| 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 | 30.2 | Very low | 34 | Very low | 235 Ų | 235 | 155.5 Ų | 155.5 | 100% | 1.158 | 87% | 0.871 | S | S | * | * | 0 | 119.6 | 0 | -139.8 | 174 | -176.1 | 0 | 0 | 106.2 | |||||
| 2 | V | 34.3 | Very low | 34 | Very low | 138 Ų | 138 | 152.8 Ų | 152.8 | 84% | 0.836 | 87% | 0.867 | S | S | * | * | trans | 72.5 | 124.6 | 178.6 | -164.3 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 3 | V | 34.5 | Very low | 34.4 | Very low | 99 Ų | 99 | 154.5 Ų | 154.5 | 60% | 0.6 | 87% | 0.871 | S | S | * | * | cis | -168.9 | 122.7 | -19.4 | 135.6 | 0 | 0 | 0 | 0 | 104.4 | N5 | V3-N5 VanDerWaalsContact C-N 3.35Å; V3-N5 HydrophobicContact CG1-CB 3.41Å; V3-N5 VanDerWaalsContact CG1-CB 3.41Å; V3-N5 VanDerWaalsContact CG1-ND2 3.34Å; V3-N5 WeakPolarHBondContact CG1-ND2 3.48Å; V3-N5 PolarHBondContact O-N 3.08Å | ||
| 4 | L | 30.3 | Very low | 34.2 | Very low | 181 Ų | 181 | 160.1 Ų | 160.1 | 95% | 0.948 | 87% | 0.874 | S | S | * | * | trans | -73.4 | 86.5 | 159.5 | -89.2 | 143.5 | 0 | 0 | 0 | 107.6 | ||||
| 5 | N | 34.3 | Very low | 34.3 | Very low | 144 Ų | 144 | 156.6 Ų | 156.6 | 77% | 0.77 | 87% | 0.866 | S | S | * | * | trans | -142.7 | 106.6 | 167.2 | -85.8 | -46.9 | 0 | 0 | 0 | 109.5 | V3 | V3-N5 VanDerWaalsContact C-N 3.35Å; V3-N5 HydrophobicContact CG1-CB 3.41Å; V3-N5 VanDerWaalsContact CG1-CB 3.41Å; V3-N5 VanDerWaalsContact CG1-ND2 3.34Å; V3-N5 WeakPolarHBondContact CG1-ND2 3.48Å; V3-N5 PolarHBondContact O-N 3.08Å | ||
| 6 | G | 34.6 | Very low | 34.6 | Very low | 85 Ų | 85 | 153.3 Ų | 153.3 | 88% | 0.876 | 86% | 0.857 | S | S | * | * | trans | 173.4 | 28.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 7 | S | 33.1 | Very low | 34.7 | Very low | 117 Ų | 117 | 157.2 Ų | 157.2 | 82% | 0.818 | 86% | 0.863 | S | S | * | * | S | Bend | trans | -131.5 | 13.1 | 178.1 | -156.6 | 0 | 0 | 0 | 0 | 115.9 | ||
| 8 | L | 33.9 | Very low | 34.7 | Very low | 167 Ų | 167 | 157.9 Ų | 157.9 | 87% | 0.874 | 86% | 0.864 | S | S | * | * | S | Bend | trans | -129.3 | 0.4 | -176.8 | -79.7 | 171.1 | 0 | 0 | 0 | 118 | ||
| 9 | S | 40.4 | Very low | 34.9 | Very low | 124 Ų | 124 | 155.2 Ų | 155.2 | 87% | 0.867 | 86% | 0.858 | S | S | * | * | S | Bend | trans | -101.6 | 6 | -174 | -55.5 | 0 | 0 | 0 | 0 | 116.7 | ||
| 10 | R | 37.1 | Very low | 34.8 | Very low | 256 Ų | 256 | 157.6 Ų | 157.6 | 97% | 0.966 | 86% | 0.859 | S | S | * | * | S | Bend | trans | -94.6 | 6.2 | -179.2 | -74.5 | -169.4 | -163.4 | -117.8 | 2.4 | 115.9 | ||
| 11 | L | 31.7 | Very low | 34.9 | Very low | 165 Ų | 165 | 155.1 Ų | 155.1 | 86% | 0.864 | 85% | 0.851 | S | S | * | * | S | Bend | trans | -108.6 | 1.3 | -173.4 | -97.8 | 156.6 | 0 | 0 | 0 | 117 | ||
| 12 | C | 34.2 | Very low | 35.3 | Very low | 122 Ų | 122 | 151.7 Ų | 151.7 | 82% | 0.824 | 84% | 0.836 | S | S | * | * | trans | -135.2 | 71.1 | 178.3 | -77.5 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 13 | L | 38.1 | Very low | 35.7 | Very low | 176 Ų | 176 | 151.2 Ų | 151.2 | 92% | 0.921 | 83% | 0.833 | S | S | * | * | trans | -142.4 | 64.6 | 156.5 | -98.4 | 162.3 | 0 | 0 | 0 | 108.4 | ||||
| 14 | Y | 31.7 | Very low | 35.9 | Very low | 232 Ų | 232 | 154.6 Ų | 154.6 | 91% | 0.91 | 85% | 0.847 | S | S | * | * | trans | -121.6 | 74.5 | 169.2 | -157 | -88.6 | 0 | 0 | 0 | 107.9 | ||||
| 15 | S | 36.8 | Very low | 36.3 | Very low | 108 Ų | 108 | 153.2 Ų | 153.2 | 76% | 0.755 | 84% | 0.841 | S | S | * | * | trans | -167.9 | 152.3 | 161.6 | -156.2 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 16 | S | 38.5 | Very low | 36.4 | Very low | 103 Ų | 103 | 150.4 Ų | 150.4 | 72% | 0.72 | 85% | 0.846 | S | S | * | * | trans | 72 | 68.3 | 168.6 | 78.5 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 17 | K | 35.9 | Very low | 36.6 | Very low | 221 Ų | 221 | 149.1 Ų | 149.1 | 96% | 0.961 | 83% | 0.833 | S | S | * | * | trans | -139.1 | 64.7 | 131.3 | -78 | -157.9 | 178 | 179.1 | 0 | 109.7 | ||||
| 18 | L | 35.1 | Very low | 37 | Very low | 170 Ų | 170 | 149.9 Ų | 149.9 | 89% | 0.89 | 83% | 0.828 | S | S | * | * | trans | -90.4 | 144.5 | 166.4 | -162.2 | 75.5 | 0 | 0 | 0 | 108.5 | ||||
| 19 | S | 38.4 | Very low | 37.4 | Very low | 105 Ų | 105 | 146.4 Ų | 146.4 | 73% | 0.734 | 82% | 0.823 | S | S | * | * | trans | 83.5 | 82.5 | 165.6 | -144.2 | 0 | 0 | 0 | 0 | 117 | ||||
| 20 | K | 33.4 | Very low | 37.6 | Very low | 203 Ų | 203 | 143.1 Ų | 143.1 | 88% | 0.883 | 81% | 0.809 | S | S | * | * | trans | -102.4 | 122.3 | 133.9 | -78.6 | -173.6 | 176.8 | -177.7 | 0 | 107 | L22 | K20-L22 PolarHBondContact O-N 2.83Š| ||
| 21 | P | 36.4 | Very low | 37.9 | Very low | 107 Ų | 107 | 135.9 Ų | 135.9 | 70% | 0.695 | 79% | 0.788 | S | S | * | * | trans | -67.2 | 126.1 | -176.8 | 25.4 | -31 | 0 | 0 | 0 | 109.9 | V23 | P21-V23 PolarHBondContact O-N 3.1Å; P21-V23 VanDerWaalsContact O-N 3.13Å | ||
| 22 | L | 39.1 | Very low | 38.3 | Very low | 162 Ų | 162 | 130.1 Ų | 130.1 | 85% | 0.848 | 77% | 0.769 | S | S | * | * | trans | -66.8 | 105.9 | 169 | -100.1 | 157.2 | 0 | 0 | 0 | 108 | K20 L24 | K20-L22 PolarHBondContact O-N 2.83Å; L22-L24 PolarHBondContact O-N 3.37Å | ||
| 23 | V | 42.2 | Very low | 38.7 | Very low | 128 Ų | 128 | 127.4 Ų | 127.4 | 78% | 0.776 | 76% | 0.756 | S | S | * | * | trans | -64.4 | 105.4 | 168.2 | 176.6 | 0 | 0 | 0 | 0 | 107.4 | P21 N25 | P21-V23 PolarHBondContact O-N 3.1Å; P21-V23 VanDerWaalsContact O-N 3.13Å; V23-N25 PolarHBondContact O-N 3.42Å | ||
| 24 | L | 38.6 | Very low | 38.8 | Very low | 171 Ų | 171 | 128.7 Ų | 128.7 | 90% | 0.895 | 75% | 0.748 | S | S | * | * | trans | -65.7 | 95.1 | 170.3 | -89 | 111.6 | 0 | 0 | 0 | 108.8 | L22 G26 | L22-L24 PolarHBondContact O-N 3.37Å; L24-G26 PolarHBondContact O-N 3.36Å | ||
| 25 | N | 38.3 | Very low | 39.3 | Very low | 151 Ų | 151 | 125 Ų | 125 | 81% | 0.807 | 74% | 0.737 | S | S | * | * | trans | -85.8 | 107.6 | 168.3 | -158.6 | -17.6 | 0 | 0 | 0 | 108.7 | V23 G27 | V23-N25 PolarHBondContact O-N 3.42Å; N25-G27 VanDerWaalsContact C-N 3.27Å; N25-G27 PolarHBondContact O-N 2.85Å | ||
| 26 | G | 36.7 | Very low | 39.5 | Very low | 86 Ų | 86 | 128 Ų | 128 | 89% | 0.887 | 74% | 0.737 | S | S | * | * | trans | -73.5 | 64.4 | -173 | 0 | 0 | 0 | 0 | 0 | 114.3 | L24 | L24-G26 PolarHBondContact O-N 3.36Š| ||
| 27 | G | 39.1 | Very low | 39.9 | Very low | 58 Ų | 58 | 125.7 Ų | 125.7 | 60% | 0.598 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -131.6 | 115.9 | 173 | 0 | 0 | 0 | 0 | 0 | 111.6 | N25 | N25-G27 VanDerWaalsContact C-N 3.27Å; N25-G27 PolarHBondContact O-N 2.85Å |
| 28 | N | 41.5 | Very low | 40.4 | Very low | 132 Ų | 132 | 119.8 Ų | 119.8 | 71% | 0.706 | 71% | 0.707 | S | S | * | * | trans | 69.3 | 58.3 | 170 | -77.1 | -2.6 | 0 | 0 | 0 | 118.2 | G30 | N28-G30 PolarHBondContact O-N 3.5Š| ||
| 29 | A | 43.3 | Very low | 40.8 | Very low | 95 Ų | 95 | 121 Ų | 121 | 79% | 0.785 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -57.9 | -14.6 | 167.4 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 30 | G | 44.5 | Very low | 41 | Very low | 55 Ų | 55 | 120 Ų | 120 | 57% | 0.567 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -76.3 | -27.3 | -176.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | N28 | N28-G30 PolarHBondContact O-N 3.5Å |
| 31 | I | 43.4 | Very low | 41.4 | Very low | 103 Ų | 103 | 119.9 Ų | 119.9 | 53% | 0.528 | 69% | 0.688 | S | S | . | * | H | α-helix | trans | -90.3 | -38.5 | -172.2 | -55 | 173.7 | 0 | 0 | 0 | 110.9 | R34 F35 | I31-R34 PolarHBondContact O-N 3.46Å; I31-F35 HydrophobicContact CG2-CD2 4.24Å; I31-F35 HydrophobicContact CG2-CE2 4.26Å; I31-F35 PolarHBondContact O-N 3.28Å |
| 32 | G | 39.2 | Very low | 41.8 | Very low | 44 Ų | 44 | 124.7 Ų | 124.7 | 45% | 0.454 | 69% | 0.692 | S | S | . | * | H | α-helix | trans | -66.6 | -39.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | R34 F35 F36 | G32-R34 VanDerWaalsContact C-N 3.3Å; G32-R34 PolarHBondContact O-N 3.23Å; G32-F35 PolarHBondContact O-N 2.86Å; G32-F35 VanDerWaalsContact O-N 3.16Å; G32-F36 PolarHBondContact O-N 3.47Å |
| 33 | A | 43.6 | Very low | 42.2 | Very low | 66 Ų | 66 | 122.4 Ų | 122.4 | 55% | 0.545 | 68% | 0.681 | S | S | . | * | H | α-helix | trans | -63.5 | -36.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | F36 A37 | A33-F36 PolarHBondContact O-N 2.9Å; A33-A37 PolarHBondContact O-N 3.3Å; A33-A37 VanDerWaalsContact O-N 3.12Å |
| 34 | R | 39.6 | Very low | 42.5 | Very low | 203 Ų | 203 | 122.4 Ų | 122.4 | 77% | 0.766 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -67.1 | -37.5 | 175.1 | -67.8 | -160.4 | 179.4 | -144.3 | 1.7 | 112 | I31 G32 T38 | I31-R34 PolarHBondContact O-N 3.46Å; G32-R34 VanDerWaalsContact C-N 3.3Å; G32-R34 PolarHBondContact O-N 3.23Å; R34-T38 PolarHBondContact O-N 3.29Å; R34-T38 VanDerWaalsContact O-N 3.15Å; R34-T38 PolarHBondContact O-OG1 3.03Å |
| 35 | F | 41 | Very low | 42.7 | Very low | 154 Ų | 154 | 117.3 Ų | 117.3 | 68% | 0.675 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -68.1 | -36.1 | 176.3 | -92.3 | -82.9 | 0 | 0 | 0 | 113.2 | I31 G32 T38 R39 | I31-F35 HydrophobicContact CG2-CD2 4.24Å; I31-F35 HydrophobicContact CG2-CE2 4.26Å; I31-F35 PolarHBondContact O-N 3.28Å; G32-F35 PolarHBondContact O-N 2.86Å; G32-F35 VanDerWaalsContact O-N 3.16Å; F35-T38 PolarHBondContact O-N 2.81Å; F35-R39 PolarHBondContact O-N 3.46Å |
| 36 | F | 42.8 | Very low | 43.3 | Very low | 171 Ų | 171 | 117.7 Ų | 117.7 | 75% | 0.75 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -69.2 | -41.6 | 177.5 | -116.9 | -88.8 | 0 | 0 | 0 | 112.2 | G32 A33 T38 R39 S40 | G32-F36 PolarHBondContact O-N 3.47Å; A33-F36 PolarHBondContact O-N 2.9Å; F36-T38 VanDerWaalsContact C-N 3.34Å; F36-T38 PolarHBondContact O-N 3.42Å; F36-R39 PolarHBondContact O-N 3.19Å; F36-S40 PolarHBondContact O-N 2.93Å |
| 37 | A | 46 | Very low | 43.8 | Very low | 54 Ų | 54 | 117.4 Ų | 117.4 | 45% | 0.446 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -59.9 | -44.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | A33 R39 S40 Y41 | A33-A37 PolarHBondContact O-N 3.3Å; A33-A37 VanDerWaalsContact O-N 3.12Å; A37-R39 VanDerWaalsContact C-N 3.26Å; A37-R39 PolarHBondContact O-N 3.2Å; A37-S40 PolarHBondContact O-N 3.13Å; A37-Y41 WeakPolarHBondContact O-CD2 3.46Å |
| 38 | T | 47.1 | Very low | 44.5 | Very low | 98 Ų | 98 | 122.2 Ų | 122.2 | 60% | 0.601 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -65.4 | -28.4 | 179.1 | -46.5 | 0 | 0 | 0 | 0 | 112.8 | R34 F35 F36 | R34-T38 PolarHBondContact O-N 3.29Å; R34-T38 VanDerWaalsContact O-N 3.15Å; R34-T38 PolarHBondContact O-OG1 3.03Å; F35-T38 PolarHBondContact O-N 2.81Å; F36-T38 VanDerWaalsContact C-N 3.34Å; F36-T38 PolarHBondContact O-N 3.42Å |
| 39 | R | 43 | Very low | 45 | Very low | 195 Ų | 195 | 125.4 Ų | 125.4 | 74% | 0.736 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -78 | -31.8 | 180 | -152.7 | 168.5 | -165.1 | 172.7 | 2.5 | 112.9 | F35 F36 A37 R42 | F35-R39 PolarHBondContact O-N 3.46Å; F36-R39 PolarHBondContact O-N 3.19Å; A37-R39 VanDerWaalsContact C-N 3.26Å; A37-R39 PolarHBondContact O-N 3.2Å; R39-R42 PolarHBondContact O-N 3.19Å |
| 40 | S | 42.2 | Very low | 45.6 | Very low | 84 Ų | 84 | 131.6 Ų | 131.6 | 59% | 0.587 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -69.2 | -34.3 | 179.5 | -159.7 | 0 | 0 | 0 | 0 | 112.7 | F36 A37 R42 | F36-S40 PolarHBondContact O-N 2.93Å; A37-S40 PolarHBondContact O-N 3.13Å; S40-R42 VanDerWaalsContact C-N 3.28Å; S40-R42 PolarHBondContact O-N 3.04Å |
| 41 | Y | 42.1 | Very low | 46 | Very low | 201 Ų | 201 | 131.7 Ų | 131.7 | 79% | 0.788 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -69.5 | -21.1 | 177.5 | -79.1 | -78.2 | 0 | 0 | 0 | 114.1 | A37 | A37-Y41 WeakPolarHBondContact O-CD2 3.46Å |
| 42 | R | 44.2 | Very low | 46.7 | Very low | 207 Ų | 207 | 128.7 Ų | 128.7 | 78% | 0.781 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -78.1 | -23.1 | -178.7 | -124.8 | 178.1 | -160.4 | 152.5 | 5 | 113.9 | R39 S40 | R39-R42 PolarHBondContact O-N 3.19Å; S40-R42 VanDerWaalsContact C-N 3.28Å; S40-R42 PolarHBondContact O-N 3.04Å |
| 43 | N | 47.4 | Very low | 47.5 | Very low | 115 Ų | 115 | 133.1 Ų | 133.1 | 62% | 0.615 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -93.9 | -19.5 | -173.5 | -69.4 | -10.2 | 0 | 0 | 0 | 113.8 | G45 | N43-G45 VanDerWaalsContact C-N 3.31Å |
| 44 | V | 48.1 | Very low | 48.2 | Very low | 128 Ų | 128 | 138.3 Ų | 138.3 | 78% | 0.776 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -78.4 | -19 | 177.1 | -175.8 | 0 | 0 | 0 | 0 | 111.9 | ||
| 45 | G | 44.5 | Very low | 49.2 | Very low | 64 Ų | 64 | 134.1 Ų | 134.1 | 66% | 0.66 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | -2.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | N43 A47 | N43-G45 VanDerWaalsContact C-N 3.31Å; G45-A47 PolarHBondContact O-N 3.39Å |
| 46 | Q | 49.8 | Very low | 50.1 | Low | 158 Ų | 158 | 129 Ų | 129 | 74% | 0.738 | 66% | 0.658 | S | S | * | * | trans | -76.4 | 60.5 | 169.1 | -74.6 | -172.8 | -13.6 | 0 | 0 | 109.8 | I48 | Q46-I48 PolarHBondContact O-N 3.17Š| ||
| 47 | A | 48 | Very low | 50.8 | Low | 80 Ų | 80 | 122.6 Ų | 122.6 | 66% | 0.661 | 63% | 0.631 | S | S | * | * | trans | -49.9 | 116 | 152.2 | 0 | 0 | 0 | 0 | 0 | 105.7 | G45 K49 | G45-A47 PolarHBondContact O-N 3.39Å; A47-K49 VanDerWaalsContact C-N 3.3Å; A47-K49 PolarHBondContact O-N 3.36Å | ||
| 48 | I | 52.9 | Low | 51.3 | Low | 159 Ų | 159 | 122.7 Ų | 122.7 | 82% | 0.815 | 64% | 0.637 | S | S | * | * | trans | -47.9 | 101.4 | 175.1 | -64.6 | 168.2 | 0 | 0 | 0 | 105.8 | Q46 R50 | Q46-I48 PolarHBondContact O-N 3.17Å; I48-R50 VanDerWaalsContact C-N 3.25Å; I48-R50 PolarHBondContact O-N 3.11Å | ||
| 49 | K | 52.2 | Low | 51.8 | Low | 199 Ų | 199 | 123.8 Ų | 123.8 | 87% | 0.865 | 63% | 0.63 | S | S | * | * | trans | -62.9 | 98.6 | 177 | -92.6 | -170.5 | 175.3 | -176.1 | 0 | 104.7 | A47 P51 | A47-K49 VanDerWaalsContact C-N 3.3Å; A47-K49 PolarHBondContact O-N 3.36Å; K49-P51 WeakPolarHBondContact O-CD 3.43Å; K49-P51 VanDerWaalsContact O-N 3.12Å | ||
| 50 | R | 55.3 | Low | 52.3 | Low | 225 Ų | 225 | 119.8 Ų | 119.8 | 85% | 0.849 | 63% | 0.63 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 121 | 168.2 | -70.4 | 179.8 | 175.1 | 162.5 | -1.5 | 104.8 | I48 G52 | I48-R50 VanDerWaalsContact C-N 3.25Å; I48-R50 PolarHBondContact O-N 3.11Å; R50-G52 PolarHBondContact O-N 3.34Å |
| 51 | P | 53.4 | Low | 53 | Low | 57 Ų | 57 | 118.5 Ų | 118.5 | 37% | 0.37 | 62% | 0.618 | S | S | . | * | P | Polyproline II helix | trans | -53.7 | 131.6 | 177.2 | 22 | -31.5 | 0 | 0 | 0 | 107.2 | K49 V56 | K49-P51 WeakPolarHBondContact O-CD 3.43Å; K49-P51 VanDerWaalsContact O-N 3.12Å; P51-V56 HydrophobicContact CB-CG2 3.8Å; P51-V56 HydrophobicContact CG-CG2 3.67Å |
| 52 | G | 58.3 | Low | 53.8 | Low | 40 Ų | 40 | 113.6 Ų | 113.6 | 41% | 0.412 | 61% | 0.609 | S | S | . | * | P | Polyproline II helix | trans | -56.7 | 148.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | R50 Q54 E55 V56 | R50-G52 PolarHBondContact O-N 3.34Å; G52-Q54 PolarHBondContact O-N 3.45Å; G52-Q54 VanDerWaalsContact O-N 3.12Å; G52-E55 WeakPolarHBondContact O-CA 3.13Å; G52-E55 WeakPolarHBondContact O-CB 3.25Å; G52-E55 PolarHBondContact O-N 3.36Å; G52-V56 PolarHBondContact O-N 3.29Å |
| 53 | L | 56.3 | Low | 54.6 | Low | 138 Ų | 138 | 110.9 Ų | 110.9 | 72% | 0.723 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -49.2 | -43.7 | 178.9 | -171.3 | 82.7 | 0 | 0 | 0 | 110.7 | E55 V56 L57 | L53-E55 VanDerWaalsContact C-N 3.31Å; L53-E55 PolarHBondContact O-N 2.95Å; L53-V56 PolarHBondContact O-N 2.84Å; L53-L57 HydrophobicContact CD1-CD1 4.48Å; L53-L57 HydrophobicContact CD2-CD1 3.91Å; L53-L57 HydrophobicContact CG-CD1 3.65Å; L53-L57 HydrophobicContact CG-CG 4.22Å; L53-L57 VanDerWaalsContact O-CB 3.29Å; L53-L57 WeakPolarHBondContact O-CB 3.38Å; L53-L57 WeakPolarHBondContact O-CD1 3.2Å; L53-L57 WeakPolarHBondContact O-CG 3.39Å; L53-L57 PolarHBondContact O-N 2.84Å |
| 54 | Q | 57.6 | Low | 55.8 | Low | 175 Ų | 175 | 109.3 Ų | 109.3 | 82% | 0.818 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -60.2 | -36.6 | 177.3 | -165.1 | 177.5 | 10.5 | 0 | 0 | 113.5 | G52 G58 | G52-Q54 PolarHBondContact O-N 3.45Å; G52-Q54 VanDerWaalsContact O-N 3.12Å; Q54-G58 PolarHBondContact O-N 2.96Å |
| 55 | E | 60.9 | Low | 56.9 | Low | 115 Ų | 115 | 104.1 Ų | 104.1 | 54% | 0.537 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -72.8 | -41.4 | 177.3 | -164.1 | -167.1 | 141.2 | 0 | 0 | 111.2 | G52 L53 L57 G58 R59 | G52-E55 WeakPolarHBondContact O-CA 3.13Å; G52-E55 WeakPolarHBondContact O-CB 3.25Å; G52-E55 PolarHBondContact O-N 3.36Å; L53-E55 VanDerWaalsContact C-N 3.31Å; L53-E55 PolarHBondContact O-N 2.95Å; E55-L57 VanDerWaalsContact C-N 3.32Å; E55-L57 PolarHBondContact O-N 3.4Å; E55-G58 PolarHBondContact O-N 3.1Å; E55-R59 WeakPolarHBondContact O-CG 3.34Å; E55-R59 PolarHBondContact O-N 3.39Å; E55-R59 IonicContact OE1-NH2 2.53Å; E55-R59 PolarHBondContact OE1-NH2 2.79Å |
| 56 | V | 60.4 | Low | 58.5 | Low | 47 Ų | 47 | 103.9 Ų | 103.9 | 29% | 0.285 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -62.6 | -41.7 | 174.5 | 179.1 | 0 | 0 | 0 | 0 | 110.7 | P51 G52 L53 R59 M293 | P51-V56 HydrophobicContact CB-CG2 3.8Å; P51-V56 HydrophobicContact CG-CG2 3.67Å; G52-V56 PolarHBondContact O-N 3.29Å; L53-V56 PolarHBondContact O-N 2.84Å; V56-R59 PolarHBondContact O-N 3.16Å; V56-M293 HydrophobicContact CG1-CE 4.2Å; V56-M293 HydrophobicContact CG1-SD 4.22Å; V56-M293 VanDerWaalsContact O-SD 3.41Å |
| 57 | L | 57 | Low | 60 | Low | 36 Ų | 36 | 99.9 Ų | 99.9 | 19% | 0.188 | 54% | 0.536 | C | S | . | . | H | α-helix | trans | -71.9 | -27.5 | -179.8 | -68 | 172.7 | 0 | 0 | 0 | 113.3 | L53 E55 M293 L294 | L53-L57 HydrophobicContact CD1-CD1 4.48Å; L53-L57 HydrophobicContact CD2-CD1 3.91Å; L53-L57 HydrophobicContact CG-CD1 3.65Å; L53-L57 HydrophobicContact CG-CG 4.22Å; L53-L57 VanDerWaalsContact O-CB 3.29Å; L53-L57 WeakPolarHBondContact O-CB 3.38Å; L53-L57 WeakPolarHBondContact O-CD1 3.2Å; L53-L57 WeakPolarHBondContact O-CG 3.39Å; L53-L57 PolarHBondContact O-N 2.84Å; E55-L57 VanDerWaalsContact C-N 3.32Å; E55-L57 PolarHBondContact O-N 3.4Å; L57-M293 HydrophobicContact CD2-CE 3.93Å; L57-M293 WeakPolarHBondContact O-CB 3.29Å; L57-M293 PolarHBondContact O-N 3.06Å; L57-L294 HydrophobicContact CB-CD1 4.11Å; L57-L294 HydrophobicContact CB-CG 3.95Å; L57-L294 HydrophobicContact CD1-CD1 3.91Å; L57-L294 HydrophobicContact CD1-CD2 4.2Å; L57-L294 HydrophobicContact CD1-CG 4.12Å; L57-L294 HydrophobicContact CD2-CD1 4.33Å; L57-L294 HydrophobicContact CD2-CD2 3.42Å; L57-L294 VanDerWaalsContact CD2-CD2 3.42Å; L57-L294 HydrophobicContact CD2-CG 3.58Å; L57-L294 HydrophobicContact CG-CD1 4.3Å; L57-L294 HydrophobicContact CG-CD2 4.25Å; L57-L294 HydrophobicContact CG-CG 4.04Å |
| 58 | G | 56.4 | Low | 61.5 | Low | 56 Ų | 56 | 100.7 Ų | 100.7 | 58% | 0.577 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -84.7 | -7.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | Q54 E55 | Q54-G58 PolarHBondContact O-N 2.96Å; E55-G58 PolarHBondContact O-N 3.1Å |
| 59 | R | 57.7 | Low | 62.6 | Low | 121 Ų | 121 | 93.5 Ų | 93.5 | 46% | 0.457 | 50% | 0.498 | S | S | . | . | S | Bend | trans | -64.1 | 145.5 | 177.2 | -79.3 | 170.8 | -171.5 | -160.6 | -0.9 | 111 | E55 V56 | E55-R59 WeakPolarHBondContact O-CG 3.34Å; E55-R59 PolarHBondContact O-N 3.39Å; E55-R59 IonicContact OE1-NH2 2.53Å; E55-R59 PolarHBondContact OE1-NH2 2.79Å; V56-R59 PolarHBondContact O-N 3.16Å |
| 60 | P | 54.2 | Low | 64.1 | Low | 111 Ų | 111 | 89.6 Ų | 89.6 | 72% | 0.721 | 48% | 0.481 | S | S | * | . | B | Isolated β-bridge | trans | -57.5 | 141.3 | 172.7 | 25 | -33.2 | 0 | 0 | 0 | 109.8 | T62 | P60-T62 PolarHBondContact O-N 2.83Å |
| 61 | T | 57.1 | Low | 65.2 | Low | 57 Ų | 57 | 84.8 Ų | 84.8 | 35% | 0.35 | 47% | 0.471 | S | S | . | . | P | Polyproline II helix | trans | -58.4 | 119.7 | -170.9 | 51.9 | 0 | 0 | 0 | 0 | 112.6 | T291 S292 A296 | T61-T291 WeakPolarHBondContact CG2-O 3.31Å; T61-S292 WeakPolarHBondContact CG2-O 3.47Å; T61-A296 HydrophobicContact CG2-CB 3.44Å; T61-A296 VanDerWaalsContact CG2-CB 3.44Å |
| 62 | T | 57.4 | Low | 66.5 | Low | 97 Ų | 97 | 84.8 Ų | 84.8 | 60% | 0.595 | 48% | 0.476 | S | S | * | . | P | Polyproline II helix | trans | -74.1 | 151.9 | 154.9 | -47.9 | 0 | 0 | 0 | 0 | 108.5 | P60 T64 P65 | P60-T62 PolarHBondContact O-N 2.83Å; T62-T64 HydrophobicContact CG2-CG2 3.86Å; T62-T64 PolarHBondContact O-N 2.95Å; T62-P65 WeakPolarHBondContact O-CD 3.1Å |
| 63 | E | 61.6 | Low | 67.6 | Low | 151 Ų | 151 | 84.6 Ų | 84.6 | 71% | 0.706 | 47% | 0.467 | S | S | * | . | S | Bend | trans | -58.9 | -2 | 178.2 | -56.9 | -174.8 | 161.1 | 0 | 0 | 114.8 | F66 T67 | E63-F66 PolarHBondContact O-N 3.24Å; E63-T67 PolarHBondContact O-N 3.47Å; E63-T67 PolarHBondContact O-OG1 2.83Å; E63-T67 VanDerWaalsContact O-OG1 3.05Å |
| 64 | T | 73 | Confident | 68.8 | Low | 82 Ų | 82 | 80.9 Ų | 80.9 | 50% | 0.503 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -58.8 | -45.2 | -171.1 | 56.4 | 0 | 0 | 0 | 0 | 114.4 | T62 F66 T67 V68 | T62-T64 HydrophobicContact CG2-CG2 3.86Å; T62-T64 PolarHBondContact O-N 2.95Å; T64-F66 VanDerWaalsContact C-N 3.33Å; T64-F66 PolarHBondContact O-N 2.85Å; T64-T67 PolarHBondContact O-N 3.27Å; T64-V68 WeakPolarHBondContact O-CG2 3.27Å; T64-V68 PolarHBondContact O-N 3.04Å |
| 65 | P | 71.6 | Confident | 69.9 | Low | 18 Ų | 18 | 74.1 Ų | 74.1 | 12% | 0.117 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -66.8 | -37.5 | -177.2 | -17.5 | 33 | 0 | 0 | 0 | 111.9 | T62 V68 G69 A296 S300 | T62-P65 WeakPolarHBondContact O-CD 3.1Å; P65-V68 PolarHBondContact O-N 3.27Å; P65-G69 PolarHBondContact O-N 3.46Å; P65-A296 HydrophobicContact CG-CB 4.34Å; P65-S300 PolarHBondContact O-OG 2.91Å |
| 66 | F | 77.3 | Confident | 70.6 | Confident | 60 Ų | 60 | 70.2 Ų | 70.2 | 26% | 0.263 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -67.8 | -40 | 176.1 | -63.4 | -77.8 | 0 | 0 | 0 | 111.6 | E63 T64 G69 K70 A296 Y299 Y304 | E63-F66 PolarHBondContact O-N 3.24Å; T64-F66 VanDerWaalsContact C-N 3.33Å; T64-F66 PolarHBondContact O-N 2.85Å; F66-G69 PolarHBondContact O-N 3.13Å; F66-K70 VanDerWaalsContact O-CG 3.3Å; F66-K70 WeakPolarHBondContact O-CG 3.37Å; F66-K70 PolarHBondContact O-N 2.95Å; F66-A296 HydrophobicContact CE2-CB 3.96Å; F66-A296 HydrophobicContact CZ-CB 4.22Å; F66-Y299 AromaticContact CE1-CD1 3.68Å; F66-Y299 HydrophobicContact CE1-CD1 3.68Å; F66-Y299 AromaticContact CE1-CE1 3.95Å; F66-Y299 HydrophobicContact CE1-CE1 3.95Å; F66-Y299 HydrophobicContact CZ-CD1 4.21Å; F66-Y304 HydrophobicContact CD1-CE2 4.12Å |
| 67 | T | 80.7 | Confident | 71.3 | Confident | 73 Ų | 73 | 71 Ų | 71 | 45% | 0.448 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -65 | -41.2 | 176.2 | -62.5 | 0 | 0 | 0 | 0 | 111.6 | E63 T64 K70 L71 | E63-T67 PolarHBondContact O-N 3.47Å; E63-T67 PolarHBondContact O-OG1 2.83Å; E63-T67 VanDerWaalsContact O-OG1 3.05Å; T64-T67 PolarHBondContact O-N 3.27Å; T67-K70 PolarHBondContact O-N 3.38Å; T67-L71 VanDerWaalsContact O-CB 3.31Å; T67-L71 WeakPolarHBondContact O-CB 3.36Å; T67-L71 PolarHBondContact O-N 3.48Å |
| 68 | V | 79.8 | Confident | 72.3 | Confident | 98 Ų | 98 | 72 Ų | 72 | 59% | 0.594 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -62.1 | -44.6 | 173.5 | 172 | 0 | 0 | 0 | 0 | 110.9 | T64 P65 L71 A72 | T64-V68 WeakPolarHBondContact O-CG2 3.27Å; T64-V68 PolarHBondContact O-N 3.04Å; P65-V68 PolarHBondContact O-N 3.27Å; V68-L71 PolarHBondContact O-N 2.97Å; V68-A72 WeakPolarHBondContact O-CB 3.42Å; V68-A72 PolarHBondContact O-N 3.06Å |
| 69 | G | 77.3 | Confident | 73.2 | Confident | 8 Ų | 8 | 75.4 Ų | 75.4 | 8% | 0.082 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -60.5 | -45.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | P65 F66 L71 A72 V73 Y304 | P65-G69 PolarHBondContact O-N 3.46Å; F66-G69 PolarHBondContact O-N 3.13Å; G69-L71 PolarHBondContact O-N 3Å; G69-A72 PolarHBondContact O-N 2.96Å; G69-V73 PolarHBondContact O-N 3.46Å; G69-Y304 VanDerWaalsContact C-CD1 3.42Å; G69-Y304 VanDerWaalsContact C-CG 3.49Å; G69-Y304 WeakPolarHBondContact O-CD1 3.33Å |
| 70 | K | 82.2 | Confident | 73.9 | Confident | 116 Ų | 116 | 71.7 Ų | 71.7 | 50% | 0.504 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -60.7 | -44.1 | 174.6 | -72 | 173.1 | -173.8 | 175 | 0 | 111.8 | F66 T67 A72 V73 A74 Y304 | F66-K70 VanDerWaalsContact O-CG 3.3Å; F66-K70 WeakPolarHBondContact O-CG 3.37Å; F66-K70 PolarHBondContact O-N 2.95Å; T67-K70 PolarHBondContact O-N 3.38Å; K70-A72 VanDerWaalsContact C-N 3.35Å; K70-V73 PolarHBondContact O-N 3.3Å; K70-A74 VanDerWaalsContact O-CB 3.32Å; K70-A74 WeakPolarHBondContact O-CB 3.4Å; K70-A74 PolarHBondContact O-N 3.37Å; K70-Y304 HydrophobicContact CB-CE1 4.36Å; K70-Y304 WeakPolarHBondContact CE-OH 3.48Å; K70-Y304 HydrophobicContact CG-CE1 3.55Å; K70-Y304 WeakPolarHBondContact CG-OH 3.3Å |
| 71 | L | 79.8 | Confident | 74.6 | Confident | 124 Ų | 124 | 71.6 Ų | 71.6 | 65% | 0.649 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -63 | -41.6 | 178.1 | -179.2 | 62.4 | 0 | 0 | 0 | 111.4 | T67 V68 G69 A74 G75 | T67-L71 VanDerWaalsContact O-CB 3.31Å; T67-L71 WeakPolarHBondContact O-CB 3.36Å; T67-L71 PolarHBondContact O-N 3.48Å; V68-L71 PolarHBondContact O-N 2.97Å; G69-L71 PolarHBondContact O-N 3Å; L71-A74 PolarHBondContact O-N 2.85Å; L71-G75 PolarHBondContact O-N 3.49Å |
| 72 | A | 80.6 | Confident | 75.3 | Confident | 57 Ų | 57 | 72.1 Ų | 72.1 | 47% | 0.471 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -62.8 | -44.5 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | V68 G69 K70 G76 | V68-A72 WeakPolarHBondContact O-CB 3.42Å; V68-A72 PolarHBondContact O-N 3.06Å; G69-A72 PolarHBondContact O-N 2.96Å; K70-A72 VanDerWaalsContact C-N 3.35Å; A72-G76 PolarHBondContact O-N 3.35Å |
| 73 | V | 81.6 | Confident | 75.8 | Confident | 37 Ų | 37 | 69.2 Ų | 69.2 | 22% | 0.224 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -65.9 | -43.8 | 176.1 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | G69 K70 G76 A77 Y304 L307 V308 | G69-V73 PolarHBondContact O-N 3.46Å; K70-V73 PolarHBondContact O-N 3.3Å; V73-G76 PolarHBondContact O-N 3.44Å; V73-A77 WeakPolarHBondContact O-CB 3.28Å; V73-A77 PolarHBondContact O-N 2.97Å; V73-Y304 HydrophobicContact CG2-CD1 3.85Å; V73-Y304 HydrophobicContact CG2-CG 4.41Å; V73-L307 HydrophobicContact CG1-CD2 3.79Å; V73-L307 HydrophobicContact CG2-CD2 3.91Å; V73-V308 HydrophobicContact CG2-CG2 3.92Å |
| 74 | A | 80.9 | Confident | 75.9 | Confident | 60 Ų | 60 | 64.1 Ų | 64.1 | 50% | 0.496 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -64.2 | -42.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112 | K70 L71 A77 A78 | K70-A74 VanDerWaalsContact O-CB 3.32Å; K70-A74 WeakPolarHBondContact O-CB 3.4Å; K70-A74 PolarHBondContact O-N 3.37Å; L71-A74 PolarHBondContact O-N 2.85Å; A74-A77 PolarHBondContact O-N 2.74Å; A74-A78 WeakPolarHBondContact O-CB 3.34Å; A74-A78 PolarHBondContact O-N 3.09Å |
