| 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 | 36.7 | Very low | 25.5 | Very low | 252 Ų | 252 | 153 Ų | 153 | 100% | 1.241 | 82% | 0.823 | S | S | * | * | 0 | 91.8 | 0 | -127.2 | 163.2 | 172.3 | 0 | 0 | 106.3 | |||||
| 2 | S | 24.6 | Very low | 25.6 | Very low | 121 Ų | 121 | 151.5 Ų | 151.5 | 85% | 0.846 | 81% | 0.807 | S | S | * | * | trans | -83.3 | 131 | -179.2 | -59.1 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 3 | C | 24.4 | Very low | 25.7 | Very low | 135 Ų | 135 | 156.5 Ų | 156.5 | 91% | 0.912 | 81% | 0.811 | S | S | * | * | trans | -120.9 | 132 | 166.8 | -102.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 4 | H | 24.5 | Very low | 25.6 | Very low | 187 Ų | 187 | 151.1 Ų | 151.1 | 87% | 0.866 | 80% | 0.801 | S | S | * | * | trans | -66.9 | 147.6 | -170.9 | -95.1 | -98.8 | 0 | 0 | 0 | 113.9 | ||||
| 5 | V | 24.1 | Very low | 25.6 | Very low | 112 Ų | 112 | 153.7 Ų | 153.7 | 68% | 0.679 | 81% | 0.806 | S | S | * | * | trans | -75.4 | 135.7 | 164.3 | 174.4 | 0 | 0 | 0 | 0 | 109.4 | F7 | V5-F7 HydrophobicContact CG1-CD2 3.57Å; V5-F7 HydrophobicContact CG1-CE2 3.91Å | ||
| 6 | V | 24.3 | Very low | 25.6 | Very low | 136 Ų | 136 | 152.1 Ų | 152.1 | 82% | 0.824 | 81% | 0.812 | S | S | * | * | trans | -128.9 | 116.2 | 158.6 | 179.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 7 | F | 24.1 | Very low | 25.6 | Very low | 170 Ų | 170 | 149.1 Ų | 149.1 | 75% | 0.746 | 81% | 0.813 | S | S | * | * | trans | -90.9 | 138.2 | 167.8 | -94.2 | -94.8 | 0 | 0 | 0 | 109.1 | V5 | V5-F7 HydrophobicContact CG1-CD2 3.57Å; V5-F7 HydrophobicContact CG1-CE2 3.91Å | ||
| 8 | T | 25.6 | Very low | 25.6 | Very low | 142 Ų | 142 | 147 Ų | 147 | 87% | 0.871 | 81% | 0.811 | S | S | * | * | trans | -144.6 | 122.8 | 145.4 | 43.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 9 | D | 23.4 | Very low | 25.7 | Very low | 137 Ų | 137 | 147.9 Ų | 147.9 | 73% | 0.733 | 81% | 0.813 | S | S | * | * | trans | -120.3 | 143.5 | -175.7 | -163.4 | 1.5 | 0 | 0 | 0 | 110 | ||||
| 10 | S | 24.6 | Very low | 25.7 | Very low | 75 Ų | 75 | 148 Ų | 148 | 52% | 0.524 | 81% | 0.812 | S | S | . | * | trans | 54.6 | 133.6 | 150.9 | 20.1 | 0 | 0 | 0 | 0 | 125.8 | ||||
| 11 | R | 24.1 | Very low | 25.8 | Very low | 216 Ų | 216 | 148.6 Ų | 148.6 | 82% | 0.815 | 81% | 0.814 | S | S | * | * | 75.7 | 146.6 | 128.2 | -73.7 | 169.2 | 177.3 | -152.6 | 9 | 117.3 | |||||
| 12 | E | 27.3 | Very low | 25.4 | Very low | 135 Ų | 135 | 148 Ų | 148 | 63% | 0.631 | 80% | 0.799 | S | S | * | * | cis | -168.4 | -177.1 | 9.4 | -132.8 | 162.2 | 123.9 | 0 | 0 | 109.7 | ||||
| 13 | Y | 26.8 | Very low | 25.5 | Very low | 217 Ų | 217 | 146.6 Ų | 146.6 | 85% | 0.851 | 79% | 0.794 | S | S | * | * | trans | 96.6 | 84.7 | 174.2 | -65.7 | -81.3 | 0 | 0 | 0 | 114.6 | ||||
| 14 | A | 24.1 | Very low | 25.8 | Very low | 81 Ų | 81 | 146 Ų | 146 | 67% | 0.669 | 79% | 0.788 | S | S | * | * | 72 | 101.5 | 50.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 15 | E | 25.1 | Very low | 25.7 | Very low | 190 Ų | 190 | 146.7 Ų | 146.7 | 89% | 0.888 | 79% | 0.789 | S | S | * | * | trans | 161.9 | 99.4 | 144.1 | -93.7 | -179.1 | 152.7 | 0 | 0 | 106.8 | ||||
| 16 | S | 26.5 | Very low | 25.9 | Very low | 127 Ų | 127 | 151 Ų | 151 | 89% | 0.888 | 80% | 0.799 | S | S | * | * | -170.4 | 123.4 | 88.2 | -56.5 | 0 | 0 | 0 | 0 | 109.6 | |||||
| 17 | A | 25.5 | Very low | 25.9 | Very low | 102 Ų | 102 | 152.7 Ų | 152.7 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | -98.7 | 139.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 18 | S | 24.3 | Very low | 26.1 | Very low | 111 Ų | 111 | 150 Ų | 150 | 78% | 0.776 | 80% | 0.8 | S | S | * | * | trans | 168.6 | 132.6 | 135.3 | 75.9 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 19 | I | 27.8 | Very low | 26 | Very low | 164 Ų | 164 | 149.2 Ų | 149.2 | 84% | 0.841 | 80% | 0.795 | S | S | * | * | cis | -147.7 | 137.1 | 32.4 | -72.3 | 168 | 0 | 0 | 0 | 108 | ||||
| 20 | N | 26.6 | Very low | 26.1 | Very low | 149 Ų | 149 | 151.8 Ų | 151.8 | 80% | 0.797 | 80% | 0.803 | S | S | * | * | trans | -75.1 | 120.3 | -163 | -125 | -21.1 | 0 | 0 | 0 | 114.2 | ||||
| 21 | N | 27.7 | Very low | 26.2 | Very low | 161 Ų | 161 | 154.8 Ų | 154.8 | 86% | 0.861 | 82% | 0.818 | S | S | * | * | trans | -88.4 | 117.7 | 148.6 | -106 | -17.1 | 0 | 0 | 0 | 107.1 | A23 | N21-A23 PolarHBondContact O-N 3.21Š| ||
| 22 | R | 27.2 | Very low | 26.5 | Very low | 241 Ų | 241 | 148.4 Ų | 148.4 | 91% | 0.909 | 82% | 0.819 | S | S | * | * | trans | -68.5 | 109.8 | 173 | -98.9 | -177.9 | -175.1 | 176.8 | 2.2 | 109.8 | ||||
| 23 | A | 27.9 | Very low | 26.7 | Very low | 91 Ų | 91 | 145.6 Ų | 145.6 | 75% | 0.752 | 83% | 0.826 | S | S | * | * | trans | -79.3 | 140.8 | 159.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | N21 | N21-A23 PolarHBondContact O-N 3.21Š| ||
| 24 | P | 29.5 | Very low | 26.7 | Very low | 122 Ų | 122 | 141.3 Ų | 141.3 | 79% | 0.792 | 83% | 0.827 | S | S | * | * | trans | -84.7 | 139 | 169.5 | 32.8 | -28.9 | 0 | 0 | 0 | 110.8 | ||||
| 25 | F | 24.1 | Very low | 26.8 | Very low | 201 Ų | 201 | 143.7 Ų | 143.7 | 88% | 0.882 | 84% | 0.837 | S | S | * | * | trans | -45.5 | 129 | 169.5 | -133.5 | -111.8 | 0 | 0 | 0 | 111.7 | ||||
| 26 | K | 26.8 | Very low | 26.9 | Very low | 202 Ų | 202 | 140.9 Ų | 140.9 | 88% | 0.878 | 83% | 0.832 | S | S | * | * | trans | -103.1 | 109.2 | 164.2 | -81.7 | -174 | 178.1 | -179.7 | 0 | 108.4 | ||||
| 27 | E | 25.9 | Very low | 27 | Very low | 172 Ų | 172 | 141.2 Ų | 141.2 | 80% | 0.804 | 83% | 0.829 | S | S | * | * | trans | -86.2 | 115.5 | 167 | -153.6 | 169.4 | -156 | 0 | 0 | 107.2 | ||||
| 28 | S | 26.3 | Very low | 27 | Very low | 114 Ų | 114 | 138.7 Ų | 138.7 | 80% | 0.797 | 81% | 0.813 | S | S | * | * | trans | -106.2 | 96.9 | -179.8 | 55 | 0 | 0 | 0 | 0 | 110 | ||||
| 29 | T | 25.2 | Very low | 27.1 | Very low | 126 Ų | 126 | 138.8 Ų | 138.8 | 77% | 0.773 | 81% | 0.814 | S | S | * | * | trans | -92 | 107.5 | 165.7 | -51 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 30 | Q | 25.1 | Very low | 27 | Very low | 191 Ų | 191 | 139.7 Ų | 139.7 | 89% | 0.893 | 81% | 0.812 | S | S | * | * | trans | -80.7 | 115 | 175.7 | -108.4 | -175 | -11.5 | 0 | 0 | 110.4 | ||||
| 31 | V | 27.1 | Very low | 27.3 | Very low | 138 Ų | 138 | 137.7 Ų | 137.7 | 84% | 0.836 | 81% | 0.807 | S | S | * | * | trans | -137.1 | 109.9 | 154.7 | -175.6 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 32 | G | 30.2 | Very low | 27.6 | Very low | 81 Ų | 81 | 135.4 Ų | 135.4 | 84% | 0.835 | 80% | 0.803 | S | S | * | * | S | Bend | trans | 46 | 114.5 | 154.2 | 0 | 0 | 0 | 0 | 0 | 121 | ||
| 33 | G | 31.3 | Very low | 28.2 | Very low | 76 Ų | 76 | 127.7 Ų | 127.7 | 78% | 0.784 | 79% | 0.786 | S | S | * | * | S | Bend | trans | 107.2 | 122.1 | 148.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 34 | C | 25.8 | Very low | 28.7 | Very low | 128 Ų | 128 | 130.2 Ų | 130.2 | 87% | 0.865 | 79% | 0.788 | S | S | * | * | trans | 41.3 | 90.6 | 167.5 | -82.3 | 0 | 0 | 0 | 0 | 117.7 | V36 | C34-V36 PolarHBondContact O-N 3.04Å; C34-V36 VanDerWaalsContact O-N 3.08Å | ||
| 35 | C | 26.3 | Very low | 29.6 | Very low | 130 Ų | 130 | 130.4 Ų | 130.4 | 88% | 0.878 | 78% | 0.779 | S | S | * | * | trans | -75.8 | 89.8 | 159.2 | -79.3 | 0 | 0 | 0 | 0 | 109.9 | T37 | C35-T37 PolarHBondContact O-N 3.02Š| ||
| 36 | V | 28.5 | Very low | 31.5 | Very low | 131 Ų | 131 | 124.5 Ų | 124.5 | 79% | 0.794 | 77% | 0.767 | S | S | * | * | trans | -71.7 | 107.5 | 151.7 | 178 | 0 | 0 | 0 | 0 | 105.4 | C34 G38 | C34-V36 PolarHBondContact O-N 3.04Å; C34-V36 VanDerWaalsContact O-N 3.08Å; V36-G38 PolarHBondContact O-N 2.95Å | ||
| 37 | T | 27.7 | Very low | 33.7 | Very low | 135 Ų | 135 | 119.1 Ų | 119.1 | 83% | 0.828 | 74% | 0.742 | S | S | * | * | trans | -71.5 | 73 | 169.6 | 47.2 | 0 | 0 | 0 | 0 | 108.9 | C35 S39 | C35-T37 PolarHBondContact O-N 3.02Å; T37-S39 PolarHBondContact O-N 3.26Å | ||
| 38 | G | 25.8 | Very low | 36.6 | Very low | 48 Ų | 48 | 114.2 Ų | 114.2 | 50% | 0.495 | 72% | 0.724 | S | S | . | * | trans | -76.2 | 99.4 | 163 | 0 | 0 | 0 | 0 | 0 | 107.7 | V36 F40 | V36-G38 PolarHBondContact O-N 2.95Å; G38-F40 PolarHBondContact O-N 3.19Å | ||
| 39 | S | 26.2 | Very low | 39.6 | Very low | 113 Ų | 113 | 118.1 Ų | 118.1 | 79% | 0.79 | 73% | 0.726 | S | S | * | * | trans | -61.4 | 92.8 | 156.8 | 44.7 | 0 | 0 | 0 | 0 | 107.2 | T37 P41 | T37-S39 PolarHBondContact O-N 3.26Å; S39-P41 WeakPolarHBondContact O-CD 3.4Å | ||
| 40 | F | 26.9 | Very low | 42.6 | Very low | 183 Ų | 183 | 117.6 Ų | 117.6 | 80% | 0.803 | 71% | 0.711 | S | S | * | * | trans | -63.9 | 111.2 | 165.6 | -90.4 | -91.1 | 0 | 0 | 0 | 107 | G38 S42 | G38-F40 PolarHBondContact O-N 3.19Å; F40-S42 PolarHBondContact O-N 3.16Å; F40-S42 VanDerWaalsContact O-N 3.08Å | ||
| 41 | P | 32.7 | Very low | 45.7 | Very low | 107 Ų | 107 | 109.9 Ų | 109.9 | 70% | 0.695 | 68% | 0.675 | S | S | * | * | trans | -66 | 115.1 | 163.3 | 24.9 | -18.6 | 0 | 0 | 0 | 105.2 | S39 S43 | S39-P41 WeakPolarHBondContact O-CD 3.4Å; P41-S43 PolarHBondContact O-N 3.27Å | ||
| 42 | S | 33.3 | Very low | 48.7 | Very low | 113 Ų | 113 | 108 Ų | 108 | 79% | 0.79 | 66% | 0.659 | S | S | * | * | trans | -69.8 | 76.8 | 164.7 | -45.4 | 0 | 0 | 0 | 0 | 106.9 | F40 N44 | F40-S42 PolarHBondContact O-N 3.16Å; F40-S42 VanDerWaalsContact O-N 3.08Å; S42-N44 PolarHBondContact O-N 3.46Å | ||
| 43 | S | 39 | Very low | 51.7 | Low | 79 Ų | 79 | 110.1 Ų | 110.1 | 55% | 0.552 | 65% | 0.646 | S | S | * | * | trans | -72.8 | 73.4 | 172.2 | 51.1 | 0 | 0 | 0 | 0 | 108.4 | P41 M45 | P41-S43 PolarHBondContact O-N 3.27Å; S43-M45 VanDerWaalsContact C-N 3.34Å; S43-M45 PolarHBondContact O-N 3.03Å | ||
| 44 | N | 39.2 | Very low | 54.6 | Low | 145 Ų | 145 | 106.5 Ų | 106.5 | 78% | 0.775 | 61% | 0.609 | S | S | * | * | trans | -57.8 | 109 | 153.9 | -85.2 | -24.8 | 0 | 0 | 0 | 106 | S42 A46 | S42-N44 PolarHBondContact O-N 3.46Å; N44-A46 PolarHBondContact O-N 3.13Å | ||
| 45 | M | 48.4 | Very low | 57.7 | Low | 126 Ų | 126 | 100.7 Ų | 100.7 | 62% | 0.621 | 57% | 0.57 | S | S | * | * | trans | -55.7 | 73.4 | 157.5 | -94.5 | -164.6 | -82.6 | 0 | 0 | 108.5 | S43 R383 | S43-M45 VanDerWaalsContact C-N 3.34Å; S43-M45 PolarHBondContact O-N 3.03Å; M45-R383 HydrophobicContact CE-CB 4.4Å | ||
| 46 | A | 63.1 | Low | 60.9 | Low | 76 Ų | 76 | 95.9 Ų | 95.9 | 63% | 0.628 | 54% | 0.543 | S | S | * | . | trans | -103.9 | 109.8 | 166.1 | 0 | 0 | 0 | 0 | 0 | 104.5 | N44 T48 | N44-A46 PolarHBondContact O-N 3.13Å; A46-T48 PolarHBondContact O-N 3.2Å | ||
| 47 | W | 74.1 | Confident | 64.1 | Low | 89 Ų | 89 | 91.2 Ų | 91.2 | 34% | 0.337 | 51% | 0.513 | S | S | . | . | trans | -41.3 | 136.7 | 160.3 | -76 | 5.4 | 0 | 0 | 0 | 108.4 | Q51 L52 A55 I332 T336 | W47-Q51 HydrophobicContact CB-CB 4.08Å; W47-L52 HydrophobicContact CB-CD1 4.36Å; W47-L52 HydrophobicContact CB-CD2 4.18Å; W47-L52 HydrophobicContact CB-CG 3.78Å; W47-L52 HydrophobicContact CD2-CD2 4.45Å; W47-L52 HydrophobicContact CE3-CD2 3.71Å; W47-L52 HydrophobicContact CE3-CG 4.22Å; W47-L52 HydrophobicContact CZ3-CD2 4.49Å; W47-A55 HydrophobicContact CE3-CB 4.33Å; W47-A55 HydrophobicContact CZ3-CB 3.62Å; W47-I332 HydrophobicContact CD2-CD1 4.41Å; W47-I332 HydrophobicContact CZ2-CD1 4.37Å; W47-T336 HydrophobicContact CH2-CG2 4.13Å; W47-T336 HydrophobicContact CZ2-CG2 4.06Å | ||
| 48 | T | 87.3 | Confident | 67.2 | Low | 70 Ų | 70 | 84.8 Ų | 84.8 | 43% | 0.429 | 47% | 0.474 | S | S | . | . | trans | -59.1 | 154.3 | 178.7 | 71.2 | 0 | 0 | 0 | 0 | 109.1 | A46 Y50 Q51 L52 | A46-T48 PolarHBondContact O-N 3.2Å; T48-Y50 PolarHBondContact O-N 2.81Å; T48-Q51 PolarHBondContact O-N 2.92Å; T48-Q51 WeakPolarHBondContact OG1-CG 3.29Å; T48-Q51 PolarHBondContact OG1-N 3.43Å; T48-Q51 VanDerWaalsContact OG1-N 3.09Å; T48-L52 PolarHBondContact O-N 3.48Å | ||
| 49 | K | 88.7 | Confident | 70.4 | Confident | 196 Ų | 196 | 84.5 Ų | 84.5 | 85% | 0.852 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -53.5 | -32.3 | 175.4 | -66.2 | -177.6 | -178.3 | 178 | 0 | 111.5 | F53 | K49-F53 VanDerWaalsContact O-CB 3.31Å; K49-F53 WeakPolarHBondContact O-CB 3.36Å; K49-F53 PolarHBondContact O-N 3.14Å |
| 50 | Y | 88.9 | Confident | 73.6 | Confident | 114 Ų | 114 | 82.9 Ų | 82.9 | 45% | 0.447 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -68.4 | -47.5 | 175 | -178.7 | -116.8 | 0 | 0 | 0 | 112.7 | T48 L52 F53 L54 E331 | T48-Y50 PolarHBondContact O-N 2.81Å; Y50-L52 PolarHBondContact O-N 2.97Å; Y50-F53 WeakPolarHBondContact O-CB 3.3Å; Y50-F53 PolarHBondContact O-N 2.83Å; Y50-L54 HydrophobicContact CD1-CD1 4.08Å; Y50-L54 HydrophobicContact CE1-CD1 3.57Å; Y50-L54 HydrophobicContact CE1-CG 4.28Å; Y50-L54 HydrophobicContact CE2-CD1 4.32Å; Y50-L54 HydrophobicContact CE2-CD2 4.24Å; Y50-L54 HydrophobicContact CE2-CG 4.17Å; Y50-L54 WeakPolarHBondContact O-CG 3.27Å; Y50-L54 PolarHBondContact O-N 3.31Å; Y50-E331 HydrophobicContact CE1-CG 3.97Å |
| 51 | Q | 89.3 | Confident | 76.8 | Confident | 29 Ų | 29 | 74.8 Ų | 74.8 | 14% | 0.136 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -60.7 | -42.4 | 175.6 | -75.6 | 168.4 | -19.4 | 0 | 0 | 112.3 | W47 T48 F53 L54 A55 E331 I332 | W47-Q51 HydrophobicContact CB-CB 4.08Å; T48-Q51 PolarHBondContact O-N 2.92Å; T48-Q51 WeakPolarHBondContact OG1-CG 3.29Å; T48-Q51 PolarHBondContact OG1-N 3.43Å; T48-Q51 VanDerWaalsContact OG1-N 3.09Å; Q51-F53 VanDerWaalsContact C-N 3.34Å; Q51-L54 PolarHBondContact O-N 3.5Å; Q51-A55 WeakPolarHBondContact O-CB 3.35Å; Q51-A55 PolarHBondContact O-N 2.92Å; Q51-E331 HydrophobicContact CG-CB 4.37Å; Q51-E331 PolarHBondContact NE2-O 3.28Å; Q51-I332 HydrophobicContact CB-CD1 4.14Å; Q51-I332 HydrophobicContact CG-CD1 4.11Å; Q51-I332 HydrophobicContact CG-CG1 4.07Å |
| 52 | L | 89.1 | Confident | 79.5 | Confident | 98 Ų | 98 | 69.7 Ų | 69.7 | 51% | 0.513 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.9 | -41.1 | 174.1 | -76 | 165.2 | 0 | 0 | 0 | 112 | W47 T48 Y50 A55 G56 | W47-L52 HydrophobicContact CB-CD1 4.36Å; W47-L52 HydrophobicContact CB-CD2 4.18Å; W47-L52 HydrophobicContact CB-CG 3.78Å; W47-L52 HydrophobicContact CD2-CD2 4.45Å; W47-L52 HydrophobicContact CE3-CD2 3.71Å; W47-L52 HydrophobicContact CE3-CG 4.22Å; W47-L52 HydrophobicContact CZ3-CD2 4.49Å; T48-L52 PolarHBondContact O-N 3.48Å; Y50-L52 PolarHBondContact O-N 2.97Å; L52-A55 PolarHBondContact O-N 3.37Å; L52-G56 PolarHBondContact O-N 2.87Å |
| 53 | F | 93.9 | Very high | 82.3 | Confident | 126 Ų | 126 | 64.7 Ų | 64.7 | 55% | 0.553 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -61.6 | -46.8 | 175.1 | 170.9 | -98.7 | 0 | 0 | 0 | 111.7 | K49 Y50 Q51 A55 G56 L57 | K49-F53 VanDerWaalsContact O-CB 3.31Å; K49-F53 WeakPolarHBondContact O-CB 3.36Å; K49-F53 PolarHBondContact O-N 3.14Å; Y50-F53 WeakPolarHBondContact O-CB 3.3Å; Y50-F53 PolarHBondContact O-N 2.83Å; Q51-F53 VanDerWaalsContact C-N 3.34Å; F53-A55 PolarHBondContact O-N 3.14Å; F53-G56 PolarHBondContact O-N 2.99Å; F53-L57 HydrophobicContact CE1-CD2 4.22Å; F53-L57 HydrophobicContact CZ-CD2 4.38Å; F53-L57 VanDerWaalsContact O-CB 3.31Å; F53-L57 WeakPolarHBondContact O-CB 3.27Å; F53-L57 PolarHBondContact O-N 3.23Å |
| 54 | L | 93.4 | Very high | 84.8 | Confident | 1 Ų | 1 | 65 Ų | 65 | 1% | 0.005 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 177 | -70.7 | 177.7 | 0 | 0 | 0 | 112 | Y50 Q51 L57 M58 V328 E331 | Y50-L54 HydrophobicContact CD1-CD1 4.08Å; Y50-L54 HydrophobicContact CE1-CD1 3.57Å; Y50-L54 HydrophobicContact CE1-CG 4.28Å; Y50-L54 HydrophobicContact CE2-CD1 4.32Å; Y50-L54 HydrophobicContact CE2-CD2 4.24Å; Y50-L54 HydrophobicContact CE2-CG 4.17Å; Y50-L54 WeakPolarHBondContact O-CG 3.27Å; Y50-L54 PolarHBondContact O-N 3.31Å; Q51-L54 PolarHBondContact O-N 3.5Å; L54-L57 PolarHBondContact O-N 2.95Å; L54-M58 WeakPolarHBondContact O-CB 3.31Å; L54-M58 PolarHBondContact O-N 3.35Å; L54-V328 HydrophobicContact CB-CG2 3.91Å; L54-E331 HydrophobicContact CD1-CG 4.05Å |
| 55 | A | 90.8 | Very high | 87.3 | Confident | 5 Ų | 5 | 59.2 Ų | 59.2 | 4% | 0.041 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62.6 | -45.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | W47 Q51 L52 F53 M58 L59 L340 | W47-A55 HydrophobicContact CE3-CB 4.33Å; W47-A55 HydrophobicContact CZ3-CB 3.62Å; Q51-A55 WeakPolarHBondContact O-CB 3.35Å; Q51-A55 PolarHBondContact O-N 2.92Å; L52-A55 PolarHBondContact O-N 3.37Å; F53-A55 PolarHBondContact O-N 3.14Å; A55-M58 PolarHBondContact O-N 3.04Å; A55-L59 WeakPolarHBondContact O-CB 2.98Å; A55-L59 VanDerWaalsContact O-CG 3.3Å; A55-L59 WeakPolarHBondContact O-CG 3.28Å; A55-L59 PolarHBondContact O-N 2.91Å; A55-L340 HydrophobicContact CB-CD1 3.75Å; A55-L340 HydrophobicContact CB-CD2 3.86Å; A55-L340 HydrophobicContact CB-CG 4.49Å |
| 56 | G | 92.6 | Very high | 89.1 | Confident | 30 Ų | 30 | 54.7 Ų | 54.7 | 31% | 0.309 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -63.6 | -40.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | L52 F53 L59 T60 | L52-G56 PolarHBondContact O-N 2.87Å; F53-G56 PolarHBondContact O-N 2.99Å; G56-L59 PolarHBondContact O-N 3.45Å; G56-T60 WeakPolarHBondContact O-CB 3.37Å; G56-T60 VanDerWaalsContact O-CG2 3.29Å; G56-T60 WeakPolarHBondContact O-CG2 3.3Å; G56-T60 PolarHBondContact O-N 3.26Å; G56-T60 PolarHBondContact O-OG1 3.24Å |
