | 1% | 0.012 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -67.2 | -33 | 180 | 170 | 0 | 0 | 0 | 0 | 112 | L1139 K1147 I1148 H1149 E1153 L1154 C1174 V1178 L1183 F1185 | L1139-V1151 HydrophobicContact CD2-CG2 3.69Å; K1147-V1151 WeakPolarHBondContact O-CB 3.48Å; K1147-V1151 WeakPolarHBondContact O-CG2 3.46Å; K1147-V1151 PolarHBondContact O-N 2.85Å; I1148-V1151 PolarHBondContact O-N 2.66Å; H1149-V1151 VanDerWaalsContact C-N 3.35Å; H1149-V1151 PolarHBondContact O-N 3.15Å; V1151-E1153 VanDerWaalsContact C-N 3.35Å; V1151-E1153 PolarHBondContact O-N 3.4Å; V1151-L1154 WeakPolarHBondContact O-CB 3.34Å; V1151-L1154 PolarHBondContact O-N 3.05Å; V1151-C1174 HydrophobicContact CG2-CB 4.15Å; V1151-V1178 HydrophobicContact CG2-CG2 3.74Å; V1151-L1183 HydrophobicContact CG1-CD2 4.41Å; V1151-F1185 HydrophobicContact CG1-CE1 3.7Å; V1151-F1185 HydrophobicContact CG1-CZ 3.53Å; V1151-F1185 WeakPolarHBondContact O-CZ 3.32Å |
| 1152 | G | 96.7 | Very high | 96.2 | Very high | 34 Ų | 34 | 52.9 Ų | 52.9 | 35% | 0.351 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -59.9 | -38.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | I1148 H1149 I1150 L1154 R1155 | I1148-G1152 PolarHBondContact O-N 3.39Å; H1149-G1152 PolarHBondContact O-N 2.86Å; I1150-G1152 VanDerWaalsContact C-N 3.33Å; I1150-G1152 PolarHBondContact O-N 2.81Å; G1152-L1154 PolarHBondContact O-N 2.97Å; G1152-R1155 WeakPolarHBondContact O-CB 3.37Å; G1152-R1155 PolarHBondContact O-N 3.23Å; G1152-R1155 VanDerWaalsContact O-N 3.15Å |
| 1153 | E | 97.5 | Very high | 96.3 | Very high | 48 Ų | 48 | 56.2 Ų | 56.2 | 22% | 0.224 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -64.7 | -25.5 | 177.6 | -73.1 | -173.5 | -152.7 | 0 | 0 | 113.5 | Q1119 G1120 H1121 V1122 I1150 V1151 R1155 | Q1119-E1153 WeakPolarHBondContact CA-OE1 3.24Å; Q1119-E1153 WeakPolarHBondContact CG-OE1 3.45Å; G1120-E1153 WeakPolarHBondContact CA-OE2 3.23Å; G1120-E1153 VanDerWaalsContact N-CD 3.26Å; G1120-E1153 PolarHBondContact N-OE1 3.35Å; G1120-E1153 PolarHBondContact N-OE2 3.02Å; G1120-E1153 VanDerWaalsContact N-OE2 3.09Å; H1121-E1153 PolarHBondContact N-OE2 2.74Å; V1122-E1153 HydrophobicContact CB-CB 3.98Å; V1122-E1153 WeakPolarHBondContact CB-OE2 3.32Å; V1122-E1153 HydrophobicContact CG2-CB 4.24Å; V1122-E1153 HydrophobicContact CG2-CG 4.39Å; V1122-E1153 VanDerWaalsContact CG2-OE2 3.3Å; V1122-E1153 WeakPolarHBondContact CG2-OE2 3.47Å; V1122-E1153 PolarHBondContact N-OE2 3.02Å; I1150-E1153 PolarHBondContact O-N 3.09Å; V1151-E1153 VanDerWaalsContact C-N 3.35Å; V1151-E1153 PolarHBondContact O-N 3.4Å; E1153-R1155 PolarHBondContact O-N 3.42Å |
| 1154 | L | 97.8 | Very high | 96.6 | Very high | 1 Ų | 1 | 55.2 Ų | 55.2 | 1% | 0.005 | 28% | 0.28 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | -12.6 | 177.8 | -59.5 | 174.9 | 0 | 0 | 0 | 112.9 | V1122 V1123 A1126 V1151 G1152 F1157 V1158 V1170 I1171 | V1122-L1154 HydrophobicContact CG1-CD2 3.92Å; V1122-L1154 HydrophobicContact CG1-CG 4.16Å; V1123-L1154 HydrophobicContact CG2-CD2 4.11Å; A1126-L1154 HydrophobicContact CB-CD2 4.24Å; V1151-L1154 WeakPolarHBondContact O-CB 3.34Å; V1151-L1154 PolarHBondContact O-N 3.05Å; G1152-L1154 PolarHBondContact O-N 2.97Å; L1154-F1157 CarbonylContact O-C 3.54Å; L1154-F1157 WeakPolarHBondContact O-CA 3.47Å; L1154-F1157 PolarHBondContact O-N 2.82Å; L1154-V1158 WeakPolarHBondContact O-CG2 3.24Å; L1154-V1158 PolarHBondContact O-N 3.19Å; L1154-V1170 HydrophobicContact CD1-CG1 3.81Å; L1154-I1171 HydrophobicContact CD1-CD1 4.13Å |
| 1155 | R | 97.3 | Very high | 96.9 | Very high | 141 Ų | 141 | 58 Ų | 58 | 53% | 0.532 | 28% | 0.283 | S | S | . | . | G | 310 helix | trans | -52.8 | -50.8 | -170.2 | -178 | 170 | -65.6 | -136.3 | 2.8 | 115.4 | G1152 E1153 F1157 F1185 | G1152-R1155 WeakPolarHBondContact O-CB 3.37Å; G1152-R1155 PolarHBondContact O-N 3.23Å; G1152-R1155 VanDerWaalsContact O-N 3.15Å; E1153-R1155 PolarHBondContact O-N 3.42Å; R1155-F1157 PolarHBondContact O-N 3.29Å; R1155-F1185 HydrophobicContact CB-CD2 3.75Å; R1155-F1185 HydrophobicContact CB-CE2 3.95Å; R1155-F1185 HydrophobicContact CB-CG 4.28Å; R1155-F1185 HydrophobicContact CG-CB 3.96Å; R1155-F1185 HydrophobicContact CG-CD2 3.71Å; R1155-F1185 HydrophobicContact CG-CE2 4.42Å; R1155-F1185 HydrophobicContact CG-CG 3.92Å; R1155-F1185 VanDerWaalsContact NH2-CD1 3.31Å |
| 1156 | P | 96.8 | Very high | 97.1 | Very high | 106 Ų | 106 | 52 Ų | 52 | 69% | 0.688 | 26% | 0.256 | S | S | * | . | G | 310 helix | trans | -77.7 | -3.2 | 176.4 | 29.3 | -31.8 | 0 | 0 | 0 | 113.9 | ||
| 1157 | F | 97.9 | Very high | 97.4 | Very high | 82 Ų | 82 | 51.2 Ų | 51.2 | 36% | 0.36 | 25% | 0.249 | S | C | . | . | G | 310 helix | trans | -118.5 | 3.3 | -172.7 | -58.3 | -70.7 | 0 | 0 | 0 | 115 | V1123 L1154 R1155 T1159 R1160 C1161 | V1123-F1157 HydrophobicContact CB-CD2 4.19Å; V1123-F1157 HydrophobicContact CB-CE2 4.5Å; V1123-F1157 HydrophobicContact CG1-CB 4.06Å; V1123-F1157 HydrophobicContact CG1-CD1 4.3Å; V1123-F1157 HydrophobicContact CG1-CD2 3.84Å; V1123-F1157 HydrophobicContact CG1-CE2 4.32Å; V1123-F1157 HydrophobicContact CG1-CG 3.81Å; V1123-F1157 HydrophobicContact CG2-CB 4.41Å; V1123-F1157 HydrophobicContact CG2-CD2 3.35Å; V1123-F1157 HydrophobicContact CG2-CE2 3.81Å; V1123-F1157 HydrophobicContact CG2-CG 4.1Å; L1154-F1157 CarbonylContact O-C 3.54Å; L1154-F1157 WeakPolarHBondContact O-CA 3.47Å; L1154-F1157 PolarHBondContact O-N 2.82Å; R1155-F1157 PolarHBondContact O-N 3.29Å; F1157-T1159 PolarHBondContact O-N 2.86Å; F1157-R1160 WeakPolarHBondContact O-CA 3.45Å; F1157-R1160 WeakPolarHBondContact O-CB 3.45Å; F1157-R1160 PolarHBondContact O-N 2.87Å; F1157-C1161 PolarHBondContact O-N 2.9Å; F1157-C1161 PolarHBondContact O-SG 3.48Å; F1157-C1161 VanDerWaalsContact O-SG 3.37Å |
| 1158 | V | 98.5 | Very high | 97.5 | Very high | 2 Ų | 2 | 49.6 Ų | 49.6 | 1% | 0.012 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -47.8 | -54.5 | -176 | 178.4 | 0 | 0 | 0 | 0 | 112.3 | L1154 R1160 C1161 V1162 I1171 F1185 I1186 A1189 | L1154-V1158 WeakPolarHBondContact O-CG2 3.24Å; L1154-V1158 PolarHBondContact O-N 3.19Å; V1158-R1160 PolarHBondContact O-N 3.32Å; V1158-C1161 PolarHBondContact O-N 2.93Å; V1158-V1162 HydrophobicContact CG1-CG2 3.94Å; V1158-V1162 WeakPolarHBondContact O-CB 3.39Å; V1158-V1162 VanDerWaalsContact O-CG2 3.26Å; V1158-V1162 WeakPolarHBondContact O-CG2 3.46Å; V1158-V1162 PolarHBondContact O-N 3.15Å; V1158-I1171 HydrophobicContact CG1-CD1 4.44Å; V1158-F1185 HydrophobicContact CG2-CD2 3.66Å; V1158-F1185 HydrophobicContact CG2-CE2 3.52Å; V1158-I1186 HydrophobicContact CG1-CB 4.46Å; V1158-I1186 HydrophobicContact CG1-CG2 4.02Å; V1158-I1186 HydrophobicContact CG2-CG1 4.28Å; V1158-A1189 HydrophobicContact CB-CB 3.82Å; V1158-A1189 HydrophobicContact CG1-CB 3.81Å; V1158-A1189 HydrophobicContact CG2-CB 4.44Å |
| 1159 | T | 97.7 | Very high | 97.7 | Very high | 46 Ų | 46 | 49.2 Ų | 49.2 | 28% | 0.282 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.3 | -29.2 | -178.9 | -55.6 | 0 | 0 | 0 | 0 | 113.5 | F1157 K1163 Q1193 | F1157-T1159 PolarHBondContact O-N 2.86Å; T1159-K1163 HydrophobicContact CG2-CD 4.31Å; T1159-K1163 WeakPolarHBondContact O-CG 3.32Å; T1159-K1163 PolarHBondContact O-N 3.45Å; T1159-Q1193 PolarHBondContact OG1-NE2 3.42Å; T1159-Q1193 VanDerWaalsContact OG1-NE2 3.11Å |
| 1160 | R | 97.9 | Very high | 97.9 | Very high | 145 Ų | 145 | 43.4 Ų | 43.4 | 55% | 0.547 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -72 | -48.6 | 172.5 | 175.3 | -178.1 | 170.5 | -170.9 | -5.9 | 110.2 | F1157 V1158 K1163 D1164 | F1157-R1160 WeakPolarHBondContact O-CA 3.45Å; F1157-R1160 WeakPolarHBondContact O-CB 3.45Å; F1157-R1160 PolarHBondContact O-N 2.87Å; V1158-R1160 PolarHBondContact O-N 3.32Å; R1160-K1163 PolarHBondContact O-N 3.22Å; R1160-D1164 WeakPolarHBondContact O-CB 3.39Å; R1160-D1164 PolarHBondContact O-N 2.89Å |
| 1161 | C | 98.6 | Very high | 98.1 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -64 | -43.8 | -178.8 | -59.4 | 0 | 0 | 0 | 0 | 111.8 | F1157 V1158 K1163 D1164 G1167 N1168 I1171 | F1157-C1161 PolarHBondContact O-N 2.9Å; F1157-C1161 PolarHBondContact O-SG 3.48Å; F1157-C1161 VanDerWaalsContact O-SG 3.37Å; V1158-C1161 PolarHBondContact O-N 2.93Å; C1161-K1163 PolarHBondContact O-N 3.38Å; C1161-D1164 PolarHBondContact O-N 3.07Å; C1161-G1167 CarbonylContact O-C 3.04Å; C1161-G1167 WeakPolarHBondContact O-CA 3.46Å; C1161-N1168 PolarHBondContact O-N 2.61Å; C1161-I1171 HydrophobicContact CB-CD1 3.93Å; C1161-I1171 HydrophobicContact CB-CG1 3.61Å |
| 1162 | V | 98.7 | Very high | 98.2 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -58 | -31.4 | 175 | 170.9 | 0 | 0 | 0 | 0 | 112.7 | V1158 I1171 F1190 L1197 Y1202 V1206 | V1158-V1162 HydrophobicContact CG1-CG2 3.94Å; V1158-V1162 WeakPolarHBondContact O-CB 3.39Å; V1158-V1162 VanDerWaalsContact O-CG2 3.26Å; V1158-V1162 WeakPolarHBondContact O-CG2 3.46Å; V1158-V1162 PolarHBondContact O-N 3.15Å; V1162-I1171 HydrophobicContact CG2-CB 4.38Å; V1162-I1171 HydrophobicContact CG2-CG1 4.19Å; V1162-I1171 HydrophobicContact CG2-CG2 3.94Å; V1162-F1190 HydrophobicContact CG1-CE1 4.48Å; V1162-F1190 HydrophobicContact CG1-CE2 4.42Å; V1162-F1190 HydrophobicContact CG1-CZ 3.75Å; V1162-F1190 HydrophobicContact CG2-CE2 3.79Å; V1162-F1190 HydrophobicContact CG2-CZ 3.9Å; V1162-L1197 HydrophobicContact CG1-CD1 4.4Å; V1162-L1197 HydrophobicContact CG1-CD2 3.81Å; V1162-Y1202 WeakPolarHBondContact O-CB 3.43Å; V1162-V1206 HydrophobicContact CG1-CG2 4.26Å; V1162-V1206 HydrophobicContact CG2-CG1 4.27Å; V1162-V1206 HydrophobicContact CG2-CG2 4.3Å |
| 1163 | K | 98.3 | Very high | 98.2 | Very high | 76 Ų | 76 | 43.4 Ų | 43.4 | 33% | 0.33 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -93 | -6.9 | 179.1 | -66 | 177 | -170.9 | 174.7 | 0 | 113.4 | T1159 R1160 C1161 L1197 | T1159-K1163 HydrophobicContact CG2-CD 4.31Å; T1159-K1163 WeakPolarHBondContact O-CG 3.32Å; T1159-K1163 PolarHBondContact O-N 3.45Å; R1160-K1163 PolarHBondContact O-N 3.22Å; C1161-K1163 PolarHBondContact O-N 3.38Å; K1163-L1197 HydrophobicContact CD-CD2 4.39Å; K1163-L1197 HydrophobicContact CG-CD2 4.14Å |
| 1164 | D | 98.6 | Very high | 98.3 | Very high | 39 Ų | 39 | 41.1 Ų | 41.1 | 21% | 0.209 | 19% | 0.191 | C | C | . | . | S | Bend | trans | -89.5 | 145.7 | 178.9 | -179.2 | 64.9 | 0 | 0 | 0 | 112.7 | T1127 R1160 C1161 N1166 G1167 N1168 | T1127-D1164 HydrophobicContact CG2-CB 4.17Å; R1160-D1164 WeakPolarHBondContact O-CB 3.39Å; R1160-D1164 PolarHBondContact O-N 2.89Å; C1161-D1164 PolarHBondContact O-N 3.07Å; D1164-N1166 PolarHBondContact O-N 3.05Å; D1164-N1166 WeakPolarHBondContact OD2-CA 3.4Å; D1164-N1166 WeakPolarHBondContact OD2-CB 3.26Å; D1164-N1166 PolarHBondContact OD2-N 3.47Å; D1164-G1167 PolarHBondContact OD2-N 3.21Å; D1164-N1168 WeakPolarHBondContact O-CB 3.49Å; D1164-N1168 PolarHBondContact O-N 3.23Å; D1164-N1168 PolarHBondContact O-ND2 2.92Å |
| 1165 | Q | 98.3 | Very high | 98.3 | Very high | 115 Ų | 115 | 41.3 Ų | 41.3 | 54% | 0.537 | 19% | 0.192 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -65 | -25.4 | -178 | 66.4 | -177.1 | -8.7 | 0 | 0 | 113.8 | N1168 Y1202 | Q1165-N1168 VanDerWaalsContact C-ND2 3.31Å; Q1165-N1168 PolarHBondContact O-ND2 3.06Å; Q1165-Y1202 HydrophobicContact CB-CE2 3.93Å |
| 1166 | N | 98.5 | Very high | 98.4 | Very high | 16 Ų | 16 | 38 Ų | 38 | 9% | 0.086 | 18% | 0.183 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -102.5 | -46.7 | 178.4 | -58 | -49.2 | 0 | 0 | 0 | 110.6 | A1126 T1127 M1129 C1132 D1164 N1168 H1169 | A1126-N1166 CarbonylContact O-C 3.59Å; T1127-N1166 PolarHBondContact O-ND2 2.83Å; M1129-N1166 WeakPolarHBondContact CA-OD1 3.32Å; M1129-N1166 PolarHBondContact N-ND2 3.05Å; C1132-N1166 HydrophobicContact CB-CB 3.85Å; D1164-N1166 PolarHBondContact O-N 3.05Å; D1164-N1166 WeakPolarHBondContact OD2-CA 3.4Å; D1164-N1166 WeakPolarHBondContact OD2-CB 3.26Å; D1164-N1166 PolarHBondContact OD2-N 3.47Å; N1166-N1168 VanDerWaalsContact C-N 3.26Å; N1166-N1168 PolarHBondContact O-N 3.2Å; N1166-H1169 WeakPolarHBondContact O-CB 3.48Å; N1166-H1169 PolarHBondContact O-N 3.06Å; N1166-H1169 VanDerWaalsContact O-N 3.08Å |
| 1167 | G | 98.6 | Very high | 98.4 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.1 | -28.7 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | A1126 C1161 D1164 H1169 V1170 I1171 | A1126-G1167 VanDerWaalsContact O-CA 3.26Å; A1126-G1167 WeakPolarHBondContact O-CA 3.41Å; A1126-G1167 PolarHBondContact O-N 3.39Å; A1126-G1167 VanDerWaalsContact O-N 3.12Å; C1161-G1167 CarbonylContact O-C 3.04Å; C1161-G1167 WeakPolarHBondContact O-CA 3.46Å; D1164-G1167 PolarHBondContact OD2-N 3.21Å; G1167-H1169 VanDerWaalsContact C-N 3.25Å; G1167-H1169 PolarHBondContact O-N 3.21Å; G1167-V1170 PolarHBondContact O-N 2.96Å; G1167-I1171 WeakPolarHBondContact O-CG1 3.32Å; G1167-I1171 PolarHBondContact O-N 2.78Å |
| 1168 | N | 98.7 | Very high | 98.3 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -65.3 | -30.5 | 177.7 | 78.7 | 93.3 | 0 | 0 | 0 | 112.3 | C1161 D1164 Q1165 N1166 Q1172 Y1202 V1206 | C1161-N1168 PolarHBondContact O-N 2.61Å; D1164-N1168 WeakPolarHBondContact O-CB 3.49Å; D1164-N1168 PolarHBondContact O-N 3.23Å; D1164-N1168 PolarHBondContact O-ND2 2.92Å; Q1165-N1168 VanDerWaalsContact C-ND2 3.31Å; Q1165-N1168 PolarHBondContact O-ND2 3.06Å; N1166-N1168 VanDerWaalsContact C-N 3.26Å; N1166-N1168 PolarHBondContact O-N 3.2Å; N1168-Q1172 WeakPolarHBondContact O-CB 3.22Å; N1168-Q1172 VanDerWaalsContact O-CG 3.26Å; N1168-Q1172 WeakPolarHBondContact O-CG 3.46Å; N1168-Q1172 PolarHBondContact O-N 2.96Å; N1168-Q1172 PolarHBondContact O-NE2 3.11Å; N1168-Q1172 PolarHBondContact OD1-NE2 2.8Å; N1168-Y1202 HydrophobicContact CB-CG 4.38Å; N1168-V1206 HydrophobicContact CB-CG2 4.46Å |
| 1169 | H | 98.7 | Very high | 98.2 | Very high | 52 Ų | 52 | 33.9 Ų | 33.9 | 24% | 0.241 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -72.8 | -35.3 | 175.4 | -70.4 | -79.8 | 0 | 0 | 0 | 111.5 | N1166 G1167 K1173 | N1166-H1169 WeakPolarHBondContact O-CB 3.48Å; N1166-H1169 PolarHBondContact O-N 3.06Å; N1166-H1169 VanDerWaalsContact O-N 3.08Å; G1167-H1169 VanDerWaalsContact C-N 3.25Å; G1167-H1169 PolarHBondContact O-N 3.21Å; H1169-K1173 WeakPolarHBondContact O-CB 3.46Å; H1169-K1173 PolarHBondContact O-N 2.89Å |
| 1170 | V | 98.7 | Very high | 98.2 | Very high | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -65.6 | -46.4 | 172.2 | 173.9 | 0 | 0 | 0 | 0 | 111 | A1126 C1132 I1135 Q1136 L1139 L1154 G1167 Q1172 K1173 C1174 | A1126-V1170 HydrophobicContact CB-CB 4.14Å; A1126-V1170 HydrophobicContact CB-CG1 4.03Å; A1126-V1170 HydrophobicContact CB-CG2 3.85Å; C1132-V1170 HydrophobicContact CB-CG2 4Å; I1135-V1170 HydrophobicContact CB-CG2 4.05Å; I1135-V1170 HydrophobicContact CG2-CB 4.45Å; I1135-V1170 HydrophobicContact CG2-CG1 3.58Å; I1135-V1170 HydrophobicContact CG2-CG2 3.99Å; Q1136-V1170 HydrophobicContact CG-CG2 4.34Å; L1139-V1170 HydrophobicContact CD1-CG1 4.31Å; L1154-V1170 HydrophobicContact CD1-CG1 3.81Å; G1167-V1170 PolarHBondContact O-N 2.96Å; V1170-Q1172 PolarHBondContact O-N 2.81Å; V1170-K1173 PolarHBondContact O-N 3.24Å; V1170-K1173 VanDerWaalsContact O-N 3.14Å; V1170-C1174 PolarHBondContact O-N 2.89Å; V1170-C1174 PolarHBondContact O-SG 3.4Å |
| 1171 | I | 98.7 | Very high | 98.1 | Very high | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.9 | -40.4 | 178.5 | -62.9 | -67.5 | 0 | 0 | 0 | 111.7 | L1154 V1158 C1161 V1162 G1167 C1174 I1175 I1186 V1206 | L1154-I1171 HydrophobicContact CD1-CD1 4.13Å; V1158-I1171 HydrophobicContact CG1-CD1 4.44Å; C1161-I1171 HydrophobicContact CB-CD1 3.93Å; C1161-I1171 HydrophobicContact CB-CG1 3.61Å; V1162-I1171 HydrophobicContact CG2-CB 4.38Å; V1162-I1171 HydrophobicContact CG2-CG1 4.19Å; V1162-I1171 HydrophobicContact CG2-CG2 3.94Å; G1167-I1171 WeakPolarHBondContact O-CG1 3.32Å; G1167-I1171 PolarHBondContact O-N 2.78Å; I1171-C1174 WeakPolarHBondContact O-CB 3.41Å; I1171-C1174 PolarHBondContact O-N 2.98Å; I1171-I1175 HydrophobicContact CG2-CD1 4.15Å; I1171-I1175 WeakPolarHBondContact O-CD1 3.36Å; I1171-I1175 WeakPolarHBondContact O-CG1 3.37Å; I1171-I1175 PolarHBondContact O-N 3.43Å; I1171-I1186 HydrophobicContact CG2-CD1 4.45Å; I1171-I1186 HydrophobicContact CG2-CG2 4.26Å; I1171-V1206 HydrophobicContact CG2-CG1 3.68Å; I1171-V1206 HydrophobicContact CG2-CG2 4.24Å |
| 1172 | Q | 98.8 | Very high | 98 | Very high | 13 Ų | 13 | 33.1 Ų | 33.1 | 6% | 0.061 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -59.3 | -47.3 | 171.6 | -74.1 | 171.2 | 92.9 | 0 | 0 | 111.4 | N1168 V1170 C1174 I1175 E1176 V1206 R1209 | N1168-Q1172 WeakPolarHBondContact O-CB 3.22Å; N1168-Q1172 VanDerWaalsContact O-CG 3.26Å; N1168-Q1172 WeakPolarHBondContact O-CG 3.46Å; N1168-Q1172 PolarHBondContact O-N 2.96Å; N1168-Q1172 PolarHBondContact O-NE2 3.11Å; N1168-Q1172 PolarHBondContact OD1-NE2 2.8Å; V1170-Q1172 PolarHBondContact O-N 2.81Å; Q1172-C1174 VanDerWaalsContact C-N 3.32Å; Q1172-C1174 PolarHBondContact O-N 3.5Å; Q1172-I1175 WeakPolarHBondContact O-CA 3Å; Q1172-I1175 WeakPolarHBondContact O-CB 3.27Å; Q1172-I1175 PolarHBondContact O-N 3.14Å; Q1172-E1176 WeakPolarHBondContact O-CG 3.48Å; Q1172-E1176 PolarHBondContact O-N 2.79Å; Q1172-V1206 HydrophobicContact CG-CG2 3.98Å; Q1172-R1209 HydrophobicContact CB-CG 3.81Å; Q1172-R1209 HydrophobicContact CG-CG 3.62Å |
| 1173 | K | 98.6 | Very high | 98 | Very high | 30 Ų | 30 | 33.1 Ų | 33.1 | 13% | 0.13 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -64.3 | -33.3 | 178.6 | -168.3 | 59.9 | 60 | 175.8 | 0 | 113.3 | Q1136 L1139 E1140 H1169 V1170 I1175 E1176 C1177 | Q1136-K1173 HydrophobicContact CB-CG 4.18Å; Q1136-K1173 HydrophobicContact CG-CB 3.9Å; Q1136-K1173 HydrophobicContact CG-CG 4.08Å; L1139-K1173 HydrophobicContact CB-CG 4.03Å; L1139-K1173 HydrophobicContact CD1-CB 4.29Å; L1139-K1173 HydrophobicContact CD1-CG 4.19Å; E1140-K1173 HydrophobicContact CG-CD 3.86Å; E1140-K1173 WeakPolarHBondContact OE1-CE 3.26Å; E1140-K1173 IonicContact OE1-NZ 2.88Å; E1140-K1173 PolarHBondContact OE1-NZ 3.05Å; H1169-K1173 WeakPolarHBondContact O-CB 3.46Å; H1169-K1173 PolarHBondContact O-N 2.89Å; V1170-K1173 PolarHBondContact O-N 3.24Å; V1170-K1173 VanDerWaalsContact O-N 3.14Å; K1173-I1175 VanDerWaalsContact C-N 3.31Å; K1173-I1175 PolarHBondContact O-N 3.45Å; K1173-E1176 WeakPolarHBondContact CD-OE2 3.38Å; K1173-E1176 WeakPolarHBondContact CE-OE2 3.26Å; K1173-E1176 IonicContact NZ-OE2 3.63Å; K1173-E1176 PolarHBondContact NZ-OE2 3.31Å; K1173-E1176 PolarHBondContact O-N 3.11Å; K1173-C1177 WeakPolarHBondContact CD-SG 3.34Å; K1173-C1177 VanDerWaalsContact O-CB 3.24Å; K1173-C1177 WeakPolarHBondContact O-CB 3.36Å; K1173-C1177 PolarHBondContact O-N 3.19Å |
| 1174 | C | 98.5 | Very high | 97.9 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -59.3 | -43.5 | 169.7 | -64.8 | 0 | 0 | 0 | 0 | 111.2 | L1139 V1151 V1170 I1171 Q1172 V1178 I1186 | L1139-C1174 VanDerWaalsContact CD1-SG 3.59Å; V1151-C1174 HydrophobicContact CG2-CB 4.15Å; V1170-C1174 PolarHBondContact O-N 2.89Å; V1170-C1174 PolarHBondContact O-SG 3.4Å; I1171-C1174 WeakPolarHBondContact O-CB 3.41Å; I1171-C1174 PolarHBondContact O-N 2.98Å; Q1172-C1174 VanDerWaalsContact C-N 3.32Å; Q1172-C1174 PolarHBondContact O-N 3.5Å; C1174-V1178 WeakPolarHBondContact O-CB 3.45Å; C1174-V1178 VanDerWaalsContact O-CG2 3.23Å; C1174-V1178 WeakPolarHBondContact O-CG2 3.25Å; C1174-V1178 PolarHBondContact O-N 3.13Å; C1174-I1186 HydrophobicContact CB-CD1 4.35Å |
| 1175 | I | 98.4 | Very high | 97.9 | Very high | 4 Ų | 4 | 32.7 Ų | 32.7 | 2% | 0.021 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -69.3 | -35 | 179.7 | -62.7 | 156.2 | 0 | 0 | 0 | 111.9 | I1171 Q1172 K1173 L1183 I1186 V1206 R1209 I1210 H1213 | I1171-I1175 HydrophobicContact CG2-CD1 4.15Å; I1171-I1175 WeakPolarHBondContact O-CD1 3.36Å; I1171-I1175 WeakPolarHBondContact O-CG1 3.37Å; I1171-I1175 PolarHBondContact O-N 3.43Å; Q1172-I1175 WeakPolarHBondContact O-CA 3Å; Q1172-I1175 WeakPolarHBondContact O-CB 3.27Å; Q1172-I1175 PolarHBondContact O-N 3.14Å; K1173-I1175 VanDerWaalsContact C-N 3.31Å; K1173-I1175 PolarHBondContact O-N 3.45Å; I1175-L1183 HydrophobicContact CB-CD1 4.35Å; I1175-L1183 HydrophobicContact CG1-CD1 4.25Å; I1175-L1183 HydrophobicContact CG2-CD1 4.46Å; I1175-I1186 HydrophobicContact CG1-CD1 4.3Å; I1175-V1206 HydrophobicContact CD1-CG1 3.77Å; I1175-R1209 HydrophobicContact CB-CB 4.13Å; I1175-R1209 HydrophobicContact CD1-CB 4.11Å; I1175-R1209 HydrophobicContact CG2-CB 3.81Å; I1175-R1209 WeakPolarHBondContact CG2-O 3.49Å; I1175-I1210 HydrophobicContact CD1-CG1 3.76Å; I1175-H1213 HydrophobicContact CG2-CB 3.76Å |
| 1176 | E | 98.2 | Very high | 97.9 | Very high | 73 Ų | 73 | 27.2 Ų | 27.2 | 34% | 0.341 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -72.9 | -33.2 | 176.9 | -67.7 | 160.6 | -147 | 0 | 0 | 114 | Q1172 K1173 | Q1172-E1176 WeakPolarHBondContact O-CG 3.48Å; Q1172-E1176 PolarHBondContact O-N 2.79Å; K1173-E1176 WeakPolarHBondContact CD-OE2 3.38Å; K1173-E1176 WeakPolarHBondContact CE-OE2 3.26Å; K1173-E1176 IonicContact NZ-OE2 3.63Å; K1173-E1176 PolarHBondContact NZ-OE2 3.31Å; K1173-E1176 PolarHBondContact O-N 3.11Å |
| 1177 | C | 97.3 | Very high | 97.9 | Very high | 32 Ų | 32 | 26.6 Ų | 26.6 | 22% | 0.216 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -116.3 | -0.3 | -162.5 | -72.2 | 0 | 0 | 0 | 0 | 116.3 | L1139 K1147 K1173 | L1139-C1177 WeakPolarHBondContact O-CB 3.46Å; K1147-C1177 VanDerWaalsContact CD-O 3.26Å; K1147-C1177 WeakPolarHBondContact CD-O 3.38Å; K1147-C1177 PolarHBondContact NZ-O 3.46Å; K1173-C1177 WeakPolarHBondContact CD-SG 3.34Å; K1173-C1177 VanDerWaalsContact O-CB 3.24Å; K1173-C1177 WeakPolarHBondContact O-CB 3.36Å; K1173-C1177 PolarHBondContact O-N 3.19Å |
| 1178 | V | 97 | Very high | 97.8 | Very high | 9 Ų | 9 | 29.6 Ų | 29.6 | 6% | 0.055 | 17% | 0.168 | C | C | . | . | S | Bend | trans | -124.3 | 142.9 | -173.9 | -175.6 | 0 | 0 | 0 | 0 | 109.5 | K1147 V1151 C1174 E1182 L1183 | K1147-V1178 HydrophobicContact CB-CG2 4.26Å; K1147-V1178 HydrophobicContact CD-CG2 4.48Å; V1151-V1178 HydrophobicContact CG2-CG2 3.74Å; C1174-V1178 WeakPolarHBondContact O-CB 3.45Å; C1174-V1178 VanDerWaalsContact O-CG2 3.23Å; C1174-V1178 WeakPolarHBondContact O-CG2 3.25Å; C1174-V1178 PolarHBondContact O-N 3.13Å; V1178-E1182 HydrophobicContact CG1-CB 3.92Å; V1178-E1182 HydrophobicContact CG1-CG 4.34Å; V1178-L1183 HydrophobicContact CB-CD2 4.1Å; V1178-L1183 HydrophobicContact CG1-CD2 4.09Å |
| 1179 | P | 95.7 | Very high | 97.8 | Very high | 61 Ų | 61 | 30.9 Ų | 30.9 | 40% | 0.396 | 18% | 0.178 | S | C | . | . | trans | -53.9 | 131.3 | 175.7 | -26.8 | 35.7 | 0 | 0 | 0 | 112 | S1181 E1182 | P1179-S1181 PolarHBondContact O-N 2.64Å; P1179-E1182 PolarHBondContact O-N 2.83Å | ||
| 1180 | P | 97.2 | Very high | 97.7 | Very high | 37 Ų | 37 | 28.5 Ų | 28.5 | 24% | 0.24 | 17% | 0.167 | C | C | . | . | G | 310 helix | trans | -54.6 | -28.9 | -176.9 | -33.1 | 38.7 | 0 | 0 | 0 | 115.4 | E1182 L1183 H1213 L1215 Q1218 | P1180-E1182 PolarHBondContact O-N 3.35Å; P1180-E1182 VanDerWaalsContact O-N 3.15Å; P1180-L1183 WeakPolarHBondContact O-CB 3.29Å; P1180-L1183 PolarHBondContact O-N 3.24Å; P1180-H1213 VanDerWaalsContact CG-O 3.27Å; P1180-H1213 WeakPolarHBondContact CG-O 3.4Å; P1180-L1215 HydrophobicContact CB-CD1 4.31Å; P1180-L1215 HydrophobicContact CB-CD2 4.29Å; P1180-L1215 HydrophobicContact CB-CG 3.83Å; P1180-Q1218 PolarHBondContact O-NE2 3.03Å |
| 1181 | S | 96.7 | Very high | 97.6 | Very high | 69 Ų | 69 | 35.6 Ų | 35.6 | 48% | 0.483 | 19% | 0.194 | S | C | . | . | G | 310 helix | trans | -54.3 | -30.5 | 174.7 | 56 | 0 | 0 | 0 | 0 | 113.8 | P1179 L1183 | P1179-S1181 PolarHBondContact O-N 2.64Å; S1181-L1183 VanDerWaalsContact C-N 3.32Å |
| 1182 | E | 96.8 | Very high | 97.5 | Very high | 69 Ų | 69 | 38.9 Ų | 38.9 | 32% | 0.322 | 23% | 0.227 | S | C | . | . | G | 310 helix | trans | -84.1 | -9.7 | -178.2 | -56.2 | -55.3 | 129.9 | 0 | 0 | 112.9 | I1148 V1178 P1179 P1180 F1185 | I1148-E1182 HydrophobicContact CD1-CG 3.98Å; I1148-E1182 HydrophobicContact CG1-CG 4Å; V1178-E1182 HydrophobicContact CG1-CB 3.92Å; V1178-E1182 HydrophobicContact CG1-CG 4.34Å; P1179-E1182 PolarHBondContact O-N 2.83Å; P1180-E1182 PolarHBondContact O-N 3.35Å; P1180-E1182 VanDerWaalsContact O-N 3.15Å; E1182-F1185 VanDerWaalsContact O-CD1 3.25Å; E1182-F1185 WeakPolarHBondContact O-CD1 3.42Å; E1182-F1185 VanDerWaalsContact O-CE1 3.25Å; E1182-F1185 WeakPolarHBondContact O-CE1 3.09Å |
| 1183 | L | 97.5 | Very high | 97.4 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 23% | 0.232 | C | C | . | . | G | 310 helix | trans | -96.3 | -0.2 | -167.9 | -55.9 | -176.5 | 0 | 0 | 0 | 114.4 | V1151 I1175 V1178 P1180 S1181 F1185 I1186 I1187 | V1151-L1183 HydrophobicContact CG1-CD2 4.41Å; I1175-L1183 HydrophobicContact CB-CD1 4.35Å; I1175-L1183 HydrophobicContact CG1-CD1 4.25Å; I1175-L1183 HydrophobicContact CG2-CD1 4.46Å; V1178-L1183 HydrophobicContact CB-CD2 4.1Å; V1178-L1183 HydrophobicContact CG1-CD2 4.09Å; P1180-L1183 WeakPolarHBondContact O-CB 3.29Å; P1180-L1183 PolarHBondContact O-N 3.24Å; S1181-L1183 VanDerWaalsContact C-N 3.32Å; L1183-F1185 PolarHBondContact O-N 2.95Å; L1183-I1186 HydrophobicContact CD2-CD1 3.97Å; L1183-I1186 WeakPolarHBondContact O-CA 3.32Å; L1183-I1186 WeakPolarHBondContact O-CB 3.31Å; L1183-I1186 PolarHBondContact O-N 2.86Å; L1183-I1187 PolarHBondContact O-N 3.41Å |
| 1184 | D | 97.4 | Very high | 97.4 | Very high | 89 Ų | 89 | 38.5 Ų | 38.5 | 48% | 0.476 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -51.4 | -30.4 | -178.9 | -91.9 | -6.1 | 0 | 0 | 0 | 114.3 | I1187 S1188 Q1218 | D1184-I1187 PolarHBondContact O-N 2.8Å; D1184-S1188 VanDerWaalsContact O-CB 3.26Å; D1184-S1188 WeakPolarHBondContact O-CB 3.45Å; D1184-S1188 PolarHBondContact O-N 3.37Å; D1184-S1188 PolarHBondContact O-OG 3.23Å; D1184-Q1218 PolarHBondContact OD1-NE2 2.71Å |