| 75 | G | 80 | Confident | 75.8 | Confident | 32 Ų | 32 | 63.6 Ų | 63.6 | 33% | 0.33 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -63.7 | -44.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L71 A77 A78 L79 | L71-G75 PolarHBondContact O-N 3.49Å; G75-A77 PolarHBondContact O-N 3.34Å; G75-A78 PolarHBondContact O-N 3.35Å; G75-L79 WeakPolarHBondContact O-CG 3.45Å; G75-L79 PolarHBondContact O-N 3.21Å |
| 76 | G | 77 | Confident | 75.6 | Confident | 34 Ų | 34 | 68.8 Ų | 68.8 | 35% | 0.351 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -61.1 | -42.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | A72 V73 L79 G80 | A72-G76 PolarHBondContact O-N 3.35Å; V73-G76 PolarHBondContact O-N 3.44Å; G76-L79 PolarHBondContact O-N 3.35Å; G76-G80 PolarHBondContact O-N 3.24Å |
| 77 | A | 74.6 | Confident | 74.8 | Confident | 62 Ų | 62 | 70.6 Ų | 70.6 | 51% | 0.512 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -65.4 | -39.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | V73 A74 G75 G80 L81 | V73-A77 WeakPolarHBondContact O-CB 3.28Å; V73-A77 PolarHBondContact O-N 2.97Å; A74-A77 PolarHBondContact O-N 2.74Å; G75-A77 PolarHBondContact O-N 3.34Å; A77-G80 PolarHBondContact O-N 3.26Å; A77-L81 WeakPolarHBondContact O-CB 3.1Å; A77-L81 PolarHBondContact O-N 3.26Å |
| 78 | A | 78.1 | Confident | 73.9 | Confident | 59 Ų | 59 | 69.2 Ų | 69.2 | 49% | 0.488 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -64.1 | -42.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | A74 G75 L81 S82 | A74-A78 WeakPolarHBondContact O-CB 3.34Å; A74-A78 PolarHBondContact O-N 3.09Å; G75-A78 PolarHBondContact O-N 3.35Å; A78-L81 PolarHBondContact O-N 3.2Å; A78-S82 WeakPolarHBondContact O-CB 3.19Å; A78-S82 PolarHBondContact O-N 3.11Å; A78-S82 PolarHBondContact O-OG 3.24Å |
| 79 | L | 74.9 | Confident | 73 | Confident | 126 Ų | 126 | 70.8 Ų | 70.8 | 66% | 0.66 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -67.2 | -38.1 | 174.6 | -68.5 | 176.4 | 0 | 0 | 0 | 112.3 | G75 G76 S82 A83 | G75-L79 WeakPolarHBondContact O-CG 3.45Å; G75-L79 PolarHBondContact O-N 3.21Å; G76-L79 PolarHBondContact O-N 3.35Å; L79-S82 WeakPolarHBondContact CA-OG 2.81Å; L79-S82 PolarHBondContact O-OG 3.45Å; L79-A83 VanDerWaalsContact O-CB 3.27Å; L79-A83 WeakPolarHBondContact O-CB 3.08Å; L79-A83 PolarHBondContact O-N 2.88Å |
| 80 | G | 72.1 | Confident | 72 | Confident | 43 Ų | 43 | 73.1 Ų | 73.1 | 44% | 0.443 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -65.3 | -43.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | G76 A77 L84 | G76-G80 PolarHBondContact O-N 3.24Å; A77-G80 PolarHBondContact O-N 3.26Å; G80-L84 WeakPolarHBondContact O-CB 3.11Å; G80-L84 PolarHBondContact O-N 2.86Å |
| 81 | L | 69.9 | Low | 70.7 | Confident | 110 Ų | 110 | 72.6 Ų | 72.6 | 58% | 0.576 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -68.3 | -40.4 | 177.3 | -173.5 | 65.3 | 0 | 0 | 0 | 111.7 | A77 A78 L84 C85 | A77-L81 WeakPolarHBondContact O-CB 3.1Å; A77-L81 PolarHBondContact O-N 3.26Å; A78-L81 PolarHBondContact O-N 3.2Å; L81-L84 PolarHBondContact O-N 3.09Å; L81-C85 PolarHBondContact O-N 3.1Å; L81-C85 PolarHBondContact O-SG 3.36Å; L81-C85 VanDerWaalsContact O-SG 3.35Å |
| 82 | S | 71.7 | Confident | 69.4 | Low | 67 Ų | 67 | 68 Ų | 68 | 47% | 0.469 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -66.3 | -40.1 | 177 | 68.8 | 0 | 0 | 0 | 0 | 111.8 | A78 L79 L84 C85 Y86 | A78-S82 WeakPolarHBondContact O-CB 3.19Å; A78-S82 PolarHBondContact O-N 3.11Å; A78-S82 PolarHBondContact O-OG 3.24Å; L79-S82 WeakPolarHBondContact CA-OG 2.81Å; L79-S82 PolarHBondContact O-OG 3.45Å; S82-L84 VanDerWaalsContact C-N 3.34Å; S82-C85 PolarHBondContact O-N 3.25Å; S82-Y86 WeakPolarHBondContact O-CB 3.35Å; S82-Y86 PolarHBondContact O-N 3.46Å |
| 83 | A | 68.1 | Low | 67.9 | Low | 36 Ų | 36 | 71.6 Ų | 71.6 | 30% | 0.298 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -60.9 | -44 | 172 | 0 | 0 | 0 | 0 | 0 | 111 | L79 C85 Y86 Y87 | L79-A83 VanDerWaalsContact O-CB 3.27Å; L79-A83 WeakPolarHBondContact O-CB 3.08Å; L79-A83 PolarHBondContact O-N 2.88Å; A83-C85 PolarHBondContact O-N 2.89Å; A83-Y86 WeakPolarHBondContact O-CB 3.03Å; A83-Y86 PolarHBondContact O-N 2.96Å; A83-Y86 VanDerWaalsContact O-N 3.12Å; A83-Y87 HydrophobicContact CB-CD2 4.37Å; A83-Y87 HydrophobicContact CB-CE2 4.44Å; A83-Y87 WeakPolarHBondContact O-CD2 3.37Å; A83-Y87 PolarHBondContact O-N 3.42Å |
| 84 | L | 63.6 | Low | 66.6 | Low | 44 Ų | 44 | 75.6 Ų | 75.6 | 23% | 0.23 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -61.7 | -44.3 | 177.1 | -177.6 | 65.2 | 0 | 0 | 0 | 112.7 | G80 L81 S82 Y86 G88 A254 M257 C258 | G80-L84 WeakPolarHBondContact O-CB 3.11Å; G80-L84 PolarHBondContact O-N 2.86Å; L81-L84 PolarHBondContact O-N 3.09Å; S82-L84 VanDerWaalsContact C-N 3.34Å; L84-Y86 VanDerWaalsContact C-N 3.27Å; L84-Y86 PolarHBondContact O-N 2.84Å; L84-G88 WeakPolarHBondContact O-CA 3.3Å; L84-G88 PolarHBondContact O-N 3.32Å; L84-A254 HydrophobicContact CD1-CB 4.18Å; L84-A254 HydrophobicContact CD2-CB 3.53Å; L84-M257 HydrophobicContact CD1-CB 4.34Å; L84-C258 VanDerWaalsContact CA-SG 3.59Å; L84-C258 VanDerWaalsContact CD1-SG 3.53Å |
| 85 | C | 69.8 | Low | 65 | Low | 72 Ų | 72 | 75.8 Ų | 75.8 | 49% | 0.486 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.7 | -38.2 | 174.1 | -67.8 | 0 | 0 | 0 | 0 | 111.3 | L81 S82 A83 L89 | L81-C85 PolarHBondContact O-N 3.1Å; L81-C85 PolarHBondContact O-SG 3.36Å; L81-C85 VanDerWaalsContact O-SG 3.35Å; S82-C85 PolarHBondContact O-N 3.25Å; A83-C85 PolarHBondContact O-N 2.89Å; C85-L89 WeakPolarHBondContact O-CB 3.4Å; C85-L89 WeakPolarHBondContact O-CD1 3.47Å; C85-L89 WeakPolarHBondContact O-CG 3.47Å; C85-L89 PolarHBondContact O-N 2.99Å; C85-L89 VanDerWaalsContact O-N 3.15Å |
| 86 | Y | 66.8 | Low | 63.6 | Low | 127 Ų | 127 | 75.5 Ų | 75.5 | 50% | 0.498 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -67.4 | -50.6 | 179.1 | -171.6 | -92.1 | 0 | 0 | 0 | 112.8 | S82 A83 L84 L91 | S82-Y86 WeakPolarHBondContact O-CB 3.35Å; S82-Y86 PolarHBondContact O-N 3.46Å; A83-Y86 WeakPolarHBondContact O-CB 3.03Å; A83-Y86 PolarHBondContact O-N 2.96Å; A83-Y86 VanDerWaalsContact O-N 3.12Å; L84-Y86 VanDerWaalsContact C-N 3.27Å; L84-Y86 PolarHBondContact O-N 2.84Å; Y86-L91 HydrophobicContact CD2-CB 4.49Å; Y86-L91 HydrophobicContact CD2-CD1 4.28Å; Y86-L91 HydrophobicContact CE1-CB 4.4Å; Y86-L91 HydrophobicContact CE2-CB 4.19Å; Y86-L91 HydrophobicContact CE2-CD1 4.42Å |
| 87 | Y | 61.8 | Low | 62.4 | Low | 97 Ų | 97 | 75.5 Ų | 75.5 | 38% | 0.38 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -71.9 | -37.5 | 178.6 | -74.1 | -72.8 | 0 | 0 | 0 | 112.2 | A83 L89 G90 S92 | A83-Y87 HydrophobicContact CB-CD2 4.37Å; A83-Y87 HydrophobicContact CB-CE2 4.44Å; A83-Y87 WeakPolarHBondContact O-CD2 3.37Å; A83-Y87 PolarHBondContact O-N 3.42Å; Y87-L89 VanDerWaalsContact C-N 3.3Å; Y87-L89 PolarHBondContact O-N 3.07Å; Y87-G90 PolarHBondContact O-N 3.38Å; Y87-S92 WeakPolarHBondContact CD1-OG 3.2Å |
| 88 | G | 60.8 | Low | 61.5 | Low | 45 Ų | 45 | 76.8 Ų | 76.8 | 46% | 0.464 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -67.3 | -28.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | L84 G90 | L84-G88 WeakPolarHBondContact O-CA 3.3Å; L84-G88 PolarHBondContact O-N 3.32Å; G88-G90 PolarHBondContact O-N 3.37Å |
| 89 | L | 60.9 | Low | 60.3 | Low | 131 Ų | 131 | 79.7 Ų | 79.7 | 69% | 0.686 | 48% | 0.481 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.8 | -0 | 171.8 | -74 | 173.4 | 0 | 0 | 0 | 113.5 | C85 Y87 L91 | C85-L89 WeakPolarHBondContact O-CB 3.4Å; C85-L89 WeakPolarHBondContact O-CD1 3.47Å; C85-L89 WeakPolarHBondContact O-CG 3.47Å; C85-L89 PolarHBondContact O-N 2.99Å; C85-L89 VanDerWaalsContact O-N 3.15Å; Y87-L89 VanDerWaalsContact C-N 3.3Å; Y87-L89 PolarHBondContact O-N 3.07Å; L89-L91 HydrophobicContact CB-CD1 3.81Å; L89-L91 HydrophobicContact CB-CG 4.09Å; L89-L91 HydrophobicContact CD1-CD1 3.99Å; L89-L91 PolarHBondContact O-N 3.47Å |
| 90 | G | 55.8 | Low | 59.7 | Low | 56 Ų | 56 | 76.8 Ų | 76.8 | 58% | 0.577 | 46% | 0.464 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.8 | 18.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y87 G88 S92 | Y87-G90 PolarHBondContact O-N 3.38Å; G88-G90 PolarHBondContact O-N 3.37Å; G90-S92 PolarHBondContact O-N 3.36Å |
| 91 | L | 55.2 | Low | 59.2 | Low | 106 Ų | 106 | 76 Ų | 76 | 56% | 0.555 | 45% | 0.454 | S | S | * | . | trans | -70.4 | -9.1 | 177.5 | -74.2 | 158.3 | 0 | 0 | 0 | 112.5 | Y86 L89 | Y86-L91 HydrophobicContact CD2-CB 4.49Å; Y86-L91 HydrophobicContact CD2-CD1 4.28Å; Y86-L91 HydrophobicContact CE1-CB 4.4Å; Y86-L91 HydrophobicContact CE2-CB 4.19Å; Y86-L91 HydrophobicContact CE2-CD1 4.42Å; L89-L91 HydrophobicContact CB-CD1 3.81Å; L89-L91 HydrophobicContact CB-CG 4.09Å; L89-L91 HydrophobicContact CD1-CD1 3.99Å; L89-L91 PolarHBondContact O-N 3.47Å | ||
| 92 | S | 52.8 | Low | 58.8 | Low | 28 Ų | 28 | 74.3 Ų | 74.3 | 20% | 0.196 | 46% | 0.455 | C | S | . | . | S | Bend | trans | -97.2 | 139.8 | 173.2 | 60.3 | 0 | 0 | 0 | 0 | 111.6 | Y87 G90 E94 | Y87-S92 WeakPolarHBondContact CD1-OG 3.2Å; G90-S92 PolarHBondContact O-N 3.36Å; S92-E94 PolarHBondContact O-N 2.86Å |
| 93 | S | 50.4 | Low | 58.8 | Low | 131 Ų | 131 | 77.8 Ų | 77.8 | 92% | 0.916 | 47% | 0.468 | S | S | * | . | S | Bend | trans | -75.6 | 0.2 | 171.9 | 62.7 | 0 | 0 | 0 | 0 | 114.4 | ||
| 94 | E | 52.4 | Low | 59.1 | Low | 122 Ų | 122 | 77.9 Ų | 77.9 | 57% | 0.57 | 46% | 0.46 | S | S | * | . | S | Bend | trans | -86.3 | 124.5 | 174.2 | -71.3 | -167.4 | -170.7 | 0 | 0 | 109.4 | S92 G96 | S92-E94 PolarHBondContact O-N 2.86Å; E94-G96 PolarHBondContact O-N 3.02Å; E94-G96 VanDerWaalsContact O-N 3.09Å |
| 95 | A | 48.2 | Very low | 59.9 | Low | 63 Ų | 63 | 78.5 Ų | 78.5 | 52% | 0.521 | 47% | 0.467 | S | S | . | . | trans | -52.1 | 115.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | E99 | A95-E99 WeakPolarHBondContact CA-OE2 3.38Å; A95-E99 HydrophobicContact CB-CB 4.19Å; A95-E99 VanDerWaalsContact CB-OE2 3.27Å; A95-E99 WeakPolarHBondContact CB-OE2 3.44Å | ||
| 96 | G | 50.1 | Low | 60.5 | Low | 27 Ų | 27 | 81.1 Ų | 81.1 | 28% | 0.278 | 47% | 0.472 | S | S | . | . | trans | -56.1 | 150.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | E94 I98 E99 H100 | E94-G96 PolarHBondContact O-N 3.02Å; E94-G96 VanDerWaalsContact O-N 3.09Å; G96-I98 PolarHBondContact O-N 3.17Å; G96-E99 PolarHBondContact O-N 3.39Å; G96-H100 PolarHBondContact O-N 2.95Å | ||
| 97 | A | 52.8 | Low | 61.3 | Low | 34 Ų | 34 | 78.9 Ų | 78.9 | 28% | 0.281 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -55 | -20.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | A101 A256 | A97-A101 WeakPolarHBondContact O-CB 3.41Å; A97-A101 PolarHBondContact O-N 2.99Å; A97-A256 WeakPolarHBondContact CB-O 3.28Å |
| 98 | I | 54.6 | Low | 62.4 | Low | 88 Ų | 88 | 74.3 Ų | 74.3 | 45% | 0.451 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64.1 | -43.7 | 171.4 | -71.6 | -172.4 | 0 | 0 | 0 | 112.4 | G96 H100 A101 A102 M257 | G96-I98 PolarHBondContact O-N 3.17Å; I98-H100 VanDerWaalsContact C-N 3.32Å; I98-A101 PolarHBondContact O-N 2.89Å; I98-A102 PolarHBondContact O-N 3.48Å; I98-M257 HydrophobicContact CB-SD 4.02Å; I98-M257 HydrophobicContact CD1-CE 3.97Å; I98-M257 HydrophobicContact CD1-CG 3.9Å; I98-M257 HydrophobicContact CD1-SD 3.1Å; I98-M257 WeakPolarHBondContact CD1-SD 3.42Å; I98-M257 HydrophobicContact CG1-CG 4.23Å; I98-M257 HydrophobicContact CG1-SD 3.35Å; I98-M257 WeakPolarHBondContact CG1-SD 3.39Å |
| 99 | E | 54.3 | Low | 63.4 | Low | 120 Ų | 120 | 76 Ų | 76 | 56% | 0.561 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -65.7 | -40.7 | 178.1 | -67.3 | -179.8 | 176.4 | 0 | 0 | 110.3 | A95 G96 A102 L103 | A95-E99 WeakPolarHBondContact CA-OE2 3.38Å; A95-E99 HydrophobicContact CB-CB 4.19Å; A95-E99 VanDerWaalsContact CB-OE2 3.27Å; A95-E99 WeakPolarHBondContact CB-OE2 3.44Å; G96-E99 PolarHBondContact O-N 3.39Å; E99-A102 WeakPolarHBondContact O-CB 3.18Å; E99-A102 PolarHBondContact O-N 2.89Å; E99-L103 PolarHBondContact O-N 3.35Å |
| 100 | H | 61.4 | Low | 64.5 | Low | 65 Ų | 65 | 74 Ų | 74 | 30% | 0.301 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -66.2 | -38.7 | 174.4 | -166.6 | 66.1 | 0 | 0 | 0 | 112.2 | G96 I98 A102 L103 W104 E326 | G96-H100 PolarHBondContact O-N 2.95Å; I98-H100 VanDerWaalsContact C-N 3.32Å; H100-A102 VanDerWaalsContact C-N 3.33Å; H100-A102 PolarHBondContact O-N 3.3Å; H100-L103 WeakPolarHBondContact O-CB 3.14Å; H100-L103 PolarHBondContact O-N 3.48Å; H100-L103 VanDerWaalsContact O-N 3.1Å; H100-W104 AromaticContact CD2-CD1 3.97Å; H100-W104 AromaticContact CD2-CE2 3.96Å; H100-W104 AromaticContact CD2-NE1 3.16Å; H100-W104 PolarHBondContact CD2-NE1 3.45Å; H100-W104 AromaticContact NE2-NE1 3.39Å; H100-W104 PolarHBondContact NE2-NE1 3.21Å; H100-W104 VanDerWaalsContact O-CD1 3.29Å; H100-W104 PolarHBondContact O-N 2.85Å; H100-E326 IonicContact CD2-OE1 3.52Å; H100-E326 IonicContact CE1-OE1 3.95Å; H100-E326 IonicContact NE2-OE1 2.83Å; H100-E326 PolarHBondContact NE2-OE1 3.43Å |
| 101 | A | 60.8 | Low | 65.9 | Low | 28 Ų | 28 | 72.7 Ų | 72.7 | 23% | 0.231 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -68.1 | -31.3 | 177 | 0 | 0 | 0 | 0 | 0 | 113.2 | A97 I98 L103 W104 R109 | A97-A101 WeakPolarHBondContact O-CB 3.41Å; A97-A101 PolarHBondContact O-N 2.99Å; I98-A101 PolarHBondContact O-N 2.89Å; A101-L103 PolarHBondContact O-N 2.87Å; A101-W104 HydrophobicContact CB-CD2 4.02Å; A101-W104 HydrophobicContact CB-CE3 3.77Å; A101-W104 HydrophobicContact CB-CH2 3.99Å; A101-W104 HydrophobicContact CB-CZ2 4.22Å; A101-W104 HydrophobicContact CB-CZ3 3.77Å; A101-W104 WeakPolarHBondContact O-CB 3.34Å; A101-W104 PolarHBondContact O-N 3.44Å; A101-R109 PolarHBondContact O-NE 3.45Å; A101-R109 PolarHBondContact O-NH2 3.46Å |
| 102 | A | 61.7 | Low | 67.3 | Low | 73 Ų | 73 | 68.4 Ų | 68.4 | 60% | 0.603 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -63.5 | -31.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | I98 E99 H100 R109 | I98-A102 PolarHBondContact O-N 3.48Å; E99-A102 WeakPolarHBondContact O-CB 3.18Å; E99-A102 PolarHBondContact O-N 2.89Å; H100-A102 VanDerWaalsContact C-N 3.33Å; H100-A102 PolarHBondContact O-N 3.3Å; A102-R109 PolarHBondContact O-NH2 2.89Å |
| 103 | L | 72 | Confident | 68.7 | Low | 141 Ų | 141 | 72.3 Ų | 72.3 | 74% | 0.738 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.1 | -7.7 | 177 | -66.1 | 162.2 | 0 | 0 | 0 | 113.8 | E99 H100 A101 | E99-L103 PolarHBondContact O-N 3.35Å; H100-L103 WeakPolarHBondContact O-CB 3.14Å; H100-L103 PolarHBondContact O-N 3.48Å; H100-L103 VanDerWaalsContact O-N 3.1Å; A101-L103 PolarHBondContact O-N 2.87Å |
| 104 | W | 74.7 | Confident | 70.4 | Confident | 38 Ų | 38 | 72 Ų | 72 | 14% | 0.144 | 38% | 0.377 | C | S | . | . | trans | -62.3 | 134 | -176.6 | -75.9 | -16.6 | 0 | 0 | 0 | 113.5 | H100 A101 V108 R109 I322 E326 | H100-W104 AromaticContact CD2-CD1 3.97Å; H100-W104 AromaticContact CD2-CE2 3.96Å; H100-W104 AromaticContact CD2-NE1 3.16Å; H100-W104 PolarHBondContact CD2-NE1 3.45Å; H100-W104 AromaticContact NE2-NE1 3.39Å; H100-W104 PolarHBondContact NE2-NE1 3.21Å; H100-W104 VanDerWaalsContact O-CD1 3.29Å; H100-W104 PolarHBondContact O-N 2.85Å; A101-W104 HydrophobicContact CB-CD2 4.02Å; A101-W104 HydrophobicContact CB-CE3 3.77Å; A101-W104 HydrophobicContact CB-CH2 3.99Å; A101-W104 HydrophobicContact CB-CZ2 4.22Å; A101-W104 HydrophobicContact CB-CZ3 3.77Å; A101-W104 WeakPolarHBondContact O-CB 3.34Å; A101-W104 PolarHBondContact O-N 3.44Å; W104-V108 HydrophobicContact CB-CB 4.4Å; W104-V108 HydrophobicContact CD2-CG1 4.19Å; W104-V108 HydrophobicContact CG-CG1 4.17Å; W104-R109 HydrophobicContact CB-CG 3.97Å; W104-R109 HydrophobicContact CE3-CG 4.36Å; W104-R109 PolarHBondContact O-NE 3.46Å; W104-R109 PolarHBondContact O-NH1 3.46Å; W104-R109 VanDerWaalsContact O-NH1 3.08Å; W104-R109 PolarHBondContact O-NH2 2.85Å; W104-I322 HydrophobicContact CH2-CD1 3.9Å; W104-I322 HydrophobicContact CH2-CG1 4Å; W104-I322 HydrophobicContact CH2-CG2 3.97Å; W104-I322 HydrophobicContact CZ2-CB 4.5Å; W104-I322 HydrophobicContact CZ2-CD1 4.25Å; W104-I322 HydrophobicContact CZ2-CG1 4.31Å; W104-I322 HydrophobicContact CZ2-CG2 3.4Å; W104-I322 VanDerWaalsContact CZ2-CG2 3.4Å; W104-E326 PolarHBondContact NE1-OE1 3.2Å | ||
| 105 | P | 80.8 | Confident | 72 | Confident | 57 Ų | 57 | 66.3 Ų | 66.3 | 37% | 0.37 | 35% | 0.351 | S | S | . | . | trans | -58.5 | 150.8 | 166.7 | -24.2 | 34.2 | 0 | 0 | 0 | 112 | Y107 V108 R109 | P105-Y107 VanDerWaalsContact C-N 3.25Å; P105-Y107 HydrophobicContact CB-CD1 3.47Å; P105-Y107 VanDerWaalsContact CB-CD1 3.47Å; P105-Y107 HydrophobicContact CB-CE1 3.16Å; P105-Y107 HydrophobicContact CB-CG 4.39Å; P105-Y107 HydrophobicContact CG-CD1 4.46Å; P105-Y107 HydrophobicContact CG-CE1 3.7Å; P105-Y107 PolarHBondContact O-N 3.42Å; P105-V108 HydrophobicContact CB-CG2 4.31Å; P105-V108 HydrophobicContact CG-CG2 4.31Å; P105-V108 PolarHBondContact O-N 3.09Å; P105-R109 PolarHBondContact O-N 3.39Å | ||
| 106 | Q | 83.2 | Confident | 73.7 | Confident | 127 Ų | 127 | 67.2 Ų | 67.2 | 59% | 0.593 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -56.7 | -38.4 | -178.1 | -62.8 | -62.2 | -6.9 | 0 | 0 | 112.7 | V108 R109 D110 | Q106-V108 VanDerWaalsContact C-N 3.29Å; Q106-V108 PolarHBondContact O-N 3.31Å; Q106-R109 VanDerWaalsContact CD-NH1 3.25Å; Q106-R109 PolarHBondContact O-N 3.5Å; Q106-D110 PolarHBondContact O-N 3.3Å |
| 107 | Y | 83.3 | Confident | 75.4 | Confident | 80 Ų | 80 | 71 Ų | 71 | 31% | 0.314 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -63.7 | -31 | 179 | 72.3 | -95.2 | 0 | 0 | 0 | 113.4 | P105 R111 Q330 | P105-Y107 VanDerWaalsContact C-N 3.25Å; P105-Y107 HydrophobicContact CB-CD1 3.47Å; P105-Y107 VanDerWaalsContact CB-CD1 3.47Å; P105-Y107 HydrophobicContact CB-CE1 3.16Å; P105-Y107 HydrophobicContact CB-CG 4.39Å; P105-Y107 HydrophobicContact CG-CD1 4.46Å; P105-Y107 HydrophobicContact CG-CE1 3.7Å; P105-Y107 PolarHBondContact O-N 3.42Å; Y107-R111 WeakPolarHBondContact O-CD 3.36Å; Y107-R111 WeakPolarHBondContact O-CG 3.4Å; Y107-R111 PolarHBondContact O-N 3.43Å; Y107-R111 VanDerWaalsContact O-N 3.13Å; Y107-Q330 HydrophobicContact CD2-CG 4.39Å; Y107-Q330 HydrophobicContact CE2-CG 4.45Å |
| 108 | V | 83.7 | Confident | 77 | Confident | 1 Ų | 1 | 71.4 Ų | 71.4 | 1% | 0.006 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -70.6 | -45.7 | 176.1 | 179.5 | 0 | 0 | 0 | 0 | 109.2 | W104 P105 Q106 D110 R111 V112 A325 E326 | W104-V108 HydrophobicContact CB-CB 4.4Å; W104-V108 HydrophobicContact CD2-CG1 4.19Å; W104-V108 HydrophobicContact CG-CG1 4.17Å; P105-V108 HydrophobicContact CB-CG2 4.31Å; P105-V108 HydrophobicContact CG-CG2 4.31Å; P105-V108 PolarHBondContact O-N 3.09Å; Q106-V108 VanDerWaalsContact C-N 3.29Å; Q106-V108 PolarHBondContact O-N 3.31Å; V108-D110 VanDerWaalsContact C-N 3.32Å; V108-D110 PolarHBondContact O-N 2.93Å; V108-R111 PolarHBondContact O-N 2.85Å; V108-V112 HydrophobicContact CG1-CG2 4.4Å; V108-V112 WeakPolarHBondContact O-CG2 3.22Å; V108-V112 PolarHBondContact O-N 3.31Å; V108-A325 HydrophobicContact CG1-CB 4.07Å; V108-E326 HydrophobicContact CG1-CG 3.86Å; V108-E326 HydrophobicContact CG2-CG 4.32Å |
| 109 | R | 81.8 | Confident | 78.6 | Confident | 80 Ų | 80 | 67.6 Ų | 67.6 | 30% | 0.302 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -58.9 | -44.2 | 176.2 | -60.4 | -169.4 | -171.9 | 113.4 | 0.1 | 111.4 | A101 A102 W104 P105 Q106 R111 V112 H113 | A101-R109 PolarHBondContact O-NE 3.45Å; A101-R109 PolarHBondContact O-NH2 3.46Å; A102-R109 PolarHBondContact O-NH2 2.89Å; W104-R109 HydrophobicContact CB-CG 3.97Å; W104-R109 HydrophobicContact CE3-CG 4.36Å; W104-R109 PolarHBondContact O-NE 3.46Å; W104-R109 PolarHBondContact O-NH1 3.46Å; W104-R109 VanDerWaalsContact O-NH1 3.08Å; W104-R109 PolarHBondContact O-NH2 2.85Å; P105-R109 PolarHBondContact O-N 3.39Å; Q106-R109 VanDerWaalsContact CD-NH1 3.25Å; Q106-R109 PolarHBondContact O-N 3.5Å; R109-R111 PolarHBondContact O-N 2.75Å; R109-V112 PolarHBondContact O-N 2.53Å; R109-H113 WeakPolarHBondContact O-CB 3.43Å; R109-H113 PolarHBondContact O-N 2.85Å |
| 110 | D | 84.2 | Confident | 80.1 | Confident | 88 Ų | 88 | 63.1 Ų | 63.1 | 47% | 0.471 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -62.9 | -41 | 178.2 | -72.6 | -26.3 | 0 | 0 | 0 | 112.4 | Q106 V108 R114 | Q106-D110 PolarHBondContact O-N 3.3Å; V108-D110 VanDerWaalsContact C-N 3.32Å; V108-D110 PolarHBondContact O-N 2.93Å; D110-R114 WeakPolarHBondContact O-CB 3.31Å; D110-R114 VanDerWaalsContact O-CG 3.25Å; D110-R114 WeakPolarHBondContact O-CG 3.46Å; D110-R114 PolarHBondContact O-N 3.15Å |
| 111 | R | 85.7 | Confident | 81.3 | Confident | 29 Ų | 29 | 61.3 Ų | 61.3 | 11% | 0.109 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -65.3 | -50.5 | 177 | -74 | 167 | -178.3 | -175.2 | -7.3 | 111.7 | Y107 V108 R109 H113 R114 T115 A325 Y328 P329 Y336 | Y107-R111 WeakPolarHBondContact O-CD 3.36Å; Y107-R111 WeakPolarHBondContact O-CG 3.4Å; Y107-R111 PolarHBondContact O-N 3.43Å; Y107-R111 VanDerWaalsContact O-N 3.13Å; V108-R111 PolarHBondContact O-N 2.85Å; R109-R111 PolarHBondContact O-N 2.75Å; R111-H113 VanDerWaalsContact C-N 3.34Å; R111-H113 PolarHBondContact O-N 3.3Å; R111-R114 PolarHBondContact O-N 3.3Å; R111-T115 PolarHBondContact O-N 3.24Å; R111-T115 PolarHBondContact O-OG1 2.77Å; R111-A325 HydrophobicContact CB-CB 3.99Å; R111-A325 PolarHBondContact NH1-O 2.65Å; R111-Y328 PolarHBondContact NH1-O 3.05Å; R111-Y328 PolarHBondContact NH2-O 3.42Å; R111-P329 PolarHBondContact NH2-O 3.34Å; R111-Y336 HydrophobicContact CB-CD1 3.97Å; R111-Y336 HydrophobicContact CB-CE1 3.75Å; R111-Y336 HydrophobicContact CB-CE2 4.49Å; R111-Y336 HydrophobicContact CB-CG 4.43Å; R111-Y336 HydrophobicContact CG-CD1 3.8Å; R111-Y336 HydrophobicContact CG-CD2 4.44Å; R111-Y336 HydrophobicContact CG-CE1 4.13Å; R111-Y336 HydrophobicContact CG-CG 3.97Å |
| 112 | V | 84.2 | Confident | 82.7 | Confident | 17 Ų | 17 | 60 Ų | 60 | 10% | 0.103 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59.9 | -47.5 | 177.3 | 173.9 | 0 | 0 | 0 | 0 | 109.8 | V108 R109 R114 T115 Y116 A325 | V108-V112 HydrophobicContact CG1-CG2 4.4Å; V108-V112 WeakPolarHBondContact O-CG2 3.22Å; V108-V112 PolarHBondContact O-N 3.31Å; R109-V112 PolarHBondContact O-N 2.53Å; V112-R114 PolarHBondContact O-N 3.25Å; V112-T115 WeakPolarHBondContact O-CB 3.42Å; V112-T115 PolarHBondContact O-N 3.31Å; V112-T115 VanDerWaalsContact O-N 3.13Å; V112-Y116 HydrophobicContact CG1-CD2 3.71Å; V112-Y116 HydrophobicContact CG1-CE2 3.74Å; V112-Y116 VanDerWaalsContact O-CD2 3.3Å; V112-Y116 WeakPolarHBondContact O-CD2 3.3Å; V112-Y116 PolarHBondContact O-N 2.87Å; V112-A325 HydrophobicContact CG2-CB 3.7Å |
| 113 | H | 83.3 | Confident | 84 | Confident | 110 Ų | 110 | 57 Ų | 57 | 51% | 0.509 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -57.5 | -46.3 | 177.9 | -172.9 | 70.8 | 0 | 0 | 0 | 111.9 | R109 R111 T115 Y116 Q117 | R109-H113 WeakPolarHBondContact O-CB 3.43Å; R109-H113 PolarHBondContact O-N 2.85Å; R111-H113 VanDerWaalsContact C-N 3.34Å; R111-H113 PolarHBondContact O-N 3.3Å; H113-T115 PolarHBondContact O-N 2.76Å; H113-Y116 PolarHBondContact O-N 3.28Å; H113-Q117 PolarHBondContact CD2-NE2 2.94Å; H113-Q117 PolarHBondContact NE2-NE2 3.39Å; H113-Q117 VanDerWaalsContact O-CG 3.3Å; H113-Q117 WeakPolarHBondContact O-CG 3.27Å; H113-Q117 PolarHBondContact O-N 3.24Å |
| 114 | R | 84.9 | Confident | 84.8 | Confident | 124 Ų | 124 | 53.5 Ų | 53.5 | 47% | 0.468 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.3 | -39.4 | 175.6 | -75.5 | 178.8 | -175.5 | -179.3 | 2.5 | 112.7 | D110 R111 V112 Q117 Y118 P338 | D110-R114 WeakPolarHBondContact O-CB 3.31Å; D110-R114 VanDerWaalsContact O-CG 3.25Å; D110-R114 WeakPolarHBondContact O-CG 3.46Å; D110-R114 PolarHBondContact O-N 3.15Å; R111-R114 PolarHBondContact O-N 3.3Å; V112-R114 PolarHBondContact O-N 3.25Å; R114-Q117 WeakPolarHBondContact O-CB 3.42Å; R114-Q117 PolarHBondContact O-N 3.05Å; R114-Y118 WeakPolarHBondContact O-CD2 3.2Å; R114-Y118 PolarHBondContact O-N 3.49Å; R114-P338 HydrophobicContact CB-CB 4.16Å; R114-P338 HydrophobicContact CB-CG 4.48Å |
| 115 | T | 86 | Confident | 85.6 | Confident | 2 Ų | 2 | 54.6 Ų | 54.6 | 1% | 0.012 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -60.5 | -45 | 175.2 | -60.1 | 0 | 0 | 0 | 0 | 111.2 | R111 V112 H113 Y118 L119 V321 Y336 A341 Q342 | R111-T115 PolarHBondContact O-N 3.24Å; R111-T115 PolarHBondContact O-OG1 2.77Å; V112-T115 WeakPolarHBondContact O-CB 3.42Å; V112-T115 PolarHBondContact O-N 3.31Å; V112-T115 VanDerWaalsContact O-N 3.13Å; H113-T115 PolarHBondContact O-N 2.76Å; T115-Y118 PolarHBondContact O-N 3.33Å; T115-L119 PolarHBondContact O-N 3.23Å; T115-V321 HydrophobicContact CG2-CG1 3.7Å; T115-V321 HydrophobicContact CG2-CG2 4.28Å; T115-Y336 WeakPolarHBondContact OG1-CE1 3.21Å; T115-Y336 PolarHBondContact OG1-OH 2.77Å; T115-A341 HydrophobicContact CG2-CB 3.78Å; T115-Q342 HydrophobicContact CG2-CB 3.64Å; T115-Q342 HydrophobicContact CG2-CG 4.49Å |
| 116 | Y | 84.7 | Confident | 86 | Confident | 82 Ų | 82 | 52 Ų | 52 | 32% | 0.322 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -71.6 | -29.4 | 175.7 | -81 | -81.6 | 0 | 0 | 0 | 113.7 | V112 H113 L119 G120 T318 | V112-Y116 HydrophobicContact CG1-CD2 3.71Å; V112-Y116 HydrophobicContact CG1-CE2 3.74Å; V112-Y116 VanDerWaalsContact O-CD2 3.3Å; V112-Y116 WeakPolarHBondContact O-CD2 3.3Å; V112-Y116 PolarHBondContact O-N 2.87Å; H113-Y116 PolarHBondContact O-N 3.28Å; Y116-L119 HydrophobicContact CD1-CD2 3.76Å; Y116-L119 HydrophobicContact CE1-CD2 3.93Å; Y116-L119 PolarHBondContact O-N 3.28Å; Y116-G120 PolarHBondContact O-N 3.33Å; Y116-T318 WeakPolarHBondContact OH-CG2 3.15Å |
| 117 | Q | 85.8 | Confident | 86.3 | Confident | 107 Ų | 107 | 47.9 Ų | 47.9 | 50% | 0.5 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -63.2 | -45.9 | 171.8 | -76.8 | 177.4 | -20.9 | 0 | 0 | 111.3 | H113 R114 G120 G121 | H113-Q117 PolarHBondContact CD2-NE2 2.94Å; H113-Q117 PolarHBondContact NE2-NE2 3.39Å; H113-Q117 VanDerWaalsContact O-CG 3.3Å; H113-Q117 WeakPolarHBondContact O-CG 3.27Å; H113-Q117 PolarHBondContact O-N 3.24Å; R114-Q117 WeakPolarHBondContact O-CB 3.42Å; R114-Q117 PolarHBondContact O-N 3.05Å; Q117-G120 PolarHBondContact O-N 2.7Å; Q117-G121 PolarHBondContact O-N 2.72Å |