| 57 | L | 95.3 | Very high | 90.3 | Very high | 32 Ų | 32 | 52.7 Ų | 52.7 | 17% | 0.168 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.2 | -47.8 | 176.2 | -178.1 | 64 | 0 | 0 | 0 | 110.8 | F53 L54 L59 T60 T61 A324 | F53-L57 HydrophobicContact CE1-CD2 4.22Å; F53-L57 HydrophobicContact CZ-CD2 4.38Å; F53-L57 VanDerWaalsContact O-CB 3.31Å; F53-L57 WeakPolarHBondContact O-CB 3.27Å; F53-L57 PolarHBondContact O-N 3.23Å; L54-L57 PolarHBondContact O-N 2.95Å; L57-L59 PolarHBondContact O-N 3.22Å; L57-T60 PolarHBondContact O-N 3.45Å; L57-T60 PolarHBondContact O-OG1 3.06Å; L57-T60 VanDerWaalsContact O-OG1 3.09Å; L57-T61 HydrophobicContact CD1-CG2 3.73Å; L57-T61 HydrophobicContact CG-CG2 4.41Å; L57-T61 WeakPolarHBondContact O-CB 3.32Å; L57-T61 WeakPolarHBondContact O-CG2 3.4Å; L57-T61 PolarHBondContact O-N 3.44Å; L57-T61 PolarHBondContact O-OG1 3.3Å; L57-A324 HydrophobicContact CB-CB 4.31Å; L57-A324 HydrophobicContact CD2-CB 4.04Å; L57-A324 HydrophobicContact CG-CB 4.07Å |
| 58 | M | 93.6 | Very high | 91.1 | Very high | 1 Ų | 1 | 49.2 Ų | 49.2 | 1% | 0.005 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60 | -46.6 | 177.1 | -175.9 | -177.2 | 168.5 | 0 | 0 | 111.6 | L54 A55 G62 F321 A324 R337 L340 D341 | L54-M58 WeakPolarHBondContact O-CB 3.31Å; L54-M58 PolarHBondContact O-N 3.35Å; A55-M58 PolarHBondContact O-N 3.04Å; M58-G62 WeakPolarHBondContact O-CA 3.45Å; M58-G62 PolarHBondContact O-N 3.17Å; M58-F321 HydrophobicContact CE-CE2 3.64Å; M58-F321 HydrophobicContact CE-CZ 3.9Å; M58-F321 HydrophobicContact CG-CD2 3.84Å; M58-F321 HydrophobicContact CG-CE2 3.72Å; M58-F321 WeakPolarHBondContact O-CD2 3.42Å; M58-A324 HydrophobicContact CB-CB 3.83Å; M58-R337 HydrophobicContact CE-CG 3.58Å; M58-R337 WeakPolarHBondContact CE-O 3.42Å; M58-R337 HydrophobicContact SD-CG 4.01Å; M58-L340 HydrophobicContact CE-CB 4.12Å; M58-L340 HydrophobicContact SD-CB 3.81Å; M58-L340 HydrophobicContact SD-CD1 3.82Å; M58-D341 HydrophobicContact CE-CB 4.34Å |
| 59 | L | 92.1 | Very high | 91.1 | Very high | 41 Ų | 41 | 46.8 Ų | 46.8 | 22% | 0.215 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -62.2 | -50.2 | 179.6 | -73.9 | 170.1 | 0 | 0 | 0 | 111.9 | A55 G56 L57 S63 L340 L343 R344 | A55-L59 WeakPolarHBondContact O-CB 2.98Å; A55-L59 VanDerWaalsContact O-CG 3.3Å; A55-L59 WeakPolarHBondContact O-CG 3.28Å; A55-L59 PolarHBondContact O-N 2.91Å; G56-L59 PolarHBondContact O-N 3.45Å; L57-L59 PolarHBondContact O-N 3.22Å; L59-S63 WeakPolarHBondContact O-CB 3.39Å; L59-S63 PolarHBondContact O-N 3.28Å; L59-S63 PolarHBondContact O-OG 3.17Å; L59-S63 VanDerWaalsContact O-OG 3.05Å; L59-L340 HydrophobicContact CD1-CD2 4.12Å; L59-L340 HydrophobicContact CD2-CB 4.43Å; L59-L340 WeakPolarHBondContact CD2-O 3.5Å; L59-L340 HydrophobicContact CG-CD2 4.26Å; L59-L343 HydrophobicContact CD2-CB 3.64Å; L59-R344 HydrophobicContact CD2-CB 4.2Å |
| 60 | T | 93.7 | Very high | 91 | Very high | 79 Ų | 79 | 39.6 Ų | 39.6 | 49% | 0.485 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -65.9 | -50.8 | -176.5 | 50.7 | 0 | 0 | 0 | 0 | 112 | G56 L57 G62 S63 I64 | G56-T60 WeakPolarHBondContact O-CB 3.37Å; G56-T60 VanDerWaalsContact O-CG2 3.29Å; G56-T60 WeakPolarHBondContact O-CG2 3.3Å; G56-T60 PolarHBondContact O-N 3.26Å; G56-T60 PolarHBondContact O-OG1 3.24Å; L57-T60 PolarHBondContact O-N 3.45Å; L57-T60 PolarHBondContact O-OG1 3.06Å; L57-T60 VanDerWaalsContact O-OG1 3.09Å; T60-G62 VanDerWaalsContact C-N 3.35Å; T60-S63 PolarHBondContact O-N 3.47Å; T60-I64 WeakPolarHBondContact O-CG1 3.15Å; T60-I64 PolarHBondContact O-N 3.4Å |
| 61 | T | 94.3 | Very high | 91 | Very high | 13 Ų | 13 | 38.8 Ų | 38.8 | 8% | 0.08 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -69.2 | -35.2 | -179.2 | 58.6 | 0 | 0 | 0 | 0 | 111.6 | L57 I64 N65 S317 F320 F321 | L57-T61 HydrophobicContact CD1-CG2 3.73Å; L57-T61 HydrophobicContact CG-CG2 4.41Å; L57-T61 WeakPolarHBondContact O-CB 3.32Å; L57-T61 WeakPolarHBondContact O-CG2 3.4Å; L57-T61 PolarHBondContact O-N 3.44Å; L57-T61 PolarHBondContact O-OG1 3.3Å; T61-I64 PolarHBondContact O-N 3.33Å; T61-N65 WeakPolarHBondContact O-CB 3.33Å; T61-N65 PolarHBondContact O-N 3.33Å; T61-S317 WeakPolarHBondContact O-CB 3.38Å; T61-F320 HydrophobicContact CG2-CB 3.67Å; T61-F320 HydrophobicContact CG2-CG 4.43Å; T61-F321 WeakPolarHBondContact OG1-CA 3.47Å; T61-F321 PolarHBondContact OG1-N 2.71Å |
| 62 | G | 90.4 | Very high | 91 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63.1 | -41.3 | 172 | 0 | 0 | 0 | 0 | 0 | 113.1 | M58 T60 N65 T66 R344 | M58-G62 WeakPolarHBondContact O-CA 3.45Å; M58-G62 PolarHBondContact O-N 3.17Å; T60-G62 VanDerWaalsContact C-N 3.35Å; G62-N65 WeakPolarHBondContact O-CB 3.26Å; G62-N65 PolarHBondContact O-N 3.43Å; G62-T66 PolarHBondContact O-N 3.46Å; G62-R344 VanDerWaalsContact CA-CD 3.5Å; G62-R344 WeakPolarHBondContact O-CD 3.34Å |
| 63 | S | 90.8 | Very high | 90.9 | Very high | 9 Ų | 9 | 36.2 Ų | 36.2 | 6% | 0.063 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -66.6 | -41.5 | 175.1 | -65 | 0 | 0 | 0 | 0 | 111.7 | L59 T60 N65 T66 L67 V347 | L59-S63 WeakPolarHBondContact O-CB 3.39Å; L59-S63 PolarHBondContact O-N 3.28Å; L59-S63 PolarHBondContact O-OG 3.17Å; L59-S63 VanDerWaalsContact O-OG 3.05Å; T60-S63 PolarHBondContact O-N 3.47Å; S63-N65 VanDerWaalsContact C-N 3.34Å; S63-N65 PolarHBondContact O-N 3.18Å; S63-T66 PolarHBondContact O-N 3.32Å; S63-L67 WeakPolarHBondContact O-CB 3.23Å; S63-L67 VanDerWaalsContact O-CG 3.24Å; S63-L67 WeakPolarHBondContact O-CG 3.46Å; S63-L67 PolarHBondContact O-N 2.96Å; S63-V347 VanDerWaalsContact OG-CG1 3.31Å; S63-V347 WeakPolarHBondContact OG-CG1 3.36Å |
| 64 | I | 92.1 | Very high | 90.6 | Very high | 86 Ų | 86 | 35.2 Ų | 35.2 | 44% | 0.441 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -61.3 | -42.6 | 176 | -67.8 | 164.5 | 0 | 0 | 0 | 111 | T60 T61 L67 S68 | T60-I64 WeakPolarHBondContact O-CG1 3.15Å; T60-I64 PolarHBondContact O-N 3.4Å; T61-I64 PolarHBondContact O-N 3.33Å; I64-L67 PolarHBondContact O-N 2.94Å; I64-S68 WeakPolarHBondContact O-CB 3.12Å; I64-S68 PolarHBondContact O-N 3.18Å; I64-S68 PolarHBondContact O-OG 3.07Å |
| 65 | N | 91.1 | Very high | 90.4 | Very high | 22 Ų | 22 | 36.2 Ų | 36.2 | 12% | 0.118 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -50.8 | -62.2 | 174.8 | 165.4 | 2.1 | 0 | 0 | 0 | 110.7 | T61 G62 S63 L67 S68 A69 N314 S317 I318 | T61-N65 WeakPolarHBondContact O-CB 3.33Å; T61-N65 PolarHBondContact O-N 3.33Å; G62-N65 WeakPolarHBondContact O-CB 3.26Å; G62-N65 PolarHBondContact O-N 3.43Å; S63-N65 VanDerWaalsContact C-N 3.34Å; S63-N65 PolarHBondContact O-N 3.18Å; N65-L67 PolarHBondContact O-N 3.36Å; N65-S68 PolarHBondContact O-N 3.06Å; N65-S68 VanDerWaalsContact O-N 3.16Å; N65-A69 PolarHBondContact O-N 2.87Å; N65-N314 PolarHBondContact O-OD1 2.84Å; N65-N314 PolarHBondContact OD1-OD1 2.94Å; N65-S317 WeakPolarHBondContact CA-OG 3.21Å; N65-S317 VanDerWaalsContact CB-OG 3.25Å; N65-S317 WeakPolarHBondContact CB-OG 3.26Å; N65-S317 PolarHBondContact N-OG 3.42Å; N65-I318 HydrophobicContact CB-CG1 4.17Å; N65-I318 VanDerWaalsContact CG-CG1 3.46Å; N65-I318 VanDerWaalsContact ND2-CG1 3.33Å; N65-I318 WeakPolarHBondContact ND2-CG1 3.36Å |
| 66 | T | 87.1 | Confident | 90.4 | Very high | 32 Ų | 32 | 38.1 Ų | 38.1 | 20% | 0.196 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -65.6 | -37.4 | -175.3 | -52.7 | 0 | 0 | 0 | 0 | 112.9 | G62 S63 K70 I348 | G62-T66 PolarHBondContact O-N 3.46Å; S63-T66 PolarHBondContact O-N 3.32Å; T66-K70 WeakPolarHBondContact O-CB 3.45Å; T66-K70 PolarHBondContact O-N 3.27Å; T66-I348 VanDerWaalsContact CB-CD1 3.46Å; T66-I348 HydrophobicContact CG2-CD1 3.76Å; T66-I348 HydrophobicContact CG2-CG1 4.48Å; T66-I348 HydrophobicContact CG2-CG2 4.23Å |
| 67 | L | 87.9 | Confident | 90.2 | Very high | 33 Ų | 33 | 37 Ų | 37 | 17% | 0.173 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -67.6 | -36.7 | 176.6 | -69.7 | 170.1 | 0 | 0 | 0 | 112 | S63 I64 N65 W71 I348 V351 W357 | S63-L67 WeakPolarHBondContact O-CB 3.23Å; S63-L67 VanDerWaalsContact O-CG 3.24Å; S63-L67 WeakPolarHBondContact O-CG 3.46Å; S63-L67 PolarHBondContact O-N 2.96Å; I64-L67 PolarHBondContact O-N 2.94Å; N65-L67 PolarHBondContact O-N 3.36Å; L67-W71 VanDerWaalsContact O-CB 3.26Å; L67-W71 WeakPolarHBondContact O-CB 3.4Å; L67-W71 PolarHBondContact O-N 3.33Å; L67-I348 HydrophobicContact CD2-CG2 4.34Å; L67-V351 HydrophobicContact CD1-CB 4.32Å; L67-V351 HydrophobicContact CD1-CG1 3.77Å; L67-V351 HydrophobicContact CD2-CB 4.49Å; L67-V351 HydrophobicContact CD2-CG1 4Å; L67-W357 HydrophobicContact CD2-CE3 4.43Å; L67-W357 HydrophobicContact CD2-CZ3 3.87Å |
| 68 | S | 90.8 | Very high | 89.9 | Confident | 17 Ų | 17 | 41.3 Ų | 41.3 | 12% | 0.119 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -70.6 | -40.4 | 177.9 | -57.2 | 0 | 0 | 0 | 0 | 111.6 | I64 N65 W71 A72 | I64-S68 WeakPolarHBondContact O-CB 3.12Å; I64-S68 PolarHBondContact O-N 3.18Å; I64-S68 PolarHBondContact O-OG 3.07Å; N65-S68 PolarHBondContact O-N 3.06Å; N65-S68 VanDerWaalsContact O-N 3.16Å; S68-W71 PolarHBondContact O-N 3.08Å; S68-A72 PolarHBondContact O-N 3.29Å |
| 69 | A | 88.1 | Confident | 89.4 | Confident | 18 Ų | 18 | 41.3 Ų | 41.3 | 15% | 0.149 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -60.1 | -51.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | N65 W71 A72 D73 | N65-A69 PolarHBondContact O-N 2.87Å; A69-W71 VanDerWaalsContact C-N 3.25Å; A69-W71 PolarHBondContact O-N 2.97Å; A69-A72 WeakPolarHBondContact O-CA 3.42Å; A69-A72 WeakPolarHBondContact O-CB 3.23Å; A69-A72 PolarHBondContact O-N 2.93Å; A69-D73 PolarHBondContact O-N 3.27Å |
| 70 | K | 86.3 | Confident | 89 | Confident | 46 Ų | 46 | 40 Ų | 40 | 20% | 0.2 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -58.2 | -38.3 | 175.3 | -177.8 | 165.9 | 179.5 | 172.9 | 0 | 112.2 | T66 A72 D73 M74 W357 E358 | T66-K70 WeakPolarHBondContact O-CB 3.45Å; T66-K70 PolarHBondContact O-N 3.27Å; K70-A72 VanDerWaalsContact C-N 3.34Å; K70-D73 PolarHBondContact O-N 3.22Å; K70-M74 VanDerWaalsContact O-CG 3.32Å; K70-M74 WeakPolarHBondContact O-CG 3.24Å; K70-M74 PolarHBondContact O-N 2.68Å; K70-W357 HydrophobicContact CB-CZ3 4.43Å; K70-W357 HydrophobicContact CD-CE3 3.73Å; K70-W357 HydrophobicContact CD-CZ3 4.12Å; K70-W357 HydrophobicContact CG-CE3 4.12Å; K70-W357 HydrophobicContact CG-CZ3 4.13Å; K70-E358 IonicContact NZ-OE1 2.69Å; K70-E358 PolarHBondContact NZ-OE1 2.8Å |
| 71 | W | 88.2 | Confident | 88.3 | Confident | 97 Ų | 97 | 44.5 Ų | 44.5 | 37% | 0.367 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -67.1 | -34.8 | 176.9 | -170.9 | 39.1 | 0 | 0 | 0 | 112.5 | L67 S68 A69 F75 L309 A310 W357 | L67-W71 VanDerWaalsContact O-CB 3.26Å; L67-W71 WeakPolarHBondContact O-CB 3.4Å; L67-W71 PolarHBondContact O-N 3.33Å; S68-W71 PolarHBondContact O-N 3.08Å; A69-W71 VanDerWaalsContact C-N 3.25Å; A69-W71 PolarHBondContact O-N 2.97Å; W71-F75 HydrophobicContact CD2-CE2 4.07Å; W71-F75 HydrophobicContact CD2-CZ 4.17Å; W71-F75 AromaticContact CE2-CE2 3.89Å; W71-F75 AromaticContact CE2-CZ 3.5Å; W71-F75 HydrophobicContact CG-CE2 4.3Å; W71-F75 HydrophobicContact CH2-CZ 4.49Å; W71-F75 HydrophobicContact CZ2-CE2 4.32Å; W71-F75 AromaticContact CZ2-CZ 3.71Å; W71-F75 HydrophobicContact CZ2-CZ 3.71Å; W71-F75 AromaticContact NE1-CE2 3.97Å; W71-F75 AromaticContact NE1-CZ 3.47Å; W71-F75 WeakPolarHBondContact O-CD2 3.44Å; W71-F75 WeakPolarHBondContact O-CE2 3.12Å; W71-L309 HydrophobicContact CH2-CD2 4.41Å; W71-A310 HydrophobicContact CD2-CB 4.3Å; W71-A310 HydrophobicContact CE3-CB 3.67Å; W71-A310 HydrophobicContact CZ3-CB 4.17Å; W71-W357 HydrophobicContact CB-CH2 4.32Å |
| 72 | A | 89.6 | Confident | 87.3 | Confident | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62.6 | -47.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | S68 A69 K70 M74 F75 F88 A310 L311 | S68-A72 PolarHBondContact O-N 3.29Å; A69-A72 WeakPolarHBondContact O-CA 3.42Å; A69-A72 WeakPolarHBondContact O-CB 3.23Å; A69-A72 PolarHBondContact O-N 2.93Å; K70-A72 VanDerWaalsContact C-N 3.34Å; A72-M74 PolarHBondContact O-N 3Å; A72-F75 PolarHBondContact O-N 2.92Å; A72-F75 VanDerWaalsContact O-N 3.1Å; A72-F88 HydrophobicContact CB-CD1 4.29Å; A72-F88 HydrophobicContact CB-CE1 4.41Å; A72-A310 HydrophobicContact CB-CB 3.91Å; A72-L311 HydrophobicContact CB-CD2 4.19Å |
| 73 | D | 87.4 | Confident | 86.8 | Confident | 73 Ų | 73 | 49.4 Ų | 49.4 | 39% | 0.39 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.1 | -29 | -179.1 | -62 | -24.4 | 0 | 0 | 0 | 113.4 | A69 K70 F75 Q94 | A69-D73 PolarHBondContact O-N 3.27Å; K70-D73 PolarHBondContact O-N 3.22Å; D73-F75 PolarHBondContact O-N 3Å; D73-Q94 PolarHBondContact OD1-NE2 3.1Å |
| 74 | M | 86.9 | Confident | 86.4 | Confident | 104 Ų | 104 | 53.6 Ų | 53.6 | 51% | 0.512 | 30% | 0.295 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | -11.7 | 178.7 | -73 | 179.9 | 69.9 | 0 | 0 | 113.8 | K70 A72 W357 | K70-M74 VanDerWaalsContact O-CG 3.32Å; K70-M74 WeakPolarHBondContact O-CG 3.24Å; K70-M74 PolarHBondContact O-N 2.68Å; A72-M74 PolarHBondContact O-N 3Å; M74-W357 HydrophobicContact SD-CD2 4.04Å; M74-W357 HydrophobicContact SD-CG 4.41Å; M74-W357 HydrophobicContact SD-CZ2 4.04Å |
| 75 | F | 90.3 | Very high | 86.1 | Confident | 23 Ų | 23 | 55.5 Ų | 55.5 | 10% | 0.101 | 30% | 0.302 | C | S | . | . | trans | -82.3 | 133.6 | 177.5 | -70.4 | -56.8 | 0 | 0 | 0 | 111.4 | W71 A72 D73 F88 K304 L306 I307 A310 | W71-F75 HydrophobicContact CD2-CE2 4.07Å; W71-F75 HydrophobicContact CD2-CZ 4.17Å; W71-F75 AromaticContact CE2-CE2 3.89Å; W71-F75 AromaticContact CE2-CZ 3.5Å; W71-F75 HydrophobicContact CG-CE2 4.3Å; W71-F75 HydrophobicContact CH2-CZ 4.49Å; W71-F75 HydrophobicContact CZ2-CE2 4.32Å; W71-F75 AromaticContact CZ2-CZ 3.71Å; W71-F75 HydrophobicContact CZ2-CZ 3.71Å; W71-F75 AromaticContact NE1-CE2 3.97Å; W71-F75 AromaticContact NE1-CZ 3.47Å; W71-F75 WeakPolarHBondContact O-CD2 3.44Å; W71-F75 WeakPolarHBondContact O-CE2 3.12Å; A72-F75 PolarHBondContact O-N 2.92Å; A72-F75 VanDerWaalsContact O-N 3.1Å; D73-F75 PolarHBondContact O-N 3Å; F75-F88 VanDerWaalsContact O-CB 3.31Å; F75-F88 WeakPolarHBondContact O-CB 3.29Å; F75-F88 PolarHBondContact O-N 3.46Å; F75-K304 HydrophobicContact CB-CD 4.44Å; F75-K304 HydrophobicContact CD1-CD 4.3Å; F75-L306 HydrophobicContact CE1-CB 4.37Å; F75-L306 HydrophobicContact CE2-CB 4.39Å; F75-L306 HydrophobicContact CZ-CB 3.96Å; F75-I307 HydrophobicContact CB-CD1 4.01Å; F75-I307 HydrophobicContact CB-CG1 3.69Å; F75-I307 HydrophobicContact CD2-CG1 3.77Å; F75-I307 HydrophobicContact CG-CG1 3.93Å; F75-A310 HydrophobicContact CE2-CB 4.25Å | ||
| 76 | S | 89.4 | Confident | 85.9 | Confident | 45 Ų | 45 | 55.8 Ų | 55.8 | 32% | 0.315 | 30% | 0.302 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.2 | 145 | 161.7 | -53.6 | 0 | 0 | 0 | 0 | 110.9 | H86 K304 | S76-H86 WeakPolarHBondContact CA-O 3.46Å; S76-H86 WeakPolarHBondContact CB-O 3.33Å; S76-K304 WeakPolarHBondContact O-CD 2.98Å; S76-K304 PolarHBondContact O-NZ 2.81Å |
| 77 | A | 88.9 | Confident | 85.9 | Confident | 5 Ų | 5 | 56.5 Ų | 56.5 | 4% | 0.041 | 31% | 0.309 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.4 | 167.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | E85 H86 Q300 K304 I307 | A77-E85 WeakPolarHBondContact O-CA 3.26Å; A77-H86 PolarHBondContact N-O 2.95Å; A77-H86 VanDerWaalsContact N-O 3.09Å; A77-H86 PolarHBondContact O-N 3.33Å; A77-H86 VanDerWaalsContact O-N 3.16Å; A77-Q300 HydrophobicContact CB-CB 3.93Å; A77-Q300 HydrophobicContact CB-CG 4.09Å; A77-K304 HydrophobicContact CB-CB 4.06Å; A77-K304 HydrophobicContact CB-CD 4.45Å; A77-I307 HydrophobicContact CB-CD1 4.1Å |
| 78 | K | 88.3 | Confident | 86 | Confident | 124 Ų | 124 | 55 Ų | 55 | 54% | 0.539 | 30% | 0.3 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.4 | 135.8 | 173.3 | -70 | -177.6 | 179.2 | 179.1 | 0 | 110.1 | Y303 | K78-Y303 HydrophobicContact CB-CD2 4.04Å; K78-Y303 HydrophobicContact CB-CE2 4.18Å; K78-Y303 HydrophobicContact CB-CG 4.38Å; K78-Y303 WeakPolarHBondContact O-CD2 3.26Å |
| 79 | G | 84.4 | Confident | 85.7 | Confident | 1 Ų | 1 | 55.1 Ų | 55.1 | 1% | 0.01 | 30% | 0.301 | C | S | . | . | trans | -78.3 | -177.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | D296 | G79-D296 WeakPolarHBondContact CA-OD1 3.41Å; G79-D296 WeakPolarHBondContact CA-OD2 3.15Å | ||
| 80 | C | 83.9 | Confident | 85.8 | Confident | 12 Ų | 12 | 54.3 Ų | 54.3 | 8% | 0.081 | 30% | 0.295 | C | S | . | . | G | 310 helix | trans | -66.7 | 165.7 | 168.4 | -65 | 0 | 0 | 0 | 0 | 111.3 | G82 N83 L295 D296 C299 | C80-G82 PolarHBondContact O-N 3.05Å; C80-N83 WeakPolarHBondContact O-CB 3.42Å; C80-N83 VanDerWaalsContact O-CG 3.3Å; C80-N83 PolarHBondContact O-N 2.97Å; C80-N83 VanDerWaalsContact O-N 3.1Å; C80-N83 PolarHBondContact O-ND2 3.08Å; C80-L295 VanDerWaalsContact SG-C 3.54Å; C80-L295 PolarHBondContact SG-O 3Å; C80-D296 PolarHBondContact N-OD1 3.32Å; C80-C299 WeakPolarHBondContact CA-SG 3.33Å; C80-C299 HydrophobicContact CB-CB 3.97Å; C80-C299 WeakPolarHBondContact CB-SG 3.42Å; C80-C299 WeakPolarHBondContact SG-CB 3.17Å; C80-C299 CovalentContact SG-SG 2.03Å; C80-C299 PolarHBondContact SG-SG 2.77Å |
| 81 | H | 79.1 | Confident | 85.8 | Confident | 174 Ų | 174 | 53.1 Ų | 53.1 | 81% | 0.806 | 29% | 0.292 | S | S | * | . | G | 310 helix | trans | 57.6 | 23 | 171.1 | -57.7 | -68.1 | 0 | 0 | 0 | 116.6 | N83 | H81-N83 VanDerWaalsContact C-N 3.29Š|
| 82 | G | 72.3 | Confident | 85.9 | Confident | 76 Ų | 76 | 48.9 Ų | 48.9 | 78% | 0.784 | 28% | 0.276 | S | S | * | . | G | 310 helix | trans | 77.1 | 16.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | C80 | C80-G82 PolarHBondContact O-N 3.05Š|
| 83 | N | 79.1 | Confident | 86 | Confident | 41 Ų | 41 | 49.8 Ų | 49.8 | 22% | 0.219 | 28% | 0.281 | C | S | . | . | P | Polyproline II helix | trans | -56 | 144.5 | 171.5 | -74.7 | -25.1 | 0 | 0 | 0 | 110.9 | C80 H81 P287 | C80-N83 WeakPolarHBondContact O-CB 3.42Å; C80-N83 VanDerWaalsContact O-CG 3.3Å; C80-N83 PolarHBondContact O-N 2.97Å; C80-N83 VanDerWaalsContact O-N 3.1Å; C80-N83 PolarHBondContact O-ND2 3.08Å; H81-N83 VanDerWaalsContact C-N 3.29Å; N83-P287 HydrophobicContact CB-CG 4.27Å |