| 1185 | F | 97.7 | Very high | 97.4 | Very high | 17 Ų | 17 | 40.1 Ų | 40.1 | 8% | 0.075 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -72.4 | -29.2 | 177.2 | 76.2 | -87.5 | 0 | 0 | 0 | 113.1 | V1151 R1155 V1158 E1182 L1183 A1189 | V1151-F1185 HydrophobicContact CG1-CE1 3.7Å; V1151-F1185 HydrophobicContact CG1-CZ 3.53Å; V1151-F1185 WeakPolarHBondContact O-CZ 3.32Å; R1155-F1185 HydrophobicContact CB-CD2 3.75Å; R1155-F1185 HydrophobicContact CB-CE2 3.95Å; R1155-F1185 HydrophobicContact CB-CG 4.28Å; R1155-F1185 HydrophobicContact CG-CB 3.96Å; R1155-F1185 HydrophobicContact CG-CD2 3.71Å; R1155-F1185 HydrophobicContact CG-CE2 4.42Å; R1155-F1185 HydrophobicContact CG-CG 3.92Å; R1155-F1185 VanDerWaalsContact NH2-CD1 3.31Å; V1158-F1185 HydrophobicContact CG2-CD2 3.66Å; V1158-F1185 HydrophobicContact CG2-CE2 3.52Å; E1182-F1185 VanDerWaalsContact O-CD1 3.25Å; E1182-F1185 WeakPolarHBondContact O-CD1 3.42Å; E1182-F1185 VanDerWaalsContact O-CE1 3.25Å; E1182-F1185 WeakPolarHBondContact O-CE1 3.09Å; L1183-F1185 PolarHBondContact O-N 2.95Å; F1185-A1189 WeakPolarHBondContact O-CB 3.01Å; F1185-A1189 PolarHBondContact O-N 3.19Å; F1185-A1189 VanDerWaalsContact O-N 3.1Å |
| 1186 | I | 98.1 | Very high | 97.4 | Very high | 1 Ų | 1 | 45.3 Ų | 45.3 | 1% | 0.005 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -67.9 | -51.5 | 171.3 | -56.8 | -177 | 0 | 0 | 0 | 108.2 | V1158 I1171 C1174 I1175 L1183 S1188 A1189 F1190 I1210 | V1158-I1186 HydrophobicContact CG1-CB 4.46Å; V1158-I1186 HydrophobicContact CG1-CG2 4.02Å; V1158-I1186 HydrophobicContact CG2-CG1 4.28Å; I1171-I1186 HydrophobicContact CG2-CD1 4.45Å; I1171-I1186 HydrophobicContact CG2-CG2 4.26Å; C1174-I1186 HydrophobicContact CB-CD1 4.35Å; I1175-I1186 HydrophobicContact CG1-CD1 4.3Å; L1183-I1186 HydrophobicContact CD2-CD1 3.97Å; L1183-I1186 WeakPolarHBondContact O-CA 3.32Å; L1183-I1186 WeakPolarHBondContact O-CB 3.31Å; L1183-I1186 PolarHBondContact O-N 2.86Å; I1186-S1188 VanDerWaalsContact C-N 3.27Å; I1186-S1188 PolarHBondContact O-N 2.86Å; I1186-A1189 WeakPolarHBondContact O-CB 3.47Å; I1186-A1189 PolarHBondContact O-N 2.9Å; I1186-F1190 HydrophobicContact CG2-CD2 4.27Å; I1186-F1190 HydrophobicContact CG2-CE2 4.11Å; I1186-F1190 WeakPolarHBondContact O-CD2 3.44Å; I1186-F1190 PolarHBondContact O-N 2.95Å; I1186-I1210 HydrophobicContact CG2-CD1 4.43Å |
| 1187 | I | 97.7 | Very high | 97.4 | Very high | 2 Ų | 2 | 41.9 Ų | 41.9 | 1% | 0.01 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -55 | -44.6 | 176.9 | -50.3 | -59.6 | 0 | 0 | 0 | 111 | L1183 D1184 A1189 F1190 R1191 I1210 C1214 Q1218 I1222 | L1183-I1187 PolarHBondContact O-N 3.41Å; D1184-I1187 PolarHBondContact O-N 2.8Å; I1187-A1189 VanDerWaalsContact C-N 3.32Å; I1187-A1189 PolarHBondContact O-N 3.42Å; I1187-F1190 PolarHBondContact O-N 3.42Å; I1187-F1190 VanDerWaalsContact O-N 3.14Å; I1187-R1191 PolarHBondContact O-N 3.34Å; I1187-I1210 HydrophobicContact CD1-CD1 4.24Å; I1187-I1210 HydrophobicContact CD1-CG1 4.17Å; I1187-I1210 HydrophobicContact CD1-CG2 3.59Å; I1187-C1214 HydrophobicContact CD1-CB 4.28Å; I1187-Q1218 HydrophobicContact CD1-CB 4.17Å; I1187-Q1218 HydrophobicContact CG1-CB 4Å; I1187-Q1218 HydrophobicContact CG1-CG 4.24Å; I1187-Q1218 HydrophobicContact CG2-CB 4.48Å; I1187-Q1218 WeakPolarHBondContact CG2-O 3.33Å; I1187-I1222 HydrophobicContact CG2-CD1 4.32Å; I1187-I1222 HydrophobicContact CG2-CG1 4.47Å |
| 1188 | S | 97.5 | Very high | 97.5 | Very high | 64 Ų | 64 | 40.3 Ų | 40.3 | 45% | 0.448 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -62.4 | -35.8 | 177.8 | -62 | 0 | 0 | 0 | 0 | 113 | D1184 I1186 F1190 | D1184-S1188 VanDerWaalsContact O-CB 3.26Å; D1184-S1188 WeakPolarHBondContact O-CB 3.45Å; D1184-S1188 PolarHBondContact O-N 3.37Å; D1184-S1188 PolarHBondContact O-OG 3.23Å; I1186-S1188 VanDerWaalsContact C-N 3.27Å; I1186-S1188 PolarHBondContact O-N 2.86Å; S1188-F1190 VanDerWaalsContact C-N 3.29Å; S1188-F1190 PolarHBondContact O-N 3.41Å |
| 1189 | A | 97.7 | Very high | 97.6 | Very high | 26 Ų | 26 | 41.1 Ų | 41.1 | 22% | 0.215 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -71.1 | -20.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | V1158 F1185 I1186 I1187 Q1193 | V1158-A1189 HydrophobicContact CB-CB 3.82Å; V1158-A1189 HydrophobicContact CG1-CB 3.81Å; V1158-A1189 HydrophobicContact CG2-CB 4.44Å; F1185-A1189 WeakPolarHBondContact O-CB 3.01Å; F1185-A1189 PolarHBondContact O-N 3.19Å; F1185-A1189 VanDerWaalsContact O-N 3.1Å; I1186-A1189 WeakPolarHBondContact O-CB 3.47Å; I1186-A1189 PolarHBondContact O-N 2.9Å; I1187-A1189 VanDerWaalsContact C-N 3.32Å; I1187-A1189 PolarHBondContact O-N 3.42Å; A1189-Q1193 PolarHBondContact O-NE2 2.83Å |
| 1190 | F | 97.9 | Very high | 97.7 | Very high | 2 Ų | 2 | 40.4 Ų | 40.4 | 1% | 0.009 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -82.8 | -27.8 | 177.1 | -90.1 | -100.4 | 0 | 0 | 0 | 113.8 | V1162 I1186 I1187 S1188 G1192 Q1193 V1194 L1197 V1206 I1207 I1210 I1222 | V1162-F1190 HydrophobicContact CG1-CE1 4.48Å; V1162-F1190 HydrophobicContact CG1-CE2 4.42Å; V1162-F1190 HydrophobicContact CG1-CZ 3.75Å; V1162-F1190 HydrophobicContact CG2-CE2 3.79Å; V1162-F1190 HydrophobicContact CG2-CZ 3.9Å; I1186-F1190 HydrophobicContact CG2-CD2 4.27Å; I1186-F1190 HydrophobicContact CG2-CE2 4.11Å; I1186-F1190 WeakPolarHBondContact O-CD2 3.44Å; I1186-F1190 PolarHBondContact O-N 2.95Å; I1187-F1190 PolarHBondContact O-N 3.42Å; I1187-F1190 VanDerWaalsContact O-N 3.14Å; S1188-F1190 VanDerWaalsContact C-N 3.29Å; S1188-F1190 PolarHBondContact O-N 3.41Å; F1190-G1192 PolarHBondContact O-N 3.48Å; F1190-Q1193 CarbonylContact O-C 3.08Å; F1190-Q1193 WeakPolarHBondContact O-CG 3.43Å; F1190-Q1193 PolarHBondContact O-N 2.99Å; F1190-V1194 HydrophobicContact CB-CG2 4.37Å; F1190-V1194 WeakPolarHBondContact O-CG2 3.37Å; F1190-V1194 PolarHBondContact O-N 3.3Å; F1190-L1197 HydrophobicContact CD1-CB 4.18Å; F1190-L1197 HydrophobicContact CD1-CD1 3.36Å; F1190-L1197 HydrophobicContact CD1-CG 4.39Å; F1190-L1197 HydrophobicContact CD2-CD1 4.42Å; F1190-L1197 HydrophobicContact CE1-CB 3.83Å; F1190-L1197 HydrophobicContact CE1-CD1 3.35Å; F1190-L1197 HydrophobicContact CE1-CG 4.17Å; F1190-L1197 HydrophobicContact CE2-CD1 4.42Å; F1190-L1197 HydrophobicContact CG-CD1 3.94Å; F1190-L1197 HydrophobicContact CZ-CD1 3.9Å; F1190-V1206 HydrophobicContact CE1-CG1 4.44Å; F1190-V1206 HydrophobicContact CE2-CG1 3.72Å; F1190-V1206 HydrophobicContact CZ-CB 3.83Å; F1190-V1206 HydrophobicContact CZ-CG1 3.38Å; F1190-I1207 HydrophobicContact CD1-CD1 3.39Å; F1190-I1207 HydrophobicContact CD1-CG1 4.3Å; F1190-I1207 HydrophobicContact CE1-CD1 3.41Å; F1190-I1207 VanDerWaalsContact CE1-CD1 3.41Å; F1190-I1207 HydrophobicContact CE1-CG1 3.83Å; F1190-I1210 HydrophobicContact CD1-CD1 4.43Å; F1190-I1210 HydrophobicContact CD2-CD1 3.92Å; F1190-I1210 HydrophobicContact CE1-CD1 4.38Å; F1190-I1210 HydrophobicContact CE2-CD1 3.87Å; F1190-I1210 HydrophobicContact CG-CD1 4.21Å; F1190-I1210 HydrophobicContact CZ-CD1 4.12Å; F1190-I1222 HydrophobicContact CB-CD1 3.78Å |
| 1191 | R | 95.5 | Very high | 97.8 | Very high | 150 Ų | 150 | 40.4 Ų | 40.4 | 57% | 0.566 | 23% | 0.233 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -55.2 | 129.1 | -177.8 | -66.2 | -179.6 | -179.4 | -174.2 | 0.3 | 111.6 | I1187 Q1193 | I1187-R1191 PolarHBondContact O-N 3.34Å; R1191-Q1193 VanDerWaalsContact C-N 3.31Å |
| 1192 | G | 97.2 | Very high | 97.9 | Very high | 68 Ų | 68 | 40.5 Ų | 40.5 | 70% | 0.701 | 22% | 0.224 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 81.3 | -0.5 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | F1190 E1225 | F1190-G1192 PolarHBondContact O-N 3.48Å; G1192-E1225 VanDerWaalsContact C-OE1 3.27Å; G1192-E1225 WeakPolarHBondContact CA-OE2 3.48Å; G1192-E1225 PolarHBondContact N-OE2 2.92Å |
| 1193 | Q | 97.9 | Very high | 97.9 | Very high | 36 Ų | 36 | 37.2 Ų | 37.2 | 17% | 0.168 | 21% | 0.209 | C | C | . | . | trans | -138.1 | 19.9 | 172.8 | 60.6 | 167.4 | -22.8 | 0 | 0 | 113.5 | T1159 A1189 F1190 R1191 V1195 L1196 L1197 E1225 | T1159-Q1193 PolarHBondContact OG1-NE2 3.42Å; T1159-Q1193 VanDerWaalsContact OG1-NE2 3.11Å; A1189-Q1193 PolarHBondContact O-NE2 2.83Å; F1190-Q1193 CarbonylContact O-C 3.08Å; F1190-Q1193 WeakPolarHBondContact O-CG 3.43Å; F1190-Q1193 PolarHBondContact O-N 2.99Å; R1191-Q1193 VanDerWaalsContact C-N 3.31Å; Q1193-V1195 PolarHBondContact O-N 2.92Å; Q1193-L1196 HydrophobicContact CB-CB 4.37Å; Q1193-L1196 HydrophobicContact CB-CD2 4.42Å; Q1193-L1196 PolarHBondContact O-N 3.13Å; Q1193-L1197 HydrophobicContact CG-CD1 3.72Å; Q1193-L1197 HydrophobicContact CG-CG 4.21Å; Q1193-L1197 WeakPolarHBondContact O-CB 3.5Å; Q1193-L1197 WeakPolarHBondContact O-CG 3.5Å; Q1193-L1197 PolarHBondContact O-N 3.08Å; Q1193-E1225 PolarHBondContact N-OE1 3.49Å; Q1193-E1225 VanDerWaalsContact N-OE1 3.14Å | ||
| 1194 | V | 98.6 | Very high | 98 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -60.8 | -44.6 | -179.2 | 175.8 | 0 | 0 | 0 | 0 | 111.2 | F1190 L1197 S1198 I1207 I1222 E1225 L1226 | F1190-V1194 HydrophobicContact CB-CG2 4.37Å; F1190-V1194 WeakPolarHBondContact O-CG2 3.37Å; F1190-V1194 PolarHBondContact O-N 3.3Å; V1194-L1197 PolarHBondContact O-N 3.12Å; V1194-S1198 VanDerWaalsContact O-CB 3.28Å; V1194-S1198 WeakPolarHBondContact O-CB 3.37Å; V1194-S1198 PolarHBondContact O-N 3.36Å; V1194-S1198 PolarHBondContact O-OG 3.16Å; V1194-I1207 HydrophobicContact CG1-CD1 3.97Å; V1194-I1222 HydrophobicContact CG1-CG2 3.75Å; V1194-I1222 HydrophobicContact CG2-CD1 3.8Å; V1194-I1222 HydrophobicContact CG2-CG2 4.31Å; V1194-E1225 HydrophobicContact CB-CB 3.83Å; V1194-E1225 HydrophobicContact CB-CG 3.9Å; V1194-E1225 WeakPolarHBondContact CB-OE1 3.45Å; V1194-E1225 HydrophobicContact CG1-CB 4.28Å; V1194-E1225 HydrophobicContact CG2-CB 3.92Å; V1194-E1225 HydrophobicContact CG2-CG 4.22Å; V1194-E1225 PolarHBondContact N-OE1 3.27Å; V1194-L1226 HydrophobicContact CG1-CD2 3.76Å; V1194-L1226 HydrophobicContact CG1-CG 3.75Å |
| 1195 | V | 98.3 | Very high | 98.1 | Very high | 33 Ų | 33 | 38 Ų | 38 | 20% | 0.2 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -64.2 | -44.6 | 178.3 | -177.5 | 0 | 0 | 0 | 0 | 110.6 | Q1193 L1197 S1198 S1199 E1225 L1233 | Q1193-V1195 PolarHBondContact O-N 2.92Å; V1195-L1197 PolarHBondContact O-N 3.01Å; V1195-S1198 PolarHBondContact O-N 3.02Å; V1195-S1199 PolarHBondContact O-N 2.59Å; V1195-S1199 VanDerWaalsContact O-N 3.11Å; V1195-S1199 PolarHBondContact O-OG 3.34Å; V1195-E1225 HydrophobicContact CG2-CG 4.47Å; V1195-L1233 HydrophobicContact CG1-CD1 4.42Å; V1195-L1233 HydrophobicContact CG1-CD2 4.08Å; V1195-L1233 HydrophobicContact CG1-CG 4.19Å |
| 1196 | L | 98.2 | Very high | 98.1 | Very high | 113 Ų | 113 | 37.2 Ų | 37.2 | 59% | 0.592 | 20% | 0.202 | S | C | * | . | H | α-helix | trans | -61.9 | -40.7 | 177.3 | 176.5 | 64.5 | 0 | 0 | 0 | 112.4 | Q1193 H1200 | Q1193-L1196 HydrophobicContact CB-CB 4.37Å; Q1193-L1196 HydrophobicContact CB-CD2 4.42Å; Q1193-L1196 PolarHBondContact O-N 3.13Å; L1196-H1200 PolarHBondContact O-N 3.46Å |
| 1197 | L | 98.5 | Very high | 98.1 | Very high | 1 Ų | 1 | 37.2 Ų | 37.2 | 1% | 0.005 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -75.8 | -29.9 | 178.1 | -72.1 | 175.9 | 0 | 0 | 0 | 112.3 | V1162 K1163 F1190 Q1193 V1194 V1195 S1199 H1200 G1203 C1204 | V1162-L1197 HydrophobicContact CG1-CD1 4.4Å; V1162-L1197 HydrophobicContact CG1-CD2 3.81Å; K1163-L1197 HydrophobicContact CD-CD2 4.39Å; K1163-L1197 HydrophobicContact CG-CD2 4.14Å; F1190-L1197 HydrophobicContact CD1-CB 4.18Å; F1190-L1197 HydrophobicContact CD1-CD1 3.36Å; F1190-L1197 HydrophobicContact CD1-CG 4.39Å; F1190-L1197 HydrophobicContact CD2-CD1 4.42Å; F1190-L1197 HydrophobicContact CE1-CB 3.83Å; F1190-L1197 HydrophobicContact CE1-CD1 3.35Å; F1190-L1197 HydrophobicContact CE1-CG 4.17Å; F1190-L1197 HydrophobicContact CE2-CD1 4.42Å; F1190-L1197 HydrophobicContact CG-CD1 3.94Å; F1190-L1197 HydrophobicContact CZ-CD1 3.9Å; Q1193-L1197 HydrophobicContact CG-CD1 3.72Å; Q1193-L1197 HydrophobicContact CG-CG 4.21Å; Q1193-L1197 WeakPolarHBondContact O-CB 3.5Å; Q1193-L1197 WeakPolarHBondContact O-CG 3.5Å; Q1193-L1197 PolarHBondContact O-N 3.08Å; V1194-L1197 PolarHBondContact O-N 3.12Å; V1195-L1197 PolarHBondContact O-N 3.01Å; L1197-S1199 VanDerWaalsContact C-N 3.32Å; L1197-H1200 VanDerWaalsContact O-CB 3.29Å; L1197-H1200 WeakPolarHBondContact O-CB 3.32Å; L1197-H1200 PolarHBondContact O-N 3Å; L1197-H1200 VanDerWaalsContact O-N 3.09Å; L1197-G1203 CarbonylContact O-C 3.55Å; L1197-G1203 WeakPolarHBondContact O-CA 3.2Å; L1197-C1204 PolarHBondContact O-N 2.84Å |
| 1198 | S | 98.7 | Very high | 98.2 | Very high | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -68.5 | -31.3 | 173.9 | -60.1 | 0 | 0 | 0 | 0 | 112.4 | V1194 V1195 H1200 C1204 L1226 Y1238 G1239 | V1194-S1198 VanDerWaalsContact O-CB 3.28Å; V1194-S1198 WeakPolarHBondContact O-CB 3.37Å; V1194-S1198 PolarHBondContact O-N 3.36Å; V1194-S1198 PolarHBondContact O-OG 3.16Å; V1195-S1198 PolarHBondContact O-N 3.02Å; S1198-H1200 VanDerWaalsContact C-N 3.28Å; S1198-H1200 PolarHBondContact O-N 3.09Å; S1198-C1204 WeakPolarHBondContact O-CB 3.37Å; S1198-L1226 VanDerWaalsContact OG-CD2 3.24Å; S1198-L1226 WeakPolarHBondContact OG-CD2 3.43Å; S1198-Y1238 CarbonylContact O-C 3.58Å; S1198-G1239 WeakPolarHBondContact O-CA 3.48Å; S1198-G1239 PolarHBondContact O-N 3.15Å |
| 1199 | S | 98.6 | Very high | 98.2 | Very high | 25 Ų | 25 | 38.1 Ų | 38.1 | 18% | 0.175 | 20% | 0.197 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | 12.6 | 169.6 | -53.3 | 0 | 0 | 0 | 0 | 113.8 | V1195 L1197 H1232 L1233 D1236 Y1238 | V1195-S1199 PolarHBondContact O-N 2.59Å; V1195-S1199 VanDerWaalsContact O-N 3.11Å; V1195-S1199 PolarHBondContact O-OG 3.34Å; L1197-S1199 VanDerWaalsContact C-N 3.32Å; S1199-H1232 PolarHBondContact OG-CD2 2.89Å; S1199-H1232 PolarHBondContact OG-NE2 2.89Å; S1199-L1233 WeakPolarHBondContact OG-CD2 3.45Å; S1199-D1236 WeakPolarHBondContact CA-OD2 3.5Å; S1199-D1236 WeakPolarHBondContact CB-OD2 3.42Å; S1199-Y1238 WeakPolarHBondContact O-CD2 3.31Å |
| 1200 | H | 98.5 | Very high | 98.3 | Very high | 46 Ų | 46 | 36.9 Ų | 36.9 | 21% | 0.213 | 19% | 0.187 | C | C | . | . | S | Bend | trans | -101.9 | 133.6 | 177.3 | -168.6 | -100.2 | 0 | 0 | 0 | 111 | L1196 L1197 S1198 Y1202 G1203 C1204 | L1196-H1200 PolarHBondContact O-N 3.46Å; L1197-H1200 VanDerWaalsContact O-CB 3.29Å; L1197-H1200 WeakPolarHBondContact O-CB 3.32Å; L1197-H1200 PolarHBondContact O-N 3Å; L1197-H1200 VanDerWaalsContact O-N 3.09Å; S1198-H1200 VanDerWaalsContact C-N 3.28Å; S1198-H1200 PolarHBondContact O-N 3.09Å; H1200-Y1202 AromaticContact CE1-CD2 3.75Å; H1200-Y1202 PolarHBondContact ND1-N 3.1Å; H1200-Y1202 PolarHBondContact O-N 3.42Å; H1200-G1203 PolarHBondContact ND1-N 2.7Å; H1200-G1203 PolarHBondContact O-N 3.47Å; H1200-C1204 PolarHBondContact O-N 3.28Å; H1200-C1204 PolarHBondContact O-SG 3.39Å; H1200-C1204 VanDerWaalsContact O-SG 3.41Å |
| 1201 | P | 98.3 | Very high | 98.3 | Very high | 37 Ų | 37 | 38.4 Ų | 38.4 | 24% | 0.24 | 20% | 0.195 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -54.4 | -28.3 | -175.5 | 17.9 | -32.5 | 0 | 0 | 0 | 115.1 | Y1238 | P1201-Y1238 HydrophobicContact CB-CD1 4.24Å; P1201-Y1238 HydrophobicContact CB-CD2 4.39Å; P1201-Y1238 HydrophobicContact CB-CE1 3.76Å; P1201-Y1238 HydrophobicContact CB-CE2 3.93Å; P1201-Y1238 HydrophobicContact CG-CE2 4.25Å |
| 1202 | Y | 98.5 | Very high | 98.4 | Very high | 72 Ų | 72 | 35.1 Ų | 35.1 | 28% | 0.282 | 19% | 0.186 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -105.3 | -27.3 | 177.4 | -48.1 | -32.4 | 0 | 0 | 0 | 112.6 | V1162 Q1165 N1168 H1200 R1205 V1206 | V1162-Y1202 WeakPolarHBondContact O-CB 3.43Å; Q1165-Y1202 HydrophobicContact CB-CE2 3.93Å; N1168-Y1202 HydrophobicContact CB-CG 4.38Å; H1200-Y1202 AromaticContact CE1-CD2 3.75Å; H1200-Y1202 PolarHBondContact ND1-N 3.1Å; H1200-Y1202 PolarHBondContact O-N 3.42Å; Y1202-R1205 PolarHBondContact O-N 2.86Å; Y1202-V1206 PolarHBondContact O-N 3.12Å |
| 1203 | G | 98.6 | Very high | 98.5 | Very high | 0 Ų | 0 | 35.8 Ų | 35.8 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -72.8 | -35.7 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112 | L1197 H1200 R1205 V1206 I1207 | L1197-G1203 CarbonylContact O-C 3.55Å; L1197-G1203 WeakPolarHBondContact O-CA 3.2Å; H1200-G1203 PolarHBondContact ND1-N 2.7Å; H1200-G1203 PolarHBondContact O-N 3.47Å; G1203-R1205 PolarHBondContact O-N 3.45Å; G1203-V1206 PolarHBondContact O-N 2.75Å; G1203-V1206 VanDerWaalsContact O-N 3.15Å; G1203-I1207 WeakPolarHBondContact O-CG1 3.29Å; G1203-I1207 PolarHBondContact O-N 2.88Å |
| 1204 | C | 98.6 | Very high | 98.5 | Very high | 7 Ų | 7 | 34.7 Ų | 34.7 | 5% | 0.047 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -58.4 | -32.6 | 175.1 | 67.9 | 0 | 0 | 0 | 0 | 112.5 | L1197 S1198 H1200 Q1208 V1242 | L1197-C1204 PolarHBondContact O-N 2.84Å; S1198-C1204 WeakPolarHBondContact O-CB 3.37Å; H1200-C1204 PolarHBondContact O-N 3.28Å; H1200-C1204 PolarHBondContact O-SG 3.39Å; H1200-C1204 VanDerWaalsContact O-SG 3.41Å; C1204-Q1208 WeakPolarHBondContact O-CG 3.4Å; C1204-Q1208 PolarHBondContact O-N 3.18Å; C1204-Q1208 PolarHBondContact O-NE2 3.45Å; C1204-V1242 HydrophobicContact CB-CG2 3.79Å |
| 1205 | R | 98.7 | Very high | 98.4 | Very high | 99 Ų | 99 | 37.9 Ų | 37.9 | 37% | 0.374 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -73.1 | -41 | 178.5 | -54.4 | -178.8 | 175.6 | -177.1 | -7.4 | 111.5 | Y1202 G1203 Q1208 R1209 | Y1202-R1205 PolarHBondContact O-N 2.86Å; G1203-R1205 PolarHBondContact O-N 3.45Å; R1205-Q1208 PolarHBondContact O-N 2.72Å; R1205-R1209 PolarHBondContact O-N 2.88Å; R1205-R1209 VanDerWaalsContact O-N 3.11Å |
| 1206 | V | 98.7 | Very high | 98.4 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -67 | -39.9 | 175.2 | -178 | 0 | 0 | 0 | 0 | 111 | V1162 N1168 I1171 Q1172 I1175 F1190 Y1202 G1203 Q1208 R1209 I1210 | V1162-V1206 HydrophobicContact CG1-CG2 4.26Å; V1162-V1206 HydrophobicContact CG2-CG1 4.27Å; V1162-V1206 HydrophobicContact CG2-CG2 4.3Å; N1168-V1206 HydrophobicContact CB-CG2 4.46Å; I1171-V1206 HydrophobicContact CG2-CG1 3.68Å; I1171-V1206 HydrophobicContact CG2-CG2 4.24Å; Q1172-V1206 HydrophobicContact CG-CG2 3.98Å; I1175-V1206 HydrophobicContact CD1-CG1 3.77Å; F1190-V1206 HydrophobicContact CE1-CG1 4.44Å; F1190-V1206 HydrophobicContact CE2-CG1 3.72Å; F1190-V1206 HydrophobicContact CZ-CB 3.83Å; F1190-V1206 HydrophobicContact CZ-CG1 3.38Å; Y1202-V1206 PolarHBondContact O-N 3.12Å; G1203-V1206 PolarHBondContact O-N 2.75Å; G1203-V1206 VanDerWaalsContact O-N 3.15Å; V1206-Q1208 VanDerWaalsContact C-N 3.31Å; V1206-Q1208 PolarHBondContact O-N 2.99Å; V1206-R1209 PolarHBondContact O-N 3.19Å; V1206-I1210 HydrophobicContact CG1-CD1 4.13Å; V1206-I1210 WeakPolarHBondContact O-CG1 3.16Å; V1206-I1210 PolarHBondContact O-N 3.24Å |
| 1207 | I | 98.6 | Very high | 98.4 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -56.2 | -45.9 | 172.2 | -68.2 | -69.4 | 0 | 0 | 0 | 111 | F1190 V1194 G1203 I1210 L1211 I1222 L1226 V1242 | F1190-I1207 HydrophobicContact CD1-CD1 3.39Å; F1190-I1207 HydrophobicContact CD1-CG1 4.3Å; F1190-I1207 HydrophobicContact CE1-CD1 3.41Å; F1190-I1207 VanDerWaalsContact CE1-CD1 3.41Å; F1190-I1207 HydrophobicContact CE1-CG1 3.83Å; V1194-I1207 HydrophobicContact CG1-CD1 3.97Å; G1203-I1207 WeakPolarHBondContact O-CG1 3.29Å; G1203-I1207 PolarHBondContact O-N 2.88Å; I1207-I1210 WeakPolarHBondContact O-CB 3.44Å; I1207-I1210 PolarHBondContact O-N 2.91Å; I1207-L1211 HydrophobicContact CG2-CD1 3.93Å; I1207-L1211 HydrophobicContact CG2-CG 4.35Å; I1207-L1211 WeakPolarHBondContact O-CG 3.27Å; I1207-L1211 PolarHBondContact O-N 2.77Å; I1207-I1222 HydrophobicContact CD1-CG2 3.89Å; I1207-L1226 HydrophobicContact CG2-CD1 4.4Å; I1207-V1242 HydrophobicContact CB-CG2 4.48Å; I1207-V1242 HydrophobicContact CG2-CG1 3.55Å; I1207-V1242 HydrophobicContact CG2-CG2 4.26Å |
| 1208 | Q | 98.7 | Very high | 98.3 | Very high | 37 Ų | 37 | 41.8 Ų | 41.8 | 17% | 0.173 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.2 | -47.1 | 178.2 | -75.6 | 163.1 | 87.6 | 0 | 0 | 111.8 | C1204 R1205 V1206 I1210 L1211 E1212 H1245 | C1204-Q1208 WeakPolarHBondContact O-CG 3.4Å; C1204-Q1208 PolarHBondContact O-N 3.18Å; C1204-Q1208 PolarHBondContact O-NE2 3.45Å; R1205-Q1208 PolarHBondContact O-N 2.72Å; V1206-Q1208 VanDerWaalsContact C-N 3.31Å; V1206-Q1208 PolarHBondContact O-N 2.99Å; Q1208-I1210 VanDerWaalsContact C-N 3.3Å; Q1208-I1210 PolarHBondContact O-N 3.14Å; Q1208-L1211 PolarHBondContact O-N 2.75Å; Q1208-L1211 VanDerWaalsContact O-N 3.13Å; Q1208-E1212 WeakPolarHBondContact O-CB 3.46Å; Q1208-E1212 VanDerWaalsContact O-CG 3.24Å; Q1208-E1212 WeakPolarHBondContact O-CG 3.24Å; Q1208-E1212 PolarHBondContact O-N 3.14Å; Q1208-H1245 HydrophobicContact CG-CB 4.09Å |
| 1209 | R | 98.7 | Very high | 98.3 | Very high | 49 Ų | 49 | 42.6 Ų | 42.6 | 19% | 0.185 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -58.4 | -39.4 | 173.5 | -64.1 | -56.1 | 83.1 | 71.4 | -0.1 | 112.8 | Q1172 I1175 R1205 V1206 E1212 H1213 | Q1172-R1209 HydrophobicContact CB-CG 3.81Å; Q1172-R1209 HydrophobicContact CG-CG 3.62Å; I1175-R1209 HydrophobicContact CB-CB 4.13Å; I1175-R1209 HydrophobicContact CD1-CB 4.11Å; I1175-R1209 HydrophobicContact CG2-CB 3.81Å; I1175-R1209 WeakPolarHBondContact CG2-O 3.49Å; R1205-R1209 PolarHBondContact O-N 2.88Å; R1205-R1209 VanDerWaalsContact O-N 3.11Å; V1206-R1209 PolarHBondContact O-N 3.19Å; R1209-E1212 IonicContact CZ-OE1 3.7Å; R1209-E1212 IonicContact CZ-OE2 3.46Å; R1209-E1212 IonicContact NE-OE1 3.9Å; R1209-E1212 IonicContact NE-OE2 3.5Å; R1209-E1212 PolarHBondContact NE-OE2 3.45Å; R1209-E1212 IonicContact NH2-OE1 3.4Å; R1209-E1212 PolarHBondContact NH2-OE1 3.04Å; R1209-E1212 IonicContact NH2-OE2 2.59Å; R1209-E1212 PolarHBondContact NH2-OE2 3.2Å; R1209-E1212 PolarHBondContact O-N 3.24Å; R1209-H1213 PolarHBondContact O-CD2 3.03Å; R1209-H1213 PolarHBondContact O-N 3.31Å |
| 1210 | I | 98.6 | Very high | 98.3 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61.1 | -45.8 | 176 | -69.8 | 168.5 | 0 | 0 | 0 | 110.6 | I1175 I1186 I1187 F1190 V1206 I1207 Q1208 E1212 C1214 T1219 I1222 | I1175-I1210 HydrophobicContact CD1-CG1 3.76Å; I1186-I1210 HydrophobicContact CG2-CD1 4.43Å; I1187-I1210 HydrophobicContact CD1-CD1 4.24Å; I1187-I1210 HydrophobicContact CD1-CG1 4.17Å; I1187-I1210 HydrophobicContact CD1-CG2 3.59Å; F1190-I1210 HydrophobicContact CD1-CD1 4.43Å; F1190-I1210 HydrophobicContact CD2-CD1 3.92Å; F1190-I1210 HydrophobicContact CE1-CD1 4.38Å; F1190-I1210 HydrophobicContact CE2-CD1 3.87Å; F1190-I1210 HydrophobicContact CG-CD1 4.21Å; F1190-I1210 HydrophobicContact CZ-CD1 4.12Å; V1206-I1210 HydrophobicContact CG1-CD1 4.13Å; V1206-I1210 WeakPolarHBondContact O-CG1 3.16Å; V1206-I1210 PolarHBondContact O-N 3.24Å; I1207-I1210 WeakPolarHBondContact O-CB 3.44Å; I1207-I1210 PolarHBondContact O-N 2.91Å; Q1208-I1210 VanDerWaalsContact C-N 3.3Å; Q1208-I1210 PolarHBondContact O-N 3.14Å; I1210-E1212 VanDerWaalsContact C-N 3.28Å; I1210-E1212 PolarHBondContact O-N 3.37Å; I1210-C1214 HydrophobicContact CG2-CB 4.21Å; I1210-C1214 VanDerWaalsContact O-CB 3.23Å; I1210-C1214 WeakPolarHBondContact O-CB 3.46Å; I1210-C1214 PolarHBondContact O-N 3.26Å; I1210-T1219 HydrophobicContact CG2-CG2 4.35Å; I1210-T1219 VanDerWaalsContact O-CG2 3.24Å; I1210-T1219 WeakPolarHBondContact O-CG2 3.36Å; I1210-I1222 HydrophobicContact CG2-CG1 4.2Å |
| 1211 | L | 98.4 | Very high | 98.2 | Very high | 33 Ų | 33 | 44.4 Ų | 44.4 | 17% | 0.173 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -68.4 | -25.4 | 179.2 | -65.4 | 174.7 | 0 | 0 | 0 | 113.3 | I1207 Q1208 T1219 L1223 L1226 V1246 | I1207-L1211 HydrophobicContact CG2-CD1 3.93Å; I1207-L1211 HydrophobicContact CG2-CG 4.35Å; I1207-L1211 WeakPolarHBondContact O-CG 3.27Å; I1207-L1211 PolarHBondContact O-N 2.77Å; Q1208-L1211 PolarHBondContact O-N 2.75Å; Q1208-L1211 VanDerWaalsContact O-N 3.13Å; L1211-T1219 HydrophobicContact CD2-CG2 4.38Å; L1211-L1223 HydrophobicContact CD2-CD1 4.43Å; L1211-L1223 HydrophobicContact CD2-CD2 3.83Å; L1211-L1223 HydrophobicContact CD2-CG 3.88Å; L1211-L1226 HydrophobicContact CD1-CD1 4.21Å; L1211-V1246 HydrophobicContact CD1-CG2 3.81Å |
| 1212 | E | 98.1 | Very high | 98.3 | Very high | 82 Ų | 82 | 42.7 Ų | 42.7 | 38% | 0.383 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -85.5 | -33.3 | -179.9 | -72 | 161.9 | -160.6 | 0 | 0 | 114.2 | Q1208 R1209 I1210 H1245 | Q1208-E1212 WeakPolarHBondContact O-CB 3.46Å; Q1208-E1212 VanDerWaalsContact O-CG 3.24Å; Q1208-E1212 WeakPolarHBondContact O-CG 3.24Å; Q1208-E1212 PolarHBondContact O-N 3.14Å; R1209-E1212 IonicContact CZ-OE1 3.7Å; R1209-E1212 IonicContact CZ-OE2 3.46Å; R1209-E1212 IonicContact NE-OE1 3.9Å; R1209-E1212 IonicContact NE-OE2 3.5Å; R1209-E1212 PolarHBondContact NE-OE2 3.45Å; R1209-E1212 IonicContact NH2-OE1 3.4Å; R1209-E1212 PolarHBondContact NH2-OE1 3.04Å; R1209-E1212 IonicContact NH2-OE2 2.59Å; R1209-E1212 PolarHBondContact NH2-OE2 3.2Å; R1209-E1212 PolarHBondContact O-N 3.24Å; I1210-E1212 VanDerWaalsContact C-N 3.28Å; I1210-E1212 PolarHBondContact O-N 3.37Å; E1212-H1245 WeakPolarHBondContact CG-CE1 3.4Å; E1212-H1245 IonicContact OE1-CE1 3.89Å; E1212-H1245 PolarHBondContact OE1-CE1 3.15Å; E1212-H1245 IonicContact OE1-ND1 3.32Å; E1212-H1245 IonicContact OE1-NE2 2.67Å |
| 1213 | H | 97.9 | Very high | 98.3 | Very high | 81 Ų | 81 | 40 Ų | 40 | 38% | 0.375 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -122.8 | -19.1 | -167.5 | -61.4 | -70.9 | 0 | 0 | 0 | 115.6 | I1175 P1180 R1209 | I1175-H1213 HydrophobicContact CG2-CB 3.76Å; P1180-H1213 VanDerWaalsContact CG-O 3.27Å; P1180-H1213 WeakPolarHBondContact CG-O 3.4Å; R1209-H1213 PolarHBondContact O-CD2 3.03Å; R1209-H1213 PolarHBondContact O-N 3.31Å |