| 118 | Y | 86.8 | Confident | 86.6 | Confident | 43 Ų | 43 | 46.3 Ų | 46.3 | 17% | 0.169 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -66.9 | -38 | 173.9 | -82.6 | -72.8 | 0 | 0 | 0 | 111.9 | R114 T115 G121 G122 Y186 Q195 W198 P338 I339 | R114-Y118 WeakPolarHBondContact O-CD2 3.2Å; R114-Y118 PolarHBondContact O-N 3.49Å; T115-Y118 PolarHBondContact O-N 3.33Å; Y118-G121 PolarHBondContact O-N 3.41Å; Y118-G122 PolarHBondContact O-N 2.94Å; Y118-Y186 HydrophobicContact CE2-CE2 4.21Å; Y118-Q195 HydrophobicContact CE1-CG 4.3Å; Y118-Q195 PolarHBondContact OH-NE2 3.3Å; Y118-W198 HydrophobicContact CD1-CD2 4.28Å; Y118-W198 HydrophobicContact CD1-CE3 4.32Å; Y118-W198 HydrophobicContact CD1-CH2 4.02Å; Y118-W198 AromaticContact CD1-CZ2 3.96Å; Y118-W198 HydrophobicContact CD1-CZ2 3.96Å; Y118-W198 HydrophobicContact CD1-CZ3 4.2Å; Y118-W198 HydrophobicContact CE1-CE3 4.43Å; Y118-W198 HydrophobicContact CE1-CZ3 4.35Å; Y118-W198 VanDerWaalsContact O-CZ2 3.22Å; Y118-W198 WeakPolarHBondContact O-CZ2 3.26Å; Y118-P338 HydrophobicContact CD2-CB 3.89Å; Y118-P338 HydrophobicContact CD2-CG 3.66Å; Y118-P338 HydrophobicContact CE2-CB 4.39Å; Y118-P338 HydrophobicContact CE2-CG 3.66Å; Y118-I339 HydrophobicContact CD1-CD1 3.98Å; Y118-I339 HydrophobicContact CD1-CG1 3.58Å; Y118-I339 HydrophobicContact CD2-CG1 3.98Å; Y118-I339 HydrophobicContact CE1-CD1 3.67Å; Y118-I339 HydrophobicContact CE1-CG1 3.76Å; Y118-I339 HydrophobicContact CE2-CD1 4.49Å; Y118-I339 HydrophobicContact CE2-CG1 4.12Å; Y118-I339 HydrophobicContact CG-CG1 3.7Å |
| 119 | L | 86.7 | Confident | 86.9 | Confident | 7 Ų | 7 | 47.1 Ų | 47.1 | 4% | 0.037 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -57.2 | -53.1 | 172.2 | -179.7 | 63.8 | 0 | 0 | 0 | 112 | T115 Y116 G122 L123 Q342 I345 Y346 | T115-L119 PolarHBondContact O-N 3.23Å; Y116-L119 HydrophobicContact CD1-CD2 3.76Å; Y116-L119 HydrophobicContact CE1-CD2 3.93Å; Y116-L119 PolarHBondContact O-N 3.28Å; L119-G122 PolarHBondContact O-N 3.19Å; L119-G122 VanDerWaalsContact O-N 3.17Å; L119-L123 WeakPolarHBondContact O-CG 3.02Å; L119-L123 PolarHBondContact O-N 3.45Å; L119-Q342 HydrophobicContact CB-CB 4.02Å; L119-Q342 HydrophobicContact CB-CG 4.49Å; L119-I345 HydrophobicContact CD1-CB 4.39Å; L119-I345 HydrophobicContact CD1-CG2 4.14Å; L119-I345 HydrophobicContact CD2-CB 4.31Å; L119-I345 HydrophobicContact CD2-CG2 3.53Å; L119-Y346 VanDerWaalsContact CD1-CA 3.49Å; L119-Y346 HydrophobicContact CD1-CD2 4.3Å; L119-Y346 HydrophobicContact CD1-CG 4.45Å |
| 120 | G | 85.9 | Confident | 87.2 | Confident | 26 Ų | 26 | 43.9 Ų | 43.9 | 27% | 0.268 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -62.7 | -43.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y116 Q117 G122 L123 V124 | Y116-G120 PolarHBondContact O-N 3.33Å; Q117-G120 PolarHBondContact O-N 2.7Å; G120-G122 VanDerWaalsContact C-N 3.25Å; G120-G122 PolarHBondContact O-N 3.45Å; G120-L123 PolarHBondContact O-N 2.99Å; G120-V124 WeakPolarHBondContact O-CG2 3.47Å; G120-V124 PolarHBondContact O-N 3.2Å; G120-V124 VanDerWaalsContact O-N 3.07Å |
| 121 | G | 87.9 | Confident | 87.4 | Confident | 27 Ų | 27 | 44 Ų | 44 | 28% | 0.278 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -58.8 | -38.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q117 Y118 V124 L125 | Q117-G121 PolarHBondContact O-N 2.72Å; Y118-G121 PolarHBondContact O-N 3.41Å; G121-V124 PolarHBondContact O-N 3.47Å; G121-L125 WeakPolarHBondContact O-CB 3.44Å; G121-L125 VanDerWaalsContact O-CG 3.31Å; G121-L125 WeakPolarHBondContact O-CG 3.47Å; G121-L125 PolarHBondContact O-N 2.97Å |
| 122 | G | 89.1 | Confident | 87.6 | Confident | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -69.6 | -43.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | Y118 L119 G120 V124 L125 T126 W198 | Y118-G122 PolarHBondContact O-N 2.94Å; L119-G122 PolarHBondContact O-N 3.19Å; L119-G122 VanDerWaalsContact O-N 3.17Å; G120-G122 VanDerWaalsContact C-N 3.25Å; G120-G122 PolarHBondContact O-N 3.45Å; G122-V124 VanDerWaalsContact C-N 3.33Å; G122-V124 PolarHBondContact O-N 2.88Å; G122-L125 PolarHBondContact O-N 3.49Å; G122-T126 VanDerWaalsContact O-CB 3.32Å; G122-T126 WeakPolarHBondContact O-CB 3.41Å; G122-T126 PolarHBondContact O-N 3.4Å; G122-T126 PolarHBondContact O-OG1 3.27Å; G122-W198 VanDerWaalsContact CA-CZ2 3.43Å; G122-W198 VanDerWaalsContact N-CZ2 3.26Å |
| 123 | L | 88.4 | Confident | 87.7 | Confident | 10 Ų | 10 | 49.6 Ų | 49.6 | 5% | 0.052 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -61.1 | -40.9 | 174.4 | -65.4 | 172.7 | 0 | 0 | 0 | 112.2 | L119 G120 A127 A234 L236 Y346 T349 I350 | L119-L123 WeakPolarHBondContact O-CG 3.02Å; L119-L123 PolarHBondContact O-N 3.45Å; G120-L123 PolarHBondContact O-N 2.99Å; L123-A127 WeakPolarHBondContact O-CB 3.34Å; L123-A127 PolarHBondContact O-N 2.85Å; L123-A234 HydrophobicContact CD1-CB 3.9Å; L123-L236 HydrophobicContact CB-CD1 3.97Å; L123-Y346 HydrophobicContact CD2-CD2 3.99Å; L123-Y346 HydrophobicContact CD2-CE2 4.07Å; L123-Y346 HydrophobicContact CG-CD2 4.42Å; L123-T349 HydrophobicContact CD1-CG2 3.99Å; L123-T349 HydrophobicContact CD2-CG2 3.65Å; L123-T349 HydrophobicContact CG-CG2 4.48Å; L123-I350 HydrophobicContact CD2-CD1 3.84Å; L123-I350 HydrophobicContact CD2-CG1 4.37Å |
| 124 | V | 89 | Confident | 87.8 | Confident | 68 Ų | 68 | 46 Ų | 46 | 41% | 0.412 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -65.6 | -45.9 | 175.8 | 170.4 | 0 | 0 | 0 | 0 | 111.2 | G120 G121 G122 T126 A127 A128 | G120-V124 WeakPolarHBondContact O-CG2 3.47Å; G120-V124 PolarHBondContact O-N 3.2Å; G120-V124 VanDerWaalsContact O-N 3.07Å; G121-V124 PolarHBondContact O-N 3.47Å; G122-V124 VanDerWaalsContact C-N 3.33Å; G122-V124 PolarHBondContact O-N 2.88Å; V124-T126 VanDerWaalsContact C-N 3.33Å; V124-T126 PolarHBondContact O-N 3.31Å; V124-A127 PolarHBondContact O-N 2.78Å; V124-A128 WeakPolarHBondContact O-CB 3.35Å; V124-A128 PolarHBondContact O-N 3.23Å |
| 125 | L | 91.2 | Very high | 87.9 | Confident | 61 Ų | 61 | 48.9 Ų | 48.9 | 32% | 0.319 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -62.6 | -41.2 | 177.2 | -76.1 | 174.6 | 0 | 0 | 0 | 111.8 | G121 G122 A128 S129 W198 I199 C202 | G121-L125 WeakPolarHBondContact O-CB 3.44Å; G121-L125 VanDerWaalsContact O-CG 3.31Å; G121-L125 WeakPolarHBondContact O-CG 3.47Å; G121-L125 PolarHBondContact O-N 2.97Å; G122-L125 PolarHBondContact O-N 3.49Å; L125-A128 PolarHBondContact O-N 2.82Å; L125-S129 WeakPolarHBondContact O-CB 3.33Å; L125-S129 PolarHBondContact O-N 3.5Å; L125-W198 HydrophobicContact CD1-CE3 4.16Å; L125-W198 HydrophobicContact CD1-CH2 3.44Å; L125-W198 VanDerWaalsContact CD1-CH2 3.44Å; L125-W198 HydrophobicContact CD1-CZ2 4.11Å; L125-W198 HydrophobicContact CD1-CZ3 3.46Å; L125-W198 VanDerWaalsContact CD1-CZ3 3.46Å; L125-I199 HydrophobicContact CD1-CG1 3.88Å; L125-C202 HydrophobicContact CB-CB 4.02Å |
| 126 | T | 90.2 | Very high | 87.8 | Confident | 3 Ų | 3 | 50.3 Ų | 50.3 | 2% | 0.018 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.1 | -45.4 | 176.3 | -64 | 0 | 0 | 0 | 0 | 111 | G122 V124 A128 S129 T130 C202 L205 I209 Y346 I350 | G122-T126 VanDerWaalsContact O-CB 3.32Å; G122-T126 WeakPolarHBondContact O-CB 3.41Å; G122-T126 PolarHBondContact O-N 3.4Å; G122-T126 PolarHBondContact O-OG1 3.27Å; V124-T126 VanDerWaalsContact C-N 3.33Å; V124-T126 PolarHBondContact O-N 3.31Å; T126-A128 PolarHBondContact O-N 3.11Å; T126-S129 PolarHBondContact O-N 3.4Å; T126-T130 WeakPolarHBondContact O-CB 3.41Å; T126-T130 PolarHBondContact O-N 3.08Å; T126-T130 PolarHBondContact O-OG1 3.47Å; T126-C202 WeakPolarHBondContact OG1-CB 3.14Å; T126-C202 PolarHBondContact OG1-O 2.71Å; T126-L205 HydrophobicContact CG2-CB 4.35Å; T126-I209 HydrophobicContact CG2-CD1 3.71Å; T126-Y346 PolarHBondContact OG1-OH 2.93Å; T126-I350 HydrophobicContact CG2-CD1 3.98Å |
| 127 | A | 88.8 | Confident | 87.7 | Confident | 40 Ų | 40 | 50.9 Ų | 50.9 | 33% | 0.331 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -61.6 | -44.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | L123 V124 T130 L131 | L123-A127 WeakPolarHBondContact O-CB 3.34Å; L123-A127 PolarHBondContact O-N 2.85Å; V124-A127 PolarHBondContact O-N 2.78Å; A127-T130 PolarHBondContact O-N 3.04Å; A127-L131 WeakPolarHBondContact O-CG 3.4Å; A127-L131 PolarHBondContact O-N 2.85Å; A127-L131 VanDerWaalsContact O-N 3.08Å |
| 128 | A | 90 | Very high | 87.4 | Confident | 48 Ų | 48 | 49.3 Ų | 49.3 | 40% | 0.397 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -63.1 | -44.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | V124 L125 T126 L131 M132 | V124-A128 WeakPolarHBondContact O-CB 3.35Å; V124-A128 PolarHBondContact O-N 3.23Å; L125-A128 PolarHBondContact O-N 2.82Å; T126-A128 PolarHBondContact O-N 3.11Å; A128-L131 PolarHBondContact O-N 3.3Å; A128-M132 VanDerWaalsContact O-CG 3.29Å; A128-M132 WeakPolarHBondContact O-CG 3.32Å; A128-M132 PolarHBondContact O-N 3.19Å |
| 129 | S | 89.6 | Confident | 87 | Confident | 18 Ų | 18 | 50.1 Ų | 50.1 | 13% | 0.126 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -58.5 | -49.3 | 176.1 | -179.9 | 0 | 0 | 0 | 0 | 111.3 | L125 T126 L131 M132 M133 G203 | L125-S129 WeakPolarHBondContact O-CB 3.33Å; L125-S129 PolarHBondContact O-N 3.5Å; T126-S129 PolarHBondContact O-N 3.4Å; S129-L131 VanDerWaalsContact C-N 3.3Å; S129-L131 PolarHBondContact O-N 2.88Å; S129-M132 PolarHBondContact O-N 3.12Å; S129-M132 VanDerWaalsContact O-N 3.13Å; S129-M133 WeakPolarHBondContact O-CB 3.28Å; S129-M133 VanDerWaalsContact O-CG 3.3Å; S129-M133 WeakPolarHBondContact O-CG 3.22Å; S129-M133 PolarHBondContact O-N 3.16Å; S129-M133 VanDerWaalsContact OG-CE 3.28Å; S129-M133 WeakPolarHBondContact OG-CE 3.12Å; S129-G203 WeakPolarHBondContact OG-CA 3.23Å; S129-G203 PolarHBondContact OG-O 3.13Å; S129-G203 VanDerWaalsContact OG-O 3.12Å |
| 130 | T | 89.5 | Confident | 86.6 | Confident | 12 Ų | 12 | 50.4 Ų | 50.4 | 7% | 0.074 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -54.2 | -45.6 | 175.2 | -67.3 | 0 | 0 | 0 | 0 | 111.6 | T126 A127 M133 A134 G206 I209 T213 | T126-T130 WeakPolarHBondContact O-CB 3.41Å; T126-T130 PolarHBondContact O-N 3.08Å; T126-T130 PolarHBondContact O-OG1 3.47Å; A127-T130 PolarHBondContact O-N 3.04Å; T130-M133 PolarHBondContact O-N 3.44Å; T130-A134 WeakPolarHBondContact O-CB 3.41Å; T130-A134 PolarHBondContact O-N 3.09Å; T130-G206 WeakPolarHBondContact CA-O 2.89Å; T130-G206 VanDerWaalsContact OG1-CA 3.25Å; T130-G206 WeakPolarHBondContact OG1-CA 3.38Å; T130-G206 PolarHBondContact OG1-O 2.79Å; T130-I209 HydrophobicContact CG2-CB 4.48Å; T130-I209 HydrophobicContact CG2-CG2 3.93Å; T130-T213 HydrophobicContact CG2-CG2 3.6Å |
| 131 | L | 88.4 | Confident | 86.2 | Confident | 91 Ų | 91 | 52.8 Ų | 52.8 | 48% | 0.476 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -66.4 | -38.8 | 178.7 | -69.3 | 175.8 | 0 | 0 | 0 | 112.9 | A127 A128 S129 R135 | A127-L131 WeakPolarHBondContact O-CG 3.4Å; A127-L131 PolarHBondContact O-N 2.85Å; A127-L131 VanDerWaalsContact O-N 3.08Å; A128-L131 PolarHBondContact O-N 3.3Å; S129-L131 VanDerWaalsContact C-N 3.3Å; S129-L131 PolarHBondContact O-N 2.88Å; L131-R135 WeakPolarHBondContact O-CG 3.34Å; L131-R135 PolarHBondContact O-N 3.5Å |
| 132 | M | 88.9 | Confident | 85.4 | Confident | 129 Ų | 129 | 57.5 Ų | 57.5 | 64% | 0.635 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -68.5 | -43 | 178 | -66.7 | -64.9 | -96.4 | 0 | 0 | 111.1 | A128 S129 R135 S136 | A128-M132 VanDerWaalsContact O-CG 3.29Å; A128-M132 WeakPolarHBondContact O-CG 3.32Å; A128-M132 PolarHBondContact O-N 3.19Å; S129-M132 PolarHBondContact O-N 3.12Å; S129-M132 VanDerWaalsContact O-N 3.13Å; M132-R135 PolarHBondContact O-N 3.47Å; M132-S136 PolarHBondContact O-N 3.46Å |
| 133 | M | 86.4 | Confident | 84.5 | Confident | 33 Ų | 33 | 59.5 Ų | 59.5 | 16% | 0.163 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -70.7 | -37.1 | 178.9 | -66.2 | -176.3 | -178 | 0 | 0 | 112.3 | S129 T130 R135 S136 I139 G203 A207 A210 | S129-M133 WeakPolarHBondContact O-CB 3.28Å; S129-M133 VanDerWaalsContact O-CG 3.3Å; S129-M133 WeakPolarHBondContact O-CG 3.22Å; S129-M133 PolarHBondContact O-N 3.16Å; S129-M133 VanDerWaalsContact OG-CE 3.28Å; S129-M133 WeakPolarHBondContact OG-CE 3.12Å; T130-M133 PolarHBondContact O-N 3.44Å; M133-R135 PolarHBondContact O-N 3.25Å; M133-S136 PolarHBondContact O-N 3.46Å; M133-S136 PolarHBondContact O-OG 3.36Å; M133-I139 HydrophobicContact CB-CG2 4.08Å; M133-I139 HydrophobicContact CG-CD1 3.87Å; M133-I139 HydrophobicContact CG-CG2 4.04Å; M133-I139 HydrophobicContact SD-CG2 4.08Å; M133-G203 WeakPolarHBondContact CE-O 3.45Å; M133-A207 HydrophobicContact CE-CB 4.04Å; M133-A207 WeakPolarHBondContact SD-CA 3.32Å; M133-A207 HydrophobicContact SD-CB 3.25Å; M133-A207 WeakPolarHBondContact SD-CB 3.47Å; M133-A207 PolarHBondContact SD-N 2.9Å; M133-A207 VanDerWaalsContact SD-N 3.39Å; M133-A210 HydrophobicContact CB-CB 4.1Å |
| 134 | A | 85.8 | Confident | 83.6 | Confident | 34 Ų | 34 | 61.7 Ų | 61.7 | 28% | 0.281 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62 | -28.4 | 174 | 0 | 0 | 0 | 0 | 0 | 113.1 | T130 M140 T213 | T130-A134 WeakPolarHBondContact O-CB 3.41Å; T130-A134 PolarHBondContact O-N 3.09Å; A134-M140 HydrophobicContact CB-CE 4.24Å; A134-T213 HydrophobicContact CB-CG2 3.84Å; A134-T213 WeakPolarHBondContact CB-OG1 3.36Å |
| 135 | R | 86 | Confident | 82.3 | Confident | 186 Ų | 186 | 65.4 Ų | 65.4 | 70% | 0.702 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -83.3 | -20.5 | 174.6 | -71 | 174.3 | 179.8 | 146.1 | -0.6 | 113.3 | L131 M132 M133 P137 | L131-R135 WeakPolarHBondContact O-CG 3.34Å; L131-R135 PolarHBondContact O-N 3.5Å; M132-R135 PolarHBondContact O-N 3.47Å; M133-R135 PolarHBondContact O-N 3.25Å; R135-P137 WeakPolarHBondContact O-CD 3.15Å |
| 136 | S | 84.7 | Confident | 80.5 | Confident | 31 Ų | 31 | 68.9 Ų | 68.9 | 22% | 0.217 | 38% | 0.378 | C | S | . | . | trans | -91.4 | 113 | -178.2 | 82.3 | 0 | 0 | 0 | 0 | 110.7 | M132 M133 A138 I139 M140 | M132-S136 PolarHBondContact O-N 3.46Å; M133-S136 PolarHBondContact O-N 3.46Å; M133-S136 PolarHBondContact O-OG 3.36Å; S136-A138 PolarHBondContact O-N 2.89Å; S136-I139 PolarHBondContact O-N 3.43Å; S136-I139 WeakPolarHBondContact OG-CB 3.39Å; S136-I139 WeakPolarHBondContact OG-CD1 3.36Å; S136-I139 WeakPolarHBondContact OG-CG1 3.49Å; S136-M140 WeakPolarHBondContact O-CB 3.41Å; S136-M140 PolarHBondContact O-N 3.46Å | ||
| 137 | P | 81.5 | Confident | 78.6 | Confident | 95 Ų | 95 | 72 Ų | 72 | 62% | 0.617 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -66 | -27.6 | 179.9 | 25.5 | -33.6 | 0 | 0 | 0 | 111.9 | R135 N141 | R135-P137 WeakPolarHBondContact O-CD 3.15Å; P137-N141 WeakPolarHBondContact O-CB 3.29Å; P137-N141 PolarHBondContact O-N 3.21Å; P137-N141 PolarHBondContact O-ND2 3.33Å; P137-N141 VanDerWaalsContact O-ND2 3.08Å |
| 138 | A | 81.2 | Confident | 76.2 | Confident | 73 Ų | 73 | 77.7 Ų | 77.7 | 60% | 0.603 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -64 | -48.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | S136 L142 | S136-A138 PolarHBondContact O-N 2.89Å; A138-L142 PolarHBondContact O-N 3.12Å |
| 139 | I | 77.7 | Confident | 74 | Confident | 61 Ų | 61 | 82.1 Ų | 82.1 | 31% | 0.313 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -74 | -41 | 179 | -55.8 | 174.6 | 0 | 0 | 0 | 110 | M133 S136 N141 L142 V143 | M133-I139 HydrophobicContact CB-CG2 4.08Å; M133-I139 HydrophobicContact CG-CD1 3.87Å; M133-I139 HydrophobicContact CG-CG2 4.04Å; M133-I139 HydrophobicContact SD-CG2 4.08Å; S136-I139 PolarHBondContact O-N 3.43Å; S136-I139 WeakPolarHBondContact OG-CB 3.39Å; S136-I139 WeakPolarHBondContact OG-CD1 3.36Å; S136-I139 WeakPolarHBondContact OG-CG1 3.49Å; I139-N141 VanDerWaalsContact C-N 3.3Å; I139-N141 PolarHBondContact O-N 3.14Å; I139-L142 WeakPolarHBondContact O-CA 3.46Å; I139-L142 WeakPolarHBondContact O-CB 3.41Å; I139-L142 PolarHBondContact O-N 2.98Å; I139-V143 HydrophobicContact CG2-CG2 3.98Å; I139-V143 WeakPolarHBondContact O-CG2 3.37Å; I139-V143 PolarHBondContact O-N 3.4Å |
| 140 | M | 79 | Confident | 71.8 | Confident | 13 Ų | 13 | 85.4 Ų | 85.4 | 6% | 0.064 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -59.1 | -46.4 | 176.3 | -171.5 | 56.9 | 66.1 | 0 | 0 | 110.3 | A134 S136 L142 V143 T144 A210 P211 F214 | A134-M140 HydrophobicContact CB-CE 4.24Å; S136-M140 WeakPolarHBondContact O-CB 3.41Å; S136-M140 PolarHBondContact O-N 3.46Å; M140-L142 VanDerWaalsContact C-N 3.32Å; M140-L142 PolarHBondContact O-N 3.35Å; M140-V143 PolarHBondContact O-N 2.9Å; M140-T144 HydrophobicContact CG-CG2 4.02Å; M140-T144 WeakPolarHBondContact O-CB 3.28Å; M140-T144 WeakPolarHBondContact O-CG2 3.42Å; M140-T144 PolarHBondContact O-N 3.37Å; M140-T144 PolarHBondContact O-OG1 2.93Å; M140-T144 HydrophobicContact SD-CG2 3.34Å; M140-T144 WeakPolarHBondContact SD-CG2 3.32Å; M140-A210 HydrophobicContact CE-CB 3.86Å; M140-P211 HydrophobicContact SD-CG 4.49Å; M140-F214 HydrophobicContact CE-CE2 4.23Å; M140-F214 HydrophobicContact CE-CZ 4.26Å; M140-F214 HydrophobicContact CG-CE2 4.04Å; M140-F214 HydrophobicContact CG-CZ 3.74Å; M140-F214 HydrophobicContact SD-CE2 3.51Å; M140-F214 VanDerWaalsContact SD-CE2 3.51Å; M140-F214 HydrophobicContact SD-CZ 3.78Å |
| 141 | N | 77.1 | Confident | 69.6 | Low | 75 Ų | 75 | 90 Ų | 90 | 40% | 0.401 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -57.7 | -43 | 171.7 | -75.7 | -26.8 | 0 | 0 | 0 | 111.4 | P137 I139 V143 R145 | P137-N141 WeakPolarHBondContact O-CB 3.29Å; P137-N141 PolarHBondContact O-N 3.21Å; P137-N141 PolarHBondContact O-ND2 3.33Å; P137-N141 VanDerWaalsContact O-ND2 3.08Å; I139-N141 VanDerWaalsContact C-N 3.3Å; I139-N141 PolarHBondContact O-N 3.14Å; N141-V143 PolarHBondContact O-N 3.05Å; N141-R145 VanDerWaalsContact O-CA 3.31Å; N141-R145 WeakPolarHBondContact O-CA 3.19Å; N141-R145 WeakPolarHBondContact O-CB 3.23Å; N141-R145 WeakPolarHBondContact O-CD 3.34Å; N141-R145 WeakPolarHBondContact O-CG 3.27Å; N141-R145 PolarHBondContact O-N 3.42Å |
| 142 | L | 70.9 | Confident | 67.7 | Low | 127 Ų | 127 | 91.1 Ų | 91.1 | 67% | 0.665 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.7 | -43.6 | 176.7 | -172.7 | 76.5 | 0 | 0 | 0 | 112.7 | A138 I139 M140 | A138-L142 PolarHBondContact O-N 3.12Å; I139-L142 WeakPolarHBondContact O-CA 3.46Å; I139-L142 WeakPolarHBondContact O-CB 3.41Å; I139-L142 PolarHBondContact O-N 2.98Å; M140-L142 VanDerWaalsContact C-N 3.32Å; M140-L142 PolarHBondContact O-N 3.35Å |
| 143 | V | 70.3 | Confident | 65.8 | Low | 42 Ų | 42 | 92.8 Ų | 92.8 | 26% | 0.255 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -77.8 | -35.8 | -175.5 | -179.8 | 0 | 0 | 0 | 0 | 111.7 | I139 M140 N141 A207 P211 | I139-V143 HydrophobicContact CG2-CG2 3.98Å; I139-V143 WeakPolarHBondContact O-CG2 3.37Å; I139-V143 PolarHBondContact O-N 3.4Å; M140-V143 PolarHBondContact O-N 2.9Å; N141-V143 PolarHBondContact O-N 3.05Å; V143-A207 HydrophobicContact CG2-CB 4.34Å; V143-P211 HydrophobicContact CB-CG 4.43Å; V143-P211 HydrophobicContact CG1-CG 3.42Å; V143-P211 VanDerWaalsContact CG1-CG 3.42Å |
| 144 | T | 68.7 | Low | 64.1 | Low | 56 Ų | 56 | 97.4 Ų | 97.4 | 34% | 0.344 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -99.8 | -6.2 | -178.9 | 68.1 | 0 | 0 | 0 | 0 | 114 | M140 N146 P211 F214 | M140-T144 HydrophobicContact CG-CG2 4.02Å; M140-T144 WeakPolarHBondContact O-CB 3.28Å; M140-T144 WeakPolarHBondContact O-CG2 3.42Å; M140-T144 PolarHBondContact O-N 3.37Å; M140-T144 PolarHBondContact O-OG1 2.93Å; M140-T144 HydrophobicContact SD-CG2 3.34Å; M140-T144 WeakPolarHBondContact SD-CG2 3.32Å; T144-N146 PolarHBondContact O-N 3.39Å; T144-P211 HydrophobicContact CG2-CB 4.19Å; T144-P211 HydrophobicContact CG2-CG 4.04Å; T144-F214 HydrophobicContact CG2-CE2 4.07Å |
| 145 | R | 61.6 | Low | 62.4 | Low | 146 Ų | 146 | 99.1 Ų | 99.1 | 55% | 0.551 | 55% | 0.545 | S | S | * | . | trans | -59.8 | 89.5 | 163.1 | -86.7 | 161.4 | -167.7 | -169 | 5.6 | 104.9 | N141 S147 | N141-R145 VanDerWaalsContact O-CA 3.31Å; N141-R145 WeakPolarHBondContact O-CA 3.19Å; N141-R145 WeakPolarHBondContact O-CB 3.23Å; N141-R145 WeakPolarHBondContact O-CD 3.34Å; N141-R145 WeakPolarHBondContact O-CG 3.27Å; N141-R145 PolarHBondContact O-N 3.42Å; R145-S147 PolarHBondContact O-N 2.94Å | ||
| 146 | N | 55.1 | Low | 60.8 | Low | 134 Ų | 134 | 97.7 Ų | 97.7 | 72% | 0.717 | 55% | 0.55 | S | S | * | . | trans | -46.9 | 101.9 | 137.2 | -93.8 | -1.9 | 0 | 0 | 0 | 103.2 | T144 F148 | T144-N146 PolarHBondContact O-N 3.39Å; N146-F148 PolarHBondContact O-N 3.48Å | ||
| 147 | S | 49.2 | Very low | 59.1 | Low | 68 Ų | 68 | 100.9 Ų | 100.9 | 48% | 0.476 | 57% | 0.572 | S | S | . | * | trans | -51.8 | 87.9 | -168.3 | -64.8 | 0 | 0 | 0 | 0 | 110.9 | R145 L149 | R145-S147 PolarHBondContact O-N 2.94Å; S147-L149 PolarHBondContact O-N 3.26Å | ||
| 148 | F | 39.3 | Very low | 57.3 | Low | 159 Ų | 159 | 99.8 Ų | 99.8 | 70% | 0.697 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.3 | 105.8 | 156.9 | -167.2 | -93.1 | 0 | 0 | 0 | 102.9 | N146 T151 | N146-F148 PolarHBondContact O-N 3.48Å; F148-T151 HydrophobicContact CE2-CG2 4.18Å; F148-T151 HydrophobicContact CZ-CG2 4.47Å |
| 149 | L | 43.3 | Very low | 55.8 | Low | 142 Ų | 142 | 105.5 Ų | 105.5 | 74% | 0.743 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 164.4 | 16.5 | 157.3 | -87.1 | -178.2 | 0 | 0 | 0 | 113.9 | S147 | S147-L149 PolarHBondContact O-N 3.26Š|
| 150 | V | 43.7 | Very low | 54.3 | Low | 86 Ų | 86 | 107.2 Ų | 107.2 | 52% | 0.521 | 57% | 0.573 | S | S | . | * | trans | -125.9 | 58.5 | 152.3 | -170.2 | 0 | 0 | 0 | 0 | 108.1 | D152 L158 | V150-D152 HydrophobicContact CG1-CB 3.76Å; V150-D152 PolarHBondContact O-N 3.12Å; V150-L158 HydrophobicContact CG1-CD1 4.25Å | ||
| 151 | T | 43.3 | Very low | 52.7 | Low | 109 Ų | 109 | 111.4 Ų | 111.4 | 67% | 0.669 | 59% | 0.594 | S | S | * | * | trans | -67.3 | 66.6 | 147.5 | 47.9 | 0 | 0 | 0 | 0 | 107.3 | F148 | F148-T151 HydrophobicContact CE2-CG2 4.18Å; F148-T151 HydrophobicContact CZ-CG2 4.47Å | ||
| 152 | D | 48 | Very low | 51.4 | Low | 115 Ų | 115 | 109.8 Ų | 109.8 | 62% | 0.615 | 59% | 0.586 | S | S | * | * | trans | -92.1 | 137.3 | 165.1 | -129.5 | -19.5 | 0 | 0 | 0 | 107.9 | V150 N154 | V150-D152 HydrophobicContact CG1-CB 3.76Å; V150-D152 PolarHBondContact O-N 3.12Å; D152-N154 PolarHBondContact O-N 2.96Å | ||
| 153 | L | 48.5 | Very low | 50.4 | Low | 163 Ų | 163 | 107.5 Ų | 107.5 | 85% | 0.853 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -60.4 | 12.7 | -154.8 | -169.2 | 58.1 | 0 | 0 | 0 | 116.9 | ||
| 154 | N | 50.3 | Low | 49.3 | Very low | 130 Ų | 130 | 106.9 Ų | 106.9 | 70% | 0.695 | 57% | 0.569 | S | S | * | * | trans | -111.5 | 51.6 | -170.3 | -61.8 | -45.9 | 0 | 0 | 0 | 113.7 | D152 I156 | D152-N154 PolarHBondContact O-N 2.96Å; N154-I156 PolarHBondContact O-N 2.95Å | ||
| 155 | G | 51.3 | Low | 48.3 | Very low | 70 Ų | 70 | 109.6 Ų | 109.6 | 72% | 0.722 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 69.4 | -59.9 | 136.8 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||
| 156 | I | 51.8 | Low | 48.1 | Very low | 157 Ų | 157 | 104.7 Ų | 104.7 | 81% | 0.805 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -148.1 | -17.3 | -165.8 | -84.1 | 114.8 | 0 | 0 | 0 | 115 | N154 | N154-I156 PolarHBondContact O-N 2.95Š|
| 157 | S | 49.3 | Very low | 48.3 | Very low | 98 Ų | 98 | 101.5 Ų | 101.5 | 69% | 0.685 | 55% | 0.548 | S | S | * | . | S | Bend | trans | -81.5 | -25.4 | -175.1 | -162.9 | 0 | 0 | 0 | 0 | 114.3 | ||
| 158 | L | 44.5 | Very low | 48.9 | Very low | 72 Ų | 72 | 102.2 Ų | 102.2 | 38% | 0.377 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -93.3 | -17.2 | -170.9 | -92.6 | 148.9 | 0 | 0 | 0 | 115.6 | V150 F160 M161 T162 | V150-L158 HydrophobicContact CG1-CD1 4.25Å; L158-F160 PolarHBondContact O-N 3.23Å; L158-M161 HydrophobicContact CD2-CB 4.3Å; L158-M161 PolarHBondContact O-N 2.97Å; L158-T162 VanDerWaalsContact O-CB 3.29Å; L158-T162 WeakPolarHBondContact O-CB 3.36Å; L158-T162 PolarHBondContact O-N 3.24Å; L158-T162 PolarHBondContact O-OG1 3.23Å |
| 159 | Y | 48.3 | Very low | 50.1 | Low | 193 Ų | 193 | 95.9 Ų | 95.9 | 76% | 0.757 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62 | -38.2 | 176.2 | -117.7 | -86.2 | 0 | 0 | 0 | 111.3 | T162 I163 | Y159-T162 PolarHBondContact O-N 3.43Å; Y159-I163 HydrophobicContact CD1-CD1 4.31Å; Y159-I163 PolarHBondContact O-N 3.5Å |
| 160 | F | 47.1 | Very low | 51.5 | Low | 97 Ų | 97 | 91.5 Ų | 91.5 | 43% | 0.425 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.1 | -45.6 | 177.1 | -167.5 | -104.3 | 0 | 0 | 0 | 112.1 | L158 T162 L164 F287 | L158-F160 PolarHBondContact O-N 3.23Å; F160-T162 PolarHBondContact O-N 3.47Å; F160-L164 HydrophobicContact CE1-CD1 4.34Å; F160-L164 HydrophobicContact CE1-CG 4.21Å; F160-L164 HydrophobicContact CE2-CD2 4.41Å; F160-L164 HydrophobicContact CZ-CD1 4.35Å; F160-L164 HydrophobicContact CZ-CD2 4.32Å; F160-L164 HydrophobicContact CZ-CG 4.23Å; F160-L164 VanDerWaalsContact O-CB 3.3Å; F160-L164 WeakPolarHBondContact O-CB 3.48Å; F160-L164 VanDerWaalsContact O-CG 3.3Å; F160-L164 WeakPolarHBondContact O-CG 3.45Å; F160-L164 PolarHBondContact O-N 2.93Å; F160-F287 HydrophobicContact CD2-CE1 4.11Å; F160-F287 HydrophobicContact CE1-CE1 4.49Å; F160-F287 HydrophobicContact CE1-CZ 4.46Å; F160-F287 AromaticContact CE2-CD1 3.72Å; F160-F287 HydrophobicContact CE2-CD1 3.72Å; F160-F287 AromaticContact CE2-CE1 3.06Å; F160-F287 HydrophobicContact CE2-CE1 3.06Å; F160-F287 HydrophobicContact CE2-CE2 4.35Å; F160-F287 AromaticContact CE2-CZ 3.45Å; F160-F287 HydrophobicContact CE2-CZ 3.45Å; F160-F287 VanDerWaalsContact CE2-CZ 3.45Å; F160-F287 HydrophobicContact CZ-CD1 4.37Å; F160-F287 AromaticContact CZ-CE1 3.32Å; F160-F287 HydrophobicContact CZ-CE1 3.32Å; F160-F287 HydrophobicContact CZ-CE2 4.26Å; F160-F287 AromaticContact CZ-CZ 3.26Å; F160-F287 HydrophobicContact CZ-CZ 3.26Å |
| 161 | M | 44.7 | Very low | 53 | Low | 101 Ų | 101 | 90.6 Ų | 90.6 | 50% | 0.498 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.9 | -34.1 | 175.5 | -85.7 | -95.7 | 96.3 | 0 | 0 | 112.9 | L158 Q165 | L158-M161 HydrophobicContact CD2-CB 4.3Å; L158-M161 PolarHBondContact O-N 2.97Å; M161-Q165 VanDerWaalsContact O-CB 3.31Å; M161-Q165 WeakPolarHBondContact O-CB 3.4Å; M161-Q165 PolarHBondContact O-N 3.33Å |
| 162 | T | 51.3 | Low | 54.6 | Low | 40 Ų | 40 | 88.2 Ų | 88.2 | 25% | 0.245 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -73.5 | -44.3 | -174.2 | -55.2 | 0 | 0 | 0 | 0 | 112.4 | L158 Y159 F160 L164 Q165 | L158-T162 VanDerWaalsContact O-CB 3.29Å; L158-T162 WeakPolarHBondContact O-CB 3.36Å; L158-T162 PolarHBondContact O-N 3.24Å; L158-T162 PolarHBondContact O-OG1 3.23Å; Y159-T162 PolarHBondContact O-N 3.43Å; F160-T162 PolarHBondContact O-N 3.47Å; T162-L164 VanDerWaalsContact C-N 3.33Å; T162-Q165 PolarHBondContact O-N 2.87Å |