| 84 | P | 82.5 | Confident | 86.2 | Confident | 97 Ų | 97 | 47.3 Ų | 47.3 | 63% | 0.63 | 27% | 0.267 | S | S | * | . | P | Polyproline II helix | trans | -61.6 | 163.8 | 176.5 | 27.8 | -34.4 | 0 | 0 | 0 | 111.3 | H86 | P84-H86 PolarHBondContact O-N 2.97Å; P84-H86 PolarHBondContact O-ND1 3.1Å |
| 85 | E | 86.3 | Confident | 86.4 | Confident | 126 Ų | 126 | 42.9 Ų | 42.9 | 59% | 0.589 | 25% | 0.248 | S | C | * | . | E | Extended strand (participates in β ladder) | trans | -61.9 | 126.2 | 173.8 | -176.3 | 170 | -178.1 | 0 | 0 | 109.9 | A77 | A77-E85 WeakPolarHBondContact O-CA 3.26Å |
| 86 | H | 86.9 | Confident | 86.6 | Confident | 27 Ų | 27 | 42.8 Ų | 42.8 | 13% | 0.125 | 25% | 0.249 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -142.5 | 168.7 | 178.6 | 61.8 | -79.3 | 0 | 0 | 0 | 109.9 | S76 A77 P84 P287 D296 Q300 | S76-H86 WeakPolarHBondContact CA-O 3.46Å; S76-H86 WeakPolarHBondContact CB-O 3.33Å; A77-H86 PolarHBondContact N-O 2.95Å; A77-H86 VanDerWaalsContact N-O 3.09Å; A77-H86 PolarHBondContact O-N 3.33Å; A77-H86 VanDerWaalsContact O-N 3.16Å; P84-H86 PolarHBondContact O-N 2.97Å; P84-H86 PolarHBondContact O-ND1 3.1Å; H86-P287 VanDerWaalsContact CE1-CG 3.48Å; H86-P287 WeakPolarHBondContact CE1-CG 3.32Å; H86-P287 VanDerWaalsContact NE2-CD 3.29Å; H86-P287 WeakPolarHBondContact NE2-CD 3.42Å; H86-D296 IonicContact CE1-OD1 2.79Å; H86-D296 IonicContact CE1-OD2 4Å; H86-D296 PolarHBondContact CE1-OD2 3.01Å; H86-D296 IonicContact NE2-OD2 3.79Å; H86-D296 PolarHBondContact NE2-OD2 2.94Å; H86-Q300 PolarHBondContact CD2-NE2 2.67Å; H86-Q300 VanDerWaalsContact CD2-NE2 3.27Å; H86-Q300 PolarHBondContact CE1-NE2 3.07Å; H86-Q300 PolarHBondContact NE2-NE2 3.38Å |
| 87 | S | 88.1 | Confident | 86.7 | Confident | 47 Ų | 47 | 41.4 Ų | 41.4 | 33% | 0.329 | 24% | 0.241 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -67.7 | 150.3 | -179.9 | 44.3 | 0 | 0 | 0 | 0 | 112 | S89 | S87-S89 VanDerWaalsContact C-N 3.32Å; S87-S89 PolarHBondContact O-N 3.49Å |
| 88 | F | 88.9 | Confident | 86.9 | Confident | 1 Ų | 1 | 42.6 Ų | 42.6 | 0% | 0.004 | 25% | 0.247 | C | C | . | . | trans | -74.1 | 84.9 | 171.6 | -173.3 | -91.3 | 0 | 0 | 0 | 109.2 | A72 F75 H90 Q94 A297 Q300 I301 I307 L311 | A72-F88 HydrophobicContact CB-CD1 4.29Å; A72-F88 HydrophobicContact CB-CE1 4.41Å; F75-F88 VanDerWaalsContact O-CB 3.31Å; F75-F88 WeakPolarHBondContact O-CB 3.29Å; F75-F88 PolarHBondContact O-N 3.46Å; F88-H90 AromaticContact CD2-CD2 3.91Å; F88-H90 HydrophobicContact CE1-CB 4.14Å; F88-H90 HydrophobicContact CE2-CB 4.48Å; F88-H90 AromaticContact CE2-CD2 3.87Å; F88-H90 HydrophobicContact CZ-CB 4.03Å; F88-Q94 HydrophobicContact CE1-CG 4.13Å; F88-A297 HydrophobicContact CE2-CB 4.18Å; F88-A297 HydrophobicContact CZ-CB 4.49Å; F88-Q300 HydrophobicContact CD2-CB 4.24Å; F88-I301 HydrophobicContact CE2-CD1 4.47Å; F88-I301 HydrophobicContact CE2-CG1 4.19Å; F88-I307 HydrophobicContact CD1-CG2 4.39Å; F88-I307 HydrophobicContact CD2-CD1 3.98Å; F88-I307 HydrophobicContact CD2-CG2 3.68Å; F88-I307 HydrophobicContact CE1-CG2 4.3Å; F88-I307 HydrophobicContact CE2-CG2 3.62Å; F88-I307 HydrophobicContact CG-CD1 4.49Å; F88-I307 HydrophobicContact CG-CG2 4.13Å; F88-I307 HydrophobicContact CZ-CG2 3.95Å; F88-L311 HydrophobicContact CE1-CD2 4.09Å; F88-L311 HydrophobicContact CZ-CD1 3.95Å; F88-L311 HydrophobicContact CZ-CD2 4.25Å | ||
| 89 | S | 85.3 | Confident | 87.2 | Confident | 20 Ų | 20 | 36.8 Ų | 36.8 | 14% | 0.14 | 22% | 0.221 | C | C | . | . | trans | -110.2 | 79.4 | 178.5 | -165.9 | 0 | 0 | 0 | 0 | 109.6 | S87 | S87-S89 VanDerWaalsContact C-N 3.32Å; S87-S89 PolarHBondContact O-N 3.49Å | ||
| 90 | H | 89.1 | Confident | 87.7 | Confident | 1 Ų | 1 | 40.4 Ų | 40.4 | 1% | 0.005 | 24% | 0.24 | C | C | . | . | trans | -134 | 64.4 | -173.8 | -67.4 | -65.9 | 0 | 0 | 0 | 112 | F88 F92 V93 Q94 E292 D293 D296 A297 | F88-H90 AromaticContact CD2-CD2 3.91Å; F88-H90 HydrophobicContact CE1-CB 4.14Å; F88-H90 HydrophobicContact CE2-CB 4.48Å; F88-H90 AromaticContact CE2-CD2 3.87Å; F88-H90 HydrophobicContact CZ-CB 4.03Å; H90-F92 PolarHBondContact O-N 3.02Å; H90-V93 HydrophobicContact CB-CB 4.1Å; H90-V93 HydrophobicContact CB-CG2 4.44Å; H90-Q94 WeakPolarHBondContact O-CG 3.36Å; H90-Q94 PolarHBondContact O-N 3.19Å; H90-E292 WeakPolarHBondContact CA-OE1 3.5Å; H90-E292 WeakPolarHBondContact CB-OE1 3.3Å; H90-E292 IonicContact ND1-OE1 3.2Å; H90-D293 PolarHBondContact CE1-O 2.64Å; H90-D293 PolarHBondContact ND1-O 3.28Å; H90-D296 IonicContact NE2-OD2 3.74Å; H90-A297 HydrophobicContact CB-CB 4.01Å; H90-A297 PolarHBondContact NE2-N 3.31Å | ||
| 91 | P | 87.7 | Confident | 88.3 | Confident | 21 Ų | 21 | 39.9 Ų | 39.9 | 14% | 0.136 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60.8 | -39.4 | -176.3 | 31.4 | -46.5 | 0 | 0 | 0 | 114.7 | Q94 A95 Y150 E292 | P91-Q94 WeakPolarHBondContact O-CB 3.5Å; P91-Q94 PolarHBondContact O-N 3.43Å; P91-A95 WeakPolarHBondContact O-CB 3.43Å; P91-A95 PolarHBondContact O-N 3.35Å; P91-Y150 HydrophobicContact CB-CD1 3.93Å; P91-Y150 HydrophobicContact CB-CD2 3.17Å; P91-Y150 HydrophobicContact CB-CE1 3.93Å; P91-Y150 HydrophobicContact CB-CE2 3.17Å; P91-Y150 HydrophobicContact CB-CG 3.57Å; P91-Y150 HydrophobicContact CG-CD1 3.79Å; P91-Y150 HydrophobicContact CG-CD2 3.81Å; P91-Y150 HydrophobicContact CG-CE1 3.4Å; P91-Y150 HydrophobicContact CG-CE2 3.41Å; P91-Y150 VanDerWaalsContact CG-CE2 3.41Å; P91-Y150 HydrophobicContact CG-CG 3.99Å; P91-Y150 WeakPolarHBondContact CG-OH 3.25Å; P91-E292 VanDerWaalsContact CD-OE2 3.26Å; P91-E292 WeakPolarHBondContact CD-OE2 3.35Å; P91-E292 WeakPolarHBondContact CG-OE2 3.35Å |
| 92 | F | 89.9 | Confident | 89 | Confident | 9 Ų | 9 | 31.7 Ų | 31.7 | 4% | 0.039 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -79.2 | -33.4 | -174.5 | -66.3 | -79.3 | 0 | 0 | 0 | 109.6 | H90 A95 V96 Y150 L268 L272 M275 L291 E292 | H90-F92 PolarHBondContact O-N 3.02Å; F92-A95 PolarHBondContact O-N 3.2Å; F92-V96 WeakPolarHBondContact O-CG2 3.48Å; F92-V96 PolarHBondContact O-N 3.46Å; F92-Y150 AromaticContact CE2-CD1 3.91Å; F92-Y150 HydrophobicContact CE2-CD1 3.91Å; F92-Y150 HydrophobicContact CE2-CE1 4.15Å; F92-Y150 HydrophobicContact CZ-CD1 4.08Å; F92-L268 HydrophobicContact CD1-CD1 4.3Å; F92-L272 HydrophobicContact CB-CD2 3.65Å; F92-M275 HydrophobicContact CB-SD 4.29Å; F92-M275 HydrophobicContact CD1-CE 3.85Å; F92-M275 HydrophobicContact CD1-SD 3.91Å; F92-M275 HydrophobicContact CD2-SD 4.24Å; F92-M275 HydrophobicContact CE1-CE 3.7Å; F92-M275 HydrophobicContact CE1-SD 4.26Å; F92-M275 HydrophobicContact CG-CE 4.41Å; F92-M275 HydrophobicContact CG-SD 3.9Å; F92-M275 HydrophobicContact CZ-CE 4.15Å; F92-L291 HydrophobicContact CE2-CD1 3.95Å; F92-L291 HydrophobicContact CE2-CD2 4.39Å; F92-L291 HydrophobicContact CE2-CG 3.86Å; F92-L291 HydrophobicContact CZ-CD1 4.44Å; F92-L291 HydrophobicContact CZ-CD2 4.5Å; F92-L291 HydrophobicContact CZ-CG 4.42Å; F92-E292 HydrophobicContact CB-CB 4.23Å; F92-E292 HydrophobicContact CB-CG 3.9Å; F92-E292 HydrophobicContact CD2-CB 4.04Å; F92-E292 HydrophobicContact CD2-CG 4.44Å; F92-E292 PolarHBondContact N-OE1 3.17Å |
| 93 | V | 91.9 | Very high | 90.2 | Very high | 19 Ų | 19 | 31.5 Ų | 31.5 | 12% | 0.115 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62.4 | -42.8 | 166.4 | 170.7 | 0 | 0 | 0 | 0 | 110.9 | H90 A95 V96 G97 E292 A294 A297 | H90-V93 HydrophobicContact CB-CB 4.1Å; H90-V93 HydrophobicContact CB-CG2 4.44Å; V93-A95 VanDerWaalsContact C-N 3.34Å; V93-A95 PolarHBondContact O-N 2.98Å; V93-V96 PolarHBondContact O-N 3.49Å; V93-G97 PolarHBondContact O-N 3.36Å; V93-E292 WeakPolarHBondContact CB-OE1 3.38Å; V93-E292 HydrophobicContact CG2-CG 4.19Å; V93-E292 WeakPolarHBondContact CG2-OE1 3.4Å; V93-E292 PolarHBondContact N-OE1 3.33Å; V93-A294 HydrophobicContact CG2-CB 3.71Å; V93-A297 HydrophobicContact CB-CB 4.48Å; V93-A297 HydrophobicContact CG1-CB 4.21Å; V93-A297 HydrophobicContact CG2-CB 4.09Å |
| 94 | Q | 91.6 | Very high | 90.9 | Very high | 20 Ų | 20 | 31.9 Ų | 31.9 | 9% | 0.093 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -62.7 | -39.6 | 174.3 | -74.9 | -176.2 | 51.4 | 0 | 0 | 112.5 | D73 F88 H90 P91 G97 M98 L311 | D73-Q94 PolarHBondContact OD1-NE2 3.1Å; F88-Q94 HydrophobicContact CE1-CG 4.13Å; H90-Q94 WeakPolarHBondContact O-CG 3.36Å; H90-Q94 PolarHBondContact O-N 3.19Å; P91-Q94 WeakPolarHBondContact O-CB 3.5Å; P91-Q94 PolarHBondContact O-N 3.43Å; Q94-G97 CarbonylContact O-C 3.54Å; Q94-G97 WeakPolarHBondContact O-CA 3.29Å; Q94-G97 PolarHBondContact O-N 3.26Å; Q94-G97 VanDerWaalsContact O-N 3.12Å; Q94-M98 PolarHBondContact O-N 3.06Å; Q94-L311 HydrophobicContact CG-CD2 3.79Å |
| 95 | A | 91.1 | Very high | 91.5 | Very high | 12 Ų | 12 | 27.5 Ų | 27.5 | 10% | 0.099 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -66.6 | -34.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | P91 F92 V93 G97 M98 F99 L268 | P91-A95 WeakPolarHBondContact O-CB 3.43Å; P91-A95 PolarHBondContact O-N 3.35Å; F92-A95 PolarHBondContact O-N 3.2Å; V93-A95 VanDerWaalsContact C-N 3.34Å; V93-A95 PolarHBondContact O-N 2.98Å; A95-G97 VanDerWaalsContact C-N 3.31Å; A95-G97 PolarHBondContact O-N 3.14Å; A95-M98 WeakPolarHBondContact O-CB 3.25Å; A95-M98 PolarHBondContact O-N 3.18Å; A95-F99 VanDerWaalsContact O-CD2 3.28Å; A95-F99 WeakPolarHBondContact O-CD2 3.28Å; A95-F99 PolarHBondContact O-N 2.62Å; A95-L268 HydrophobicContact CB-CD2 3.58Å |
| 96 | V | 93.3 | Very high | 91.9 | Very high | 20 Ų | 20 | 22.4 Ų | 22.4 | 12% | 0.121 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -63 | -40.7 | 168.7 | 170.1 | 0 | 0 | 0 | 0 | 110.7 | F92 V93 M98 F99 L100 F265 L268 L272 | F92-V96 WeakPolarHBondContact O-CG2 3.48Å; F92-V96 PolarHBondContact O-N 3.46Å; V93-V96 PolarHBondContact O-N 3.49Å; V96-M98 VanDerWaalsContact C-N 3.28Å; V96-M98 PolarHBondContact O-N 2.98Å; V96-F99 PolarHBondContact O-N 3.27Å; V96-L100 WeakPolarHBondContact O-CB 3.23Å; V96-L100 PolarHBondContact O-N 3.25Å; V96-F265 HydrophobicContact CG1-CD2 3.86Å; V96-F265 HydrophobicContact CG1-CE2 3.58Å; V96-L268 HydrophobicContact CB-CD2 4.48Å; V96-L268 HydrophobicContact CG2-CB 4.13Å; V96-L268 HydrophobicContact CG2-CD2 3.63Å; V96-L268 HydrophobicContact CG2-CG 3.65Å; V96-L272 HydrophobicContact CG2-CD1 3.68Å; V96-L272 HydrophobicContact CG2-CG 4.16Å |
| 97 | G | 93.3 | Very high | 92.1 | Very high | 16 Ų | 16 | 23.8 Ų | 23.8 | 17% | 0.165 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -61.2 | -32.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | V93 Q94 A95 G101 T315 | V93-G97 PolarHBondContact O-N 3.36Å; Q94-G97 CarbonylContact O-C 3.54Å; Q94-G97 WeakPolarHBondContact O-CA 3.29Å; Q94-G97 PolarHBondContact O-N 3.26Å; Q94-G97 VanDerWaalsContact O-N 3.12Å; A95-G97 VanDerWaalsContact C-N 3.31Å; A95-G97 PolarHBondContact O-N 3.14Å; G97-G101 PolarHBondContact O-N 2.7Å; G97-G101 VanDerWaalsContact O-N 3.17Å; G97-T315 WeakPolarHBondContact O-CG2 3.4Å; G97-T315 PolarHBondContact O-OG1 3.35Å |
| 98 | M | 92.7 | Very high | 92.4 | Very high | 31 Ų | 31 | 24.7 Ų | 24.7 | 15% | 0.153 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -65.5 | -54.7 | 173.1 | 176.9 | 179.1 | 90.5 | 0 | 0 | 111.3 | Q94 A95 V96 L100 G101 E102 D142 T146 I318 | Q94-M98 PolarHBondContact O-N 3.06Å; A95-M98 WeakPolarHBondContact O-CB 3.25Å; A95-M98 PolarHBondContact O-N 3.18Å; V96-M98 VanDerWaalsContact C-N 3.28Å; V96-M98 PolarHBondContact O-N 2.98Å; M98-L100 PolarHBondContact O-N 2.98Å; M98-G101 WeakPolarHBondContact O-CA 3.32Å; M98-G101 PolarHBondContact O-N 3.09Å; M98-E102 PolarHBondContact O-N 3.35Å; M98-E102 VanDerWaalsContact O-N 3.09Å; M98-D142 WeakPolarHBondContact CE-OD2 3.26Å; M98-T146 HydrophobicContact CE-CG2 4.47Å; M98-I318 HydrophobicContact CB-CD1 3.68Å; M98-I318 HydrophobicContact CB-CG2 4.36Å; M98-I318 HydrophobicContact CG-CD1 3.75Å; M98-I318 HydrophobicContact CG-CG1 4.29Å; M98-I318 HydrophobicContact CG-CG2 3.65Å; M98-I318 WeakPolarHBondContact O-CG2 3.47Å |
| 99 | F | 94.7 | Very high | 92.5 | Very high | 1 Ų | 1 | 24.8 Ų | 24.8 | 0% | 0.004 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -63.6 | -30.7 | 178 | -73.2 | -58.4 | 0 | 0 | 0 | 112.9 | A95 V96 G101 E102 F103 D142 M143 F265 L268 | A95-F99 VanDerWaalsContact O-CD2 3.28Å; A95-F99 WeakPolarHBondContact O-CD2 3.28Å; A95-F99 PolarHBondContact O-N 2.62Å; V96-F99 PolarHBondContact O-N 3.27Å; F99-G101 VanDerWaalsContact C-N 3.32Å; F99-E102 PolarHBondContact O-N 3.28Å; F99-F103 VanDerWaalsContact O-CB 3.25Å; F99-F103 WeakPolarHBondContact O-CB 3.47Å; F99-F103 PolarHBondContact O-N 2.82Å; F99-D142 WeakPolarHBondContact CE1-OD2 3.09Å; F99-D142 WeakPolarHBondContact CZ-OD2 3.16Å; F99-M143 HydrophobicContact CE2-CB 4.3Å; F99-M143 HydrophobicContact CE2-CE 4.25Å; F99-M143 HydrophobicContact CE2-CG 4.45Å; F99-M143 HydrophobicContact CZ-CB 4.04Å; F99-F265 HydrophobicContact CB-CB 3.89Å; F99-L268 HydrophobicContact CD2-CB 4.35Å; F99-L268 HydrophobicContact CD2-CD2 3.81Å; F99-L268 HydrophobicContact CE2-CB 4.49Å; F99-L268 HydrophobicContact CE2-CD2 3.89Å |
| 100 | L | 95.3 | Very high | 92.8 | Very high | 78 Ų | 78 | 29.3 Ų | 29.3 | 41% | 0.408 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -62.9 | -39.8 | 171.6 | -178.6 | 62.2 | 0 | 0 | 0 | 111.7 | V96 M98 F103 S104 F265 | V96-L100 WeakPolarHBondContact O-CB 3.23Å; V96-L100 PolarHBondContact O-N 3.25Å; M98-L100 PolarHBondContact O-N 2.98Å; L100-F103 HydrophobicContact CD1-CD1 4.27Å; L100-F103 PolarHBondContact O-N 3.08Å; L100-S104 PolarHBondContact O-N 2.91Å; L100-F265 HydrophobicContact CB-CD2 4.03Å; L100-F265 HydrophobicContact CB-CE2 4.08Å; L100-F265 HydrophobicContact CD1-CD2 4.4Å; L100-F265 HydrophobicContact CD1-CE2 4.05Å; L100-F265 HydrophobicContact CD1-CZ 4.45Å |
| 101 | G | 95.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -61.5 | -47.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | G97 M98 F99 S104 A319 | G97-G101 PolarHBondContact O-N 2.7Å; G97-G101 VanDerWaalsContact O-N 3.17Å; M98-G101 WeakPolarHBondContact O-CA 3.32Å; M98-G101 PolarHBondContact O-N 3.09Å; F99-G101 VanDerWaalsContact C-N 3.32Å; G101-S104 WeakPolarHBondContact O-CB 3.49Å; G101-S104 PolarHBondContact O-N 2.88Å; G101-S104 PolarHBondContact O-OG 3.45Å; G101-A319 VanDerWaalsContact O-CB 3.3Å; G101-A319 WeakPolarHBondContact O-CB 3.47Å |
| 102 | E | 95 | Very high | 93 | Very high | 3 Ų | 3 | 37.4 Ų | 37.4 | 1% | 0.014 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.2 | -45.5 | 175.5 | -67.8 | 174.4 | -169.4 | 0 | 0 | 112.3 | M98 F99 S104 C105 V257 G258 I318 N322 | M98-E102 PolarHBondContact O-N 3.35Å; M98-E102 VanDerWaalsContact O-N 3.09Å; F99-E102 PolarHBondContact O-N 3.28Å; E102-S104 PolarHBondContact O-N 3.35Å; E102-C105 WeakPolarHBondContact O-CB 3.42Å; E102-C105 PolarHBondContact O-N 2.81Å; E102-V257 HydrophobicContact CB-CG1 3.83Å; E102-V257 HydrophobicContact CG-CG1 3.92Å; E102-G258 WeakPolarHBondContact O-CA 3.28Å; E102-I318 HydrophobicContact CG-CG2 4Å; E102-N322 HydrophobicContact CG-CB 4.22Å; E102-N322 WeakPolarHBondContact CG-ND2 3.34Å; E102-N322 PolarHBondContact OE1-ND2 2.85Å |
| 103 | F | 96 | Very high | 92.9 | Very high | 71 Ų | 71 | 37.8 Ų | 37.8 | 31% | 0.311 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -58.1 | -35.9 | 176.7 | 173.6 | -133.2 | 0 | 0 | 0 | 111.7 | F99 L100 C105 L106 L262 | F99-F103 VanDerWaalsContact O-CB 3.25Å; F99-F103 WeakPolarHBondContact O-CB 3.47Å; F99-F103 PolarHBondContact O-N 2.82Å; L100-F103 HydrophobicContact CD1-CD1 4.27Å; L100-F103 PolarHBondContact O-N 3.08Å; F103-C105 PolarHBondContact O-N 3.35Å; F103-L106 HydrophobicContact CD2-CB 4.43Å; F103-L106 HydrophobicContact CD2-CD2 4.48Å; F103-L106 HydrophobicContact CE2-CD2 4.17Å; F103-L106 VanDerWaalsContact O-CB 3.26Å; F103-L106 WeakPolarHBondContact O-CB 3.18Å; F103-L106 PolarHBondContact O-N 3.45Å; F103-L262 HydrophobicContact CD2-CB 3.84Å; F103-L262 HydrophobicContact CD2-CD1 4Å; F103-L262 HydrophobicContact CD2-CG 4.47Å; F103-L262 HydrophobicContact CE2-CB 4.26Å; F103-L262 HydrophobicContact CE2-CD1 3.71Å; F103-L262 HydrophobicContact CE2-CG 4.43Å; F103-L262 HydrophobicContact CZ-CD1 4.16Å |
| 104 | S | 95.6 | Very high | 92.7 | Very high | 49 Ų | 49 | 43 Ų | 43 | 34% | 0.343 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -60.3 | -26.1 | 176.3 | 84 | 0 | 0 | 0 | 0 | 113.4 | L100 G101 E102 L106 A107 V108 | L100-S104 PolarHBondContact O-N 2.91Å; G101-S104 WeakPolarHBondContact O-CB 3.49Å; G101-S104 PolarHBondContact O-N 2.88Å; G101-S104 PolarHBondContact O-OG 3.45Å; E102-S104 PolarHBondContact O-N 3.35Å; S104-L106 PolarHBondContact O-N 3.41Å; S104-A107 WeakPolarHBondContact O-CB 3.48Å; S104-A107 PolarHBondContact O-N 3.05Å; S104-A107 VanDerWaalsContact O-N 3.07Å; S104-V108 PolarHBondContact O-N 3.26Å |
| 105 | C | 94.5 | Very high | 92.6 | Very high | 5 Ų | 5 | 48 Ų | 48 | 3% | 0.034 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.6 | -30.6 | 173.3 | -64.9 | 0 | 0 | 0 | 0 | 112.3 | E102 F103 V108 F109 L254 V257 | E102-C105 WeakPolarHBondContact O-CB 3.42Å; E102-C105 PolarHBondContact O-N 2.81Å; F103-C105 PolarHBondContact O-N 3.35Å; C105-V108 PolarHBondContact O-N 3.03Å; C105-F109 WeakPolarHBondContact O-CB 3.28Å; C105-F109 PolarHBondContact O-N 3.31Å; C105-L254 HydrophobicContact CB-CD2 4.09Å; C105-V257 HydrophobicContact CB-CB 4.4Å; C105-V257 HydrophobicContact CB-CG1 4.21Å |