| 1214 | C | 98 | Very high | 98.2 | Very high | 14 Ų | 14 | 42.3 Ų | 42.3 | 10% | 0.095 | 21% | 0.208 | C | C | . | . | S | Bend | trans | -88.2 | 158.5 | -177.4 | -61.6 | 0 | 0 | 0 | 0 | 112.3 | I1187 I1210 Q1218 T1219 | I1187-C1214 HydrophobicContact CD1-CB 4.28Å; I1210-C1214 HydrophobicContact CG2-CB 4.21Å; I1210-C1214 VanDerWaalsContact O-CB 3.23Å; I1210-C1214 WeakPolarHBondContact O-CB 3.46Å; I1210-C1214 PolarHBondContact O-N 3.26Å; C1214-Q1218 HydrophobicContact CB-CB 3.96Å; C1214-T1219 HydrophobicContact CB-CG2 4.03Å |
| 1215 | L | 98 | Very high | 98.2 | Very high | 67 Ų | 67 | 43.5 Ų | 43.5 | 35% | 0.351 | 21% | 0.213 | S | C | . | . | trans | -65.9 | 155.5 | -175 | -58.2 | 171 | 0 | 0 | 0 | 112.1 | P1180 E1217 Q1218 T1219 | P1180-L1215 HydrophobicContact CB-CD1 4.31Å; P1180-L1215 HydrophobicContact CB-CD2 4.29Å; P1180-L1215 HydrophobicContact CB-CG 3.83Å; L1215-E1217 VanDerWaalsContact C-N 3.26Å; L1215-E1217 HydrophobicContact CB-CG 4.14Å; L1215-E1217 PolarHBondContact O-N 2.78Å; L1215-Q1218 HydrophobicContact CB-CB 4.5Å; L1215-Q1218 HydrophobicContact CB-CG 4.23Å; L1215-Q1218 CarbonylContact O-C 3.36Å; L1215-Q1218 WeakPolarHBondContact O-CA 3.28Å; L1215-Q1218 WeakPolarHBondContact O-CB 3.36Å; L1215-Q1218 PolarHBondContact O-N 3.36Å; L1215-T1219 PolarHBondContact O-N 2.97Å; L1215-T1219 PolarHBondContact O-OG1 3.49Å | ||
| 1216 | P | 97.5 | Very high | 98.2 | Very high | 95 Ų | 95 | 39 Ų | 39 | 62% | 0.617 | 20% | 0.196 | S | C | * | . | H | α-helix | trans | -51.9 | -40.4 | 178.3 | -28.7 | 36.7 | 0 | 0 | 0 | 114.1 | Q1218 T1219 R1220 | P1216-Q1218 VanDerWaalsContact C-N 3.27Å; P1216-Q1218 PolarHBondContact O-N 2.76Å; P1216-T1219 WeakPolarHBondContact CA-OG1 3.45Å; P1216-T1219 PolarHBondContact O-N 2.76Å; P1216-T1219 PolarHBondContact O-OG1 3.27Å; P1216-R1220 VanDerWaalsContact O-CB 3.24Å; P1216-R1220 WeakPolarHBondContact O-CB 3.38Å; P1216-R1220 PolarHBondContact O-N 3.43Å |
| 1217 | E | 97.4 | Very high | 98.2 | Very high | 128 Ų | 128 | 40.3 Ų | 40.3 | 60% | 0.598 | 20% | 0.202 | S | C | * | . | H | α-helix | trans | -67.1 | -24.2 | 175.7 | 59 | -90.8 | -145.9 | 0 | 0 | 113.7 | L1215 P1221 | L1215-E1217 VanDerWaalsContact C-N 3.26Å; L1215-E1217 HydrophobicContact CB-CG 4.14Å; L1215-E1217 PolarHBondContact O-N 2.78Å; E1217-P1221 VanDerWaalsContact O-CD 3.25Å; E1217-P1221 WeakPolarHBondContact O-CD 3.06Å |
| 1218 | Q | 98 | Very high | 98.1 | Very high | 6 Ų | 6 | 48.4 Ų | 48.4 | 3% | 0.028 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -85.6 | -36 | 174.6 | -67.6 | 177.4 | -37.6 | 0 | 0 | 111.8 | P1180 D1184 I1187 C1214 L1215 P1216 P1221 | P1180-Q1218 PolarHBondContact O-NE2 3.03Å; D1184-Q1218 PolarHBondContact OD1-NE2 2.71Å; I1187-Q1218 HydrophobicContact CD1-CB 4.17Å; I1187-Q1218 HydrophobicContact CG1-CB 4Å; I1187-Q1218 HydrophobicContact CG1-CG 4.24Å; I1187-Q1218 HydrophobicContact CG2-CB 4.48Å; I1187-Q1218 WeakPolarHBondContact CG2-O 3.33Å; C1214-Q1218 HydrophobicContact CB-CB 3.96Å; L1215-Q1218 HydrophobicContact CB-CB 4.5Å; L1215-Q1218 HydrophobicContact CB-CG 4.23Å; L1215-Q1218 CarbonylContact O-C 3.36Å; L1215-Q1218 WeakPolarHBondContact O-CA 3.28Å; L1215-Q1218 WeakPolarHBondContact O-CB 3.36Å; L1215-Q1218 PolarHBondContact O-N 3.36Å; P1216-Q1218 VanDerWaalsContact C-N 3.27Å; P1216-Q1218 PolarHBondContact O-N 2.76Å; Q1218-P1221 WeakPolarHBondContact O-CD 3.36Å; Q1218-P1221 WeakPolarHBondContact O-CG 3.39Å |
| 1219 | T | 98.2 | Very high | 98 | Very high | 16 Ų | 16 | 47 Ų | 47 | 10% | 0.098 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -82.9 | -34.2 | -178.7 | 57 | 0 | 0 | 0 | 0 | 113.2 | I1210 L1211 C1214 L1215 P1216 I1222 L1223 | I1210-T1219 HydrophobicContact CG2-CG2 4.35Å; I1210-T1219 VanDerWaalsContact O-CG2 3.24Å; I1210-T1219 WeakPolarHBondContact O-CG2 3.36Å; L1211-T1219 HydrophobicContact CD2-CG2 4.38Å; C1214-T1219 HydrophobicContact CB-CG2 4.03Å; L1215-T1219 PolarHBondContact O-N 2.97Å; L1215-T1219 PolarHBondContact O-OG1 3.49Å; P1216-T1219 WeakPolarHBondContact CA-OG1 3.45Å; P1216-T1219 PolarHBondContact O-N 2.76Å; P1216-T1219 PolarHBondContact O-OG1 3.27Å; T1219-I1222 WeakPolarHBondContact O-CA 3.43Å; T1219-I1222 WeakPolarHBondContact O-CB 3.5Å; T1219-I1222 PolarHBondContact O-N 3.28Å; T1219-L1223 PolarHBondContact O-N 3.25Å |
| 1220 | R | 97.8 | Very high | 98 | Very high | 70 Ų | 70 | 44.9 Ų | 44.9 | 26% | 0.264 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -48.2 | -51.2 | 176.3 | -172 | 69.9 | -94.5 | 147.1 | -7.6 | 114.4 | P1216 I1222 L1223 D1224 D1254 | P1216-R1220 VanDerWaalsContact O-CB 3.24Å; P1216-R1220 WeakPolarHBondContact O-CB 3.38Å; P1216-R1220 PolarHBondContact O-N 3.43Å; R1220-I1222 VanDerWaalsContact C-N 3.26Å; R1220-I1222 PolarHBondContact O-N 2.86Å; R1220-L1223 PolarHBondContact O-N 3.03Å; R1220-D1224 IonicContact CZ-OD1 3.34Å; R1220-D1224 IonicContact CZ-OD2 3.35Å; R1220-D1224 IonicContact NE-OD1 3.2Å; R1220-D1224 PolarHBondContact NE-OD1 3.36Å; R1220-D1224 IonicContact NE-OD2 2.69Å; R1220-D1224 PolarHBondContact NE-OD2 2.97Å; R1220-D1224 IonicContact NH2-OD1 2.77Å; R1220-D1224 PolarHBondContact NH2-OD1 3.4Å; R1220-D1224 IonicContact NH2-OD2 2.7Å; R1220-D1224 PolarHBondContact O-N 3.34Å; R1220-D1254 IonicContact CZ-OD1 3.01Å; R1220-D1254 IonicContact NH1-OD1 2.75Å; R1220-D1254 PolarHBondContact NH1-OD1 3.15Å; R1220-D1254 IonicContact NH1-OD2 2.71Å; R1220-D1254 PolarHBondContact NH1-OD2 3.27Å; R1220-D1254 IonicContact NH2-OD1 2.88Å; R1220-D1254 PolarHBondContact NH2-OD1 3.47Å |
| 1221 | P | 97.8 | Very high | 97.9 | Very high | 40 Ų | 40 | 49 Ų | 49 | 26% | 0.26 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -66.3 | -25.6 | 177.9 | 26.4 | -35.9 | 0 | 0 | 0 | 113.7 | E1217 Q1218 E1225 | E1217-P1221 VanDerWaalsContact O-CD 3.25Å; E1217-P1221 WeakPolarHBondContact O-CD 3.06Å; Q1218-P1221 WeakPolarHBondContact O-CD 3.36Å; Q1218-P1221 WeakPolarHBondContact O-CG 3.39Å; P1221-E1225 PolarHBondContact O-N 2.93Å |
| 1222 | I | 98.5 | Very high | 97.9 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -72.5 | -47.9 | 173.3 | -54.4 | -61.6 | 0 | 0 | 0 | 109.5 | I1187 F1190 V1194 I1207 I1210 T1219 R1220 D1224 E1225 L1226 | I1187-I1222 HydrophobicContact CG2-CD1 4.32Å; I1187-I1222 HydrophobicContact CG2-CG1 4.47Å; F1190-I1222 HydrophobicContact CB-CD1 3.78Å; V1194-I1222 HydrophobicContact CG1-CG2 3.75Å; V1194-I1222 HydrophobicContact CG2-CD1 3.8Å; V1194-I1222 HydrophobicContact CG2-CG2 4.31Å; I1207-I1222 HydrophobicContact CD1-CG2 3.89Å; I1210-I1222 HydrophobicContact CG2-CG1 4.2Å; T1219-I1222 WeakPolarHBondContact O-CA 3.43Å; T1219-I1222 WeakPolarHBondContact O-CB 3.5Å; T1219-I1222 PolarHBondContact O-N 3.28Å; R1220-I1222 VanDerWaalsContact C-N 3.26Å; R1220-I1222 PolarHBondContact O-N 2.86Å; I1222-D1224 PolarHBondContact O-N 3.28Å; I1222-E1225 PolarHBondContact O-N 2.92Å; I1222-E1225 VanDerWaalsContact O-N 3.14Å; I1222-L1226 HydrophobicContact CG2-CD1 4.29Å; I1222-L1226 WeakPolarHBondContact O-CG 3.3Å; I1222-L1226 PolarHBondContact O-N 3.29Å |
| 1223 | L | 98.6 | Very high | 97.9 | Very high | 15 Ų | 15 | 48.3 Ų | 48.3 | 8% | 0.079 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -58.3 | -44.6 | 175.8 | -70.4 | 164 | 0 | 0 | 0 | 111.9 | L1211 T1219 R1220 E1225 L1226 H1227 V1246 | L1211-L1223 HydrophobicContact CD2-CD1 4.43Å; L1211-L1223 HydrophobicContact CD2-CD2 3.83Å; L1211-L1223 HydrophobicContact CD2-CG 3.88Å; T1219-L1223 PolarHBondContact O-N 3.25Å; R1220-L1223 PolarHBondContact O-N 3.03Å; L1223-E1225 PolarHBondContact O-N 2.89Å; L1223-L1226 HydrophobicContact CD2-CD1 4.34Å; L1223-L1226 WeakPolarHBondContact O-CB 3.4Å; L1223-L1226 PolarHBondContact O-N 2.82Å; L1223-H1227 PolarHBondContact O-CD2 3.41Å; L1223-H1227 PolarHBondContact O-N 3.25Å; L1223-V1246 HydrophobicContact CD2-CG1 4.05Å; L1223-V1246 HydrophobicContact CD2-CG2 3.85Å |
| 1224 | D | 98.2 | Very high | 98 | Very high | 50 Ų | 50 | 44.5 Ų | 44.5 | 27% | 0.267 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -71.4 | -10.9 | 178.4 | -70.1 | -41.1 | 0 | 0 | 0 | 114.6 | R1220 I1222 K1228 R1257 | R1220-D1224 IonicContact CZ-OD1 3.34Å; R1220-D1224 IonicContact CZ-OD2 3.35Å; R1220-D1224 IonicContact NE-OD1 3.2Å; R1220-D1224 PolarHBondContact NE-OD1 3.36Å; R1220-D1224 IonicContact NE-OD2 2.69Å; R1220-D1224 PolarHBondContact NE-OD2 2.97Å; R1220-D1224 IonicContact NH2-OD1 2.77Å; R1220-D1224 PolarHBondContact NH2-OD1 3.4Å; R1220-D1224 IonicContact NH2-OD2 2.7Å; R1220-D1224 PolarHBondContact O-N 3.34Å; I1222-D1224 PolarHBondContact O-N 3.28Å; D1224-K1228 WeakPolarHBondContact O-CD 3.46Å; D1224-K1228 WeakPolarHBondContact O-CE 3.06Å; D1224-K1228 WeakPolarHBondContact O-CG 3.46Å; D1224-K1228 PolarHBondContact O-NZ 3.45Å; D1224-R1257 IonicContact OD1-CZ 3.54Å; D1224-R1257 IonicContact OD1-NH1 2.74Å; D1224-R1257 PolarHBondContact OD1-NH1 2.89Å; D1224-R1257 IonicContact OD1-NH2 3.02Å; D1224-R1257 PolarHBondContact OD1-NH2 2.87Å |
| 1225 | E | 98.2 | Very high | 98 | Very high | 31 Ų | 31 | 47.7 Ų | 47.7 | 15% | 0.145 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -92.6 | -37.6 | 166.2 | -158.2 | 179.3 | 131.3 | 0 | 0 | 112 | G1192 Q1193 V1194 V1195 P1221 I1222 L1223 H1227 K1228 G1229 | G1192-E1225 VanDerWaalsContact C-OE1 3.27Å; G1192-E1225 WeakPolarHBondContact CA-OE2 3.48Å; G1192-E1225 PolarHBondContact N-OE2 2.92Å; Q1193-E1225 PolarHBondContact N-OE1 3.49Å; Q1193-E1225 VanDerWaalsContact N-OE1 3.14Å; V1194-E1225 HydrophobicContact CB-CB 3.83Å; V1194-E1225 HydrophobicContact CB-CG 3.9Å; V1194-E1225 WeakPolarHBondContact CB-OE1 3.45Å; V1194-E1225 HydrophobicContact CG1-CB 4.28Å; V1194-E1225 HydrophobicContact CG2-CB 3.92Å; V1194-E1225 HydrophobicContact CG2-CG 4.22Å; V1194-E1225 PolarHBondContact N-OE1 3.27Å; V1195-E1225 HydrophobicContact CG2-CG 4.47Å; P1221-E1225 PolarHBondContact O-N 2.93Å; I1222-E1225 PolarHBondContact O-N 2.92Å; I1222-E1225 VanDerWaalsContact O-N 3.14Å; L1223-E1225 PolarHBondContact O-N 2.89Å; E1225-H1227 VanDerWaalsContact C-N 3.29Å; E1225-H1227 PolarHBondContact O-N 3.02Å; E1225-K1228 WeakPolarHBondContact O-CB 3.4Å; E1225-K1228 PolarHBondContact O-N 3.21Å; E1225-K1228 VanDerWaalsContact O-N 3.14Å; E1225-G1229 PolarHBondContact O-N 2.8Å |
| 1226 | L | 98.4 | Very high | 98 | Very high | 4 Ų | 4 | 45.7 Ų | 45.7 | 2% | 0.021 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -55.3 | -43.8 | 169.6 | -71.3 | 171.7 | 0 | 0 | 0 | 111.9 | V1194 S1198 I1207 L1211 I1222 L1223 K1228 G1229 V1230 L1233 V1242 V1246 | V1194-L1226 HydrophobicContact CG1-CD2 3.76Å; V1194-L1226 HydrophobicContact CG1-CG 3.75Å; S1198-L1226 VanDerWaalsContact OG-CD2 3.24Å; S1198-L1226 WeakPolarHBondContact OG-CD2 3.43Å; I1207-L1226 HydrophobicContact CG2-CD1 4.4Å; L1211-L1226 HydrophobicContact CD1-CD1 4.21Å; I1222-L1226 HydrophobicContact CG2-CD1 4.29Å; I1222-L1226 WeakPolarHBondContact O-CG 3.3Å; I1222-L1226 PolarHBondContact O-N 3.29Å; L1223-L1226 HydrophobicContact CD2-CD1 4.34Å; L1223-L1226 WeakPolarHBondContact O-CB 3.4Å; L1223-L1226 PolarHBondContact O-N 2.82Å; L1226-K1228 PolarHBondContact O-N 3.1Å; L1226-G1229 CarbonylContact O-C 3.09Å; L1226-G1229 WeakPolarHBondContact O-CA 3.29Å; L1226-G1229 PolarHBondContact O-N 2.8Å; L1226-V1230 WeakPolarHBondContact O-CG2 3.25Å; L1226-V1230 PolarHBondContact O-N 3.3Å; L1226-V1230 VanDerWaalsContact O-N 3.17Å; L1226-L1233 HydrophobicContact CD2-CD1 3.7Å; L1226-V1242 HydrophobicContact CD1-CG1 3.89Å; L1226-V1242 HydrophobicContact CD2-CG1 3.66Å; L1226-V1242 HydrophobicContact CG-CG1 4.47Å; L1226-V1246 HydrophobicContact CD1-CG2 4.37Å |
| 1227 | H | 98.4 | Very high | 98.1 | Very high | 28 Ų | 28 | 45.1 Ų | 45.1 | 13% | 0.13 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -59.7 | -27.1 | 178.4 | -79.1 | -57 | 0 | 0 | 0 | 114 | L1223 E1225 G1229 D1254 R1257 | L1223-H1227 PolarHBondContact O-CD2 3.41Å; L1223-H1227 PolarHBondContact O-N 3.25Å; E1225-H1227 VanDerWaalsContact C-N 3.29Å; E1225-H1227 PolarHBondContact O-N 3.02Å; H1227-G1229 VanDerWaalsContact C-N 3.33Å; H1227-D1254 IonicContact CD2-OD1 3.74Å; H1227-D1254 PolarHBondContact CE1-O 3.35Å; H1227-D1254 IonicContact CE1-OD1 3.89Å; H1227-D1254 IonicContact NE2-OD1 3.65Å; H1227-D1254 PolarHBondContact NE2-OD1 2.98Å; H1227-R1257 PolarHBondContact CD2-NH2 3.24Å; H1227-R1257 VanDerWaalsContact CE1-CB 3.46Å; H1227-R1257 WeakPolarHBondContact CE1-CB 3.34Å |
| 1228 | K | 97.1 | Very high | 98.1 | Very high | 170 Ų | 170 | 41.7 Ų | 41.7 | 74% | 0.739 | 20% | 0.196 | S | C | * | . | H | α-helix | trans | -77.4 | -22.2 | 174.6 | -61.2 | 164.3 | -170.7 | 148 | 0 | 112.1 | D1224 E1225 L1226 | D1224-K1228 WeakPolarHBondContact O-CD 3.46Å; D1224-K1228 WeakPolarHBondContact O-CE 3.06Å; D1224-K1228 WeakPolarHBondContact O-CG 3.46Å; D1224-K1228 PolarHBondContact O-NZ 3.45Å; E1225-K1228 WeakPolarHBondContact O-CB 3.4Å; E1225-K1228 PolarHBondContact O-N 3.21Å; E1225-K1228 VanDerWaalsContact O-N 3.14Å; L1226-K1228 PolarHBondContact O-N 3.1Å |
| 1229 | G | 97.2 | Very high | 98.2 | Very high | 9 Ų | 9 | 41.4 Ų | 41.4 | 9% | 0.093 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -103.2 | -3.1 | -175.5 | 0 | 0 | 0 | 0 | 0 | 116 | E1225 L1226 H1227 E1231 H1232 L1233 | E1225-G1229 PolarHBondContact O-N 2.8Å; L1226-G1229 CarbonylContact O-C 3.09Å; L1226-G1229 WeakPolarHBondContact O-CA 3.29Å; L1226-G1229 PolarHBondContact O-N 2.8Å; H1227-G1229 VanDerWaalsContact C-N 3.33Å; G1229-E1231 VanDerWaalsContact C-N 3.34Å; G1229-E1231 PolarHBondContact O-N 2.98Å; G1229-E1231 VanDerWaalsContact O-N 3.15Å; G1229-H1232 WeakPolarHBondContact O-CB 3.09Å; G1229-H1232 PolarHBondContact O-N 2.81Å; G1229-L1233 WeakPolarHBondContact O-CG 3.33Å; G1229-L1233 PolarHBondContact O-N 3.22Å |
| 1230 | V | 98.3 | Very high | 98.2 | Very high | 3 Ų | 3 | 40.7 Ų | 40.7 | 2% | 0.018 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -47.9 | -49.8 | -168.4 | 179.5 | 0 | 0 | 0 | 0 | 113 | L1226 H1232 L1233 V1234 I1243 I1258 N1261 | L1226-V1230 WeakPolarHBondContact O-CG2 3.25Å; L1226-V1230 PolarHBondContact O-N 3.3Å; L1226-V1230 VanDerWaalsContact O-N 3.17Å; V1230-H1232 VanDerWaalsContact C-N 3.27Å; V1230-H1232 PolarHBondContact O-N 3.07Å; V1230-L1233 PolarHBondContact O-N 2.93Å; V1230-L1233 VanDerWaalsContact O-N 3.11Å; V1230-V1234 HydrophobicContact CG1-CG1 3.87Å; V1230-V1234 WeakPolarHBondContact O-CG1 3.4Å; V1230-V1234 WeakPolarHBondContact O-CG2 3.24Å; V1230-V1234 PolarHBondContact O-N 2.9Å; V1230-I1243 HydrophobicContact CG2-CD1 4.47Å; V1230-I1258 HydrophobicContact CG1-CG2 4.33Å; V1230-I1258 HydrophobicContact CG2-CG1 4.32Å; V1230-N1261 HydrophobicContact CB-CB 4.5Å; V1230-N1261 HydrophobicContact CG1-CB 4.07Å |
| 1231 | E | 96.7 | Very high | 98.3 | Very high | 88 Ų | 88 | 43.3 Ų | 43.3 | 41% | 0.411 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -58 | -36.1 | -178.7 | 168.6 | 156.7 | -158.5 | 0 | 0 | 113.9 | G1229 K1235 R1265 | G1229-E1231 VanDerWaalsContact C-N 3.34Å; G1229-E1231 PolarHBondContact O-N 2.98Å; G1229-E1231 VanDerWaalsContact O-N 3.15Å; E1231-K1235 WeakPolarHBondContact O-CD 3.36Å; E1231-K1235 WeakPolarHBondContact O-CE 3.4Å; E1231-K1235 IonicContact OE1-NZ 3.24Å; E1231-K1235 PolarHBondContact OE1-NZ 2.9Å; E1231-R1265 IonicContact OE1-NH1 3.69Å; E1231-R1265 PolarHBondContact OE1-NH1 3.17Å; E1231-R1265 VanDerWaalsContact OE1-NH1 3.08Å; E1231-R1265 IonicContact OE2-CZ 3.5Å; E1231-R1265 IonicContact OE2-NH1 2.64Å; E1231-R1265 PolarHBondContact OE2-NH1 2.99Å; E1231-R1265 IonicContact OE2-NH2 2.8Å |
| 1232 | H | 97.9 | Very high | 98.3 | Very high | 100 Ų | 100 | 41.4 Ų | 41.4 | 46% | 0.463 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -73.9 | -50.7 | 173.3 | 170.4 | 62.1 | 0 | 0 | 0 | 110.2 | S1199 G1229 V1230 V1234 K1235 D1236 | S1199-H1232 PolarHBondContact OG-CD2 2.89Å; S1199-H1232 PolarHBondContact OG-NE2 2.89Å; G1229-H1232 WeakPolarHBondContact O-CB 3.09Å; G1229-H1232 PolarHBondContact O-N 2.81Å; V1230-H1232 VanDerWaalsContact C-N 3.27Å; V1230-H1232 PolarHBondContact O-N 3.07Å; H1232-V1234 PolarHBondContact O-N 3.46Å; H1232-K1235 CarbonylContact O-C 3.54Å; H1232-K1235 PolarHBondContact O-N 3.47Å; H1232-D1236 PolarHBondContact O-N 3.47Å |
| 1233 | L | 98.7 | Very high | 98.3 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.1 | -38.3 | -171.9 | -66.6 | 173.2 | 0 | 0 | 0 | 113 | V1195 S1199 L1226 G1229 V1230 K1235 D1236 G1239 N1240 I1243 | V1195-L1233 HydrophobicContact CG1-CD1 4.42Å; V1195-L1233 HydrophobicContact CG1-CD2 4.08Å; V1195-L1233 HydrophobicContact CG1-CG 4.19Å; S1199-L1233 WeakPolarHBondContact OG-CD2 3.45Å; L1226-L1233 HydrophobicContact CD2-CD1 3.7Å; G1229-L1233 WeakPolarHBondContact O-CG 3.33Å; G1229-L1233 PolarHBondContact O-N 3.22Å; V1230-L1233 PolarHBondContact O-N 2.93Å; V1230-L1233 VanDerWaalsContact O-N 3.11Å; L1233-K1235 PolarHBondContact O-N 3.11Å; L1233-D1236 PolarHBondContact O-N 3.43Å; L1233-D1236 VanDerWaalsContact O-N 3.15Å; L1233-G1239 CarbonylContact O-C 3.29Å; L1233-N1240 WeakPolarHBondContact O-CA 3.47Å; L1233-N1240 PolarHBondContact O-N 3.35Å; L1233-I1243 HydrophobicContact CB-CD1 3.9Å; L1233-I1243 HydrophobicContact CB-CG1 3.76Å; L1233-I1243 HydrophobicContact CD1-CD1 4Å |
| 1234 | V | 98.7 | Very high | 98.3 | Very high | 1 Ų | 1 | 41.6 Ų | 41.6 | 1% | 0.006 | 19% | 0.189 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.7 | -21.1 | 177.1 | -58.7 | 0 | 0 | 0 | 0 | 113.5 | V1230 H1232 I1243 L1262 L1269 A1275 V1278 | V1230-V1234 HydrophobicContact CG1-CG1 3.87Å; V1230-V1234 WeakPolarHBondContact O-CG1 3.4Å; V1230-V1234 WeakPolarHBondContact O-CG2 3.24Å; V1230-V1234 PolarHBondContact O-N 2.9Å; H1232-V1234 PolarHBondContact O-N 3.46Å; V1234-I1243 HydrophobicContact CG1-CB 4.12Å; V1234-I1243 HydrophobicContact CG1-CG1 3.89Å; V1234-I1243 HydrophobicContact CG1-CG2 3.81Å; V1234-L1262 HydrophobicContact CG1-CD2 4.23Å; V1234-L1269 HydrophobicContact CG2-CD2 4.22Å; V1234-A1275 HydrophobicContact CB-CB 4.49Å; V1234-A1275 VanDerWaalsContact O-CA 3.28Å; V1234-A1275 WeakPolarHBondContact O-CA 3.48Å; V1234-A1275 VanDerWaalsContact O-CB 3.23Å; V1234-A1275 WeakPolarHBondContact O-CB 3.42Å; V1234-A1275 PolarHBondContact O-N 3.01Å; V1234-V1278 HydrophobicContact CB-CB 4.41Å; V1234-V1278 HydrophobicContact CB-CG1 4.22Å; V1234-V1278 HydrophobicContact CB-CG2 4.09Å; V1234-V1278 HydrophobicContact CG1-CB 4.43Å; V1234-V1278 HydrophobicContact CG1-CG1 3.74Å; V1234-V1278 HydrophobicContact CG1-CG2 4.26Å |
| 1235 | K | 98.6 | Very high | 98.4 | Very high | 81 Ų | 81 | 39.9 Ų | 39.9 | 35% | 0.352 | 18% | 0.179 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -97.7 | -13.7 | 177 | -57.7 | 170.2 | -164.1 | 163.7 | 0 | 112.3 | E1231 H1232 L1233 L1269 H1272 | E1231-K1235 WeakPolarHBondContact O-CD 3.36Å; E1231-K1235 WeakPolarHBondContact O-CE 3.4Å; E1231-K1235 IonicContact OE1-NZ 3.24Å; E1231-K1235 PolarHBondContact OE1-NZ 2.9Å; H1232-K1235 CarbonylContact O-C 3.54Å; H1232-K1235 PolarHBondContact O-N 3.47Å; L1233-K1235 PolarHBondContact O-N 3.11Å; K1235-L1269 HydrophobicContact CG-CD2 4.4Å; K1235-H1272 PolarHBondContact O-CE1 3.5Å; K1235-H1272 VanDerWaalsContact O-CE1 3.3Å |
| 1236 | D | 98.7 | Very high | 98.4 | Very high | 24 Ų | 24 | 38.6 Ų | 38.6 | 13% | 0.128 | 17% | 0.174 | C | C | . | . | S | Bend | trans | -78.3 | 147.5 | 179 | -178.1 | 62 | 0 | 0 | 0 | 112.7 | S1199 H1232 L1233 Y1238 G1239 N1240 | S1199-D1236 WeakPolarHBondContact CA-OD2 3.5Å; S1199-D1236 WeakPolarHBondContact CB-OD2 3.42Å; H1232-D1236 PolarHBondContact O-N 3.47Å; L1233-D1236 PolarHBondContact O-N 3.43Å; L1233-D1236 VanDerWaalsContact O-N 3.15Å; D1236-Y1238 VanDerWaalsContact C-N 3.26Å; D1236-Y1238 PolarHBondContact O-N 3.28Å; D1236-Y1238 WeakPolarHBondContact OD2-CA 3.5Å; D1236-Y1238 WeakPolarHBondContact OD2-CB 3.42Å; D1236-Y1238 PolarHBondContact OD2-N 3.46Å; D1236-G1239 PolarHBondContact OD2-N 2.95Å; D1236-N1240 WeakPolarHBondContact O-CB 3.31Å; D1236-N1240 PolarHBondContact O-N 2.86Å; D1236-N1240 PolarHBondContact O-ND2 3.4Å |
| 1237 | Q | 98.5 | Very high | 98.4 | Very high | 84 Ų | 84 | 38.4 Ų | 38.4 | 39% | 0.393 | 17% | 0.173 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.9 | -22 | -177.8 | 75.8 | -162.5 | -63.1 | 0 | 0 | 114.1 | N1240 Y1241 F1274 | Q1237-N1240 VanDerWaalsContact C-ND2 3.26Å; Q1237-N1240 PolarHBondContact O-ND2 3.17Å; Q1237-Y1241 WeakPolarHBondContact O-CE2 3.33Å; Q1237-F1274 HydrophobicContact CB-CD1 4.42Å; Q1237-F1274 HydrophobicContact CB-CD2 4.28Å; Q1237-F1274 HydrophobicContact CB-CE1 3.86Å; Q1237-F1274 HydrophobicContact CB-CE2 3.7Å; Q1237-F1274 HydrophobicContact CB-CZ 3.46Å; Q1237-F1274 VanDerWaalsContact CB-CZ 3.46Å |
| 1238 | Y | 98.5 | Very high | 98.4 | Very high | 56 Ų | 56 | 38.2 Ų | 38.2 | 22% | 0.22 | 17% | 0.172 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -112.5 | -41.8 | 176.5 | -53.7 | -63.1 | 0 | 0 | 0 | 111.7 | S1198 S1199 P1201 D1236 N1240 Y1241 | S1198-Y1238 CarbonylContact O-C 3.58Å; S1199-Y1238 WeakPolarHBondContact O-CD2 3.31Å; P1201-Y1238 HydrophobicContact CB-CD1 4.24Å; P1201-Y1238 HydrophobicContact CB-CD2 4.39Å; P1201-Y1238 HydrophobicContact CB-CE1 3.76Å; P1201-Y1238 HydrophobicContact CB-CE2 3.93Å; P1201-Y1238 HydrophobicContact CG-CE2 4.25Å; D1236-Y1238 VanDerWaalsContact C-N 3.26Å; D1236-Y1238 PolarHBondContact O-N 3.28Å; D1236-Y1238 WeakPolarHBondContact OD2-CA 3.5Å; D1236-Y1238 WeakPolarHBondContact OD2-CB 3.42Å; D1236-Y1238 PolarHBondContact OD2-N 3.46Å; Y1238-N1240 PolarHBondContact O-N 2.88Å; Y1238-Y1241 PolarHBondContact O-N 2.9Å; Y1238-Y1241 VanDerWaalsContact O-N 3.1Å |
| 1239 | G | 98.7 | Very high | 98.4 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -59.6 | -29 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | S1198 L1233 D1236 Y1241 V1242 I1243 | S1198-G1239 WeakPolarHBondContact O-CA 3.48Å; S1198-G1239 PolarHBondContact O-N 3.15Å; L1233-G1239 CarbonylContact O-C 3.29Å; D1236-G1239 PolarHBondContact OD2-N 2.95Å; G1239-Y1241 PolarHBondContact O-N 3.2Å; G1239-V1242 WeakPolarHBondContact O-CB 3.5Å; G1239-V1242 PolarHBondContact O-N 3.29Å; G1239-V1242 VanDerWaalsContact O-N 3.08Å; G1239-I1243 PolarHBondContact O-N 3.14Å; G1239-I1243 VanDerWaalsContact O-N 3.13Å |
| 1240 | N | 98.8 | Very high | 98.4 | Very high | 1 Ų | 1 | 34.9 Ų | 34.9 | 1% | 0.005 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -61.5 | -33.8 | 177.4 | 77.8 | 88.8 | 0 | 0 | 0 | 111.9 | L1233 D1236 Q1237 Y1238 V1242 I1243 Q1244 F1274 V1278 | L1233-N1240 WeakPolarHBondContact O-CA 3.47Å; L1233-N1240 PolarHBondContact O-N 3.35Å; D1236-N1240 WeakPolarHBondContact O-CB 3.31Å; D1236-N1240 PolarHBondContact O-N 2.86Å; D1236-N1240 PolarHBondContact O-ND2 3.4Å; Q1237-N1240 VanDerWaalsContact C-ND2 3.26Å; Q1237-N1240 PolarHBondContact O-ND2 3.17Å; Y1238-N1240 PolarHBondContact O-N 2.88Å; N1240-V1242 VanDerWaalsContact C-N 3.35Å; N1240-I1243 PolarHBondContact O-N 3.22Å; N1240-Q1244 WeakPolarHBondContact O-CB 3.44Å; N1240-Q1244 VanDerWaalsContact O-CG 3.24Å; N1240-Q1244 WeakPolarHBondContact O-CG 3.21Å; N1240-Q1244 PolarHBondContact O-N 3.38Å; N1240-Q1244 PolarHBondContact OD1-NE2 3.01Å; N1240-F1274 HydrophobicContact CB-CB 4.16Å; N1240-V1278 HydrophobicContact CB-CG2 3.83Å |
| 1241 | Y | 98.8 | Very high | 98.3 | Very high | 124 Ų | 124 | 37.3 Ų | 37.3 | 49% | 0.486 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -68.6 | -34.8 | 176.3 | -62.8 | -72.4 | 0 | 0 | 0 | 111.8 | Q1237 Y1238 G1239 Q1244 H1245 | Q1237-Y1241 WeakPolarHBondContact O-CE2 3.33Å; Y1238-Y1241 PolarHBondContact O-N 2.9Å; Y1238-Y1241 VanDerWaalsContact O-N 3.1Å; G1239-Y1241 PolarHBondContact O-N 3.2Å; Y1241-Q1244 PolarHBondContact O-N 3.49Å; Y1241-H1245 VanDerWaalsContact O-CB 3.31Å; Y1241-H1245 WeakPolarHBondContact O-CB 3.39Å; Y1241-H1245 PolarHBondContact O-N 3.46Å |
| 1242 | V | 98.8 | Very high | 98.3 | Very high | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -65.4 | -43.4 | 175.1 | -179.6 | 0 | 0 | 0 | 0 | 110.9 | C1204 I1207 L1226 G1239 N1240 H1245 V1246 | C1204-V1242 HydrophobicContact CB-CG2 3.79Å; I1207-V1242 HydrophobicContact CB-CG2 4.48Å; I1207-V1242 HydrophobicContact CG2-CG1 3.55Å; I1207-V1242 HydrophobicContact CG2-CG2 4.26Å; L1226-V1242 HydrophobicContact CD1-CG1 3.89Å; L1226-V1242 HydrophobicContact CD2-CG1 3.66Å; L1226-V1242 HydrophobicContact CG-CG1 4.47Å; G1239-V1242 WeakPolarHBondContact O-CB 3.5Å; G1239-V1242 PolarHBondContact O-N 3.29Å; G1239-V1242 VanDerWaalsContact O-N 3.08Å; N1240-V1242 VanDerWaalsContact C-N 3.35Å; V1242-H1245 PolarHBondContact O-N 3.45Å; V1242-V1246 WeakPolarHBondContact O-CG2 3.27Å; V1242-V1246 PolarHBondContact O-N 3.22Å; V1242-V1246 VanDerWaalsContact O-N 3.12Å |
| 1243 | I | 98.8 | Very high | 98.3 | Very high | 1 Ų | 1 | 38.8 Ų | 38.8 | 1% | 0.005 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -68.1 | -40.9 | 175.7 | -53.5 | -53.3 | 0 | 0 | 0 | 111.2 | V1230 L1233 V1234 G1239 N1240 H1245 V1246 L1247 I1258 V1278 | V1230-I1243 HydrophobicContact CG2-CD1 4.47Å; L1233-I1243 HydrophobicContact CB-CD1 3.9Å; L1233-I1243 HydrophobicContact CB-CG1 3.76Å; L1233-I1243 HydrophobicContact CD1-CD1 4Å; V1234-I1243 HydrophobicContact CG1-CB 4.12Å; V1234-I1243 HydrophobicContact CG1-CG1 3.89Å; V1234-I1243 HydrophobicContact CG1-CG2 3.81Å; G1239-I1243 PolarHBondContact O-N 3.14Å; G1239-I1243 VanDerWaalsContact O-N 3.13Å; N1240-I1243 PolarHBondContact O-N 3.22Å; I1243-H1245 VanDerWaalsContact C-N 3.3Å; I1243-H1245 PolarHBondContact O-N 3.34Å; I1243-V1246 PolarHBondContact O-N 3.44Å; I1243-L1247 HydrophobicContact CG2-CD1 4.12Å; I1243-L1247 HydrophobicContact CG2-CG 4.45Å; I1243-L1247 WeakPolarHBondContact O-CB 3.42Å; I1243-L1247 WeakPolarHBondContact O-CG 3.34Å; I1243-L1247 PolarHBondContact O-N 3.4Å; I1243-I1258 HydrophobicContact CG2-CD1 4.01Å; I1243-I1258 HydrophobicContact CG2-CG1 4.37Å; I1243-I1258 HydrophobicContact CG2-CG2 3.62Å; I1243-V1278 HydrophobicContact CG2-CG1 3.87Å |