| 163 | I | 49.3 | Very low | 56.2 | Low | 79 Ų | 79 | 84.7 Ų | 84.7 | 41% | 0.405 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.1 | -41.1 | 174.7 | -62.6 | 172.5 | 0 | 0 | 0 | 109.6 | Y159 Q165 S166 | Y159-I163 HydrophobicContact CD1-CD1 4.31Å; Y159-I163 PolarHBondContact O-N 3.5Å; I163-Q165 PolarHBondContact O-N 3.34Å; I163-S166 PolarHBondContact O-OG 3.41Å; I163-S166 VanDerWaalsContact O-OG 3.08Å |
| 164 | L | 46.3 | Very low | 58 | Low | 29 Ų | 29 | 78.1 Ų | 78.1 | 15% | 0.152 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -62.9 | -39.4 | 176.2 | -80.6 | -113.8 | 0 | 0 | 0 | 111.7 | F160 T162 S166 I167 L168 L286 | F160-L164 HydrophobicContact CE1-CD1 4.34Å; F160-L164 HydrophobicContact CE1-CG 4.21Å; F160-L164 HydrophobicContact CE2-CD2 4.41Å; F160-L164 HydrophobicContact CZ-CD1 4.35Å; F160-L164 HydrophobicContact CZ-CD2 4.32Å; F160-L164 HydrophobicContact CZ-CG 4.23Å; F160-L164 VanDerWaalsContact O-CB 3.3Å; F160-L164 WeakPolarHBondContact O-CB 3.48Å; F160-L164 VanDerWaalsContact O-CG 3.3Å; F160-L164 WeakPolarHBondContact O-CG 3.45Å; F160-L164 PolarHBondContact O-N 2.93Å; T162-L164 VanDerWaalsContact C-N 3.33Å; L164-S166 PolarHBondContact O-N 3.16Å; L164-I167 PolarHBondContact O-N 3.41Å; L164-L168 HydrophobicContact CB-CD1 3.97Å; L164-L168 HydrophobicContact CB-CG 4.35Å; L164-L168 HydrophobicContact CD1-CD1 3.79Å; L164-L168 HydrophobicContact CD1-CG 4.31Å; L164-L168 WeakPolarHBondContact O-CA 3.16Å; L164-L168 WeakPolarHBondContact O-CB 3.36Å; L164-L168 WeakPolarHBondContact O-CG 3.43Å; L164-L168 PolarHBondContact O-N 3.12Å; L164-L286 HydrophobicContact CD2-CD1 3.8Å |
| 165 | Q | 49 | Very low | 59.8 | Low | 114 Ų | 114 | 76.9 Ų | 76.9 | 53% | 0.533 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -66.1 | -32.9 | -175.1 | -169 | 60.6 | 43.1 | 0 | 0 | 113.6 | M161 T162 I163 G169 | M161-Q165 VanDerWaalsContact O-CB 3.31Å; M161-Q165 WeakPolarHBondContact O-CB 3.4Å; M161-Q165 PolarHBondContact O-N 3.33Å; T162-Q165 PolarHBondContact O-N 2.87Å; I163-Q165 PolarHBondContact O-N 3.34Å; Q165-G169 WeakPolarHBondContact O-CA 2.94Å; Q165-G169 PolarHBondContact O-N 3.35Å |
| 166 | S | 55.8 | Low | 61.5 | Low | 43 Ų | 43 | 74.9 Ų | 74.9 | 30% | 0.301 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -70.5 | -44.7 | 176.9 | 66.6 | 0 | 0 | 0 | 0 | 111.8 | I163 L164 T170 | I163-S166 PolarHBondContact O-OG 3.41Å; I163-S166 VanDerWaalsContact O-OG 3.08Å; L164-S166 PolarHBondContact O-N 3.16Å; S166-T170 WeakPolarHBondContact O-CB 3.4Å; S166-T170 VanDerWaalsContact O-CG2 3.32Å; S166-T170 WeakPolarHBondContact O-CG2 3.2Å; S166-T170 PolarHBondContact O-N 3.06Å; S166-T170 PolarHBondContact O-OG1 3.41Å |
| 167 | I | 61.1 | Low | 63.2 | Low | 67 Ų | 67 | 68.1 Ų | 68.1 | 34% | 0.344 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -73.9 | -48.2 | 179.4 | -62.5 | 174.3 | 0 | 0 | 0 | 110.4 | L164 G169 T170 I171 L286 | L164-I167 PolarHBondContact O-N 3.41Å; I167-G169 VanDerWaalsContact C-N 3.29Å; I167-G169 PolarHBondContact O-N 2.82Å; I167-T170 WeakPolarHBondContact CA-OG1 3.44Å; I167-T170 PolarHBondContact O-N 2.87Å; I167-T170 PolarHBondContact O-OG1 3.44Å; I167-I171 HydrophobicContact CG2-CD1 3.68Å; I167-I171 HydrophobicContact CG2-CG1 4.38Å; I167-I171 WeakPolarHBondContact O-CB 3.45Å; I167-I171 WeakPolarHBondContact O-CG1 3.48Å; I167-I171 PolarHBondContact O-N 3.25Å; I167-L286 HydrophobicContact CD1-CD2 3.54Å |
| 168 | L | 60.6 | Low | 65.1 | Low | 82 Ų | 82 | 63.7 Ų | 63.7 | 43% | 0.429 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -64.7 | -35.5 | 175.1 | -64.7 | -179.3 | 0 | 0 | 0 | 111.5 | L164 I171 A172 | L164-L168 HydrophobicContact CB-CD1 3.97Å; L164-L168 HydrophobicContact CB-CG 4.35Å; L164-L168 HydrophobicContact CD1-CD1 3.79Å; L164-L168 HydrophobicContact CD1-CG 4.31Å; L164-L168 WeakPolarHBondContact O-CA 3.16Å; L164-L168 WeakPolarHBondContact O-CB 3.36Å; L164-L168 WeakPolarHBondContact O-CG 3.43Å; L164-L168 PolarHBondContact O-N 3.12Å; L168-I171 PolarHBondContact O-N 3.21Å; L168-A172 WeakPolarHBondContact O-CB 3.27Å; L168-A172 PolarHBondContact O-N 2.99Å |
| 169 | G | 63.8 | Low | 67.2 | Low | 26 Ų | 26 | 63.9 Ų | 63.9 | 27% | 0.268 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -66.2 | -43.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | Q165 I167 A172 A173 | Q165-G169 WeakPolarHBondContact O-CA 2.94Å; Q165-G169 PolarHBondContact O-N 3.35Å; I167-G169 VanDerWaalsContact C-N 3.29Å; I167-G169 PolarHBondContact O-N 2.82Å; G169-A172 PolarHBondContact O-N 3.16Å; G169-A173 VanDerWaalsContact O-CB 3.26Å; G169-A173 WeakPolarHBondContact O-CB 3.15Å; G169-A173 PolarHBondContact O-N 3Å |
| 170 | T | 73.2 | Confident | 69.1 | Low | 51 Ų | 51 | 59.3 Ų | 59.3 | 31% | 0.313 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -67 | -42.3 | 173.6 | 49.6 | 0 | 0 | 0 | 0 | 111.9 | S166 I167 A173 V174 V208 | S166-T170 WeakPolarHBondContact O-CB 3.4Å; S166-T170 VanDerWaalsContact O-CG2 3.32Å; S166-T170 WeakPolarHBondContact O-CG2 3.2Å; S166-T170 PolarHBondContact O-N 3.06Å; S166-T170 PolarHBondContact O-OG1 3.41Å; I167-T170 WeakPolarHBondContact CA-OG1 3.44Å; I167-T170 PolarHBondContact O-N 2.87Å; I167-T170 PolarHBondContact O-OG1 3.44Å; T170-A173 PolarHBondContact O-N 3.46Å; T170-V174 WeakPolarHBondContact O-CB 3.41Å; T170-V174 VanDerWaalsContact O-CG2 3.28Å; T170-V174 WeakPolarHBondContact O-CG2 3.48Å; T170-V174 PolarHBondContact O-N 2.83Å; T170-V208 HydrophobicContact CG2-CG2 4.06Å |
| 171 | I | 75.3 | Confident | 71 | Confident | 66 Ų | 66 | 54.8 Ų | 54.8 | 34% | 0.338 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -60.4 | -48 | 174 | -70 | 168 | 0 | 0 | 0 | 110.5 | I167 L168 A173 V174 I175 | I167-I171 HydrophobicContact CG2-CD1 3.68Å; I167-I171 HydrophobicContact CG2-CG1 4.38Å; I167-I171 WeakPolarHBondContact O-CB 3.45Å; I167-I171 WeakPolarHBondContact O-CG1 3.48Å; I167-I171 PolarHBondContact O-N 3.25Å; L168-I171 PolarHBondContact O-N 3.21Å; I171-A173 VanDerWaalsContact C-N 3.32Å; I171-A173 PolarHBondContact O-N 3.46Å; I171-V174 PolarHBondContact O-N 2.73Å; I171-I175 HydrophobicContact CG2-CD1 3.51Å; I171-I175 HydrophobicContact CG2-CG1 4.21Å; I171-I175 WeakPolarHBondContact O-CB 3.42Å; I171-I175 VanDerWaalsContact O-CG1 3.25Å; I171-I175 WeakPolarHBondContact O-CG1 3.45Å; I171-I175 PolarHBondContact O-N 3.45Å |
| 172 | A | 76.4 | Confident | 73 | Confident | 60 Ų | 60 | 54.2 Ų | 54.2 | 50% | 0.496 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -63.7 | -37.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | L168 G169 G176 | L168-A172 WeakPolarHBondContact O-CB 3.27Å; L168-A172 PolarHBondContact O-N 2.99Å; G169-A172 PolarHBondContact O-N 3.16Å; A172-G176 WeakPolarHBondContact O-CA 3.39Å; A172-G176 PolarHBondContact O-N 2.76Å |
| 173 | A | 82 | Confident | 74.7 | Confident | 40 Ų | 40 | 56.4 Ų | 56.4 | 33% | 0.331 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -66 | -45.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | G169 T170 I171 G176 T177 T204 | G169-A173 VanDerWaalsContact O-CB 3.26Å; G169-A173 WeakPolarHBondContact O-CB 3.15Å; G169-A173 PolarHBondContact O-N 3Å; T170-A173 PolarHBondContact O-N 3.46Å; I171-A173 VanDerWaalsContact C-N 3.32Å; I171-A173 PolarHBondContact O-N 3.46Å; A173-G176 PolarHBondContact O-N 2.85Å; A173-T177 VanDerWaalsContact O-CB 3.31Å; A173-T177 WeakPolarHBondContact O-CB 3.46Å; A173-T177 WeakPolarHBondContact O-CG2 3.5Å; A173-T177 PolarHBondContact O-N 2.98Å; A173-T177 PolarHBondContact O-OG1 3.43Å; A173-T204 HydrophobicContact CB-CG2 3.93Å |
| 174 | V | 87.3 | Confident | 76.5 | Confident | 26 Ų | 26 | 54.9 Ų | 54.9 | 16% | 0.158 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -64.7 | -46.2 | 178 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | T170 I171 T177 G178 H201 T204 L205 V208 L347 | T170-V174 WeakPolarHBondContact O-CB 3.41Å; T170-V174 VanDerWaalsContact O-CG2 3.28Å; T170-V174 WeakPolarHBondContact O-CG2 3.48Å; T170-V174 PolarHBondContact O-N 2.83Å; I171-V174 PolarHBondContact O-N 2.73Å; V174-T177 PolarHBondContact O-OG1 3.29Å; V174-G178 PolarHBondContact O-N 3.18Å; V174-H201 PolarHBondContact O-CE1 2.7Å; V174-H201 VanDerWaalsContact O-CE1 3.32Å; V174-T204 HydrophobicContact CG2-CG2 4.36Å; V174-L205 HydrophobicContact CB-CD2 4.5Å; V174-L205 HydrophobicContact CG1-CD2 3.89Å; V174-L205 HydrophobicContact CG1-CG 4.36Å; V174-L205 HydrophobicContact CG2-CD2 3.7Å; V174-L205 HydrophobicContact CG2-CG 4.21Å; V174-V208 HydrophobicContact CG2-CG2 3.95Å; V174-L347 HydrophobicContact CG1-CD2 4.4Å |
| 175 | I | 86.7 | Confident | 78.1 | Confident | 104 Ų | 104 | 58.1 Ų | 58.1 | 53% | 0.533 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -64.1 | -49.1 | 176.9 | -66.7 | 173.1 | 0 | 0 | 0 | 109.9 | I171 T177 G178 T179 | I171-I175 HydrophobicContact CG2-CD1 3.51Å; I171-I175 HydrophobicContact CG2-CG1 4.21Å; I171-I175 WeakPolarHBondContact O-CB 3.42Å; I171-I175 VanDerWaalsContact O-CG1 3.25Å; I171-I175 WeakPolarHBondContact O-CG1 3.45Å; I171-I175 PolarHBondContact O-N 3.45Å; I175-T177 PolarHBondContact O-N 3.3Å; I175-G178 CarbonylContact O-C 3.58Å; I175-G178 PolarHBondContact O-N 2.98Å; I175-T179 HydrophobicContact CG2-CG2 4.17Å; I175-T179 WeakPolarHBondContact O-CG2 3.42Å; I175-T179 PolarHBondContact O-N 2.94Å; I175-T179 PolarHBondContact O-OG1 3.18Å |
| 176 | G | 87.4 | Confident | 79.5 | Confident | 27 Ų | 27 | 53.7 Ų | 53.7 | 28% | 0.278 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.8 | -43.4 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | A172 A173 G178 T179 L180 | A172-G176 WeakPolarHBondContact O-CA 3.39Å; A172-G176 PolarHBondContact O-N 2.76Å; A173-G176 PolarHBondContact O-N 2.85Å; G176-G178 VanDerWaalsContact C-N 3.34Å; G176-T179 PolarHBondContact O-N 3.08Å; G176-T179 PolarHBondContact O-OG1 3.02Å; G176-L180 VanDerWaalsContact O-CB 3.3Å; G176-L180 WeakPolarHBondContact O-CB 3.29Å; G176-L180 WeakPolarHBondContact O-CD1 3.43Å; G176-L180 WeakPolarHBondContact O-CG 3.44Å; G176-L180 PolarHBondContact O-N 3.44Å |
| 177 | T | 88.7 | Confident | 80.5 | Confident | 15 Ų | 15 | 56.8 Ų | 56.8 | 9% | 0.092 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -70.6 | -33.5 | 176.4 | 56.8 | 0 | 0 | 0 | 0 | 112 | A173 V174 I175 C181 L200 H201 T204 | A173-T177 VanDerWaalsContact O-CB 3.31Å; A173-T177 WeakPolarHBondContact O-CB 3.46Å; A173-T177 WeakPolarHBondContact O-CG2 3.5Å; A173-T177 PolarHBondContact O-N 2.98Å; A173-T177 PolarHBondContact O-OG1 3.43Å; V174-T177 PolarHBondContact O-OG1 3.29Å; I175-T177 PolarHBondContact O-N 3.3Å; T177-C181 WeakPolarHBondContact O-CB 3.36Å; T177-C181 PolarHBondContact O-N 3.47Å; T177-L200 HydrophobicContact CG2-CD2 3.14Å; T177-H201 PolarHBondContact OG1-ND1 3.19Å; T177-T204 HydrophobicContact CG2-CG2 4.35Å |
| 178 | G | 88 | Confident | 80.7 | Confident | 5 Ų | 5 | 56 Ų | 56 | 5% | 0.052 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -66.8 | -43.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113 | V174 I175 G176 C181 Q182 H201 | V174-G178 PolarHBondContact O-N 3.18Å; I175-G178 CarbonylContact O-C 3.58Å; I175-G178 PolarHBondContact O-N 2.98Å; G176-G178 VanDerWaalsContact C-N 3.34Å; G178-C181 PolarHBondContact O-N 2.92Å; G178-Q182 VanDerWaalsContact O-CG 3.27Å; G178-Q182 WeakPolarHBondContact O-CG 3.31Å; G178-Q182 PolarHBondContact O-N 3.04Å; G178-Q182 VanDerWaalsContact O-N 3.14Å; G178-Q182 PolarHBondContact O-NE2 3.09Å; G178-H201 PolarHBondContact N-ND1 3.2Å |
| 179 | T | 88.5 | Confident | 80.9 | Confident | 77 Ų | 77 | 59.7 Ų | 59.7 | 47% | 0.472 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -69.7 | -38.3 | 177 | 56.3 | 0 | 0 | 0 | 0 | 111.5 | I175 G176 Q182 S183 | I175-T179 HydrophobicContact CG2-CG2 4.17Å; I175-T179 WeakPolarHBondContact O-CG2 3.42Å; I175-T179 PolarHBondContact O-N 2.94Å; I175-T179 PolarHBondContact O-OG1 3.18Å; G176-T179 PolarHBondContact O-N 3.08Å; G176-T179 PolarHBondContact O-OG1 3.02Å; T179-Q182 PolarHBondContact O-N 2.83Å; T179-S183 WeakPolarHBondContact O-CB 3.48Å; T179-S183 PolarHBondContact O-N 3.29Å; T179-S183 PolarHBondContact O-OG 3.27Å |
| 180 | L | 87.9 | Confident | 81.3 | Confident | 97 Ų | 97 | 65.3 Ų | 65.3 | 51% | 0.508 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61 | -42.6 | 172 | -75.1 | 171.4 | 0 | 0 | 0 | 112.2 | G176 Q182 S183 I184 | G176-L180 VanDerWaalsContact O-CB 3.3Å; G176-L180 WeakPolarHBondContact O-CB 3.29Å; G176-L180 WeakPolarHBondContact O-CD1 3.43Å; G176-L180 WeakPolarHBondContact O-CG 3.44Å; G176-L180 PolarHBondContact O-N 3.44Å; L180-Q182 VanDerWaalsContact C-N 3.25Å; L180-Q182 PolarHBondContact O-N 3.3Å; L180-S183 PolarHBondContact O-N 3.31Å; L180-S183 PolarHBondContact O-OG 2.9Å; L180-S183 VanDerWaalsContact O-OG 3.05Å; L180-I184 WeakPolarHBondContact O-CG1 3.47Å |
| 181 | C | 87.3 | Confident | 81.3 | Confident | 1 Ų | 1 | 69.7 Ų | 69.7 | 1% | 0.007 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -64.3 | -32.2 | 176.4 | -174.6 | 0 | 0 | 0 | 0 | 112.5 | T177 G178 K194 A197 I339 M343 | T177-C181 WeakPolarHBondContact O-CB 3.36Å; T177-C181 PolarHBondContact O-N 3.47Å; G178-C181 PolarHBondContact O-N 2.92Å; C181-K194 WeakPolarHBondContact O-CE 3.33Å; C181-K194 PolarHBondContact O-NZ 3.33Å; C181-A197 HydrophobicContact CB-CB 4.24Å; C181-I339 VanDerWaalsContact SG-CG2 3.54Å; C181-M343 HydrophobicContact CB-CE 4.02Å |
| 182 | Q | 87.3 | Confident | 81.7 | Confident | 89 Ų | 89 | 67.6 Ų | 67.6 | 42% | 0.416 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -83.2 | -28.6 | -179.5 | -70.8 | 175.8 | 61.8 | 0 | 0 | 113.3 | G178 T179 L180 I184 N340 | G178-Q182 VanDerWaalsContact O-CG 3.27Å; G178-Q182 WeakPolarHBondContact O-CG 3.31Å; G178-Q182 PolarHBondContact O-N 3.04Å; G178-Q182 VanDerWaalsContact O-N 3.14Å; G178-Q182 PolarHBondContact O-NE2 3.09Å; T179-Q182 PolarHBondContact O-N 2.83Å; L180-Q182 VanDerWaalsContact C-N 3.25Å; L180-Q182 PolarHBondContact O-N 3.3Å; Q182-I184 VanDerWaalsContact C-N 3.35Å; Q182-N340 WeakPolarHBondContact CG-OD1 3.15Å; Q182-N340 PolarHBondContact OE1-OD1 3Å |
| 183 | S | 87.1 | Confident | 82.2 | Confident | 87 Ų | 87 | 67.6 Ų | 67.6 | 61% | 0.608 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -74.4 | -25 | -178.9 | 66 | 0 | 0 | 0 | 0 | 113.3 | T179 L180 | T179-S183 WeakPolarHBondContact O-CB 3.48Å; T179-S183 PolarHBondContact O-N 3.29Å; T179-S183 PolarHBondContact O-OG 3.27Å; L180-S183 PolarHBondContact O-N 3.31Å; L180-S183 PolarHBondContact O-OG 2.9Å; L180-S183 VanDerWaalsContact O-OG 3.05Å |
| 184 | I | 85.9 | Confident | 82.4 | Confident | 46 Ų | 46 | 65.9 Ų | 65.9 | 24% | 0.236 | 37% | 0.374 | C | S | . | . | S | Bend | trans | -79.5 | 131 | 179.8 | -61.2 | 167.1 | 0 | 0 | 0 | 109.7 | L180 Q182 A193 K194 A197 | L180-I184 WeakPolarHBondContact O-CG1 3.47Å; Q182-I184 VanDerWaalsContact C-N 3.35Å; I184-A193 HydrophobicContact CD1-CB 4.33Å; I184-A193 HydrophobicContact CG2-CB 3.96Å; I184-K194 HydrophobicContact CB-CB 4.48Å; I184-K194 HydrophobicContact CG2-CB 3.92Å; I184-K194 WeakPolarHBondContact O-CD 3.13Å; I184-K194 PolarHBondContact O-NZ 3.06Å; I184-A197 HydrophobicContact CD1-CB 3.65Å |
| 185 | P | 81.2 | Confident | 82.6 | Confident | 98 Ų | 98 | 65.1 Ų | 65.1 | 64% | 0.636 | 37% | 0.368 | S | S | * | . | P | Polyproline II helix | trans | -66.4 | 143.9 | 176.1 | 27.3 | -33.8 | 0 | 0 | 0 | 111.7 | ||
| 186 | Y | 78.7 | Confident | 82.8 | Confident | 21 Ų | 21 | 64.9 Ų | 64.9 | 8% | 0.082 | 37% | 0.368 | C | S | . | . | P | Polyproline II helix | trans | -82.9 | 127.4 | 177.4 | -179.5 | -99.3 | 0 | 0 | 0 | 110.5 | Y118 A188 K194 P335 Y336 D337 P338 I339 | Y118-Y186 HydrophobicContact CE2-CE2 4.21Å; Y186-A188 HydrophobicContact CD1-CB 4.49Å; Y186-A188 VanDerWaalsContact CE1-CA 3.48Å; Y186-A188 HydrophobicContact CE1-CB 3.81Å; Y186-K194 HydrophobicContact CD2-CD 3.97Å; Y186-K194 HydrophobicContact CG-CD 4.37Å; Y186-P335 HydrophobicContact CD1-CG 4.43Å; Y186-P335 WeakPolarHBondContact O-CG 3.26Å; Y186-Y336 WeakPolarHBondContact CD1-O 3.23Å; Y186-D337 HydrophobicContact CG-CB 4.49Å; Y186-P338 HydrophobicContact CE1-CG 4.24Å; Y186-P338 HydrophobicContact CE2-CG 3.88Å; Y186-I339 HydrophobicContact CD2-CD1 4.09Å; Y186-I339 HydrophobicContact CE2-CD1 4.06Å; Y186-I339 HydrophobicContact CE2-CG1 4.42Å |
| 187 | E | 76.1 | Confident | 83 | Confident | 108 Ų | 108 | 64.2 Ų | 64.2 | 51% | 0.505 | 36% | 0.359 | S | S | . | . | trans | -108.5 | 117.7 | 169.6 | -71 | -176.8 | -160.4 | 0 | 0 | 109.2 | N189 | E187-N189 VanDerWaalsContact C-N 3.33Å; E187-N189 PolarHBondContact O-N 2.91Å | ||
| 188 | A | 65.7 | Low | 83.2 | Confident | 49 Ų | 49 | 64.4 Ų | 64.4 | 41% | 0.405 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.4 | -28.2 | -172 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y186 | Y186-A188 HydrophobicContact CD1-CB 4.49Å; Y186-A188 VanDerWaalsContact CE1-CA 3.48Å; Y186-A188 HydrophobicContact CE1-CB 3.81Å |
| 189 | N | 65 | Low | 83.4 | Confident | 160 Ų | 160 | 67.2 Ų | 67.2 | 86% | 0.856 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.9 | 0.3 | -169 | -78.8 | -12.7 | 0 | 0 | 0 | 114.6 | E187 | E187-N189 VanDerWaalsContact C-N 3.33Å; E187-N189 PolarHBondContact O-N 2.91Å |
| 190 | K | 71.4 | Confident | 83.7 | Confident | 144 Ų | 144 | 67.9 Ų | 67.9 | 63% | 0.626 | 37% | 0.371 | S | S | * | . | S | Bend | trans | -137.8 | 139.8 | -175 | -63.9 | -178 | -177.6 | 176.5 | 0 | 111.3 | G192 Q195 | K190-G192 PolarHBondContact O-N 2.86Å; K190-G192 VanDerWaalsContact O-N 3.11Å; K190-Q195 PolarHBondContact O-NE2 3.31Å |
| 191 | F | 74.2 | Confident | 83.9 | Confident | 143 Ų | 143 | 63.3 Ų | 63.3 | 63% | 0.627 | 35% | 0.348 | S | S | * | . | trans | -68.8 | 104.4 | 161.5 | -172.3 | -91.6 | 0 | 0 | 0 | 107.2 | Q195 L196 I199 | F191-Q195 HydrophobicContact CD2-CB 3.71Å; F191-Q195 HydrophobicContact CD2-CG 4.04Å; F191-Q195 HydrophobicContact CE2-CB 3.48Å; F191-Q195 VanDerWaalsContact CE2-CB 3.48Å; F191-Q195 HydrophobicContact CE2-CG 4.23Å; F191-Q195 HydrophobicContact CG-CB 4.41Å; F191-Q195 HydrophobicContact CZ-CB 4Å; F191-L196 HydrophobicContact CE1-CD2 3.74Å; F191-L196 HydrophobicContact CE1-CG 3.97Å; F191-L196 HydrophobicContact CZ-CD2 4.03Å; F191-L196 HydrophobicContact CZ-CG 4.42Å; F191-I199 HydrophobicContact CE2-CD1 4.09Å; F191-I199 HydrophobicContact CZ-CD1 3.69Å | ||
| 192 | G | 82.3 | Confident | 84.2 | Confident | 22 Ų | 22 | 63.3 Ų | 63.3 | 23% | 0.227 | 35% | 0.347 | C | S | . | . | trans | -122.7 | -167.2 | -171.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | K190 K194 Q195 L196 | K190-G192 PolarHBondContact O-N 2.86Å; K190-G192 VanDerWaalsContact O-N 3.11Å; G192-K194 PolarHBondContact O-N 3.5Å; G192-K194 VanDerWaalsContact O-N 3.09Å; G192-Q195 PolarHBondContact O-N 2.99Å; G192-Q195 PolarHBondContact O-OE1 3.2Å; G192-L196 PolarHBondContact O-N 3.2Å | ||
| 193 | A | 86.6 | Confident | 84.4 | Confident | 61 Ų | 61 | 59.9 Ų | 59.9 | 50% | 0.504 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -56.3 | -28.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | I184 L196 A197 | I184-A193 HydrophobicContact CD1-CB 4.33Å; I184-A193 HydrophobicContact CG2-CB 3.96Å; A193-L196 PolarHBondContact O-N 2.86Å; A193-A197 WeakPolarHBondContact O-CB 3.42Å; A193-A197 PolarHBondContact O-N 3.47Å |
| 194 | K | 88 | Confident | 84.6 | Confident | 4 Ų | 4 | 57.1 Ų | 57.1 | 2% | 0.017 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -71.4 | -43.3 | -178.7 | -167.5 | 160.3 | -173.9 | 137 | 0 | 113.5 | C181 I184 Y186 G192 L196 A197 W198 D337 I339 | C181-K194 WeakPolarHBondContact O-CE 3.33Å; C181-K194 PolarHBondContact O-NZ 3.33Å; I184-K194 HydrophobicContact CB-CB 4.48Å; I184-K194 HydrophobicContact CG2-CB 3.92Å; I184-K194 WeakPolarHBondContact O-CD 3.13Å; I184-K194 PolarHBondContact O-NZ 3.06Å; Y186-K194 HydrophobicContact CD2-CD 3.97Å; Y186-K194 HydrophobicContact CG-CD 4.37Å; G192-K194 PolarHBondContact O-N 3.5Å; G192-K194 VanDerWaalsContact O-N 3.09Å; K194-L196 VanDerWaalsContact C-N 3.26Å; K194-L196 PolarHBondContact O-N 3.39Å; K194-A197 PolarHBondContact O-N 3.11Å; K194-W198 VanDerWaalsContact O-CB 3.3Å; K194-W198 WeakPolarHBondContact O-CB 3.43Å; K194-W198 PolarHBondContact O-N 3.08Å; K194-D337 WeakPolarHBondContact CE-OD1 3.5Å; K194-D337 VanDerWaalsContact CE-OD2 3.27Å; K194-D337 WeakPolarHBondContact CE-OD2 3.25Å; K194-D337 IonicContact NZ-OD1 3.45Å; K194-D337 PolarHBondContact NZ-OD1 2.88Å; K194-D337 IonicContact NZ-OD2 3.39Å; K194-D337 PolarHBondContact NZ-OD2 3.07Å; K194-I339 HydrophobicContact CD-CD1 4.36Å; K194-I339 HydrophobicContact CG-CD1 3.91Å |
| 195 | Q | 91 | Very high | 84.8 | Confident | 10 Ų | 10 | 55.2 Ų | 55.2 | 5% | 0.047 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -66.5 | -33.9 | 176.3 | -65.8 | 81.8 | -2.4 | 0 | 0 | 110.5 | Y118 K190 F191 G192 W198 I199 I339 | Y118-Q195 HydrophobicContact CE1-CG 4.3Å; Y118-Q195 PolarHBondContact OH-NE2 3.3Å; K190-Q195 PolarHBondContact O-NE2 3.31Å; F191-Q195 HydrophobicContact CD2-CB 3.71Å; F191-Q195 HydrophobicContact CD2-CG 4.04Å; F191-Q195 HydrophobicContact CE2-CB 3.48Å; F191-Q195 VanDerWaalsContact CE2-CB 3.48Å; F191-Q195 HydrophobicContact CE2-CG 4.23Å; F191-Q195 HydrophobicContact CG-CB 4.41Å; F191-Q195 HydrophobicContact CZ-CB 4Å; G192-Q195 PolarHBondContact O-N 2.99Å; G192-Q195 PolarHBondContact O-OE1 3.2Å; Q195-W198 PolarHBondContact O-N 3.22Å; Q195-I199 WeakPolarHBondContact O-CB 3.19Å; Q195-I199 WeakPolarHBondContact O-CD1 3.37Å; Q195-I199 WeakPolarHBondContact O-CG1 3.49Å; Q195-I199 PolarHBondContact O-N 3.02Å; Q195-I339 HydrophobicContact CG-CD1 4.3Å |
| 196 | L | 90.9 | Very high | 85.2 | Confident | 99 Ų | 99 | 50.6 Ų | 50.6 | 52% | 0.518 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -65 | -45.9 | 171.7 | -70.2 | 176 | 0 | 0 | 0 | 112.5 | F191 G192 A193 K194 W198 I199 L200 | F191-L196 HydrophobicContact CE1-CD2 3.74Å; F191-L196 HydrophobicContact CE1-CG 3.97Å; F191-L196 HydrophobicContact CZ-CD2 4.03Å; F191-L196 HydrophobicContact CZ-CG 4.42Å; G192-L196 PolarHBondContact O-N 3.2Å; A193-L196 PolarHBondContact O-N 2.86Å; K194-L196 VanDerWaalsContact C-N 3.26Å; K194-L196 PolarHBondContact O-N 3.39Å; L196-W198 VanDerWaalsContact C-N 3.3Å; L196-W198 PolarHBondContact O-N 3.12Å; L196-I199 PolarHBondContact O-N 3.32Å; L196-L200 WeakPolarHBondContact O-CB 3.48Å; L196-L200 PolarHBondContact O-N 2.98Å |
| 197 | A | 90.7 | Very high | 85.6 | Confident | 12 Ų | 12 | 50.3 Ų | 50.3 | 10% | 0.099 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.6 | -35.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | C181 I184 A193 K194 L200 H201 | C181-A197 HydrophobicContact CB-CB 4.24Å; I184-A197 HydrophobicContact CD1-CB 3.65Å; A193-A197 WeakPolarHBondContact O-CB 3.42Å; A193-A197 PolarHBondContact O-N 3.47Å; K194-A197 PolarHBondContact O-N 3.11Å; A197-L200 WeakPolarHBondContact O-CB 3.34Å; A197-L200 PolarHBondContact O-N 3.31Å; A197-H201 WeakPolarHBondContact O-CB 3.25Å; A197-H201 PolarHBondContact O-N 2.94Å |
| 198 | W | 92.5 | Very high | 86 | Confident | 20 Ų | 20 | 47.1 Ų | 47.1 | 8% | 0.076 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -66 | -44.9 | 173.1 | 170.5 | 70.4 | 0 | 0 | 0 | 112.4 | Y118 G122 L125 K194 Q195 L196 L200 H201 C202 I339 | Y118-W198 HydrophobicContact CD1-CD2 4.28Å; Y118-W198 HydrophobicContact CD1-CE3 4.32Å; Y118-W198 HydrophobicContact CD1-CH2 4.02Å; Y118-W198 AromaticContact CD1-CZ2 3.96Å; Y118-W198 HydrophobicContact CD1-CZ2 3.96Å; Y118-W198 HydrophobicContact CD1-CZ3 4.2Å; Y118-W198 HydrophobicContact CE1-CE3 4.43Å; Y118-W198 HydrophobicContact CE1-CZ3 4.35Å; Y118-W198 VanDerWaalsContact O-CZ2 3.22Å; Y118-W198 WeakPolarHBondContact O-CZ2 3.26Å; G122-W198 VanDerWaalsContact CA-CZ2 3.43Å; G122-W198 VanDerWaalsContact N-CZ2 3.26Å; L125-W198 HydrophobicContact CD1-CE3 4.16Å; L125-W198 HydrophobicContact CD1-CH2 3.44Å; L125-W198 VanDerWaalsContact CD1-CH2 3.44Å; L125-W198 HydrophobicContact CD1-CZ2 4.11Å; L125-W198 HydrophobicContact CD1-CZ3 3.46Å; L125-W198 VanDerWaalsContact CD1-CZ3 3.46Å; K194-W198 VanDerWaalsContact O-CB 3.3Å; K194-W198 WeakPolarHBondContact O-CB 3.43Å; K194-W198 PolarHBondContact O-N 3.08Å; Q195-W198 PolarHBondContact O-N 3.22Å; L196-W198 VanDerWaalsContact C-N 3.3Å; L196-W198 PolarHBondContact O-N 3.12Å; W198-L200 VanDerWaalsContact C-N 3.31Å; W198-L200 PolarHBondContact O-N 2.83Å; W198-H201 PolarHBondContact O-N 3.34Å; W198-C202 PolarHBondContact O-N 3.18Å; W198-C202 PolarHBondContact O-SG 3.49Å; W198-I339 HydrophobicContact CB-CD1 4.39Å; W198-I339 HydrophobicContact CB-CG2 3.98Å; W198-I339 HydrophobicContact CG-CG2 4Å |
| 199 | I | 93.9 | Very high | 87 | Confident | 63 Ų | 63 | 45.1 Ų | 45.1 | 32% | 0.323 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -59.9 | -43.7 | 173 | -73.1 | 162.6 | 0 | 0 | 0 | 110.4 | L125 F191 Q195 L196 C202 G203 | L125-I199 HydrophobicContact CD1-CG1 3.88Å; F191-I199 HydrophobicContact CE2-CD1 4.09Å; F191-I199 HydrophobicContact CZ-CD1 3.69Å; Q195-I199 WeakPolarHBondContact O-CB 3.19Å; Q195-I199 WeakPolarHBondContact O-CD1 3.37Å; Q195-I199 WeakPolarHBondContact O-CG1 3.49Å; Q195-I199 PolarHBondContact O-N 3.02Å; L196-I199 PolarHBondContact O-N 3.32Å; I199-C202 PolarHBondContact O-N 3.45Å; I199-G203 PolarHBondContact O-N 3.19Å |
| 200 | L | 93.4 | Very high | 88.1 | Confident | 91 Ų | 91 | 37.5 Ų | 37.5 | 48% | 0.476 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -58.5 | -49.3 | 176.2 | -172.6 | 169.5 | 0 | 0 | 0 | 110.1 | T177 L196 A197 W198 C202 G203 T204 | T177-L200 HydrophobicContact CG2-CD2 3.14Å; L196-L200 WeakPolarHBondContact O-CB 3.48Å; L196-L200 PolarHBondContact O-N 2.98Å; A197-L200 WeakPolarHBondContact O-CB 3.34Å; A197-L200 PolarHBondContact O-N 3.31Å; W198-L200 VanDerWaalsContact C-N 3.31Å; W198-L200 PolarHBondContact O-N 2.83Å; L200-C202 PolarHBondContact O-N 2.89Å; L200-G203 CarbonylContact O-C 3.58Å; L200-G203 WeakPolarHBondContact O-CA 3.3Å; L200-G203 PolarHBondContact O-N 2.78Å; L200-G203 VanDerWaalsContact O-N 3.09Å; L200-T204 PolarHBondContact O-N 3.21Å; L200-T204 PolarHBondContact O-OG1 2.86Å; L200-T204 VanDerWaalsContact O-OG1 3.12Å |
| 201 | H | 93.1 | Very high | 88.7 | Confident | 2 Ų | 2 | 32.5 Ų | 32.5 | 1% | 0.009 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61.1 | -43.6 | 178.3 | -175.7 | 61.2 | 0 | 0 | 0 | 112.9 | V174 T177 G178 A197 W198 G203 T204 L205 M343 Y346 | V174-H201 PolarHBondContact O-CE1 2.7Å; V174-H201 VanDerWaalsContact O-CE1 3.32Å; T177-H201 PolarHBondContact OG1-ND1 3.19Å; G178-H201 PolarHBondContact N-ND1 3.2Å; A197-H201 WeakPolarHBondContact O-CB 3.25Å; A197-H201 PolarHBondContact O-N 2.94Å; W198-H201 PolarHBondContact O-N 3.34Å; H201-G203 VanDerWaalsContact C-N 3.28Å; H201-G203 PolarHBondContact O-N 2.98Å; H201-T204 PolarHBondContact O-N 2.88Å; H201-L205 WeakPolarHBondContact NE2-CD1 3.47Å; H201-L205 PolarHBondContact O-N 3.29Å; H201-M343 PolarHBondContact NE2-SD 2.95Å; H201-Y346 AromaticContact CD2-CE1 3.84Å; H201-Y346 AromaticContact NE2-CE1 3.82Å |