| 106 | L | 93.6 | Very high | 92.4 | Very high | 19 Ų | 19 | 48.6 Ų | 48.6 | 10% | 0.099 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -67.6 | -39.9 | 175.1 | -165.7 | 61.4 | 0 | 0 | 0 | 111.4 | F103 S104 F109 Y110 R255 | F103-L106 HydrophobicContact CD2-CB 4.43Å; F103-L106 HydrophobicContact CD2-CD2 4.48Å; F103-L106 HydrophobicContact CE2-CD2 4.17Å; F103-L106 VanDerWaalsContact O-CB 3.26Å; F103-L106 WeakPolarHBondContact O-CB 3.18Å; F103-L106 PolarHBondContact O-N 3.45Å; S104-L106 PolarHBondContact O-N 3.41Å; L106-F109 WeakPolarHBondContact O-CB 3.49Å; L106-F109 PolarHBondContact O-N 2.87Å; L106-Y110 HydrophobicContact CD1-CD2 4.37Å; L106-Y110 HydrophobicContact CD1-CE2 3.85Å; L106-Y110 HydrophobicContact CD2-CE2 4.26Å; L106-Y110 HydrophobicContact CG-CD2 4.06Å; L106-Y110 HydrophobicContact CG-CE2 3.74Å; L106-Y110 VanDerWaalsContact O-CD2 3.23Å; L106-Y110 WeakPolarHBondContact O-CD2 3.23Å; L106-Y110 PolarHBondContact O-N 3.27Å; L106-R255 HydrophobicContact CD1-CG 4.41Å |
| 107 | A | 92.6 | Very high | 92 | Very high | 56 Ų | 56 | 55.5 Ų | 55.5 | 46% | 0.463 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -63.5 | -46.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | S104 F109 Y110 I111 | S104-A107 WeakPolarHBondContact O-CB 3.48Å; S104-A107 PolarHBondContact O-N 3.05Å; S104-A107 VanDerWaalsContact O-N 3.07Å; A107-F109 VanDerWaalsContact C-N 3.33Å; A107-F109 PolarHBondContact O-N 3.37Å; A107-Y110 PolarHBondContact O-N 3.26Å; A107-I111 VanDerWaalsContact O-CG1 3.27Å; A107-I111 WeakPolarHBondContact O-CG1 3.4Å; A107-I111 PolarHBondContact O-N 3.34Å |
| 108 | V | 92.9 | Very high | 91.6 | Very high | 67 Ų | 67 | 65 Ų | 65 | 41% | 0.406 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -59.5 | -43.7 | 175.1 | 177.4 | 0 | 0 | 0 | 0 | 111.1 | S104 C105 Y110 I111 L112 L254 | S104-V108 PolarHBondContact O-N 3.26Å; C105-V108 PolarHBondContact O-N 3.03Å; V108-Y110 PolarHBondContact O-N 2.92Å; V108-I111 PolarHBondContact O-N 2.82Å; V108-L112 HydrophobicContact CG1-CD1 4.02Å; V108-L112 HydrophobicContact CG1-CG 4.32Å; V108-L112 WeakPolarHBondContact O-CG 3.29Å; V108-L112 PolarHBondContact O-N 3.04Å; V108-L254 HydrophobicContact CG1-CD1 4.32Å |
| 109 | F | 91.8 | Very high | 91 | Very high | 2 Ų | 2 | 65.5 Ų | 65.5 | 1% | 0.009 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -56.9 | -49.2 | 176.6 | 177.4 | -106.2 | 0 | 0 | 0 | 112.1 | C105 L106 A107 L112 L113 M124 V126 H252 L254 R255 | C105-F109 WeakPolarHBondContact O-CB 3.28Å; C105-F109 PolarHBondContact O-N 3.31Å; L106-F109 WeakPolarHBondContact O-CB 3.49Å; L106-F109 PolarHBondContact O-N 2.87Å; A107-F109 VanDerWaalsContact C-N 3.33Å; A107-F109 PolarHBondContact O-N 3.37Å; F109-L112 PolarHBondContact O-N 3.12Å; F109-L113 HydrophobicContact CD1-CD1 3.76Å; F109-L113 HydrophobicContact CD1-CG 4.42Å; F109-L113 HydrophobicContact CE1-CD1 3.24Å; F109-L113 HydrophobicContact CE1-CG 4.12Å; F109-L113 HydrophobicContact CE2-CD1 4.28Å; F109-L113 HydrophobicContact CE2-CG 4.34Å; F109-L113 HydrophobicContact CG-CD1 4.47Å; F109-L113 HydrophobicContact CZ-CD1 3.55Å; F109-L113 HydrophobicContact CZ-CD2 4.31Å; F109-L113 HydrophobicContact CZ-CG 4.07Å; F109-L113 WeakPolarHBondContact O-CG 3.35Å; F109-L113 PolarHBondContact O-N 3.04Å; F109-M124 HydrophobicContact CD2-CE 3.4Å; F109-M124 VanDerWaalsContact CD2-CE 3.4Å; F109-M124 HydrophobicContact CE2-CE 3.53Å; F109-M124 HydrophobicContact CG-CE 4.49Å; F109-V126 HydrophobicContact CZ-CG1 4.03Å; F109-H252 HydrophobicContact CD2-CB 4.48Å; F109-H252 AromaticContact CD2-ND1 3.7Å; F109-H252 HydrophobicContact CE2-CB 3.74Å; F109-H252 AromaticContact CE2-CG 3.66Å; F109-H252 AromaticContact CE2-ND1 3.77Å; F109-H252 HydrophobicContact CZ-CB 4.44Å; F109-L254 HydrophobicContact CB-CB 3.91Å; F109-L254 HydrophobicContact CD2-CB 4.08Å; F109-L254 HydrophobicContact CG-CB 4.41Å; F109-R255 HydrophobicContact CD1-CB 4.07Å; F109-R255 HydrophobicContact CD1-CG 4.32Å; F109-R255 HydrophobicContact CD2-CB 4.16Å; F109-R255 HydrophobicContact CE1-CB 3.91Å; F109-R255 HydrophobicContact CE1-CG 3.99Å; F109-R255 HydrophobicContact CE2-CB 4.02Å; F109-R255 HydrophobicContact CG-CB 4.17Å; F109-R255 HydrophobicContact CZ-CB 3.89Å; F109-R255 HydrophobicContact CZ-CG 4.29Å |
| 110 | Y | 90.5 | Very high | 89.9 | Confident | 115 Ų | 115 | 71.9 Ų | 71.9 | 45% | 0.451 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -65.8 | -39.5 | 177.9 | -77.1 | -61.6 | 0 | 0 | 0 | 112.4 | L106 A107 V108 L112 L113 F114 | L106-Y110 HydrophobicContact CD1-CD2 4.37Å; L106-Y110 HydrophobicContact CD1-CE2 3.85Å; L106-Y110 HydrophobicContact CD2-CE2 4.26Å; L106-Y110 HydrophobicContact CG-CD2 4.06Å; L106-Y110 HydrophobicContact CG-CE2 3.74Å; L106-Y110 VanDerWaalsContact O-CD2 3.23Å; L106-Y110 WeakPolarHBondContact O-CD2 3.23Å; L106-Y110 PolarHBondContact O-N 3.27Å; A107-Y110 PolarHBondContact O-N 3.26Å; V108-Y110 PolarHBondContact O-N 2.92Å; Y110-L112 VanDerWaalsContact C-N 3.33Å; Y110-L112 PolarHBondContact O-N 3.27Å; Y110-L113 HydrophobicContact CD1-CD1 4.07Å; Y110-L113 HydrophobicContact CE1-CD1 4.42Å; Y110-L113 WeakPolarHBondContact O-CB 3.31Å; Y110-L113 PolarHBondContact O-N 2.89Å; Y110-F114 WeakPolarHBondContact O-CD2 3.43Å; Y110-F114 PolarHBondContact O-N 3.26Å |
| 111 | I | 91.6 | Very high | 88.9 | Confident | 115 Ų | 115 | 74.7 Ų | 74.7 | 59% | 0.59 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -58.3 | -47.1 | 175.1 | -69.4 | 164.4 | 0 | 0 | 0 | 110.5 | A107 V108 L113 F114 H115 | A107-I111 VanDerWaalsContact O-CG1 3.27Å; A107-I111 WeakPolarHBondContact O-CG1 3.4Å; A107-I111 PolarHBondContact O-N 3.34Å; V108-I111 PolarHBondContact O-N 2.82Å; I111-L113 PolarHBondContact O-N 2.82Å; I111-F114 PolarHBondContact O-N 3.41Å; I111-H115 WeakPolarHBondContact O-CB 3.39Å; I111-H115 PolarHBondContact O-N 3.42Å |
| 112 | L | 89.8 | Confident | 87.8 | Confident | 77 Ų | 77 | 79.3 Ų | 79.3 | 40% | 0.403 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.6 | -41.7 | 176.6 | -69 | 175.7 | 0 | 0 | 0 | 111.6 | V108 F109 Y110 H115 D116 M124 L254 | V108-L112 HydrophobicContact CG1-CD1 4.02Å; V108-L112 HydrophobicContact CG1-CG 4.32Å; V108-L112 WeakPolarHBondContact O-CG 3.29Å; V108-L112 PolarHBondContact O-N 3.04Å; F109-L112 PolarHBondContact O-N 3.12Å; Y110-L112 VanDerWaalsContact C-N 3.33Å; Y110-L112 PolarHBondContact O-N 3.27Å; L112-H115 PolarHBondContact O-N 3.09Å; L112-D116 VanDerWaalsContact O-CB 3.3Å; L112-D116 WeakPolarHBondContact O-CB 3.28Å; L112-D116 PolarHBondContact O-N 3.05Å; L112-M124 HydrophobicContact CB-CE 4.07Å; L112-M124 HydrophobicContact CB-SD 3.9Å; L112-M124 HydrophobicContact CD1-CE 4.36Å; L112-L254 HydrophobicContact CD1-CD1 3.72Å |
| 113 | L | 88.6 | Confident | 86.9 | Confident | 17 Ų | 17 | 89.4 Ų | 89.4 | 9% | 0.089 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -62.6 | -42.7 | 174.8 | -75.1 | 178.1 | 0 | 0 | 0 | 112.9 | F109 Y110 I111 H115 D116 K117 M124 V126 | F109-L113 HydrophobicContact CD1-CD1 3.76Å; F109-L113 HydrophobicContact CD1-CG 4.42Å; F109-L113 HydrophobicContact CE1-CD1 3.24Å; F109-L113 HydrophobicContact CE1-CG 4.12Å; F109-L113 HydrophobicContact CE2-CD1 4.28Å; F109-L113 HydrophobicContact CE2-CG 4.34Å; F109-L113 HydrophobicContact CG-CD1 4.47Å; F109-L113 HydrophobicContact CZ-CD1 3.55Å; F109-L113 HydrophobicContact CZ-CD2 4.31Å; F109-L113 HydrophobicContact CZ-CG 4.07Å; F109-L113 WeakPolarHBondContact O-CG 3.35Å; F109-L113 PolarHBondContact O-N 3.04Å; Y110-L113 HydrophobicContact CD1-CD1 4.07Å; Y110-L113 HydrophobicContact CE1-CD1 4.42Å; Y110-L113 WeakPolarHBondContact O-CB 3.31Å; Y110-L113 PolarHBondContact O-N 2.89Å; I111-L113 PolarHBondContact O-N 2.82Å; L113-H115 VanDerWaalsContact C-N 3.29Å; L113-H115 PolarHBondContact O-N 2.91Å; L113-D116 PolarHBondContact O-N 3.18Å; L113-K117 WeakPolarHBondContact O-CB 3.31Å; L113-K117 VanDerWaalsContact O-CG 3.27Å; L113-K117 WeakPolarHBondContact O-CG 3.42Å; L113-K117 PolarHBondContact O-N 2.94Å; L113-M124 HydrophobicContact CD2-CG 4.24Å; L113-M124 HydrophobicContact CD2-SD 3.57Å; L113-M124 VanDerWaalsContact CD2-SD 3.57Å; L113-M124 HydrophobicContact CG-SD 3.93Å; L113-V126 HydrophobicContact CD1-CG1 4.34Å; L113-V126 HydrophobicContact CD2-CB 4.37Å; L113-V126 HydrophobicContact CD2-CG1 4.05Å; L113-V126 HydrophobicContact CD2-CG2 3.56Å |
| 114 | F | 88.3 | Confident | 85.9 | Confident | 128 Ų | 128 | 87.7 Ų | 87.7 | 56% | 0.561 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -65.2 | -36.2 | 177.2 | -77.9 | -64.9 | 0 | 0 | 0 | 111.4 | Y110 I111 R118 | Y110-F114 WeakPolarHBondContact O-CD2 3.43Å; Y110-F114 PolarHBondContact O-N 3.26Å; I111-F114 PolarHBondContact O-N 3.41Å; F114-R118 WeakPolarHBondContact O-CG 3.31Å; F114-R118 PolarHBondContact O-N 3.43Å |
| 115 | H | 88.4 | Confident | 84.9 | Confident | 127 Ų | 127 | 90.2 Ų | 90.2 | 59% | 0.588 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -71.5 | -41 | 175.7 | -172.1 | -106.1 | 0 | 0 | 0 | 112.4 | I111 L112 L113 R118 S119 | I111-H115 WeakPolarHBondContact O-CB 3.39Å; I111-H115 PolarHBondContact O-N 3.42Å; L112-H115 PolarHBondContact O-N 3.09Å; L113-H115 VanDerWaalsContact C-N 3.29Å; L113-H115 PolarHBondContact O-N 2.91Å; H115-R118 PolarHBondContact O-N 3.39Å; H115-R118 VanDerWaalsContact O-N 3.16Å; H115-S119 PolarHBondContact O-N 2.97Å; H115-S119 PolarHBondContact O-OG 3.38Å |
| 116 | D | 87.1 | Confident | 83.7 | Confident | 24 Ų | 24 | 92.9 Ų | 92.9 | 13% | 0.128 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -67.7 | -38.8 | 178.2 | -163.2 | 58.9 | 0 | 0 | 0 | 111.5 | L112 L113 R118 S119 P122 R123 M124 | L112-D116 VanDerWaalsContact O-CB 3.3Å; L112-D116 WeakPolarHBondContact O-CB 3.28Å; L112-D116 PolarHBondContact O-N 3.05Å; L113-D116 PolarHBondContact O-N 3.18Å; D116-R118 PolarHBondContact O-N 3.24Å; D116-S119 WeakPolarHBondContact O-CB 3.44Å; D116-S119 PolarHBondContact O-N 3.33Å; D116-P122 VanDerWaalsContact OD2-CA 3.31Å; D116-P122 WeakPolarHBondContact OD2-CA 3.44Å; D116-P122 VanDerWaalsContact OD2-CB 3.29Å; D116-P122 WeakPolarHBondContact OD2-CB 3.3Å; D116-R123 PolarHBondContact OD1-N 3.14Å; D116-R123 PolarHBondContact OD2-N 3.16Å; D116-R123 VanDerWaalsContact OD2-N 3.14Å; D116-M124 HydrophobicContact CB-CB 4.2Å; D116-M124 VanDerWaalsContact OD2-CB 3.28Å; D116-M124 WeakPolarHBondContact OD2-CB 3.47Å; D116-M124 PolarHBondContact OD2-N 2.86Å |
| 117 | K | 84.3 | Confident | 82.6 | Confident | 165 Ų | 165 | 93 Ų | 93 | 72% | 0.717 | 47% | 0.465 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.7 | -23.2 | 172 | -78.3 | -179.1 | 178.6 | -174 | 0 | 114 | L113 | L113-K117 WeakPolarHBondContact O-CB 3.31Å; L113-K117 VanDerWaalsContact O-CG 3.27Å; L113-K117 WeakPolarHBondContact O-CG 3.42Å; L113-K117 PolarHBondContact O-N 2.94Å |
| 118 | R | 84.9 | Confident | 81.6 | Confident | 216 Ų | 216 | 96 Ų | 96 | 82% | 0.815 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.9 | -13.7 | 174.7 | -70.6 | 176.2 | -177.3 | -174.8 | 2 | 112.4 | F114 H115 D116 | F114-R118 WeakPolarHBondContact O-CG 3.31Å; F114-R118 PolarHBondContact O-N 3.43Å; H115-R118 PolarHBondContact O-N 3.39Å; H115-R118 VanDerWaalsContact O-N 3.16Å; D116-R118 PolarHBondContact O-N 3.24Å |
| 119 | S | 81.2 | Confident | 80.6 | Confident | 41 Ų | 41 | 98.3 Ų | 98.3 | 29% | 0.287 | 49% | 0.489 | S | S | . | . | S | Bend | trans | -80.9 | 142.6 | 178.2 | -61.5 | 0 | 0 | 0 | 0 | 110.1 | H115 D116 E121 | H115-S119 PolarHBondContact O-N 2.97Å; H115-S119 PolarHBondContact O-OG 3.38Å; D116-S119 WeakPolarHBondContact O-CB 3.44Å; D116-S119 PolarHBondContact O-N 3.33Å; S119-E121 PolarHBondContact O-N 3.02Å |
| 120 | P | 71.2 | Confident | 80 | Confident | 135 Ų | 135 | 98.8 Ų | 98.8 | 88% | 0.877 | 49% | 0.491 | S | S | * | . | S | Bend | trans | -65.6 | -23.7 | -178.7 | 24.1 | -32.4 | 0 | 0 | 0 | 113.2 | ||
| 121 | E | 74.4 | Confident | 79.8 | Confident | 137 Ų | 137 | 99.7 Ų | 99.7 | 64% | 0.64 | 50% | 0.504 | S | S | * | . | S | Bend | trans | -125.4 | 102.5 | 173.3 | -66.6 | -175.6 | 164.5 | 0 | 0 | 109.2 | S119 R123 | S119-E121 PolarHBondContact O-N 3.02Å; E121-R123 PolarHBondContact O-N 3.35Å |
| 122 | P | 72.5 | Confident | 79.4 | Confident | 97 Ų | 97 | 97.2 Ų | 97.2 | 63% | 0.63 | 50% | 0.495 | S | S | * | . | trans | -67 | 126.4 | 177.4 | 26.4 | -32.2 | 0 | 0 | 0 | 109.9 | D116 | D116-P122 VanDerWaalsContact OD2-CA 3.31Å; D116-P122 WeakPolarHBondContact OD2-CA 3.44Å; D116-P122 VanDerWaalsContact OD2-CB 3.29Å; D116-P122 WeakPolarHBondContact OD2-CB 3.3Å | ||
| 123 | R | 74.7 | Confident | 79.3 | Confident | 215 Ų | 215 | 99.4 Ų | 99.4 | 81% | 0.811 | 51% | 0.506 | S | S | * | . | trans | -106.3 | -12.1 | -178.2 | -64.5 | -178 | -179.3 | 179.2 | -0.7 | 112.7 | D116 E121 N125 | D116-R123 PolarHBondContact OD1-N 3.14Å; D116-R123 PolarHBondContact OD2-N 3.16Å; D116-R123 VanDerWaalsContact OD2-N 3.14Å; E121-R123 PolarHBondContact O-N 3.35Å; R123-N125 PolarHBondContact O-N 3.23Å | ||
| 124 | M | 75.9 | Confident | 79.3 | Confident | 34 Ų | 34 | 100.8 Ų | 100.8 | 17% | 0.167 | 51% | 0.513 | C | S | . | . | trans | -85.5 | 114.4 | -173.8 | -163.1 | 171 | -168.1 | 0 | 0 | 111 | F109 L112 L113 D116 V126 | F109-M124 HydrophobicContact CD2-CE 3.4Å; F109-M124 VanDerWaalsContact CD2-CE 3.4Å; F109-M124 HydrophobicContact CE2-CE 3.53Å; F109-M124 HydrophobicContact CG-CE 4.49Å; L112-M124 HydrophobicContact CB-CE 4.07Å; L112-M124 HydrophobicContact CB-SD 3.9Å; L112-M124 HydrophobicContact CD1-CE 4.36Å; L113-M124 HydrophobicContact CD2-CG 4.24Å; L113-M124 HydrophobicContact CD2-SD 3.57Å; L113-M124 VanDerWaalsContact CD2-SD 3.57Å; L113-M124 HydrophobicContact CG-SD 3.93Å; D116-M124 HydrophobicContact CB-CB 4.2Å; D116-M124 VanDerWaalsContact OD2-CB 3.28Å; D116-M124 WeakPolarHBondContact OD2-CB 3.47Å; D116-M124 PolarHBondContact OD2-N 2.86Å; M124-V126 PolarHBondContact O-N 3.41Å; M124-V126 VanDerWaalsContact O-N 3.14Å | ||
| 125 | N | 73.8 | Confident | 79.4 | Confident | 103 Ų | 103 | 94.7 Ų | 94.7 | 55% | 0.551 | 49% | 0.487 | S | S | * | . | trans | -74.2 | 104.5 | 168.2 | -173.9 | -0.1 | 0 | 0 | 0 | 109 | R123 G127 D250 H252 | R123-N125 PolarHBondContact O-N 3.23Å; N125-G127 PolarHBondContact O-N 3.28Å; N125-G127 PolarHBondContact OD1-N 3.46Å; N125-D250 PolarHBondContact ND2-OD2 2.92Å; N125-H252 PolarHBondContact O-CD2 3.43Å | ||
| 126 | V | 69.9 | Low | 79.7 | Confident | 60 Ų | 60 | 92.4 Ų | 92.4 | 36% | 0.364 | 48% | 0.475 | S | S | . | . | trans | -69.6 | -13.2 | -178.1 | -165.4 | 0 | 0 | 0 | 0 | 111.9 | F109 L113 M124 | F109-V126 HydrophobicContact CZ-CG1 4.03Å; L113-V126 HydrophobicContact CD1-CG1 4.34Å; L113-V126 HydrophobicContact CD2-CB 4.37Å; L113-V126 HydrophobicContact CD2-CG1 4.05Å; L113-V126 HydrophobicContact CD2-CG2 3.56Å; M124-V126 PolarHBondContact O-N 3.41Å; M124-V126 VanDerWaalsContact O-N 3.14Å | ||
| 127 | G | 69.5 | Low | 80 | Confident | 21 Ų | 21 | 94.1 Ų | 94.1 | 22% | 0.216 | 49% | 0.487 | C | S | . | . | trans | 69.4 | 179 | -171.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | N125 D250 | N125-G127 PolarHBondContact O-N 3.28Å; N125-G127 PolarHBondContact OD1-N 3.46Å; G127-D250 VanDerWaalsContact CA-O 3.3Å; G127-D250 WeakPolarHBondContact CA-O 3.42Å | ||
| 128 | Q | 72 | Confident | 80.4 | Confident | 120 Ų | 120 | 86.2 Ų | 86.2 | 56% | 0.561 | 45% | 0.453 | S | S | * | . | trans | -71.8 | 152.8 | 175.7 | -66.4 | -177.7 | -13 | 0 | 0 | 111.3 | F130 | Q128-F130 PolarHBondContact O-N 3.3Š| ||
| 129 | S | 71.7 | Confident | 80.8 | Confident | 115 Ų | 115 | 76 Ų | 76 | 80% | 0.804 | 41% | 0.414 | S | S | * | . | trans | -70.3 | 116.3 | 168.6 | 55.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 130 | F | 80.6 | Confident | 81.5 | Confident | 12 Ų | 12 | 76 Ų | 76 | 5% | 0.053 | 41% | 0.411 | C | S | . | . | trans | -116.7 | 157.3 | 173.1 | 67.5 | -84 | 0 | 0 | 0 | 110.2 | Q128 P132 L134 F135 H249 V251 R255 | Q128-F130 PolarHBondContact O-N 3.3Å; F130-P132 WeakPolarHBondContact O-CD 3.42Å; F130-L134 HydrophobicContact CD2-CB 4.47Å; F130-F135 HydrophobicContact CD2-CD2 4.15Å; F130-F135 AromaticContact CD2-CE2 3.99Å; F130-F135 HydrophobicContact CD2-CE2 3.99Å; F130-F135 AromaticContact CE2-CD2 3.4Å; F130-F135 HydrophobicContact CE2-CD2 3.4Å; F130-F135 AromaticContact CE2-CE2 3.36Å; F130-F135 HydrophobicContact CE2-CE2 3.36Å; F130-F135 HydrophobicContact CZ-CD2 4.02Å; F130-F135 AromaticContact CZ-CE2 3.67Å; F130-F135 HydrophobicContact CZ-CE2 3.67Å; F130-H249 HydrophobicContact CB-CB 4.26Å; F130-V251 HydrophobicContact CD1-CB 4.46Å; F130-V251 HydrophobicContact CD1-CG1 4.16Å; F130-V251 HydrophobicContact CD1-CG2 3.54Å; F130-V251 HydrophobicContact CE1-CB 4.09Å; F130-V251 HydrophobicContact CE1-CG1 3.34Å; F130-V251 HydrophobicContact CE1-CG2 3.59Å; F130-V251 HydrophobicContact CG-CG2 4.17Å; F130-V251 HydrophobicContact CZ-CG1 3.76Å; F130-V251 HydrophobicContact CZ-CG2 4.24Å; F130-R255 HydrophobicContact CE1-CG 4.35Å; F130-R255 HydrophobicContact CZ-CG 4.32Å | ||
| 131 | N | 84.7 | Confident | 82.6 | Confident | 135 Ų | 135 | 70.9 Ų | 70.9 | 72% | 0.722 | 38% | 0.378 | S | S | * | . | trans | -67.8 | 118.8 | 174.6 | -73.1 | -32.2 | 0 | 0 | 0 | 109.7 | L133 L134 | N131-L133 PolarHBondContact O-N 3.37Å; N131-L133 VanDerWaalsContact O-N 3.08Å; N131-L134 VanDerWaalsContact O-CB 3.24Å; N131-L134 WeakPolarHBondContact O-CB 3.23Å; N131-L134 PolarHBondContact O-N 3.03Å | ||
| 132 | P | 83.8 | Confident | 83.5 | Confident | 62 Ų | 62 | 65.3 Ų | 65.3 | 40% | 0.403 | 35% | 0.352 | S | S | . | . | G | 310 helix | trans | -55.2 | -31.8 | -177.5 | -27.8 | 35.9 | 0 | 0 | 0 | 113.7 | F130 L134 F135 F263 | F130-P132 WeakPolarHBondContact O-CD 3.42Å; P132-L134 PolarHBondContact O-N 3.03Å; P132-F135 PolarHBondContact O-N 3.04Å; P132-F263 HydrophobicContact CB-CZ 4.4Å; P132-F263 VanDerWaalsContact O-CE2 3.23Å; P132-F263 WeakPolarHBondContact O-CE2 3.34Å |