| 1244 | Q | 98.8 | Very high | 98.3 | Very high | 19 Ų | 19 | 39 Ų | 39 | 9% | 0.089 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -58.3 | -42.8 | 173.6 | -74.4 | -176.4 | 80.8 | 0 | 0 | 111.6 | N1240 Y1241 L1247 E1248 V1278 K1281 | N1240-Q1244 WeakPolarHBondContact O-CB 3.44Å; N1240-Q1244 VanDerWaalsContact O-CG 3.24Å; N1240-Q1244 WeakPolarHBondContact O-CG 3.21Å; N1240-Q1244 PolarHBondContact O-N 3.38Å; N1240-Q1244 PolarHBondContact OD1-NE2 3.01Å; Y1241-Q1244 PolarHBondContact O-N 3.49Å; Q1244-L1247 WeakPolarHBondContact O-CB 3.26Å; Q1244-L1247 PolarHBondContact O-N 2.83Å; Q1244-E1248 WeakPolarHBondContact O-CG 3.47Å; Q1244-E1248 PolarHBondContact O-N 3.47Å; Q1244-V1278 HydrophobicContact CG-CG2 4.16Å; Q1244-K1281 HydrophobicContact CB-CG 3.98Å; Q1244-K1281 HydrophobicContact CG-CB 4.23Å; Q1244-K1281 HydrophobicContact CG-CG 3.6Å; Q1244-K1281 VanDerWaalsContact OE1-CG 3.24Å |
| 1245 | H | 98.7 | Very high | 98.2 | Very high | 13 Ų | 13 | 39.9 Ų | 39.9 | 6% | 0.06 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.7 | -45.2 | 176.9 | -178.6 | 91.1 | 0 | 0 | 0 | 112.2 | Q1208 E1212 Y1241 V1242 I1243 L1247 E1248 H1249 | Q1208-H1245 HydrophobicContact CG-CB 4.09Å; E1212-H1245 WeakPolarHBondContact CG-CE1 3.4Å; E1212-H1245 IonicContact OE1-CE1 3.89Å; E1212-H1245 PolarHBondContact OE1-CE1 3.15Å; E1212-H1245 IonicContact OE1-ND1 3.32Å; E1212-H1245 IonicContact OE1-NE2 2.67Å; Y1241-H1245 VanDerWaalsContact O-CB 3.31Å; Y1241-H1245 WeakPolarHBondContact O-CB 3.39Å; Y1241-H1245 PolarHBondContact O-N 3.46Å; V1242-H1245 PolarHBondContact O-N 3.45Å; I1243-H1245 VanDerWaalsContact C-N 3.3Å; I1243-H1245 PolarHBondContact O-N 3.34Å; H1245-L1247 VanDerWaalsContact C-N 3.34Å; H1245-L1247 PolarHBondContact O-N 3.5Å; H1245-E1248 PolarHBondContact O-N 3.08Å; H1245-H1249 AromaticContact CE1-CD2 3.4Å; H1245-H1249 PolarHBondContact CE1-CD2 3.44Å; H1245-H1249 VanDerWaalsContact CE1-CD2 3.4Å; H1245-H1249 AromaticContact CG-CD2 3.92Å; H1245-H1249 AromaticContact ND1-CD2 3.42Å; H1245-H1249 PolarHBondContact ND1-CD2 3.2Å; H1245-H1249 AromaticContact ND1-NE2 4Å; H1245-H1249 AromaticContact NE2-CD2 3.9Å; H1245-H1249 PolarHBondContact O-CD2 3.33Å; H1245-H1249 PolarHBondContact O-N 3.22Å |
| 1246 | V | 98.7 | Very high | 98.2 | Very high | 4 Ų | 4 | 37.4 Ų | 37.4 | 2% | 0.024 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -65.7 | -36.7 | 174.7 | -179.4 | 0 | 0 | 0 | 0 | 111.5 | L1211 L1223 L1226 V1242 I1243 E1248 G1250 D1254 I1258 | L1211-V1246 HydrophobicContact CD1-CG2 3.81Å; L1223-V1246 HydrophobicContact CD2-CG1 4.05Å; L1223-V1246 HydrophobicContact CD2-CG2 3.85Å; L1226-V1246 HydrophobicContact CD1-CG2 4.37Å; V1242-V1246 WeakPolarHBondContact O-CG2 3.27Å; V1242-V1246 PolarHBondContact O-N 3.22Å; V1242-V1246 VanDerWaalsContact O-N 3.12Å; I1243-V1246 PolarHBondContact O-N 3.44Å; V1246-E1248 VanDerWaalsContact C-N 3.29Å; V1246-E1248 PolarHBondContact O-N 3.48Å; V1246-G1250 VanDerWaalsContact O-CA 3.27Å; V1246-G1250 WeakPolarHBondContact O-CA 3.42Å; V1246-G1250 PolarHBondContact O-N 3.36Å; V1246-D1254 HydrophobicContact CG1-CB 3.91Å; V1246-I1258 HydrophobicContact CB-CD1 3.82Å; V1246-I1258 HydrophobicContact CG1-CD1 3.52Å |
| 1247 | L | 98.6 | Very high | 98.2 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -64.1 | -32 | 174.5 | -75 | 168.8 | 0 | 0 | 0 | 112.7 | I1243 Q1244 H1245 K1255 I1258 I1259 V1278 K1281 A1282 N1285 | I1243-L1247 HydrophobicContact CG2-CD1 4.12Å; I1243-L1247 HydrophobicContact CG2-CG 4.45Å; I1243-L1247 WeakPolarHBondContact O-CB 3.42Å; I1243-L1247 WeakPolarHBondContact O-CG 3.34Å; I1243-L1247 PolarHBondContact O-N 3.4Å; Q1244-L1247 WeakPolarHBondContact O-CB 3.26Å; Q1244-L1247 PolarHBondContact O-N 2.83Å; H1245-L1247 VanDerWaalsContact C-N 3.34Å; H1245-L1247 PolarHBondContact O-N 3.5Å; L1247-K1255 WeakPolarHBondContact O-CD 3.45Å; L1247-K1255 WeakPolarHBondContact O-CE 3.42Å; L1247-K1255 PolarHBondContact O-NZ 3.2Å; L1247-I1258 HydrophobicContact CD1-CG2 4.17Å; L1247-I1258 HydrophobicContact CD2-CB 4.16Å; L1247-I1258 HydrophobicContact CD2-CG2 3.82Å; L1247-I1258 HydrophobicContact CG-CD1 4.41Å; L1247-I1258 HydrophobicContact CG-CG2 4.08Å; L1247-I1259 HydrophobicContact CD2-CD1 4.45Å; L1247-I1259 HydrophobicContact CD2-CG1 4.17Å; L1247-V1278 HydrophobicContact CD1-CG1 3.79Å; L1247-K1281 HydrophobicContact CB-CB 4.33Å; L1247-K1281 HydrophobicContact CD1-CB 4.21Å; L1247-A1282 HydrophobicContact CD1-CB 4.06Å; L1247-A1282 HydrophobicContact CD2-CB 4.37Å; L1247-N1285 WeakPolarHBondContact O-CB 3.16Å; L1247-N1285 PolarHBondContact O-OD1 3.1Å |
| 1248 | E | 98.3 | Very high | 98.2 | Very high | 25 Ų | 25 | 36.1 Ų | 36.1 | 12% | 0.117 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -84.7 | -49.1 | 178.4 | -68.2 | -172.9 | 137.9 | 0 | 0 | 112.7 | S134 Q1244 H1245 V1246 K1255 K1281 | S134-E1248 VanDerWaalsContact CA-OE1 3.32Å; S134-E1248 WeakPolarHBondContact CA-OE1 3.2Å; S134-E1248 VanDerWaalsContact CB-OE2 3.22Å; S134-E1248 WeakPolarHBondContact CB-OE2 3.3Å; S134-E1248 PolarHBondContact OG-OE2 3.1Å; Q1244-E1248 WeakPolarHBondContact O-CG 3.47Å; Q1244-E1248 PolarHBondContact O-N 3.47Å; H1245-E1248 PolarHBondContact O-N 3.08Å; V1246-E1248 VanDerWaalsContact C-N 3.29Å; V1246-E1248 PolarHBondContact O-N 3.48Å; E1248-K1255 PolarHBondContact O-NZ 3.29Å; E1248-K1281 HydrophobicContact CG-CD 4.33Å; E1248-K1281 VanDerWaalsContact OE1-CD 3.29Å; E1248-K1281 WeakPolarHBondContact OE1-CD 3.46Å; E1248-K1281 WeakPolarHBondContact OE1-CE 3.47Å; E1248-K1281 IonicContact OE1-NZ 3.52Å; E1248-K1281 PolarHBondContact OE1-NZ 3.22Å; E1248-K1281 IonicContact OE2-NZ 3.72Å |
| 1249 | H | 97.1 | Very high | 98.2 | Very high | 86 Ų | 86 | 33.6 Ų | 33.6 | 40% | 0.398 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -111.1 | -14.3 | -167.9 | -50.5 | -75.2 | 0 | 0 | 0 | 115.2 | S134 H1245 | S134-H1249 PolarHBondContact OG-CE1 3.38Å; S134-H1249 PolarHBondContact OG-NE2 3.47Å; S134-H1249 VanDerWaalsContact OG-NE2 3.15Å; H1245-H1249 AromaticContact CE1-CD2 3.4Å; H1245-H1249 PolarHBondContact CE1-CD2 3.44Å; H1245-H1249 VanDerWaalsContact CE1-CD2 3.4Å; H1245-H1249 AromaticContact CG-CD2 3.92Å; H1245-H1249 AromaticContact ND1-CD2 3.42Å; H1245-H1249 PolarHBondContact ND1-CD2 3.2Å; H1245-H1249 AromaticContact ND1-NE2 4Å; H1245-H1249 AromaticContact NE2-CD2 3.9Å; H1245-H1249 PolarHBondContact O-CD2 3.33Å; H1245-H1249 PolarHBondContact O-N 3.22Å |
| 1250 | G | 96.8 | Very high | 98.1 | Very high | 22 Ų | 22 | 39.5 Ų | 39.5 | 23% | 0.227 | 20% | 0.195 | C | C | . | . | S | Bend | trans | -72.1 | 172.3 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | V1246 K1255 | V1246-G1250 VanDerWaalsContact O-CA 3.27Å; V1246-G1250 WeakPolarHBondContact O-CA 3.42Å; V1246-G1250 PolarHBondContact O-N 3.36Å; G1250-K1255 WeakPolarHBondContact O-CE 3.46Å |
| 1251 | S | 97.1 | Very high | 98 | Very high | 54 Ų | 54 | 42.1 Ų | 42.1 | 38% | 0.378 | 21% | 0.209 | S | C | . | . | trans | -63.7 | 153.3 | 175 | 84.8 | 0 | 0 | 0 | 0 | 111.6 | E1253 D1254 K1255 | S1251-E1253 PolarHBondContact O-N 3.47Å; S1251-E1253 PolarHBondContact OG-N 2.92Å; S1251-D1254 PolarHBondContact O-N 3.01Å; S1251-D1254 PolarHBondContact OG-N 2.98Å; S1251-D1254 VanDerWaalsContact OG-N 3.11Å; S1251-D1254 PolarHBondContact OG-OD2 3.24Å; S1251-K1255 WeakPolarHBondContact O-CG 3.34Å; S1251-K1255 PolarHBondContact O-N 2.59Å | ||
| 1252 | N | 96.8 | Very high | 97.9 | Very high | 108 Ų | 108 | 36.2 Ų | 36.2 | 58% | 0.578 | 19% | 0.186 | S | C | * | . | H | α-helix | trans | -58.7 | -31.3 | 175.3 | -72.8 | -22.5 | 0 | 0 | 0 | 112.4 | K1255 S1256 | N1252-K1255 PolarHBondContact O-N 3.34Å; N1252-S1256 WeakPolarHBondContact O-CB 3.49Å; N1252-S1256 PolarHBondContact O-N 2.91Å; N1252-S1256 PolarHBondContact O-OG 2.85Å |
| 1253 | E | 97.4 | Very high | 97.7 | Very high | 111 Ų | 111 | 42 Ų | 42 | 52% | 0.519 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -63.3 | -46.6 | 173.5 | -169 | -153.8 | 126.3 | 0 | 0 | 111.4 | S1251 S1256 R1257 | S1251-E1253 PolarHBondContact O-N 3.47Å; S1251-E1253 PolarHBondContact OG-N 2.92Å; E1253-S1256 PolarHBondContact O-N 3.1Å; E1253-R1257 WeakPolarHBondContact O-CB 3.47Å; E1253-R1257 VanDerWaalsContact O-CG 3.27Å; E1253-R1257 WeakPolarHBondContact O-CG 3.42Å; E1253-R1257 PolarHBondContact O-N 2.89Å; E1253-R1257 WeakPolarHBondContact OE1-CD 3.28Å; E1253-R1257 IonicContact OE1-CZ 3.96Å; E1253-R1257 IonicContact OE1-NH1 3.54Å; E1253-R1257 PolarHBondContact OE1-NH1 3.16Å |
| 1254 | D | 98.3 | Very high | 97.5 | Very high | 4 Ų | 4 | 44.5 Ų | 44.5 | 2% | 0.021 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -66.7 | -37.9 | 178.7 | -65 | -69.6 | 0 | 0 | 0 | 111.5 | R1220 H1227 V1246 S1251 R1257 I1258 | R1220-D1254 IonicContact CZ-OD1 3.01Å; R1220-D1254 IonicContact NH1-OD1 2.75Å; R1220-D1254 PolarHBondContact NH1-OD1 3.15Å; R1220-D1254 IonicContact NH1-OD2 2.71Å; R1220-D1254 PolarHBondContact NH1-OD2 3.27Å; R1220-D1254 IonicContact NH2-OD1 2.88Å; R1220-D1254 PolarHBondContact NH2-OD1 3.47Å; H1227-D1254 IonicContact CD2-OD1 3.74Å; H1227-D1254 PolarHBondContact CE1-O 3.35Å; H1227-D1254 IonicContact CE1-OD1 3.89Å; H1227-D1254 IonicContact NE2-OD1 3.65Å; H1227-D1254 PolarHBondContact NE2-OD1 2.98Å; V1246-D1254 HydrophobicContact CG1-CB 3.91Å; S1251-D1254 PolarHBondContact O-N 3.01Å; S1251-D1254 PolarHBondContact OG-N 2.98Å; S1251-D1254 VanDerWaalsContact OG-N 3.11Å; S1251-D1254 PolarHBondContact OG-OD2 3.24Å; D1254-R1257 PolarHBondContact O-N 3.37Å; D1254-I1258 WeakPolarHBondContact O-CG1 3.47Å; D1254-I1258 PolarHBondContact O-N 2.93Å; D1254-I1258 VanDerWaalsContact O-N 3.1Å |
| 1255 | K | 98.4 | Very high | 97.2 | Very high | 21 Ų | 21 | 46.9 Ų | 46.9 | 9% | 0.091 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -60.2 | -50.9 | 171.7 | -64 | -176.1 | -170 | -147.9 | 0 | 111.1 | L1247 E1248 G1250 S1251 N1252 R1257 I1258 I1259 N1285 | L1247-K1255 WeakPolarHBondContact O-CD 3.45Å; L1247-K1255 WeakPolarHBondContact O-CE 3.42Å; L1247-K1255 PolarHBondContact O-NZ 3.2Å; E1248-K1255 PolarHBondContact O-NZ 3.29Å; G1250-K1255 WeakPolarHBondContact O-CE 3.46Å; S1251-K1255 WeakPolarHBondContact O-CG 3.34Å; S1251-K1255 PolarHBondContact O-N 2.59Å; N1252-K1255 PolarHBondContact O-N 3.34Å; K1255-R1257 PolarHBondContact O-N 2.83Å; K1255-I1258 PolarHBondContact O-N 2.95Å; K1255-I1259 WeakPolarHBondContact O-CD1 3.39Å; K1255-I1259 VanDerWaalsContact O-CG1 3.31Å; K1255-I1259 WeakPolarHBondContact O-CG1 3.03Å; K1255-I1259 PolarHBondContact O-N 3.48Å; K1255-N1285 HydrophobicContact CD-CB 4.44Å |
| 1256 | S | 98.3 | Very high | 97.1 | Very high | 28 Ų | 28 | 46.3 Ų | 46.3 | 20% | 0.196 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.8 | -41.9 | 177.7 | -72.9 | 0 | 0 | 0 | 0 | 112.9 | N1252 E1253 I1258 I1259 Q1260 E1290 | N1252-S1256 WeakPolarHBondContact O-CB 3.49Å; N1252-S1256 PolarHBondContact O-N 2.91Å; N1252-S1256 PolarHBondContact O-OG 2.85Å; E1253-S1256 PolarHBondContact O-N 3.1Å; S1256-I1258 VanDerWaalsContact C-N 3.35Å; S1256-I1258 PolarHBondContact O-N 3.42Å; S1256-I1259 PolarHBondContact O-N 3.26Å; S1256-Q1260 WeakPolarHBondContact O-CB 3.47Å; S1256-Q1260 WeakPolarHBondContact O-CG 3.29Å; S1256-Q1260 PolarHBondContact O-N 2.84Å; S1256-E1290 VanDerWaalsContact CA-OE1 3.26Å; S1256-E1290 WeakPolarHBondContact CA-OE1 3.2Å; S1256-E1290 WeakPolarHBondContact CB-OE1 3.08Å; S1256-E1290 PolarHBondContact OG-OE1 3.24Å |
| 1257 | R | 98.1 | Very high | 96.8 | Very high | 78 Ų | 78 | 47.9 Ų | 47.9 | 29% | 0.294 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -61.5 | -40.6 | 176.4 | -75.4 | 166 | 64.2 | 169.4 | -1.3 | 112 | D1224 H1227 E1253 D1254 K1255 N1261 | D1224-R1257 IonicContact OD1-CZ 3.54Å; D1224-R1257 IonicContact OD1-NH1 2.74Å; D1224-R1257 PolarHBondContact OD1-NH1 2.89Å; D1224-R1257 IonicContact OD1-NH2 3.02Å; D1224-R1257 PolarHBondContact OD1-NH2 2.87Å; H1227-R1257 PolarHBondContact CD2-NH2 3.24Å; H1227-R1257 VanDerWaalsContact CE1-CB 3.46Å; H1227-R1257 WeakPolarHBondContact CE1-CB 3.34Å; E1253-R1257 WeakPolarHBondContact O-CB 3.47Å; E1253-R1257 VanDerWaalsContact O-CG 3.27Å; E1253-R1257 WeakPolarHBondContact O-CG 3.42Å; E1253-R1257 PolarHBondContact O-N 2.89Å; E1253-R1257 WeakPolarHBondContact OE1-CD 3.28Å; E1253-R1257 IonicContact OE1-CZ 3.96Å; E1253-R1257 IonicContact OE1-NH1 3.54Å; E1253-R1257 PolarHBondContact OE1-NH1 3.16Å; D1254-R1257 PolarHBondContact O-N 3.37Å; K1255-R1257 PolarHBondContact O-N 2.83Å; R1257-N1261 PolarHBondContact O-N 3.34Å |
| 1258 | I | 98.6 | Very high | 96.7 | Very high | 3 Ų | 3 | 51.2 Ų | 51.2 | 2% | 0.015 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -66 | -49.9 | 172.8 | -68.6 | 163.1 | 0 | 0 | 0 | 110.4 | V1230 I1243 V1246 L1247 D1254 K1255 S1256 Q1260 N1261 L1262 | V1230-I1258 HydrophobicContact CG1-CG2 4.33Å; V1230-I1258 HydrophobicContact CG2-CG1 4.32Å; I1243-I1258 HydrophobicContact CG2-CD1 4.01Å; I1243-I1258 HydrophobicContact CG2-CG1 4.37Å; I1243-I1258 HydrophobicContact CG2-CG2 3.62Å; V1246-I1258 HydrophobicContact CB-CD1 3.82Å; V1246-I1258 HydrophobicContact CG1-CD1 3.52Å; L1247-I1258 HydrophobicContact CD1-CG2 4.17Å; L1247-I1258 HydrophobicContact CD2-CB 4.16Å; L1247-I1258 HydrophobicContact CD2-CG2 3.82Å; L1247-I1258 HydrophobicContact CG-CD1 4.41Å; L1247-I1258 HydrophobicContact CG-CG2 4.08Å; D1254-I1258 WeakPolarHBondContact O-CG1 3.47Å; D1254-I1258 PolarHBondContact O-N 2.93Å; D1254-I1258 VanDerWaalsContact O-N 3.1Å; K1255-I1258 PolarHBondContact O-N 2.95Å; S1256-I1258 VanDerWaalsContact C-N 3.35Å; S1256-I1258 PolarHBondContact O-N 3.42Å; I1258-Q1260 VanDerWaalsContact C-N 3.32Å; I1258-Q1260 PolarHBondContact O-N 2.98Å; I1258-N1261 WeakPolarHBondContact O-CA 3.46Å; I1258-N1261 VanDerWaalsContact O-CB 3.27Å; I1258-N1261 WeakPolarHBondContact O-CB 3.48Å; I1258-N1261 PolarHBondContact O-N 3.45Å; I1258-L1262 HydrophobicContact CG2-CD1 4.17Å; I1258-L1262 HydrophobicContact CG2-CG 4.44Å; I1258-L1262 WeakPolarHBondContact O-CG 3.28Å; I1258-L1262 PolarHBondContact O-N 3.42Å; I1258-L1262 VanDerWaalsContact O-N 3.15Å |
| 1259 | I | 98.1 | Very high | 96.6 | Very high | 3 Ų | 3 | 50.4 Ų | 50.4 | 2% | 0.015 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -60.1 | -40.9 | -177.4 | -70.7 | 160.4 | 0 | 0 | 0 | 111.7 | L1247 K1255 S1256 N1261 L1262 R1263 A1282 A1286 E1290 L1294 | L1247-I1259 HydrophobicContact CD2-CD1 4.45Å; L1247-I1259 HydrophobicContact CD2-CG1 4.17Å; K1255-I1259 WeakPolarHBondContact O-CD1 3.39Å; K1255-I1259 VanDerWaalsContact O-CG1 3.31Å; K1255-I1259 WeakPolarHBondContact O-CG1 3.03Å; K1255-I1259 PolarHBondContact O-N 3.48Å; S1256-I1259 PolarHBondContact O-N 3.26Å; I1259-N1261 PolarHBondContact O-N 3.13Å; I1259-L1262 WeakPolarHBondContact O-CB 3.35Å; I1259-L1262 PolarHBondContact O-N 3.48Å; I1259-R1263 PolarHBondContact O-N 2.86Å; I1259-A1282 HydrophobicContact CG1-CB 4.29Å; I1259-A1286 HydrophobicContact CD1-CB 3.67Å; I1259-E1290 VanDerWaalsContact CD1-OE2 3.31Å; I1259-E1290 WeakPolarHBondContact CD1-OE2 3.37Å; I1259-E1290 HydrophobicContact CG2-CB 4.2Å; I1259-E1290 HydrophobicContact CG2-CG 4.4Å; I1259-L1294 HydrophobicContact CG2-CD1 4.09Å; I1259-L1294 HydrophobicContact CG2-CD2 4.37Å; I1259-L1294 HydrophobicContact CG2-CG 4.34Å |
| 1260 | Q | 97.1 | Very high | 96.7 | Very high | 125 Ų | 125 | 46.3 Ų | 46.3 | 58% | 0.584 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -59.6 | -33.4 | 173.5 | -72.6 | 170 | 31.5 | 0 | 0 | 112.5 | S1256 I1258 | S1256-Q1260 WeakPolarHBondContact O-CB 3.47Å; S1256-Q1260 WeakPolarHBondContact O-CG 3.29Å; S1256-Q1260 PolarHBondContact O-N 2.84Å; I1258-Q1260 VanDerWaalsContact C-N 3.32Å; I1258-Q1260 PolarHBondContact O-N 2.98Å |
| 1261 | N | 96.4 | Very high | 96.7 | Very high | 55 Ų | 55 | 47.4 Ų | 47.4 | 29% | 0.294 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -73.4 | -25.2 | 174.4 | -158.8 | -92.2 | 0 | 0 | 0 | 113.1 | V1230 R1257 I1258 I1259 R1265 | V1230-N1261 HydrophobicContact CB-CB 4.5Å; V1230-N1261 HydrophobicContact CG1-CB 4.07Å; R1257-N1261 PolarHBondContact O-N 3.34Å; I1258-N1261 WeakPolarHBondContact O-CA 3.46Å; I1258-N1261 VanDerWaalsContact O-CB 3.27Å; I1258-N1261 WeakPolarHBondContact O-CB 3.48Å; I1258-N1261 PolarHBondContact O-N 3.45Å; I1259-N1261 PolarHBondContact O-N 3.13Å; N1261-R1265 PolarHBondContact O-NE 3.05Å; N1261-R1265 PolarHBondContact O-NH2 2.95Å; N1261-R1265 PolarHBondContact OD1-NH2 3.38Å |
| 1262 | L | 96.9 | Very high | 96.8 | Very high | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.005 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -80.2 | -23.1 | 178.7 | -61 | 174 | 0 | 0 | 0 | 113.3 | V1234 I1258 I1259 R1265 L1269 V1278 M1279 A1282 | V1234-L1262 HydrophobicContact CG1-CD2 4.23Å; I1258-L1262 HydrophobicContact CG2-CD1 4.17Å; I1258-L1262 HydrophobicContact CG2-CG 4.44Å; I1258-L1262 WeakPolarHBondContact O-CG 3.28Å; I1258-L1262 PolarHBondContact O-N 3.42Å; I1258-L1262 VanDerWaalsContact O-N 3.15Å; I1259-L1262 WeakPolarHBondContact O-CB 3.35Å; I1259-L1262 PolarHBondContact O-N 3.48Å; L1262-R1265 PolarHBondContact O-N 3.22Å; L1262-L1269 HydrophobicContact CB-CD1 4.44Å; L1262-L1269 HydrophobicContact CD2-CD1 3.58Å; L1262-V1278 HydrophobicContact CD1-CG1 4.32Å; L1262-V1278 HydrophobicContact CD2-CG1 4.34Å; L1262-M1279 HydrophobicContact CB-SD 3.96Å; L1262-M1279 HydrophobicContact CD1-CE 4.49Å; L1262-M1279 HydrophobicContact CD1-SD 3.93Å; L1262-M1279 HydrophobicContact CD2-SD 4.1Å; L1262-M1279 HydrophobicContact CG-SD 4.21Å; L1262-A1282 HydrophobicContact CD1-CB 3.55Å |
| 1263 | R | 95.4 | Very high | 96.8 | Very high | 121 Ų | 121 | 48 Ų | 48 | 46% | 0.457 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.7 | 152.9 | 178.8 | -70.3 | -175.9 | 67.4 | 179.5 | 5.5 | 113.2 | I1259 R1265 V1293 L1294 E1297 | I1259-R1263 PolarHBondContact O-N 2.86Å; R1263-R1265 PolarHBondContact O-N 2.89Å; R1263-V1293 HydrophobicContact CG-CG1 4.3Å; R1263-L1294 HydrophobicContact CG-CD2 4.2Å; R1263-E1297 WeakPolarHBondContact CA-OE2 3.34Å |
| 1264 | G | 92.7 | Very high | 96.9 | Very high | 53 Ų | 53 | 45.4 Ų | 45.4 | 55% | 0.546 | 24% | 0.238 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 70 | 3.5 | -173.7 | 0 | 0 | 0 | 0 | 0 | 114 | E1297 | G1264-E1297 VanDerWaalsContact CA-OE1 3.31Å; G1264-E1297 WeakPolarHBondContact CA-OE1 3.37Å; G1264-E1297 PolarHBondContact N-OE1 3.23Å; G1264-E1297 VanDerWaalsContact N-OE1 3.13Å; G1264-E1297 PolarHBondContact N-OE2 3.26Å |
| 1265 | R | 94.1 | Very high | 96.9 | Very high | 70 Ų | 70 | 45.2 Ų | 45.2 | 26% | 0.264 | 24% | 0.237 | S | C | . | . | trans | -140.1 | 8.1 | -170.2 | -56.6 | -168.5 | -70.5 | -167.7 | 3.8 | 113.4 | E1231 N1261 L1262 R1263 C1267 A1268 L1269 E1297 | E1231-R1265 IonicContact OE1-NH1 3.69Å; E1231-R1265 PolarHBondContact OE1-NH1 3.17Å; E1231-R1265 VanDerWaalsContact OE1-NH1 3.08Å; E1231-R1265 IonicContact OE2-CZ 3.5Å; E1231-R1265 IonicContact OE2-NH1 2.64Å; E1231-R1265 PolarHBondContact OE2-NH1 2.99Å; E1231-R1265 IonicContact OE2-NH2 2.8Å; N1261-R1265 PolarHBondContact O-NE 3.05Å; N1261-R1265 PolarHBondContact O-NH2 2.95Å; N1261-R1265 PolarHBondContact OD1-NH2 3.38Å; L1262-R1265 PolarHBondContact O-N 3.22Å; R1263-R1265 PolarHBondContact O-N 2.89Å; R1265-C1267 VanDerWaalsContact C-N 3.35Å; R1265-C1267 PolarHBondContact O-N 3.38Å; R1265-A1268 PolarHBondContact O-N 2.93Å; R1265-A1268 VanDerWaalsContact O-N 3.09Å; R1265-L1269 HydrophobicContact CB-CD1 3.98Å; R1265-L1269 HydrophobicContact CB-CG 4.13Å; R1265-L1269 WeakPolarHBondContact O-CG 3.22Å; R1265-L1269 PolarHBondContact O-N 3.25Å; R1265-E1297 PolarHBondContact N-OE1 3.02Å | ||
| 1266 | V | 95.2 | Very high | 96.9 | Very high | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -54.9 | -47.4 | -173.4 | 171.1 | 0 | 0 | 0 | 0 | 111.6 | A1268 S1270 M1279 L1294 E1297 I1298 M1339 | V1266-A1268 PolarHBondContact O-N 3.43Å; V1266-S1270 WeakPolarHBondContact O-CB 3.45Å; V1266-S1270 PolarHBondContact O-N 3.3Å; V1266-S1270 PolarHBondContact O-OG 3.33Å; V1266-M1279 HydrophobicContact CB-CE 4.48Å; V1266-M1279 HydrophobicContact CG1-CE 4.17Å; V1266-M1279 HydrophobicContact CG2-CE 3.91Å; V1266-L1294 HydrophobicContact CG2-CD2 3.74Å; V1266-E1297 HydrophobicContact CB-CG 4.48Å; V1266-E1297 VanDerWaalsContact CB-OE1 3.3Å; V1266-E1297 WeakPolarHBondContact CB-OE1 3.31Å; V1266-E1297 HydrophobicContact CG2-CG 4.43Å; V1266-E1297 VanDerWaalsContact CG2-OE1 3.27Å; V1266-E1297 WeakPolarHBondContact CG2-OE1 3.22Å; V1266-E1297 PolarHBondContact N-OE1 3.31Å; V1266-I1298 HydrophobicContact CB-CG2 4.24Å; V1266-I1298 HydrophobicContact CG1-CG2 3.63Å; V1266-M1339 HydrophobicContact CG1-CE 3.89Å |
| 1267 | C | 94 | Very high | 96.9 | Very high | 38 Ų | 38 | 45.8 Ų | 45.8 | 26% | 0.257 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -62.5 | -42 | 179 | -175.9 | 0 | 0 | 0 | 0 | 113 | R1265 S1271 S1322 M1326 | R1265-C1267 VanDerWaalsContact C-N 3.35Å; R1265-C1267 PolarHBondContact O-N 3.38Å; C1267-S1271 PolarHBondContact O-N 3Å; C1267-S1271 PolarHBondContact O-OG 3.15Å; C1267-S1322 WeakPolarHBondContact CB-OG 3.5Å; C1267-S1322 PolarHBondContact SG-OG 3.18Å; C1267-M1326 HydrophobicContact CB-CG 4.36Å; C1267-M1326 HydrophobicContact CB-SD 3.97Å |
| 1268 | A | 95.1 | Very high | 97 | Very high | 70 Ų | 70 | 42.1 Ų | 42.1 | 58% | 0.579 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -71.1 | -40.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | R1265 V1266 | R1265-A1268 PolarHBondContact O-N 2.93Å; R1265-A1268 VanDerWaalsContact O-N 3.09Å; V1266-A1268 PolarHBondContact O-N 3.43Å |
| 1269 | L | 97.8 | Very high | 97 | Very high | 8 Ų | 8 | 42 Ų | 42 | 4% | 0.042 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -74.2 | -35.8 | 177.6 | -63.5 | 176.9 | 0 | 0 | 0 | 111.9 | V1234 K1235 L1262 R1265 S1271 H1272 A1275 S1276 M1279 | V1234-L1269 HydrophobicContact CG2-CD2 4.22Å; K1235-L1269 HydrophobicContact CG-CD2 4.4Å; L1262-L1269 HydrophobicContact CB-CD1 4.44Å; L1262-L1269 HydrophobicContact CD2-CD1 3.58Å; R1265-L1269 HydrophobicContact CB-CD1 3.98Å; R1265-L1269 HydrophobicContact CB-CG 4.13Å; R1265-L1269 WeakPolarHBondContact O-CG 3.22Å; R1265-L1269 PolarHBondContact O-N 3.25Å; L1269-S1271 PolarHBondContact O-N 3.3Å; L1269-H1272 PolarHBondContact O-N 3.05Å; L1269-A1275 HydrophobicContact CB-CB 4.02Å; L1269-A1275 HydrophobicContact CD2-CB 3.99Å; L1269-A1275 CarbonylContact O-C 3.59Å; L1269-A1275 VanDerWaalsContact O-C 3.29Å; L1269-A1275 WeakPolarHBondContact O-CB 3.23Å; L1269-S1276 PolarHBondContact O-N 3.26Å; L1269-M1279 HydrophobicContact CB-CG 3.95Å; L1269-M1279 HydrophobicContact CB-SD 4.2Å; L1269-M1279 HydrophobicContact CD1-SD 4.38Å |
| 1270 | S | 98.1 | Very high | 97 | Very high | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -62 | -32.5 | 174.7 | -61 | 0 | 0 | 0 | 0 | 112.8 | V1266 H1272 S1276 Y1331 A1332 | V1266-S1270 WeakPolarHBondContact O-CB 3.45Å; V1266-S1270 PolarHBondContact O-N 3.3Å; V1266-S1270 PolarHBondContact O-OG 3.33Å; S1270-H1272 PolarHBondContact O-N 3.17Å; S1270-S1276 VanDerWaalsContact O-CB 3.29Å; S1270-S1276 WeakPolarHBondContact O-CB 3.28Å; S1270-Y1331 CarbonylContact O-C 3.23Å; S1270-A1332 WeakPolarHBondContact O-CA 3.5Å; S1270-A1332 WeakPolarHBondContact O-CB 3.5Å; S1270-A1332 PolarHBondContact O-N 3.29Å; S1270-A1332 VanDerWaalsContact O-N 3.14Å |
| 1271 | S | 97.1 | Very high | 97.1 | Very high | 45 Ų | 45 | 38.8 Ų | 38.8 | 32% | 0.315 | 21% | 0.209 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.1 | 7.7 | -179.3 | -48.4 | 0 | 0 | 0 | 0 | 113.2 | C1267 L1269 D1329 | C1267-S1271 PolarHBondContact O-N 3Å; C1267-S1271 PolarHBondContact O-OG 3.15Å; L1269-S1271 PolarHBondContact O-N 3.3Å; S1271-D1329 WeakPolarHBondContact CA-OD2 3.21Å |
| 1272 | H | 98.3 | Very high | 97.2 | Very high | 66 Ų | 66 | 36.2 Ų | 36.2 | 31% | 0.306 | 20% | 0.195 | S | C | . | . | S | Bend | trans | -112.3 | 126.1 | -175.7 | -179.1 | -102.4 | 0 | 0 | 0 | 111.5 | K1235 L1269 S1270 F1274 A1275 S1276 | K1235-H1272 PolarHBondContact O-CE1 3.5Å; K1235-H1272 VanDerWaalsContact O-CE1 3.3Å; L1269-H1272 PolarHBondContact O-N 3.05Å; S1270-H1272 PolarHBondContact O-N 3.17Å; H1272-F1274 AromaticContact CE1-CD2 3.92Å; H1272-F1274 PolarHBondContact O-N 3.2Å; H1272-A1275 HydrophobicContact CB-CB 4.11Å; H1272-A1275 PolarHBondContact ND1-N 2.91Å; H1272-A1275 PolarHBondContact O-N 3.34Å; H1272-S1276 PolarHBondContact O-N 3.02Å; H1272-S1276 PolarHBondContact O-OG 2.75Å |
| 1273 | K | 98.3 | Very high | 97.2 | Very high | 109 Ų | 109 | 36.1 Ų | 36.1 | 47% | 0.474 | 20% | 0.195 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -43.1 | -39.4 | -171.3 | -179 | 172.9 | 175.5 | 60.1 | 0 | 115.9 | S1276 N1277 Y1331 | K1273-S1276 PolarHBondContact O-OG 2.93Å; K1273-N1277 PolarHBondContact O-ND2 3.22Å; K1273-Y1331 HydrophobicContact CB-CD1 4.42Å; K1273-Y1331 HydrophobicContact CB-CD2 4.4Å; K1273-Y1331 HydrophobicContact CB-CE1 3.88Å; K1273-Y1331 HydrophobicContact CB-CE2 3.85Å; K1273-Y1331 HydrophobicContact CD-CE1 4.46Å; K1273-Y1331 HydrophobicContact CG-CE1 3.77Å |
| 1274 | F | 98.5 | Very high | 97.3 | Very high | 55 Ų | 55 | 32 Ų | 32 | 24% | 0.241 | 19% | 0.187 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -97.4 | -34.7 | -178.8 | -57.6 | -60.3 | 0 | 0 | 0 | 112.7 | Q1237 N1240 H1272 N1277 | Q1237-F1274 HydrophobicContact CB-CD1 4.42Å; Q1237-F1274 HydrophobicContact CB-CD2 4.28Å; Q1237-F1274 HydrophobicContact CB-CE1 3.86Å; Q1237-F1274 HydrophobicContact CB-CE2 3.7Å; Q1237-F1274 HydrophobicContact CB-CZ 3.46Å; Q1237-F1274 VanDerWaalsContact CB-CZ 3.46Å; N1240-F1274 HydrophobicContact CB-CB 4.16Å; H1272-F1274 AromaticContact CE1-CD2 3.92Å; H1272-F1274 PolarHBondContact O-N 3.2Å; F1274-N1277 PolarHBondContact O-ND2 2.96Å |
| 1275 | A | 98.7 | Very high | 97.5 | Very high | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -82.4 | -17.4 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113 | V1234 L1269 H1272 N1277 V1278 M1279 | V1234-A1275 HydrophobicContact CB-CB 4.49Å; V1234-A1275 VanDerWaalsContact O-CA 3.28Å; V1234-A1275 WeakPolarHBondContact O-CA 3.48Å; V1234-A1275 VanDerWaalsContact O-CB 3.23Å; V1234-A1275 WeakPolarHBondContact O-CB 3.42Å; V1234-A1275 PolarHBondContact O-N 3.01Å; L1269-A1275 HydrophobicContact CB-CB 4.02Å; L1269-A1275 HydrophobicContact CD2-CB 3.99Å; L1269-A1275 CarbonylContact O-C 3.59Å; L1269-A1275 VanDerWaalsContact O-C 3.29Å; L1269-A1275 WeakPolarHBondContact O-CB 3.23Å; H1272-A1275 HydrophobicContact CB-CB 4.11Å; H1272-A1275 PolarHBondContact ND1-N 2.91Å; H1272-A1275 PolarHBondContact O-N 3.34Å; A1275-N1277 VanDerWaalsContact C-N 3.3Å; A1275-N1277 PolarHBondContact O-N 3.15Å; A1275-V1278 WeakPolarHBondContact O-CB 3.5Å; A1275-V1278 PolarHBondContact O-N 2.95Å; A1275-M1279 WeakPolarHBondContact O-CG 3.37Å; A1275-M1279 PolarHBondContact O-N 3.41Å |