| 202 | C | 92.3 | Very high | 89 | Confident | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -61.4 | -39.9 | 172.9 | -62.7 | 0 | 0 | 0 | 0 | 111.3 | L125 T126 W198 I199 L200 L205 G206 | L125-C202 HydrophobicContact CB-CB 4.02Å; T126-C202 WeakPolarHBondContact OG1-CB 3.14Å; T126-C202 PolarHBondContact OG1-O 2.71Å; W198-C202 PolarHBondContact O-N 3.18Å; W198-C202 PolarHBondContact O-SG 3.49Å; I199-C202 PolarHBondContact O-N 3.45Å; L200-C202 PolarHBondContact O-N 2.89Å; C202-L205 PolarHBondContact O-N 2.96Å; C202-G206 PolarHBondContact O-N 3.01Å |
| 203 | G | 92.7 | Very high | 89.2 | Confident | 17 Ų | 17 | 27.6 Ų | 27.6 | 18% | 0.175 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -58.2 | -51.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | S129 M133 I199 L200 H201 G206 A207 | S129-G203 WeakPolarHBondContact OG-CA 3.23Å; S129-G203 PolarHBondContact OG-O 3.13Å; S129-G203 VanDerWaalsContact OG-O 3.12Å; M133-G203 WeakPolarHBondContact CE-O 3.45Å; I199-G203 PolarHBondContact O-N 3.19Å; L200-G203 CarbonylContact O-C 3.58Å; L200-G203 WeakPolarHBondContact O-CA 3.3Å; L200-G203 PolarHBondContact O-N 2.78Å; L200-G203 VanDerWaalsContact O-N 3.09Å; H201-G203 VanDerWaalsContact C-N 3.28Å; H201-G203 PolarHBondContact O-N 2.98Å; G203-G206 CarbonylContact O-C 3.55Å; G203-G206 WeakPolarHBondContact O-CA 3.33Å; G203-G206 PolarHBondContact O-N 2.88Å; G203-G206 VanDerWaalsContact O-N 3.11Å; G203-A207 PolarHBondContact O-N 3.43Å |
| 204 | T | 90.3 | Very high | 89 | Confident | 29 Ų | 29 | 31.6 Ų | 31.6 | 18% | 0.178 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -60.3 | -45 | 178.7 | -59.8 | 0 | 0 | 0 | 0 | 112.1 | A173 V174 T177 L200 H201 G206 A207 V208 | A173-T204 HydrophobicContact CB-CG2 3.93Å; V174-T204 HydrophobicContact CG2-CG2 4.36Å; T177-T204 HydrophobicContact CG2-CG2 4.35Å; L200-T204 PolarHBondContact O-N 3.21Å; L200-T204 PolarHBondContact O-OG1 2.86Å; L200-T204 VanDerWaalsContact O-OG1 3.12Å; H201-T204 PolarHBondContact O-N 2.88Å; T204-G206 VanDerWaalsContact C-N 3.3Å; T204-G206 PolarHBondContact O-N 2.97Å; T204-A207 VanDerWaalsContact O-CB 3.23Å; T204-A207 WeakPolarHBondContact O-CB 3.34Å; T204-A207 PolarHBondContact O-N 2.92Å; T204-A207 VanDerWaalsContact O-N 3.12Å; T204-V208 WeakPolarHBondContact O-CG2 3.23Å; T204-V208 PolarHBondContact O-N 2.92Å; T204-V208 VanDerWaalsContact O-N 3.08Å |
| 205 | L | 90.7 | Very high | 88.5 | Confident | 7 Ų | 7 | 34.7 Ų | 34.7 | 4% | 0.037 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.1 | -35.2 | 174.2 | -80.6 | 164.6 | 0 | 0 | 0 | 112.2 | T126 V174 H201 C202 A207 V208 I209 Y346 L347 I350 | T126-L205 HydrophobicContact CG2-CB 4.35Å; V174-L205 HydrophobicContact CB-CD2 4.5Å; V174-L205 HydrophobicContact CG1-CD2 3.89Å; V174-L205 HydrophobicContact CG1-CG 4.36Å; V174-L205 HydrophobicContact CG2-CD2 3.7Å; V174-L205 HydrophobicContact CG2-CG 4.21Å; H201-L205 WeakPolarHBondContact NE2-CD1 3.47Å; H201-L205 PolarHBondContact O-N 3.29Å; C202-L205 PolarHBondContact O-N 2.96Å; L205-A207 PolarHBondContact O-N 2.86Å; L205-V208 PolarHBondContact O-N 3.35Å; L205-I209 WeakPolarHBondContact O-CD1 3.18Å; L205-I209 VanDerWaalsContact O-CG1 3.26Å; L205-I209 WeakPolarHBondContact O-CG1 3.4Å; L205-I209 PolarHBondContact O-N 3.5Å; L205-Y346 HydrophobicContact CD1-CD1 4.26Å; L205-Y346 HydrophobicContact CD1-CE1 3.19Å; L205-Y346 WeakPolarHBondContact CD1-OH 3.34Å; L205-L347 HydrophobicContact CD1-CD2 3.91Å; L205-I350 HydrophobicContact CD2-CG2 4.42Å |
| 206 | G | 89 | Confident | 87.9 | Confident | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -57.5 | -37.6 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | T130 C202 G203 T204 I209 A210 | T130-G206 WeakPolarHBondContact CA-O 2.89Å; T130-G206 VanDerWaalsContact OG1-CA 3.25Å; T130-G206 WeakPolarHBondContact OG1-CA 3.38Å; T130-G206 PolarHBondContact OG1-O 2.79Å; C202-G206 PolarHBondContact O-N 3.01Å; G203-G206 CarbonylContact O-C 3.55Å; G203-G206 WeakPolarHBondContact O-CA 3.33Å; G203-G206 PolarHBondContact O-N 2.88Å; G203-G206 VanDerWaalsContact O-N 3.11Å; T204-G206 VanDerWaalsContact C-N 3.3Å; T204-G206 PolarHBondContact O-N 2.97Å; G206-I209 PolarHBondContact O-N 3.27Å; G206-A210 PolarHBondContact O-N 2.66Å |
| 207 | A | 87.7 | Confident | 87.4 | Confident | 16 Ų | 16 | 32.9 Ų | 32.9 | 13% | 0.132 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -66.2 | -45.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | M133 V143 G203 T204 L205 I209 A210 P211 | M133-A207 HydrophobicContact CE-CB 4.04Å; M133-A207 WeakPolarHBondContact SD-CA 3.32Å; M133-A207 HydrophobicContact SD-CB 3.25Å; M133-A207 WeakPolarHBondContact SD-CB 3.47Å; M133-A207 PolarHBondContact SD-N 2.9Å; M133-A207 VanDerWaalsContact SD-N 3.39Å; V143-A207 HydrophobicContact CG2-CB 4.34Å; G203-A207 PolarHBondContact O-N 3.43Å; T204-A207 VanDerWaalsContact O-CB 3.23Å; T204-A207 WeakPolarHBondContact O-CB 3.34Å; T204-A207 PolarHBondContact O-N 2.92Å; T204-A207 VanDerWaalsContact O-N 3.12Å; L205-A207 PolarHBondContact O-N 2.86Å; A207-I209 PolarHBondContact O-N 3.41Å; A207-A210 VanDerWaalsContact O-CB 3.27Å; A207-A210 WeakPolarHBondContact O-CB 3.16Å; A207-A210 PolarHBondContact O-N 2.97Å; A207-A210 VanDerWaalsContact O-N 3.1Å; A207-P211 WeakPolarHBondContact O-CD 3.31Å |
| 208 | V | 85.3 | Confident | 87.1 | Confident | 41 Ų | 41 | 37 Ų | 37 | 25% | 0.248 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.2 | -34.4 | 178.6 | 175.1 | 0 | 0 | 0 | 0 | 111.3 | T170 V174 T204 L205 P211 | T170-V208 HydrophobicContact CG2-CG2 4.06Å; V174-V208 HydrophobicContact CG2-CG2 3.95Å; T204-V208 WeakPolarHBondContact O-CG2 3.23Å; T204-V208 PolarHBondContact O-N 2.92Å; T204-V208 VanDerWaalsContact O-N 3.08Å; L205-V208 PolarHBondContact O-N 3.35Å; V208-P211 WeakPolarHBondContact O-CD 3.21Å |
| 209 | I | 86.5 | Confident | 86.7 | Confident | 6 Ų | 6 | 37.9 Ų | 37.9 | 3% | 0.031 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -80.7 | -20.8 | 177.8 | -64 | 164 | 0 | 0 | 0 | 111.9 | T126 T130 L205 G206 A207 P211 L212 I350 F353 M354 | T126-I209 HydrophobicContact CG2-CD1 3.71Å; T130-I209 HydrophobicContact CG2-CB 4.48Å; T130-I209 HydrophobicContact CG2-CG2 3.93Å; L205-I209 WeakPolarHBondContact O-CD1 3.18Å; L205-I209 VanDerWaalsContact O-CG1 3.26Å; L205-I209 WeakPolarHBondContact O-CG1 3.4Å; L205-I209 PolarHBondContact O-N 3.5Å; G206-I209 PolarHBondContact O-N 3.27Å; A207-I209 PolarHBondContact O-N 3.41Å; I209-P211 VanDerWaalsContact C-CD 3.48Å; I209-L212 HydrophobicContact CG2-CD1 4.28Å; I209-L212 VanDerWaalsContact O-CB 3.24Å; I209-L212 WeakPolarHBondContact O-CB 3.47Å; I209-L212 PolarHBondContact O-N 3.02Å; I209-I350 HydrophobicContact CD1-CD1 4.01Å; I209-I350 HydrophobicContact CD1-CG2 3.77Å; I209-I350 HydrophobicContact CG1-CG2 4.45Å; I209-F353 HydrophobicContact CG2-CE1 3.9Å; I209-M354 HydrophobicContact CG1-CG 4.3Å; I209-M354 HydrophobicContact CG1-SD 4.04Å |
| 210 | A | 87 | Confident | 86.3 | Confident | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 22% | 0.218 | C | C | . | . | G | 310 helix | trans | -52.7 | -42.7 | -173.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | M133 M140 G206 A207 L212 T213 | M133-A210 HydrophobicContact CB-CB 4.1Å; M140-A210 HydrophobicContact CE-CB 3.86Å; G206-A210 PolarHBondContact O-N 2.66Å; A207-A210 VanDerWaalsContact O-CB 3.27Å; A207-A210 WeakPolarHBondContact O-CB 3.16Å; A207-A210 PolarHBondContact O-N 2.97Å; A207-A210 VanDerWaalsContact O-N 3.1Å; A210-L212 PolarHBondContact O-N 3.46Å; A210-T213 VanDerWaalsContact O-CB 3.32Å; A210-T213 WeakPolarHBondContact O-CB 3.37Å; A210-T213 WeakPolarHBondContact O-CG2 3.4Å; A210-T213 PolarHBondContact O-N 3.42Å; A210-T213 PolarHBondContact O-OG1 3.25Å |
| 211 | P | 83.7 | Confident | 85.8 | Confident | 40 Ų | 40 | 35.9 Ų | 35.9 | 26% | 0.26 | 22% | 0.222 | S | C | . | . | G | 310 helix | trans | -62.6 | -24.1 | 177 | -24.1 | 35.6 | 0 | 0 | 0 | 114 | M140 V143 T144 A207 V208 I209 T213 F214 | M140-P211 HydrophobicContact SD-CG 4.49Å; V143-P211 HydrophobicContact CB-CG 4.43Å; V143-P211 HydrophobicContact CG1-CG 3.42Å; V143-P211 VanDerWaalsContact CG1-CG 3.42Å; T144-P211 HydrophobicContact CG2-CB 4.19Å; T144-P211 HydrophobicContact CG2-CG 4.04Å; A207-P211 WeakPolarHBondContact O-CD 3.31Å; V208-P211 WeakPolarHBondContact O-CD 3.21Å; I209-P211 VanDerWaalsContact C-CD 3.48Å; P211-T213 PolarHBondContact O-N 3.48Å; P211-F214 VanDerWaalsContact O-CD2 3.27Å; P211-F214 WeakPolarHBondContact O-CD2 3.33Å; P211-F214 PolarHBondContact O-N 3.24Å |
| 212 | L | 82.3 | Confident | 85.4 | Confident | 28 Ų | 28 | 43.4 Ų | 43.4 | 15% | 0.147 | 25% | 0.25 | C | S | . | . | G | 310 helix | trans | -66.4 | -17.8 | 175.4 | -62.1 | 175.4 | 0 | 0 | 0 | 112 | I209 A210 F214 L215 L220 M354 I358 | I209-L212 HydrophobicContact CG2-CD1 4.28Å; I209-L212 VanDerWaalsContact O-CB 3.24Å; I209-L212 WeakPolarHBondContact O-CB 3.47Å; I209-L212 PolarHBondContact O-N 3.02Å; A210-L212 PolarHBondContact O-N 3.46Å; L212-F214 PolarHBondContact O-N 3.04Å; L212-L215 HydrophobicContact CB-CD1 4.34Å; L212-L215 HydrophobicContact CD2-CD1 3.79Å; L212-L215 VanDerWaalsContact O-CB 3.28Å; L212-L215 WeakPolarHBondContact O-CB 3.14Å; L212-L215 WeakPolarHBondContact O-CG 3.3Å; L212-L215 PolarHBondContact O-N 3.33Å; L212-L220 HydrophobicContact CB-CD2 4.33Å; L212-M354 HydrophobicContact CD1-CB 4.2Å; L212-M354 HydrophobicContact CD1-CG 3.74Å; L212-M354 HydrophobicContact CD1-SD 4.41Å; L212-I358 HydrophobicContact CD2-CG1 4.27Å |
| 213 | T | 84.8 | Confident | 85 | Confident | 34 Ų | 34 | 43.4 Ų | 43.4 | 21% | 0.209 | 25% | 0.25 | C | S | . | . | G | 310 helix | trans | -62.8 | -21.9 | 174.5 | 64.8 | 0 | 0 | 0 | 0 | 113.3 | T130 A134 A210 P211 L215 G216 L220 | T130-T213 HydrophobicContact CG2-CG2 3.6Å; A134-T213 HydrophobicContact CB-CG2 3.84Å; A134-T213 WeakPolarHBondContact CB-OG1 3.36Å; A210-T213 VanDerWaalsContact O-CB 3.32Å; A210-T213 WeakPolarHBondContact O-CB 3.37Å; A210-T213 WeakPolarHBondContact O-CG2 3.4Å; A210-T213 PolarHBondContact O-N 3.42Å; A210-T213 PolarHBondContact O-OG1 3.25Å; P211-T213 PolarHBondContact O-N 3.48Å; T213-L215 PolarHBondContact O-N 3.38Å; T213-G216 PolarHBondContact O-N 2.86Å; T213-L220 HydrophobicContact CG2-CD1 4.21Å |
| 214 | F | 82.4 | Confident | 84.7 | Confident | 144 Ų | 144 | 43.8 Ų | 43.8 | 63% | 0.632 | 25% | 0.252 | S | S | * | . | G | 310 helix | trans | -68.1 | -20.2 | 172.8 | -66.3 | -54.8 | 0 | 0 | 0 | 114 | M140 T144 P211 L212 G216 | M140-F214 HydrophobicContact CE-CE2 4.23Å; M140-F214 HydrophobicContact CE-CZ 4.26Å; M140-F214 HydrophobicContact CG-CE2 4.04Å; M140-F214 HydrophobicContact CG-CZ 3.74Å; M140-F214 HydrophobicContact SD-CE2 3.51Å; M140-F214 VanDerWaalsContact SD-CE2 3.51Å; M140-F214 HydrophobicContact SD-CZ 3.78Å; T144-F214 HydrophobicContact CG2-CE2 4.07Å; P211-F214 VanDerWaalsContact O-CD2 3.27Å; P211-F214 WeakPolarHBondContact O-CD2 3.33Å; P211-F214 PolarHBondContact O-N 3.24Å; L212-F214 PolarHBondContact O-N 3.04Å; F214-G216 PolarHBondContact O-N 3.39Å |
| 215 | L | 77.9 | Confident | 84.3 | Confident | 69 Ų | 69 | 45.3 Ų | 45.3 | 36% | 0.361 | 26% | 0.262 | S | S | . | . | G | 310 helix | trans | -67.6 | -14.8 | 174.9 | -58.8 | 176.4 | 0 | 0 | 0 | 112.5 | L212 T213 L219 A361 | L212-L215 HydrophobicContact CB-CD1 4.34Å; L212-L215 HydrophobicContact CD2-CD1 3.79Å; L212-L215 VanDerWaalsContact O-CB 3.28Å; L212-L215 WeakPolarHBondContact O-CB 3.14Å; L212-L215 WeakPolarHBondContact O-CG 3.3Å; L212-L215 PolarHBondContact O-N 3.33Å; T213-L215 PolarHBondContact O-N 3.38Å; L215-L219 HydrophobicContact CB-CD2 4.32Å; L215-A361 HydrophobicContact CB-CB 4.49Å; L215-A361 HydrophobicContact CD1-CB 3.84Å; L215-A361 HydrophobicContact CD2-CB 3.66Å; L215-A361 HydrophobicContact CG-CB 4.2Å |
| 216 | G | 79 | Confident | 83.9 | Confident | 27 Ų | 27 | 51.2 Ų | 51.2 | 28% | 0.278 | 29% | 0.285 | S | S | . | . | trans | 106.6 | 135.8 | 178 | 0 | 0 | 0 | 0 | 0 | 112.9 | T213 F214 L219 L220 | T213-G216 PolarHBondContact O-N 2.86Å; F214-G216 PolarHBondContact O-N 3.39Å; G216-L219 PolarHBondContact O-N 3.35Å; G216-L220 PolarHBondContact O-N 3.24Å | ||
| 217 | G | 79.9 | Confident | 83.6 | Confident | 44 Ų | 44 | 51.4 Ų | 51.4 | 45% | 0.454 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -54.7 | -49.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | L219 L220 V221 | G217-L219 VanDerWaalsContact C-N 3.25Å; G217-L219 PolarHBondContact O-N 3.3Å; G217-L220 PolarHBondContact O-N 3.39Å; G217-V221 WeakPolarHBondContact O-CG2 3.31Å; G217-V221 PolarHBondContact O-N 3.31Å |
| 218 | P | 84.3 | Confident | 83 | Confident | 99 Ų | 99 | 51.8 Ų | 51.8 | 64% | 0.643 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -61.9 | -31.3 | -178.9 | -25.3 | 35 | 0 | 0 | 0 | 114 | R222 | P218-R222 WeakPolarHBondContact O-CG 3.33Å; P218-R222 PolarHBondContact O-N 2.97Å |
| 219 | L | 85.1 | Confident | 82.5 | Confident | 38 Ų | 38 | 52.7 Ų | 52.7 | 20% | 0.199 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -70 | -45.3 | 177.5 | -175.5 | 151.9 | 0 | 0 | 0 | 110.6 | L215 G216 G217 V221 R222 A223 L360 A361 | L215-L219 HydrophobicContact CB-CD2 4.32Å; G216-L219 PolarHBondContact O-N 3.35Å; G217-L219 VanDerWaalsContact C-N 3.25Å; G217-L219 PolarHBondContact O-N 3.3Å; L219-V221 VanDerWaalsContact C-N 3.33Å; L219-V221 PolarHBondContact O-N 3.41Å; L219-R222 WeakPolarHBondContact O-CB 3.41Å; L219-R222 PolarHBondContact O-N 3.32Å; L219-A223 PolarHBondContact O-N 3.15Å; L219-L360 HydrophobicContact CD1-CB 4.18Å; L219-L360 HydrophobicContact CD2-CB 3.85Å; L219-L360 HydrophobicContact CG-CB 3.91Å; L219-A361 HydrophobicContact CD1-CB 4.33Å |
| 220 | L | 85.3 | Confident | 81.7 | Confident | 21 Ų | 21 | 55 Ų | 55 | 11% | 0.11 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -64.3 | -36.3 | 176.8 | -66 | -175.2 | 0 | 0 | 0 | 112.7 | L212 T213 G216 G217 R222 A223 A224 F353 A357 | L212-L220 HydrophobicContact CB-CD2 4.33Å; T213-L220 HydrophobicContact CG2-CD1 4.21Å; G216-L220 PolarHBondContact O-N 3.24Å; G217-L220 PolarHBondContact O-N 3.39Å; L220-R222 VanDerWaalsContact C-N 3.34Å; L220-R222 PolarHBondContact O-N 2.84Å; L220-A223 WeakPolarHBondContact O-CB 3.36Å; L220-A223 PolarHBondContact O-N 3.21Å; L220-A224 WeakPolarHBondContact O-CB 3.5Å; L220-A224 PolarHBondContact O-N 2.98Å; L220-F353 HydrophobicContact CB-CZ 4.4Å; L220-F353 HydrophobicContact CD2-CZ 4.03Å; L220-A357 HydrophobicContact CD2-CB 3.74Å |
| 221 | V | 83.6 | Confident | 80.7 | Confident | 91 Ų | 91 | 55.8 Ų | 55.8 | 55% | 0.552 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -62.8 | -42.8 | 174.6 | 173.3 | 0 | 0 | 0 | 0 | 110.7 | G217 L219 A224 C225 | G217-V221 WeakPolarHBondContact O-CG2 3.31Å; G217-V221 PolarHBondContact O-N 3.31Å; L219-V221 VanDerWaalsContact C-N 3.33Å; L219-V221 PolarHBondContact O-N 3.41Å; V221-A224 PolarHBondContact O-N 2.82Å; V221-C225 PolarHBondContact O-N 3.46Å; V221-C225 PolarHBondContact O-SG 2.95Å |
| 222 | R | 84 | Confident | 79.6 | Confident | 161 Ų | 161 | 54.2 Ų | 54.2 | 61% | 0.608 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -63 | -43.5 | 174.5 | -69.4 | 174.4 | -176.6 | 177.4 | 1.9 | 111.6 | P218 L219 L220 A224 C225 Y226 L360 | P218-R222 WeakPolarHBondContact O-CG 3.33Å; P218-R222 PolarHBondContact O-N 2.97Å; L219-R222 WeakPolarHBondContact O-CB 3.41Å; L219-R222 PolarHBondContact O-N 3.32Å; L220-R222 VanDerWaalsContact C-N 3.34Å; L220-R222 PolarHBondContact O-N 2.84Å; R222-A224 VanDerWaalsContact C-N 3.33Å; R222-A224 PolarHBondContact O-N 2.83Å; R222-C225 PolarHBondContact O-N 3.01Å; R222-Y226 HydrophobicContact CB-CE2 4.32Å; R222-Y226 WeakPolarHBondContact O-CD2 3.4Å; R222-Y226 PolarHBondContact O-N 2.98Å; R222-L360 HydrophobicContact CB-CD1 4.33Å |
| 223 | A | 84.5 | Confident | 78 | Confident | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -56.8 | -49.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | L219 L220 C225 Y226 T227 F353 I356 A357 L360 | L219-A223 PolarHBondContact O-N 3.15Å; L220-A223 WeakPolarHBondContact O-CB 3.36Å; L220-A223 PolarHBondContact O-N 3.21Å; A223-C225 VanDerWaalsContact C-N 3.34Å; A223-C225 PolarHBondContact O-N 3.05Å; A223-Y226 PolarHBondContact O-N 2.84Å; A223-Y226 VanDerWaalsContact O-N 3.16Å; A223-T227 PolarHBondContact O-N 3.28Å; A223-T227 PolarHBondContact O-OG1 3.21Å; A223-F353 HydrophobicContact CB-CD2 4.16Å; A223-F353 HydrophobicContact CB-CE2 3.89Å; A223-I356 HydrophobicContact CB-CB 4.46Å; A223-I356 HydrophobicContact CB-CG2 3.91Å; A223-A357 HydrophobicContact CB-CB 3.97Å; A223-L360 HydrophobicContact CB-CD1 3.77Å |
| 224 | A | 84.5 | Confident | 76.1 | Confident | 25 Ų | 25 | 53.6 Ų | 53.6 | 21% | 0.207 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -59.8 | -41.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | L220 V221 R222 T227 A228 F353 | L220-A224 WeakPolarHBondContact O-CB 3.5Å; L220-A224 PolarHBondContact O-N 2.98Å; V221-A224 PolarHBondContact O-N 2.82Å; R222-A224 VanDerWaalsContact C-N 3.33Å; R222-A224 PolarHBondContact O-N 2.83Å; A224-T227 PolarHBondContact O-N 3.14Å; A224-A228 WeakPolarHBondContact O-CB 3.45Å; A224-A228 PolarHBondContact O-N 3.35Å; A224-F353 HydrophobicContact CB-CD2 4.26Å; A224-F353 HydrophobicContact CB-CE2 3.99Å |
| 225 | C | 82.2 | Confident | 74.2 | Confident | 60 Ų | 60 | 53.7 Ų | 53.7 | 41% | 0.405 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.4 | -41.9 | 175 | -68 | 0 | 0 | 0 | 0 | 112.4 | V221 R222 A223 A228 G229 | V221-C225 PolarHBondContact O-N 3.46Å; V221-C225 PolarHBondContact O-SG 2.95Å; R222-C225 PolarHBondContact O-N 3.01Å; A223-C225 VanDerWaalsContact C-N 3.34Å; A223-C225 PolarHBondContact O-N 3.05Å; C225-A228 PolarHBondContact O-N 3.22Å; C225-G229 PolarHBondContact O-N 3.32Å |
| 226 | Y | 82.2 | Confident | 72.4 | Confident | 131 Ų | 131 | 53 Ų | 53 | 51% | 0.514 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -66.4 | -41.7 | 175.2 | -63.9 | -42.6 | 0 | 0 | 0 | 111.8 | R222 A223 A228 G229 V230 I356 L360 | R222-Y226 HydrophobicContact CB-CE2 4.32Å; R222-Y226 WeakPolarHBondContact O-CD2 3.4Å; R222-Y226 PolarHBondContact O-N 2.98Å; A223-Y226 PolarHBondContact O-N 2.84Å; A223-Y226 VanDerWaalsContact O-N 3.16Å; Y226-A228 VanDerWaalsContact C-N 3.32Å; Y226-A228 PolarHBondContact O-N 3.2Å; Y226-G229 PolarHBondContact O-N 3Å; Y226-G229 VanDerWaalsContact O-N 3.16Å; Y226-V230 WeakPolarHBondContact O-CG2 3.19Å; Y226-V230 PolarHBondContact O-N 2.9Å; Y226-I356 HydrophobicContact CD2-CG2 3.94Å; Y226-L360 HydrophobicContact CD2-CD1 4Å; Y226-L360 HydrophobicContact CE2-CD1 4.02Å; Y226-L360 HydrophobicContact CE2-CD2 3.99Å |
| 227 | T | 83.4 | Confident | 70.4 | Confident | 5 Ų | 5 | 56.9 Ų | 56.9 | 3% | 0.031 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -61.4 | -42 | 174.8 | -46.2 | 0 | 0 | 0 | 0 | 111.3 | A223 A224 G229 V230 V231 T349 I352 F353 | A223-T227 PolarHBondContact O-N 3.28Å; A223-T227 PolarHBondContact O-OG1 3.21Å; A224-T227 PolarHBondContact O-N 3.14Å; T227-G229 PolarHBondContact O-N 3.21Å; T227-V230 PolarHBondContact O-N 3.1Å; T227-V230 VanDerWaalsContact O-N 3.12Å; T227-V231 HydrophobicContact CG2-CG2 3.93Å; T227-V231 WeakPolarHBondContact O-CB 3.5Å; T227-V231 WeakPolarHBondContact O-CG2 3.39Å; T227-V231 PolarHBondContact O-N 2.91Å; T227-T349 HydrophobicContact CG2-CG2 4.3Å; T227-I352 HydrophobicContact CG2-CB 4.04Å; T227-I352 HydrophobicContact CG2-CG2 3.77Å; T227-F353 HydrophobicContact CG2-CB 4.04Å; T227-F353 VanDerWaalsContact OG1-CA 3.29Å; T227-F353 WeakPolarHBondContact OG1-CA 3.48Å |
| 228 | A | 75.7 | Confident | 68.4 | Low | 24 Ų | 24 | 62 Ų | 62 | 20% | 0.198 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -62 | -34.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | A224 C225 Y226 G232 | A224-A228 WeakPolarHBondContact O-CB 3.45Å; A224-A228 PolarHBondContact O-N 3.35Å; C225-A228 PolarHBondContact O-N 3.22Å; Y226-A228 VanDerWaalsContact C-N 3.32Å; Y226-A228 PolarHBondContact O-N 3.2Å; A228-G232 PolarHBondContact O-N 2.63Å |
| 229 | G | 73.4 | Confident | 66 | Low | 59 Ų | 59 | 66 Ų | 66 | 61% | 0.608 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -64.9 | -44 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | C225 Y226 T227 G232 | C225-G229 PolarHBondContact O-N 3.32Å; Y226-G229 PolarHBondContact O-N 3Å; Y226-G229 VanDerWaalsContact O-N 3.16Å; T227-G229 PolarHBondContact O-N 3.21Å; G229-G232 PolarHBondContact O-N 3.19Å |
| 230 | V | 70.7 | Confident | 63.8 | Low | 56 Ų | 56 | 69.6 Ų | 69.6 | 34% | 0.339 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -68.8 | -41.5 | 178.5 | 175.3 | 0 | 0 | 0 | 0 | 112.2 | Y226 T227 G232 I352 | Y226-V230 WeakPolarHBondContact O-CG2 3.19Å; Y226-V230 PolarHBondContact O-N 2.9Å; T227-V230 PolarHBondContact O-N 3.1Å; T227-V230 VanDerWaalsContact O-N 3.12Å; V230-G232 PolarHBondContact O-N 3.04Å; V230-I352 HydrophobicContact CB-CG2 4.45Å; V230-I352 HydrophobicContact CG1-CD1 4.22Å; V230-I352 HydrophobicContact CG1-CG2 4.24Å |
| 231 | V | 66.3 | Low | 61.2 | Low | 15 Ų | 15 | 79.6 Ų | 79.6 | 9% | 0.091 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -73.5 | -12 | -179.2 | 176.3 | 0 | 0 | 0 | 0 | 111.6 | T227 G233 A234 L314 T349 | T227-V231 HydrophobicContact CG2-CG2 3.93Å; T227-V231 WeakPolarHBondContact O-CB 3.5Å; T227-V231 WeakPolarHBondContact O-CG2 3.39Å; T227-V231 PolarHBondContact O-N 2.91Å; V231-G233 PolarHBondContact O-N 3.34Å; V231-A234 HydrophobicContact CB-CB 4.24Å; V231-A234 HydrophobicContact CG1-CB 3.74Å; V231-L314 HydrophobicContact CB-CD1 3.95Å; V231-L314 HydrophobicContact CG1-CD1 4Å; V231-L314 HydrophobicContact CG2-CD1 3.55Å; V231-T349 HydrophobicContact CG2-CG2 3.87Å |
| 232 | G | 60.8 | Low | 59.1 | Low | 8 Ų | 8 | 80.7 Ų | 80.7 | 8% | 0.082 | 44% | 0.435 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 65 | 40.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | A228 G229 V230 G251 M252 | A228-G232 PolarHBondContact O-N 2.63Å; G229-G232 PolarHBondContact O-N 3.19Å; V230-G232 PolarHBondContact O-N 3.04Å; G232-G251 VanDerWaalsContact C-C 3.47Å; G232-G251 CarbonylContact C-O 3.19Å; G232-G251 VanDerWaalsContact C-O 3.24Å; G232-G251 WeakPolarHBondContact CA-O 3.2Å; G232-G251 CarbonylContact O-C 3.59Å; G232-M252 WeakPolarHBondContact O-CA 3.17Å; G232-M252 PolarHBondContact O-N 2.98Å |
| 233 | G | 48.1 | Very low | 56.6 | Low | 30 Ų | 30 | 82.4 Ų | 82.4 | 31% | 0.309 | 45% | 0.446 | S | S | . | . | trans | 129.5 | 27.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | V231 Y235 | V231-G233 PolarHBondContact O-N 3.34Å; G233-Y235 PolarHBondContact O-N 3.48Å | ||
| 234 | A | 44.7 | Very low | 54.4 | Low | 18 Ų | 18 | 90.6 Ų | 90.6 | 15% | 0.149 | 48% | 0.482 | C | S | . | . | trans | -83 | 103.2 | 163.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | L123 V231 L236 | L123-A234 HydrophobicContact CD1-CB 3.9Å; V231-A234 HydrophobicContact CB-CB 4.24Å; V231-A234 HydrophobicContact CG1-CB 3.74Å; A234-L236 PolarHBondContact O-N 2.86Å | ||
| 235 | Y | 43 | Very low | 52.1 | Low | 147 Ų | 147 | 99.4 Ų | 99.4 | 58% | 0.576 | 51% | 0.512 | S | S | * | . | trans | -41.3 | 88.1 | 166.6 | -79.6 | -107.6 | 0 | 0 | 0 | 113.3 | G233 H248 | G233-Y235 PolarHBondContact O-N 3.48Å; Y235-H248 AromaticContact CE2-NE2 3.68Å; Y235-H248 AromaticContact CZ-CD2 3.97Å; Y235-H248 AromaticContact CZ-NE2 3.71Å; Y235-H248 PolarHBondContact OH-CD2 3.4Å; Y235-H248 PolarHBondContact OH-NE2 3.01Å | ||
| 236 | L | 39.4 | Very low | 49.9 | Very low | 54 Ų | 54 | 102.7 Ų | 102.7 | 28% | 0.283 | 53% | 0.53 | S | S | . | . | trans | -150.6 | 66.3 | 170.1 | -97.4 | 165.2 | 0 | 0 | 0 | 110.7 | L123 A234 | L123-L236 HydrophobicContact CB-CD1 3.97Å; A234-L236 PolarHBondContact O-N 2.86Å | ||
| 237 | C | 37.8 | Very low | 47.5 | Very low | 108 Ų | 108 | 100.7 Ų | 100.7 | 73% | 0.73 | 53% | 0.533 | S | S | * | . | trans | -120 | 99.4 | 143.8 | -166 | 0 | 0 | 0 | 0 | 106.6 | K239 | C237-K239 PolarHBondContact O-N 3.31Š| ||
| 238 | L | 36.5 | Very low | 45.1 | Very low | 152 Ų | 152 | 105.1 Ų | 105.1 | 80% | 0.796 | 55% | 0.554 | S | S | * | * | trans | -71.2 | 76.3 | 176.8 | -139.1 | 81.6 | 0 | 0 | 0 | 108.7 | ||||
| 239 | K | 35.5 | Very low | 43.2 | Very low | 184 Ų | 184 | 109.2 Ų | 109.2 | 80% | 0.8 | 57% | 0.571 | S | S | * | * | S | Bend | trans | -151.3 | 105.1 | 162.7 | -117.9 | -176.1 | -178.6 | -174.7 | 0 | 108.3 | C237 | C237-K239 PolarHBondContact O-N 3.31Š|
| 240 | S | 37.3 | Very low | 41.4 | Very low | 112 Ų | 112 | 114.6 Ų | 114.6 | 78% | 0.783 | 59% | 0.585 | S | S | * | * | trans | 69.7 | 75.7 | 168.2 | -64.7 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 241 | W | 31.8 | Very low | 39.8 | Very low | 231 Ų | 231 | 113.4 Ų | 113.4 | 88% | 0.875 | 58% | 0.584 | S | S | * | * | -62.6 | 129.1 | 124.6 | -77 | 74.6 | 0 | 0 | 0 | 106.9 | |||||
| 242 | P | 40.2 | Very low | 38.5 | Very low | 115 Ų | 115 | 116.7 Ų | 116.7 | 75% | 0.747 | 60% | 0.6 | S | S | * | * | cis | -137.7 | 95.9 | 38.3 | 36.4 | -14.7 | 0 | 0 | 0 | 112.7 | ||||
| 243 | K | 30.6 | Very low | 37.9 | Very low | 196 Ų | 196 | 118.1 Ų | 118.1 | 85% | 0.852 | 61% | 0.608 | S | S | * | * | trans | -127 | 102.8 | 158.4 | -75.3 | -124.8 | 178.5 | 178.4 | 0 | 108.6 | ||||
| 244 | K | 38.1 | Very low | 37.7 | Very low | 173 Ų | 173 | 118.4 Ų | 118.4 | 75% | 0.752 | 61% | 0.608 | S | S | * | * | trans | -56.8 | 144.3 | 161.8 | -61.9 | -173.9 | -178.8 | -174.4 | 0 | 107.4 | ||||
| 245 | Y | 37 | Very low | 37.8 | Very low | 210 Ų | 210 | 118.8 Ų | 118.8 | 82% | 0.824 | 61% | 0.608 | S | S | * | * | trans | 82.7 | 52.3 | 169.7 | -39.6 | -74.1 | 0 | 0 | 0 | 118.6 | ||||
| 246 | V | 35 | Very low | 37.8 | Very low | 129 Ų | 129 | 113.9 Ų | 113.9 | 78% | 0.782 | 60% | 0.598 | S | S | * | * | trans | -140.4 | 82.6 | 149.2 | -171.9 | 0 | 0 | 0 | 0 | 109.8 | H248 | V246-H248 PolarHBondContact O-N 2.84Š| ||
| 247 | C | 31.6 | Very low | 37.9 | Very low | 88 Ų | 88 | 114.1 Ų | 114.1 | 60% | 0.595 | 60% | 0.598 | S | S | * | * | 31.6 | 87.3 | 126.1 | -167.7 | 0 | 0 | 0 | 0 | 114.9 | I249 | C247-I249 WeakPolarHBondContact SG-CB 3.27Å; C247-I249 WeakPolarHBondContact SG-CD1 3.44Å; C247-I249 WeakPolarHBondContact SG-CG1 3.14Å | |||
| 248 | H | 33.7 | Very low | 38.5 | Very low | 99 Ų | 99 | 110.5 Ų | 110.5 | 46% | 0.458 | 57% | 0.574 | S | S | . | * | cis | 63.6 | 0.4 | 49.5 | -133.2 | -81.9 | 0 | 0 | 0 | 116.6 | Y235 V246 | Y235-H248 AromaticContact CE2-NE2 3.68Å; Y235-H248 AromaticContact CZ-CD2 3.97Å; Y235-H248 AromaticContact CZ-NE2 3.71Å; Y235-H248 PolarHBondContact OH-CD2 3.4Å; Y235-H248 PolarHBondContact OH-NE2 3.01Å; V246-H248 PolarHBondContact O-N 2.84Å | ||