| 133 | L | 88.5 | Confident | 84.4 | Confident | 124 Ų | 124 | 61.1 Ų | 61.1 | 65% | 0.649 | 32% | 0.324 | S | S | * | . | G | 310 helix | trans | -56.6 | -16.2 | 176.3 | -66.8 | 173.4 | 0 | 0 | 0 | 114.2 | N131 F135 F136 F263 | N131-L133 PolarHBondContact O-N 3.37Å; N131-L133 VanDerWaalsContact O-N 3.08Å; L133-F135 PolarHBondContact O-N 3.35Å; L133-F136 VanDerWaalsContact O-CB 3.26Å; L133-F136 WeakPolarHBondContact O-CB 3.44Å; L133-F136 PolarHBondContact O-N 3.25Å; L133-F136 VanDerWaalsContact O-N 3.14Å; L133-F263 HydrophobicContact CD2-CE1 4.12Å; L133-F263 HydrophobicContact CD2-CZ 4.02Å |
| 134 | L | 88.9 | Confident | 85.2 | Confident | 45 Ų | 45 | 54 Ų | 54 | 24% | 0.236 | 31% | 0.305 | C | S | . | . | G | 310 helix | trans | -62 | -30.3 | 174.3 | -171.4 | 67.7 | 0 | 0 | 0 | 112.8 | F130 N131 P132 F136 P137 F245 H249 | F130-L134 HydrophobicContact CD2-CB 4.47Å; N131-L134 VanDerWaalsContact O-CB 3.24Å; N131-L134 WeakPolarHBondContact O-CB 3.23Å; N131-L134 PolarHBondContact O-N 3.03Å; P132-L134 PolarHBondContact O-N 3.03Å; L134-F136 VanDerWaalsContact C-N 3.31Å; L134-P137 WeakPolarHBondContact O-CD 3.48Å; L134-F245 HydrophobicContact CD1-CD1 3.96Å; L134-F245 HydrophobicContact CD1-CD2 4.29Å; L134-F245 HydrophobicContact CD1-CE1 3.65Å; L134-F245 HydrophobicContact CD1-CE2 4Å; L134-F245 HydrophobicContact CD1-CG 4.28Å; L134-F245 HydrophobicContact CD1-CZ 3.67Å; L134-F245 HydrophobicContact CD2-CB 3.99Å; L134-F245 HydrophobicContact CD2-CD1 3.91Å; L134-F245 HydrophobicContact CD2-CD2 4.24Å; L134-F245 HydrophobicContact CD2-CE1 4.47Å; L134-F245 HydrophobicContact CD2-CG 3.79Å; L134-F245 HydrophobicContact CG-CB 4.48Å; L134-F245 HydrophobicContact CG-CD1 4.01Å; L134-F245 HydrophobicContact CG-CD2 3.81Å; L134-F245 HydrophobicContact CG-CE1 4.15Å; L134-F245 HydrophobicContact CG-CE2 3.94Å; L134-F245 HydrophobicContact CG-CG 3.84Å; L134-F245 HydrophobicContact CG-CZ 4.11Å; L134-F245 VanDerWaalsContact O-CE2 3.29Å; L134-F245 WeakPolarHBondContact O-CE2 3.33Å; L134-H249 VanDerWaalsContact CD2-CE1 3.44Å; L134-H249 WeakPolarHBondContact CD2-CE1 3.46Å |
| 135 | F | 90.3 | Very high | 86.1 | Confident | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 30% | 0.297 | C | S | . | . | G | 310 helix | trans | -87.4 | 0.4 | 177.7 | -77.5 | -94.2 | 0 | 0 | 0 | 113.2 | F130 P132 L133 P138 A139 F245 V246 V251 A256 | F130-F135 HydrophobicContact CD2-CD2 4.15Å; F130-F135 AromaticContact CD2-CE2 3.99Å; F130-F135 HydrophobicContact CD2-CE2 3.99Å; F130-F135 AromaticContact CE2-CD2 3.4Å; F130-F135 HydrophobicContact CE2-CD2 3.4Å; F130-F135 AromaticContact CE2-CE2 3.36Å; F130-F135 HydrophobicContact CE2-CE2 3.36Å; F130-F135 HydrophobicContact CZ-CD2 4.02Å; F130-F135 AromaticContact CZ-CE2 3.67Å; F130-F135 HydrophobicContact CZ-CE2 3.67Å; P132-F135 PolarHBondContact O-N 3.04Å; L133-F135 PolarHBondContact O-N 3.35Å; F135-P138 WeakPolarHBondContact O-CD 3.43Å; F135-A139 WeakPolarHBondContact O-CB 3.43Å; F135-A139 PolarHBondContact O-N 3.39Å; F135-A139 VanDerWaalsContact O-N 3.16Å; F135-F245 HydrophobicContact CZ-CB 4.42Å; F135-V246 HydrophobicContact CZ-CG2 4.36Å; F135-V251 HydrophobicContact CE2-CG2 4.39Å; F135-V251 HydrophobicContact CZ-CG1 4.45Å; F135-V251 HydrophobicContact CZ-CG2 4.48Å; F135-A256 HydrophobicContact CD1-CB 4.46Å; F135-A256 HydrophobicContact CE1-CB 3.58Å; F135-A256 HydrophobicContact CE2-CB 4.48Å; F135-A256 HydrophobicContact CZ-CB 3.58Å |
| 136 | F | 93.3 | Very high | 86.8 | Confident | 80 Ų | 80 | 49.1 Ų | 49.1 | 35% | 0.351 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -66.3 | -47 | 176.3 | -177.6 | -97 | 0 | 0 | 0 | 112.9 | L133 L134 A139 M140 F263 V267 | L133-F136 VanDerWaalsContact O-CB 3.26Å; L133-F136 WeakPolarHBondContact O-CB 3.44Å; L133-F136 PolarHBondContact O-N 3.25Å; L133-F136 VanDerWaalsContact O-N 3.14Å; L134-F136 VanDerWaalsContact C-N 3.31Å; F136-A139 PolarHBondContact O-N 3.32Å; F136-M140 HydrophobicContact CD1-CG 4.06Å; F136-M140 HydrophobicContact CD2-CE 4.47Å; F136-M140 HydrophobicContact CE1-CG 3.62Å; F136-M140 HydrophobicContact CE1-SD 4.25Å; F136-M140 HydrophobicContact CE2-CE 3.98Å; F136-M140 HydrophobicContact CE2-CG 4.15Å; F136-M140 HydrophobicContact CE2-SD 3.99Å; F136-M140 HydrophobicContact CG-CG 4.5Å; F136-M140 HydrophobicContact CZ-CE 4.3Å; F136-M140 HydrophobicContact CZ-CG 3.67Å; F136-M140 HydrophobicContact CZ-SD 3.68Å; F136-M140 WeakPolarHBondContact O-CG 3.12Å; F136-M140 PolarHBondContact O-N 3Å; F136-F263 HydrophobicContact CB-CD2 4.31Å; F136-F263 HydrophobicContact CB-CE2 4.46Å; F136-F263 HydrophobicContact CB-CG 4.43Å; F136-F263 HydrophobicContact CD2-CB 4.02Å; F136-F263 AromaticContact CD2-CD1 3.72Å; F136-F263 HydrophobicContact CD2-CD1 3.72Å; F136-F263 HydrophobicContact CD2-CE1 4.32Å; F136-F263 AromaticContact CD2-CG 3.85Å; F136-F263 HydrophobicContact CD2-CG 3.85Å; F136-F263 HydrophobicContact CE2-CD1 4.46Å; F136-V267 HydrophobicContact CE2-CG2 4.11Å |
| 137 | P | 93.9 | Very high | 87.7 | Confident | 59 Ų | 59 | 47.8 Ų | 47.8 | 38% | 0.383 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -60.9 | -45.8 | 177.1 | -19.4 | 30.7 | 0 | 0 | 0 | 114.1 | L134 A139 M140 C141 | L134-P137 WeakPolarHBondContact O-CD 3.48Å; P137-A139 VanDerWaalsContact C-N 3.34Å; P137-A139 PolarHBondContact O-N 3.47Å; P137-M140 PolarHBondContact O-N 2.92Å; P137-C141 PolarHBondContact O-N 3.39Å; P137-C141 PolarHBondContact O-SG 3.36Å; P137-C141 VanDerWaalsContact O-SG 3.41Å |
| 138 | P | 93.1 | Very high | 88.7 | Confident | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -54.2 | -46.5 | 171 | -27.8 | 35.6 | 0 | 0 | 0 | 113.2 | F135 M140 C141 D142 Q238 L241 E242 F245 | F135-P138 WeakPolarHBondContact O-CD 3.43Å; P138-M140 VanDerWaalsContact C-N 3.3Å; P138-M140 PolarHBondContact O-N 3.44Å; P138-C141 WeakPolarHBondContact O-CB 3.5Å; P138-C141 PolarHBondContact O-N 2.9Å; P138-C141 VanDerWaalsContact O-N 3.1Å; P138-D142 PolarHBondContact O-N 2.82Å; P138-Q238 HydrophobicContact CB-CG 4.25Å; P138-L241 HydrophobicContact CG-CB 4.18Å; P138-E242 HydrophobicContact CB-CG 4.17Å; P138-F245 HydrophobicContact CG-CD2 4.15Å; P138-F245 HydrophobicContact CG-CE2 3.95Å |
| 139 | A | 93.6 | Very high | 89.6 | Confident | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -60.3 | -37.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | F135 F136 P137 M143 E260 F263 | F135-A139 WeakPolarHBondContact O-CB 3.43Å; F135-A139 PolarHBondContact O-N 3.39Å; F135-A139 VanDerWaalsContact O-N 3.16Å; F136-A139 PolarHBondContact O-N 3.32Å; P137-A139 VanDerWaalsContact C-N 3.34Å; P137-A139 PolarHBondContact O-N 3.47Å; A139-M143 WeakPolarHBondContact O-CB 3.25Å; A139-M143 PolarHBondContact O-N 3.18Å; A139-E260 HydrophobicContact CB-CG 3.88Å; A139-F263 HydrophobicContact CB-CB 3.94Å |
| 140 | M | 94.8 | Very high | 90.2 | Very high | 43 Ų | 43 | 40.3 Ų | 40.3 | 21% | 0.212 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -71.2 | -36.6 | 176.2 | -65.6 | -57.5 | 91.7 | 0 | 0 | 112 | F136 P137 P138 M143 T144 V267 | F136-M140 HydrophobicContact CD1-CG 4.06Å; F136-M140 HydrophobicContact CD2-CE 4.47Å; F136-M140 HydrophobicContact CE1-CG 3.62Å; F136-M140 HydrophobicContact CE1-SD 4.25Å; F136-M140 HydrophobicContact CE2-CE 3.98Å; F136-M140 HydrophobicContact CE2-CG 4.15Å; F136-M140 HydrophobicContact CE2-SD 3.99Å; F136-M140 HydrophobicContact CG-CG 4.5Å; F136-M140 HydrophobicContact CZ-CE 4.3Å; F136-M140 HydrophobicContact CZ-CG 3.67Å; F136-M140 HydrophobicContact CZ-SD 3.68Å; F136-M140 WeakPolarHBondContact O-CG 3.12Å; F136-M140 PolarHBondContact O-N 3Å; P137-M140 PolarHBondContact O-N 2.92Å; P138-M140 VanDerWaalsContact C-N 3.3Å; P138-M140 PolarHBondContact O-N 3.44Å; M140-M143 HydrophobicContact CE-CE 3.79Å; M140-T144 VanDerWaalsContact O-CB 3.24Å; M140-T144 WeakPolarHBondContact O-CB 3.12Å; M140-T144 PolarHBondContact O-N 3.49Å; M140-T144 PolarHBondContact O-OG1 3.43Å; M140-V267 HydrophobicContact CE-CB 3.92Å; M140-V267 HydrophobicContact CE-CG1 4.02Å; M140-V267 HydrophobicContact CE-CG2 3.86Å; M140-V267 HydrophobicContact SD-CG1 4.06Å; M140-V267 HydrophobicContact SD-CG2 4.35Å |
| 141 | C | 94.9 | Very high | 90.4 | Very high | 26 Ų | 26 | 42.3 Ų | 42.3 | 18% | 0.176 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.5 | -47 | 172.7 | -70.9 | 0 | 0 | 0 | 0 | 111.1 | P137 P138 T144 A145 I234 Q238 | P137-C141 PolarHBondContact O-N 3.39Å; P137-C141 PolarHBondContact O-SG 3.36Å; P137-C141 VanDerWaalsContact O-SG 3.41Å; P138-C141 WeakPolarHBondContact O-CB 3.5Å; P138-C141 PolarHBondContact O-N 2.9Å; P138-C141 VanDerWaalsContact O-N 3.1Å; C141-T144 PolarHBondContact O-N 3.27Å; C141-A145 VanDerWaalsContact O-CB 3.23Å; C141-A145 WeakPolarHBondContact O-CB 3.06Å; C141-A145 PolarHBondContact O-N 3.45Å; C141-I234 HydrophobicContact CB-CG2 3.79Å; C141-I234 VanDerWaalsContact O-CG2 3.29Å; C141-I234 WeakPolarHBondContact O-CG2 3.19Å; C141-Q238 HydrophobicContact CB-CB 3.78Å |
| 142 | D | 92.6 | Very high | 90.5 | Very high | 20 Ų | 20 | 35.9 Ų | 35.9 | 11% | 0.107 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -59 | -49.7 | 178.6 | -175 | 52.9 | 0 | 0 | 0 | 111.9 | M98 F99 P138 T144 A145 T146 Q238 | M98-D142 WeakPolarHBondContact CE-OD2 3.26Å; F99-D142 WeakPolarHBondContact CE1-OD2 3.09Å; F99-D142 WeakPolarHBondContact CZ-OD2 3.16Å; P138-D142 PolarHBondContact O-N 2.82Å; D142-T144 PolarHBondContact O-N 2.84Å; D142-A145 PolarHBondContact O-N 2.94Å; D142-T146 VanDerWaalsContact O-CB 3.26Å; D142-T146 WeakPolarHBondContact O-CB 3.37Å; D142-T146 PolarHBondContact O-N 3Å; D142-T146 PolarHBondContact O-OG1 2.87Å; D142-Q238 PolarHBondContact OD1-OE1 3.3Å |
| 143 | M | 91.5 | Very high | 90.5 | Very high | 9 Ų | 9 | 36 Ų | 36 | 4% | 0.044 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -60.9 | -46 | 178.2 | -177 | -176 | -54.4 | 0 | 0 | 112.3 | F99 A139 M140 T146 S147 G264 V267 L268 L271 | F99-M143 HydrophobicContact CE2-CB 4.3Å; F99-M143 HydrophobicContact CE2-CE 4.25Å; F99-M143 HydrophobicContact CE2-CG 4.45Å; F99-M143 HydrophobicContact CZ-CB 4.04Å; A139-M143 WeakPolarHBondContact O-CB 3.25Å; A139-M143 PolarHBondContact O-N 3.18Å; M140-M143 HydrophobicContact CE-CE 3.79Å; M143-T146 PolarHBondContact O-N 3.32Å; M143-S147 WeakPolarHBondContact O-CB 3.29Å; M143-S147 PolarHBondContact O-N 2.8Å; M143-S147 PolarHBondContact O-OG 2.89Å; M143-G264 VanDerWaalsContact CE-O 3.26Å; M143-G264 WeakPolarHBondContact CE-O 3.33Å; M143-V267 HydrophobicContact CE-CB 3.69Å; M143-V267 HydrophobicContact CE-CG1 3.72Å; M143-V267 HydrophobicContact SD-CB 4.4Å; M143-V267 HydrophobicContact SD-CG1 3.75Å; M143-L268 HydrophobicContact CE-CB 3.74Å; M143-L268 HydrophobicContact CG-CD1 4.29Å; M143-L268 HydrophobicContact SD-CB 4.17Å; M143-L268 HydrophobicContact SD-CD1 4.2Å; M143-L271 HydrophobicContact SD-CD1 3.78Å |
| 144 | T | 92.9 | Very high | 90 | Very high | 67 Ų | 67 | 33.5 Ų | 33.5 | 41% | 0.411 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -66.1 | -45.2 | -178.8 | -56.7 | 0 | 0 | 0 | 0 | 110.6 | M140 C141 D142 S147 I148 I234 | M140-T144 VanDerWaalsContact O-CB 3.24Å; M140-T144 WeakPolarHBondContact O-CB 3.12Å; M140-T144 PolarHBondContact O-N 3.49Å; M140-T144 PolarHBondContact O-OG1 3.43Å; C141-T144 PolarHBondContact O-N 3.27Å; D142-T144 PolarHBondContact O-N 2.84Å; T144-S147 PolarHBondContact O-N 3.49Å; T144-I148 HydrophobicContact CG2-CD1 3.99Å; T144-I148 WeakPolarHBondContact O-CG1 3.18Å; T144-I148 PolarHBondContact O-N 3.4Å; T144-I234 HydrophobicContact CG2-CD1 4.09Å |
| 145 | A | 93.4 | Very high | 89.7 | Confident | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -62.2 | -44.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | C141 D142 S147 I148 M149 I234 V235 | C141-A145 VanDerWaalsContact O-CB 3.23Å; C141-A145 WeakPolarHBondContact O-CB 3.06Å; C141-A145 PolarHBondContact O-N 3.45Å; D142-A145 PolarHBondContact O-N 2.94Å; A145-S147 VanDerWaalsContact C-N 3.34Å; A145-S147 PolarHBondContact O-N 2.95Å; A145-I148 PolarHBondContact O-N 3.39Å; A145-M149 WeakPolarHBondContact O-CB 3.18Å; A145-M149 WeakPolarHBondContact O-CG 3.37Å; A145-M149 PolarHBondContact O-N 3.07Å; A145-I234 HydrophobicContact CB-CB 4.09Å; A145-I234 HydrophobicContact CB-CG2 3.95Å; A145-V235 HydrophobicContact CB-CG2 3.53Å |
| 146 | T | 89.1 | Confident | 89.3 | Confident | 33 Ų | 33 | 33.5 Ų | 33.5 | 20% | 0.202 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62.6 | -41.1 | 178 | -63.6 | 0 | 0 | 0 | 0 | 111.7 | M98 D142 M143 M149 Y150 | M98-T146 HydrophobicContact CE-CG2 4.47Å; D142-T146 VanDerWaalsContact O-CB 3.26Å; D142-T146 WeakPolarHBondContact O-CB 3.37Å; D142-T146 PolarHBondContact O-N 3Å; D142-T146 PolarHBondContact O-OG1 2.87Å; M143-T146 PolarHBondContact O-N 3.32Å; T146-M149 PolarHBondContact O-N 2.91Å; T146-Y150 PolarHBondContact O-N 3.42Å |
| 147 | S | 88.6 | Confident | 88.5 | Confident | 33 Ų | 33 | 31.8 Ų | 31.8 | 23% | 0.231 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -63.8 | -44.8 | 176.6 | -57.1 | 0 | 0 | 0 | 0 | 112 | M143 T144 A145 Y150 V151 | M143-S147 WeakPolarHBondContact O-CB 3.29Å; M143-S147 PolarHBondContact O-N 2.8Å; M143-S147 PolarHBondContact O-OG 2.89Å; T144-S147 PolarHBondContact O-N 3.49Å; A145-S147 VanDerWaalsContact C-N 3.34Å; A145-S147 PolarHBondContact O-N 2.95Å; S147-Y150 PolarHBondContact O-N 3.17Å; S147-V151 WeakPolarHBondContact O-CG2 3.49Å; S147-V151 PolarHBondContact O-N 2.73Å; S147-V151 VanDerWaalsContact O-N 3.13Å |
| 148 | I | 91.4 | Very high | 87.6 | Confident | 42 Ų | 42 | 31 Ų | 31 | 22% | 0.215 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -65 | -41.7 | 176.4 | -65.8 | 166.6 | 0 | 0 | 0 | 110.7 | T144 A145 Y150 V151 A152 L227 A231 I234 | T144-I148 HydrophobicContact CG2-CD1 3.99Å; T144-I148 WeakPolarHBondContact O-CG1 3.18Å; T144-I148 PolarHBondContact O-N 3.4Å; A145-I148 PolarHBondContact O-N 3.39Å; I148-Y150 VanDerWaalsContact C-N 3.29Å; I148-Y150 PolarHBondContact O-N 2.98Å; I148-V151 PolarHBondContact O-N 3.09Å; I148-A152 WeakPolarHBondContact O-CB 3.39Å; I148-A152 PolarHBondContact O-N 3.31Å; I148-L227 HydrophobicContact CG2-CB 4Å; I148-L227 HydrophobicContact CG2-CD2 4.2Å; I148-L227 WeakPolarHBondContact CG2-O 3.4Å; I148-A231 HydrophobicContact CB-CB 4.12Å; I148-A231 HydrophobicContact CG2-CB 3.9Å; I148-I234 HydrophobicContact CD1-CD1 3.71Å |
| 149 | M | 89.4 | Confident | 86.7 | Confident | 21 Ų | 21 | 32.1 Ų | 32.1 | 10% | 0.103 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60.7 | -38.2 | 175.8 | -82.6 | -169.1 | -65.5 | 0 | 0 | 112.2 | A145 T146 A152 L153 F161 A231 V235 | A145-M149 WeakPolarHBondContact O-CB 3.18Å; A145-M149 WeakPolarHBondContact O-CG 3.37Å; A145-M149 PolarHBondContact O-N 3.07Å; T146-M149 PolarHBondContact O-N 2.91Å; M149-A152 PolarHBondContact O-N 2.7Å; M149-L153 WeakPolarHBondContact O-CG 3.44Å; M149-L153 PolarHBondContact O-N 2.96Å; M149-F161 HydrophobicContact CB-CE2 3.72Å; M149-F161 HydrophobicContact CB-CZ 4.04Å; M149-F161 HydrophobicContact CG-CE2 3.93Å; M149-F161 HydrophobicContact CG-CZ 4.33Å; M149-F161 WeakPolarHBondContact O-CE2 3.4Å; M149-F161 HydrophobicContact SD-CE2 4.27Å; M149-F161 HydrophobicContact SD-CZ 4.17Å; M149-A231 HydrophobicContact CG-CB 3.69Å; M149-V235 HydrophobicContact CE-CG2 4.39Å |
| 150 | Y | 84.8 | Confident | 86 | Confident | 35 Ų | 35 | 32.1 Ų | 32.1 | 14% | 0.137 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -64.7 | -48.2 | 175.5 | 175 | -104.3 | 0 | 0 | 0 | 111.9 | P91 F92 T146 S147 I148 A152 L153 N154 | P91-Y150 HydrophobicContact CB-CD1 3.93Å; P91-Y150 HydrophobicContact CB-CD2 3.17Å; P91-Y150 HydrophobicContact CB-CE1 3.93Å; P91-Y150 HydrophobicContact CB-CE2 3.17Å; P91-Y150 HydrophobicContact CB-CG 3.57Å; P91-Y150 HydrophobicContact CG-CD1 3.79Å; P91-Y150 HydrophobicContact CG-CD2 3.81Å; P91-Y150 HydrophobicContact CG-CE1 3.4Å; P91-Y150 HydrophobicContact CG-CE2 3.41Å; P91-Y150 VanDerWaalsContact CG-CE2 3.41Å; P91-Y150 HydrophobicContact CG-CG 3.99Å; P91-Y150 WeakPolarHBondContact CG-OH 3.25Å; F92-Y150 AromaticContact CE2-CD1 3.91Å; F92-Y150 HydrophobicContact CE2-CD1 3.91Å; F92-Y150 HydrophobicContact CE2-CE1 4.15Å; F92-Y150 HydrophobicContact CZ-CD1 4.08Å; T146-Y150 PolarHBondContact O-N 3.42Å; S147-Y150 PolarHBondContact O-N 3.17Å; I148-Y150 VanDerWaalsContact C-N 3.29Å; I148-Y150 PolarHBondContact O-N 2.98Å; Y150-A152 PolarHBondContact O-N 2.88Å; Y150-L153 WeakPolarHBondContact O-CB 3.4Å; Y150-L153 PolarHBondContact O-N 3.3Å; Y150-L153 VanDerWaalsContact O-N 3.12Å; Y150-N154 VanDerWaalsContact CZ-ND2 3.33Å; Y150-N154 PolarHBondContact O-N 3.38Å; Y150-N154 PolarHBondContact OH-ND2 3.26Å |
| 151 | V | 85.4 | Confident | 85.4 | Confident | 54 Ų | 54 | 30.7 Ų | 30.7 | 33% | 0.327 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -57.8 | -41.1 | 175.9 | 174.8 | 0 | 0 | 0 | 0 | 110.6 | S147 I148 L153 N154 M155 L227 | S147-V151 WeakPolarHBondContact O-CG2 3.49Å; S147-V151 PolarHBondContact O-N 2.73Å; S147-V151 VanDerWaalsContact O-N 3.13Å; I148-V151 PolarHBondContact O-N 3.09Å; V151-L153 PolarHBondContact O-N 3.3Å; V151-N154 PolarHBondContact O-N 3.21Å; V151-M155 HydrophobicContact CG1-SD 4.32Å; V151-M155 WeakPolarHBondContact O-CG 3.39Å; V151-L227 HydrophobicContact CG1-CD1 4.24Å |