| 1276 | S | 98.7 | Very high | 97.7 | Very high | 4 Ų | 4 | 28.1 Ų | 28.1 | 3% | 0.028 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -57.7 | -43.5 | 169.8 | 62.4 | 0 | 0 | 0 | 0 | 111.5 | L1269 S1270 H1272 K1273 M1279 E1280 | L1269-S1276 PolarHBondContact O-N 3.26Å; S1270-S1276 VanDerWaalsContact O-CB 3.29Å; S1270-S1276 WeakPolarHBondContact O-CB 3.28Å; H1272-S1276 PolarHBondContact O-N 3.02Å; H1272-S1276 PolarHBondContact O-OG 2.75Å; K1273-S1276 PolarHBondContact O-OG 2.93Å; S1276-M1279 PolarHBondContact O-N 3.31Å; S1276-E1280 PolarHBondContact O-N 3.38Å |
| 1277 | N | 98.7 | Very high | 97.7 | Very high | 58 Ų | 58 | 30.7 Ų | 30.7 | 31% | 0.31 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -64.9 | -41.3 | 176.8 | -41.1 | -82.9 | 0 | 0 | 0 | 110.7 | K1273 F1274 A1275 E1280 K1281 | K1273-N1277 PolarHBondContact O-ND2 3.22Å; F1274-N1277 PolarHBondContact O-ND2 2.96Å; A1275-N1277 VanDerWaalsContact C-N 3.3Å; A1275-N1277 PolarHBondContact O-N 3.15Å; N1277-E1280 WeakPolarHBondContact O-CB 3.5Å; N1277-E1280 PolarHBondContact O-N 3.11Å; N1277-K1281 WeakPolarHBondContact O-CG 3.35Å; N1277-K1281 PolarHBondContact O-N 2.81Å |
| 1278 | V | 98.8 | Very high | 97.7 | Very high | 1 Ų | 1 | 33.2 Ų | 33.2 | 1% | 0.006 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -61.3 | -44.4 | 173.8 | -176.5 | 0 | 0 | 0 | 0 | 111 | V1234 N1240 I1243 Q1244 L1247 L1262 A1275 E1280 K1281 A1282 | V1234-V1278 HydrophobicContact CB-CB 4.41Å; V1234-V1278 HydrophobicContact CB-CG1 4.22Å; V1234-V1278 HydrophobicContact CB-CG2 4.09Å; V1234-V1278 HydrophobicContact CG1-CB 4.43Å; V1234-V1278 HydrophobicContact CG1-CG1 3.74Å; V1234-V1278 HydrophobicContact CG1-CG2 4.26Å; N1240-V1278 HydrophobicContact CB-CG2 3.83Å; I1243-V1278 HydrophobicContact CG2-CG1 3.87Å; Q1244-V1278 HydrophobicContact CG-CG2 4.16Å; L1247-V1278 HydrophobicContact CD1-CG1 3.79Å; L1262-V1278 HydrophobicContact CD1-CG1 4.32Å; L1262-V1278 HydrophobicContact CD2-CG1 4.34Å; A1275-V1278 WeakPolarHBondContact O-CB 3.5Å; A1275-V1278 PolarHBondContact O-N 2.95Å; V1278-E1280 PolarHBondContact O-N 3.32Å; V1278-K1281 PolarHBondContact O-N 3.34Å; V1278-A1282 WeakPolarHBondContact O-CB 3.41Å; V1278-A1282 PolarHBondContact O-N 3.1Å |
| 1279 | M | 98.4 | Very high | 97.8 | Very high | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62 | -42.8 | 175.2 | -72.7 | -50.9 | -43 | 0 | 0 | 111.7 | L1262 V1266 L1269 A1275 S1276 K1281 A1282 I1283 L1294 V1335 | L1262-M1279 HydrophobicContact CB-SD 3.96Å; L1262-M1279 HydrophobicContact CD1-CE 4.49Å; L1262-M1279 HydrophobicContact CD1-SD 3.93Å; L1262-M1279 HydrophobicContact CD2-SD 4.1Å; L1262-M1279 HydrophobicContact CG-SD 4.21Å; V1266-M1279 HydrophobicContact CB-CE 4.48Å; V1266-M1279 HydrophobicContact CG1-CE 4.17Å; V1266-M1279 HydrophobicContact CG2-CE 3.91Å; L1269-M1279 HydrophobicContact CB-CG 3.95Å; L1269-M1279 HydrophobicContact CB-SD 4.2Å; L1269-M1279 HydrophobicContact CD1-SD 4.38Å; A1275-M1279 WeakPolarHBondContact O-CG 3.37Å; A1275-M1279 PolarHBondContact O-N 3.41Å; S1276-M1279 PolarHBondContact O-N 3.31Å; M1279-K1281 PolarHBondContact O-N 3.47Å; M1279-A1282 PolarHBondContact O-N 3.5Å; M1279-I1283 HydrophobicContact CE-CD1 4.38Å; M1279-I1283 HydrophobicContact CE-CG1 4.49Å; M1279-I1283 WeakPolarHBondContact O-CB 3.48Å; M1279-I1283 VanDerWaalsContact O-CD1 3.28Å; M1279-I1283 WeakPolarHBondContact O-CD1 3.37Å; M1279-I1283 VanDerWaalsContact O-CG1 3.22Å; M1279-I1283 WeakPolarHBondContact O-CG1 3.44Å; M1279-I1283 PolarHBondContact O-N 2.93Å; M1279-L1294 HydrophobicContact CE-CD1 4.34Å; M1279-L1294 HydrophobicContact CE-CD2 4.22Å; M1279-V1335 HydrophobicContact CB-CG1 4.02Å; M1279-V1335 HydrophobicContact CB-CG2 4.31Å |
| 1280 | E | 98.5 | Very high | 97.7 | Very high | 29 Ų | 29 | 34.9 Ų | 34.9 | 14% | 0.136 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59 | -41 | 174.5 | -89.8 | -172.2 | -117.9 | 0 | 0 | 113.2 | S1276 N1277 V1278 A1284 Y1334 V1335 R1338 | S1276-E1280 PolarHBondContact O-N 3.38Å; N1277-E1280 WeakPolarHBondContact O-CB 3.5Å; N1277-E1280 PolarHBondContact O-N 3.11Å; V1278-E1280 PolarHBondContact O-N 3.32Å; E1280-A1284 VanDerWaalsContact O-CB 3.3Å; E1280-A1284 WeakPolarHBondContact O-CB 3.5Å; E1280-A1284 PolarHBondContact O-N 3.09Å; E1280-A1284 VanDerWaalsContact O-N 3.15Å; E1280-Y1334 VanDerWaalsContact OE1-CB 3.28Å; E1280-Y1334 WeakPolarHBondContact OE1-CB 3.3Å; E1280-V1335 HydrophobicContact CG-CG2 4.29Å; E1280-R1338 HydrophobicContact CG-CB 4.02Å; E1280-R1338 HydrophobicContact CG-CG 4.27Å; E1280-R1338 IonicContact OE2-CZ 3.99Å; E1280-R1338 IonicContact OE2-NH1 2.67Å; E1280-R1338 PolarHBondContact OE2-NH1 3.36Å; E1280-R1338 IonicContact OE2-NH2 2.96Å; E1280-R1338 PolarHBondContact OE2-NH2 2.97Å |
| 1281 | K | 98.4 | Very high | 97.6 | Very high | 32 Ų | 32 | 37.3 Ų | 37.3 | 14% | 0.139 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -72.8 | -36.3 | 174.4 | -62.9 | -55.5 | -170 | 161.1 | 0 | 112.4 | Q1244 L1247 E1248 N1277 V1278 M1279 A1284 N1285 | Q1244-K1281 HydrophobicContact CB-CG 3.98Å; Q1244-K1281 HydrophobicContact CG-CB 4.23Å; Q1244-K1281 HydrophobicContact CG-CG 3.6Å; Q1244-K1281 VanDerWaalsContact OE1-CG 3.24Å; L1247-K1281 HydrophobicContact CB-CB 4.33Å; L1247-K1281 HydrophobicContact CD1-CB 4.21Å; E1248-K1281 HydrophobicContact CG-CD 4.33Å; E1248-K1281 VanDerWaalsContact OE1-CD 3.29Å; E1248-K1281 WeakPolarHBondContact OE1-CD 3.46Å; E1248-K1281 WeakPolarHBondContact OE1-CE 3.47Å; E1248-K1281 IonicContact OE1-NZ 3.52Å; E1248-K1281 PolarHBondContact OE1-NZ 3.22Å; E1248-K1281 IonicContact OE2-NZ 3.72Å; N1277-K1281 WeakPolarHBondContact O-CG 3.35Å; N1277-K1281 PolarHBondContact O-N 2.81Å; V1278-K1281 PolarHBondContact O-N 3.34Å; M1279-K1281 PolarHBondContact O-N 3.47Å; K1281-A1284 PolarHBondContact O-N 3.29Å; K1281-N1285 WeakPolarHBondContact O-CB 3.3Å; K1281-N1285 PolarHBondContact O-N 3.34Å; K1281-N1285 PolarHBondContact O-ND2 2.97Å |
| 1282 | A | 98.5 | Very high | 97.5 | Very high | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.7 | -48.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | L1247 I1259 L1262 V1278 M1279 A1284 N1285 A1286 L1294 | L1247-A1282 HydrophobicContact CD1-CB 4.06Å; L1247-A1282 HydrophobicContact CD2-CB 4.37Å; I1259-A1282 HydrophobicContact CG1-CB 4.29Å; L1262-A1282 HydrophobicContact CD1-CB 3.55Å; V1278-A1282 WeakPolarHBondContact O-CB 3.41Å; V1278-A1282 PolarHBondContact O-N 3.1Å; M1279-A1282 PolarHBondContact O-N 3.5Å; A1282-A1284 PolarHBondContact O-N 3Å; A1282-N1285 PolarHBondContact O-N 3.01Å; A1282-A1286 WeakPolarHBondContact O-CB 3.46Å; A1282-A1286 PolarHBondContact O-N 3.27Å; A1282-L1294 HydrophobicContact CB-CD1 4.43Å |
| 1283 | I | 97.8 | Very high | 97.3 | Very high | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.7 | -29 | 176.4 | -64.2 | 156.9 | 0 | 0 | 0 | 111.6 | M1279 R1291 L1294 V1335 R1338 M1339 | M1279-I1283 HydrophobicContact CE-CD1 4.38Å; M1279-I1283 HydrophobicContact CE-CG1 4.49Å; M1279-I1283 WeakPolarHBondContact O-CB 3.48Å; M1279-I1283 VanDerWaalsContact O-CD1 3.28Å; M1279-I1283 WeakPolarHBondContact O-CD1 3.37Å; M1279-I1283 VanDerWaalsContact O-CG1 3.22Å; M1279-I1283 WeakPolarHBondContact O-CG1 3.44Å; M1279-I1283 PolarHBondContact O-N 2.93Å; I1283-R1291 HydrophobicContact CG2-CG 4.3Å; I1283-R1291 VanDerWaalsContact O-CD 3.25Å; I1283-R1291 WeakPolarHBondContact O-CD 3.38Å; I1283-L1294 HydrophobicContact CG1-CD1 4.18Å; I1283-V1335 HydrophobicContact CD1-CG1 3.48Å; I1283-V1335 VanDerWaalsContact CD1-CG1 3.48Å; I1283-R1338 HydrophobicContact CG2-CG 4.22Å; I1283-M1339 HydrophobicContact CD1-CE 3.56Å; I1283-M1339 HydrophobicContact CD1-CG 3.82Å; I1283-M1339 HydrophobicContact CD1-SD 4.49Å; I1283-M1339 HydrophobicContact CG1-CE 4.36Å; I1283-M1339 HydrophobicContact CG2-CG 4.31Å |
| 1284 | A | 97.9 | Very high | 97.1 | Very high | 34 Ų | 34 | 29.4 Ų | 29.4 | 28% | 0.281 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -76.9 | -31.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | E1280 K1281 A1282 L1342 | E1280-A1284 VanDerWaalsContact O-CB 3.3Å; E1280-A1284 WeakPolarHBondContact O-CB 3.5Å; E1280-A1284 PolarHBondContact O-N 3.09Å; E1280-A1284 VanDerWaalsContact O-N 3.15Å; K1281-A1284 PolarHBondContact O-N 3.29Å; A1282-A1284 PolarHBondContact O-N 3Å; A1284-L1342 HydrophobicContact CB-CD1 3.9Å |
| 1285 | N | 97.6 | Very high | 96.9 | Very high | 34 Ų | 34 | 26.8 Ų | 26.8 | 18% | 0.182 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -114.2 | -6.2 | -172.2 | -66.5 | -88.3 | 0 | 0 | 0 | 114.6 | L1247 K1255 K1281 A1282 | L1247-N1285 WeakPolarHBondContact O-CB 3.16Å; L1247-N1285 PolarHBondContact O-OD1 3.1Å; K1255-N1285 HydrophobicContact CD-CB 4.44Å; K1281-N1285 WeakPolarHBondContact O-CB 3.3Å; K1281-N1285 PolarHBondContact O-N 3.34Å; K1281-N1285 PolarHBondContact O-ND2 2.97Å; A1282-N1285 PolarHBondContact O-N 3.01Å |
| 1286 | A | 97 | Very high | 96.5 | Very high | 7 Ų | 7 | 31.7 Ų | 31.7 | 6% | 0.058 | 18% | 0.181 | C | C | . | . | S | Bend | trans | -62.1 | 144.5 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | I1259 A1282 E1290 R1291 | I1259-A1286 HydrophobicContact CD1-CB 3.67Å; A1282-A1286 WeakPolarHBondContact O-CB 3.46Å; A1282-A1286 PolarHBondContact O-N 3.27Å; A1286-E1290 HydrophobicContact CB-CB 3.85Å; A1286-R1291 HydrophobicContact CB-CB 4.12Å |
| 1287 | V | 95.4 | Very high | 96.1 | Very high | 55 Ų | 55 | 32.5 Ų | 32.5 | 33% | 0.333 | 19% | 0.185 | S | C | . | . | trans | -65.8 | 157.4 | 168.9 | -61.1 | 0 | 0 | 0 | 0 | 110.1 | S1289 E1290 R1291 | V1287-S1289 VanDerWaalsContact C-N 3.26Å; V1287-S1289 PolarHBondContact O-N 3.22Å; V1287-S1289 VanDerWaalsContact O-N 3.07Å; V1287-E1290 HydrophobicContact CG2-CB 4.08Å; V1287-E1290 HydrophobicContact CG2-CG 3.72Å; V1287-E1290 PolarHBondContact N-OE2 3.18Å; V1287-E1290 WeakPolarHBondContact O-CB 3.33Å; V1287-E1290 PolarHBondContact O-N 2.85Å; V1287-R1291 PolarHBondContact O-N 2.92Å | ||
| 1288 | P | 95.1 | Very high | 95.6 | Very high | 91 Ų | 91 | 29.8 Ų | 29.8 | 59% | 0.591 | 17% | 0.17 | S | C | * | . | H | α-helix | trans | -54.3 | -35.1 | -170.8 | -30.4 | 36.9 | 0 | 0 | 0 | 115.7 | A1292 | P1288-A1292 WeakPolarHBondContact O-CB 3.38Å; P1288-A1292 PolarHBondContact O-N 2.94Å |
| 1289 | S | 95.4 | Very high | 94.8 | Very high | 83 Ų | 83 | 30.1 Ų | 30.1 | 58% | 0.58 | 17% | 0.172 | S | C | * | . | H | α-helix | trans | -70 | -38.8 | 175.9 | 48.1 | 0 | 0 | 0 | 0 | 113.4 | V1287 A1292 V1293 | V1287-S1289 VanDerWaalsContact C-N 3.26Å; V1287-S1289 PolarHBondContact O-N 3.22Å; V1287-S1289 VanDerWaalsContact O-N 3.07Å; S1289-A1292 WeakPolarHBondContact O-CB 3.33Å; S1289-V1293 WeakPolarHBondContact O-CG2 3.14Å; S1289-V1293 PolarHBondContact O-N 3.07Å |
| 1290 | E | 96.5 | Very high | 93.6 | Very high | 29 Ų | 29 | 34.8 Ų | 34.8 | 14% | 0.136 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -68.8 | -41 | 173.6 | -72.7 | -179.8 | 148.8 | 0 | 0 | 111.4 | S1256 I1259 A1286 V1287 A1292 V1293 L1294 | S1256-E1290 VanDerWaalsContact CA-OE1 3.26Å; S1256-E1290 WeakPolarHBondContact CA-OE1 3.2Å; S1256-E1290 WeakPolarHBondContact CB-OE1 3.08Å; S1256-E1290 PolarHBondContact OG-OE1 3.24Å; I1259-E1290 VanDerWaalsContact CD1-OE2 3.31Å; I1259-E1290 WeakPolarHBondContact CD1-OE2 3.37Å; I1259-E1290 HydrophobicContact CG2-CB 4.2Å; I1259-E1290 HydrophobicContact CG2-CG 4.4Å; A1286-E1290 HydrophobicContact CB-CB 3.85Å; V1287-E1290 HydrophobicContact CG2-CB 4.08Å; V1287-E1290 HydrophobicContact CG2-CG 3.72Å; V1287-E1290 PolarHBondContact N-OE2 3.18Å; V1287-E1290 WeakPolarHBondContact O-CB 3.33Å; V1287-E1290 PolarHBondContact O-N 2.85Å; E1290-A1292 VanDerWaalsContact C-N 3.35Å; E1290-V1293 WeakPolarHBondContact O-CB 3.39Å; E1290-V1293 PolarHBondContact O-N 2.88Å; E1290-L1294 WeakPolarHBondContact O-CG 3.4Å; E1290-L1294 PolarHBondContact O-N 3.23Å |
| 1291 | R | 96.1 | Very high | 91.7 | Very high | 52 Ų | 52 | 35 Ų | 35 | 20% | 0.196 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.2 | -40.6 | 175.4 | -173 | 170.5 | 67.2 | -148 | 3.4 | 111.9 | I1283 A1286 V1287 L1294 I1295 L1342 | I1283-R1291 HydrophobicContact CG2-CG 4.3Å; I1283-R1291 VanDerWaalsContact O-CD 3.25Å; I1283-R1291 WeakPolarHBondContact O-CD 3.38Å; A1286-R1291 HydrophobicContact CB-CB 4.12Å; V1287-R1291 PolarHBondContact O-N 2.92Å; R1291-L1294 PolarHBondContact O-N 3.35Å; R1291-I1295 HydrophobicContact CG-CD1 3.95Å; R1291-I1295 WeakPolarHBondContact O-CG1 3.35Å; R1291-I1295 PolarHBondContact O-N 3Å; R1291-I1295 VanDerWaalsContact O-N 3.13Å; R1291-L1342 PolarHBondContact NE-O 3.47Å; R1291-L1342 PolarHBondContact NH2-O 3.32Å |
| 1292 | A | 94.2 | Very high | 89.5 | Confident | 15 Ų | 15 | 38.7 Ų | 38.7 | 12% | 0.124 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -55.3 | -53.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | P1288 S1289 E1290 L1294 I1295 E1296 Q1347 | P1288-A1292 WeakPolarHBondContact O-CB 3.38Å; P1288-A1292 PolarHBondContact O-N 2.94Å; S1289-A1292 WeakPolarHBondContact O-CB 3.33Å; E1290-A1292 VanDerWaalsContact C-N 3.35Å; A1292-L1294 VanDerWaalsContact C-N 3.35Å; A1292-L1294 PolarHBondContact O-N 3.17Å; A1292-I1295 PolarHBondContact O-N 2.8Å; A1292-E1296 WeakPolarHBondContact O-CB 3.49Å; A1292-E1296 WeakPolarHBondContact O-CG 3.27Å; A1292-E1296 PolarHBondContact O-N 3.38Å; A1292-Q1347 VanDerWaalsContact CA-NE2 3.28Å |
| 1293 | V | 94.2 | Very high | 86.9 | Confident | 38 Ų | 38 | 41.7 Ų | 41.7 | 23% | 0.23 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -57.1 | -41.5 | 179 | 160.9 | 0 | 0 | 0 | 0 | 113.1 | R1263 S1289 E1290 I1295 E1297 | R1263-V1293 HydrophobicContact CG-CG1 4.3Å; S1289-V1293 WeakPolarHBondContact O-CG2 3.14Å; S1289-V1293 PolarHBondContact O-N 3.07Å; E1290-V1293 WeakPolarHBondContact O-CB 3.39Å; E1290-V1293 PolarHBondContact O-N 2.88Å; V1293-I1295 VanDerWaalsContact C-N 3.32Å; V1293-I1295 PolarHBondContact O-N 2.96Å; V1293-E1297 PolarHBondContact O-N 3.22Å |
| 1294 | L | 95.4 | Very high | 84.3 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -68.6 | -28.4 | 177 | -68.6 | 177.4 | 0 | 0 | 0 | 113.3 | I1259 R1263 V1266 M1279 A1282 I1283 E1290 R1291 A1292 M1339 | I1259-L1294 HydrophobicContact CG2-CD1 4.09Å; I1259-L1294 HydrophobicContact CG2-CD2 4.37Å; I1259-L1294 HydrophobicContact CG2-CG 4.34Å; R1263-L1294 HydrophobicContact CG-CD2 4.2Å; V1266-L1294 HydrophobicContact CG2-CD2 3.74Å; M1279-L1294 HydrophobicContact CE-CD1 4.34Å; M1279-L1294 HydrophobicContact CE-CD2 4.22Å; A1282-L1294 HydrophobicContact CB-CD1 4.43Å; I1283-L1294 HydrophobicContact CG1-CD1 4.18Å; E1290-L1294 WeakPolarHBondContact O-CG 3.4Å; E1290-L1294 PolarHBondContact O-N 3.23Å; R1291-L1294 PolarHBondContact O-N 3.35Å; A1292-L1294 VanDerWaalsContact C-N 3.35Å; A1292-L1294 PolarHBondContact O-N 3.17Å; L1294-M1339 WeakPolarHBondContact O-CE 3.34Å |
| 1295 | I | 93.6 | Very high | 81.6 | Confident | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -82.5 | -40 | 176.4 | -69.1 | 167.1 | 0 | 0 | 0 | 110.6 | R1291 A1292 V1293 E1297 I1298 L1299 M1339 A1343 L1351 | R1291-I1295 HydrophobicContact CG-CD1 3.95Å; R1291-I1295 WeakPolarHBondContact O-CG1 3.35Å; R1291-I1295 PolarHBondContact O-N 3Å; R1291-I1295 VanDerWaalsContact O-N 3.13Å; A1292-I1295 PolarHBondContact O-N 2.8Å; V1293-I1295 VanDerWaalsContact C-N 3.32Å; V1293-I1295 PolarHBondContact O-N 2.96Å; I1295-E1297 VanDerWaalsContact C-N 3.29Å; I1295-E1297 PolarHBondContact O-N 3.13Å; I1295-I1298 WeakPolarHBondContact O-CG1 3.44Å; I1295-I1298 PolarHBondContact O-N 2.92Å; I1295-L1299 HydrophobicContact CG2-CD1 3.83Å; I1295-L1299 HydrophobicContact CG2-CG 4.4Å; I1295-L1299 WeakPolarHBondContact O-CG 3.45Å; I1295-L1299 PolarHBondContact O-N 3.33Å; I1295-M1339 HydrophobicContact CG1-CB 4.32Å; I1295-M1339 HydrophobicContact CG1-CE 4.36Å; I1295-M1339 HydrophobicContact CG1-CG 3.98Å; I1295-M1339 HydrophobicContact CG1-SD 4.16Å; I1295-A1343 HydrophobicContact CD1-CB 4.05Å; I1295-L1351 HydrophobicContact CG2-CD1 3.9Å; I1295-L1351 HydrophobicContact CG2-CD2 4.32Å; I1295-L1351 HydrophobicContact CG2-CG 4.16Å |
| 1296 | E | 90.6 | Very high | 78.9 | Confident | 103 Ų | 103 | 56.9 Ų | 56.9 | 48% | 0.481 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60.3 | -37.7 | 177.2 | -77 | 170.2 | -165.1 | 0 | 0 | 112.3 | A1292 I1298 L1299 H1300 | A1292-E1296 WeakPolarHBondContact O-CB 3.49Å; A1292-E1296 WeakPolarHBondContact O-CG 3.27Å; A1292-E1296 PolarHBondContact O-N 3.38Å; E1296-I1298 PolarHBondContact O-N 3.43Å; E1296-I1298 VanDerWaalsContact O-N 3.16Å; E1296-L1299 PolarHBondContact O-N 3.23Å; E1296-H1300 PolarHBondContact O-N 2.99Å |
| 1297 | E | 90.3 | Very high | 76.9 | Confident | 21 Ų | 21 | 60.8 Ų | 60.8 | 10% | 0.098 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -56.8 | -29.4 | 177.9 | -171.4 | 175.9 | 130.9 | 0 | 0 | 113.5 | R1263 G1264 R1265 V1266 V1293 I1295 H1300 P1301 | R1263-E1297 WeakPolarHBondContact CA-OE2 3.34Å; G1264-E1297 VanDerWaalsContact CA-OE1 3.31Å; G1264-E1297 WeakPolarHBondContact CA-OE1 3.37Å; G1264-E1297 PolarHBondContact N-OE1 3.23Å; G1264-E1297 VanDerWaalsContact N-OE1 3.13Å; G1264-E1297 PolarHBondContact N-OE2 3.26Å; R1265-E1297 PolarHBondContact N-OE1 3.02Å; V1266-E1297 HydrophobicContact CB-CG 4.48Å; V1266-E1297 VanDerWaalsContact CB-OE1 3.3Å; V1266-E1297 WeakPolarHBondContact CB-OE1 3.31Å; V1266-E1297 HydrophobicContact CG2-CG 4.43Å; V1266-E1297 VanDerWaalsContact CG2-OE1 3.27Å; V1266-E1297 WeakPolarHBondContact CG2-OE1 3.22Å; V1266-E1297 PolarHBondContact N-OE1 3.31Å; V1293-E1297 PolarHBondContact O-N 3.22Å; I1295-E1297 VanDerWaalsContact C-N 3.29Å; I1295-E1297 PolarHBondContact O-N 3.13Å; E1297-H1300 CarbonylContact O-C 3.57Å; E1297-P1301 WeakPolarHBondContact O-CA 3.34Å |
| 1298 | I | 87.3 | Confident | 74.6 | Confident | 1 Ų | 1 | 64.6 Ų | 64.6 | 1% | 0.005 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -96.8 | -16.2 | 177.2 | 69.5 | 154 | 0 | 0 | 0 | 113.6 | V1266 I1295 E1296 L1323 M1326 M1339 L1351 | V1266-I1298 HydrophobicContact CB-CG2 4.24Å; V1266-I1298 HydrophobicContact CG1-CG2 3.63Å; I1295-I1298 WeakPolarHBondContact O-CG1 3.44Å; I1295-I1298 PolarHBondContact O-N 2.92Å; E1296-I1298 PolarHBondContact O-N 3.43Å; E1296-I1298 VanDerWaalsContact O-N 3.16Å; I1298-L1323 HydrophobicContact CD1-CD1 4.11Å; I1298-M1326 HydrophobicContact CB-SD 4.23Å; I1298-M1326 HydrophobicContact CD1-CE 4.23Å; I1298-M1326 HydrophobicContact CD1-SD 4.41Å; I1298-M1326 HydrophobicContact CG2-CE 4.13Å; I1298-M1326 HydrophobicContact CG2-SD 3.63Å; I1298-M1339 HydrophobicContact CD1-CE 4.12Å; I1298-M1339 HydrophobicContact CD1-SD 3.3Å; I1298-M1339 WeakPolarHBondContact CD1-SD 3.31Å; I1298-M1339 HydrophobicContact CG1-CE 4.34Å; I1298-M1339 HydrophobicContact CG1-SD 3.98Å; I1298-L1351 HydrophobicContact CD1-CD2 4.42Å |
| 1299 | L | 82.7 | Confident | 72 | Confident | 8 Ų | 8 | 63 Ų | 63 | 4% | 0.042 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -82 | -33.1 | 173.2 | -69.5 | 172.7 | 0 | 0 | 0 | 111.7 | I1295 E1296 I1319 V1350 L1351 R1354 | I1295-L1299 HydrophobicContact CG2-CD1 3.83Å; I1295-L1299 HydrophobicContact CG2-CG 4.4Å; I1295-L1299 WeakPolarHBondContact O-CG 3.45Å; I1295-L1299 PolarHBondContact O-N 3.33Å; E1296-L1299 PolarHBondContact O-N 3.23Å; L1299-I1319 WeakPolarHBondContact O-CG2 3.33Å; L1299-V1350 HydrophobicContact CD1-CB 4.47Å; L1299-V1350 HydrophobicContact CD1-CG1 3.81Å; L1299-V1350 HydrophobicContact CD2-CG1 4.01Å; L1299-V1350 HydrophobicContact CG-CG1 4.49Å; L1299-L1351 HydrophobicContact CD2-CD2 3.82Å; L1299-L1351 HydrophobicContact CD2-CG 4.23Å; L1299-L1351 HydrophobicContact CG-CD2 4.33Å; L1299-R1354 HydrophobicContact CD2-CB 4.42Å; L1299-R1354 HydrophobicContact CD2-CG 3.76Å |
| 1300 | H | 73.7 | Confident | 69.7 | Low | 98 Ų | 98 | 65 Ų | 65 | 45% | 0.454 | 36% | 0.361 | S | S | . | . | S | Bend | trans | -139.5 | 79.3 | 177.6 | -51.3 | 109.9 | 0 | 0 | 0 | 108 | E1296 E1297 I1302 R1354 | E1296-H1300 PolarHBondContact O-N 2.99Å; E1297-H1300 CarbonylContact O-C 3.57Å; H1300-I1302 PolarHBondContact O-N 3.44Å; H1300-I1302 VanDerWaalsContact O-N 3.12Å; H1300-R1354 PolarHBondContact CD2-NH2 3.14Å; H1300-R1354 VanDerWaalsContact CD2-NH2 3.33Å; H1300-R1354 PolarHBondContact NE2-NH2 3.08Å |
| 1301 | P | 58.1 | Low | 67.4 | Low | 35 Ų | 35 | 70.6 Ų | 70.6 | 23% | 0.227 | 40% | 0.397 | C | S | . | . | trans | -46.8 | 123.8 | 172.6 | -29.8 | 37.5 | 0 | 0 | 0 | 109.9 | E1297 S1303 | E1297-P1301 WeakPolarHBondContact O-CA 3.34Å; P1301-S1303 PolarHBondContact O-N 2.9Å | ||
| 1302 | I | 52.5 | Low | 64.8 | Low | 108 Ų | 108 | 72.6 Ų | 72.6 | 55% | 0.554 | 42% | 0.419 | S | S | * | . | trans | -53.6 | 110.6 | -177.5 | -61.3 | 172.4 | 0 | 0 | 0 | 106.4 | H1300 N1304 | H1300-I1302 PolarHBondContact O-N 3.44Å; H1300-I1302 VanDerWaalsContact O-N 3.12Å; I1302-N1304 PolarHBondContact O-N 3.44Å; I1302-N1304 VanDerWaalsContact O-N 3.11Å | ||
| 1303 | S | 44.3 | Very low | 62.4 | Low | 64 Ų | 64 | 76.3 Ų | 76.3 | 45% | 0.448 | 44% | 0.444 | S | S | . | . | trans | -55.8 | 121.9 | 172.8 | 51 | 0 | 0 | 0 | 0 | 107.1 | P1301 V1305 | P1301-S1303 PolarHBondContact O-N 2.9Å; S1303-V1305 VanDerWaalsContact C-N 3.29Å; S1303-V1305 PolarHBondContact O-N 3.15Å | ||
| 1304 | N | 42.4 | Very low | 60 | Low | 153 Ų | 153 | 79.1 Ų | 79.1 | 82% | 0.818 | 46% | 0.461 | S | S | * | . | trans | -56.7 | 101.8 | 167.2 | -81.7 | -4.3 | 0 | 0 | 0 | 106.7 | I1302 N1306 | I1302-N1304 PolarHBondContact O-N 3.44Å; I1302-N1304 VanDerWaalsContact O-N 3.11Å; N1304-N1306 PolarHBondContact O-N 3.06Å | ||
| 1305 | V | 41.8 | Very low | 57.5 | Low | 115 Ų | 115 | 82.4 Ų | 82.4 | 70% | 0.697 | 48% | 0.481 | S | S | * | . | trans | -70.4 | 88.1 | 174.7 | -179.7 | 0 | 0 | 0 | 0 | 105.6 | S1303 I1307 | S1303-V1305 VanDerWaalsContact C-N 3.29Å; S1303-V1305 PolarHBondContact O-N 3.15Å; V1305-I1307 PolarHBondContact O-N 3.31Å; V1305-I1307 VanDerWaalsContact O-N 3.12Å | ||
| 1306 | N | 39.3 | Very low | 55.2 | Low | 119 Ų | 119 | 87.5 Ų | 87.5 | 64% | 0.636 | 51% | 0.513 | S | S | * | . | trans | -53.1 | 121.6 | 164.4 | -104.3 | -1.9 | 0 | 0 | 0 | 106.3 | N1304 N1308 G1309 | N1304-N1306 PolarHBondContact O-N 3.06Å; N1306-N1308 PolarHBondContact O-N 2.82Å; N1306-G1309 PolarHBondContact O-N 3.09Å | ||
| 1307 | I | 56 | Low | 53.3 | Low | 88 Ų | 88 | 88.2 Ų | 88.2 | 45% | 0.451 | 52% | 0.52 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -13.1 | -166.8 | -62.7 | 118.9 | 0 | 0 | 0 | 112.7 | Q542 V1305 G1309 | Q542-I1307 HydrophobicContact CB-CG2 3.86Å; Q542-I1307 HydrophobicContact CG-CG1 4.2Å; Q542-I1307 HydrophobicContact CG-CG2 3.99Å; Q542-I1307 VanDerWaalsContact OE1-CD1 3.27Å; V1305-I1307 PolarHBondContact O-N 3.31Å; V1305-I1307 VanDerWaalsContact O-N 3.12Å; I1307-G1309 VanDerWaalsContact C-N 3.31Å; I1307-G1309 PolarHBondContact O-N 3.03Å |
| 1308 | N | 46.2 | Very low | 51.4 | Low | 136 Ų | 136 | 92.5 Ų | 92.5 | 73% | 0.727 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.1 | 0.8 | -177.1 | -51.2 | -3 | 0 | 0 | 0 | 113.7 | N1306 D1310 | N1306-N1308 PolarHBondContact O-N 2.82Å; N1308-D1310 PolarHBondContact O-N 2.82Å |
| 1309 | G | 41.9 | Very low | 49.7 | Very low | 56 Ų | 56 | 94.5 Ų | 94.5 | 58% | 0.577 | 55% | 0.554 | S | S | * | * | trans | 75.3 | -11.3 | 171.1 | 0 | 0 | 0 | 0 | 0 | 116.9 | N1306 I1307 T1311 | N1306-G1309 PolarHBondContact O-N 3.09Å; I1307-G1309 VanDerWaalsContact C-N 3.31Å; I1307-G1309 PolarHBondContact O-N 3.03Å; G1309-T1311 PolarHBondContact O-N 3.14Å; G1309-T1311 PolarHBondContact O-OG1 3.41Å | ||
| 1310 | D | 46 | Very low | 48.4 | Very low | 127 Ų | 127 | 96.5 Ų | 96.5 | 68% | 0.679 | 57% | 0.568 | S | S | * | * | trans | -57.1 | 106.8 | 177.9 | -90.2 | -23.9 | 0 | 0 | 0 | 112.1 | N1308 S1312 | N1308-D1310 PolarHBondContact O-N 2.82Å; D1310-S1312 PolarHBondContact O-N 3.4Å | ||
| 1311 | T | 48.1 | Very low | 48.4 | Very low | 146 Ų | 146 | 93.2 Ų | 93.2 | 90% | 0.896 | 56% | 0.556 | S | S | * | * | trans | -79.7 | 47.2 | 175.5 | -49 | 0 | 0 | 0 | 0 | 110.5 | G1309 S1313 | G1309-T1311 PolarHBondContact O-N 3.14Å; G1309-T1311 PolarHBondContact O-OG1 3.41Å; T1311-S1313 PolarHBondContact O-N 2.67Å | ||
| 1312 | S | 42.6 | Very low | 49.6 | Very low | 94 Ų | 94 | 92.4 Ų | 92.4 | 66% | 0.657 | 55% | 0.552 | S | S | * | * | trans | -79.3 | 77.1 | -169.7 | -75.1 | 0 | 0 | 0 | 0 | 112.2 | D1310 | D1310-S1312 PolarHBondContact O-N 3.4Š| ||
| 1313 | S | 43.5 | Very low | 51.3 | Low | 93 Ų | 93 | 87.6 Ų | 87.6 | 65% | 0.65 | 53% | 0.527 | S | S | * | . | trans | 50 | 75.4 | 165.4 | -168.4 | 0 | 0 | 0 | 0 | 114.8 | T1311 T1315 | T1311-S1313 PolarHBondContact O-N 2.67Å; S1313-T1315 PolarHBondContact O-N 2.71Å | ||
| 1314 | V | 44.2 | Very low | 53.4 | Low | 97 Ų | 97 | 85.6 Ų | 85.6 | 59% | 0.588 | 51% | 0.512 | S | S | * | . | trans | -63.4 | 91.4 | 156.6 | 179.5 | 0 | 0 | 0 | 0 | 107.4 | T1316 I1319 | V1314-T1316 PolarHBondContact O-N 2.89Å; V1314-I1319 HydrophobicContact CG1-CD1 4.27Å; V1314-I1319 HydrophobicContact CG1-CG1 4.37Å | ||
| 1315 | T | 41.7 | Very low | 55.7 | Low | 69 Ų | 69 | 81.8 Ų | 81.8 | 42% | 0.423 | 49% | 0.492 | S | S | . | . | trans | -59.6 | 127.9 | 175.8 | 51.2 | 0 | 0 | 0 | 0 | 109.1 | S1313 N1317 N1318 | S1313-T1315 PolarHBondContact O-N 2.71Å; T1315-N1317 PolarHBondContact O-N 3.32Å; T1315-N1318 PolarHBondContact O-N 2.88Å | ||
| 1316 | T | 46.9 | Very low | 58.2 | Low | 107 Ų | 107 | 76.3 Ų | 76.3 | 66% | 0.656 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | -19.6 | -178.4 | 41.8 | 0 | 0 | 0 | 0 | 113.5 | V1314 N1318 I1319 S1320 | V1314-T1316 PolarHBondContact O-N 2.89Å; T1316-N1318 VanDerWaalsContact C-N 3.27Å; T1316-N1318 PolarHBondContact O-N 3Å; T1316-I1319 PolarHBondContact O-N 3.14Å; T1316-S1320 PolarHBondContact O-N 3.4Å; T1316-S1320 PolarHBondContact O-OG 3.39Å; T1316-S1320 VanDerWaalsContact O-OG 3.04Å |