| 249 | I | 35.5 | Very low | 39.1 | Very low | 109 Ų | 109 | 103.9 Ų | 103.9 | 56% | 0.559 | 54% | 0.541 | S | S | * | . | trans | -110.7 | -19.8 | -173.5 | -75 | -177.5 | 0 | 0 | 0 | 116.9 | C247 S253 | C247-I249 WeakPolarHBondContact SG-CB 3.27Å; C247-I249 WeakPolarHBondContact SG-CD1 3.44Å; C247-I249 WeakPolarHBondContact SG-CG1 3.14Å; I249-S253 PolarHBondContact O-OG 3.41Å | ||
| 250 | L | 35.2 | Very low | 39.5 | Very low | 172 Ų | 172 | 96.5 Ų | 96.5 | 90% | 0.901 | 51% | 0.512 | S | S | * | . | S | Bend | trans | -88 | -29.1 | -178.8 | -70.6 | 174.3 | 0 | 0 | 0 | 114.7 | ||
| 251 | G | 38 | Very low | 40.2 | Very low | 31 Ų | 31 | 94 Ų | 94 | 32% | 0.32 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -94.8 | -47.7 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | G232 S253 | G232-G251 VanDerWaalsContact C-C 3.47Å; G232-G251 CarbonylContact C-O 3.19Å; G232-G251 VanDerWaalsContact C-O 3.24Å; G232-G251 WeakPolarHBondContact CA-O 3.2Å; G232-G251 CarbonylContact O-C 3.59Å; G251-S253 PolarHBondContact O-N 3.08Å; G251-S253 VanDerWaalsContact O-N 3.11Å |
| 252 | M | 39.1 | Very low | 41 | Very low | 85 Ų | 85 | 90 Ų | 90 | 42% | 0.419 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -56.8 | -30 | -179.6 | -78.3 | -89.9 | -62.6 | 0 | 0 | 112.4 | G232 A256 | G232-M252 WeakPolarHBondContact O-CA 3.17Å; G232-M252 PolarHBondContact O-N 2.98Å; M252-A256 WeakPolarHBondContact O-CB 3.4Å; M252-A256 PolarHBondContact O-N 3.29Å |
| 253 | S | 46.8 | Very low | 41.5 | Very low | 37 Ų | 37 | 92.6 Ų | 92.6 | 26% | 0.259 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -80.5 | -41 | -168.7 | -59.9 | 0 | 0 | 0 | 0 | 113.2 | I249 G251 V255 M257 | I249-S253 PolarHBondContact O-OG 3.41Å; G251-S253 PolarHBondContact O-N 3.08Å; G251-S253 VanDerWaalsContact O-N 3.11Å; S253-V255 PolarHBondContact O-N 3Å; S253-M257 WeakPolarHBondContact O-CA 3.24Å; S253-M257 WeakPolarHBondContact O-CB 3.39Å; S253-M257 WeakPolarHBondContact O-CG 3.42Å; S253-M257 PolarHBondContact O-N 2.85Å |
| 254 | A | 45.6 | Very low | 42.3 | Very low | 37 Ų | 37 | 85.8 Ų | 85.8 | 31% | 0.306 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -62.8 | -49.2 | -171.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | L84 C258 | L84-A254 HydrophobicContact CD1-CB 4.18Å; L84-A254 HydrophobicContact CD2-CB 3.53Å; A254-C258 PolarHBondContact O-N 2.85Å |
| 255 | V | 47.1 | Very low | 42.9 | Very low | 26 Ų | 26 | 80.6 Ų | 80.6 | 16% | 0.158 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -74.7 | -43.7 | -178.3 | 164.7 | 0 | 0 | 0 | 0 | 111.2 | S253 A259 L314 L315 | S253-V255 PolarHBondContact O-N 3Å; V255-A259 PolarHBondContact O-N 3.25Å; V255-L314 HydrophobicContact CG1-CD2 4.09Å; V255-L315 HydrophobicContact CB-CD2 4.15Å; V255-L315 HydrophobicContact CG1-CD2 3.34Å; V255-L315 HydrophobicContact CG2-CD2 4.14Å |
| 256 | A | 42.9 | Very low | 43.7 | Very low | 44 Ų | 44 | 79.7 Ų | 79.7 | 36% | 0.364 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -66 | -40.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | A97 M252 C258 | A97-A256 WeakPolarHBondContact CB-O 3.28Å; M252-A256 WeakPolarHBondContact O-CB 3.4Å; M252-A256 PolarHBondContact O-N 3.29Å; A256-C258 PolarHBondContact O-N 3.5Å |
| 257 | M | 41.7 | Very low | 44.8 | Very low | 58 Ų | 58 | 77.4 Ų | 77.4 | 29% | 0.286 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -63.6 | -39.7 | -178.7 | -75.2 | -80 | -100.8 | 0 | 0 | 113 | L84 I98 S253 | L84-M257 HydrophobicContact CD1-CB 4.34Å; I98-M257 HydrophobicContact CB-SD 4.02Å; I98-M257 HydrophobicContact CD1-CE 3.97Å; I98-M257 HydrophobicContact CD1-CG 3.9Å; I98-M257 HydrophobicContact CD1-SD 3.1Å; I98-M257 WeakPolarHBondContact CD1-SD 3.42Å; I98-M257 HydrophobicContact CG1-CG 4.23Å; I98-M257 HydrophobicContact CG1-SD 3.35Å; I98-M257 WeakPolarHBondContact CG1-SD 3.39Å; S253-M257 WeakPolarHBondContact O-CA 3.24Å; S253-M257 WeakPolarHBondContact O-CB 3.39Å; S253-M257 WeakPolarHBondContact O-CG 3.42Å; S253-M257 PolarHBondContact O-N 2.85Å |
| 258 | C | 49.7 | Very low | 46.3 | Very low | 32 Ų | 32 | 74 Ų | 74 | 22% | 0.216 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -99.9 | -1 | -171.1 | -82.3 | 0 | 0 | 0 | 0 | 115 | L84 A254 A256 P260 | L84-C258 VanDerWaalsContact CA-SG 3.59Å; L84-C258 VanDerWaalsContact CD1-SG 3.53Å; A254-C258 PolarHBondContact O-N 2.85Å; A256-C258 PolarHBondContact O-N 3.5Å; C258-P260 WeakPolarHBondContact O-CD 3.29Å |
| 259 | A | 48.2 | Very low | 48.1 | Very low | 14 Ų | 14 | 71.8 Ų | 71.8 | 12% | 0.116 | 40% | 0.397 | C | S | . | . | trans | -67.6 | 97.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | V255 N261 Q319 | V255-A259 PolarHBondContact O-N 3.25Å; A259-N261 PolarHBondContact O-N 3.43Å; A259-Q319 HydrophobicContact CB-CG 4.01Å; A259-Q319 PolarHBondContact O-NE2 2.69Å | ||
| 260 | P | 45.3 | Very low | 50.1 | Low | 28 Ų | 28 | 72.1 Ų | 72.1 | 18% | 0.182 | 40% | 0.399 | C | S | . | . | trans | -75.1 | 121.2 | -170.1 | 33.9 | -29.7 | 0 | 0 | 0 | 108.4 | C258 E262 F264 Q319 | C258-P260 WeakPolarHBondContact O-CD 3.29Å; P260-E262 VanDerWaalsContact C-N 3.27Å; P260-E262 PolarHBondContact O-N 2.81Å; P260-F264 HydrophobicContact CG-CB 4.23Å; P260-F264 HydrophobicContact CG-CD2 3.24Å; P260-F264 HydrophobicContact CG-CE2 3.83Å; P260-F264 HydrophobicContact CG-CG 4.04Å; P260-Q319 VanDerWaalsContact C-NE2 3.33Å; P260-Q319 PolarHBondContact O-NE2 2.86Å | ||
| 261 | N | 51.1 | Low | 52 | Low | 61 Ų | 61 | 64.4 Ų | 64.4 | 33% | 0.326 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.5 | -25.5 | -153.6 | -161.5 | -9.6 | 0 | 0 | 0 | 114.3 | A259 K323 | A259-N261 PolarHBondContact O-N 3.43Å; N261-K323 VanDerWaalsContact O-CE 3.22Å; N261-K323 WeakPolarHBondContact O-CE 3.21Å; N261-K323 PolarHBondContact O-NZ 2.75Å; N261-K323 VanDerWaalsContact OD1-CE 3.28Å; N261-K323 WeakPolarHBondContact OD1-CE 3.35Å |
| 262 | E | 49.6 | Very low | 54 | Low | 147 Ų | 147 | 64.6 Ų | 64.6 | 69% | 0.687 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -128.7 | -33.9 | -169.7 | -54.2 | -174.5 | -146.7 | 0 | 0 | 115.1 | P260 L265 | P260-E262 VanDerWaalsContact C-N 3.27Å; P260-E262 PolarHBondContact O-N 2.81Å; E262-L265 PolarHBondContact O-N 2.8Å |
| 263 | K | 49.3 | Very low | 56.1 | Low | 168 Ų | 168 | 65.3 Ų | 65.3 | 73% | 0.73 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -68.9 | -37.4 | 179.8 | -83.5 | -176.9 | -178.4 | 179.5 | 0 | 112.4 | L265 K266 M267 | K263-L265 VanDerWaalsContact C-N 3.34Å; K263-L265 PolarHBondContact O-N 3.41Å; K263-K266 PolarHBondContact O-N 3.49Å; K263-M267 PolarHBondContact O-N 2.87Å |
| 264 | F | 48.8 | Very low | 57.8 | Low | 53 Ų | 53 | 64.1 Ų | 64.1 | 23% | 0.232 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -70.5 | -29.7 | 178.9 | -103.6 | -103.7 | 0 | 0 | 0 | 112.8 | P260 K266 M267 G268 L315 | P260-F264 HydrophobicContact CG-CB 4.23Å; P260-F264 HydrophobicContact CG-CD2 3.24Å; P260-F264 HydrophobicContact CG-CE2 3.83Å; P260-F264 HydrophobicContact CG-CG 4.04Å; F264-K266 VanDerWaalsContact C-N 3.25Å; F264-K266 PolarHBondContact O-N 3.37Å; F264-M267 HydrophobicContact CE1-CE 4.16Å; F264-M267 HydrophobicContact CE2-CE 4.41Å; F264-M267 HydrophobicContact CZ-CE 4.1Å; F264-M267 WeakPolarHBondContact O-CA 3.32Å; F264-M267 WeakPolarHBondContact O-CB 3.45Å; F264-M267 PolarHBondContact O-N 2.88Å; F264-G268 PolarHBondContact O-N 3.4Å; F264-L315 HydrophobicContact CE1-CD1 4.46Å |
| 265 | L | 50.5 | Low | 59.5 | Low | 64 Ų | 64 | 65.6 Ų | 65.6 | 34% | 0.335 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.2 | -33.7 | 177.1 | -156.9 | 79 | 0 | 0 | 0 | 111.9 | E262 K263 M267 Y316 K323 | E262-L265 PolarHBondContact O-N 2.8Å; K263-L265 VanDerWaalsContact C-N 3.34Å; K263-L265 PolarHBondContact O-N 3.41Å; L265-M267 VanDerWaalsContact C-N 3.35Å; L265-Y316 HydrophobicContact CD1-CE2 3.91Å; L265-Y316 HydrophobicContact CG-CE2 4.37Å; L265-K323 HydrophobicContact CD1-CD 4.4Å; L265-K323 HydrophobicContact CD2-CD 4.13Å |
| 266 | K | 52.5 | Low | 61.3 | Low | 191 Ų | 191 | 66 Ų | 66 | 83% | 0.83 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -75.8 | -20.6 | 173.4 | -69.2 | -175.6 | 178.9 | 177.9 | 0 | 113.3 | K263 F264 G268 | K263-K266 PolarHBondContact O-N 3.49Å; F264-K266 VanDerWaalsContact C-N 3.25Å; F264-K266 PolarHBondContact O-N 3.37Å; K266-G268 VanDerWaalsContact C-N 3.32Å |
| 267 | M | 57.9 | Low | 63.4 | Low | 81 Ų | 81 | 67.6 Ų | 67.6 | 40% | 0.399 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -81 | -4.5 | 175.9 | -93.5 | 170 | 58 | 0 | 0 | 114.3 | K263 F264 L265 G269 I270 L271 | K263-M267 PolarHBondContact O-N 2.87Å; F264-M267 HydrophobicContact CE1-CE 4.16Å; F264-M267 HydrophobicContact CE2-CE 4.41Å; F264-M267 HydrophobicContact CZ-CE 4.1Å; F264-M267 WeakPolarHBondContact O-CA 3.32Å; F264-M267 WeakPolarHBondContact O-CB 3.45Å; F264-M267 PolarHBondContact O-N 2.88Å; L265-M267 VanDerWaalsContact C-N 3.35Å; M267-G269 PolarHBondContact O-N 3.35Å; M267-I270 HydrophobicContact CB-CG2 3.95Å; M267-I270 HydrophobicContact CE-CG2 4.36Å; M267-I270 HydrophobicContact CG-CG2 3.8Å; M267-I270 WeakPolarHBondContact O-CG2 3.34Å; M267-I270 PolarHBondContact O-N 2.88Å; M267-L271 HydrophobicContact CB-CD1 4.09Å; M267-L271 HydrophobicContact CE-CD1 4.33Å; M267-L271 WeakPolarHBondContact O-CD1 3.44Å; M267-L271 PolarHBondContact O-N 3.46Å; M267-L271 VanDerWaalsContact O-N 3.15Å |
| 268 | G | 63.2 | Low | 65.4 | Low | 16 Ų | 16 | 65 Ų | 65 | 17% | 0.165 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -51.3 | -31 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | F264 K266 G272 | F264-G268 PolarHBondContact O-N 3.4Å; K266-G268 VanDerWaalsContact C-N 3.32Å; G268-G272 PolarHBondContact O-N 2.88Å |
| 269 | G | 71.1 | Confident | 67 | Low | 53 Ų | 53 | 69.3 Ų | 69.3 | 55% | 0.546 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62.1 | -47.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114 | M267 G272 V273 | M267-G269 PolarHBondContact O-N 3.35Å; G269-G272 PolarHBondContact O-N 3.23Å; G269-V273 WeakPolarHBondContact O-CG2 3.42Å; G269-V273 PolarHBondContact O-N 3.27Å |
| 270 | I | 78.6 | Confident | 68.7 | Low | 116 Ų | 116 | 73.3 Ų | 73.3 | 60% | 0.595 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -71.6 | -34.7 | -179.8 | -171.3 | 165.7 | 0 | 0 | 0 | 111.8 | M267 G272 V273 G274 | M267-I270 HydrophobicContact CB-CG2 3.95Å; M267-I270 HydrophobicContact CE-CG2 4.36Å; M267-I270 HydrophobicContact CG-CG2 3.8Å; M267-I270 WeakPolarHBondContact O-CG2 3.34Å; M267-I270 PolarHBondContact O-N 2.88Å; I270-G272 VanDerWaalsContact C-N 3.34Å; I270-V273 PolarHBondContact O-N 2.85Å; I270-G274 PolarHBondContact O-N 3.22Å |
| 271 | L | 75.7 | Confident | 70.4 | Confident | 10 Ų | 10 | 72.4 Ų | 72.4 | 5% | 0.052 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -63.2 | -42 | 171.5 | -82.2 | 83.1 | 0 | 0 | 0 | 111.1 | M267 G274 L275 G312 F313 | M267-L271 HydrophobicContact CB-CD1 4.09Å; M267-L271 HydrophobicContact CE-CD1 4.33Å; M267-L271 WeakPolarHBondContact O-CD1 3.44Å; M267-L271 PolarHBondContact O-N 3.46Å; M267-L271 VanDerWaalsContact O-N 3.15Å; L271-G274 PolarHBondContact O-N 2.97Å; L271-L275 PolarHBondContact O-N 3.32Å; L271-G312 WeakPolarHBondContact CD2-O 3.32Å; L271-F313 HydrophobicContact CB-CD1 4.42Å; L271-F313 HydrophobicContact CB-CD2 4.42Å; L271-F313 HydrophobicContact CB-CE1 3.95Å; L271-F313 HydrophobicContact CB-CE2 3.93Å; L271-F313 HydrophobicContact CB-CZ 3.7Å; L271-F313 HydrophobicContact CD2-CD1 4.28Å; L271-F313 HydrophobicContact CD2-CD2 4.29Å; L271-F313 HydrophobicContact CD2-CG 4.11Å; L271-F313 VanDerWaalsContact O-CE2 3.29Å; L271-F313 WeakPolarHBondContact O-CE2 2.83Å; L271-F313 WeakPolarHBondContact O-CZ 3.12Å |
| 272 | G | 78.6 | Confident | 71.7 | Confident | 36 Ų | 36 | 71.4 Ų | 71.4 | 37% | 0.371 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -59.7 | -43.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | G268 G269 I270 G274 L275 G276 | G268-G272 PolarHBondContact O-N 2.88Å; G269-G272 PolarHBondContact O-N 3.23Å; I270-G272 VanDerWaalsContact C-N 3.34Å; G272-G274 VanDerWaalsContact C-N 3.34Å; G272-L275 WeakPolarHBondContact O-CB 3.27Å; G272-L275 PolarHBondContact O-N 2.88Å; G272-G276 PolarHBondContact O-N 3.38Å |
| 273 | V | 82.9 | Confident | 73.1 | Confident | 100 Ų | 100 | 68 Ų | 68 | 61% | 0.606 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -61.7 | -44.1 | 173.2 | 173.5 | 0 | 0 | 0 | 0 | 110.7 | G269 I270 L275 G276 V277 | G269-V273 WeakPolarHBondContact O-CG2 3.42Å; G269-V273 PolarHBondContact O-N 3.27Å; I270-V273 PolarHBondContact O-N 2.85Å; V273-L275 VanDerWaalsContact C-N 3.32Å; V273-L275 PolarHBondContact O-N 3.47Å; V273-G276 WeakPolarHBondContact O-CA 3.5Å; V273-G276 PolarHBondContact O-N 2.93Å; V273-G276 VanDerWaalsContact O-N 3.14Å; V273-V277 PolarHBondContact O-N 3.04Å |
| 274 | G | 83.8 | Confident | 74.3 | Confident | 12 Ų | 12 | 60.8 Ų | 60.8 | 12% | 0.124 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -58.9 | -42 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | I270 L271 G272 G276 V277 V278 L309 | I270-G274 PolarHBondContact O-N 3.22Å; L271-G274 PolarHBondContact O-N 2.97Å; G272-G274 VanDerWaalsContact C-N 3.34Å; G274-G276 VanDerWaalsContact C-N 3.32Å; G274-G276 PolarHBondContact O-N 3.23Å; G274-V277 PolarHBondContact O-N 3.05Å; G274-V278 PolarHBondContact O-N 2.99Å; G274-L309 VanDerWaalsContact O-CD1 3.28Å; G274-L309 WeakPolarHBondContact O-CD1 3.43Å |
| 275 | L | 81.1 | Confident | 75.5 | Confident | 68 Ų | 68 | 60.2 Ų | 60.2 | 36% | 0.356 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -60.6 | -42.3 | 174.5 | -173.5 | 62.1 | 0 | 0 | 0 | 111.5 | L271 G272 V273 V277 V278 F279 F310 F313 | L271-L275 PolarHBondContact O-N 3.32Å; G272-L275 WeakPolarHBondContact O-CB 3.27Å; G272-L275 PolarHBondContact O-N 2.88Å; V273-L275 VanDerWaalsContact C-N 3.32Å; V273-L275 PolarHBondContact O-N 3.47Å; L275-V277 VanDerWaalsContact C-N 3.33Å; L275-V277 PolarHBondContact O-N 3.03Å; L275-V278 PolarHBondContact O-N 3.39Å; L275-F279 VanDerWaalsContact O-CB 3.26Å; L275-F279 WeakPolarHBondContact O-CB 3.28Å; L275-F279 PolarHBondContact O-N 3.42Å; L275-F310 HydrophobicContact CD1-CE1 3.57Å; L275-F310 HydrophobicContact CD1-CE2 4.29Å; L275-F310 HydrophobicContact CD1-CZ 3.28Å; L275-F313 HydrophobicContact CB-CE2 3.77Å; L275-F313 HydrophobicContact CB-CZ 3.83Å; L275-F313 HydrophobicContact CD1-CE2 4.41Å; L275-F313 HydrophobicContact CD2-CE2 4.32Å; L275-F313 HydrophobicContact CD2-CZ 4.04Å; L275-F313 HydrophobicContact CG-CE2 4.4Å; L275-F313 HydrophobicContact CG-CZ 4.47Å |
| 276 | G | 84.6 | Confident | 76.5 | Confident | 34 Ų | 34 | 60 Ų | 60 | 35% | 0.351 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -57.6 | -44.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | G272 V273 G274 F279 V280 | G272-G276 PolarHBondContact O-N 3.38Å; V273-G276 WeakPolarHBondContact O-CA 3.5Å; V273-G276 PolarHBondContact O-N 2.93Å; V273-G276 VanDerWaalsContact O-N 3.14Å; G274-G276 VanDerWaalsContact C-N 3.32Å; G274-G276 PolarHBondContact O-N 3.23Å; G276-F279 PolarHBondContact O-N 3.01Å; G276-V280 WeakPolarHBondContact O-CB 3.25Å; G276-V280 VanDerWaalsContact O-CG2 3.3Å; G276-V280 WeakPolarHBondContact O-CG2 3.1Å; G276-V280 PolarHBondContact O-N 3.07Å |
| 277 | V | 87.1 | Confident | 77.6 | Confident | 77 Ų | 77 | 57 Ų | 57 | 47% | 0.467 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.7 | -46 | 176.6 | 174.2 | 0 | 0 | 0 | 0 | 111.5 | V273 G274 L275 F279 S281 I301 | V273-V277 PolarHBondContact O-N 3.04Å; G274-V277 PolarHBondContact O-N 3.05Å; L275-V277 VanDerWaalsContact C-N 3.33Å; L275-V277 PolarHBondContact O-N 3.03Å; V277-F279 VanDerWaalsContact C-N 3.34Å; V277-F279 PolarHBondContact O-N 3.03Å; V277-S281 VanDerWaalsContact O-CB 3.24Å; V277-S281 WeakPolarHBondContact O-CB 3.38Å; V277-S281 PolarHBondContact O-N 2.82Å; V277-S281 PolarHBondContact O-OG 3.36Å; V277-I301 HydrophobicContact CG1-CG2 4.31Å |
| 278 | V | 83.9 | Confident | 78.3 | Confident | 5 Ų | 5 | 55.9 Ų | 55.9 | 3% | 0.03 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -65.7 | -38.3 | 178.3 | 169.8 | 0 | 0 | 0 | 0 | 111.4 | G274 L275 S281 S282 I301 L309 F310 | G274-V278 PolarHBondContact O-N 2.99Å; L275-V278 PolarHBondContact O-N 3.39Å; V278-S281 PolarHBondContact O-N 3.28Å; V278-S282 WeakPolarHBondContact O-CB 3.32Å; V278-S282 PolarHBondContact O-N 2.88Å; V278-S282 PolarHBondContact O-OG 2.72Å; V278-I301 HydrophobicContact CG2-CG2 4.41Å; V278-L309 HydrophobicContact CG2-CD1 3.49Å; V278-L309 VanDerWaalsContact CG2-CD1 3.49Å; V278-F310 HydrophobicContact CG1-CE2 4.37Å |
| 279 | F | 83.7 | Confident | 78.7 | Confident | 122 Ų | 122 | 58.5 Ų | 58.5 | 54% | 0.535 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -65.8 | -49.9 | 177.2 | -177.8 | -101.5 | 0 | 0 | 0 | 111.7 | L275 G276 V277 S281 S282 I283 | L275-F279 VanDerWaalsContact O-CB 3.26Å; L275-F279 WeakPolarHBondContact O-CB 3.28Å; L275-F279 PolarHBondContact O-N 3.42Å; G276-F279 PolarHBondContact O-N 3.01Å; V277-F279 VanDerWaalsContact C-N 3.34Å; V277-F279 PolarHBondContact O-N 3.03Å; F279-S281 VanDerWaalsContact C-N 3.27Å; F279-S281 PolarHBondContact O-N 2.83Å; F279-S282 WeakPolarHBondContact O-CB 3.47Å; F279-S282 PolarHBondContact O-N 3.43Å; F279-S282 VanDerWaalsContact O-N 3.09Å; F279-I283 HydrophobicContact CD1-CD1 4.11Å; F279-I283 HydrophobicContact CE1-CD1 3.63Å; F279-I283 HydrophobicContact CZ-CD1 4.09Å; F279-I283 PolarHBondContact O-N 3.29Å; F279-I283 VanDerWaalsContact O-N 3.1Å |
| 280 | V | 82.9 | Confident | 78.4 | Confident | 98 Ų | 98 | 59.8 Ų | 59.8 | 59% | 0.594 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -61.8 | -37.9 | 175.3 | 172.8 | 0 | 0 | 0 | 0 | 111 | G276 S282 I283 G284 | G276-V280 WeakPolarHBondContact O-CB 3.25Å; G276-V280 VanDerWaalsContact O-CG2 3.3Å; G276-V280 WeakPolarHBondContact O-CG2 3.1Å; G276-V280 PolarHBondContact O-N 3.07Å; V280-S282 VanDerWaalsContact C-N 3.32Å; V280-S282 PolarHBondContact O-N 3.37Å; V280-I283 PolarHBondContact O-N 3.44Å; V280-G284 PolarHBondContact O-N 2.75Å |
| 281 | S | 81.1 | Confident | 78 | Confident | 9 Ų | 9 | 59.1 Ų | 59.1 | 6% | 0.063 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -64.4 | -38 | 174.9 | -59.9 | 0 | 0 | 0 | 0 | 111.9 | V277 V278 F279 I283 G284 T285 | V277-S281 VanDerWaalsContact O-CB 3.24Å; V277-S281 WeakPolarHBondContact O-CB 3.38Å; V277-S281 PolarHBondContact O-N 2.82Å; V277-S281 PolarHBondContact O-OG 3.36Å; V278-S281 PolarHBondContact O-N 3.28Å; F279-S281 VanDerWaalsContact C-N 3.27Å; F279-S281 PolarHBondContact O-N 2.83Å; S281-I283 VanDerWaalsContact C-N 3.33Å; S281-I283 PolarHBondContact O-N 3.49Å; S281-G284 PolarHBondContact O-N 2.88Å; S281-G284 VanDerWaalsContact O-N 3.12Å; S281-T285 WeakPolarHBondContact O-CG2 3.32Å; S281-T285 PolarHBondContact O-N 2.89Å |
| 282 | S | 78.8 | Confident | 77.9 | Confident | 40 Ų | 40 | 59.6 Ų | 59.6 | 28% | 0.28 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -62.9 | -41.1 | 176.4 | -57 | 0 | 0 | 0 | 0 | 111 | V278 F279 V280 G284 T285 V302 | V278-S282 WeakPolarHBondContact O-CB 3.32Å; V278-S282 PolarHBondContact O-N 2.88Å; V278-S282 PolarHBondContact O-OG 2.72Å; F279-S282 WeakPolarHBondContact O-CB 3.47Å; F279-S282 PolarHBondContact O-N 3.43Å; F279-S282 VanDerWaalsContact O-N 3.09Å; V280-S282 VanDerWaalsContact C-N 3.32Å; V280-S282 PolarHBondContact O-N 3.37Å; S282-G284 VanDerWaalsContact C-N 3.35Å; S282-T285 PolarHBondContact O-N 3.19Å; S282-T285 PolarHBondContact O-OG1 3.49Å; S282-V302 WeakPolarHBondContact OG-CG2 3.45Å |
| 283 | I | 78.1 | Confident | 77.7 | Confident | 74 Ų | 74 | 61 Ų | 61 | 38% | 0.379 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -63 | -42.8 | 172.3 | -63.8 | 170.5 | 0 | 0 | 0 | 110.6 | F279 V280 S281 T285 L286 F287 | F279-I283 HydrophobicContact CD1-CD1 4.11Å; F279-I283 HydrophobicContact CE1-CD1 3.63Å; F279-I283 HydrophobicContact CZ-CD1 4.09Å; F279-I283 PolarHBondContact O-N 3.29Å; F279-I283 VanDerWaalsContact O-N 3.1Å; V280-I283 PolarHBondContact O-N 3.44Å; S281-I283 VanDerWaalsContact C-N 3.33Å; S281-I283 PolarHBondContact O-N 3.49Å; I283-T285 VanDerWaalsContact C-N 3.32Å; I283-T285 PolarHBondContact O-N 2.94Å; I283-L286 WeakPolarHBondContact O-CB 3.26Å; I283-L286 WeakPolarHBondContact O-CG 3.39Å; I283-L286 PolarHBondContact O-N 2.76Å; I283-F287 HydrophobicContact CG2-CE2 3.93Å; I283-F287 WeakPolarHBondContact O-CD2 3.38Å |
| 284 | G | 75.8 | Confident | 77.4 | Confident | 17 Ų | 17 | 59.1 Ų | 59.1 | 18% | 0.175 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -61.9 | -35 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | V280 S281 S282 L286 F287 L288 | V280-G284 PolarHBondContact O-N 2.75Å; S281-G284 PolarHBondContact O-N 2.88Å; S281-G284 VanDerWaalsContact O-N 3.12Å; S282-G284 VanDerWaalsContact C-N 3.35Å; G284-L286 PolarHBondContact O-N 2.74Å; G284-L286 VanDerWaalsContact O-N 3.13Å; G284-F287 PolarHBondContact O-N 3.47Å; G284-F287 VanDerWaalsContact O-N 3.15Å; G284-L288 PolarHBondContact O-N 2.88Å |
| 285 | T | 74.6 | Confident | 77.1 | Confident | 42 Ų | 42 | 58.6 Ų | 58.6 | 26% | 0.258 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -64.4 | -13.2 | 174.2 | 61.9 | 0 | 0 | 0 | 0 | 113.9 | S281 S282 I283 L298 V302 | S281-T285 WeakPolarHBondContact O-CG2 3.32Å; S281-T285 PolarHBondContact O-N 2.89Å; S282-T285 PolarHBondContact O-N 3.19Å; S282-T285 PolarHBondContact O-OG1 3.49Å; I283-T285 VanDerWaalsContact C-N 3.32Å; I283-T285 PolarHBondContact O-N 2.94Å; T285-L298 HydrophobicContact CG2-CB 3.59Å; T285-V302 HydrophobicContact CG2-CG2 4.42Å |
| 286 | L | 70.4 | Confident | 77 | Confident | 60 Ų | 60 | 55.3 Ų | 55.3 | 31% | 0.314 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -78.8 | -30.8 | 175.4 | -52.8 | 175.5 | 0 | 0 | 0 | 112.3 | L164 I167 I283 G284 | L164-L286 HydrophobicContact CD2-CD1 3.8Å; I167-L286 HydrophobicContact CD1-CD2 3.54Å; I283-L286 WeakPolarHBondContact O-CB 3.26Å; I283-L286 WeakPolarHBondContact O-CG 3.39Å; I283-L286 PolarHBondContact O-N 2.76Å; G284-L286 PolarHBondContact O-N 2.74Å; G284-L286 VanDerWaalsContact O-N 3.13Å |
| 287 | F | 75.3 | Confident | 76.9 | Confident | 126 Ų | 126 | 55.5 Ų | 55.5 | 55% | 0.553 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -90.9 | -23.6 | -179.5 | -64.4 | -86.5 | 0 | 0 | 0 | 112.9 | F160 I283 G284 | F160-F287 HydrophobicContact CD2-CE1 4.11Å; F160-F287 HydrophobicContact CE1-CE1 4.49Å; F160-F287 HydrophobicContact CE1-CZ 4.46Å; F160-F287 AromaticContact CE2-CD1 3.72Å; F160-F287 HydrophobicContact CE2-CD1 3.72Å; F160-F287 AromaticContact CE2-CE1 3.06Å; F160-F287 HydrophobicContact CE2-CE1 3.06Å; F160-F287 HydrophobicContact CE2-CE2 4.35Å; F160-F287 AromaticContact CE2-CZ 3.45Å; F160-F287 HydrophobicContact CE2-CZ 3.45Å; F160-F287 VanDerWaalsContact CE2-CZ 3.45Å; F160-F287 HydrophobicContact CZ-CD1 4.37Å; F160-F287 AromaticContact CZ-CE1 3.32Å; F160-F287 HydrophobicContact CZ-CE1 3.32Å; F160-F287 HydrophobicContact CZ-CE2 4.26Å; F160-F287 AromaticContact CZ-CZ 3.26Å; F160-F287 HydrophobicContact CZ-CZ 3.26Å; I283-F287 HydrophobicContact CG2-CE2 3.93Å; I283-F287 WeakPolarHBondContact O-CD2 3.38Å; G284-F287 PolarHBondContact O-N 3.47Å; G284-F287 VanDerWaalsContact O-N 3.15Å |
| 288 | L | 73.7 | Confident | 76.8 | Confident | 58 Ų | 58 | 53.4 Ų | 53.4 | 30% | 0.304 | 30% | 0.301 | S | S | . | . | S | Bend | trans | -118.2 | 123.1 | -171.3 | -64.6 | 172.9 | 0 | 0 | 0 | 110.3 | G284 L294 L298 | G284-L288 PolarHBondContact O-N 2.88Å; L288-L294 HydrophobicContact CD1-CB 3.85Å; L288-L294 HydrophobicContact CD1-CD1 4.14Å; L288-L298 HydrophobicContact CD1-CD1 3.92Å |
| 289 | P | 70.4 | Confident | 76.7 | Confident | 71 Ų | 71 | 56.6 Ų | 56.6 | 46% | 0.461 | 31% | 0.313 | S | S | . | . | trans | -64.3 | 140.9 | 178.9 | 27.6 | -34 | 0 | 0 | 0 | 109.7 | T291 S292 G295 | P289-T291 PolarHBondContact O-N 3.38Å; P289-S292 WeakPolarHBondContact O-CB 3.4Å; P289-S292 PolarHBondContact O-N 3.29Å; P289-S292 PolarHBondContact O-OG 3.49Å; P289-G295 WeakPolarHBondContact O-CA 3.37Å | ||
| 290 | P | 65.2 | Low | 76.7 | Confident | 81 Ų | 81 | 51.1 Ų | 51.1 | 53% | 0.526 | 29% | 0.29 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -10.4 | -178.7 | 27 | -35.2 | 0 | 0 | 0 | 113.3 | S292 | P290-S292 VanDerWaalsContact C-N 3.35Š|
| 291 | T | 71.1 | Confident | 76.8 | Confident | 101 Ų | 101 | 49.6 Ų | 49.6 | 62% | 0.62 | 28% | 0.278 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.8 | -12.3 | 174.2 | 55.7 | 0 | 0 | 0 | 0 | 113.7 | T61 P289 | T61-T291 WeakPolarHBondContact CG2-O 3.31Å; P289-T291 PolarHBondContact O-N 3.38Å |
| 292 | S | 73.3 | Confident | 77 | Confident | 21 Ų | 21 | 50.5 Ų | 50.5 | 15% | 0.147 | 28% | 0.282 | C | S | . | . | B | Isolated β-bridge | trans | -84.6 | 150.9 | 171.1 | 67 | 0 | 0 | 0 | 0 | 110.7 | T61 P289 P290 L294 G295 A296 | T61-S292 WeakPolarHBondContact CG2-O 3.47Å; P289-S292 WeakPolarHBondContact O-CB 3.4Å; P289-S292 PolarHBondContact O-N 3.29Å; P289-S292 PolarHBondContact O-OG 3.49Å; P290-S292 VanDerWaalsContact C-N 3.35Å; S292-L294 PolarHBondContact O-N 3.41Å; S292-G295 PolarHBondContact O-N 2.9Å; S292-G295 VanDerWaalsContact O-N 3.09Å; S292-G295 PolarHBondContact OG-N 3.3Å; S292-A296 PolarHBondContact O-N 3.03Å |
| 293 | M | 73.6 | Confident | 77.2 | Confident | 65 Ų | 65 | 49.1 Ų | 49.1 | 32% | 0.32 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -57.9 | -38.8 | 178.5 | -171.6 | -179.3 | 121.3 | 0 | 0 | 112.2 | V56 L57 S297 | V56-M293 HydrophobicContact CG1-CE 4.2Å; V56-M293 HydrophobicContact CG1-SD 4.22Å; V56-M293 VanDerWaalsContact O-SD 3.41Å; L57-M293 HydrophobicContact CD2-CE 3.93Å; L57-M293 WeakPolarHBondContact O-CB 3.29Å; L57-M293 PolarHBondContact O-N 3.06Å; M293-S297 PolarHBondContact O-N 2.87Å; M293-S297 VanDerWaalsContact O-N 3.11Å; M293-S297 PolarHBondContact O-OG 3.32Å |
| 294 | L | 77.5 | Confident | 77.7 | Confident | 61 Ų | 61 | 46.3 Ų | 46.3 | 32% | 0.319 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -67.4 | -43.4 | 173.2 | -77.5 | 178.5 | 0 | 0 | 0 | 112.8 | L57 L288 S292 A296 S297 L298 | L57-L294 HydrophobicContact CB-CD1 4.11Å; L57-L294 HydrophobicContact CB-CG 3.95Å; L57-L294 HydrophobicContact CD1-CD1 3.91Å; L57-L294 HydrophobicContact CD1-CD2 4.2Å; L57-L294 HydrophobicContact CD1-CG 4.12Å; L57-L294 HydrophobicContact CD2-CD1 4.33Å; L57-L294 HydrophobicContact CD2-CD2 3.42Å; L57-L294 VanDerWaalsContact CD2-CD2 3.42Å; L57-L294 HydrophobicContact CD2-CG 3.58Å; L57-L294 HydrophobicContact CG-CD1 4.3Å; L57-L294 HydrophobicContact CG-CD2 4.25Å; L57-L294 HydrophobicContact CG-CG 4.04Å; L288-L294 HydrophobicContact CD1-CB 3.85Å; L288-L294 HydrophobicContact CD1-CD1 4.14Å; S292-L294 PolarHBondContact O-N 3.41Å; L294-A296 VanDerWaalsContact C-N 3.34Å; L294-A296 PolarHBondContact O-N 3.45Å; L294-S297 PolarHBondContact O-N 2.89Å; L294-S297 PolarHBondContact O-OG 2.87Å; L294-L298 WeakPolarHBondContact O-CG 3.42Å; L294-L298 PolarHBondContact O-N 3.38Å |