| 152 | A | 87.3 | Confident | 84.6 | Confident | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -67.3 | -34.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | I148 M149 Y150 N154 M155 T156 G224 L227 I228 | I148-A152 WeakPolarHBondContact O-CB 3.39Å; I148-A152 PolarHBondContact O-N 3.31Å; M149-A152 PolarHBondContact O-N 2.7Å; Y150-A152 PolarHBondContact O-N 2.88Å; A152-N154 PolarHBondContact O-N 2.8Å; A152-M155 PolarHBondContact O-N 3.46Å; A152-T156 WeakPolarHBondContact O-CG2 3.38Å; A152-T156 PolarHBondContact O-N 2.95Å; A152-G224 WeakPolarHBondContact CB-O 3.39Å; A152-L227 HydrophobicContact CB-CB 3.93Å; A152-I228 HydrophobicContact CB-CD1 4.25Å; A152-I228 HydrophobicContact CB-CG1 3.57Å |
| 153 | L | 82.3 | Confident | 84 | Confident | 64 Ų | 64 | 30.6 Ų | 30.6 | 34% | 0.335 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -60.9 | -30.1 | 175.2 | -86.6 | 169 | 0 | 0 | 0 | 112.9 | M149 Y150 V151 M155 F161 | M149-L153 WeakPolarHBondContact O-CG 3.44Å; M149-L153 PolarHBondContact O-N 2.96Å; Y150-L153 WeakPolarHBondContact O-CB 3.4Å; Y150-L153 PolarHBondContact O-N 3.3Å; Y150-L153 VanDerWaalsContact O-N 3.12Å; V151-L153 PolarHBondContact O-N 3.3Å; L153-M155 VanDerWaalsContact C-N 3.26Å; L153-M155 PolarHBondContact O-N 2.95Å; L153-F161 HydrophobicContact CD1-CD1 4.39Å; L153-F161 HydrophobicContact CD1-CD2 4.36Å; L153-F161 HydrophobicContact CD1-CE1 3.85Å; L153-F161 HydrophobicContact CD1-CE2 3.89Å; L153-F161 HydrophobicContact CD1-CZ 3.56Å; L153-F161 HydrophobicContact CD2-CB 3.69Å; L153-F161 HydrophobicContact CD2-CD1 3.49Å; L153-F161 VanDerWaalsContact CD2-CD1 3.49Å; L153-F161 HydrophobicContact CD2-CD2 3.6Å; L153-F161 HydrophobicContact CD2-CE1 3.82Å; L153-F161 HydrophobicContact CD2-CE2 3.98Å; L153-F161 HydrophobicContact CD2-CG 3.31Å; L153-F161 HydrophobicContact CD2-CZ 4.05Å; L153-F161 HydrophobicContact CG-CD1 4.09Å; L153-F161 HydrophobicContact CG-CD2 3.56Å; L153-F161 HydrophobicContact CG-CE1 3.99Å; L153-F161 HydrophobicContact CG-CE2 3.52Å; L153-F161 HydrophobicContact CG-CG 3.84Å; L153-F161 HydrophobicContact CG-CZ 3.7Å |
| 154 | N | 79.6 | Confident | 83.8 | Confident | 72 Ų | 72 | 30.3 Ų | 30.3 | 39% | 0.385 | 18% | 0.176 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -13.6 | 175.8 | -67.9 | -7.8 | 0 | 0 | 0 | 112.6 | Y150 V151 A152 F283 | Y150-N154 VanDerWaalsContact CZ-ND2 3.33Å; Y150-N154 PolarHBondContact O-N 3.38Å; Y150-N154 PolarHBondContact OH-ND2 3.26Å; V151-N154 PolarHBondContact O-N 3.21Å; A152-N154 PolarHBondContact O-N 2.8Å; N154-F283 PolarHBondContact ND2-O 3.19Å |
| 155 | M | 80.9 | Confident | 83.4 | Confident | 33 Ų | 33 | 29 Ų | 29 | 16% | 0.163 | 16% | 0.163 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -109.2 | -26.7 | -175.8 | -60.1 | -179.6 | 73.6 | 0 | 0 | 113.6 | V151 A152 L153 D220 V221 T223 L227 | V151-M155 HydrophobicContact CG1-SD 4.32Å; V151-M155 WeakPolarHBondContact O-CG 3.39Å; A152-M155 PolarHBondContact O-N 3.46Å; L153-M155 VanDerWaalsContact C-N 3.26Å; L153-M155 PolarHBondContact O-N 2.95Å; M155-D220 HydrophobicContact CE-CB 4.38Å; M155-V221 WeakPolarHBondContact O-CA 3.17Å; M155-T223 HydrophobicContact CE-CG2 3.67Å; M155-L227 HydrophobicContact SD-CD1 3.99Å |
| 156 | T | 81.9 | Confident | 82.8 | Confident | 13 Ų | 13 | 29.5 Ų | 29.5 | 8% | 0.08 | 17% | 0.168 | C | C | . | . | S | Bend | trans | -118.2 | 172.2 | -178.9 | -167.6 | 0 | 0 | 0 | 0 | 112 | A152 S160 F161 D225 I228 | A152-T156 WeakPolarHBondContact O-CG2 3.38Å; A152-T156 PolarHBondContact O-N 2.95Å; T156-S160 WeakPolarHBondContact OG1-CB 3.04Å; T156-F161 HydrophobicContact CG2-CB 4.33Å; T156-D225 WeakPolarHBondContact CB-OD1 3.11Å; T156-D225 PolarHBondContact OG1-OD1 2.69Å; T156-I228 HydrophobicContact CG2-CD1 3.42Å; T156-I228 VanDerWaalsContact CG2-CD1 3.42Å |
| 157 | S | 76.4 | Confident | 82.8 | Confident | 44 Ų | 44 | 27.9 Ų | 27.9 | 31% | 0.308 | 16% | 0.158 | S | C | . | . | trans | -76.1 | 147.7 | 177.1 | 84 | 0 | 0 | 0 | 0 | 111.9 | S159 S160 F161 | S157-S159 PolarHBondContact O-N 3.45Å; S157-S159 PolarHBondContact OG-OG 2.82Å; S157-S160 PolarHBondContact O-N 3.43Å; S157-S160 VanDerWaalsContact O-N 3.08Å; S157-S160 WeakPolarHBondContact OG-CB 3.08Å; S157-S160 PolarHBondContact OG-N 2.67Å; S157-S160 PolarHBondContact OG-OG 2.97Å; S157-F161 PolarHBondContact O-N 2.95Å | ||
| 158 | A | 75.6 | Confident | 82.8 | Confident | 41 Ų | 41 | 26.4 Ų | 26.4 | 34% | 0.339 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -56.8 | -34.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q162 | A158-Q162 VanDerWaalsContact O-CG 3.3Å; A158-Q162 WeakPolarHBondContact O-CG 3.4Å; A158-Q162 PolarHBondContact O-N 3.48Å; A158-Q162 VanDerWaalsContact O-N 3.09Å |
| 159 | S | 74.4 | Confident | 82.6 | Confident | 24 Ų | 24 | 24.5 Ų | 24.5 | 17% | 0.168 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -63.9 | -48.6 | 173.3 | 36.9 | 0 | 0 | 0 | 0 | 112.7 | S157 F161 Q162 M163 Q364 | S157-S159 PolarHBondContact O-N 3.45Å; S157-S159 PolarHBondContact OG-OG 2.82Å; S159-F161 VanDerWaalsContact C-N 3.32Å; S159-F161 PolarHBondContact O-N 3.06Å; S159-Q162 PolarHBondContact O-N 2.97Å; S159-M163 WeakPolarHBondContact O-CE 3.43Å; S159-M163 VanDerWaalsContact O-CG 3.31Å; S159-M163 WeakPolarHBondContact O-CG 3.47Å; S159-M163 PolarHBondContact O-N 3.41Å; S159-M163 VanDerWaalsContact O-N 3.07Å; S159-Q364 VanDerWaalsContact CB-OE1 3.27Å; S159-Q364 PolarHBondContact OG-NE2 2.89Å; S159-Q364 VanDerWaalsContact OG-NE2 3.08Å; S159-Q364 PolarHBondContact OG-OE1 3.25Å; S159-Q364 VanDerWaalsContact OG-OE1 3.12Å |
| 160 | S | 78.8 | Confident | 82.7 | Confident | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -61.2 | -43.9 | 177.9 | -54.6 | 0 | 0 | 0 | 0 | 110.5 | T156 S157 Q162 M163 L164 D206 | T156-S160 WeakPolarHBondContact OG1-CB 3.04Å; S157-S160 PolarHBondContact O-N 3.43Å; S157-S160 VanDerWaalsContact O-N 3.08Å; S157-S160 WeakPolarHBondContact OG-CB 3.08Å; S157-S160 PolarHBondContact OG-N 2.67Å; S157-S160 PolarHBondContact OG-OG 2.97Å; S160-Q162 PolarHBondContact O-N 3.36Å; S160-M163 PolarHBondContact O-N 2.69Å; S160-L164 WeakPolarHBondContact O-CB 3.38Å; S160-L164 VanDerWaalsContact O-CG 3.31Å; S160-L164 WeakPolarHBondContact O-CG 3.29Å; S160-L164 PolarHBondContact O-N 3.13Å; S160-D206 WeakPolarHBondContact CB-OD2 3.05Å; S160-D206 PolarHBondContact OG-OD1 2.68Å; S160-D206 PolarHBondContact OG-OD2 2.86Å |
| 161 | F | 82.2 | Confident | 83.1 | Confident | 14 Ų | 14 | 24.8 Ų | 24.8 | 6% | 0.061 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -55.7 | -48.8 | 174.7 | 178.3 | -98.6 | 0 | 0 | 0 | 113.6 | M149 L153 T156 S157 S159 M163 R165 I228 | M149-F161 HydrophobicContact CB-CE2 3.72Å; M149-F161 HydrophobicContact CB-CZ 4.04Å; M149-F161 HydrophobicContact CG-CE2 3.93Å; M149-F161 HydrophobicContact CG-CZ 4.33Å; M149-F161 WeakPolarHBondContact O-CE2 3.4Å; M149-F161 HydrophobicContact SD-CE2 4.27Å; M149-F161 HydrophobicContact SD-CZ 4.17Å; L153-F161 HydrophobicContact CD1-CD1 4.39Å; L153-F161 HydrophobicContact CD1-CD2 4.36Å; L153-F161 HydrophobicContact CD1-CE1 3.85Å; L153-F161 HydrophobicContact CD1-CE2 3.89Å; L153-F161 HydrophobicContact CD1-CZ 3.56Å; L153-F161 HydrophobicContact CD2-CB 3.69Å; L153-F161 HydrophobicContact CD2-CD1 3.49Å; L153-F161 VanDerWaalsContact CD2-CD1 3.49Å; L153-F161 HydrophobicContact CD2-CD2 3.6Å; L153-F161 HydrophobicContact CD2-CE1 3.82Å; L153-F161 HydrophobicContact CD2-CE2 3.98Å; L153-F161 HydrophobicContact CD2-CG 3.31Å; L153-F161 HydrophobicContact CD2-CZ 4.05Å; L153-F161 HydrophobicContact CG-CD1 4.09Å; L153-F161 HydrophobicContact CG-CD2 3.56Å; L153-F161 HydrophobicContact CG-CE1 3.99Å; L153-F161 HydrophobicContact CG-CE2 3.52Å; L153-F161 HydrophobicContact CG-CG 3.84Å; L153-F161 HydrophobicContact CG-CZ 3.7Å; T156-F161 HydrophobicContact CG2-CB 4.33Å; S157-F161 PolarHBondContact O-N 2.95Å; S159-F161 VanDerWaalsContact C-N 3.32Å; S159-F161 PolarHBondContact O-N 3.06Å; F161-M163 VanDerWaalsContact C-N 3.33Å; F161-M163 PolarHBondContact O-N 3.2Å; F161-R165 PolarHBondContact O-N 3.48Å; F161-R165 VanDerWaalsContact O-N 3.13Å; F161-I228 HydrophobicContact CB-CD1 4.15Å; F161-I228 HydrophobicContact CD2-CD1 3.82Å; F161-I228 HydrophobicContact CD2-CG1 3.89Å; F161-I228 HydrophobicContact CE2-CG1 4.47Å; F161-I228 HydrophobicContact CG-CD1 4.45Å |
| 162 | Q | 78.1 | Confident | 83.3 | Confident | 33 Ų | 33 | 22.2 Ų | 22.2 | 15% | 0.154 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -64.7 | -37.7 | 178.8 | -72.7 | 173.8 | 15.2 | 0 | 0 | 112.5 | A158 S159 S160 | A158-Q162 VanDerWaalsContact O-CG 3.3Å; A158-Q162 WeakPolarHBondContact O-CG 3.4Å; A158-Q162 PolarHBondContact O-N 3.48Å; A158-Q162 VanDerWaalsContact O-N 3.09Å; S159-Q162 PolarHBondContact O-N 2.97Å; S160-Q162 PolarHBondContact O-N 3.36Å |
| 163 | M | 80.9 | Confident | 83.3 | Confident | 10 Ų | 10 | 22.2 Ų | 22.2 | 5% | 0.049 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -72.6 | -45.5 | -179.9 | -69.2 | -175 | -69.3 | 0 | 0 | 112 | S159 S160 F161 R165 G166 V202 Q364 F368 L371 | S159-M163 WeakPolarHBondContact O-CE 3.43Å; S159-M163 VanDerWaalsContact O-CG 3.31Å; S159-M163 WeakPolarHBondContact O-CG 3.47Å; S159-M163 PolarHBondContact O-N 3.41Å; S159-M163 VanDerWaalsContact O-N 3.07Å; S160-M163 PolarHBondContact O-N 2.69Å; F161-M163 VanDerWaalsContact C-N 3.33Å; F161-M163 PolarHBondContact O-N 3.2Å; M163-R165 PolarHBondContact O-N 3.49Å; M163-G166 PolarHBondContact O-N 3.08Å; M163-V202 HydrophobicContact CB-CG1 4.1Å; M163-V202 HydrophobicContact CB-CG2 4.17Å; M163-V202 HydrophobicContact CE-CG1 3.62Å; M163-V202 HydrophobicContact CE-CG2 4.18Å; M163-V202 HydrophobicContact SD-CG1 4.19Å; M163-V202 HydrophobicContact SD-CG2 3.68Å; M163-Q364 HydrophobicContact CE-CB 3.78Å; M163-Q364 HydrophobicContact CE-CG 3.8Å; M163-Q364 HydrophobicContact SD-CB 4.06Å; M163-Q364 VanDerWaalsContact SD-O 3.41Å; M163-F368 HydrophobicContact CG-CB 4.45Å; M163-F368 HydrophobicContact CG-CD2 4.14Å; M163-F368 HydrophobicContact SD-CB 4.17Å; M163-L371 HydrophobicContact CB-CD1 3.99Å |
| 164 | L | 86.3 | Confident | 83.7 | Confident | 4 Ų | 4 | 22.7 Ų | 22.7 | 2% | 0.021 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -67.6 | -25.2 | -180 | -70.6 | 176.4 | 0 | 0 | 0 | 112.5 | S160 G166 A167 L199 D225 I228 | S160-L164 WeakPolarHBondContact O-CB 3.38Å; S160-L164 VanDerWaalsContact O-CG 3.31Å; S160-L164 WeakPolarHBondContact O-CG 3.29Å; S160-L164 PolarHBondContact O-N 3.13Å; L164-G166 PolarHBondContact O-N 3.38Å; L164-A167 WeakPolarHBondContact O-CB 3.31Å; L164-A167 PolarHBondContact O-N 3.48Å; L164-L199 HydrophobicContact CD2-CD2 3.87Å; L164-D225 HydrophobicContact CD1-CB 3.57Å; L164-D225 WeakPolarHBondContact CD1-OD1 3.43Å; L164-I228 HydrophobicContact CB-CB 4.25Å; L164-I228 HydrophobicContact CB-CD1 4.45Å; L164-I228 HydrophobicContact CB-CG2 3.56Å; L164-I228 HydrophobicContact CD1-CB 4.3Å; L164-I228 HydrophobicContact CD1-CD1 3.85Å; L164-I228 HydrophobicContact CD1-CG2 4.5Å |
| 165 | R | 84.1 | Confident | 84.3 | Confident | 40 Ų | 40 | 21 Ų | 21 | 15% | 0.151 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -58.2 | -29.6 | 169.6 | -170 | 177.6 | -73.1 | 177.3 | -15.1 | 112.7 | F161 M163 A167 V168 Q232 | F161-R165 PolarHBondContact O-N 3.48Å; F161-R165 VanDerWaalsContact O-N 3.13Å; M163-R165 PolarHBondContact O-N 3.49Å; R165-A167 PolarHBondContact O-N 3.18Å; R165-A167 VanDerWaalsContact O-N 3.1Å; R165-V168 WeakPolarHBondContact O-CB 3.46Å; R165-V168 VanDerWaalsContact O-CG1 3.29Å; R165-V168 WeakPolarHBondContact O-CG1 3.36Å; R165-V168 PolarHBondContact O-N 3.2Å; R165-Q232 PolarHBondContact O-OE1 3.27Å |
| 166 | G | 81.8 | Confident | 84.6 | Confident | 9 Ų | 9 | 19.4 Ų | 19.4 | 9% | 0.093 | 11% | 0.109 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.1 | -18.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 114 | M163 L164 V168 I169 | M163-G166 PolarHBondContact O-N 3.08Å; L164-G166 PolarHBondContact O-N 3.38Å; G166-V168 PolarHBondContact O-N 2.95Å; G166-I169 VanDerWaalsContact O-CG2 3.3Å; G166-I169 WeakPolarHBondContact O-CG2 3.33Å; G166-I169 PolarHBondContact O-N 2.98Å |
| 167 | A | 87.9 | Confident | 84.8 | Confident | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 12% | 0.122 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.5 | -22.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | L164 R165 I169 I170 F171 L199 Q232 | L164-A167 WeakPolarHBondContact O-CB 3.31Å; L164-A167 PolarHBondContact O-N 3.48Å; R165-A167 PolarHBondContact O-N 3.18Å; R165-A167 VanDerWaalsContact O-N 3.1Å; A167-I169 PolarHBondContact O-N 3.31Å; A167-I169 VanDerWaalsContact O-N 3.07Å; A167-I170 WeakPolarHBondContact O-CB 3.26Å; A167-I170 PolarHBondContact O-N 3.06Å; A167-F171 HydrophobicContact CB-CE2 4.34Å; A167-L199 HydrophobicContact CB-CD1 3.46Å; A167-L199 VanDerWaalsContact CB-CD1 3.46Å; A167-L199 HydrophobicContact CB-CD2 3.88Å; A167-L199 HydrophobicContact CB-CG 4.32Å; A167-Q232 HydrophobicContact CB-CG 4.3Å |
| 168 | V | 89.6 | Confident | 85.3 | Confident | 2 Ų | 2 | 23 Ų | 23 | 1% | 0.012 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -54.4 | -31 | -179 | 73.8 | 0 | 0 | 0 | 0 | 112.7 | R165 G166 I170 F171 T172 Q232 V235 M338 | R165-V168 WeakPolarHBondContact O-CB 3.46Å; R165-V168 VanDerWaalsContact O-CG1 3.29Å; R165-V168 WeakPolarHBondContact O-CG1 3.36Å; R165-V168 PolarHBondContact O-N 3.2Å; G166-V168 PolarHBondContact O-N 2.95Å; V168-I170 VanDerWaalsContact C-N 3.3Å; V168-I170 PolarHBondContact O-N 3Å; V168-F171 PolarHBondContact O-N 3.2Å; V168-T172 VanDerWaalsContact O-CB 3.24Å; V168-T172 WeakPolarHBondContact O-CB 3.24Å; V168-T172 PolarHBondContact O-N 3.26Å; V168-T172 PolarHBondContact O-OG1 3.1Å; V168-Q232 HydrophobicContact CB-CB 4.42Å; V168-V235 HydrophobicContact CG2-CB 4.14Å; V168-V235 HydrophobicContact CG2-CG1 3.79Å; V168-M338 HydrophobicContact CB-SD 4.32Å; V168-M338 HydrophobicContact CG1-CB 4.22Å; V168-M338 HydrophobicContact CG1-CG 4.19Å; V168-M338 HydrophobicContact CG1-SD 3.65Å; V168-M338 HydrophobicContact CG2-CG 4.49Å; V168-M338 HydrophobicContact CG2-SD 3.66Å |
| 169 | I | 87.9 | Confident | 85.8 | Confident | 1 Ų | 1 | 26.8 Ų | 26.8 | 1% | 0.005 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -64.4 | -34.5 | 179.4 | -162.6 | 169.3 | 0 | 0 | 0 | 112.5 | G166 A167 G173 T195 V339 T375 Y378 | G166-I169 VanDerWaalsContact O-CG2 3.3Å; G166-I169 WeakPolarHBondContact O-CG2 3.33Å; G166-I169 PolarHBondContact O-N 2.98Å; A167-I169 PolarHBondContact O-N 3.31Å; A167-I169 VanDerWaalsContact O-N 3.07Å; I169-G173 PolarHBondContact O-N 2.85Å; I169-T195 HydrophobicContact CG2-CG2 3.9Å; I169-V339 HydrophobicContact CD1-CG2 3.64Å; I169-T375 HydrophobicContact CD1-CG2 3.99Å; I169-Y378 HydrophobicContact CD1-CD1 3.79Å; I169-Y378 HydrophobicContact CD1-CE1 4.42Å; I169-Y378 HydrophobicContact CD1-CG 3.86Å; I169-Y378 HydrophobicContact CG1-CD1 4.28Å; I169-Y378 HydrophobicContact CG1-CE1 4.45Å; I169-Y378 HydrophobicContact CG1-CG 4.38Å |
| 170 | I | 90.5 | Very high | 86.2 | Confident | 11 Ų | 11 | 26.7 Ų | 26.7 | 6% | 0.056 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -66.3 | -54.3 | -179.2 | -62.1 | 161.1 | 0 | 0 | 0 | 108.7 | A167 V168 G173 L174 I192 T195 I196 L199 | A167-I170 WeakPolarHBondContact O-CB 3.26Å; A167-I170 PolarHBondContact O-N 3.06Å; V168-I170 VanDerWaalsContact C-N 3.3Å; V168-I170 PolarHBondContact O-N 3Å; I170-G173 PolarHBondContact O-N 3.16Å; I170-L174 HydrophobicContact CG2-CD1 4.11Å; I170-L174 WeakPolarHBondContact O-CG 3.36Å; I170-L174 PolarHBondContact O-N 3.14Å; I170-I192 HydrophobicContact CG1-CG2 4.29Å; I170-I192 HydrophobicContact CG2-CG2 4Å; I170-T195 HydrophobicContact CD1-CG2 3.84Å; I170-T195 HydrophobicContact CG1-CG2 4.02Å; I170-I196 HydrophobicContact CD1-CG1 3.62Å; I170-I196 HydrophobicContact CG1-CG1 4.26Å; I170-I196 HydrophobicContact CG2-CD1 4.45Å; I170-I196 HydrophobicContact CG2-CG1 4.46Å; I170-L199 HydrophobicContact CD1-CD1 3.44Å; I170-L199 VanDerWaalsContact CD1-CD1 3.44Å |
| 171 | F | 92.6 | Very high | 86.2 | Confident | 52 Ų | 52 | 29.3 Ų | 29.3 | 23% | 0.228 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -67.9 | -41 | -177.7 | -58.2 | -65.3 | 0 | 0 | 0 | 111.6 | A167 V168 G173 L174 L175 I229 Q232 I233 S236 | A167-F171 HydrophobicContact CB-CE2 4.34Å; V168-F171 PolarHBondContact O-N 3.2Å; F171-G173 VanDerWaalsContact C-N 3.34Å; F171-G173 PolarHBondContact O-N 3.29Å; F171-L174 PolarHBondContact O-N 3.43Å; F171-L175 VanDerWaalsContact O-CB 3.28Å; F171-L175 WeakPolarHBondContact O-CB 3.29Å; F171-L175 VanDerWaalsContact O-CG 3.25Å; F171-L175 WeakPolarHBondContact O-CG 3.41Å; F171-L175 PolarHBondContact O-N 2.85Å; F171-I229 HydrophobicContact CE2-CG2 4.19Å; F171-I229 HydrophobicContact CZ-CG2 4.06Å; F171-Q232 HydrophobicContact CD2-CB 4.34Å; F171-Q232 HydrophobicContact CE2-CB 4.48Å; F171-I233 HydrophobicContact CD1-CG1 3.84Å; F171-I233 HydrophobicContact CD2-CG1 3.84Å; F171-I233 HydrophobicContact CE1-CD1 4.04Å; F171-I233 HydrophobicContact CE1-CG1 3.73Å; F171-I233 HydrophobicContact CE2-CD1 4.5Å; F171-I233 HydrophobicContact CE2-CG1 3.72Å; F171-I233 HydrophobicContact CG-CG1 3.89Å; F171-I233 HydrophobicContact CZ-CD1 4.01Å; F171-I233 HydrophobicContact CZ-CG1 3.67Å; F171-S236 WeakPolarHBondContact CB-OG 3.47Å |
| 172 | T | 90.4 | Very high | 85.9 | Confident | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62.8 | -42.3 | 177.3 | -54.1 | 0 | 0 | 0 | 0 | 111.1 | V168 S176 S236 M239 V240 T335 M338 | V168-T172 VanDerWaalsContact O-CB 3.24Å; V168-T172 WeakPolarHBondContact O-CB 3.24Å; V168-T172 PolarHBondContact O-N 3.26Å; V168-T172 PolarHBondContact O-OG1 3.1Å; T172-S176 VanDerWaalsContact O-CB 3.24Å; T172-S176 WeakPolarHBondContact O-CB 3.49Å; T172-S176 PolarHBondContact O-N 2.89Å; T172-S176 PolarHBondContact O-OG 2.94Å; T172-S236 VanDerWaalsContact OG1-CB 3.3Å; T172-S236 WeakPolarHBondContact OG1-CB 3.35Å; T172-M239 HydrophobicContact CG2-CB 4.34Å; T172-V240 HydrophobicContact CG2-CG2 4.22Å; T172-T335 HydrophobicContact CG2-CG2 4.21Å; T172-M338 HydrophobicContact CG2-CG 4.16Å |