| 1317 | N | 49.3 | Very low | 60.8 | Low | 118 Ų | 118 | 70.7 Ų | 70.7 | 63% | 0.631 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -47.1 | -44.5 | 165.2 | -58.7 | -18.1 | 0 | 0 | 0 | 112.9 | T1315 S1320 S1321 | T1315-N1317 PolarHBondContact O-N 3.32Å; N1317-S1320 PolarHBondContact O-N 2.81Å; N1317-S1321 PolarHBondContact O-N 2.63Å |
| 1318 | N | 51.7 | Low | 62.6 | Low | 111 Ų | 111 | 69.2 Ų | 69.2 | 59% | 0.594 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -89.8 | -9.3 | -170.4 | -147.9 | 32 | 0 | 0 | 0 | 114.7 | T1315 T1316 S1321 | T1315-N1318 PolarHBondContact O-N 2.88Å; T1316-N1318 VanDerWaalsContact C-N 3.27Å; T1316-N1318 PolarHBondContact O-N 3Å; N1318-S1321 WeakPolarHBondContact CA-OG 3.48Å; N1318-S1321 PolarHBondContact O-OG 2.9Å; N1318-S1321 PolarHBondContact OD1-OG 2.87Å |
| 1319 | I | 50.5 | Low | 64.9 | Low | 43 Ų | 43 | 64.2 Ų | 64.2 | 22% | 0.221 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -79.6 | -36.5 | 163.6 | -71.3 | 174.4 | 0 | 0 | 0 | 109.4 | L1299 V1314 T1316 | L1299-I1319 WeakPolarHBondContact O-CG2 3.33Å; V1314-I1319 HydrophobicContact CG1-CD1 4.27Å; V1314-I1319 HydrophobicContact CG1-CG1 4.37Å; T1316-I1319 PolarHBondContact O-N 3.14Å |
| 1320 | S | 56.7 | Low | 67.6 | Low | 49 Ų | 49 | 65.6 Ų | 65.6 | 34% | 0.343 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -69.7 | -40.9 | 177.1 | -51.6 | 0 | 0 | 0 | 0 | 111.6 | T1316 N1317 S1322 L1323 V1324 | T1316-S1320 PolarHBondContact O-N 3.4Å; T1316-S1320 PolarHBondContact O-OG 3.39Å; T1316-S1320 VanDerWaalsContact O-OG 3.04Å; N1317-S1320 PolarHBondContact O-N 2.81Å; S1320-S1322 PolarHBondContact O-N 3.3Å; S1320-L1323 PolarHBondContact O-N 3.32Å; S1320-V1324 WeakPolarHBondContact O-CB 3.4Å; S1320-V1324 WeakPolarHBondContact O-CG2 3.45Å; S1320-V1324 PolarHBondContact O-N 3.24Å |
| 1321 | S | 71.9 | Confident | 70 | Confident | 29 Ų | 29 | 62.2 Ų | 62.2 | 20% | 0.203 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -51.4 | -49.1 | -174.8 | 57.7 | 0 | 0 | 0 | 0 | 114 | N1317 N1318 L1323 V1324 D1325 | N1317-S1321 PolarHBondContact O-N 2.63Å; N1318-S1321 WeakPolarHBondContact CA-OG 3.48Å; N1318-S1321 PolarHBondContact O-OG 2.9Å; N1318-S1321 PolarHBondContact OD1-OG 2.87Å; S1321-L1323 PolarHBondContact O-N 3.26Å; S1321-V1324 CarbonylContact O-C 3.59Å; S1321-V1324 WeakPolarHBondContact O-CB 3.21Å; S1321-V1324 PolarHBondContact O-N 2.76Å; S1321-D1325 WeakPolarHBondContact O-CB 3.41Å; S1321-D1325 PolarHBondContact O-N 3.13Å |
| 1322 | S | 84.2 | Confident | 72.4 | Confident | 19 Ų | 19 | 55.3 Ų | 55.3 | 13% | 0.133 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -57.1 | -52.9 | -176.9 | -178.5 | 0 | 0 | 0 | 0 | 112.9 | C1267 S1320 D1325 M1326 | C1267-S1322 WeakPolarHBondContact CB-OG 3.5Å; C1267-S1322 PolarHBondContact SG-OG 3.18Å; S1320-S1322 PolarHBondContact O-N 3.3Å; S1322-D1325 PolarHBondContact O-N 2.93Å; S1322-M1326 WeakPolarHBondContact O-CG 3.3Å; S1322-M1326 PolarHBondContact O-N 3.46Å |
| 1323 | L | 88.7 | Confident | 75 | Confident | 6 Ų | 6 | 50.8 Ų | 50.8 | 3% | 0.031 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -66.4 | -40.3 | 175.7 | 169.4 | 57.9 | 0 | 0 | 0 | 111.7 | I1298 S1320 S1321 D1325 M1327 V1336 R1354 I1355 | I1298-L1323 HydrophobicContact CD1-CD1 4.11Å; S1320-L1323 PolarHBondContact O-N 3.32Å; S1321-L1323 PolarHBondContact O-N 3.26Å; L1323-D1325 VanDerWaalsContact C-N 3.29Å; L1323-D1325 PolarHBondContact O-N 3.19Å; L1323-M1327 HydrophobicContact CD1-CE 3.67Å; L1323-M1327 HydrophobicContact CD1-CG 4.11Å; L1323-M1327 HydrophobicContact CD1-SD 3.9Å; L1323-M1327 HydrophobicContact CG-CE 3.71Å; L1323-M1327 WeakPolarHBondContact O-CE 3.42Å; L1323-M1327 WeakPolarHBondContact O-CG 3.42Å; L1323-M1327 PolarHBondContact O-N 2.84Å; L1323-M1327 VanDerWaalsContact O-N 3.16Å; L1323-V1336 HydrophobicContact CD1-CG1 4.27Å; L1323-V1336 HydrophobicContact CD1-CG2 4.31Å; L1323-R1354 HydrophobicContact CD2-CB 3.78Å; L1323-I1355 HydrophobicContact CD1-CG1 4.35Å; L1323-I1355 HydrophobicContact CD2-CG1 4.14Å |
| 1324 | V | 87.8 | Confident | 77.6 | Confident | 22 Ų | 22 | 50.8 Ų | 50.8 | 13% | 0.133 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -53 | -47.9 | 173.4 | 169.9 | 0 | 0 | 0 | 0 | 110.8 | S1320 S1321 M1327 K1328 M1358 | S1320-V1324 WeakPolarHBondContact O-CB 3.4Å; S1320-V1324 WeakPolarHBondContact O-CG2 3.45Å; S1320-V1324 PolarHBondContact O-N 3.24Å; S1321-V1324 CarbonylContact O-C 3.59Å; S1321-V1324 WeakPolarHBondContact O-CB 3.21Å; S1321-V1324 PolarHBondContact O-N 2.76Å; V1324-M1327 PolarHBondContact O-N 2.89Å; V1324-K1328 HydrophobicContact CG1-CD 4.28Å; V1324-K1328 VanDerWaalsContact CG1-NZ 3.3Å; V1324-K1328 WeakPolarHBondContact O-CG 3.45Å; V1324-K1328 PolarHBondContact O-N 3.28Å; V1324-M1358 HydrophobicContact CB-CE 3.89Å; V1324-M1358 HydrophobicContact CG2-CE 3.22Å; V1324-M1358 HydrophobicContact CG2-CG 4.35Å; V1324-M1358 HydrophobicContact CG2-SD 3.53Å; V1324-M1358 VanDerWaalsContact CG2-SD 3.53Å |
| 1325 | D | 90.1 | Very high | 80.1 | Confident | 74 Ų | 74 | 46.2 Ų | 46.2 | 40% | 0.396 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -80.6 | -35.1 | -170.8 | -64.9 | -30.1 | 0 | 0 | 0 | 111.7 | S1321 S1322 L1323 M1327 K1328 D1329 | S1321-D1325 WeakPolarHBondContact O-CB 3.41Å; S1321-D1325 PolarHBondContact O-N 3.13Å; S1322-D1325 PolarHBondContact O-N 2.93Å; L1323-D1325 VanDerWaalsContact C-N 3.29Å; L1323-D1325 PolarHBondContact O-N 3.19Å; D1325-M1327 VanDerWaalsContact C-N 3.26Å; D1325-M1327 PolarHBondContact O-N 3.43Å; D1325-K1328 PolarHBondContact O-N 2.69Å; D1325-K1328 IonicContact OD1-NZ 3.84Å; D1325-K1328 PolarHBondContact OD1-NZ 2.73Å; D1325-D1329 PolarHBondContact O-N 2.67Å |
| 1326 | M | 94.5 | Very high | 82.7 | Confident | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -56 | -40.1 | 167.3 | -74.2 | 177.2 | 63.1 | 0 | 0 | 112.3 | C1267 I1298 S1322 K1328 D1329 A1332 N1333 V1336 | C1267-M1326 HydrophobicContact CB-CG 4.36Å; C1267-M1326 HydrophobicContact CB-SD 3.97Å; I1298-M1326 HydrophobicContact CB-SD 4.23Å; I1298-M1326 HydrophobicContact CD1-CE 4.23Å; I1298-M1326 HydrophobicContact CD1-SD 4.41Å; I1298-M1326 HydrophobicContact CG2-CE 4.13Å; I1298-M1326 HydrophobicContact CG2-SD 3.63Å; S1322-M1326 WeakPolarHBondContact O-CG 3.3Å; S1322-M1326 PolarHBondContact O-N 3.46Å; M1326-K1328 VanDerWaalsContact C-N 3.29Å; M1326-K1328 PolarHBondContact O-N 3.08Å; M1326-D1329 PolarHBondContact O-N 3.36Å; M1326-A1332 HydrophobicContact CB-CB 3.78Å; M1326-A1332 HydrophobicContact CG-CB 3.92Å; M1326-A1332 CarbonylContact O-C 3.25Å; M1326-A1332 VanDerWaalsContact O-C 3.23Å; M1326-A1332 WeakPolarHBondContact O-CB 3.42Å; M1326-N1333 PolarHBondContact O-N 3.05Å; M1326-V1336 HydrophobicContact CB-CG2 3.93Å; M1326-V1336 HydrophobicContact CE-CG2 3.88Å |
| 1327 | M | 94.6 | Very high | 85.1 | Confident | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 20% | 0.198 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78 | -10.3 | 177.7 | -69.5 | -173.2 | -63 | 0 | 0 | 114.6 | L1323 V1324 D1325 V1336 I1355 M1358 L1362 G1368 I1371 | L1323-M1327 HydrophobicContact CD1-CE 3.67Å; L1323-M1327 HydrophobicContact CD1-CG 4.11Å; L1323-M1327 HydrophobicContact CD1-SD 3.9Å; L1323-M1327 HydrophobicContact CG-CE 3.71Å; L1323-M1327 WeakPolarHBondContact O-CE 3.42Å; L1323-M1327 WeakPolarHBondContact O-CG 3.42Å; L1323-M1327 PolarHBondContact O-N 2.84Å; L1323-M1327 VanDerWaalsContact O-N 3.16Å; V1324-M1327 PolarHBondContact O-N 2.89Å; D1325-M1327 VanDerWaalsContact C-N 3.26Å; D1325-M1327 PolarHBondContact O-N 3.43Å; M1327-V1336 HydrophobicContact CG-CB 4.11Å; M1327-V1336 HydrophobicContact CG-CG1 3.76Å; M1327-V1336 HydrophobicContact CG-CG2 3.92Å; M1327-V1336 HydrophobicContact SD-CG1 3.93Å; M1327-I1355 HydrophobicContact CE-CB 4.34Å; M1327-I1355 HydrophobicContact CE-CG1 3.87Å; M1327-I1355 HydrophobicContact CE-CG2 3.77Å; M1327-I1355 HydrophobicContact SD-CB 4.28Å; M1327-I1355 HydrophobicContact SD-CD1 3.79Å; M1327-I1355 HydrophobicContact SD-CG1 3.69Å; M1327-I1355 HydrophobicContact SD-CG2 3.54Å; M1327-I1355 VanDerWaalsContact SD-CG2 3.54Å; M1327-M1358 HydrophobicContact CE-CE 3.1Å; M1327-L1362 HydrophobicContact CB-CD1 4.48Å; M1327-L1362 HydrophobicContact CB-CD2 3.67Å; M1327-L1362 HydrophobicContact CE-CD1 3.97Å; M1327-L1362 HydrophobicContact CE-CD2 4.38Å; M1327-L1362 HydrophobicContact SD-CD1 4Å; M1327-G1368 WeakPolarHBondContact O-CA 3.28Å; M1327-G1368 PolarHBondContact O-N 2.96Å; M1327-I1371 HydrophobicContact CB-CG1 4.03Å; M1327-I1371 HydrophobicContact CG-CD1 4.3Å; M1327-I1371 HydrophobicContact CG-CG1 3.94Å; M1327-I1371 HydrophobicContact CG-CG2 4.48Å; M1327-I1371 HydrophobicContact SD-CB 4.43Å; M1327-I1371 HydrophobicContact SD-CG1 4.22Å; M1327-I1371 HydrophobicContact SD-CG2 3.7Å |
| 1328 | K | 93 | Very high | 87.3 | Confident | 57 Ų | 57 | 33.6 Ų | 33.6 | 25% | 0.248 | 17% | 0.17 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | -22.1 | 170.8 | -67.6 | 170.7 | -170.7 | 157.5 | 0 | 112.9 | V1324 D1325 M1326 F1365 Y1367 | V1324-K1328 HydrophobicContact CG1-CD 4.28Å; V1324-K1328 VanDerWaalsContact CG1-NZ 3.3Å; V1324-K1328 WeakPolarHBondContact O-CG 3.45Å; V1324-K1328 PolarHBondContact O-N 3.28Å; D1325-K1328 PolarHBondContact O-N 2.69Å; D1325-K1328 IonicContact OD1-NZ 3.84Å; D1325-K1328 PolarHBondContact OD1-NZ 2.73Å; M1326-K1328 VanDerWaalsContact C-N 3.29Å; M1326-K1328 PolarHBondContact O-N 3.08Å; K1328-F1365 HydrophobicContact CB-CD1 4.19Å; K1328-F1365 HydrophobicContact CB-CG 4.4Å; K1328-F1365 HydrophobicContact CD-CD1 3.93Å; K1328-F1365 HydrophobicContact CD-CD2 4.44Å; K1328-F1365 HydrophobicContact CD-CE1 3.72Å; K1328-F1365 HydrophobicContact CD-CE2 4.27Å; K1328-F1365 HydrophobicContact CD-CG 4.31Å; K1328-F1365 HydrophobicContact CD-CZ 3.91Å; K1328-F1365 HydrophobicContact CG-CB 4.31Å; K1328-F1365 HydrophobicContact CG-CD1 3.77Å; K1328-F1365 HydrophobicContact CG-CD2 4.03Å; K1328-F1365 HydrophobicContact CG-CE1 4.08Å; K1328-F1365 HydrophobicContact CG-CE2 4.34Å; K1328-F1365 HydrophobicContact CG-CG 3.75Å; K1328-F1365 HydrophobicContact CG-CZ 4.36Å; K1328-Y1367 VanDerWaalsContact O-CD2 3.25Å; K1328-Y1367 WeakPolarHBondContact O-CD2 3.36Å |
| 1329 | D | 95.8 | Very high | 89.4 | Confident | 32 Ų | 32 | 28.3 Ų | 28.3 | 17% | 0.171 | 14% | 0.142 | C | C | . | . | S | Bend | trans | -76.8 | 153.2 | -176.7 | 174.8 | 57.4 | 0 | 0 | 0 | 112.7 | S1271 D1325 M1326 Y1331 A1332 N1333 | S1271-D1329 WeakPolarHBondContact CA-OD2 3.21Å; D1325-D1329 PolarHBondContact O-N 2.67Å; M1326-D1329 PolarHBondContact O-N 3.36Å; D1329-Y1331 VanDerWaalsContact C-N 3.31Å; D1329-Y1331 PolarHBondContact O-N 3.24Å; D1329-Y1331 WeakPolarHBondContact OD2-CA 3.42Å; D1329-Y1331 WeakPolarHBondContact OD2-CB 3.17Å; D1329-Y1331 PolarHBondContact OD2-N 2.75Å; D1329-A1332 HydrophobicContact CB-CB 4.13Å; D1329-A1332 PolarHBondContact OD2-N 3.36Å; D1329-N1333 WeakPolarHBondContact O-CB 3.27Å; D1329-N1333 PolarHBondContact O-ND2 3.47Å |
| 1330 | Q | 96.8 | Very high | 91.5 | Very high | 84 Ų | 84 | 26.3 Ų | 26.3 | 39% | 0.393 | 13% | 0.132 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -69.3 | -21.9 | -177.9 | 76.8 | -152.9 | -82.7 | 0 | 0 | 114.2 | N1333 Y1334 Y1367 | Q1330-N1333 VanDerWaalsContact C-ND2 3.29Å; Q1330-N1333 PolarHBondContact O-ND2 3.2Å; Q1330-N1333 VanDerWaalsContact O-ND2 3.09Å; Q1330-Y1334 WeakPolarHBondContact O-CE2 3.46Å; Q1330-Y1367 HydrophobicContact CB-CD1 4.26Å; Q1330-Y1367 HydrophobicContact CB-CD2 4.21Å; Q1330-Y1367 HydrophobicContact CB-CE1 3.73Å; Q1330-Y1367 HydrophobicContact CB-CE2 3.65Å; Q1330-Y1367 HydrophobicContact CB-CG 4.48Å |
| 1331 | Y | 97.9 | Very high | 93.3 | Very high | 57 Ų | 57 | 25.5 Ų | 25.5 | 22% | 0.224 | 12% | 0.123 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -111.1 | -47.9 | 179.9 | -53.3 | -63.4 | 0 | 0 | 0 | 111.6 | S1270 K1273 D1329 N1333 Y1334 | S1270-Y1331 CarbonylContact O-C 3.23Å; K1273-Y1331 HydrophobicContact CB-CD1 4.42Å; K1273-Y1331 HydrophobicContact CB-CD2 4.4Å; K1273-Y1331 HydrophobicContact CB-CE1 3.88Å; K1273-Y1331 HydrophobicContact CB-CE2 3.85Å; K1273-Y1331 HydrophobicContact CD-CE1 4.46Å; K1273-Y1331 HydrophobicContact CG-CE1 3.77Å; D1329-Y1331 VanDerWaalsContact C-N 3.31Å; D1329-Y1331 PolarHBondContact O-N 3.24Å; D1329-Y1331 WeakPolarHBondContact OD2-CA 3.42Å; D1329-Y1331 WeakPolarHBondContact OD2-CB 3.17Å; D1329-Y1331 PolarHBondContact OD2-N 2.75Å; Y1331-N1333 PolarHBondContact O-N 3.13Å; Y1331-N1333 VanDerWaalsContact O-N 3.14Å; Y1331-Y1334 WeakPolarHBondContact O-CD2 3.31Å; Y1331-Y1334 PolarHBondContact O-N 3.35Å |
| 1332 | A | 97.6 | Very high | 94.4 | Very high | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -66.3 | -20.8 | -173.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | S1270 M1326 D1329 Y1334 V1335 V1336 | S1270-A1332 WeakPolarHBondContact O-CA 3.5Å; S1270-A1332 WeakPolarHBondContact O-CB 3.5Å; S1270-A1332 PolarHBondContact O-N 3.29Å; S1270-A1332 VanDerWaalsContact O-N 3.14Å; M1326-A1332 HydrophobicContact CB-CB 3.78Å; M1326-A1332 HydrophobicContact CG-CB 3.92Å; M1326-A1332 CarbonylContact O-C 3.25Å; M1326-A1332 VanDerWaalsContact O-C 3.23Å; M1326-A1332 WeakPolarHBondContact O-CB 3.42Å; D1329-A1332 HydrophobicContact CB-CB 4.13Å; D1329-A1332 PolarHBondContact OD2-N 3.36Å; A1332-Y1334 PolarHBondContact O-N 3.11Å; A1332-V1335 WeakPolarHBondContact O-CB 3.37Å; A1332-V1335 PolarHBondContact O-N 2.91Å; A1332-V1335 VanDerWaalsContact O-N 3.16Å; A1332-V1336 PolarHBondContact O-N 2.8Å |
| 1333 | N | 97 | Very high | 94.9 | Very high | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -62.6 | -28 | 174 | 80.3 | 89 | 0 | 0 | 0 | 112.6 | M1326 D1329 Q1330 Y1331 Q1337 I1371 | M1326-N1333 PolarHBondContact O-N 3.05Å; D1329-N1333 WeakPolarHBondContact O-CB 3.27Å; D1329-N1333 PolarHBondContact O-ND2 3.47Å; Q1330-N1333 VanDerWaalsContact C-ND2 3.29Å; Q1330-N1333 PolarHBondContact O-ND2 3.2Å; Q1330-N1333 VanDerWaalsContact O-ND2 3.09Å; Y1331-N1333 PolarHBondContact O-N 3.13Å; Y1331-N1333 VanDerWaalsContact O-N 3.14Å; N1333-Q1337 WeakPolarHBondContact O-CG 3.49Å; N1333-Q1337 PolarHBondContact O-N 3.42Å; N1333-Q1337 VanDerWaalsContact O-N 3.15Å; N1333-Q1337 PolarHBondContact O-NE2 3.38Å; N1333-Q1337 PolarHBondContact OD1-NE2 2.97Å; N1333-I1371 HydrophobicContact CB-CD1 3.98Å; N1333-I1371 VanDerWaalsContact O-CD1 3.31Å; N1333-I1371 WeakPolarHBondContact O-CD1 3.08Å |
| 1334 | Y | 97.8 | Very high | 95 | Very high | 93 Ų | 93 | 29 Ų | 29 | 37% | 0.365 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -73.1 | -40.7 | 173.7 | -63.6 | -76.3 | 0 | 0 | 0 | 111.2 | A141 E1280 Q1330 Y1331 A1332 V1336 Q1337 R1338 | A141-Y1334 HydrophobicContact CB-CE1 4.38Å; E1280-Y1334 VanDerWaalsContact OE1-CB 3.28Å; E1280-Y1334 WeakPolarHBondContact OE1-CB 3.3Å; Q1330-Y1334 WeakPolarHBondContact O-CE2 3.46Å; Y1331-Y1334 WeakPolarHBondContact O-CD2 3.31Å; Y1331-Y1334 PolarHBondContact O-N 3.35Å; A1332-Y1334 PolarHBondContact O-N 3.11Å; Y1334-V1336 VanDerWaalsContact C-N 3.34Å; Y1334-V1336 PolarHBondContact O-N 3.34Å; Y1334-Q1337 WeakPolarHBondContact O-CB 3.39Å; Y1334-Q1337 PolarHBondContact O-N 2.81Å; Y1334-Q1337 VanDerWaalsContact O-N 3.1Å; Y1334-R1338 PolarHBondContact O-N 3.13Å |
| 1335 | V | 97.7 | Very high | 95.3 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.2 | -43.2 | 174.1 | -168.3 | 0 | 0 | 0 | 0 | 111.2 | M1279 E1280 I1283 A1332 Q1337 R1338 M1339 | M1279-V1335 HydrophobicContact CB-CG1 4.02Å; M1279-V1335 HydrophobicContact CB-CG2 4.31Å; E1280-V1335 HydrophobicContact CG-CG2 4.29Å; I1283-V1335 HydrophobicContact CD1-CG1 3.48Å; I1283-V1335 VanDerWaalsContact CD1-CG1 3.48Å; A1332-V1335 WeakPolarHBondContact O-CB 3.37Å; A1332-V1335 PolarHBondContact O-N 2.91Å; A1332-V1335 VanDerWaalsContact O-N 3.16Å; V1335-Q1337 VanDerWaalsContact C-N 3.33Å; V1335-Q1337 PolarHBondContact O-N 2.91Å; V1335-R1338 PolarHBondContact O-N 2.93Å; V1335-M1339 HydrophobicContact CG1-CE 4.36Å; V1335-M1339 WeakPolarHBondContact O-CG 3.02Å; V1335-M1339 PolarHBondContact O-N 3.42Å |
| 1336 | V | 96.1 | Very high | 95.3 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65 | -34.9 | 175.4 | 178.7 | 0 | 0 | 0 | 0 | 112.1 | L1323 M1326 M1327 A1332 Y1334 M1339 L1340 I1355 I1371 | L1323-V1336 HydrophobicContact CD1-CG1 4.27Å; L1323-V1336 HydrophobicContact CD1-CG2 4.31Å; M1326-V1336 HydrophobicContact CB-CG2 3.93Å; M1326-V1336 HydrophobicContact CE-CG2 3.88Å; M1327-V1336 HydrophobicContact CG-CB 4.11Å; M1327-V1336 HydrophobicContact CG-CG1 3.76Å; M1327-V1336 HydrophobicContact CG-CG2 3.92Å; M1327-V1336 HydrophobicContact SD-CG1 3.93Å; A1332-V1336 PolarHBondContact O-N 2.8Å; Y1334-V1336 VanDerWaalsContact C-N 3.34Å; Y1334-V1336 PolarHBondContact O-N 3.34Å; V1336-M1339 PolarHBondContact O-N 2.96Å; V1336-L1340 HydrophobicContact CG1-CD1 4.39Å; V1336-L1340 WeakPolarHBondContact O-CG 3.1Å; V1336-L1340 PolarHBondContact O-N 3.16Å; V1336-I1355 HydrophobicContact CG1-CD1 4.29Å; V1336-I1371 HydrophobicContact CB-CD1 4.28Å; V1336-I1371 HydrophobicContact CG1-CD1 4.32Å |
| 1337 | Q | 96.4 | Very high | 95.1 | Very high | 14 Ų | 14 | 36 Ų | 36 | 7% | 0.065 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -66.2 | -41 | 173.3 | -74.1 | 171.3 | 96.3 | 0 | 0 | 112 | N1333 Y1334 V1335 L1340 E1341 I1371 K1374 | N1333-Q1337 WeakPolarHBondContact O-CG 3.49Å; N1333-Q1337 PolarHBondContact O-N 3.42Å; N1333-Q1337 VanDerWaalsContact O-N 3.15Å; N1333-Q1337 PolarHBondContact O-NE2 3.38Å; N1333-Q1337 PolarHBondContact OD1-NE2 2.97Å; Y1334-Q1337 WeakPolarHBondContact O-CB 3.39Å; Y1334-Q1337 PolarHBondContact O-N 2.81Å; Y1334-Q1337 VanDerWaalsContact O-N 3.1Å; V1335-Q1337 VanDerWaalsContact C-N 3.33Å; V1335-Q1337 PolarHBondContact O-N 2.91Å; Q1337-L1340 PolarHBondContact O-N 3.32Å; Q1337-E1341 VanDerWaalsContact O-CG 3.29Å; Q1337-E1341 WeakPolarHBondContact O-CG 3.23Å; Q1337-E1341 PolarHBondContact O-N 3.45Å; Q1337-I1371 HydrophobicContact CG-CD1 3.71Å; Q1337-K1374 HydrophobicContact CG-CB 4.3Å; Q1337-K1374 HydrophobicContact CG-CD 4.38Å; Q1337-K1374 HydrophobicContact CG-CG 4.16Å |
| 1338 | R | 96.6 | Very high | 95.1 | Very high | 16 Ų | 16 | 39 Ų | 39 | 6% | 0.06 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -65.1 | -36.8 | 173.9 | -174.6 | 58.2 | 46.9 | 52.1 | 19.7 | 112.8 | N137 E1280 I1283 Y1334 V1335 E1341 L1342 | N137-R1338 PolarHBondContact OD1-NE 3.29Å; N137-R1338 PolarHBondContact OD1-NH2 3.23Å; E1280-R1338 HydrophobicContact CG-CB 4.02Å; E1280-R1338 HydrophobicContact CG-CG 4.27Å; E1280-R1338 IonicContact OE2-CZ 3.99Å; E1280-R1338 IonicContact OE2-NH1 2.67Å; E1280-R1338 PolarHBondContact OE2-NH1 3.36Å; E1280-R1338 IonicContact OE2-NH2 2.96Å; E1280-R1338 PolarHBondContact OE2-NH2 2.97Å; I1283-R1338 HydrophobicContact CG2-CG 4.22Å; Y1334-R1338 PolarHBondContact O-N 3.13Å; V1335-R1338 PolarHBondContact O-N 2.93Å; R1338-E1341 WeakPolarHBondContact CA-OE2 3.38Å; R1338-E1341 WeakPolarHBondContact CD-OE2 3.29Å; R1338-E1341 IonicContact CZ-OE2 3.08Å; R1338-E1341 IonicContact NE-OE2 2.69Å; R1338-E1341 PolarHBondContact NE-OE2 3.03Å; R1338-E1341 IonicContact NH2-OE2 2.73Å; R1338-E1341 WeakPolarHBondContact O-CB 3.29Å; R1338-E1341 PolarHBondContact O-N 2.99Å; R1338-L1342 VanDerWaalsContact CD-CD1 3.43Å; R1338-L1342 HydrophobicContact CG-CD1 4.14Å; R1338-L1342 PolarHBondContact O-N 3.28Å |
| 1339 | M | 95.8 | Very high | 95 | Very high | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -63.7 | -45.7 | 171.3 | -71.2 | -178.9 | 169 | 0 | 0 | 111.4 | V1266 I1283 L1294 I1295 I1298 V1335 V1336 E1341 L1342 A1343 L1351 | V1266-M1339 HydrophobicContact CG1-CE 3.89Å; I1283-M1339 HydrophobicContact CD1-CE 3.56Å; I1283-M1339 HydrophobicContact CD1-CG 3.82Å; I1283-M1339 HydrophobicContact CD1-SD 4.49Å; I1283-M1339 HydrophobicContact CG1-CE 4.36Å; I1283-M1339 HydrophobicContact CG2-CG 4.31Å; L1294-M1339 WeakPolarHBondContact O-CE 3.34Å; I1295-M1339 HydrophobicContact CG1-CB 4.32Å; I1295-M1339 HydrophobicContact CG1-CE 4.36Å; I1295-M1339 HydrophobicContact CG1-CG 3.98Å; I1295-M1339 HydrophobicContact CG1-SD 4.16Å; I1298-M1339 HydrophobicContact CD1-CE 4.12Å; I1298-M1339 HydrophobicContact CD1-SD 3.3Å; I1298-M1339 WeakPolarHBondContact CD1-SD 3.31Å; I1298-M1339 HydrophobicContact CG1-CE 4.34Å; I1298-M1339 HydrophobicContact CG1-SD 3.98Å; V1335-M1339 HydrophobicContact CG1-CE 4.36Å; V1335-M1339 WeakPolarHBondContact O-CG 3.02Å; V1335-M1339 PolarHBondContact O-N 3.42Å; V1336-M1339 PolarHBondContact O-N 2.96Å; M1339-E1341 VanDerWaalsContact C-N 3.27Å; M1339-E1341 PolarHBondContact O-N 3.44Å; M1339-L1342 PolarHBondContact O-N 2.92Å; M1339-A1343 WeakPolarHBondContact O-CB 3.26Å; M1339-A1343 PolarHBondContact O-N 2.87Å; M1339-L1351 HydrophobicContact CB-CD1 4.28Å |
| 1340 | L | 94.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 42.4 Ų | 42.4 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.6 | -32.7 | 175.6 | -75.2 | 168.5 | 0 | 0 | 0 | 113 | V1336 Q1337 R1348 L1351 I1352 I1355 I1371 K1374 L1375 Y1378 | V1336-L1340 HydrophobicContact CG1-CD1 4.39Å; V1336-L1340 WeakPolarHBondContact O-CG 3.1Å; V1336-L1340 PolarHBondContact O-N 3.16Å; Q1337-L1340 PolarHBondContact O-N 3.32Å; L1340-R1348 PolarHBondContact O-NE 3.34Å; L1340-L1351 HydrophobicContact CD2-CB 3.81Å; L1340-L1351 HydrophobicContact CD2-CD1 4.35Å; L1340-I1352 HydrophobicContact CD2-CG1 4.05Å; L1340-I1355 HydrophobicContact CD1-CD1 4.06Å; L1340-I1355 HydrophobicContact CD2-CD1 4.18Å; L1340-I1355 HydrophobicContact CG-CD1 4.43Å; L1340-I1371 HydrophobicContact CD1-CG2 4.36Å; L1340-K1374 HydrophobicContact CB-CG 4.38Å; L1340-K1374 HydrophobicContact CD1-CG 3.99Å; L1340-L1375 HydrophobicContact CD1-CD2 4.18Å; L1340-L1375 HydrophobicContact CD2-CD2 4.38Å; L1340-Y1378 HydrophobicContact CB-CE2 4.23Å; L1340-Y1378 PolarHBondContact O-OH 2.86Å |
| 1341 | E | 94.7 | Very high | 94.5 | Very high | 33 Ų | 33 | 38.4 Ų | 38.4 | 15% | 0.154 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64.7 | -55.7 | 172.5 | -73.9 | 159.2 | -174 | 0 | 0 | 111.8 | Q1337 R1338 M1339 R1348 K1374 | Q1337-E1341 VanDerWaalsContact O-CG 3.29Å; Q1337-E1341 WeakPolarHBondContact O-CG 3.23Å; Q1337-E1341 PolarHBondContact O-N 3.45Å; R1338-E1341 WeakPolarHBondContact CA-OE2 3.38Å; R1338-E1341 WeakPolarHBondContact CD-OE2 3.29Å; R1338-E1341 IonicContact CZ-OE2 3.08Å; R1338-E1341 IonicContact NE-OE2 2.69Å; R1338-E1341 PolarHBondContact NE-OE2 3.03Å; R1338-E1341 IonicContact NH2-OE2 2.73Å; R1338-E1341 WeakPolarHBondContact O-CB 3.29Å; R1338-E1341 PolarHBondContact O-N 2.99Å; M1339-E1341 VanDerWaalsContact C-N 3.27Å; M1339-E1341 PolarHBondContact O-N 3.44Å; E1341-R1348 PolarHBondContact O-NH2 2.98Å; E1341-K1374 VanDerWaalsContact CG-NZ 3.28Å; E1341-K1374 WeakPolarHBondContact OE1-CE 3.5Å; E1341-K1374 IonicContact OE1-NZ 2.96Å; E1341-K1374 PolarHBondContact OE1-NZ 2.68Å |
| 1342 | L | 95 | Very high | 94.3 | Very high | 55 Ų | 55 | 36.5 Ų | 36.5 | 29% | 0.288 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -99.9 | -8 | -164.3 | -58.3 | -175.2 | 0 | 0 | 0 | 115.4 | A1284 R1291 R1338 M1339 | A1284-L1342 HydrophobicContact CB-CD1 3.9Å; R1291-L1342 PolarHBondContact NE-O 3.47Å; R1291-L1342 PolarHBondContact NH2-O 3.32Å; R1338-L1342 VanDerWaalsContact CD-CD1 3.43Å; R1338-L1342 HydrophobicContact CG-CD1 4.14Å; R1338-L1342 PolarHBondContact O-N 3.28Å; M1339-L1342 PolarHBondContact O-N 2.92Å |
| 1343 | A | 93.7 | Very high | 93.9 | Very high | 2 Ų | 2 | 39.8 Ų | 39.8 | 2% | 0.017 | 19% | 0.191 | C | C | . | . | S | Bend | trans | -53.8 | 141.7 | 167.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | I1295 M1339 Q1347 R1348 L1351 | I1295-A1343 HydrophobicContact CD1-CB 4.05Å; M1339-A1343 WeakPolarHBondContact O-CB 3.26Å; M1339-A1343 PolarHBondContact O-N 2.87Å; A1343-Q1347 HydrophobicContact CB-CB 3.7Å; A1343-R1348 HydrophobicContact CB-CB 3.9Å; A1343-R1348 PolarHBondContact O-NH2 3.49Å; A1343-L1351 HydrophobicContact CB-CD1 3.91Å |
| 1344 | D | 92.4 | Very high | 93.5 | Very high | 71 Ų | 71 | 44.2 Ų | 44.2 | 38% | 0.38 | 21% | 0.208 | S | C | . | . | trans | -65.8 | 175.9 | 168.2 | 69.5 | 48.7 | 0 | 0 | 0 | 111.8 | E1346 Q1347 R1348 | D1344-E1346 VanDerWaalsContact C-N 3.26Å; D1344-E1346 PolarHBondContact O-N 3Å; D1344-E1346 WeakPolarHBondContact OD1-CA 3.32Å; D1344-E1346 PolarHBondContact OD1-N 3.43Å; D1344-Q1347 VanDerWaalsContact CG-CD 3.48Å; D1344-Q1347 VanDerWaalsContact N-OE1 3.12Å; D1344-Q1347 WeakPolarHBondContact OD1-CG 3.32Å; D1344-Q1347 PolarHBondContact OD1-N 3.37Å; D1344-Q1347 WeakPolarHBondContact OD2-CG 3.38Å; D1344-Q1347 PolarHBondContact OD2-NE2 3.09Å; D1344-Q1347 PolarHBondContact OD2-OE1 3.47Å; D1344-R1348 WeakPolarHBondContact O-CB 3.3Å; D1344-R1348 PolarHBondContact O-N 3.43Å | ||
| 1345 | T | 92.4 | Very high | 93.2 | Very high | 119 Ų | 119 | 39.8 Ų | 39.8 | 73% | 0.73 | 19% | 0.191 | S | C | * | . | H | α-helix | trans | -55.5 | -38.3 | -177.4 | -55.9 | 0 | 0 | 0 | 0 | 113.3 | R1349 | T1345-R1349 VanDerWaalsContact O-CB 3.31Å; T1345-R1349 WeakPolarHBondContact O-CB 3.15Å; T1345-R1349 PolarHBondContact O-N 2.92Å; T1345-R1349 VanDerWaalsContact O-N 3.08Å |
| 1346 | E | 90.9 | Very high | 92.8 | Very high | 100 Ų | 100 | 44.7 Ų | 44.7 | 47% | 0.467 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -82.8 | -46.4 | -176.4 | 175.9 | 54.9 | -161.8 | 0 | 0 | 111.2 | D1344 R1348 R1349 V1350 | D1344-E1346 VanDerWaalsContact C-N 3.26Å; D1344-E1346 PolarHBondContact O-N 3Å; D1344-E1346 WeakPolarHBondContact OD1-CA 3.32Å; D1344-E1346 PolarHBondContact OD1-N 3.43Å; E1346-R1348 VanDerWaalsContact C-N 3.29Å; E1346-R1348 PolarHBondContact O-N 3.42Å; E1346-R1349 WeakPolarHBondContact O-CB 3.16Å; E1346-R1349 PolarHBondContact O-N 3.33Å; E1346-R1349 VanDerWaalsContact O-N 3.14Å; E1346-R1349 IonicContact OE1-CZ 3.64Å; E1346-R1349 IonicContact OE1-NE 2.78Å; E1346-R1349 IonicContact OE1-NH2 2.81Å; E1346-R1349 PolarHBondContact OE1-NH2 3.27Å; E1346-R1349 IonicContact OE2-CZ 3.57Å; E1346-R1349 IonicContact OE2-NE 3.62Å; E1346-R1349 PolarHBondContact OE2-NE 3.16Å; E1346-R1349 IonicContact OE2-NH2 3.34Å; E1346-R1349 PolarHBondContact OE2-NH2 2.8Å; E1346-V1350 WeakPolarHBondContact O-CG2 3.45Å; E1346-V1350 PolarHBondContact O-N 3.09Å |