| 295 | G | 77.2 | Confident | 78.1 | Confident | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -63.2 | -41.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | P289 S292 L298 Y299 | P289-G295 WeakPolarHBondContact O-CA 3.37Å; S292-G295 PolarHBondContact O-N 2.9Å; S292-G295 VanDerWaalsContact O-N 3.09Å; S292-G295 PolarHBondContact OG-N 3.3Å; G295-L298 PolarHBondContact O-N 2.7Å; G295-Y299 VanDerWaalsContact O-CB 3.25Å; G295-Y299 WeakPolarHBondContact O-CB 3.21Å; G295-Y299 PolarHBondContact O-N 3.46Å |
| 296 | A | 79 | Confident | 78.6 | Confident | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -66.7 | -35.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | T61 P65 F66 S292 L294 S300 | T61-A296 HydrophobicContact CG2-CB 3.44Å; T61-A296 VanDerWaalsContact CG2-CB 3.44Å; P65-A296 HydrophobicContact CG-CB 4.34Å; F66-A296 HydrophobicContact CE2-CB 3.96Å; F66-A296 HydrophobicContact CZ-CB 4.22Å; S292-A296 PolarHBondContact O-N 3.03Å; L294-A296 VanDerWaalsContact C-N 3.34Å; L294-A296 PolarHBondContact O-N 3.45Å; A296-S300 VanDerWaalsContact O-CB 3.31Å; A296-S300 WeakPolarHBondContact O-CB 3.43Å; A296-S300 PolarHBondContact O-N 3.38Å; A296-S300 PolarHBondContact O-OG 3.18Å |
| 297 | S | 82.7 | Confident | 79.3 | Confident | 38 Ų | 38 | 43 Ų | 43 | 27% | 0.266 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -69 | -44.6 | 175.9 | 68.9 | 0 | 0 | 0 | 0 | 111.6 | M293 L294 Y299 S300 I301 | M293-S297 PolarHBondContact O-N 2.87Å; M293-S297 VanDerWaalsContact O-N 3.11Å; M293-S297 PolarHBondContact O-OG 3.32Å; L294-S297 PolarHBondContact O-N 2.89Å; L294-S297 PolarHBondContact O-OG 2.87Å; S297-Y299 PolarHBondContact O-N 2.95Å; S297-S300 PolarHBondContact O-N 2.88Å; S297-I301 WeakPolarHBondContact O-CG1 3.34Å; S297-I301 PolarHBondContact O-N 2.75Å |
| 298 | L | 83.8 | Confident | 79.8 | Confident | 32 Ų | 32 | 40 Ų | 40 | 17% | 0.168 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60.8 | -44.8 | 173.6 | -67.3 | -178.8 | 0 | 0 | 0 | 111.4 | T285 L288 L294 G295 S300 I301 V302 | T285-L298 HydrophobicContact CG2-CB 3.59Å; L288-L298 HydrophobicContact CD1-CD1 3.92Å; L294-L298 WeakPolarHBondContact O-CG 3.42Å; L294-L298 PolarHBondContact O-N 3.38Å; G295-L298 PolarHBondContact O-N 2.7Å; L298-S300 VanDerWaalsContact C-N 3.31Å; L298-S300 PolarHBondContact O-N 3.38Å; L298-I301 PolarHBondContact O-N 2.89Å; L298-V302 VanDerWaalsContact O-CG2 3.28Å; L298-V302 WeakPolarHBondContact O-CG2 3.47Å; L298-V302 PolarHBondContact O-N 3.44Å |
| 299 | Y | 82.1 | Confident | 80.3 | Confident | 72 Ų | 72 | 39 Ų | 39 | 28% | 0.282 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -61.7 | -39.2 | 176.2 | -177.3 | -95.2 | 0 | 0 | 0 | 112.2 | F66 G295 S297 V302 T303 I358 | F66-Y299 AromaticContact CE1-CD1 3.68Å; F66-Y299 HydrophobicContact CE1-CD1 3.68Å; F66-Y299 AromaticContact CE1-CE1 3.95Å; F66-Y299 HydrophobicContact CE1-CE1 3.95Å; F66-Y299 HydrophobicContact CZ-CD1 4.21Å; G295-Y299 VanDerWaalsContact O-CB 3.25Å; G295-Y299 WeakPolarHBondContact O-CB 3.21Å; G295-Y299 PolarHBondContact O-N 3.46Å; S297-Y299 PolarHBondContact O-N 2.95Å; Y299-V302 PolarHBondContact O-N 3.47Å; Y299-T303 HydrophobicContact CD1-CG2 4.22Å; Y299-T303 HydrophobicContact CD2-CG2 4.42Å; Y299-T303 HydrophobicContact CE1-CG2 3.83Å; Y299-T303 HydrophobicContact CE2-CG2 4.04Å; Y299-T303 WeakPolarHBondContact O-CB 3.4Å; Y299-T303 WeakPolarHBondContact O-CG2 2.95Å; Y299-T303 PolarHBondContact O-N 2.84Å; Y299-T303 PolarHBondContact O-OG1 2.99Å; Y299-I358 HydrophobicContact CE2-CG2 4.44Å; Y299-I358 WeakPolarHBondContact OH-CG2 3.4Å |
| 300 | S | 84.8 | Confident | 81 | Confident | 8 Ų | 8 | 36.2 Ų | 36.2 | 6% | 0.056 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -65.8 | -38.7 | 175.4 | -60.9 | 0 | 0 | 0 | 0 | 111.9 | P65 A296 S297 L298 T303 Y304 G305 | P65-S300 PolarHBondContact O-OG 2.91Å; A296-S300 VanDerWaalsContact O-CB 3.31Å; A296-S300 WeakPolarHBondContact O-CB 3.43Å; A296-S300 PolarHBondContact O-N 3.38Å; A296-S300 PolarHBondContact O-OG 3.18Å; S297-S300 PolarHBondContact O-N 2.88Å; L298-S300 VanDerWaalsContact C-N 3.31Å; L298-S300 PolarHBondContact O-N 3.38Å; S300-T303 PolarHBondContact O-OG1 3.46Å; S300-Y304 WeakPolarHBondContact O-CB 3.19Å; S300-Y304 WeakPolarHBondContact O-CD2 2.99Å; S300-Y304 PolarHBondContact O-N 3.19Å; S300-G305 PolarHBondContact O-N 2.89Å |
| 301 | I | 85.2 | Confident | 81.8 | Confident | 66 Ų | 66 | 34.3 Ų | 34.3 | 34% | 0.338 | 20% | 0.196 | S | C | . | . | I | π-helix | trans | -63.9 | -46.4 | 173.9 | -68.5 | 164.7 | 0 | 0 | 0 | 110.5 | V277 V278 S297 L298 T303 G305 G306 | V277-I301 HydrophobicContact CG1-CG2 4.31Å; V278-I301 HydrophobicContact CG2-CG2 4.41Å; S297-I301 WeakPolarHBondContact O-CG1 3.34Å; S297-I301 PolarHBondContact O-N 2.75Å; L298-I301 PolarHBondContact O-N 2.89Å; I301-T303 PolarHBondContact O-N 3.49Å; I301-G305 CarbonylContact O-C 3.41Å; I301-G305 WeakPolarHBondContact O-CA 3.45Å; I301-G305 PolarHBondContact O-N 3.46Å; I301-G306 PolarHBondContact O-N 3.1Å |
| 302 | V | 84.4 | Confident | 82.2 | Confident | 27 Ų | 27 | 30.1 Ų | 30.1 | 16% | 0.164 | 17% | 0.173 | C | C | . | . | I | π-helix | trans | -64 | -42 | -178.5 | 172.9 | 0 | 0 | 0 | 0 | 111.8 | S282 T285 L298 Y299 G306 R355 | S282-V302 WeakPolarHBondContact OG-CG2 3.45Å; T285-V302 HydrophobicContact CG2-CG2 4.42Å; L298-V302 VanDerWaalsContact O-CG2 3.28Å; L298-V302 WeakPolarHBondContact O-CG2 3.47Å; L298-V302 PolarHBondContact O-N 3.44Å; Y299-V302 PolarHBondContact O-N 3.47Å; V302-G306 WeakPolarHBondContact O-CA 3.28Å; V302-R355 PolarHBondContact O-NH1 3.36Å |
| 303 | T | 84.1 | Confident | 82.7 | Confident | 11 Ų | 11 | 30.3 Ų | 30.3 | 7% | 0.067 | 17% | 0.171 | C | C | . | . | I | π-helix | trans | -80.5 | -62.1 | -177.6 | 52.3 | 0 | 0 | 0 | 0 | 112.2 | Y299 S300 I301 L307 I358 | Y299-T303 HydrophobicContact CD1-CG2 4.22Å; Y299-T303 HydrophobicContact CD2-CG2 4.42Å; Y299-T303 HydrophobicContact CE1-CG2 3.83Å; Y299-T303 HydrophobicContact CE2-CG2 4.04Å; Y299-T303 WeakPolarHBondContact O-CB 3.4Å; Y299-T303 WeakPolarHBondContact O-CG2 2.95Å; Y299-T303 PolarHBondContact O-N 2.84Å; Y299-T303 PolarHBondContact O-OG1 2.99Å; S300-T303 PolarHBondContact O-OG1 3.46Å; I301-T303 PolarHBondContact O-N 3.49Å; T303-L307 WeakPolarHBondContact O-CB 3.21Å; T303-L307 PolarHBondContact O-N 3.3Å; T303-I358 HydrophobicContact CG2-CG2 4.28Å |
| 304 | Y | 86.9 | Confident | 83.2 | Confident | 15 Ų | 15 | 27.4 Ų | 27.4 | 6% | 0.059 | 16% | 0.157 | C | C | . | . | I | π-helix | trans | -79.4 | -48 | -175.4 | -61.9 | -85.1 | 0 | 0 | 0 | 112.7 | F66 G69 K70 V73 S300 G306 L307 V308 L359 | F66-Y304 HydrophobicContact CD1-CE2 4.12Å; G69-Y304 VanDerWaalsContact C-CD1 3.42Å; G69-Y304 VanDerWaalsContact C-CG 3.49Å; G69-Y304 WeakPolarHBondContact O-CD1 3.33Å; K70-Y304 HydrophobicContact CB-CE1 4.36Å; K70-Y304 WeakPolarHBondContact CE-OH 3.48Å; K70-Y304 HydrophobicContact CG-CE1 3.55Å; K70-Y304 WeakPolarHBondContact CG-OH 3.3Å; V73-Y304 HydrophobicContact CG2-CD1 3.85Å; V73-Y304 HydrophobicContact CG2-CG 4.41Å; S300-Y304 WeakPolarHBondContact O-CB 3.19Å; S300-Y304 WeakPolarHBondContact O-CD2 2.99Å; S300-Y304 PolarHBondContact O-N 3.19Å; Y304-G306 VanDerWaalsContact C-N 3.33Å; Y304-L307 WeakPolarHBondContact O-CB 3.45Å; Y304-L307 PolarHBondContact O-N 3.01Å; Y304-V308 PolarHBondContact O-N 2.62Å; Y304-L359 HydrophobicContact CD1-CD1 4.28Å; Y304-L359 HydrophobicContact CE1-CD1 3.37Å; Y304-L359 HydrophobicContact CE1-CD2 4.26Å; Y304-L359 HydrophobicContact CE1-CG 4.47Å; Y304-L359 HydrophobicContact CE2-CD1 4.17Å; Y304-L359 WeakPolarHBondContact OH-CD1 3.45Å |
| 305 | G | 84.3 | Confident | 83.1 | Confident | 27 Ų | 27 | 26.5 Ų | 26.5 | 28% | 0.278 | 15% | 0.152 | S | C | . | . | I | π-helix | trans | -63.1 | -43 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | S300 I301 V308 L309 | S300-G305 PolarHBondContact O-N 2.89Å; I301-G305 CarbonylContact O-C 3.41Å; I301-G305 WeakPolarHBondContact O-CA 3.45Å; I301-G305 PolarHBondContact O-N 3.46Å; G305-V308 PolarHBondContact O-N 3.08Å; G305-L309 WeakPolarHBondContact O-CG 3.42Å; G305-L309 PolarHBondContact O-N 3.14Å |
| 306 | G | 85.2 | Confident | 83.1 | Confident | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -54.8 | -53 | 170.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | I301 V302 Y304 V308 L309 F310 | I301-G306 PolarHBondContact O-N 3.1Å; V302-G306 WeakPolarHBondContact O-CA 3.28Å; Y304-G306 VanDerWaalsContact C-N 3.33Å; G306-V308 VanDerWaalsContact C-N 3.28Å; G306-V308 PolarHBondContact O-N 3.34Å; G306-L309 PolarHBondContact O-N 2.67Å; G306-F310 WeakPolarHBondContact O-CD2 3.46Å; G306-F310 PolarHBondContact O-N 2.72Å |
| 307 | L | 85.8 | Confident | 83.4 | Confident | 24 Ų | 24 | 30 Ų | 30 | 13% | 0.126 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -49.9 | -48.5 | 179.5 | -172.5 | 91.6 | 0 | 0 | 0 | 112.5 | V73 T303 Y304 S311 I352 R355 I356 | V73-L307 HydrophobicContact CG1-CD2 3.79Å; V73-L307 HydrophobicContact CG2-CD2 3.91Å; T303-L307 WeakPolarHBondContact O-CB 3.21Å; T303-L307 PolarHBondContact O-N 3.3Å; Y304-L307 WeakPolarHBondContact O-CB 3.45Å; Y304-L307 PolarHBondContact O-N 3.01Å; L307-S311 WeakPolarHBondContact O-CB 3.45Å; L307-S311 PolarHBondContact O-N 2.89Å; L307-S311 PolarHBondContact O-OG 3.37Å; L307-I352 HydrophobicContact CD1-CG2 4.1Å; L307-R355 HydrophobicContact CD1-CB 4.18Å; L307-I356 HydrophobicContact CD1-CD1 4.1Å; L307-I356 HydrophobicContact CD1-CG1 3.53Å |
| 308 | V | 84.6 | Confident | 83.1 | Confident | 61 Ų | 61 | 28.6 Ų | 28.6 | 37% | 0.37 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -63.6 | -46.3 | 178.6 | 177.7 | 0 | 0 | 0 | 0 | 110.8 | V73 Y304 G305 G306 S311 G312 | V73-V308 HydrophobicContact CG2-CG2 3.92Å; Y304-V308 PolarHBondContact O-N 2.62Å; G305-V308 PolarHBondContact O-N 3.08Å; G306-V308 VanDerWaalsContact C-N 3.28Å; G306-V308 PolarHBondContact O-N 3.34Å; V308-S311 PolarHBondContact O-N 3.47Å; V308-S311 PolarHBondContact O-OG 3.25Å; V308-G312 PolarHBondContact O-N 3.33Å |
| 309 | L | 85.4 | Confident | 82.8 | Confident | 39 Ų | 39 | 27.3 Ų | 27.3 | 20% | 0.204 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.6 | -46.6 | 179.7 | -74.6 | 166.1 | 0 | 0 | 0 | 112.6 | G274 V278 G305 G306 S311 G312 F313 | G274-L309 VanDerWaalsContact O-CD1 3.28Å; G274-L309 WeakPolarHBondContact O-CD1 3.43Å; V278-L309 HydrophobicContact CG2-CD1 3.49Å; V278-L309 VanDerWaalsContact CG2-CD1 3.49Å; G305-L309 WeakPolarHBondContact O-CG 3.42Å; G305-L309 PolarHBondContact O-N 3.14Å; G306-L309 PolarHBondContact O-N 2.67Å; L309-S311 VanDerWaalsContact C-N 3.32Å; L309-S311 PolarHBondContact O-N 3.36Å; L309-G312 CarbonylContact O-C 3.54Å; L309-G312 WeakPolarHBondContact O-CA 3.38Å; L309-G312 PolarHBondContact O-N 2.98Å; L309-F313 VanDerWaalsContact O-CD2 3.27Å; L309-F313 WeakPolarHBondContact O-CD2 3.34Å; L309-F313 PolarHBondContact O-N 3.45Å |
| 310 | F | 83.9 | Confident | 82.8 | Confident | 12 Ų | 12 | 30 Ų | 30 | 5% | 0.053 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -68.5 | -31.3 | 178.4 | -68.8 | -69.3 | 0 | 0 | 0 | 112.4 | L275 V278 G306 G312 F313 L314 D348 N351 I352 R355 | L275-F310 HydrophobicContact CD1-CE1 3.57Å; L275-F310 HydrophobicContact CD1-CE2 4.29Å; L275-F310 HydrophobicContact CD1-CZ 3.28Å; V278-F310 HydrophobicContact CG1-CE2 4.37Å; G306-F310 WeakPolarHBondContact O-CD2 3.46Å; G306-F310 PolarHBondContact O-N 2.72Å; F310-G312 VanDerWaalsContact C-N 3.27Å; F310-G312 PolarHBondContact O-N 2.93Å; F310-F313 HydrophobicContact CD1-CD2 4.43Å; F310-F313 PolarHBondContact O-N 3.05Å; F310-L314 WeakPolarHBondContact O-CB 3.31Å; F310-L314 PolarHBondContact O-N 3.43Å; F310-D348 WeakPolarHBondContact CD1-OD1 3.27Å; F310-N351 HydrophobicContact CD1-CB 4.13Å; F310-N351 HydrophobicContact CD2-CB 4.42Å; F310-N351 HydrophobicContact CE1-CB 4.44Å; F310-N351 HydrophobicContact CG-CB 4.1Å; F310-I352 HydrophobicContact CB-CD1 4.32Å; F310-I352 HydrophobicContact CB-CG1 3.78Å; F310-R355 VanDerWaalsContact CD2-NH2 3.3Å |
| 311 | S | 82.4 | Confident | 82.8 | Confident | 41 Ų | 41 | 29.9 Ų | 29.9 | 29% | 0.287 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -63.2 | -36.7 | 169.1 | 73.6 | 0 | 0 | 0 | 0 | 111.8 | L307 V308 L309 L315 | L307-S311 WeakPolarHBondContact O-CB 3.45Å; L307-S311 PolarHBondContact O-N 2.89Å; L307-S311 PolarHBondContact O-OG 3.37Å; V308-S311 PolarHBondContact O-N 3.47Å; V308-S311 PolarHBondContact O-OG 3.25Å; L309-S311 VanDerWaalsContact C-N 3.32Å; L309-S311 PolarHBondContact O-N 3.36Å; S311-L315 WeakPolarHBondContact O-CG 3.17Å; S311-L315 PolarHBondContact O-N 2.83Å |
| 312 | G | 79.9 | Confident | 82.6 | Confident | 12 Ų | 12 | 28.2 Ų | 28.2 | 12% | 0.124 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -68.7 | -41.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | L271 V308 L309 F310 L314 L315 Y316 | L271-G312 WeakPolarHBondContact CD2-O 3.32Å; V308-G312 PolarHBondContact O-N 3.33Å; L309-G312 CarbonylContact O-C 3.54Å; L309-G312 WeakPolarHBondContact O-CA 3.38Å; L309-G312 PolarHBondContact O-N 2.98Å; F310-G312 VanDerWaalsContact C-N 3.27Å; F310-G312 PolarHBondContact O-N 2.93Å; G312-L314 VanDerWaalsContact C-N 3.29Å; G312-L314 PolarHBondContact O-N 2.76Å; G312-L315 WeakPolarHBondContact O-CB 2.92Å; G312-L315 PolarHBondContact O-N 3.4Å; G312-Y316 PolarHBondContact O-N 2.87Å |
| 313 | F | 84.7 | Confident | 82.5 | Confident | 26 Ų | 26 | 29.2 Ų | 29.2 | 11% | 0.114 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -62.9 | -38.5 | 176.6 | -85.1 | -74.6 | 0 | 0 | 0 | 111.6 | L271 L275 L309 F310 L315 Y316 D317 D348 | L271-F313 HydrophobicContact CB-CD1 4.42Å; L271-F313 HydrophobicContact CB-CD2 4.42Å; L271-F313 HydrophobicContact CB-CE1 3.95Å; L271-F313 HydrophobicContact CB-CE2 3.93Å; L271-F313 HydrophobicContact CB-CZ 3.7Å; L271-F313 HydrophobicContact CD2-CD1 4.28Å; L271-F313 HydrophobicContact CD2-CD2 4.29Å; L271-F313 HydrophobicContact CD2-CG 4.11Å; L271-F313 VanDerWaalsContact O-CE2 3.29Å; L271-F313 WeakPolarHBondContact O-CE2 2.83Å; L271-F313 WeakPolarHBondContact O-CZ 3.12Å; L275-F313 HydrophobicContact CB-CE2 3.77Å; L275-F313 HydrophobicContact CB-CZ 3.83Å; L275-F313 HydrophobicContact CD1-CE2 4.41Å; L275-F313 HydrophobicContact CD2-CE2 4.32Å; L275-F313 HydrophobicContact CD2-CZ 4.04Å; L275-F313 HydrophobicContact CG-CE2 4.4Å; L275-F313 HydrophobicContact CG-CZ 4.47Å; L309-F313 VanDerWaalsContact O-CD2 3.27Å; L309-F313 WeakPolarHBondContact O-CD2 3.34Å; L309-F313 PolarHBondContact O-N 3.45Å; F310-F313 HydrophobicContact CD1-CD2 4.43Å; F310-F313 PolarHBondContact O-N 3.05Å; F313-L315 VanDerWaalsContact C-N 3.27Å; F313-L315 PolarHBondContact O-N 3.22Å; F313-Y316 CarbonylContact O-C 3.24Å; F313-Y316 WeakPolarHBondContact O-CB 3.46Å; F313-Y316 PolarHBondContact O-N 3.25Å; F313-Y316 VanDerWaalsContact O-N 3.08Å; F313-D317 WeakPolarHBondContact O-CB 3.16Å; F313-D317 PolarHBondContact O-N 2.97Å; F313-D348 WeakPolarHBondContact CB-OD2 3.45Å |
| 314 | L | 83.6 | Confident | 82.6 | Confident | 4 Ų | 4 | 31.9 Ų | 31.9 | 2% | 0.021 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -56.9 | -42.3 | 174.2 | -174 | 154.1 | 0 | 0 | 0 | 111.8 | V231 V255 F310 G312 T318 D348 I352 | V231-L314 HydrophobicContact CB-CD1 3.95Å; V231-L314 HydrophobicContact CG1-CD1 4Å; V231-L314 HydrophobicContact CG2-CD1 3.55Å; V255-L314 HydrophobicContact CG1-CD2 4.09Å; F310-L314 WeakPolarHBondContact O-CB 3.31Å; F310-L314 PolarHBondContact O-N 3.43Å; G312-L314 VanDerWaalsContact C-N 3.29Å; G312-L314 PolarHBondContact O-N 2.76Å; L314-T318 VanDerWaalsContact O-CB 3.32Å; L314-T318 WeakPolarHBondContact O-CB 3.31Å; L314-T318 PolarHBondContact O-N 3.48Å; L314-T318 PolarHBondContact O-OG1 3.47Å; L314-D348 HydrophobicContact CB-CB 4.38Å; L314-D348 PolarHBondContact N-OD2 2.89Å; L314-I352 HydrophobicContact CD1-CD1 3.9Å |
| 315 | L | 74.9 | Confident | 82.4 | Confident | 42 Ų | 42 | 31.2 Ų | 31.2 | 22% | 0.22 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -64.6 | -46.5 | 175.2 | -60.9 | -179.5 | 0 | 0 | 0 | 111.4 | V255 F264 S311 G312 F313 T318 Q319 | V255-L315 HydrophobicContact CB-CD2 4.15Å; V255-L315 HydrophobicContact CG1-CD2 3.34Å; V255-L315 HydrophobicContact CG2-CD2 4.14Å; F264-L315 HydrophobicContact CE1-CD1 4.46Å; S311-L315 WeakPolarHBondContact O-CG 3.17Å; S311-L315 PolarHBondContact O-N 2.83Å; G312-L315 WeakPolarHBondContact O-CB 2.92Å; G312-L315 PolarHBondContact O-N 3.4Å; F313-L315 VanDerWaalsContact C-N 3.27Å; F313-L315 PolarHBondContact O-N 3.22Å; L315-T318 PolarHBondContact O-N 3.19Å; L315-Q319 WeakPolarHBondContact O-CG 3.3Å; L315-Q319 PolarHBondContact O-N 3.09Å |
| 316 | Y | 78.3 | Confident | 82.3 | Confident | 53 Ų | 53 | 32.5 Ų | 32.5 | 21% | 0.208 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -61 | -46.8 | 178.8 | 177.4 | -91.7 | 0 | 0 | 0 | 112.1 | L265 G312 F313 Q319 R320 | L265-Y316 HydrophobicContact CD1-CE2 3.91Å; L265-Y316 HydrophobicContact CG-CE2 4.37Å; G312-Y316 PolarHBondContact O-N 2.87Å; F313-Y316 CarbonylContact O-C 3.24Å; F313-Y316 WeakPolarHBondContact O-CB 3.46Å; F313-Y316 PolarHBondContact O-N 3.25Å; F313-Y316 VanDerWaalsContact O-N 3.08Å; Y316-Q319 WeakPolarHBondContact O-CB 3.35Å; Y316-Q319 PolarHBondContact O-N 3.12Å; Y316-R320 PolarHBondContact O-N 3.38Å |
| 317 | D | 83.4 | Confident | 82.2 | Confident | 20 Ų | 20 | 38.2 Ų | 38.2 | 11% | 0.107 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -70.9 | -33.4 | -178.7 | -85.8 | -16 | 0 | 0 | 0 | 112 | F313 Q319 R320 V321 G344 I345 | F313-D317 WeakPolarHBondContact O-CB 3.16Å; F313-D317 PolarHBondContact O-N 2.97Å; D317-Q319 VanDerWaalsContact C-N 3.32Å; D317-Q319 PolarHBondContact O-N 3.48Å; D317-R320 WeakPolarHBondContact O-CB 3.49Å; D317-R320 PolarHBondContact O-N 3.13Å; D317-V321 WeakPolarHBondContact O-CG2 3.43Å; D317-V321 PolarHBondContact O-N 3.04Å; D317-G344 VanDerWaalsContact OD2-CA 3.23Å; D317-G344 WeakPolarHBondContact OD2-CA 3.09Å; D317-I345 HydrophobicContact CB-CG1 3.78Å |
| 318 | T | 78.1 | Confident | 82 | Confident | 8 Ų | 8 | 39.9 Ų | 39.9 | 5% | 0.049 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -58.5 | -46.1 | 171.2 | -63.1 | 0 | 0 | 0 | 0 | 111 | Y116 L314 L315 V321 I322 | Y116-T318 WeakPolarHBondContact OH-CG2 3.15Å; L314-T318 VanDerWaalsContact O-CB 3.32Å; L314-T318 WeakPolarHBondContact O-CB 3.31Å; L314-T318 PolarHBondContact O-N 3.48Å; L314-T318 PolarHBondContact O-OG1 3.47Å; L315-T318 PolarHBondContact O-N 3.19Å; T318-V321 PolarHBondContact O-N 2.93Å; T318-I322 HydrophobicContact CG2-CD1 4.16Å; T318-I322 WeakPolarHBondContact O-CG1 3.43Å; T318-I322 PolarHBondContact O-N 3.38Å; T318-I322 VanDerWaalsContact O-N 3.1Å |
| 319 | Q | 76.7 | Confident | 81.7 | Confident | 6 Ų | 6 | 40.4 Ų | 40.4 | 3% | 0.028 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -64.9 | -41.3 | 176.1 | -66.8 | 178.8 | -14.4 | 0 | 0 | 112 | A259 P260 L315 Y316 D317 V321 I322 K323 | A259-Q319 HydrophobicContact CB-CG 4.01Å; A259-Q319 PolarHBondContact O-NE2 2.69Å; P260-Q319 VanDerWaalsContact C-NE2 3.33Å; P260-Q319 PolarHBondContact O-NE2 2.86Å; L315-Q319 WeakPolarHBondContact O-CG 3.3Å; L315-Q319 PolarHBondContact O-N 3.09Å; Y316-Q319 WeakPolarHBondContact O-CB 3.35Å; Y316-Q319 PolarHBondContact O-N 3.12Å; D317-Q319 VanDerWaalsContact C-N 3.32Å; D317-Q319 PolarHBondContact O-N 3.48Å; Q319-V321 VanDerWaalsContact C-N 3.29Å; Q319-V321 PolarHBondContact O-N 2.95Å; Q319-I322 PolarHBondContact O-N 2.94Å; Q319-K323 WeakPolarHBondContact O-CB 3.35Å; Q319-K323 WeakPolarHBondContact O-CG 3.43Å; Q319-K323 PolarHBondContact O-N 3.31Å |
| 320 | R | 83.2 | Confident | 80.8 | Confident | 128 Ų | 128 | 45.2 Ų | 45.2 | 48% | 0.483 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -60.2 | -40.6 | 177.2 | -176.2 | 176.1 | 169.5 | -118.9 | -4 | 111.3 | Y316 D317 L324 | Y316-R320 PolarHBondContact O-N 3.38Å; D317-R320 WeakPolarHBondContact O-CB 3.49Å; D317-R320 PolarHBondContact O-N 3.13Å; R320-L324 WeakPolarHBondContact O-CB 3.14Å; R320-L324 PolarHBondContact O-N 3.48Å |
| 321 | V | 83.7 | Confident | 80 | Confident | 5 Ų | 5 | 52.9 Ų | 52.9 | 3% | 0.03 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -64.3 | -44.4 | 175.6 | 166.4 | 0 | 0 | 0 | 0 | 111.8 | T115 D317 T318 Q319 L324 A325 A341 I345 | T115-V321 HydrophobicContact CG2-CG1 3.7Å; T115-V321 HydrophobicContact CG2-CG2 4.28Å; D317-V321 WeakPolarHBondContact O-CG2 3.43Å; D317-V321 PolarHBondContact O-N 3.04Å; T318-V321 PolarHBondContact O-N 2.93Å; Q319-V321 VanDerWaalsContact C-N 3.29Å; Q319-V321 PolarHBondContact O-N 2.95Å; V321-L324 PolarHBondContact O-N 2.71Å; V321-A325 WeakPolarHBondContact O-CB 3.48Å; V321-A325 PolarHBondContact O-N 3.37Å; V321-A341 HydrophobicContact CG2-CB 4.2Å; V321-A341 WeakPolarHBondContact CG2-O 3.09Å; V321-I345 HydrophobicContact CB-CD1 4.36Å; V321-I345 HydrophobicContact CG2-CD1 3.75Å |
| 322 | I | 81.4 | Confident | 79.4 | Confident | 32 Ų | 32 | 52.8 Ų | 52.8 | 16% | 0.164 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63.2 | -51.3 | 178.4 | -68.7 | 165.9 | 0 | 0 | 0 | 110.5 | W104 T318 Q319 L324 A325 E326 | W104-I322 HydrophobicContact CH2-CD1 3.9Å; W104-I322 HydrophobicContact CH2-CG1 4Å; W104-I322 HydrophobicContact CH2-CG2 3.97Å; W104-I322 HydrophobicContact CZ2-CB 4.5Å; W104-I322 HydrophobicContact CZ2-CD1 4.25Å; W104-I322 HydrophobicContact CZ2-CG1 4.31Å; W104-I322 HydrophobicContact CZ2-CG2 3.4Å; W104-I322 VanDerWaalsContact CZ2-CG2 3.4Å; T318-I322 HydrophobicContact CG2-CD1 4.16Å; T318-I322 WeakPolarHBondContact O-CG1 3.43Å; T318-I322 PolarHBondContact O-N 3.38Å; T318-I322 VanDerWaalsContact O-N 3.1Å; Q319-I322 PolarHBondContact O-N 2.94Å; I322-L324 VanDerWaalsContact C-N 3.29Å; I322-L324 PolarHBondContact O-N 3.29Å; I322-A325 WeakPolarHBondContact O-CA 3.46Å; I322-A325 WeakPolarHBondContact O-CB 3.16Å; I322-A325 PolarHBondContact O-N 3.29Å; I322-E326 PolarHBondContact O-N 3.26Å |
| 323 | K | 82.3 | Confident | 78.9 | Confident | 47 Ų | 47 | 60.8 Ų | 60.8 | 20% | 0.204 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.7 | -40.3 | 178.1 | -71.5 | -173.8 | -179.5 | -171.6 | 0 | 111.9 | N261 L265 Q319 A325 E326 V327 | N261-K323 VanDerWaalsContact O-CE 3.22Å; N261-K323 WeakPolarHBondContact O-CE 3.21Å; N261-K323 PolarHBondContact O-NZ 2.75Å; N261-K323 VanDerWaalsContact OD1-CE 3.28Å; N261-K323 WeakPolarHBondContact OD1-CE 3.35Å; L265-K323 HydrophobicContact CD1-CD 4.4Å; L265-K323 HydrophobicContact CD2-CD 4.13Å; Q319-K323 WeakPolarHBondContact O-CB 3.35Å; Q319-K323 WeakPolarHBondContact O-CG 3.43Å; Q319-K323 PolarHBondContact O-N 3.31Å; K323-A325 VanDerWaalsContact C-N 3.31Å; K323-A325 PolarHBondContact O-N 3.32Å; K323-E326 PolarHBondContact O-N 2.84Å; K323-V327 WeakPolarHBondContact O-CB 2.93Å; K323-V327 WeakPolarHBondContact O-CG2 3.43Å; K323-V327 PolarHBondContact O-N 3.4Å |
| 324 | L | 84.9 | Confident | 78.3 | Confident | 68 Ų | 68 | 68.7 Ų | 68.7 | 36% | 0.356 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -61.4 | -42.7 | 173.4 | -174.9 | 66.2 | 0 | 0 | 0 | 110.4 | R320 V321 I322 E326 Y328 Y336 A341 | R320-L324 WeakPolarHBondContact O-CB 3.14Å; R320-L324 PolarHBondContact O-N 3.48Å; V321-L324 PolarHBondContact O-N 2.71Å; I322-L324 VanDerWaalsContact C-N 3.29Å; I322-L324 PolarHBondContact O-N 3.29Å; L324-E326 PolarHBondContact O-N 3.35Å; L324-Y328 HydrophobicContact CD1-CD2 4.08Å; L324-Y328 WeakPolarHBondContact O-CB 3.44Å; L324-Y328 PolarHBondContact O-N 2.85Å; L324-Y336 HydrophobicContact CD2-CE2 4.14Å; L324-Y336 HydrophobicContact CG-CE2 3.97Å; L324-A341 HydrophobicContact CD2-CB 4.19Å |
| 325 | A | 83.7 | Confident | 78 | Confident | 0 Ų | 0 | 71.5 Ų | 71.5 | 0% | 0 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -65.9 | -33.9 | 179 | 0 | 0 | 0 | 0 | 0 | 113.7 | V108 R111 V112 V321 I322 K323 Y336 | V108-A325 HydrophobicContact CG1-CB 4.07Å; R111-A325 HydrophobicContact CB-CB 3.99Å; R111-A325 PolarHBondContact NH1-O 2.65Å; V112-A325 HydrophobicContact CG2-CB 3.7Å; V321-A325 WeakPolarHBondContact O-CB 3.48Å; V321-A325 PolarHBondContact O-N 3.37Å; I322-A325 WeakPolarHBondContact O-CA 3.46Å; I322-A325 WeakPolarHBondContact O-CB 3.16Å; I322-A325 PolarHBondContact O-N 3.29Å; K323-A325 VanDerWaalsContact C-N 3.31Å; K323-A325 PolarHBondContact O-N 3.32Å; A325-Y336 HydrophobicContact CB-CE2 4.33Å |
| 326 | E | 82.3 | Confident | 78.4 | Confident | 54 Ų | 54 | 70.6 Ų | 70.6 | 25% | 0.252 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -73.9 | -49.5 | 176.9 | -70.6 | 178.4 | 168.3 | 0 | 0 | 112.5 | H100 W104 V108 I322 K323 L324 | H100-E326 IonicContact CD2-OE1 3.52Å; H100-E326 IonicContact CE1-OE1 3.95Å; H100-E326 IonicContact NE2-OE1 2.83Å; H100-E326 PolarHBondContact NE2-OE1 3.43Å; W104-E326 PolarHBondContact NE1-OE1 3.2Å; V108-E326 HydrophobicContact CG1-CG 3.86Å; V108-E326 HydrophobicContact CG2-CG 4.32Å; I322-E326 PolarHBondContact O-N 3.26Å; K323-E326 PolarHBondContact O-N 2.84Å; L324-E326 PolarHBondContact O-N 3.35Å |
| 327 | V | 83.4 | Confident | 78.8 | Confident | 121 Ų | 121 | 69.3 Ų | 69.3 | 73% | 0.733 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -79 | -24.8 | -172.8 | 177.7 | 0 | 0 | 0 | 0 | 112.3 | K323 | K323-V327 WeakPolarHBondContact O-CB 2.93Å; K323-V327 WeakPolarHBondContact O-CG2 3.43Å; K323-V327 PolarHBondContact O-N 3.4Å |
| 328 | Y | 81.5 | Confident | 78.9 | Confident | 59 Ų | 59 | 68.4 Ų | 68.4 | 23% | 0.231 | 34% | 0.342 | C | S | . | . | S | Bend | trans | -63.2 | 126.2 | -176.7 | -152.2 | -93.8 | 0 | 0 | 0 | 110.8 | R111 L324 A332 R334 P335 Y336 | R111-Y328 PolarHBondContact NH1-O 3.05Å; R111-Y328 PolarHBondContact NH2-O 3.42Å; L324-Y328 HydrophobicContact CD1-CD2 4.08Å; L324-Y328 WeakPolarHBondContact O-CB 3.44Å; L324-Y328 PolarHBondContact O-N 2.85Å; Y328-A332 HydrophobicContact CE1-CB 4.01Å; Y328-R334 WeakPolarHBondContact CE1-O 3.3Å; Y328-R334 PolarHBondContact OH-O 3.47Å; Y328-P335 PolarHBondContact OH-O 2.88Å; Y328-Y336 HydrophobicContact CD1-CD2 4.35Å; Y328-Y336 HydrophobicContact CD2-CD2 4.41Å; Y328-Y336 HydrophobicContact CG-CD2 4.07Å |
| 329 | P | 77.4 | Confident | 79.4 | Confident | 72 Ų | 72 | 68 Ų | 68 | 47% | 0.468 | 34% | 0.339 | S | S | . | . | trans | -59 | 148 | -179.2 | 25.9 | -37 | 0 | 0 | 0 | 111.3 | R111 A332 | R111-P329 PolarHBondContact NH2-O 3.34Å; P329-A332 HydrophobicContact CB-CB 4.41Å; P329-A332 HydrophobicContact CG-CB 3.52Å | ||
| 330 | Q | 67 | Low | 80 | Confident | 140 Ų | 140 | 70.6 Ų | 70.6 | 65% | 0.654 | 35% | 0.353 | S | S | * | . | S | Bend | trans | -68.3 | -39.2 | 176.5 | -68.4 | -176.4 | -1.9 | 0 | 0 | 111.5 | Y107 | Y107-Q330 HydrophobicContact CD2-CG 4.39Å; Y107-Q330 HydrophobicContact CE2-CG 4.45Å |