| 173 | G | 88 | Confident | 86 | Confident | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -62.1 | -47.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | I169 I170 F171 S176 V177 | I169-G173 PolarHBondContact O-N 2.85Å; I170-G173 PolarHBondContact O-N 3.16Å; F171-G173 VanDerWaalsContact C-N 3.34Å; F171-G173 PolarHBondContact O-N 3.29Å; G173-S176 PolarHBondContact O-N 2.92Å; G173-V177 PolarHBondContact O-N 3.29Å |
| 174 | L | 90.6 | Very high | 85.9 | Confident | 73 Ų | 73 | 39 Ų | 39 | 38% | 0.382 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -66.1 | -44.9 | 179.2 | -68 | 173.8 | 0 | 0 | 0 | 112.5 | I170 F171 S176 V177 A178 W189 | I170-L174 HydrophobicContact CG2-CD1 4.11Å; I170-L174 WeakPolarHBondContact O-CG 3.36Å; I170-L174 PolarHBondContact O-N 3.14Å; F171-L174 PolarHBondContact O-N 3.43Å; L174-S176 VanDerWaalsContact C-N 3.3Å; L174-S176 PolarHBondContact O-N 3.41Å; L174-V177 PolarHBondContact O-N 3.3Å; L174-A178 PolarHBondContact O-N 3.33Å; L174-A178 VanDerWaalsContact O-N 3.16Å; L174-W189 HydrophobicContact CD2-CH2 3.95Å; L174-W189 HydrophobicContact CD2-CZ3 4.26Å |
| 175 | L | 91.3 | Very high | 85.6 | Confident | 36 Ų | 36 | 39.7 Ų | 39.7 | 19% | 0.188 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -66.5 | -32.2 | 177.3 | -69.9 | 172.6 | 0 | 0 | 0 | 111.9 | F171 V177 A178 F179 S236 V237 V240 | F171-L175 VanDerWaalsContact O-CB 3.28Å; F171-L175 WeakPolarHBondContact O-CB 3.29Å; F171-L175 VanDerWaalsContact O-CG 3.25Å; F171-L175 WeakPolarHBondContact O-CG 3.41Å; F171-L175 PolarHBondContact O-N 2.85Å; L175-V177 VanDerWaalsContact C-N 3.33Å; L175-V177 PolarHBondContact O-N 2.69Å; L175-A178 PolarHBondContact O-N 2.84Å; L175-F179 HydrophobicContact CB-CD2 4.31Å; L175-F179 HydrophobicContact CD2-CD2 3.97Å; L175-F179 HydrophobicContact CD2-CE2 3.66Å; L175-F179 WeakPolarHBondContact O-CB 3.38Å; L175-F179 PolarHBondContact O-N 3.32Å; L175-S236 WeakPolarHBondContact CD1-OG 3.49Å; L175-V237 HydrophobicContact CD1-CG2 3.8Å; L175-V240 HydrophobicContact CB-CG2 3.84Å |
| 176 | S | 86.3 | Confident | 85.4 | Confident | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.3 | -38.5 | 173.5 | -64.5 | 0 | 0 | 0 | 0 | 112.1 | T172 G173 L174 L180 G181 R182 | T172-S176 VanDerWaalsContact O-CB 3.24Å; T172-S176 WeakPolarHBondContact O-CB 3.49Å; T172-S176 PolarHBondContact O-N 2.89Å; T172-S176 PolarHBondContact O-OG 2.94Å; G173-S176 PolarHBondContact O-N 2.92Å; L174-S176 VanDerWaalsContact C-N 3.3Å; L174-S176 PolarHBondContact O-N 3.41Å; S176-L180 CarbonylContact O-C 3.58Å; S176-L180 WeakPolarHBondContact O-CA 3.41Å; S176-L180 VanDerWaalsContact O-CB 3.31Å; S176-L180 WeakPolarHBondContact O-CB 3.22Å; S176-L180 PolarHBondContact O-N 3.06Å; S176-G181 PolarHBondContact O-N 3.48Å; S176-R182 PolarHBondContact O-N 2.97Å |
| 177 | V | 87.2 | Confident | 85.3 | Confident | 56 Ų | 56 | 42.8 Ų | 42.8 | 34% | 0.339 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -64.2 | -43.9 | 173.3 | 177.6 | 0 | 0 | 0 | 0 | 110.5 | G173 L174 L175 G181 R182 L184 | G173-V177 PolarHBondContact O-N 3.29Å; L174-V177 PolarHBondContact O-N 3.3Å; L175-V177 VanDerWaalsContact C-N 3.33Å; L175-V177 PolarHBondContact O-N 2.69Å; V177-G181 WeakPolarHBondContact O-CA 3.3Å; V177-G181 PolarHBondContact O-N 3.23Å; V177-R182 WeakPolarHBondContact CG2-O 3.33Å; V177-L184 HydrophobicContact CG2-CD1 3.48Å; V177-L184 VanDerWaalsContact CG2-CD1 3.48Å; V177-L184 HydrophobicContact CG2-CD2 4.41Å; V177-L184 HydrophobicContact CG2-CG 3.49Å; V177-L184 VanDerWaalsContact CG2-CG 3.49Å |
| 178 | A | 87.4 | Confident | 85.1 | Confident | 76 Ų | 76 | 45 Ų | 45 | 63% | 0.628 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -71.9 | -42.9 | -176 | 0 | 0 | 0 | 0 | 0 | 113.9 | L174 L175 | L174-A178 PolarHBondContact O-N 3.33Å; L174-A178 VanDerWaalsContact O-N 3.16Å; L175-A178 PolarHBondContact O-N 2.84Å |
| 179 | F | 86 | Confident | 85 | Confident | 122 Ų | 122 | 51.5 Ų | 51.5 | 54% | 0.535 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -103.1 | -26.4 | -170.1 | -75.2 | -77.5 | 0 | 0 | 0 | 115.1 | L175 V240 | L175-F179 HydrophobicContact CB-CD2 4.31Å; L175-F179 HydrophobicContact CD2-CD2 3.97Å; L175-F179 HydrophobicContact CD2-CE2 3.66Å; L175-F179 WeakPolarHBondContact O-CB 3.38Å; L175-F179 PolarHBondContact O-N 3.32Å; F179-V240 HydrophobicContact CB-CG1 3.82Å; F179-V240 HydrophobicContact CD2-CG1 4.5Å; F179-V240 HydrophobicContact CG-CG1 4.44Å |
| 180 | L | 82 | Confident | 85 | Confident | 21 Ų | 21 | 55.6 Ų | 55.6 | 11% | 0.11 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -106.2 | -5.8 | 177 | -81 | 58.7 | 0 | 0 | 0 | 111.8 | S176 R182 V240 E243 K244 | S176-L180 CarbonylContact O-C 3.58Å; S176-L180 WeakPolarHBondContact O-CA 3.41Å; S176-L180 VanDerWaalsContact O-CB 3.31Å; S176-L180 WeakPolarHBondContact O-CB 3.22Å; S176-L180 PolarHBondContact O-N 3.06Å; L180-R182 HydrophobicContact CB-CG 4.12Å; L180-R182 PolarHBondContact O-N 3.39Å; L180-V240 HydrophobicContact CD1-CG1 3.53Å; L180-E243 HydrophobicContact CD2-CB 4.17Å; L180-E243 VanDerWaalsContact CD2-CD 3.5Å; L180-E243 HydrophobicContact CD2-CG 3.69Å; L180-E243 WeakPolarHBondContact CD2-OE2 3.47Å; L180-K244 HydrophobicContact CD1-CB 4.2Å |
| 181 | G | 78.4 | Confident | 84.8 | Confident | 55 Ų | 55 | 55.1 Ų | 55.1 | 57% | 0.567 | 29% | 0.291 | S | S | * | . | trans | 69.7 | 20.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | S176 V177 | S176-G181 PolarHBondContact O-N 3.48Å; V177-G181 WeakPolarHBondContact O-CA 3.3Å; V177-G181 PolarHBondContact O-N 3.23Å | ||
| 182 | R | 76.4 | Confident | 84.6 | Confident | 34 Ų | 34 | 52.9 Ų | 52.9 | 13% | 0.128 | 28% | 0.281 | C | S | . | . | trans | -67.1 | 148.6 | -177.7 | -71.6 | -149.4 | 165.4 | 120.9 | -5.4 | 113.1 | S176 V177 L180 E243 E406 | S176-R182 PolarHBondContact O-N 2.97Å; V177-R182 WeakPolarHBondContact CG2-O 3.33Å; L180-R182 HydrophobicContact CB-CG 4.12Å; L180-R182 PolarHBondContact O-N 3.39Å; R182-E243 IonicContact CZ-OE1 2.71Å; R182-E243 IonicContact CZ-OE2 3.76Å; R182-E243 IonicContact NH1-OE1 3.08Å; R182-E243 PolarHBondContact NH1-OE1 3.28Å; R182-E243 IonicContact NH1-OE2 2.86Å; R182-E243 PolarHBondContact NH1-OE2 3.44Å; R182-E243 IonicContact NH2-OE1 3.07Å; R182-E243 PolarHBondContact NH2-OE1 2.98Å; R182-E243 IonicContact NH2-OE2 2.89Å; R182-E406 WeakPolarHBondContact CA-OE1 3.23Å; R182-E406 WeakPolarHBondContact CB-OE1 3.22Å; R182-E406 WeakPolarHBondContact CD-OE1 3.48Å; R182-E406 WeakPolarHBondContact CG-OE1 3.3Å; R182-E406 IonicContact NE-OE1 3Å | ||
| 183 | R | 80.3 | Confident | 84.6 | Confident | 203 Ų | 203 | 58.5 Ų | 58.5 | 77% | 0.766 | 31% | 0.306 | S | S | * | . | trans | -104.5 | 112.5 | 171.4 | -66.2 | -173.6 | 175.9 | -167 | -1.4 | 110.6 | E406 | R183-E406 PolarHBondContact N-OE1 3.5Å; R183-E406 PolarHBondContact N-OE2 3Å | ||
| 184 | L | 78.7 | Confident | 84.7 | Confident | 24 Ų | 24 | 60.1 Ų | 60.1 | 13% | 0.126 | 31% | 0.314 | C | S | . | . | trans | -74.1 | 129.7 | 176.9 | -66.2 | 171 | 0 | 0 | 0 | 111.3 | V177 Q188 W189 I192 Y378 | V177-L184 HydrophobicContact CG2-CD1 3.48Å; V177-L184 VanDerWaalsContact CG2-CD1 3.48Å; V177-L184 HydrophobicContact CG2-CD2 4.41Å; V177-L184 HydrophobicContact CG2-CG 3.49Å; V177-L184 VanDerWaalsContact CG2-CG 3.49Å; L184-Q188 VanDerWaalsContact CA-OE1 3.25Å; L184-Q188 HydrophobicContact CB-CB 4.28Å; L184-Q188 HydrophobicContact CD2-CB 4.21Å; L184-W189 HydrophobicContact CD1-CZ2 4.27Å; L184-I192 HydrophobicContact CD1-CD1 4.01Å; L184-Y378 HydrophobicContact CD2-CE2 4.2Å; L184-Y378 WeakPolarHBondContact CD2-OH 3.4Å | ||
| 185 | A | 79.8 | Confident | 84.6 | Confident | 18 Ų | 18 | 56.6 Ų | 56.6 | 15% | 0.149 | 30% | 0.296 | C | S | . | . | trans | -64.8 | 155.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | S187 Q188 W189 | A185-S187 PolarHBondContact O-N 3.37Å; A185-S187 VanDerWaalsContact O-N 3.16Å; A185-Q188 HydrophobicContact CB-CG 4.41Å; A185-Q188 WeakPolarHBondContact O-CB 3.25Å; A185-Q188 PolarHBondContact O-N 3.38Å; A185-W189 PolarHBondContact O-N 3.05Å; A185-W189 VanDerWaalsContact O-N 3.15Å | ||
| 186 | P | 80.9 | Confident | 84.6 | Confident | 94 Ų | 94 | 58.5 Ų | 58.5 | 61% | 0.61 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -57.3 | -33.1 | 177.7 | -25.7 | 34.7 | 0 | 0 | 0 | 113.6 | Q188 W189 L190 | P186-Q188 VanDerWaalsContact C-N 3.35Å; P186-W189 PolarHBondContact O-N 3.16Å; P186-L190 PolarHBondContact O-N 2.83Å |
| 187 | S | 80.1 | Confident | 84.8 | Confident | 21 Ų | 21 | 62.4 Ų | 62.4 | 15% | 0.147 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -69.8 | -31 | 176.2 | 55.4 | 0 | 0 | 0 | 0 | 113.3 | A185 L190 G191 H382 | A185-S187 PolarHBondContact O-N 3.37Å; A185-S187 VanDerWaalsContact O-N 3.16Å; S187-L190 PolarHBondContact O-N 2.93Å; S187-G191 PolarHBondContact O-N 3.44Å; S187-H382 VanDerWaalsContact CB-CE1 3.42Å; S187-H382 WeakPolarHBondContact CB-CE1 3.42Å |
| 188 | Q | 83.1 | Confident | 84.8 | Confident | 47 Ų | 47 | 59.7 Ų | 59.7 | 22% | 0.22 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -68.4 | -42.7 | 172.7 | -74.4 | 169.8 | -23.1 | 0 | 0 | 111.2 | L184 A185 P186 L190 G191 I192 Y378 | L184-Q188 VanDerWaalsContact CA-OE1 3.25Å; L184-Q188 HydrophobicContact CB-CB 4.28Å; L184-Q188 HydrophobicContact CD2-CB 4.21Å; A185-Q188 HydrophobicContact CB-CG 4.41Å; A185-Q188 WeakPolarHBondContact O-CB 3.25Å; A185-Q188 PolarHBondContact O-N 3.38Å; P186-Q188 VanDerWaalsContact C-N 3.35Å; Q188-L190 VanDerWaalsContact C-N 3.33Å; Q188-L190 PolarHBondContact O-N 2.94Å; Q188-G191 PolarHBondContact O-N 3.47Å; Q188-I192 WeakPolarHBondContact O-CG1 3.39Å; Q188-I192 PolarHBondContact O-N 2.83Å; Q188-Y378 HydrophobicContact CB-CD2 3.71Å; Q188-Y378 HydrophobicContact CB-CE2 3.59Å; Q188-Y378 HydrophobicContact CB-CG 4.36Å; Q188-Y378 HydrophobicContact CG-CD1 4.26Å; Q188-Y378 HydrophobicContact CG-CD2 3.96Å; Q188-Y378 HydrophobicContact CG-CE1 4.19Å; Q188-Y378 HydrophobicContact CG-CE2 3.9Å; Q188-Y378 HydrophobicContact CG-CG 4.14Å; Q188-Y378 VanDerWaalsContact CG-O 3.22Å; Q188-Y378 WeakPolarHBondContact CG-O 3.28Å; Q188-Y378 VanDerWaalsContact O-CD2 3.28Å; Q188-Y378 WeakPolarHBondContact O-CD2 3.49Å |
| 189 | W | 86.8 | Confident | 84.8 | Confident | 137 Ų | 137 | 57.4 Ų | 57.4 | 52% | 0.519 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -59.5 | -43 | 172.7 | -82.8 | 103.1 | 0 | 0 | 0 | 112.7 | L174 L184 A185 P186 G191 I192 F193 | L174-W189 HydrophobicContact CD2-CH2 3.95Å; L174-W189 HydrophobicContact CD2-CZ3 4.26Å; L184-W189 HydrophobicContact CD1-CZ2 4.27Å; A185-W189 PolarHBondContact O-N 3.05Å; A185-W189 VanDerWaalsContact O-N 3.15Å; P186-W189 PolarHBondContact O-N 3.16Å; W189-G191 VanDerWaalsContact C-N 3.34Å; W189-I192 PolarHBondContact O-N 3.09Å; W189-F193 PolarHBondContact O-N 3.49Å |
| 190 | L | 88.1 | Confident | 84.9 | Confident | 88 Ų | 88 | 55.4 Ų | 55.4 | 46% | 0.461 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -62.4 | -41.8 | 174.3 | -178.2 | 63.3 | 0 | 0 | 0 | 111.8 | P186 S187 Q188 F193 I194 | P186-L190 PolarHBondContact O-N 2.83Å; S187-L190 PolarHBondContact O-N 2.93Å; Q188-L190 VanDerWaalsContact C-N 3.33Å; Q188-L190 PolarHBondContact O-N 2.94Å; L190-F193 PolarHBondContact O-N 3.34Å; L190-I194 HydrophobicContact CD1-CD1 4.04Å; L190-I194 HydrophobicContact CD1-CG1 4.4Å; L190-I194 HydrophobicContact CG-CD1 3.89Å; L190-I194 WeakPolarHBondContact O-CG1 3.07Å; L190-I194 PolarHBondContact O-N 3.3Å |
| 191 | G | 86.5 | Confident | 85.2 | Confident | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.2 | -44.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113 | S187 Q188 W189 I194 T195 G374 | S187-G191 PolarHBondContact O-N 3.44Å; Q188-G191 PolarHBondContact O-N 3.47Å; W189-G191 VanDerWaalsContact C-N 3.34Å; G191-I194 PolarHBondContact O-N 3.01Å; G191-T195 WeakPolarHBondContact O-CB 3.43Å; G191-T195 PolarHBondContact O-N 2.97Å; G191-T195 PolarHBondContact O-OG1 2.95Å; G191-G374 WeakPolarHBondContact CA-O 3.3Å |
| 192 | I | 88.9 | Confident | 85.4 | Confident | 6 Ų | 6 | 54.4 Ų | 54.4 | 3% | 0.031 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -58.7 | -48.5 | 173.7 | -71 | 172.8 | 0 | 0 | 0 | 110.4 | I170 L184 Q188 W189 I194 T195 I196 Y378 | I170-I192 HydrophobicContact CG1-CG2 4.29Å; I170-I192 HydrophobicContact CG2-CG2 4Å; L184-I192 HydrophobicContact CD1-CD1 4.01Å; Q188-I192 WeakPolarHBondContact O-CG1 3.39Å; Q188-I192 PolarHBondContact O-N 2.83Å; W189-I192 PolarHBondContact O-N 3.09Å; I192-I194 PolarHBondContact O-N 2.77Å; I192-T195 WeakPolarHBondContact O-CB 3.41Å; I192-T195 PolarHBondContact O-N 3.5Å; I192-I196 HydrophobicContact CG2-CD1 3.96Å; I192-I196 WeakPolarHBondContact O-CG1 3.25Å; I192-I196 PolarHBondContact O-N 2.62Å; I192-Y378 HydrophobicContact CD1-CD2 4.43Å; I192-Y378 HydrophobicContact CD1-CE2 3.9Å; I192-Y378 HydrophobicContact CG1-CD2 3.87Å; I192-Y378 HydrophobicContact CG1-CE2 3.82Å |
| 193 | F | 90.8 | Very high | 85.7 | Confident | 118 Ų | 118 | 54.1 Ų | 54.1 | 52% | 0.518 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -59.4 | -46 | -179.4 | 177.2 | -101.9 | 0 | 0 | 0 | 112.5 | W189 L190 T195 I196 L197 | W189-F193 PolarHBondContact O-N 3.49Å; L190-F193 PolarHBondContact O-N 3.34Å; F193-T195 VanDerWaalsContact C-N 3.31Å; F193-T195 PolarHBondContact O-N 2.96Å; F193-I196 PolarHBondContact O-N 2.87Å; F193-L197 HydrophobicContact CD1-CD1 4.1Å; F193-L197 HydrophobicContact CE1-CD1 3.54Å; F193-L197 HydrophobicContact CE1-CG 4.25Å; F193-L197 HydrophobicContact CZ-CD1 3.96Å; F193-L197 HydrophobicContact CZ-CD2 4.49Å; F193-L197 HydrophobicContact CZ-CG 4.32Å; F193-L197 PolarHBondContact O-N 3.25Å; F193-L197 VanDerWaalsContact O-N 3.09Å |
| 194 | I | 89.9 | Confident | 85.9 | Confident | 33 Ų | 33 | 49.1 Ų | 49.1 | 17% | 0.169 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -65.5 | -36.8 | 177.7 | -68.3 | 166 | 0 | 0 | 0 | 111.1 | L190 G191 I192 L197 G198 V370 L377 | L190-I194 HydrophobicContact CD1-CD1 4.04Å; L190-I194 HydrophobicContact CD1-CG1 4.4Å; L190-I194 HydrophobicContact CG-CD1 3.89Å; L190-I194 WeakPolarHBondContact O-CG1 3.07Å; L190-I194 PolarHBondContact O-N 3.3Å; G191-I194 PolarHBondContact O-N 3.01Å; I192-I194 PolarHBondContact O-N 2.77Å; I194-L197 WeakPolarHBondContact O-CB 3.4Å; I194-L197 PolarHBondContact O-N 2.9Å; I194-G198 PolarHBondContact O-N 3.44Å; I194-V370 HydrophobicContact CG2-CG1 3.98Å; I194-L377 HydrophobicContact CD1-CD1 3.22Å |
| 195 | T | 88.6 | Confident | 86 | Confident | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.4 | -42.4 | 175.8 | -51.9 | 0 | 0 | 0 | 0 | 110.9 | I169 I170 G191 I192 F193 L197 G198 L199 L371 | I169-T195 HydrophobicContact CG2-CG2 3.9Å; I170-T195 HydrophobicContact CD1-CG2 3.84Å; I170-T195 HydrophobicContact CG1-CG2 4.02Å; G191-T195 WeakPolarHBondContact O-CB 3.43Å; G191-T195 PolarHBondContact O-N 2.97Å; G191-T195 PolarHBondContact O-OG1 2.95Å; I192-T195 WeakPolarHBondContact O-CB 3.41Å; I192-T195 PolarHBondContact O-N 3.5Å; F193-T195 VanDerWaalsContact C-N 3.31Å; F193-T195 PolarHBondContact O-N 2.96Å; T195-L197 VanDerWaalsContact C-N 3.34Å; T195-L197 PolarHBondContact O-N 2.89Å; T195-G198 PolarHBondContact O-N 3.16Å; T195-G198 VanDerWaalsContact O-N 3.13Å; T195-L199 WeakPolarHBondContact O-CG 2.96Å; T195-L199 PolarHBondContact O-N 2.99Å; T195-L371 HydrophobicContact CG2-CD2 3.61Å; T195-L371 WeakPolarHBondContact O-CD2 3.44Å |
| 196 | I | 90.6 | Very high | 86 | Confident | 75 Ų | 75 | 48.1 Ų | 48.1 | 39% | 0.385 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -59.5 | -44.9 | 174.7 | -67.4 | 166.7 | 0 | 0 | 0 | 110.9 | I170 I192 F193 G198 L199 V200 | I170-I196 HydrophobicContact CD1-CG1 3.62Å; I170-I196 HydrophobicContact CG1-CG1 4.26Å; I170-I196 HydrophobicContact CG2-CD1 4.45Å; I170-I196 HydrophobicContact CG2-CG1 4.46Å; I192-I196 HydrophobicContact CG2-CD1 3.96Å; I192-I196 WeakPolarHBondContact O-CG1 3.25Å; I192-I196 PolarHBondContact O-N 2.62Å; F193-I196 PolarHBondContact O-N 2.87Å; I196-G198 VanDerWaalsContact C-N 3.3Å; I196-G198 PolarHBondContact O-N 2.97Å; I196-L199 PolarHBondContact O-N 3.48Å; I196-V200 WeakPolarHBondContact O-CG2 3.3Å; I196-V200 PolarHBondContact O-N 2.75Å |
| 197 | L | 90.2 | Very high | 85.9 | Confident | 82 Ų | 82 | 48 Ų | 48 | 43% | 0.429 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -59.5 | -41.7 | 174.9 | -69.1 | 176.3 | 0 | 0 | 0 | 111.8 | F193 I194 T195 V200 V201 | F193-L197 HydrophobicContact CD1-CD1 4.1Å; F193-L197 HydrophobicContact CE1-CD1 3.54Å; F193-L197 HydrophobicContact CE1-CG 4.25Å; F193-L197 HydrophobicContact CZ-CD1 3.96Å; F193-L197 HydrophobicContact CZ-CD2 4.49Å; F193-L197 HydrophobicContact CZ-CG 4.32Å; F193-L197 PolarHBondContact O-N 3.25Å; F193-L197 VanDerWaalsContact O-N 3.09Å; I194-L197 WeakPolarHBondContact O-CB 3.4Å; I194-L197 PolarHBondContact O-N 2.9Å; T195-L197 VanDerWaalsContact C-N 3.34Å; T195-L197 PolarHBondContact O-N 2.89Å; L197-V200 PolarHBondContact O-N 3.26Å; L197-V201 WeakPolarHBondContact O-CG2 3.49Å; L197-V201 PolarHBondContact O-N 3.41Å |
| 198 | G | 87.8 | Confident | 85.8 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -59.2 | -45.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | I194 T195 I196 V200 V201 V202 | I194-G198 PolarHBondContact O-N 3.44Å; T195-G198 PolarHBondContact O-N 3.16Å; T195-G198 VanDerWaalsContact O-N 3.13Å; I196-G198 VanDerWaalsContact C-N 3.3Å; I196-G198 PolarHBondContact O-N 2.97Å; G198-V200 PolarHBondContact O-N 3.39Å; G198-V201 PolarHBondContact O-N 3.44Å; G198-V202 WeakPolarHBondContact O-CG2 3.32Å; G198-V202 PolarHBondContact O-N 3.19Å |