| 1347 | Q | 90.6 | Very high | 92.4 | Very high | 23 Ų | 23 | 49.5 Ų | 49.5 | 11% | 0.107 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -54.5 | -45.4 | 171.3 | -69.1 | 168.7 | 3.9 | 0 | 0 | 111.4 | A1292 A1343 D1344 V1350 L1351 | A1292-Q1347 VanDerWaalsContact CA-NE2 3.28Å; A1343-Q1347 HydrophobicContact CB-CB 3.7Å; D1344-Q1347 VanDerWaalsContact CG-CD 3.48Å; D1344-Q1347 VanDerWaalsContact N-OE1 3.12Å; D1344-Q1347 WeakPolarHBondContact OD1-CG 3.32Å; D1344-Q1347 PolarHBondContact OD1-N 3.37Å; D1344-Q1347 WeakPolarHBondContact OD2-CG 3.38Å; D1344-Q1347 PolarHBondContact OD2-NE2 3.09Å; D1344-Q1347 PolarHBondContact OD2-OE1 3.47Å; Q1347-V1350 PolarHBondContact O-N 3.28Å; Q1347-L1351 WeakPolarHBondContact O-CB 3.34Å; Q1347-L1351 WeakPolarHBondContact O-CG 3.25Å; Q1347-L1351 PolarHBondContact O-N 3.12Å |
| 1348 | R | 93.8 | Very high | 91.9 | Very high | 63 Ų | 63 | 50.1 Ų | 50.1 | 24% | 0.238 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -66.6 | -39.2 | 178.6 | -167.3 | -174.4 | -67.9 | 120.3 | -4.8 | 111.1 | L1340 E1341 A1343 D1344 E1346 I1352 | L1340-R1348 PolarHBondContact O-NE 3.34Å; E1341-R1348 PolarHBondContact O-NH2 2.98Å; A1343-R1348 HydrophobicContact CB-CB 3.9Å; A1343-R1348 PolarHBondContact O-NH2 3.49Å; D1344-R1348 WeakPolarHBondContact O-CB 3.3Å; D1344-R1348 PolarHBondContact O-N 3.43Å; E1346-R1348 VanDerWaalsContact C-N 3.29Å; E1346-R1348 PolarHBondContact O-N 3.42Å; R1348-I1352 HydrophobicContact CG-CD1 3.91Å; R1348-I1352 HydrophobicContact CG-CG1 4.46Å; R1348-I1352 WeakPolarHBondContact O-CB 3.34Å; R1348-I1352 WeakPolarHBondContact O-CG1 3.36Å; R1348-I1352 PolarHBondContact O-N 2.89Å |
| 1349 | R | 92.4 | Very high | 91.4 | Very high | 126 Ų | 126 | 51 Ų | 51 | 48% | 0.475 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -60.2 | -45.9 | 173.1 | -173 | -167.2 | 72 | 86.1 | 4.9 | 111.3 | T1345 E1346 N1353 | T1345-R1349 VanDerWaalsContact O-CB 3.31Å; T1345-R1349 WeakPolarHBondContact O-CB 3.15Å; T1345-R1349 PolarHBondContact O-N 2.92Å; T1345-R1349 VanDerWaalsContact O-N 3.08Å; E1346-R1349 WeakPolarHBondContact O-CB 3.16Å; E1346-R1349 PolarHBondContact O-N 3.33Å; E1346-R1349 VanDerWaalsContact O-N 3.14Å; E1346-R1349 IonicContact OE1-CZ 3.64Å; E1346-R1349 IonicContact OE1-NE 2.78Å; E1346-R1349 IonicContact OE1-NH2 2.81Å; E1346-R1349 PolarHBondContact OE1-NH2 3.27Å; E1346-R1349 IonicContact OE2-CZ 3.57Å; E1346-R1349 IonicContact OE2-NE 3.62Å; E1346-R1349 PolarHBondContact OE2-NE 3.16Å; E1346-R1349 IonicContact OE2-NH2 3.34Å; E1346-R1349 PolarHBondContact OE2-NH2 2.8Å; R1349-N1353 WeakPolarHBondContact O-CB 3.22Å; R1349-N1353 VanDerWaalsContact O-CG 3.22Å; R1349-N1353 PolarHBondContact O-N 2.83Å; R1349-N1353 PolarHBondContact O-ND2 3.06Å |
| 1350 | V | 90.8 | Very high | 91 | Very high | 34 Ų | 34 | 56.2 Ų | 56.2 | 21% | 0.206 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -65.9 | -46.7 | 178.5 | 176.4 | 0 | 0 | 0 | 0 | 111.3 | L1299 E1346 Q1347 N1353 R1354 | L1299-V1350 HydrophobicContact CD1-CB 4.47Å; L1299-V1350 HydrophobicContact CD1-CG1 3.81Å; L1299-V1350 HydrophobicContact CD2-CG1 4.01Å; L1299-V1350 HydrophobicContact CG-CG1 4.49Å; E1346-V1350 WeakPolarHBondContact O-CG2 3.45Å; E1346-V1350 PolarHBondContact O-N 3.09Å; Q1347-V1350 PolarHBondContact O-N 3.28Å; V1350-N1353 PolarHBondContact O-N 3.05Å; V1350-R1354 WeakPolarHBondContact O-CG 3.35Å; V1350-R1354 PolarHBondContact O-N 3.14Å |
| 1351 | L | 91.4 | Very high | 90.6 | Very high | 0 Ų | 0 | 59.4 Ų | 59.4 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -55.2 | -53 | 173.6 | -78.6 | 164.5 | 0 | 0 | 0 | 111.6 | I1295 I1298 L1299 M1339 L1340 A1343 Q1347 N1353 R1354 I1355 | I1295-L1351 HydrophobicContact CG2-CD1 3.9Å; I1295-L1351 HydrophobicContact CG2-CD2 4.32Å; I1295-L1351 HydrophobicContact CG2-CG 4.16Å; I1298-L1351 HydrophobicContact CD1-CD2 4.42Å; L1299-L1351 HydrophobicContact CD2-CD2 3.82Å; L1299-L1351 HydrophobicContact CD2-CG 4.23Å; L1299-L1351 HydrophobicContact CG-CD2 4.33Å; M1339-L1351 HydrophobicContact CB-CD1 4.28Å; L1340-L1351 HydrophobicContact CD2-CB 3.81Å; L1340-L1351 HydrophobicContact CD2-CD1 4.35Å; A1343-L1351 HydrophobicContact CB-CD1 3.91Å; Q1347-L1351 WeakPolarHBondContact O-CB 3.34Å; Q1347-L1351 WeakPolarHBondContact O-CG 3.25Å; Q1347-L1351 PolarHBondContact O-N 3.12Å; L1351-N1353 VanDerWaalsContact C-N 3.27Å; L1351-N1353 PolarHBondContact O-N 2.97Å; L1351-R1354 PolarHBondContact O-N 3.28Å; L1351-R1354 VanDerWaalsContact O-N 3.13Å; L1351-I1355 VanDerWaalsContact O-CG1 3.22Å; L1351-I1355 WeakPolarHBondContact O-CG1 3.44Å; L1351-I1355 PolarHBondContact O-N 3.15Å |
| 1352 | I | 92.1 | Very high | 90.3 | Very high | 17 Ų | 17 | 57.8 Ų | 57.8 | 9% | 0.087 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -57.8 | -40.8 | 178.9 | -71.9 | 171.2 | 0 | 0 | 0 | 111.1 | L1340 R1348 I1355 R1356 L1375 Y1378 | L1340-I1352 HydrophobicContact CD2-CG1 4.05Å; R1348-I1352 HydrophobicContact CG-CD1 3.91Å; R1348-I1352 HydrophobicContact CG-CG1 4.46Å; R1348-I1352 WeakPolarHBondContact O-CB 3.34Å; R1348-I1352 WeakPolarHBondContact O-CG1 3.36Å; R1348-I1352 PolarHBondContact O-N 2.89Å; I1352-I1355 PolarHBondContact O-N 3.33Å; I1352-R1356 HydrophobicContact CG2-CG 4.09Å; I1352-R1356 WeakPolarHBondContact O-CB 3.37Å; I1352-R1356 VanDerWaalsContact O-CG 3.26Å; I1352-R1356 WeakPolarHBondContact O-CG 3.39Å; I1352-R1356 PolarHBondContact O-N 3.3Å; I1352-L1375 HydrophobicContact CB-CD2 4.49Å; I1352-L1375 HydrophobicContact CG1-CD2 3.84Å; I1352-Y1378 HydrophobicContact CD1-CD2 4.35Å; I1352-Y1378 HydrophobicContact CD1-CG 4.13Å |
| 1353 | N | 90.3 | Very high | 90.1 | Very high | 70 Ų | 70 | 62.2 Ų | 62.2 | 37% | 0.374 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -70.8 | -30.5 | 178.8 | -73.6 | -23.1 | 0 | 0 | 0 | 113.6 | R1349 V1350 L1351 P1357 | R1349-N1353 WeakPolarHBondContact O-CB 3.22Å; R1349-N1353 VanDerWaalsContact O-CG 3.22Å; R1349-N1353 PolarHBondContact O-N 2.83Å; R1349-N1353 PolarHBondContact O-ND2 3.06Å; V1350-N1353 PolarHBondContact O-N 3.05Å; L1351-N1353 VanDerWaalsContact C-N 3.27Å; L1351-N1353 PolarHBondContact O-N 2.97Å; N1353-P1357 WeakPolarHBondContact O-CD 3.47Å |
| 1354 | R | 88.1 | Confident | 89.9 | Confident | 93 Ų | 93 | 70.3 Ų | 70.3 | 35% | 0.351 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -71.1 | -39.2 | 170.3 | -68.8 | -65.3 | -167.4 | 162.8 | 2.7 | 112.2 | L1299 H1300 L1323 V1350 L1351 | L1299-R1354 HydrophobicContact CD2-CB 4.42Å; L1299-R1354 HydrophobicContact CD2-CG 3.76Å; H1300-R1354 PolarHBondContact CD2-NH2 3.14Å; H1300-R1354 VanDerWaalsContact CD2-NH2 3.33Å; H1300-R1354 PolarHBondContact NE2-NH2 3.08Å; L1323-R1354 HydrophobicContact CD2-CB 3.78Å; V1350-R1354 WeakPolarHBondContact O-CG 3.35Å; V1350-R1354 PolarHBondContact O-N 3.14Å; L1351-R1354 PolarHBondContact O-N 3.28Å; L1351-R1354 VanDerWaalsContact O-N 3.13Å |
| 1355 | I | 90.8 | Very high | 89.8 | Confident | 0 Ų | 0 | 70.6 Ų | 70.6 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -82.4 | -32.9 | -173.9 | -53.3 | 163 | 0 | 0 | 0 | 112.5 | L1323 M1327 V1336 L1340 L1351 I1352 M1358 Q1359 L1362 I1371 L1375 | L1323-I1355 HydrophobicContact CD1-CG1 4.35Å; L1323-I1355 HydrophobicContact CD2-CG1 4.14Å; M1327-I1355 HydrophobicContact CE-CB 4.34Å; M1327-I1355 HydrophobicContact CE-CG1 3.87Å; M1327-I1355 HydrophobicContact CE-CG2 3.77Å; M1327-I1355 HydrophobicContact SD-CB 4.28Å; M1327-I1355 HydrophobicContact SD-CD1 3.79Å; M1327-I1355 HydrophobicContact SD-CG1 3.69Å; M1327-I1355 HydrophobicContact SD-CG2 3.54Å; M1327-I1355 VanDerWaalsContact SD-CG2 3.54Å; V1336-I1355 HydrophobicContact CG1-CD1 4.29Å; L1340-I1355 HydrophobicContact CD1-CD1 4.06Å; L1340-I1355 HydrophobicContact CD2-CD1 4.18Å; L1340-I1355 HydrophobicContact CG-CD1 4.43Å; L1351-I1355 VanDerWaalsContact O-CG1 3.22Å; L1351-I1355 WeakPolarHBondContact O-CG1 3.44Å; L1351-I1355 PolarHBondContact O-N 3.15Å; I1352-I1355 PolarHBondContact O-N 3.33Å; I1355-M1358 WeakPolarHBondContact O-CB 3.46Å; I1355-M1358 PolarHBondContact O-N 3Å; I1355-Q1359 PolarHBondContact O-N 3.32Å; I1355-L1362 HydrophobicContact CG2-CD1 3.74Å; I1355-I1371 HydrophobicContact CG2-CG2 4.16Å; I1355-L1375 HydrophobicContact CB-CD1 4.16Å; I1355-L1375 HydrophobicContact CG2-CD1 3.58Å |
| 1356 | R | 89.7 | Confident | 89.8 | Confident | 103 Ų | 103 | 70.6 Ų | 70.6 | 39% | 0.389 | 33% | 0.329 | S | S | . | . | G | 310 helix | trans | -50.2 | -50.4 | -179 | -89.4 | 172.5 | 174.6 | 173.4 | -3.6 | 114.2 | I1352 M1358 Q1359 N1379 | I1352-R1356 HydrophobicContact CG2-CG 4.09Å; I1352-R1356 WeakPolarHBondContact O-CB 3.37Å; I1352-R1356 VanDerWaalsContact O-CG 3.26Å; I1352-R1356 WeakPolarHBondContact O-CG 3.39Å; I1352-R1356 PolarHBondContact O-N 3.3Å; R1356-M1358 PolarHBondContact O-N 3.42Å; R1356-M1358 VanDerWaalsContact O-N 3.14Å; R1356-Q1359 WeakPolarHBondContact O-CG 3.35Å; R1356-Q1359 PolarHBondContact O-N 2.86Å; R1356-N1379 PolarHBondContact NH2-OD1 2.92Å |
| 1357 | P | 88.3 | Confident | 89.9 | Confident | 101 Ų | 101 | 69.8 Ų | 69.8 | 66% | 0.656 | 32% | 0.322 | S | S | * | . | G | 310 helix | trans | -57.2 | -28 | 176.8 | -26.4 | 35.2 | 0 | 0 | 0 | 114.2 | N1353 | N1353-P1357 WeakPolarHBondContact O-CD 3.47Š|
| 1358 | M | 85.1 | Confident | 89.8 | Confident | 26 Ų | 26 | 68.7 Ų | 68.7 | 13% | 0.128 | 32% | 0.317 | C | S | . | . | G | 310 helix | trans | -91.2 | -3.3 | -173.4 | -67.6 | 159.9 | 35.1 | 0 | 0 | 114 | V1324 M1327 I1355 R1356 N1360 V1361 L1362 | V1324-M1358 HydrophobicContact CB-CE 3.89Å; V1324-M1358 HydrophobicContact CG2-CE 3.22Å; V1324-M1358 HydrophobicContact CG2-CG 4.35Å; V1324-M1358 HydrophobicContact CG2-SD 3.53Å; V1324-M1358 VanDerWaalsContact CG2-SD 3.53Å; M1327-M1358 HydrophobicContact CE-CE 3.1Å; I1355-M1358 WeakPolarHBondContact O-CB 3.46Å; I1355-M1358 PolarHBondContact O-N 3Å; R1356-M1358 PolarHBondContact O-N 3.42Å; R1356-M1358 VanDerWaalsContact O-N 3.14Å; M1358-N1360 PolarHBondContact O-N 3Å; M1358-N1360 VanDerWaalsContact O-N 3.15Å; M1358-V1361 WeakPolarHBondContact O-CA 3.21Å; M1358-V1361 WeakPolarHBondContact O-CB 3.36Å; M1358-V1361 PolarHBondContact O-N 3.22Å; M1358-L1362 PolarHBondContact O-N 3.09Å |
| 1359 | Q | 87.4 | Confident | 89.7 | Confident | 36 Ų | 36 | 68.3 Ų | 68.3 | 17% | 0.168 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -53.8 | -38.5 | -179.9 | -71 | -179.5 | -8.5 | 0 | 0 | 112.7 | I1355 R1356 V1361 L1362 R1363 I1372 L1375 | I1355-Q1359 PolarHBondContact O-N 3.32Å; R1356-Q1359 WeakPolarHBondContact O-CG 3.35Å; R1356-Q1359 PolarHBondContact O-N 2.86Å; Q1359-V1361 PolarHBondContact O-N 2.91Å; Q1359-L1362 PolarHBondContact O-N 2.78Å; Q1359-R1363 WeakPolarHBondContact O-CG 3.27Å; Q1359-R1363 PolarHBondContact O-N 3.19Å; Q1359-I1372 HydrophobicContact CG-CG1 4.48Å; Q1359-L1375 HydrophobicContact CG-CD1 4.38Å |
| 1360 | N | 86.6 | Confident | 89.7 | Confident | 109 Ų | 109 | 64 Ų | 64 | 58% | 0.583 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -67.9 | -21.1 | 177 | -70 | -27.1 | 0 | 0 | 0 | 114.1 | M1358 R1363 | M1358-N1360 PolarHBondContact O-N 3Å; M1358-N1360 VanDerWaalsContact O-N 3.15Å; N1360-R1363 PolarHBondContact OD1-NH1 3.42Å |
| 1361 | V | 86.5 | Confident | 89.8 | Confident | 66 Ų | 66 | 62.4 Ų | 62.4 | 40% | 0.4 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -82.4 | -51.6 | 169.9 | -179.2 | 0 | 0 | 0 | 0 | 109.2 | M1358 Q1359 R1363 K1364 F1365 | M1358-V1361 WeakPolarHBondContact O-CA 3.21Å; M1358-V1361 WeakPolarHBondContact O-CB 3.36Å; M1358-V1361 PolarHBondContact O-N 3.22Å; Q1359-V1361 PolarHBondContact O-N 2.91Å; V1361-R1363 VanDerWaalsContact C-N 3.28Å; V1361-R1363 PolarHBondContact O-N 3.12Å; V1361-K1364 WeakPolarHBondContact O-CB 3.41Å; V1361-K1364 PolarHBondContact O-N 3.41Å; V1361-F1365 HydrophobicContact CG1-CD2 4.43Å; V1361-F1365 HydrophobicContact CG1-CE2 3.76Å; V1361-F1365 VanDerWaalsContact O-CD2 3.27Å; V1361-F1365 WeakPolarHBondContact O-CD2 3.37Å |
| 1362 | L | 88.6 | Confident | 89.8 | Confident | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -59.7 | -31.4 | -175.9 | -67.1 | 176.1 | 0 | 0 | 0 | 113.9 | M1327 I1355 M1358 Q1359 K1364 F1365 I1372 | M1327-L1362 HydrophobicContact CB-CD1 4.48Å; M1327-L1362 HydrophobicContact CB-CD2 3.67Å; M1327-L1362 HydrophobicContact CE-CD1 3.97Å; M1327-L1362 HydrophobicContact CE-CD2 4.38Å; M1327-L1362 HydrophobicContact SD-CD1 4Å; I1355-L1362 HydrophobicContact CG2-CD1 3.74Å; M1358-L1362 PolarHBondContact O-N 3.09Å; Q1359-L1362 PolarHBondContact O-N 2.78Å; L1362-K1364 PolarHBondContact O-N 3.36Å; L1362-F1365 PolarHBondContact O-N 3.44Å; L1362-F1365 VanDerWaalsContact O-N 3.09Å; L1362-I1372 HydrophobicContact CB-CD1 3.94Å; L1362-I1372 HydrophobicContact CB-CG1 4.26Å |
| 1363 | R | 89.9 | Confident | 89.7 | Confident | 147 Ų | 147 | 63.5 Ų | 63.5 | 56% | 0.555 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.1 | -19.3 | 172.1 | -76.9 | 179.7 | -179.3 | 131.9 | 1 | 114.1 | Q1359 N1360 V1361 I1372 | Q1359-R1363 WeakPolarHBondContact O-CG 3.27Å; Q1359-R1363 PolarHBondContact O-N 3.19Å; N1360-R1363 PolarHBondContact OD1-NH1 3.42Å; V1361-R1363 VanDerWaalsContact C-N 3.28Å; V1361-R1363 PolarHBondContact O-N 3.12Å; R1363-I1372 HydrophobicContact CB-CD1 4.3Å; R1363-I1372 HydrophobicContact CG-CD1 3.45Å; R1363-I1372 VanDerWaalsContact CG-CD1 3.45Å |
| 1364 | K | 90.4 | Very high | 89.7 | Confident | 173 Ų | 173 | 60.3 Ų | 60.3 | 75% | 0.752 | 29% | 0.285 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.2 | -1.5 | -179.1 | -54.9 | -175.7 | -178.8 | -176.1 | 0 | 113.9 | V1361 L1362 | V1361-K1364 WeakPolarHBondContact O-CB 3.41Å; V1361-K1364 PolarHBondContact O-N 3.41Å; L1362-K1364 PolarHBondContact O-N 3.36Å |
| 1365 | F | 90.2 | Very high | 89.8 | Confident | 77 Ų | 77 | 55.9 Ų | 55.9 | 34% | 0.338 | 27% | 0.269 | S | S | . | . | S | Bend | trans | -120.2 | 137.1 | -175.8 | -64.9 | -91.1 | 0 | 0 | 0 | 111.2 | K1328 V1361 L1362 Y1367 G1368 K1369 | K1328-F1365 HydrophobicContact CB-CD1 4.19Å; K1328-F1365 HydrophobicContact CB-CG 4.4Å; K1328-F1365 HydrophobicContact CD-CD1 3.93Å; K1328-F1365 HydrophobicContact CD-CD2 4.44Å; K1328-F1365 HydrophobicContact CD-CE1 3.72Å; K1328-F1365 HydrophobicContact CD-CE2 4.27Å; K1328-F1365 HydrophobicContact CD-CG 4.31Å; K1328-F1365 HydrophobicContact CD-CZ 3.91Å; K1328-F1365 HydrophobicContact CG-CB 4.31Å; K1328-F1365 HydrophobicContact CG-CD1 3.77Å; K1328-F1365 HydrophobicContact CG-CD2 4.03Å; K1328-F1365 HydrophobicContact CG-CE1 4.08Å; K1328-F1365 HydrophobicContact CG-CE2 4.34Å; K1328-F1365 HydrophobicContact CG-CG 3.75Å; K1328-F1365 HydrophobicContact CG-CZ 4.36Å; V1361-F1365 HydrophobicContact CG1-CD2 4.43Å; V1361-F1365 HydrophobicContact CG1-CE2 3.76Å; V1361-F1365 VanDerWaalsContact O-CD2 3.27Å; V1361-F1365 WeakPolarHBondContact O-CD2 3.37Å; L1362-F1365 PolarHBondContact O-N 3.44Å; L1362-F1365 VanDerWaalsContact O-N 3.09Å; F1365-Y1367 PolarHBondContact O-N 3.31Å; F1365-Y1367 VanDerWaalsContact O-N 3.11Å; F1365-G1368 PolarHBondContact O-N 2.59Å; F1365-K1369 PolarHBondContact O-N 2.87Å |
| 1366 | N | 91.7 | Very high | 89.7 | Confident | 118 Ų | 118 | 60.5 Ų | 60.5 | 63% | 0.631 | 29% | 0.29 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.4 | -33.9 | -174 | -69.5 | -3.1 | 0 | 0 | 0 | 113.6 | K1369 | N1366-K1369 WeakPolarHBondContact O-CD 3.33Å; N1366-K1369 WeakPolarHBondContact O-CE 3.37Å; N1366-K1369 VanDerWaalsContact O-CG 3.29Å; N1366-K1369 WeakPolarHBondContact O-CG 3.01Å |
| 1367 | Y | 92.4 | Very high | 89.6 | Confident | 83 Ų | 83 | 60.8 Ų | 60.8 | 33% | 0.325 | 29% | 0.294 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.1 | -29.8 | -178.2 | -51.1 | -72.9 | 0 | 0 | 0 | 112.7 | K1328 Q1330 F1365 K1369 H1370 | K1328-Y1367 VanDerWaalsContact O-CD2 3.25Å; K1328-Y1367 WeakPolarHBondContact O-CD2 3.36Å; Q1330-Y1367 HydrophobicContact CB-CD1 4.26Å; Q1330-Y1367 HydrophobicContact CB-CD2 4.21Å; Q1330-Y1367 HydrophobicContact CB-CE1 3.73Å; Q1330-Y1367 HydrophobicContact CB-CE2 3.65Å; Q1330-Y1367 HydrophobicContact CB-CG 4.48Å; F1365-Y1367 PolarHBondContact O-N 3.31Å; F1365-Y1367 VanDerWaalsContact O-N 3.11Å; Y1367-K1369 PolarHBondContact O-N 2.88Å; Y1367-K1369 VanDerWaalsContact O-N 3.13Å; Y1367-H1370 PolarHBondContact O-CD2 3.18Å; Y1367-H1370 PolarHBondContact O-N 3.12Å |
| 1368 | G | 90.3 | Very high | 89.3 | Confident | 0 Ų | 0 | 58.9 Ų | 58.9 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -60.7 | -24.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114 | M1327 F1365 H1370 I1371 I1372 | M1327-G1368 WeakPolarHBondContact O-CA 3.28Å; M1327-G1368 PolarHBondContact O-N 2.96Å; F1365-G1368 PolarHBondContact O-N 2.59Å; G1368-H1370 VanDerWaalsContact C-N 3.27Å; G1368-H1370 PolarHBondContact O-N 2.95Å; G1368-I1371 PolarHBondContact O-N 2.87Å; G1368-I1372 PolarHBondContact O-N 2.88Å |
| 1369 | K | 90.6 | Very high | 88.7 | Confident | 56 Ų | 56 | 60 Ų | 60 | 24% | 0.243 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -58.5 | -35.4 | 173.1 | 77.5 | -166.9 | -179.2 | -170.1 | 0 | 112.9 | A144 E145 F1365 N1366 Y1367 I1372 A1373 | A144-K1369 HydrophobicContact CB-CD 4.43Å; A144-K1369 WeakPolarHBondContact O-CE 2.89Å; E145-K1369 VanDerWaalsContact CD-NZ 3.32Å; E145-K1369 IonicContact OE1-NZ 2.68Å; E145-K1369 PolarHBondContact OE1-NZ 3.48Å; E145-K1369 IonicContact OE2-NZ 3.77Å; E145-K1369 PolarHBondContact OE2-NZ 2.78Å; F1365-K1369 PolarHBondContact O-N 2.87Å; N1366-K1369 WeakPolarHBondContact O-CD 3.33Å; N1366-K1369 WeakPolarHBondContact O-CE 3.37Å; N1366-K1369 VanDerWaalsContact O-CG 3.29Å; N1366-K1369 WeakPolarHBondContact O-CG 3.01Å; Y1367-K1369 PolarHBondContact O-N 2.88Å; Y1367-K1369 VanDerWaalsContact O-N 3.13Å; K1369-I1372 PolarHBondContact O-N 3.11Å; K1369-A1373 PolarHBondContact O-N 3.04Å |
| 1370 | H | 91.9 | Very high | 87.5 | Confident | 36 Ų | 36 | 64 Ų | 64 | 17% | 0.167 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -71 | -39.1 | -179.3 | -52.1 | -67.3 | 0 | 0 | 0 | 111.3 | G143 A144 Y1367 G1368 I1372 A1373 K1374 | G143-H1370 PolarHBondContact O-ND1 3.35Å; A144-H1370 PolarHBondContact O-CE1 3.32Å; Y1367-H1370 PolarHBondContact O-CD2 3.18Å; Y1367-H1370 PolarHBondContact O-N 3.12Å; G1368-H1370 VanDerWaalsContact C-N 3.27Å; G1368-H1370 PolarHBondContact O-N 2.95Å; H1370-I1372 VanDerWaalsContact C-N 3.29Å; H1370-I1372 PolarHBondContact O-N 3.45Å; H1370-A1373 PolarHBondContact O-N 3.13Å; H1370-K1374 PolarHBondContact O-N 2.9Å |
| 1371 | I | 92.9 | Very high | 86.2 | Confident | 0 Ų | 0 | 63.8 Ų | 63.8 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -60.8 | -39.5 | 174 | -48.3 | -57.3 | 0 | 0 | 0 | 111.2 | M1327 N1333 V1336 Q1337 L1340 I1355 G1368 K1374 L1375 | M1327-I1371 HydrophobicContact CB-CG1 4.03Å; M1327-I1371 HydrophobicContact CG-CD1 4.3Å; M1327-I1371 HydrophobicContact CG-CG1 3.94Å; M1327-I1371 HydrophobicContact CG-CG2 4.48Å; M1327-I1371 HydrophobicContact SD-CB 4.43Å; M1327-I1371 HydrophobicContact SD-CG1 4.22Å; M1327-I1371 HydrophobicContact SD-CG2 3.7Å; N1333-I1371 HydrophobicContact CB-CD1 3.98Å; N1333-I1371 VanDerWaalsContact O-CD1 3.31Å; N1333-I1371 WeakPolarHBondContact O-CD1 3.08Å; V1336-I1371 HydrophobicContact CB-CD1 4.28Å; V1336-I1371 HydrophobicContact CG1-CD1 4.32Å; Q1337-I1371 HydrophobicContact CG-CD1 3.71Å; L1340-I1371 HydrophobicContact CD1-CG2 4.36Å; I1355-I1371 HydrophobicContact CG2-CG2 4.16Å; G1368-I1371 PolarHBondContact O-N 2.87Å; I1371-K1374 WeakPolarHBondContact O-CA 3.42Å; I1371-K1374 VanDerWaalsContact O-CB 3.27Å; I1371-K1374 WeakPolarHBondContact O-CB 3.33Å; I1371-K1374 PolarHBondContact O-N 2.84Å; I1371-K1374 VanDerWaalsContact O-N 3.13Å; I1371-L1375 HydrophobicContact CG2-CD1 4.26Å; I1371-L1375 HydrophobicContact CG2-CG 4.43Å; I1371-L1375 WeakPolarHBondContact O-CG 3.34Å; I1371-L1375 PolarHBondContact O-N 3.04Å |
| 1372 | I | 91.4 | Very high | 84.6 | Confident | 11 Ų | 11 | 63.4 Ų | 63.4 | 6% | 0.056 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.3 | -45.9 | 177.4 | -63.1 | 170.2 | 0 | 0 | 0 | 110.3 | Q1359 L1362 R1363 G1368 K1369 H1370 K1374 L1375 E1376 | Q1359-I1372 HydrophobicContact CG-CG1 4.48Å; L1362-I1372 HydrophobicContact CB-CD1 3.94Å; L1362-I1372 HydrophobicContact CB-CG1 4.26Å; R1363-I1372 HydrophobicContact CB-CD1 4.3Å; R1363-I1372 HydrophobicContact CG-CD1 3.45Å; R1363-I1372 VanDerWaalsContact CG-CD1 3.45Å; G1368-I1372 PolarHBondContact O-N 2.88Å; K1369-I1372 PolarHBondContact O-N 3.11Å; H1370-I1372 VanDerWaalsContact C-N 3.29Å; H1370-I1372 PolarHBondContact O-N 3.45Å; I1372-K1374 PolarHBondContact O-N 3.2Å; I1372-L1375 VanDerWaalsContact O-N 3.1Å; I1372-L1375 PolarHBondContact O-N 2.85Å; I1372-E1376 HydrophobicContact CG2-CG 4.45Å; I1372-E1376 WeakPolarHBondContact CG2-OE1 3.28Å; I1372-E1376 WeakPolarHBondContact O-CG 3.34Å; I1372-E1376 PolarHBondContact O-N 3.26Å |
| 1373 | A | 91.3 | Very high | 82.6 | Confident | 28 Ų | 28 | 65.4 Ų | 65.4 | 23% | 0.231 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -62.7 | -25.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | K1369 H1370 | K1369-A1373 PolarHBondContact O-N 3.04Å; H1370-A1373 PolarHBondContact O-N 3.13Å |
| 1374 | K | 90.2 | Very high | 80.5 | Confident | 3 Ų | 3 | 64.5 Ų | 64.5 | 1% | 0.013 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -68.7 | -48.2 | 169.8 | -168.1 | 66.6 | 170.4 | -172.7 | 0 | 111.6 | W140 Q1337 L1340 E1341 H1370 I1371 I1372 K1377 Y1378 | W140-K1374 HydrophobicContact CE3-CD 3.93Å; W140-K1374 HydrophobicContact CH2-CD 3.36Å; W140-K1374 HydrophobicContact CZ2-CD 4.15Å; W140-K1374 HydrophobicContact CZ3-CD 3.26Å; Q1337-K1374 HydrophobicContact CG-CB 4.3Å; Q1337-K1374 HydrophobicContact CG-CD 4.38Å; Q1337-K1374 HydrophobicContact CG-CG 4.16Å; L1340-K1374 HydrophobicContact CB-CG 4.38Å; L1340-K1374 HydrophobicContact CD1-CG 3.99Å; E1341-K1374 VanDerWaalsContact CG-NZ 3.28Å; E1341-K1374 WeakPolarHBondContact OE1-CE 3.5Å; E1341-K1374 IonicContact OE1-NZ 2.96Å; E1341-K1374 PolarHBondContact OE1-NZ 2.68Å; H1370-K1374 PolarHBondContact O-N 2.9Å; I1371-K1374 WeakPolarHBondContact O-CA 3.42Å; I1371-K1374 VanDerWaalsContact O-CB 3.27Å; I1371-K1374 WeakPolarHBondContact O-CB 3.33Å; I1371-K1374 PolarHBondContact O-N 2.84Å; I1371-K1374 VanDerWaalsContact O-N 3.13Å; I1372-K1374 PolarHBondContact O-N 3.2Å; K1374-K1377 PolarHBondContact O-N 3.45Å; K1374-Y1378 HydrophobicContact CG-CE2 4.22Å; K1374-Y1378 WeakPolarHBondContact O-CD2 3.32Å |
| 1375 | L | 89.7 | Confident | 78.5 | Confident | 1 Ų | 1 | 62.3 Ų | 62.3 | 1% | 0.005 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -67.2 | -36 | -178.1 | -66.7 | 169.5 | 0 | 0 | 0 | 113.4 | L1340 I1352 I1355 Q1359 I1371 I1372 K1377 Y1378 N1379 | L1340-L1375 HydrophobicContact CD1-CD2 4.18Å; L1340-L1375 HydrophobicContact CD2-CD2 4.38Å; I1352-L1375 HydrophobicContact CB-CD2 4.49Å; I1352-L1375 HydrophobicContact CG1-CD2 3.84Å; I1355-L1375 HydrophobicContact CB-CD1 4.16Å; I1355-L1375 HydrophobicContact CG2-CD1 3.58Å; Q1359-L1375 HydrophobicContact CG-CD1 4.38Å; I1371-L1375 HydrophobicContact CG2-CD1 4.26Å; I1371-L1375 HydrophobicContact CG2-CG 4.43Å; I1371-L1375 WeakPolarHBondContact O-CG 3.34Å; I1371-L1375 PolarHBondContact O-N 3.04Å; I1372-L1375 VanDerWaalsContact O-N 3.1Å; I1372-L1375 PolarHBondContact O-N 2.85Å; L1375-K1377 PolarHBondContact O-N 3.35Å; L1375-Y1378 PolarHBondContact O-N 2.86Å; L1375-Y1378 VanDerWaalsContact O-N 3.08Å; L1375-N1379 PolarHBondContact O-N 3.39Å |
| 1376 | E | 88.5 | Confident | 76.3 | Confident | 97 Ų | 97 | 65.3 Ų | 65.3 | 45% | 0.453 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -57.4 | -37.8 | 179.2 | -76.8 | 170.6 | 178.6 | 0 | 0 | 111.8 | I1372 Y1378 N1379 N1380 | I1372-E1376 HydrophobicContact CG2-CG 4.45Å; I1372-E1376 WeakPolarHBondContact CG2-OE1 3.28Å; I1372-E1376 WeakPolarHBondContact O-CG 3.34Å; I1372-E1376 PolarHBondContact O-N 3.26Å; E1376-Y1378 PolarHBondContact O-N 2.96Å; E1376-N1379 PolarHBondContact O-N 3Å; E1376-N1380 PolarHBondContact O-OD1 2.87Å; E1376-N1380 PolarHBondContact O-N 3.17Å |
| 1377 | K | 87.1 | Confident | 74.1 | Confident | 109 Ų | 109 | 65.3 Ų | 65.3 | 47% | 0.474 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66.7 | -35 | 176.4 | -58.9 | -170.8 | -164.7 | 175.9 | 0 | 112.9 | W140 K1374 L1375 | W140-K1377 HydrophobicContact CH2-CD 3.59Å; W140-K1377 VanDerWaalsContact CH2-CE 3.49Å; W140-K1377 HydrophobicContact CZ2-CD 3.62Å; K1374-K1377 PolarHBondContact O-N 3.45Å; L1375-K1377 PolarHBondContact O-N 3.35Å |
| 1378 | Y | 82.5 | Confident | 71.7 | Confident | 60 Ų | 60 | 67.3 Ų | 67.3 | 24% | 0.235 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -74.3 | -33.3 | 175 | -67.4 | -64.5 | 0 | 0 | 0 | 113.1 | L1340 I1352 K1374 L1375 E1376 N1380 A1382 | L1340-Y1378 HydrophobicContact CB-CE2 4.23Å; L1340-Y1378 PolarHBondContact O-OH 2.86Å; I1352-Y1378 HydrophobicContact CD1-CD2 4.35Å; I1352-Y1378 HydrophobicContact CD1-CG 4.13Å; K1374-Y1378 HydrophobicContact CG-CE2 4.22Å; K1374-Y1378 WeakPolarHBondContact O-CD2 3.32Å; L1375-Y1378 PolarHBondContact O-N 2.86Å; L1375-Y1378 VanDerWaalsContact O-N 3.08Å; E1376-Y1378 PolarHBondContact O-N 2.96Å; Y1378-N1380 VanDerWaalsContact C-N 3.34Å; Y1378-A1382 PolarHBondContact O-N 3.42Å |
| 1379 | N | 73.7 | Confident | 69.3 | Low | 50 Ų | 50 | 70.7 Ų | 70.7 | 27% | 0.267 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -63.5 | -40.4 | 174.9 | -73.6 | -22.2 | 0 | 0 | 0 | 111.8 | R1356 L1375 E1376 V1381 A1382 G1383 | R1356-N1379 PolarHBondContact NH2-OD1 2.92Å; L1375-N1379 PolarHBondContact O-N 3.39Å; E1376-N1379 PolarHBondContact O-N 3Å; N1379-V1381 VanDerWaalsContact C-N 3.32Å; N1379-V1381 PolarHBondContact O-N 2.8Å; N1379-A1382 PolarHBondContact O-N 3.43Å; N1379-G1383 PolarHBondContact O-N 2.73Å; N1379-G1383 VanDerWaalsContact O-N 3.15Å |