| 331 | L | 68.3 | Low | 80.1 | Confident | 172 Ų | 172 | 65 Ų | 65 | 90% | 0.901 | 33% | 0.334 | S | S | * | . | S | Bend | trans | -114 | 76.7 | 179.2 | -164.1 | 74.3 | 0 | 0 | 0 | 109.6 | ||
| 332 | A | 69.7 | Low | 80.2 | Confident | 39 Ų | 39 | 64.7 Ų | 64.7 | 32% | 0.322 | 33% | 0.333 | S | S | . | . | trans | -99.6 | 153 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y328 P329 R334 | Y328-A332 HydrophobicContact CE1-CB 4.01Å; P329-A332 HydrophobicContact CB-CB 4.41Å; P329-A332 HydrophobicContact CG-CB 3.52Å; A332-R334 WeakPolarHBondContact CB-O 3.45Å; A332-R334 PolarHBondContact O-N 3.11Å | ||
| 333 | I | 68.6 | Low | 80.6 | Confident | 181 Ų | 181 | 63.5 Ų | 63.5 | 93% | 0.928 | 33% | 0.326 | S | S | * | . | S | Bend | trans | -53.5 | -33.9 | 170.9 | -61.6 | 169.3 | 0 | 0 | 0 | 110.8 | ||
| 334 | R | 71.9 | Confident | 80.7 | Confident | 191 Ų | 191 | 62.1 Ų | 62.1 | 72% | 0.721 | 33% | 0.326 | S | S | * | . | S | Bend | trans | -110.2 | 130 | 174.2 | -62.8 | -177.1 | -176.3 | 177.2 | 1.3 | 109.1 | Y328 A332 | Y328-R334 WeakPolarHBondContact CE1-O 3.3Å; Y328-R334 PolarHBondContact OH-O 3.47Å; A332-R334 WeakPolarHBondContact CB-O 3.45Å; A332-R334 PolarHBondContact O-N 3.11Å |
| 335 | P | 78 | Confident | 80.9 | Confident | 64 Ų | 64 | 59 Ų | 59 | 42% | 0.416 | 31% | 0.309 | S | S | . | . | trans | -68.8 | 155.7 | 175.8 | 29.5 | -34.9 | 0 | 0 | 0 | 110.9 | Y186 Y328 D337 | Y186-P335 HydrophobicContact CD1-CG 4.43Å; Y186-P335 WeakPolarHBondContact O-CG 3.26Å; Y328-P335 PolarHBondContact OH-O 2.88Å; P335-D337 PolarHBondContact O-N 3.02Å | ||
| 336 | Y | 82.1 | Confident | 81.1 | Confident | 22 Ų | 22 | 59 Ų | 59 | 9% | 0.086 | 31% | 0.309 | C | S | . | . | trans | -56.6 | 131.2 | 171.7 | 177.3 | -92.1 | 0 | 0 | 0 | 110 | R111 T115 Y186 L324 A325 Y328 P338 | R111-Y336 HydrophobicContact CB-CD1 3.97Å; R111-Y336 HydrophobicContact CB-CE1 3.75Å; R111-Y336 HydrophobicContact CB-CE2 4.49Å; R111-Y336 HydrophobicContact CB-CG 4.43Å; R111-Y336 HydrophobicContact CG-CD1 3.8Å; R111-Y336 HydrophobicContact CG-CD2 4.44Å; R111-Y336 HydrophobicContact CG-CE1 4.13Å; R111-Y336 HydrophobicContact CG-CG 3.97Å; T115-Y336 WeakPolarHBondContact OG1-CE1 3.21Å; T115-Y336 PolarHBondContact OG1-OH 2.77Å; Y186-Y336 WeakPolarHBondContact CD1-O 3.23Å; L324-Y336 HydrophobicContact CD2-CE2 4.14Å; L324-Y336 HydrophobicContact CG-CE2 3.97Å; A325-Y336 HydrophobicContact CB-CE2 4.33Å; Y328-Y336 HydrophobicContact CD1-CD2 4.35Å; Y328-Y336 HydrophobicContact CD2-CD2 4.41Å; Y328-Y336 HydrophobicContact CG-CD2 4.07Å; Y336-P338 HydrophobicContact CE1-CB 4.12Å; Y336-P338 VanDerWaalsContact O-CD 3.28Å; Y336-P338 WeakPolarHBondContact O-CD 3.44Å | ||
| 337 | D | 86.7 | Confident | 81.5 | Confident | 26 Ų | 26 | 59 Ų | 59 | 14% | 0.139 | 31% | 0.311 | C | S | . | . | trans | -108.4 | 98.2 | -173.8 | 177.9 | 10.5 | 0 | 0 | 0 | 111 | Y186 K194 P335 I339 N340 A341 | Y186-D337 HydrophobicContact CG-CB 4.49Å; K194-D337 WeakPolarHBondContact CE-OD1 3.5Å; K194-D337 VanDerWaalsContact CE-OD2 3.27Å; K194-D337 WeakPolarHBondContact CE-OD2 3.25Å; K194-D337 IonicContact NZ-OD1 3.45Å; K194-D337 PolarHBondContact NZ-OD1 2.88Å; K194-D337 IonicContact NZ-OD2 3.39Å; K194-D337 PolarHBondContact NZ-OD2 3.07Å; P335-D337 PolarHBondContact O-N 3.02Å; D337-I339 VanDerWaalsContact C-N 3.3Å; D337-I339 PolarHBondContact O-N 3.28Å; D337-I339 PolarHBondContact OD1-N 3.09Å; D337-N340 HydrophobicContact CB-CB 4.38Å; D337-N340 PolarHBondContact OD1-N 3.48Å; D337-N340 WeakPolarHBondContact OD2-CB 3.35Å; D337-A341 WeakPolarHBondContact O-CB 3.16Å; D337-A341 PolarHBondContact O-N 2.97Å | ||
| 338 | P | 86.2 | Confident | 81.7 | Confident | 1 Ų | 1 | 53.8 Ų | 53.8 | 1% | 0.006 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -69.2 | -28.3 | -177.7 | 28.4 | -34.7 | 0 | 0 | 0 | 112.6 | R114 Y118 Y186 Y336 A341 Q342 | R114-P338 HydrophobicContact CB-CB 4.16Å; R114-P338 HydrophobicContact CB-CG 4.48Å; Y118-P338 HydrophobicContact CD2-CB 3.89Å; Y118-P338 HydrophobicContact CD2-CG 3.66Å; Y118-P338 HydrophobicContact CE2-CB 4.39Å; Y118-P338 HydrophobicContact CE2-CG 3.66Å; Y186-P338 HydrophobicContact CE1-CG 4.24Å; Y186-P338 HydrophobicContact CE2-CG 3.88Å; Y336-P338 HydrophobicContact CE1-CB 4.12Å; Y336-P338 VanDerWaalsContact O-CD 3.28Å; Y336-P338 WeakPolarHBondContact O-CD 3.44Å; P338-A341 PolarHBondContact O-N 2.71Å; P338-Q342 WeakPolarHBondContact O-CG 3.31Å; P338-Q342 PolarHBondContact O-N 3.44Å; P338-Q342 VanDerWaalsContact O-N 3.09Å |
| 339 | I | 87.7 | Confident | 81.9 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -71 | -41.2 | -176.4 | -67.5 | 171.9 | 0 | 0 | 0 | 110.7 | Y118 C181 Y186 K194 Q195 W198 D337 Q342 M343 | Y118-I339 HydrophobicContact CD1-CD1 3.98Å; Y118-I339 HydrophobicContact CD1-CG1 3.58Å; Y118-I339 HydrophobicContact CD2-CG1 3.98Å; Y118-I339 HydrophobicContact CE1-CD1 3.67Å; Y118-I339 HydrophobicContact CE1-CG1 3.76Å; Y118-I339 HydrophobicContact CE2-CD1 4.49Å; Y118-I339 HydrophobicContact CE2-CG1 4.12Å; Y118-I339 HydrophobicContact CG-CG1 3.7Å; C181-I339 VanDerWaalsContact SG-CG2 3.54Å; Y186-I339 HydrophobicContact CD2-CD1 4.09Å; Y186-I339 HydrophobicContact CE2-CD1 4.06Å; Y186-I339 HydrophobicContact CE2-CG1 4.42Å; K194-I339 HydrophobicContact CD-CD1 4.36Å; K194-I339 HydrophobicContact CG-CD1 3.91Å; Q195-I339 HydrophobicContact CG-CD1 4.3Å; W198-I339 HydrophobicContact CB-CD1 4.39Å; W198-I339 HydrophobicContact CB-CG2 3.98Å; W198-I339 HydrophobicContact CG-CG2 4Å; D337-I339 VanDerWaalsContact C-N 3.3Å; D337-I339 PolarHBondContact O-N 3.28Å; D337-I339 PolarHBondContact OD1-N 3.09Å; I339-Q342 WeakPolarHBondContact O-CG 3.33Å; I339-Q342 PolarHBondContact O-NE2 3.34Å; I339-Q342 VanDerWaalsContact O-NE2 3.11Å; I339-M343 PolarHBondContact O-N 3.47Å |
| 340 | N | 89.5 | Confident | 82.5 | Confident | 60 Ų | 60 | 48.3 Ų | 48.3 | 32% | 0.321 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -72.2 | -37.8 | 175.3 | -173.4 | 20.4 | 0 | 0 | 0 | 111.4 | Q182 D337 Q342 M343 | Q182-N340 WeakPolarHBondContact CG-OD1 3.15Å; Q182-N340 PolarHBondContact OE1-OD1 3Å; D337-N340 HydrophobicContact CB-CB 4.38Å; D337-N340 PolarHBondContact OD1-N 3.48Å; D337-N340 WeakPolarHBondContact OD2-CB 3.35Å; N340-Q342 VanDerWaalsContact C-N 3.34Å; N340-Q342 PolarHBondContact O-N 3.26Å; N340-M343 WeakPolarHBondContact O-CB 3.31Å; N340-M343 PolarHBondContact O-N 2.73Å |
| 341 | A | 86.3 | Confident | 83.5 | Confident | 10 Ų | 10 | 43.5 Ų | 43.5 | 8% | 0.083 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.2 | -41.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | T115 V321 L324 D337 P338 M343 | T115-A341 HydrophobicContact CG2-CB 3.78Å; V321-A341 HydrophobicContact CG2-CB 4.2Å; V321-A341 WeakPolarHBondContact CG2-O 3.09Å; L324-A341 HydrophobicContact CD2-CB 4.19Å; D337-A341 WeakPolarHBondContact O-CB 3.16Å; D337-A341 PolarHBondContact O-N 2.97Å; P338-A341 PolarHBondContact O-N 2.71Å; A341-M343 VanDerWaalsContact C-N 3.33Å; A341-M343 PolarHBondContact O-N 2.99Å |
| 342 | Q | 86 | Confident | 84.5 | Confident | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 19% | 0.186 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78.8 | -9.1 | 178.6 | 61.1 | 92.6 | 34.2 | 0 | 0 | 114.9 | T115 L119 P338 I339 N340 G344 I345 Y346 | T115-Q342 HydrophobicContact CG2-CB 3.64Å; T115-Q342 HydrophobicContact CG2-CG 4.49Å; L119-Q342 HydrophobicContact CB-CB 4.02Å; L119-Q342 HydrophobicContact CB-CG 4.49Å; P338-Q342 WeakPolarHBondContact O-CG 3.31Å; P338-Q342 PolarHBondContact O-N 3.44Å; P338-Q342 VanDerWaalsContact O-N 3.09Å; I339-Q342 WeakPolarHBondContact O-CG 3.33Å; I339-Q342 PolarHBondContact O-NE2 3.34Å; I339-Q342 VanDerWaalsContact O-NE2 3.11Å; N340-Q342 VanDerWaalsContact C-N 3.34Å; N340-Q342 PolarHBondContact O-N 3.26Å; Q342-G344 VanDerWaalsContact C-N 3.33Å; Q342-G344 PolarHBondContact O-N 3.15Å; Q342-I345 PolarHBondContact O-N 3.4Å; Q342-Y346 VanDerWaalsContact O-CB 3.23Å; Q342-Y346 WeakPolarHBondContact O-CB 3.25Å; Q342-Y346 PolarHBondContact O-N 2.82Å |
| 343 | M | 88.3 | Confident | 85.4 | Confident | 7 Ų | 7 | 35 Ų | 35 | 3% | 0.034 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -59.5 | -41.2 | -171.6 | -170.7 | 63.5 | 75.2 | 0 | 0 | 113.1 | C181 H201 I339 N340 A341 Y346 L347 | C181-M343 HydrophobicContact CB-CE 4.02Å; H201-M343 PolarHBondContact NE2-SD 2.95Å; I339-M343 PolarHBondContact O-N 3.47Å; N340-M343 WeakPolarHBondContact O-CB 3.31Å; N340-M343 PolarHBondContact O-N 2.73Å; A341-M343 VanDerWaalsContact C-N 3.33Å; A341-M343 PolarHBondContact O-N 2.99Å; M343-Y346 HydrophobicContact SD-CD1 4.26Å; M343-L347 WeakPolarHBondContact O-CG 3.45Å; M343-L347 PolarHBondContact O-N 3.41Å |
| 344 | G | 86.2 | Confident | 86.3 | Confident | 18 Ų | 18 | 28.1 Ų | 28.1 | 19% | 0.186 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -64.1 | -54 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | D317 Q342 Y346 L347 D348 | D317-G344 VanDerWaalsContact OD2-CA 3.23Å; D317-G344 WeakPolarHBondContact OD2-CA 3.09Å; Q342-G344 VanDerWaalsContact C-N 3.33Å; Q342-G344 PolarHBondContact O-N 3.15Å; G344-Y346 PolarHBondContact O-N 3.19Å; G344-L347 PolarHBondContact O-N 3.24Å; G344-L347 VanDerWaalsContact O-N 3.09Å; G344-D348 PolarHBondContact O-N 2.98Å |
| 345 | I | 87.4 | Confident | 87 | Confident | 2 Ų | 2 | 20.6 Ų | 20.6 | 1% | 0.01 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -55.7 | -40.3 | 177.4 | -54.6 | 177.5 | 0 | 0 | 0 | 111.3 | L119 D317 V321 Q342 T349 | L119-I345 HydrophobicContact CD1-CB 4.39Å; L119-I345 HydrophobicContact CD1-CG2 4.14Å; L119-I345 HydrophobicContact CD2-CB 4.31Å; L119-I345 HydrophobicContact CD2-CG2 3.53Å; D317-I345 HydrophobicContact CB-CG1 3.78Å; V321-I345 HydrophobicContact CB-CD1 4.36Å; V321-I345 HydrophobicContact CG2-CD1 3.75Å; Q342-I345 PolarHBondContact O-N 3.4Å; I345-T349 VanDerWaalsContact O-CB 3.31Å; I345-T349 WeakPolarHBondContact O-CB 3.24Å; I345-T349 PolarHBondContact O-N 2.88Å; I345-T349 PolarHBondContact O-OG1 3.25Å |
| 346 | Y | 89.2 | Confident | 87.4 | Confident | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -63.5 | -49.3 | 177.9 | 170.8 | -111 | 0 | 0 | 0 | 112 | L119 L123 T126 H201 L205 Q342 M343 G344 D348 T349 I350 | L119-Y346 VanDerWaalsContact CD1-CA 3.49Å; L119-Y346 HydrophobicContact CD1-CD2 4.3Å; L119-Y346 HydrophobicContact CD1-CG 4.45Å; L123-Y346 HydrophobicContact CD2-CD2 3.99Å; L123-Y346 HydrophobicContact CD2-CE2 4.07Å; L123-Y346 HydrophobicContact CG-CD2 4.42Å; T126-Y346 PolarHBondContact OG1-OH 2.93Å; H201-Y346 AromaticContact CD2-CE1 3.84Å; H201-Y346 AromaticContact NE2-CE1 3.82Å; L205-Y346 HydrophobicContact CD1-CD1 4.26Å; L205-Y346 HydrophobicContact CD1-CE1 3.19Å; L205-Y346 WeakPolarHBondContact CD1-OH 3.34Å; Q342-Y346 VanDerWaalsContact O-CB 3.23Å; Q342-Y346 WeakPolarHBondContact O-CB 3.25Å; Q342-Y346 PolarHBondContact O-N 2.82Å; M343-Y346 HydrophobicContact SD-CD1 4.26Å; G344-Y346 PolarHBondContact O-N 3.19Å; Y346-D348 PolarHBondContact O-N 3.48Å; Y346-T349 PolarHBondContact O-N 3.01Å; Y346-I350 HydrophobicContact CD2-CG1 4.24Å; Y346-I350 HydrophobicContact CE2-CD1 4.14Å; Y346-I350 HydrophobicContact CE2-CG1 3.8Å; Y346-I350 WeakPolarHBondContact O-CG1 3.4Å; Y346-I350 PolarHBondContact O-N 3.12Å |
| 347 | L | 89.4 | Confident | 87.6 | Confident | 54 Ų | 54 | 17.1 Ų | 17.1 | 28% | 0.283 | 9% | 0.092 | S | C | . | . | H | α-helix | trans | -63.6 | -40.4 | 177.3 | -70.5 | 175.6 | 0 | 0 | 0 | 111.9 | V174 L205 M343 G344 I350 N351 | V174-L347 HydrophobicContact CG1-CD2 4.4Å; L205-L347 HydrophobicContact CD1-CD2 3.91Å; M343-L347 WeakPolarHBondContact O-CG 3.45Å; M343-L347 PolarHBondContact O-N 3.41Å; G344-L347 PolarHBondContact O-N 3.24Å; G344-L347 VanDerWaalsContact O-N 3.09Å; L347-I350 PolarHBondContact O-N 3.34Å; L347-N351 WeakPolarHBondContact O-CB 3.28Å; L347-N351 PolarHBondContact O-N 3.25Å; L347-N351 PolarHBondContact O-ND2 3.37Å |
| 348 | D | 87.7 | Confident | 87.5 | Confident | 11 Ų | 11 | 18.6 Ų | 18.6 | 6% | 0.059 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -62.4 | -43.1 | 174.9 | -72.2 | -18.3 | 0 | 0 | 0 | 111.8 | F310 F313 L314 G344 Y346 N351 I352 | F310-D348 WeakPolarHBondContact CD1-OD1 3.27Å; F313-D348 WeakPolarHBondContact CB-OD2 3.45Å; L314-D348 HydrophobicContact CB-CB 4.38Å; L314-D348 PolarHBondContact N-OD2 2.89Å; G344-D348 PolarHBondContact O-N 2.98Å; Y346-D348 PolarHBondContact O-N 3.48Å; D348-N351 WeakPolarHBondContact O-CB 3.35Å; D348-N351 PolarHBondContact O-N 3.45Å; D348-I352 WeakPolarHBondContact O-CB 3.2Å; D348-I352 WeakPolarHBondContact O-CD1 3.3Å; D348-I352 WeakPolarHBondContact O-CG1 3.3Å; D348-I352 PolarHBondContact O-N 3.21Å |
| 349 | T | 86.7 | Confident | 87.3 | Confident | 6 Ų | 6 | 21.3 Ų | 21.3 | 4% | 0.037 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -60.9 | -47.9 | 177.3 | -61.2 | 0 | 0 | 0 | 0 | 111.4 | L123 T227 V231 I345 Y346 N351 I352 F353 | L123-T349 HydrophobicContact CD1-CG2 3.99Å; L123-T349 HydrophobicContact CD2-CG2 3.65Å; L123-T349 HydrophobicContact CG-CG2 4.48Å; T227-T349 HydrophobicContact CG2-CG2 4.3Å; V231-T349 HydrophobicContact CG2-CG2 3.87Å; I345-T349 VanDerWaalsContact O-CB 3.31Å; I345-T349 WeakPolarHBondContact O-CB 3.24Å; I345-T349 PolarHBondContact O-N 2.88Å; I345-T349 PolarHBondContact O-OG1 3.25Å; Y346-T349 PolarHBondContact O-N 3.01Å; T349-N351 VanDerWaalsContact C-N 3.34Å; T349-I352 PolarHBondContact O-N 3.02Å; T349-F353 WeakPolarHBondContact O-CB 3.29Å; T349-F353 PolarHBondContact O-N 3.34Å |
| 350 | I | 88.6 | Confident | 87 | Confident | 11 Ų | 11 | 23.8 Ų | 23.8 | 6% | 0.056 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -63.8 | -41.7 | 176.9 | -67.1 | -59.7 | 0 | 0 | 0 | 110.9 | L123 T126 L205 I209 Y346 L347 F353 M354 | L123-I350 HydrophobicContact CD2-CD1 3.84Å; L123-I350 HydrophobicContact CD2-CG1 4.37Å; T126-I350 HydrophobicContact CG2-CD1 3.98Å; L205-I350 HydrophobicContact CD2-CG2 4.42Å; I209-I350 HydrophobicContact CD1-CD1 4.01Å; I209-I350 HydrophobicContact CD1-CG2 3.77Å; I209-I350 HydrophobicContact CG1-CG2 4.45Å; Y346-I350 HydrophobicContact CD2-CG1 4.24Å; Y346-I350 HydrophobicContact CE2-CD1 4.14Å; Y346-I350 HydrophobicContact CE2-CG1 3.8Å; Y346-I350 WeakPolarHBondContact O-CG1 3.4Å; Y346-I350 PolarHBondContact O-N 3.12Å; L347-I350 PolarHBondContact O-N 3.34Å; I350-F353 WeakPolarHBondContact O-CB 3.12Å; I350-F353 PolarHBondContact O-N 3.26Å; I350-M354 HydrophobicContact CG2-CE 3.83Å; I350-M354 HydrophobicContact CG2-SD 4.32Å; I350-M354 WeakPolarHBondContact O-CG 3.34Å; I350-M354 PolarHBondContact O-N 3.37Å |
| 351 | N | 89 | Confident | 86.4 | Confident | 39 Ų | 39 | 22.7 Ų | 22.7 | 21% | 0.209 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -58.3 | -52.7 | 175.3 | -84.9 | -38.9 | 0 | 0 | 0 | 111.3 | F310 L347 D348 T349 F353 M354 R355 | F310-N351 HydrophobicContact CD1-CB 4.13Å; F310-N351 HydrophobicContact CD2-CB 4.42Å; F310-N351 HydrophobicContact CE1-CB 4.44Å; F310-N351 HydrophobicContact CG-CB 4.1Å; L347-N351 WeakPolarHBondContact O-CB 3.28Å; L347-N351 PolarHBondContact O-N 3.25Å; L347-N351 PolarHBondContact O-ND2 3.37Å; D348-N351 WeakPolarHBondContact O-CB 3.35Å; D348-N351 PolarHBondContact O-N 3.45Å; T349-N351 VanDerWaalsContact C-N 3.34Å; N351-F353 VanDerWaalsContact C-N 3.29Å; N351-F353 PolarHBondContact O-N 3.34Å; N351-M354 PolarHBondContact O-N 3.06Å; N351-R355 VanDerWaalsContact CG-NH2 3.33Å; N351-R355 WeakPolarHBondContact O-CD 3.34Å; N351-R355 WeakPolarHBondContact O-CG 3.4Å; N351-R355 PolarHBondContact O-N 3.41Å; N351-R355 PolarHBondContact O-NE 2.85Å; N351-R355 PolarHBondContact OD1-NH2 2.77Å; N351-R355 VanDerWaalsContact OD1-NH2 3.14Å |
| 352 | I | 88.8 | Confident | 85.4 | Confident | 0 Ų | 0 | 24.9 Ų | 24.9 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -58.1 | -43.5 | 178.1 | -65.6 | 161.7 | 0 | 0 | 0 | 110.2 | T227 V230 L307 F310 L314 D348 T349 R355 I356 | T227-I352 HydrophobicContact CG2-CB 4.04Å; T227-I352 HydrophobicContact CG2-CG2 3.77Å; V230-I352 HydrophobicContact CB-CG2 4.45Å; V230-I352 HydrophobicContact CG1-CD1 4.22Å; V230-I352 HydrophobicContact CG1-CG2 4.24Å; L307-I352 HydrophobicContact CD1-CG2 4.1Å; F310-I352 HydrophobicContact CB-CD1 4.32Å; F310-I352 HydrophobicContact CB-CG1 3.78Å; L314-I352 HydrophobicContact CD1-CD1 3.9Å; D348-I352 WeakPolarHBondContact O-CB 3.2Å; D348-I352 WeakPolarHBondContact O-CD1 3.3Å; D348-I352 WeakPolarHBondContact O-CG1 3.3Å; D348-I352 PolarHBondContact O-N 3.21Å; T349-I352 PolarHBondContact O-N 3.02Å; I352-R355 PolarHBondContact O-N 2.73Å; I352-I356 HydrophobicContact CG2-CD1 3.71Å; I352-I356 HydrophobicContact CG2-CG1 4.35Å; I352-I356 VanDerWaalsContact O-CG1 3.31Å; I352-I356 WeakPolarHBondContact O-CG1 3.48Å; I352-I356 PolarHBondContact O-N 2.83Å |
| 353 | F | 88.8 | Confident | 83.8 | Confident | 32 Ų | 32 | 27.3 Ų | 27.3 | 14% | 0.14 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -57.4 | -53.6 | 176.1 | 170.2 | -106.6 | 0 | 0 | 0 | 112.8 | I209 L220 A223 A224 T227 T349 I350 N351 R355 I356 A357 | I209-F353 HydrophobicContact CG2-CE1 3.9Å; L220-F353 HydrophobicContact CB-CZ 4.4Å; L220-F353 HydrophobicContact CD2-CZ 4.03Å; A223-F353 HydrophobicContact CB-CD2 4.16Å; A223-F353 HydrophobicContact CB-CE2 3.89Å; A224-F353 HydrophobicContact CB-CD2 4.26Å; A224-F353 HydrophobicContact CB-CE2 3.99Å; T227-F353 HydrophobicContact CG2-CB 4.04Å; T227-F353 VanDerWaalsContact OG1-CA 3.29Å; T227-F353 WeakPolarHBondContact OG1-CA 3.48Å; T349-F353 WeakPolarHBondContact O-CB 3.29Å; T349-F353 PolarHBondContact O-N 3.34Å; I350-F353 WeakPolarHBondContact O-CB 3.12Å; I350-F353 PolarHBondContact O-N 3.26Å; N351-F353 VanDerWaalsContact C-N 3.29Å; N351-F353 PolarHBondContact O-N 3.34Å; F353-R355 VanDerWaalsContact C-N 3.26Å; F353-R355 PolarHBondContact O-N 3.37Å; F353-I356 PolarHBondContact O-N 3.28Å; F353-A357 WeakPolarHBondContact O-CB 3.48Å; F353-A357 PolarHBondContact O-N 3.48Å |
| 354 | M | 87.4 | Confident | 81.4 | Confident | 36 Ų | 36 | 29.3 Ų | 29.3 | 18% | 0.177 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -59.5 | -39.1 | -179.2 | -68.8 | -173.5 | -64.5 | 0 | 0 | 111.6 | I209 L212 I350 N351 A357 I358 | I209-M354 HydrophobicContact CG1-CG 4.3Å; I209-M354 HydrophobicContact CG1-SD 4.04Å; L212-M354 HydrophobicContact CD1-CB 4.2Å; L212-M354 HydrophobicContact CD1-CG 3.74Å; L212-M354 HydrophobicContact CD1-SD 4.41Å; I350-M354 HydrophobicContact CG2-CE 3.83Å; I350-M354 HydrophobicContact CG2-SD 4.32Å; I350-M354 WeakPolarHBondContact O-CG 3.34Å; I350-M354 PolarHBondContact O-N 3.37Å; N351-M354 PolarHBondContact O-N 3.06Å; M354-A357 PolarHBondContact O-N 3.17Å; M354-I358 WeakPolarHBondContact O-CB 3.41Å; M354-I358 WeakPolarHBondContact O-CD1 3.47Å; M354-I358 WeakPolarHBondContact O-CG1 3.34Å; M354-I358 PolarHBondContact O-N 3.16Å |
| 355 | R | 87.6 | Confident | 79.1 | Confident | 33 Ų | 33 | 31.7 Ų | 31.7 | 13% | 0.125 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -66.3 | -44.4 | 178.7 | -65.5 | 146.4 | -152.2 | -87.8 | -1.4 | 111.9 | V302 L307 F310 N351 I352 F353 A357 I358 L359 | V302-R355 PolarHBondContact O-NH1 3.36Å; L307-R355 HydrophobicContact CD1-CB 4.18Å; F310-R355 VanDerWaalsContact CD2-NH2 3.3Å; N351-R355 VanDerWaalsContact CG-NH2 3.33Å; N351-R355 WeakPolarHBondContact O-CD 3.34Å; N351-R355 WeakPolarHBondContact O-CG 3.4Å; N351-R355 PolarHBondContact O-N 3.41Å; N351-R355 PolarHBondContact O-NE 2.85Å; N351-R355 PolarHBondContact OD1-NH2 2.77Å; N351-R355 VanDerWaalsContact OD1-NH2 3.14Å; I352-R355 PolarHBondContact O-N 2.73Å; F353-R355 VanDerWaalsContact C-N 3.26Å; F353-R355 PolarHBondContact O-N 3.37Å; R355-A357 VanDerWaalsContact C-N 3.35Å; R355-I358 PolarHBondContact O-N 3.37Å; R355-L359 WeakPolarHBondContact O-CB 3.07Å; R355-L359 PolarHBondContact O-N 3.12Å |
| 356 | I | 85.4 | Confident | 76.9 | Confident | 13 Ų | 13 | 36.9 Ų | 36.9 | 7% | 0.067 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -65.8 | -40.9 | 176.7 | -66.3 | 174.3 | 0 | 0 | 0 | 110.3 | A223 Y226 L307 I352 F353 L359 L360 | A223-I356 HydrophobicContact CB-CB 4.46Å; A223-I356 HydrophobicContact CB-CG2 3.91Å; Y226-I356 HydrophobicContact CD2-CG2 3.94Å; L307-I356 HydrophobicContact CD1-CD1 4.1Å; L307-I356 HydrophobicContact CD1-CG1 3.53Å; I352-I356 HydrophobicContact CG2-CD1 3.71Å; I352-I356 HydrophobicContact CG2-CG1 4.35Å; I352-I356 VanDerWaalsContact O-CG1 3.31Å; I352-I356 WeakPolarHBondContact O-CG1 3.48Å; I352-I356 PolarHBondContact O-N 2.83Å; F353-I356 PolarHBondContact O-N 3.28Å; I356-L359 PolarHBondContact O-N 3.45Å; I356-L360 HydrophobicContact CG2-CD1 3.85Å; I356-L360 HydrophobicContact CG2-CG 4.3Å; I356-L360 WeakPolarHBondContact O-CB 3.39Å; I356-L360 VanDerWaalsContact O-CG 3.29Å; I356-L360 WeakPolarHBondContact O-CG 3.45Å; I356-L360 PolarHBondContact O-N 2.83Å |
| 357 | A | 86.7 | Confident | 74.4 | Confident | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -60.6 | -47.8 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | L220 A223 F353 M354 R355 L360 A361 | L220-A357 HydrophobicContact CD2-CB 3.74Å; A223-A357 HydrophobicContact CB-CB 3.97Å; F353-A357 WeakPolarHBondContact O-CB 3.48Å; F353-A357 PolarHBondContact O-N 3.48Å; M354-A357 PolarHBondContact O-N 3.17Å; R355-A357 VanDerWaalsContact C-N 3.35Å; A357-L360 PolarHBondContact O-N 3.15Å; A357-A361 WeakPolarHBondContact O-CB 3.35Å; A357-A361 PolarHBondContact O-N 3.07Å |
| 358 | I | 84.3 | Confident | 71.8 | Confident | 58 Ų | 58 | 56.4 Ų | 56.4 | 30% | 0.297 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -63.1 | -42.7 | 176.5 | -69.9 | 166.7 | 0 | 0 | 0 | 110.9 | L212 Y299 T303 M354 R355 L360 A361 G362 | L212-I358 HydrophobicContact CD2-CG1 4.27Å; Y299-I358 HydrophobicContact CE2-CG2 4.44Å; Y299-I358 WeakPolarHBondContact OH-CG2 3.4Å; T303-I358 HydrophobicContact CG2-CG2 4.28Å; M354-I358 WeakPolarHBondContact O-CB 3.41Å; M354-I358 WeakPolarHBondContact O-CD1 3.47Å; M354-I358 WeakPolarHBondContact O-CG1 3.34Å; M354-I358 PolarHBondContact O-N 3.16Å; R355-I358 PolarHBondContact O-N 3.37Å; I358-L360 PolarHBondContact O-N 3.13Å; I358-A361 PolarHBondContact O-N 3.38Å; I358-G362 PolarHBondContact O-N 3.44Å |
| 359 | L | 83 | Confident | 69.2 | Low | 58 Ų | 58 | 70.9 Ų | 70.9 | 30% | 0.304 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -61.2 | -42.7 | 177.3 | -179.7 | 68.8 | 0 | 0 | 0 | 112 | Y304 R355 I356 A361 G363 | Y304-L359 HydrophobicContact CD1-CD1 4.28Å; Y304-L359 HydrophobicContact CE1-CD1 3.37Å; Y304-L359 HydrophobicContact CE1-CD2 4.26Å; Y304-L359 HydrophobicContact CE1-CG 4.47Å; Y304-L359 HydrophobicContact CE2-CD1 4.17Å; Y304-L359 WeakPolarHBondContact OH-CD1 3.45Å; R355-L359 WeakPolarHBondContact O-CB 3.07Å; R355-L359 PolarHBondContact O-N 3.12Å; I356-L359 PolarHBondContact O-N 3.45Å; L359-A361 VanDerWaalsContact C-N 3.34Å; L359-G363 WeakPolarHBondContact O-CA 3.29Å; L359-G363 PolarHBondContact O-N 3.21Å |
| 360 | L | 81.1 | Confident | 68.4 | Low | 52 Ų | 52 | 74.1 Ų | 74.1 | 27% | 0.272 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -68.2 | -34.9 | 176.9 | -73.5 | 168.7 | 0 | 0 | 0 | 112.1 | L219 R222 A223 Y226 I356 A357 I358 | L219-L360 HydrophobicContact CD1-CB 4.18Å; L219-L360 HydrophobicContact CD2-CB 3.85Å; L219-L360 HydrophobicContact CG-CB 3.91Å; R222-L360 HydrophobicContact CB-CD1 4.33Å; A223-L360 HydrophobicContact CB-CD1 3.77Å; Y226-L360 HydrophobicContact CD2-CD1 4Å; Y226-L360 HydrophobicContact CE2-CD1 4.02Å; Y226-L360 HydrophobicContact CE2-CD2 3.99Å; I356-L360 HydrophobicContact CG2-CD1 3.85Å; I356-L360 HydrophobicContact CG2-CG 4.3Å; I356-L360 WeakPolarHBondContact O-CB 3.39Å; I356-L360 VanDerWaalsContact O-CG 3.29Å; I356-L360 WeakPolarHBondContact O-CG 3.45Å; I356-L360 PolarHBondContact O-N 2.83Å; A357-L360 PolarHBondContact O-N 3.15Å; I358-L360 PolarHBondContact O-N 3.13Å |
| 361 | A | 76.7 | Confident | 67.3 | Low | 37 Ų | 37 | 77.4 Ų | 77.4 | 31% | 0.306 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -69.9 | -46.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | L215 L219 A357 I358 L359 | L215-A361 HydrophobicContact CB-CB 4.49Å; L215-A361 HydrophobicContact CD1-CB 3.84Å; L215-A361 HydrophobicContact CD2-CB 3.66Å; L215-A361 HydrophobicContact CG-CB 4.2Å; L219-A361 HydrophobicContact CD1-CB 4.33Å; A357-A361 WeakPolarHBondContact O-CB 3.35Å; A357-A361 PolarHBondContact O-N 3.07Å; I358-A361 PolarHBondContact O-N 3.38Å; L359-A361 VanDerWaalsContact C-N 3.34Å |
| 362 | G | 66 | Low | 66.1 | Low | 56 Ų | 56 | 79.6 Ų | 79.6 | 58% | 0.577 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -71.6 | -31.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | I358 G364 | I358-G362 PolarHBondContact O-N 3.44Å; G362-G364 PolarHBondContact O-N 3.03Å |
| 363 | G | 52.4 | Low | 64.8 | Low | 50 Ų | 50 | 84.2 Ų | 84.2 | 52% | 0.515 | 45% | 0.453 | S | S | . | . | G | 310 helix | trans | -71.3 | -12.4 | 179 | 0 | 0 | 0 | 0 | 0 | 114.9 | L359 G365 | L359-G363 WeakPolarHBondContact O-CA 3.29Å; L359-G363 PolarHBondContact O-N 3.21Å; G363-G365 VanDerWaalsContact C-N 3.27Å; G363-G365 PolarHBondContact O-N 2.91Å |
| 364 | G | 37.4 | Very low | 63.3 | Low | 50 Ų | 50 | 87.5 Ų | 87.5 | 52% | 0.515 | 47% | 0.473 | S | S | . | . | G | 310 helix | trans | -71.6 | -15.1 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115 | G362 S366 R367 | G362-G364 PolarHBondContact O-N 3.03Å; G364-S366 VanDerWaalsContact C-N 3.26Å; G364-S366 PolarHBondContact O-N 3.46Å; G364-R367 PolarHBondContact O-N 3.06Å |
| 365 | G | 36.7 | Very low | 61.7 | Low | 67 Ų | 67 | 90.9 Ų | 90.9 | 69% | 0.691 | 49% | 0.492 | S | S | * | . | G | 310 helix | trans | -67.5 | -17.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | G363 | G363-G365 VanDerWaalsContact C-N 3.27Å; G363-G365 PolarHBondContact O-N 2.91Å |
| 366 | S | 43 | Very low | 59.8 | Low | 111 Ų | 111 | 95.1 Ų | 95.1 | 78% | 0.776 | 52% | 0.519 | S | S | * | . | G | 310 helix | trans | -85.9 | -6.6 | -177.6 | 179.1 | 0 | 0 | 0 | 0 | 114.1 | G364 | G364-S366 VanDerWaalsContact C-N 3.26Å; G364-S366 PolarHBondContact O-N 3.46Å |
| 367 | R | 36.7 | Very low | 57.8 | Low | 229 Ų | 229 | 101.4 Ų | 101.4 | 86% | 0.864 | 55% | 0.553 | S | S | * | * | G | 310 helix | trans | -104.4 | 9 | -173.1 | -142.1 | 173.4 | -169.6 | 171.2 | 3.2 | 117.1 | G364 | G364-R367 PolarHBondContact O-N 3.06Š|
| 368 | R | 34.5 | Very low | 55.4 | Low | 236 Ų | 236 | 109.8 Ų | 109.8 | 89% | 0.891 | 60% | 0.599 | S | S | * | * | trans | -106.3 | 84.3 | 158.2 | -73.7 | -179.6 | 170.9 | 168.7 | -3.2 | 105.8 | ||||
| 369 | R | 33.7 | Very low | 52.8 | Low | 314 Ų | 314 | 114.5 Ų | 114.5 | 100% | 1.185 | 63% | 0.627 | S | S | * | * | 38.8 | 0 | 89.2 | -83 | -165.3 | -178.9 | -176 | 0.5 | 113.2 |
Retrieved 369 of 369 residues in 205 ms
(Link to these results)