| 1380 | N | 61.3 | Low | 67 | Low | 119 Ų | 119 | 77.4 Ų | 77.4 | 64% | 0.636 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -65.3 | -33.5 | -178 | -67.4 | -5 | 0 | 0 | 0 | 112.9 | E1376 Y1378 G1383 | E1376-N1380 PolarHBondContact O-OD1 2.87Å; E1376-N1380 PolarHBondContact O-N 3.17Å; Y1378-N1380 VanDerWaalsContact C-N 3.34Å; N1380-G1383 PolarHBondContact O-N 2.85Å |
| 1381 | V | 59.1 | Low | 64.4 | Low | 105 Ų | 105 | 81.7 Ų | 81.7 | 64% | 0.636 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -69.1 | -36.7 | 175.3 | 179.3 | 0 | 0 | 0 | 0 | 111.7 | N1379 | N1379-V1381 VanDerWaalsContact C-N 3.32Å; N1379-V1381 PolarHBondContact O-N 2.8Å |
| 1382 | A | 53.7 | Low | 61.7 | Low | 59 Ų | 59 | 87.2 Ų | 87.2 | 49% | 0.488 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -76.4 | -19.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | Y1378 N1379 | Y1378-A1382 PolarHBondContact O-N 3.42Å; N1379-A1382 PolarHBondContact O-N 3.43Å |
| 1383 | G | 46.3 | Very low | 59.2 | Low | 42 Ų | 42 | 92.5 Ų | 92.5 | 43% | 0.433 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -75.6 | -43.5 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | N1379 N1380 N1385 | N1379-G1383 PolarHBondContact O-N 2.73Å; N1379-G1383 VanDerWaalsContact O-N 3.15Å; N1380-G1383 PolarHBondContact O-N 2.85Å; G1383-N1385 VanDerWaalsContact C-N 3.32Å; G1383-N1385 PolarHBondContact O-N 2.81Å |
| 1384 | N | 45.8 | Very low | 56.7 | Low | 127 Ų | 127 | 96.2 Ų | 96.2 | 68% | 0.679 | 58% | 0.584 | S | S | * | * | G | 310 helix | trans | -72.4 | -19.4 | -171.8 | -85.6 | 13.3 | 0 | 0 | 0 | 114.7 | N1386 T1387 | N1384-N1386 VanDerWaalsContact C-N 3.33Å; N1384-N1386 PolarHBondContact O-N 2.93Å; N1384-T1387 PolarHBondContact O-OG1 2.87Å |
| 1385 | N | 47.3 | Very low | 54.3 | Low | 128 Ų | 128 | 103 Ų | 103 | 68% | 0.684 | 62% | 0.62 | S | S | * | * | G | 310 helix | trans | -87.7 | 4.2 | -175.6 | -68.6 | 12.5 | 0 | 0 | 0 | 114 | G1383 | G1383-N1385 VanDerWaalsContact C-N 3.32Å; G1383-N1385 PolarHBondContact O-N 2.81Å |
| 1386 | N | 44.7 | Very low | 51.8 | Low | 140 Ų | 140 | 109.8 Ų | 109.8 | 75% | 0.749 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -114.3 | 4.8 | -176 | -86.7 | -55.3 | 0 | 0 | 0 | 114.8 | N1384 | N1384-N1386 VanDerWaalsContact C-N 3.33Å; N1384-N1386 PolarHBondContact O-N 2.93Å |
| 1387 | T | 46 | Very low | 49.5 | Very low | 117 Ų | 117 | 111.3 Ų | 111.3 | 72% | 0.718 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -105.6 | -5.9 | -176.7 | 42.3 | 0 | 0 | 0 | 0 | 115 | N1384 | N1384-T1387 PolarHBondContact O-OG1 2.87Š|
| 1388 | T | 41.7 | Very low | 47.2 | Very low | 126 Ų | 126 | 114 Ų | 114 | 77% | 0.773 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -96.9 | -9.4 | 178.3 | 46 | 0 | 0 | 0 | 0 | 114.4 | K1390 | T1388-K1390 PolarHBondContact O-N 3.05Š|
| 1389 | G | 39.9 | Very low | 45.2 | Very low | 71 Ų | 71 | 118.7 Ų | 118.7 | 73% | 0.732 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -87.7 | 17.9 | -170.8 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||
| 1390 | K | 41.8 | Very low | 43.5 | Very low | 197 Ų | 197 | 123.5 Ų | 123.5 | 86% | 0.857 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -145.1 | 75 | -176.1 | -73.5 | -172 | 176.9 | 178.7 | 0 | 114.4 | T1388 | T1388-K1390 PolarHBondContact O-N 3.05Š|
| 1391 | S | 37 | Very low | 42.4 | Very low | 125 Ų | 125 | 125.3 Ų | 125.3 | 87% | 0.874 | 75% | 0.752 | S | S | * | * | trans | -176 | 79.5 | 150 | -83.6 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 1392 | S | 36.7 | Very low | 41.4 | Very low | 117 Ų | 117 | 126.9 Ų | 126.9 | 82% | 0.818 | 76% | 0.757 | S | S | * | * | trans | -157 | 61.8 | 172.3 | 57.6 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 1393 | S | 39.8 | Very low | 40.8 | Very low | 122 Ų | 122 | 130.5 Ų | 130.5 | 85% | 0.853 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -154.8 | 143.9 | 165.1 | -83.6 | 0 | 0 | 0 | 0 | 110.8 | ||
| 1394 | A | 38.5 | Very low | 40.4 | Very low | 106 Ų | 106 | 134.3 Ų | 134.3 | 88% | 0.876 | 78% | 0.778 | S | S | * | * | S | Bend | trans | 56.1 | 72.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||
| 1395 | N | 38.5 | Very low | 40 | Very low | 146 Ų | 146 | 134.8 Ų | 134.8 | 78% | 0.781 | 78% | 0.781 | S | S | * | * | -159.2 | 120.6 | 109.3 | -150.3 | -7.6 | 0 | 0 | 0 | 112.7 | |||||
| 1396 | N | 37.8 | Very low | 39.4 | Very low | 142 Ų | 142 | 133.9 Ų | 133.9 | 76% | 0.759 | 78% | 0.78 | S | S | * | * | trans | -157.2 | 104.5 | 141.6 | -141.4 | -10.9 | 0 | 0 | 0 | 111.5 | ||||
| 1397 | N | 40.3 | Very low | 38.8 | Very low | 129 Ų | 129 | 132.5 Ų | 132.5 | 69% | 0.69 | 78% | 0.776 | S | S | * | * | trans | 20 | 104 | 145.5 | -58 | -51.1 | 0 | 0 | 0 | 118 | ||||
| 1398 | N | 39.4 | Very low | 38.1 | Very low | 165 Ų | 165 | 133 Ų | 133 | 88% | 0.882 | 78% | 0.775 | S | S | * | * | trans | -116.1 | 106.8 | 148.3 | -129.7 | -13.9 | 0 | 0 | 0 | 106.9 | ||||
| 1399 | N | 39.2 | Very low | 37.7 | Very low | 160 Ų | 160 | 132.3 Ų | 132.3 | 86% | 0.856 | 77% | 0.767 | S | S | * | * | trans | -153.8 | 102.7 | 173.9 | -132.6 | -6.3 | 0 | 0 | 0 | 109.7 | ||||
| 1400 | N | 38.6 | Very low | 37.4 | Very low | 151 Ų | 151 | 134.2 Ų | 134.2 | 81% | 0.807 | 76% | 0.76 | S | S | * | * | trans | -141.2 | 74.1 | -177.8 | -158 | 13.1 | 0 | 0 | 0 | 110.4 | ||||
| 1401 | N | 39.1 | Very low | 37 | Very low | 157 Ų | 157 | 130.5 Ų | 130.5 | 84% | 0.84 | 75% | 0.749 | S | S | * | * | trans | -162.7 | 130.8 | 149.3 | -107.8 | -35.5 | 0 | 0 | 0 | 111.6 | ||||
| 1402 | N | 38 | Very low | 36.9 | Very low | 138 Ų | 138 | 129.6 Ų | 129.6 | 74% | 0.738 | 74% | 0.739 | S | S | * | * | trans | -74.4 | 148.7 | 167.1 | -59.4 | -52.1 | 0 | 0 | 0 | 109.3 | ||||
| 1403 | N | 39.6 | Very low | 36.7 | Very low | 135 Ų | 135 | 129.8 Ų | 129.8 | 72% | 0.722 | 73% | 0.731 | S | S | * | * | -177 | 138.1 | 102.6 | -95.2 | -35.5 | 0 | 0 | 0 | 114.3 | |||||
| 1404 | N | 39.4 | Very low | 36.4 | Very low | 122 Ų | 122 | 130.1 Ų | 130.1 | 65% | 0.652 | 72% | 0.722 | S | S | * | * | trans | 52.8 | 110.5 | 136.2 | -58.5 | -18.9 | 0 | 0 | 0 | 119.8 | ||||
| 1405 | N | 37.1 | Very low | 36.2 | Very low | 137 Ų | 137 | 130 Ų | 130 | 73% | 0.733 | 71% | 0.714 | S | S | * | * | 100.1 | 140.4 | 114 | -82.6 | -9.6 | 0 | 0 | 0 | 120.3 | |||||
| 1406 | T | 34.6 | Very low | 36 | Very low | 108 Ų | 108 | 128 Ų | 128 | 66% | 0.663 | 71% | 0.707 | S | S | * | * | trans | 62.5 | 96.5 | 146.7 | 50.1 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 1407 | T | 32.7 | Very low | 35.8 | Very low | 111 Ų | 111 | 125.6 Ų | 125.6 | 68% | 0.681 | 70% | 0.702 | S | S | * | * | 71.3 | 143.6 | 120.1 | 63.7 | 0 | 0 | 0 | 0 | 118.9 | |||||
| 1408 | N | 31.1 | Very low | 35.5 | Very low | 129 Ų | 129 | 125.9 Ų | 125.9 | 69% | 0.69 | 70% | 0.703 | S | S | * | * | trans | 67.6 | 129.9 | 136.9 | -67.7 | 3.1 | 0 | 0 | 0 | 116.9 | ||||
| 1409 | N | 33.2 | Very low | 35.2 | Very low | 111 Ų | 111 | 124.2 Ų | 124.2 | 59% | 0.594 | 69% | 0.694 | S | S | * | * | cis | -167.2 | -177.2 | 5.4 | -127.1 | -14.9 | 0 | 0 | 0 | 110.7 | ||||
| 1410 | N | 34.1 | Very low | 34.9 | Very low | 111 Ų | 111 | 120.4 Ų | 120.4 | 59% | 0.594 | 68% | 0.68 | S | S | * | * | trans | 31 | 135 | 134 | -57 | -13.8 | 0 | 0 | 0 | 119 | ||||
| 1411 | N | 33.2 | Very low | 34.6 | Very low | 118 Ų | 118 | 117.4 Ų | 117.4 | 63% | 0.631 | 67% | 0.671 | S | S | * | * | cis | -179.6 | -156.6 | 2.5 | -108.1 | -21.5 | 0 | 0 | 0 | 105.3 | ||||
| 1412 | T | 33.9 | Very low | 34.3 | Very low | 106 Ų | 106 | 115.5 Ų | 115.5 | 65% | 0.65 | 67% | 0.666 | S | S | * | * | trans | 56.9 | 118.5 | 131.3 | 51.7 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 1413 | N | 33.1 | Very low | 34.1 | Very low | 122 Ų | 122 | 114.7 Ų | 114.7 | 65% | 0.652 | 66% | 0.661 | S | S | * | * | cis | -159.9 | 156.9 | 20.9 | -115.1 | -1.9 | 0 | 0 | 0 | 111 | ||||
| 1414 | L | 33.6 | Very low | 34 | Very low | 129 Ų | 129 | 116.2 Ų | 116.2 | 68% | 0.675 | 66% | 0.664 | S | S | * | * | 42.4 | 133.7 | 100.9 | -88.1 | 65.7 | 0 | 0 | 0 | 113.5 | V1416 | L1414-V1416 HydrophobicContact CG-CG2 4.15Š| |||
| 1415 | S | 34.4 | Very low | 33.8 | Very low | 102 Ų | 102 | 116 Ų | 116 | 71% | 0.713 | 67% | 0.666 | S | S | * | * | cis | -135.3 | 138.7 | 29.4 | -59.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 1416 | V | 33.7 | Very low | 33.6 | Very low | 104 Ų | 104 | 113.4 Ų | 113.4 | 63% | 0.63 | 66% | 0.659 | S | S | * | * | 53.2 | 80.4 | 68.8 | -178.8 | 0 | 0 | 0 | 0 | 109 | L1414 | L1414-V1416 HydrophobicContact CG-CG2 4.15Š| |||
| 1417 | S | 33.4 | Very low | 33.4 | Very low | 92 Ų | 92 | 116.8 Ų | 116.8 | 64% | 0.643 | 67% | 0.665 | S | S | * | * | 85.6 | 162.7 | 87.3 | -67.5 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 1418 | N | 33.8 | Very low | 33.3 | Very low | 135 Ų | 135 | 117.4 Ų | 117.4 | 72% | 0.722 | 67% | 0.668 | S | S | * | * | trans | 73 | 141.2 | 160.3 | -59.6 | -15.2 | 0 | 0 | 0 | 115.4 | ||||
| 1419 | N | 32.9 | Very low | 33.3 | Very low | 130 Ų | 130 | 115.5 Ų | 115.5 | 70% | 0.695 | 67% | 0.665 | S | S | * | * | cis | -152 | 162.8 | -0.6 | -135.9 | -13 | 0 | 0 | 0 | 113.9 | ||||
| 1420 | S | 33.4 | Very low | 33.3 | Very low | 80 Ų | 80 | 117 Ų | 117 | 56% | 0.559 | 67% | 0.673 | S | S | * | * | trans | 17.1 | 137.2 | 137.9 | 73.6 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 1421 | S | 32.8 | Very low | 33.3 | Very low | 89 Ų | 89 | 118.3 Ų | 118.3 | 62% | 0.622 | 68% | 0.68 | S | S | * | * | 178.4 | 144.2 | 65.9 | -93.1 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 1422 | T | 33.5 | Very low | 33.5 | Very low | 117 Ų | 117 | 117.3 Ų | 117.3 | 72% | 0.718 | 68% | 0.682 | S | S | * | * | trans | 62 | 165.1 | 141.2 | 63.6 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 1423 | N | 33.4 | Very low | 33.5 | Very low | 120 Ų | 120 | 118.4 Ų | 118.4 | 64% | 0.642 | 68% | 0.684 | S | S | * | * | cis | -164.1 | 174.2 | -26.4 | -100.6 | -7.1 | 0 | 0 | 0 | 105.7 | ||||
| 1424 | H | 37.1 | Very low | 33.5 | Very low | 168 Ų | 168 | 118.4 Ų | 118.4 | 78% | 0.778 | 68% | 0.684 | S | S | * | * | trans | 65.5 | 170.5 | 150.4 | -73.1 | -48.3 | 0 | 0 | 0 | 116.8 | ||||
| 1425 | V | 35.7 | Very low | 33.6 | Very low | 116 Ų | 116 | 118.3 Ų | 118.3 | 70% | 0.703 | 69% | 0.685 | S | S | * | * | cis | -156.5 | 174 | -49.8 | 82.4 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 1426 | S | 31.7 | Very low | 33.4 | Very low | 84 Ų | 84 | 120.9 Ų | 120.9 | 59% | 0.587 | 69% | 0.69 | S | S | * | * | trans | -10 | 148.9 | 161 | -52.3 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 1427 | K | 30.8 | Very low | 33.5 | Very low | 179 Ų | 179 | 118.9 Ų | 118.9 | 78% | 0.778 | 69% | 0.69 | S | S | * | * | trans | 70.4 | 130.5 | 136.7 | -75.9 | 168.1 | -179 | -178.4 | 0 | 119.8 | ||||
| 1428 | T | 30.4 | Very low | 33.5 | Very low | 123 Ų | 123 | 121.3 Ų | 121.3 | 76% | 0.755 | 70% | 0.702 | S | S | * | * | trans | 65.9 | 155 | 136.9 | 57.9 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 1429 | S | 32.2 | Very low | 33.6 | Very low | 90 Ų | 90 | 118.4 Ų | 118.4 | 63% | 0.629 | 70% | 0.703 | S | S | * | * | trans | 68.1 | 109.5 | 148.3 | -69.8 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 1430 | N | 33.1 | Very low | 33.6 | Very low | 143 Ų | 143 | 118.7 Ų | 118.7 | 77% | 0.765 | 71% | 0.705 | S | S | * | * | 70.3 | 144.6 | 117.9 | -58.5 | -3.5 | 0 | 0 | 0 | 120.9 | |||||
| 1431 | N | 33.2 | Very low | 33.6 | Very low | 137 Ų | 137 | 120.7 Ų | 120.7 | 73% | 0.733 | 71% | 0.709 | S | S | * | * | trans | 69.2 | 114.7 | 162.5 | -67.9 | -6.9 | 0 | 0 | 0 | 116.1 | ||||
| 1432 | S | 37.8 | Very low | 33.5 | Very low | 97 Ų | 97 | 123.9 Ų | 123.9 | 68% | 0.678 | 72% | 0.72 | S | S | * | * | 67.9 | 128 | 53.7 | -54.5 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 1433 | N | 33.6 | Very low | 33.6 | Very low | 130 Ų | 130 | 122 Ų | 122 | 70% | 0.695 | 72% | 0.723 | S | S | * | * | -156.1 | 141.4 | 100.1 | -103.3 | -8.3 | 0 | 0 | 0 | 112.7 | |||||
| 1434 | N | 34.2 | Very low | 33.6 | Very low | 122 Ų | 122 | 119.5 Ų | 119.5 | 65% | 0.652 | 73% | 0.726 | S | S | * | * | trans | 65.4 | 134.3 | 146.8 | -56.5 | -7.5 | 0 | 0 | 0 | 118.5 | ||||
| 1435 | N | 35.3 | Very low | 33.2 | Very low | 127 Ų | 127 | 117 Ų | 117 | 68% | 0.679 | 73% | 0.726 | S | S | * | * | cis | -142.4 | 138.2 | -8.4 | -94.8 | -31.8 | 0 | 0 | 0 | 108.2 | ||||
| 1436 | N | 29.6 | Very low | 33.1 | Very low | 156 Ų | 156 | 118.5 Ų | 118.5 | 83% | 0.834 | 73% | 0.73 | S | S | * | * | 72.8 | 107.9 | 62.3 | -144.1 | 7.4 | 0 | 0 | 0 | 111.4 | |||||
| 1437 | G | 36.5 | Very low | 33.1 | Very low | 61 Ų | 61 | 120.6 Ų | 120.6 | 63% | 0.629 | 73% | 0.734 | S | S | * | * | trans | 149 | 85 | -173.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 1438 | T | 33.3 | Very low | 33.3 | Very low | 144 Ų | 144 | 117 Ų | 117 | 88% | 0.883 | 73% | 0.728 | S | S | * | * | 61.4 | 125.7 | 77.6 | 71.3 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 1439 | G | 34.6 | Very low | 33.5 | Very low | 73 Ų | 73 | 117.6 Ų | 117.6 | 75% | 0.753 | 73% | 0.726 | S | S | * | * | trans | 112.9 | 99 | -178.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 1440 | N | 33 | Very low | 33.6 | Very low | 137 Ų | 137 | 119.4 Ų | 119.4 | 73% | 0.733 | 73% | 0.729 | S | S | * | * | cis | 75.9 | 120 | 31.9 | -161.7 | 39.7 | 0 | 0 | 0 | 115 | ||||
| 1441 | N | 32.9 | Very low | 34 | Very low | 121 Ų | 121 | 116.7 Ų | 116.7 | 65% | 0.647 | 72% | 0.721 | S | S | * | * | trans | 64.3 | 131.5 | 158.3 | -75.8 | -17.7 | 0 | 0 | 0 | 122.2 | ||||
| 1442 | N | 32 | Very low | 34.3 | Very low | 157 Ų | 157 | 115.8 Ų | 115.8 | 84% | 0.84 | 72% | 0.717 | S | S | * | * | 27.1 | 132.9 | 128.9 | -59.7 | -17.6 | 0 | 0 | 0 | 120.8 | |||||
| 1443 | G | 34.8 | Very low | 34.3 | Very low | 77 Ų | 77 | 118.3 Ų | 118.3 | 79% | 0.794 | 72% | 0.722 | S | S | * | * | trans | 142.1 | 147.2 | 133.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 1444 | G | 33.8 | Very low | 34.5 | Very low | 68 Ų | 68 | 116.1 Ų | 116.1 | 70% | 0.701 | 73% | 0.731 | S | S | * | * | trans | 81.8 | 108.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 1445 | C | 29.6 | Very low | 34.6 | Very low | 114 Ų | 114 | 114.3 Ų | 114.3 | 77% | 0.77 | 74% | 0.74 | S | S | * | * | cis | 54.1 | 88.6 | 19.7 | -49 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 1446 | N | 32.3 | Very low | 34.7 | Very low | 149 Ų | 149 | 115.1 Ų | 115.1 | 80% | 0.797 | 75% | 0.75 | S | S | * | * | 177 | 120.9 | 99.7 | -92.2 | -23.8 | 0 | 0 | 0 | 114.4 | |||||
| 1447 | N | 32 | Very low | 35.3 | Very low | 127 Ų | 127 | 113.7 Ų | 113.7 | 68% | 0.679 | 75% | 0.749 | S | S | * | * | 67.5 | 154.3 | 107.7 | -153.6 | 11.5 | 0 | 0 | 0 | 120.1 | |||||
| 1448 | T | 34.1 | Very low | 35.3 | Very low | 104 Ų | 104 | 115.7 Ų | 115.7 | 64% | 0.638 | 76% | 0.76 | S | S | * | * | trans | 65.5 | 138.1 | 165.3 | 63.7 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 1449 | N | 35.1 | Very low | 35.3 | Very low | 135 Ų | 135 | 113.4 Ų | 113.4 | 72% | 0.722 | 76% | 0.756 | S | S | * | * | cis | -162.1 | 156.2 | -7.7 | -120.1 | -12.1 | 0 | 0 | 0 | 112.4 | ||||
| 1450 | N | 35.4 | Very low | 35.4 | Very low | 129 Ų | 129 | 115.9 Ų | 115.9 | 69% | 0.69 | 76% | 0.761 | S | S | * | * | trans | 46.1 | 130 | 134.4 | -133.6 | 23.9 | 0 | 0 | 0 | 118.5 | ||||
| 1451 | S | 41.1 | Very low | 35.5 | Very low | 86 Ų | 86 | 118.9 Ų | 118.9 | 60% | 0.601 | 77% | 0.768 | S | S | * | * | cis | -168.2 | 140.9 | 49.1 | -153.7 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 1452 | N | 39 | Very low | 35.6 | Very low | 118 Ų | 118 | 119.1 Ų | 119.1 | 63% | 0.631 | 78% | 0.779 | S | S | * | * | trans | 58 | 110.7 | 140.4 | -69.6 | -6.9 | 0 | 0 | 0 | 123.7 | ||||
| 1453 | N | 38.5 | Very low | 35.7 | Very low | 149 Ų | 149 | 116.8 Ų | 116.8 | 80% | 0.797 | 78% | 0.782 | S | S | * | * | 68.3 | 113.2 | 115.3 | -57.9 | -13.8 | 0 | 0 | 0 | 121.6 | |||||
| 1454 | G | 36.4 | Very low | 35.7 | Very low | 85 Ų | 85 | 116.3 Ų | 116.3 | 88% | 0.876 | 78% | 0.777 | S | S | * | * | 121.7 | 137 | 89.5 | 0 | 0 | 0 | 0 | 0 | 117 | |||||
| 1455 | G | 36.2 | Very low | 35.9 | Very low | 83 Ų | 83 | 118.7 Ų | 118.7 | 86% | 0.856 | 78% | 0.783 | S | S | * | * | trans | 144.2 | 88.9 | 172 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 1456 | T | 38 | Very low | 36 | Very low | 145 Ų | 145 | 120.6 Ų | 120.6 | 89% | 0.89 | 79% | 0.785 | S | S | * | * | trans | -87.6 | 163.9 | 171.7 | 27.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 1457 | P | 42.5 | Very low | 36.3 | Very low | 125 Ų | 125 | 119.4 Ų | 119.4 | 81% | 0.812 | 79% | 0.788 | S | S | * | * | trans | -95.8 | 162 | -161.7 | 37.7 | -37.3 | 0 | 0 | 0 | 114.9 | ||||
| 1458 | A | 35.9 | Very low | 36.4 | Very low | 104 Ų | 104 | 121.9 Ų | 121.9 | 86% | 0.86 | 80% | 0.796 | S | S | * | * | trans | -160 | 163.3 | 155.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 1459 | A | 34.9 | Very low | 36.6 | Very low | 95 Ų | 95 | 121.7 Ų | 121.7 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | trans | -75.4 | 166.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 1460 | S | 36.2 | Very low | 36.8 | Very low | 125 Ų | 125 | 123.2 Ų | 123.2 | 87% | 0.874 | 81% | 0.807 | S | S | * | * | -170.5 | 164.9 | 127.1 | 41.8 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 1461 | K | 34.2 | Very low | 37 | Very low | 200 Ų | 200 | 121 Ų | 121 | 87% | 0.87 | 81% | 0.814 | S | S | * | * | trans | -90.8 | 154.5 | 179 | -49.4 | 165.4 | -177 | 174.1 | 0 | 110.2 | ||||
| 1462 | S | 35 | Very low | 36.7 | Very low | 127 Ų | 127 | 125 Ų | 125 | 89% | 0.888 | 83% | 0.825 | S | S | * | * | 177.3 | 163 | 125.5 | 39.4 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 1463 | A | 34 | Very low | 36.7 | Very low | 108 Ų | 108 | 124.8 Ų | 124.8 | 89% | 0.893 | 83% | 0.829 | S | S | * | * | trans | -98.3 | 160.1 | -180 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 1464 | G | 35.5 | Very low | 36.5 | Very low | 66 Ų | 66 | 123.4 Ų | 123.4 | 68% | 0.68 | 83% | 0.826 | S | S | * | * | trans | -161.8 | 108.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 1465 | S | 37.2 | Very low | 36.4 | Very low | 119 Ų | 119 | 128.1 Ų | 128.1 | 83% | 0.832 | 83% | 0.83 | S | S | * | * | trans | 49.9 | 118.2 | 147.2 | 54.2 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 1466 | N | 31.9 | Very low | 36.4 | Very low | 153 Ų | 153 | 132 Ų | 132 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | trans | -48.9 | 158.8 | 156 | -49.3 | -13.6 | 0 | 0 | 0 | 113.5 | ||||
| 1467 | S | 38 | Very low | 36.3 | Very low | 124 Ų | 124 | 133.2 Ų | 133.2 | 87% | 0.867 | 82% | 0.821 | S | S | * | * | trans | -150.9 | 139.3 | 138.6 | 32.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 1468 | E | 34.8 | Very low | 35.8 | Very low | 180 Ų | 180 | 134 Ų | 134 | 84% | 0.841 | 82% | 0.819 | S | S | * | * | trans | -94.3 | 160.7 | -178.2 | -59.3 | 147.8 | 110.4 | 0 | 0 | 110.8 | ||||
| 1469 | S | 39.2 | Very low | 35.6 | Very low | 100 Ų | 100 | 136.5 Ų | 136.5 | 70% | 0.699 | 82% | 0.818 | S | S | * | * | 167.8 | 133.9 | 113.2 | 48.1 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 1470 | N | 39.7 | Very low | 35.5 | Very low | 167 Ų | 167 | 137.3 Ų | 137.3 | 89% | 0.893 | 82% | 0.818 | S | S | * | * | trans | 60.3 | 131.9 | 138.2 | -55.9 | -16.7 | 0 | 0 | 0 | 122.9 | ||||
| 1471 | G | 38 | Very low | 35.3 | Very low | 81 Ų | 81 | 136.2 Ų | 136.2 | 84% | 0.835 | 81% | 0.81 | S | S | * | * | trans | 117.6 | 115 | 147.8 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 1472 | M | 36.5 | Very low | 35.2 | Very low | 170 Ų | 170 | 132 Ų | 132 | 84% | 0.837 | 80% | 0.802 | S | S | * | * | cis | -176.2 | 161 | -41.9 | 177.1 | 163.3 | -171.2 | 0 | 0 | 107.9 | ||||
| 1473 | T | 37.7 | Very low | 35 | Very low | 114 Ų | 114 | 132.8 Ų | 132.8 | 70% | 0.699 | 80% | 0.796 | S | S | * | * | trans | 65.9 | 104.7 | 167.9 | 36.4 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 1474 | T | 35.6 | Very low | 34.9 | Very low | 121 Ų | 121 | 132.9 Ų | 132.9 | 74% | 0.742 | 79% | 0.785 | S | S | * | * | 72.3 | 94.5 | 122.2 | -39.9 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 1475 | L | 33.8 | Very low | 34.8 | Very low | 183 Ų | 183 | 135.7 Ų | 135.7 | 96% | 0.958 | 79% | 0.789 | S | S | * | * | trans | -127.3 | 159.9 | 137.6 | -88.6 | 171.1 | 0 | 0 | 0 | 109 | ||||
| 1476 | Q | 36 | Very low | 34.4 | Very low | 164 Ų | 164 | 134.9 Ų | 134.9 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | trans | -136.8 | 158.4 | -163.8 | -165.6 | 178 | 16.6 | 0 | 0 | 110.8 | ||||
| 1477 | Q | 35.2 | Very low | 34.5 | Very low | 171 Ų | 171 | 133.2 Ų | 133.2 | 80% | 0.799 | 79% | 0.785 | S | S | * | * | trans | 75.3 | 98.8 | -176.5 | -52.6 | 173.1 | -7.7 | 0 | 0 | 111.4 | ||||
| 1478 | N | 32.9 | Very low | 34.3 | Very low | 143 Ų | 143 | 133.2 Ų | 133.2 | 77% | 0.765 | 78% | 0.781 | S | S | * | * | 67.5 | 98.2 | 60.2 | -59.8 | 22.4 | 0 | 0 | 0 | 112.5 | |||||
| 1479 | D | 30.5 | Very low | 34.3 | Very low | 155 Ų | 155 | 130.1 Ų | 130.1 | 83% | 0.829 | 77% | 0.774 | S | S | * | * | -173.8 | 110.9 | 93.5 | -90.3 | -19.4 | 0 | 0 | 0 | 110.9 | |||||
| 1480 | S | 34.4 | Very low | 34 | Very low | 112 Ų | 112 | 130.8 Ų | 130.8 | 78% | 0.783 | 77% | 0.774 | S | S | * | * | trans | -142.4 | 119.8 | -175.2 | -62.1 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 1481 | S | 31.7 | Very low | 33.7 | Very low | 102 Ų | 102 | 131.4 Ų | 131.4 | 71% | 0.713 | 77% | 0.771 | S | S | * | * | trans | 53.8 | 118.9 | 138.5 | 65.8 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 1482 | T | 30.7 | Very low | 33.4 | Very low | 113 Ų | 113 | 136.8 Ų | 136.8 | 69% | 0.693 | 77% | 0.771 | S | S | * | * | trans | 58.4 | 109.3 | 133.2 | 61.4 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 1483 | N | 32 | Very low | 33.2 | Very low | 143 Ų | 143 | 133.7 Ų | 133.7 | 77% | 0.765 | 77% | 0.766 | S | S | * | * | -164.8 | 136.1 | 92.4 | -92.8 | -49.6 | 0 | 0 | 0 | 109.6 | |||||
| 1484 | T | 30.9 | Very low | 33 | Very low | 109 Ų | 109 | 133.7 Ų | 133.7 | 67% | 0.669 | 77% | 0.771 | S | S | * | * | 64.8 | 95.5 | 62.5 | -40.3 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 1485 | T | 33.8 | Very low | 32.8 | Very low | 125 Ų | 125 | 135.2 Ų | 135.2 | 77% | 0.767 | 78% | 0.775 | S | S | * | * | trans | 171.4 | 104.9 | 130.1 | -68.6 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 1486 | A | 29.7 | Very low | 32.8 | Very low | 103 Ų | 103 | 132.1 Ų | 132.1 | 85% | 0.851 | 76% | 0.759 | S | S | * | * | trans | -113.3 | 122.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 1487 | T | 34.2 | Very low | 32.7 | Very low | 117 Ų | 117 | 132.1 Ų | 132.1 | 72% | 0.718 | 76% | 0.757 | S | S | * | * | trans | -152 | 155.3 | -175.8 | 14.7 | 0 | 0 | 0 | 0 | 112 | ||||
| 1488 | T | 32.4 | Very low | 32.6 | Very low | 125 Ų | 125 | 128 Ų | 128 | 77% | 0.767 | 75% | 0.752 | S | S | * | * | trans | 85.7 | 85.3 | 166.1 | -22.9 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 1489 | T | 34.6 | Very low | 32.5 | Very low | 115 Ų | 115 | 127.7 Ų | 127.7 | 71% | 0.706 | 75% | 0.75 | S | S | * | * | 32.1 | 120.5 | 122.7 | -12.2 | 0 | 0 | 0 | 0 | 120.6 | |||||
| 1490 | T | 33.7 | Very low | 32.6 | Very low | 113 Ų | 113 | 128.2 Ų | 128.2 | 69% | 0.693 | 75% | 0.747 | S | S | * | * | trans | 66.1 | 126.3 | 143.6 | 44.5 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 1491 | H | 33.1 | Very low | 32.5 | Very low | 180 Ų | 180 | 134 Ų | 134 | 83% | 0.833 | 75% | 0.752 | S | S | * | * | trans | 56.1 | 100.4 | 151.4 | -65.9 | -66.7 | 0 | 0 | 0 | 119.9 | ||||
| 1492 | K | 32.8 | Very low | 32.6 | Very low | 194 Ų | 194 | 139.1 Ų | 139.1 | 84% | 0.843 | 78% | 0.779 | S | S | * | * | -152.1 | 145.3 | 118.8 | -119.8 | 168.3 | -174.2 | 174.5 | 0 | 113.2 | |||||
| 1493 | S | 30.7 | Very low | 32.7 | Very low | 105 Ų | 105 | 140.4 Ų | 140.4 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | trans | -72.3 | 148.9 | 166.1 | 53 | 0 | 0 | 0 | 0 | 111 | ||||
| 1494 | S | 33.7 | Very low | 32.7 | Very low | 114 Ų | 114 | 140.3 Ų | 140.3 | 80% | 0.797 | 78% | 0.784 | S | S | * | * | -170.9 | 148.9 | 111.2 | -93.4 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 1495 | N | 32.1 | Very low | 32.8 | Very low | 153 Ų | 153 | 142 Ų | 142 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | -59.3 | 154.4 | 164.8 | -53 | -22.1 | 0 | 0 | 0 | 109.6 | ||||
| 1496 | D | 33.3 | Very low | 32.8 | Very low | 118 Ų | 118 | 143 Ų | 143 | 63% | 0.631 | 79% | 0.792 | S | S | * | * | -160.9 | 153.8 | 100.6 | -126.1 | -26 | 0 | 0 | 0 | 115.1 | |||||
| 1497 | K | 34.6 | Very low | 33 | Very low | 165 Ų | 165 | 145.5 Ų | 145.5 | 72% | 0.717 | 79% | 0.788 | S | S | * | * | trans | 33.3 | 111.6 | 162.2 | -67.2 | 130.7 | -166.5 | 160 | 0 | 119 | ||||
| 1498 | A | 33.4 | Very low | 32.9 | Very low | 84 Ų | 84 | 147.4 Ų | 147.4 | 69% | 0.694 | 79% | 0.793 | S | S | * | * | 82.3 | 143 | 55.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 1499 | N | 30.8 | Very low | 32.9 | Very low | 136 Ų | 136 | 149 Ų | 149 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | trans | 44.5 | 96.4 | 155 | -57.9 | -3.6 | 0 | 0 | 0 | 118.2 | ||||
| 1500 | H | 33 | Very low | 32.8 | Very low | 166 Ų | 166 | 151.6 Ų | 151.6 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | 169.9 | 132.4 | 94.9 | -89.2 | -63.6 | 0 | 0 | 0 | 112.1 | |||||
| 1501 | R | 31.8 | Very low | 32.7 | Very low | 235 Ų | 235 | 154.8 Ų | 154.8 | 89% | 0.887 | 81% | 0.811 | S | S | * | * | trans | 56.8 | 121.1 | 159 | -58.7 | 172.6 | 177.6 | 172.5 | -1.8 | 115.6 | ||||
| 1502 | T | 33.1 | Very low | 32.7 | Very low | 208 Ų | 208 | 152.5 Ų | 152.5 | 100% | 1.276 | 81% | 0.809 | S | S | * | * | cis | -136.7 | 0 | 21 | 48.2 | 0 | 0 | 0 | 0 | 111.3 |
Retrieved 1,502 of 1,502 residues in 1388 ms
(Link to these results)