| 199 | L | 87.4 | Confident | 85.1 | Confident | 28 Ų | 28 | 52.7 Ų | 52.7 | 15% | 0.147 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -62.8 | -41.8 | 177.2 | -66 | 173.3 | 0 | 0 | 0 | 112.2 | L164 A167 I170 T195 I196 V201 V202 G203 L371 | L164-L199 HydrophobicContact CD2-CD2 3.87Å; A167-L199 HydrophobicContact CB-CD1 3.46Å; A167-L199 VanDerWaalsContact CB-CD1 3.46Å; A167-L199 HydrophobicContact CB-CD2 3.88Å; A167-L199 HydrophobicContact CB-CG 4.32Å; I170-L199 HydrophobicContact CD1-CD1 3.44Å; I170-L199 VanDerWaalsContact CD1-CD1 3.44Å; T195-L199 WeakPolarHBondContact O-CG 2.96Å; T195-L199 PolarHBondContact O-N 2.99Å; I196-L199 PolarHBondContact O-N 3.48Å; L199-V201 VanDerWaalsContact C-N 3.33Å; L199-V201 PolarHBondContact O-N 2.97Å; L199-V202 PolarHBondContact O-N 2.89Å; L199-G203 PolarHBondContact O-N 2.89Å; L199-L371 HydrophobicContact CD2-CD1 4.46Å; L199-L371 HydrophobicContact CD2-CD2 3.84Å; L199-L371 HydrophobicContact CG-CD2 3.86Å |
| 200 | V | 88.3 | Confident | 83.9 | Confident | 79 Ų | 79 | 47.2 Ų | 47.2 | 48% | 0.479 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 176.5 | 172.8 | 0 | 0 | 0 | 0 | 110.7 | I196 L197 G198 G203 L204 | I196-V200 WeakPolarHBondContact O-CG2 3.3Å; I196-V200 PolarHBondContact O-N 2.75Å; L197-V200 PolarHBondContact O-N 3.26Å; G198-V200 PolarHBondContact O-N 3.39Å; V200-G203 PolarHBondContact O-N 2.93Å; V200-L204 HydrophobicContact CG1-CD1 3.89Å; V200-L204 HydrophobicContact CG1-CG 4.33Å; V200-L204 WeakPolarHBondContact O-CB 3.38Å; V200-L204 VanDerWaalsContact O-CG 3.25Å; V200-L204 WeakPolarHBondContact O-CG 3.28Å; V200-L204 PolarHBondContact O-N 3.03Å |
| 201 | V | 86.9 | Confident | 82.4 | Confident | 54 Ų | 54 | 48.7 Ų | 48.7 | 33% | 0.327 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -62.8 | -42.2 | 176.5 | 171 | 0 | 0 | 0 | 0 | 111.4 | L197 G198 L199 L204 A205 | L197-V201 WeakPolarHBondContact O-CG2 3.49Å; L197-V201 PolarHBondContact O-N 3.41Å; G198-V201 PolarHBondContact O-N 3.44Å; L199-V201 VanDerWaalsContact C-N 3.33Å; L199-V201 PolarHBondContact O-N 2.97Å; V201-L204 PolarHBondContact O-N 3.26Å; V201-A205 VanDerWaalsContact O-CB 3.31Å; V201-A205 WeakPolarHBondContact O-CB 3.38Å; V201-A205 PolarHBondContact O-N 3.29Å |
| 202 | V | 83.8 | Confident | 80.8 | Confident | 1 Ų | 1 | 59.3 Ų | 59.3 | 1% | 0.006 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -63.1 | -50.1 | 176.9 | 171.3 | 0 | 0 | 0 | 0 | 111.1 | M163 G198 L199 L204 A205 D206 L371 | M163-V202 HydrophobicContact CB-CG1 4.1Å; M163-V202 HydrophobicContact CB-CG2 4.17Å; M163-V202 HydrophobicContact CE-CG1 3.62Å; M163-V202 HydrophobicContact CE-CG2 4.18Å; M163-V202 HydrophobicContact SD-CG1 4.19Å; M163-V202 HydrophobicContact SD-CG2 3.68Å; G198-V202 WeakPolarHBondContact O-CG2 3.32Å; G198-V202 PolarHBondContact O-N 3.19Å; L199-V202 PolarHBondContact O-N 2.89Å; V202-L204 VanDerWaalsContact C-N 3.32Å; V202-L204 PolarHBondContact O-N 3.5Å; V202-A205 WeakPolarHBondContact O-CB 3.39Å; V202-A205 PolarHBondContact O-N 3.12Å; V202-A205 VanDerWaalsContact O-N 3.08Å; V202-D206 PolarHBondContact O-N 2.93Å; V202-L371 HydrophobicContact CG2-CD1 4.15Å |
| 203 | G | 83.1 | Confident | 79.3 | Confident | 28 Ų | 28 | 65.5 Ų | 65.5 | 29% | 0.289 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -62.9 | -36.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | L199 V200 F207 | L199-G203 PolarHBondContact O-N 2.89Å; V200-G203 PolarHBondContact O-N 2.93Å; G203-F207 WeakPolarHBondContact O-CB 3.48Å; G203-F207 PolarHBondContact O-N 3.31Å |
| 204 | L | 83.8 | Confident | 78 | Confident | 98 Ų | 98 | 64.4 Ų | 64.4 | 51% | 0.513 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -68.5 | -36.4 | 172.9 | -71.9 | 174.4 | 0 | 0 | 0 | 112.2 | V200 V201 V202 D206 F207 V208 | V200-L204 HydrophobicContact CG1-CD1 3.89Å; V200-L204 HydrophobicContact CG1-CG 4.33Å; V200-L204 WeakPolarHBondContact O-CB 3.38Å; V200-L204 VanDerWaalsContact O-CG 3.25Å; V200-L204 WeakPolarHBondContact O-CG 3.28Å; V200-L204 PolarHBondContact O-N 3.03Å; V201-L204 PolarHBondContact O-N 3.26Å; V202-L204 VanDerWaalsContact C-N 3.32Å; V202-L204 PolarHBondContact O-N 3.5Å; L204-D206 VanDerWaalsContact C-N 3.34Å; L204-F207 PolarHBondContact O-N 3.42Å; L204-V208 WeakPolarHBondContact O-CB 3.38Å; L204-V208 VanDerWaalsContact O-CG2 3.26Å; L204-V208 WeakPolarHBondContact O-CG2 3.45Å; L204-V208 PolarHBondContact O-N 3.43Å |
| 205 | A | 81.3 | Confident | 76.8 | Confident | 4 Ų | 4 | 67.2 Ų | 67.2 | 3% | 0.033 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -63.1 | -41.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | V201 V202 S209 L363 | V201-A205 VanDerWaalsContact O-CB 3.31Å; V201-A205 WeakPolarHBondContact O-CB 3.38Å; V201-A205 PolarHBondContact O-N 3.29Å; V202-A205 WeakPolarHBondContact O-CB 3.39Å; V202-A205 PolarHBondContact O-N 3.12Å; V202-A205 VanDerWaalsContact O-N 3.08Å; A205-S209 VanDerWaalsContact O-CB 3.23Å; A205-S209 WeakPolarHBondContact O-CB 3.43Å; A205-S209 PolarHBondContact O-N 3.21Å; A205-S209 PolarHBondContact O-OG 3.49Å; A205-L363 HydrophobicContact CB-CD2 3.69Å; A205-L363 HydrophobicContact CB-CG 4.2Å |
| 206 | D | 78.8 | Confident | 75.7 | Confident | 17 Ų | 17 | 74.6 Ų | 74.6 | 9% | 0.091 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -69.7 | -39.9 | 177.8 | -67.2 | -26.7 | 0 | 0 | 0 | 111.1 | S160 V202 L204 V208 S209 G210 V221 | S160-D206 WeakPolarHBondContact CB-OD2 3.05Å; S160-D206 PolarHBondContact OG-OD1 2.68Å; S160-D206 PolarHBondContact OG-OD2 2.86Å; V202-D206 PolarHBondContact O-N 2.93Å; L204-D206 VanDerWaalsContact C-N 3.34Å; D206-V208 PolarHBondContact O-N 3.18Å; D206-S209 PolarHBondContact O-N 2.97Å; D206-G210 PolarHBondContact O-N 3.42Å; D206-V221 HydrophobicContact CB-CG1 4.24Å |
| 207 | F | 78.6 | Confident | 74.8 | Confident | 91 Ų | 91 | 76.7 Ų | 76.7 | 40% | 0.399 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -60.6 | -45.8 | 173.3 | -177.7 | -107.4 | 0 | 0 | 0 | 113.3 | G203 L204 G210 H211 I218 I222 | G203-F207 WeakPolarHBondContact O-CB 3.48Å; G203-F207 PolarHBondContact O-N 3.31Å; L204-F207 PolarHBondContact O-N 3.42Å; F207-G210 PolarHBondContact O-N 3.05Å; F207-H211 AromaticContact CD1-CE1 3.85Å; F207-H211 AromaticContact CE1-CE1 3.39Å; F207-H211 WeakPolarHBondContact CE1-CE1 3.38Å; F207-H211 AromaticContact CZ-CE1 3.5Å; F207-H211 VanDerWaalsContact CZ-CE1 3.5Å; F207-H211 WeakPolarHBondContact CZ-CE1 3.45Å; F207-H211 PolarHBondContact O-ND1 3.42Å; F207-I218 HydrophobicContact CD2-CG2 4.2Å; F207-I218 HydrophobicContact CE2-CG2 4.39Å; F207-I222 HydrophobicContact CD2-CD1 4.01Å; F207-I222 HydrophobicContact CE2-CD1 4.39Å |
| 208 | V | 78.8 | Confident | 74.2 | Confident | 90 Ų | 90 | 74.2 Ų | 74.2 | 55% | 0.545 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -72.2 | -38.3 | -179.4 | 172.2 | 0 | 0 | 0 | 0 | 111.3 | L204 D206 G210 H211 | L204-V208 WeakPolarHBondContact O-CB 3.38Å; L204-V208 VanDerWaalsContact O-CG2 3.26Å; L204-V208 WeakPolarHBondContact O-CG2 3.45Å; L204-V208 PolarHBondContact O-N 3.43Å; D206-V208 PolarHBondContact O-N 3.18Å; V208-G210 PolarHBondContact O-N 3.21Å; V208-H211 WeakPolarHBondContact O-CB 3.43Å; V208-H211 PolarHBondContact O-N 3.13Å |
| 209 | S | 68.1 | Low | 73.9 | Confident | 77 Ų | 77 | 77.8 Ų | 77.8 | 54% | 0.538 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -66 | -30.2 | 176.6 | -58.2 | 0 | 0 | 0 | 0 | 111.7 | A205 D206 H211 | A205-S209 VanDerWaalsContact O-CB 3.23Å; A205-S209 WeakPolarHBondContact O-CB 3.43Å; A205-S209 PolarHBondContact O-N 3.21Å; A205-S209 PolarHBondContact O-OG 3.49Å; D206-S209 PolarHBondContact O-N 2.97Å; S209-H211 VanDerWaalsContact C-N 3.31Å; S209-H211 PolarHBondContact O-N 3.49Å |
| 210 | G | 62.1 | Low | 73.7 | Confident | 22 Ų | 22 | 80.3 Ų | 80.3 | 23% | 0.227 | 43% | 0.429 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.7 | -11.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | D206 F207 V208 R212 I218 | D206-G210 PolarHBondContact O-N 3.42Å; F207-G210 PolarHBondContact O-N 3.05Å; V208-G210 PolarHBondContact O-N 3.21Å; G210-R212 PolarHBondContact O-N 3.01Å; G210-I218 VanDerWaalsContact O-CD1 3.22Å; G210-I218 WeakPolarHBondContact O-CD1 3.43Å; G210-I218 VanDerWaalsContact O-CG1 3.3Å; G210-I218 WeakPolarHBondContact O-CG1 3.19Å |
| 211 | H | 56.1 | Low | 73.5 | Confident | 120 Ų | 120 | 78.5 Ų | 78.5 | 56% | 0.556 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.2 | 8.1 | 177.7 | -83.6 | 63.3 | 0 | 0 | 0 | 114.6 | F207 V208 S209 | F207-H211 AromaticContact CD1-CE1 3.85Å; F207-H211 AromaticContact CE1-CE1 3.39Å; F207-H211 WeakPolarHBondContact CE1-CE1 3.38Å; F207-H211 AromaticContact CZ-CE1 3.5Å; F207-H211 VanDerWaalsContact CZ-CE1 3.5Å; F207-H211 WeakPolarHBondContact CZ-CE1 3.45Å; F207-H211 PolarHBondContact O-ND1 3.42Å; V208-H211 WeakPolarHBondContact O-CB 3.43Å; V208-H211 PolarHBondContact O-N 3.13Å; S209-H211 VanDerWaalsContact C-N 3.31Å; S209-H211 PolarHBondContact O-N 3.49Å |
| 212 | R | 53.8 | Low | 73.4 | Confident | 223 Ų | 223 | 79.1 Ų | 79.1 | 84% | 0.842 | 42% | 0.419 | S | S | * | . | S | Bend | trans | -115.2 | 95.6 | 175.7 | -70.2 | 178.1 | 169.2 | 169.2 | -3.1 | 108.3 | G210 | G210-R212 PolarHBondContact O-N 3.01Š|
| 213 | D | 57.5 | Low | 73.7 | Confident | 135 Ų | 135 | 81.8 Ų | 81.8 | 72% | 0.722 | 44% | 0.435 | S | S | * | . | S | Bend | trans | 73.1 | 124.3 | 176.6 | -66.2 | -29.2 | 0 | 0 | 0 | 118.2 | ||
| 214 | D | 63.4 | Low | 74 | Confident | 95 Ų | 95 | 80.4 Ų | 80.4 | 51% | 0.508 | 42% | 0.421 | S | S | . | . | trans | 67.6 | 107.9 | 172.3 | -56.4 | -38 | 0 | 0 | 0 | 119.1 | H216 K217 | D214-H216 PolarHBondContact O-N 2.93Å; D214-H216 VanDerWaalsContact O-N 3.08Å; D214-K217 HydrophobicContact CB-CD 4.18Å; D214-K217 HydrophobicContact CB-CG 4.22Å; D214-K217 PolarHBondContact O-N 3.07Å; D214-K217 VanDerWaalsContact O-N 3.12Å; D214-K217 IonicContact OD2-NZ 2.84Å; D214-K217 PolarHBondContact OD2-NZ 3.35Å | ||
| 215 | S | 64.1 | Low | 74.3 | Confident | 93 Ų | 93 | 76.4 Ų | 76.4 | 65% | 0.65 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -56.6 | -24.2 | 172.4 | -172.4 | 0 | 0 | 0 | 0 | 114.4 | T219 | S215-T219 PolarHBondContact O-N 2.87Å; S215-T219 PolarHBondContact O-OG1 3.38Å; S215-T219 VanDerWaalsContact O-OG1 3.08Å |
| 216 | H | 65.1 | Low | 74.8 | Confident | 154 Ų | 154 | 81.2 Ų | 81.2 | 71% | 0.713 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -69.1 | -43.6 | 176.9 | -79.6 | -75.4 | 0 | 0 | 0 | 111.7 | D214 I218 T219 D220 | D214-H216 PolarHBondContact O-N 2.93Å; D214-H216 VanDerWaalsContact O-N 3.08Å; H216-I218 VanDerWaalsContact C-N 3.32Å; H216-I218 PolarHBondContact O-N 3.11Å; H216-T219 PolarHBondContact O-N 3.43Å; H216-T219 VanDerWaalsContact O-N 3.16Å; H216-D220 PolarHBondContact O-N 3.48Å |
| 217 | K | 72.4 | Confident | 75.5 | Confident | 119 Ų | 119 | 82.9 Ų | 82.9 | 52% | 0.517 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.9 | -37.7 | 179.3 | -69.1 | 176 | -176.8 | 138.9 | 0 | 112.4 | D214 T219 D220 V221 | D214-K217 HydrophobicContact CB-CD 4.18Å; D214-K217 HydrophobicContact CB-CG 4.22Å; D214-K217 PolarHBondContact O-N 3.07Å; D214-K217 VanDerWaalsContact O-N 3.12Å; D214-K217 IonicContact OD2-NZ 2.84Å; D214-K217 PolarHBondContact OD2-NZ 3.35Å; K217-T219 VanDerWaalsContact C-N 3.32Å; K217-T219 PolarHBondContact O-N 3.45Å; K217-D220 PolarHBondContact O-N 2.96Å; K217-V221 WeakPolarHBondContact O-CG2 3.43Å; K217-V221 PolarHBondContact O-N 3.04Å; K217-V221 VanDerWaalsContact O-N 3.07Å |
| 218 | I | 77 | Confident | 76.2 | Confident | 31 Ų | 31 | 78.5 Ų | 78.5 | 16% | 0.159 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -62 | -42.4 | 177.2 | -57.1 | 176.5 | 0 | 0 | 0 | 111 | F207 G210 H216 D220 V221 I222 | F207-I218 HydrophobicContact CD2-CG2 4.2Å; F207-I218 HydrophobicContact CE2-CG2 4.39Å; G210-I218 VanDerWaalsContact O-CD1 3.22Å; G210-I218 WeakPolarHBondContact O-CD1 3.43Å; G210-I218 VanDerWaalsContact O-CG1 3.3Å; G210-I218 WeakPolarHBondContact O-CG1 3.19Å; H216-I218 VanDerWaalsContact C-N 3.32Å; H216-I218 PolarHBondContact O-N 3.11Å; I218-D220 VanDerWaalsContact C-N 3.33Å; I218-D220 PolarHBondContact O-N 2.95Å; I218-V221 PolarHBondContact O-N 2.91Å; I218-I222 HydrophobicContact CG2-CD1 3.7Å; I218-I222 HydrophobicContact CG2-CG1 4.34Å; I218-I222 VanDerWaalsContact O-CG1 3.28Å; I218-I222 WeakPolarHBondContact O-CG1 3.09Å; I218-I222 PolarHBondContact O-N 3.36Å |
| 219 | T | 81.3 | Confident | 76.8 | Confident | 75 Ų | 75 | 76.8 Ų | 76.8 | 46% | 0.46 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -66.1 | -39.3 | -178.2 | -53.1 | 0 | 0 | 0 | 0 | 110.9 | S215 H216 K217 T223 | S215-T219 PolarHBondContact O-N 2.87Å; S215-T219 PolarHBondContact O-OG1 3.38Å; S215-T219 VanDerWaalsContact O-OG1 3.08Å; H216-T219 PolarHBondContact O-N 3.43Å; H216-T219 VanDerWaalsContact O-N 3.16Å; K217-T219 VanDerWaalsContact C-N 3.32Å; K217-T219 PolarHBondContact O-N 3.45Å; T219-T223 VanDerWaalsContact O-CB 3.29Å; T219-T223 WeakPolarHBondContact O-CB 3.2Å; T219-T223 PolarHBondContact O-N 2.85Å; T219-T223 PolarHBondContact O-OG1 2.7Å |
| 220 | D | 82.7 | Confident | 78.1 | Confident | 80 Ų | 80 | 78.2 Ų | 78.2 | 43% | 0.428 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -65.3 | -46.3 | 177.2 | -61.8 | -25.3 | 0 | 0 | 0 | 111.3 | M155 H216 K217 I218 I222 T223 G224 | M155-D220 HydrophobicContact CE-CB 4.38Å; H216-D220 PolarHBondContact O-N 3.48Å; K217-D220 PolarHBondContact O-N 2.96Å; I218-D220 VanDerWaalsContact C-N 3.33Å; I218-D220 PolarHBondContact O-N 2.95Å; D220-I222 PolarHBondContact O-N 3.45Å; D220-T223 PolarHBondContact O-N 3.2Å; D220-G224 PolarHBondContact O-N 2.67Å |
| 221 | V | 84.3 | Confident | 79.6 | Confident | 42 Ų | 42 | 77.2 Ų | 77.2 | 26% | 0.255 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -61.4 | -48 | 178 | 177 | 0 | 0 | 0 | 0 | 111.6 | M155 D206 K217 I218 T223 G224 D225 | M155-V221 WeakPolarHBondContact O-CA 3.17Å; D206-V221 HydrophobicContact CB-CG1 4.24Å; K217-V221 WeakPolarHBondContact O-CG2 3.43Å; K217-V221 PolarHBondContact O-N 3.04Å; K217-V221 VanDerWaalsContact O-N 3.07Å; I218-V221 PolarHBondContact O-N 2.91Å; V221-T223 VanDerWaalsContact C-N 3.29Å; V221-T223 PolarHBondContact O-N 3.19Å; V221-G224 PolarHBondContact O-N 3.39Å; V221-D225 PolarHBondContact O-N 3.44Å |
| 222 | I | 86.5 | Confident | 81.4 | Confident | 66 Ų | 66 | 71.6 Ų | 71.6 | 34% | 0.338 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.4 | -41 | 178.1 | -65.8 | 168.2 | 0 | 0 | 0 | 110.7 | F207 I218 D220 G224 D225 L226 | F207-I222 HydrophobicContact CD2-CD1 4.01Å; F207-I222 HydrophobicContact CE2-CD1 4.39Å; I218-I222 HydrophobicContact CG2-CD1 3.7Å; I218-I222 HydrophobicContact CG2-CG1 4.34Å; I218-I222 VanDerWaalsContact O-CG1 3.28Å; I218-I222 WeakPolarHBondContact O-CG1 3.09Å; I218-I222 PolarHBondContact O-N 3.36Å; D220-I222 PolarHBondContact O-N 3.45Å; I222-G224 VanDerWaalsContact C-N 3.34Å; I222-D225 PolarHBondContact O-N 2.9Å; I222-L226 HydrophobicContact CG2-CD1 4.17Å; I222-L226 HydrophobicContact CG2-CG 4.45Å; I222-L226 WeakPolarHBondContact O-CG 3.5Å; I222-L226 PolarHBondContact O-N 3.18Å |
| 223 | T | 89.3 | Confident | 83.4 | Confident | 57 Ų | 57 | 63.8 Ų | 63.8 | 35% | 0.35 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -63.8 | -42.9 | 178.1 | -57.6 | 0 | 0 | 0 | 0 | 110.6 | M155 T219 D220 V221 L226 L227 | M155-T223 HydrophobicContact CE-CG2 3.67Å; T219-T223 VanDerWaalsContact O-CB 3.29Å; T219-T223 WeakPolarHBondContact O-CB 3.2Å; T219-T223 PolarHBondContact O-N 2.85Å; T219-T223 PolarHBondContact O-OG1 2.7Å; D220-T223 PolarHBondContact O-N 3.2Å; V221-T223 VanDerWaalsContact C-N 3.29Å; V221-T223 PolarHBondContact O-N 3.19Å; T223-L226 PolarHBondContact O-N 3.03Å; T223-L227 HydrophobicContact CG2-CD1 4.36Å; T223-L227 VanDerWaalsContact O-CG 3.3Å; T223-L227 WeakPolarHBondContact O-CG 3.23Å; T223-L227 PolarHBondContact O-N 3.23Å |
| 224 | G | 89.6 | Confident | 85.3 | Confident | 0 Ų | 0 | 59.3 Ų | 59.3 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -58 | -46.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | A152 D220 V221 I222 L226 L227 I228 | A152-G224 WeakPolarHBondContact CB-O 3.39Å; D220-G224 PolarHBondContact O-N 2.67Å; V221-G224 PolarHBondContact O-N 3.39Å; I222-G224 VanDerWaalsContact C-N 3.34Å; G224-L226 PolarHBondContact O-N 2.96Å; G224-L227 WeakPolarHBondContact O-CB 3.47Å; G224-L227 PolarHBondContact O-N 3.41Å; G224-I228 WeakPolarHBondContact O-CG1 3.28Å; G224-I228 PolarHBondContact O-N 3.27Å |
| 225 | D | 90 | Very high | 86.7 | Confident | 14 Ų | 14 | 55.5 Ų | 55.5 | 8% | 0.075 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.1 | -42.4 | 179 | -70.3 | -7 | 0 | 0 | 0 | 112.4 | T156 L164 V221 I222 I228 I229 | T156-D225 WeakPolarHBondContact CB-OD1 3.11Å; T156-D225 PolarHBondContact OG1-OD1 2.69Å; L164-D225 HydrophobicContact CD1-CB 3.57Å; L164-D225 WeakPolarHBondContact CD1-OD1 3.43Å; V221-D225 PolarHBondContact O-N 3.44Å; I222-D225 PolarHBondContact O-N 2.9Å; D225-I228 PolarHBondContact O-N 3.45Å; D225-I229 WeakPolarHBondContact O-CG1 3.22Å; D225-I229 PolarHBondContact O-N 3.33Å; D225-I229 VanDerWaalsContact O-N 3.08Å |
| 226 | L | 91.4 | Very high | 88.1 | Confident | 104 Ų | 104 | 51 Ų | 51 | 55% | 0.545 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -64.1 | -41.2 | 174.7 | -70 | 175.2 | 0 | 0 | 0 | 111.9 | I222 T223 G224 I228 I229 M230 | I222-L226 HydrophobicContact CG2-CD1 4.17Å; I222-L226 HydrophobicContact CG2-CG 4.45Å; I222-L226 WeakPolarHBondContact O-CG 3.5Å; I222-L226 PolarHBondContact O-N 3.18Å; T223-L226 PolarHBondContact O-N 3.03Å; G224-L226 PolarHBondContact O-N 2.96Å; L226-I228 VanDerWaalsContact C-N 3.31Å; L226-I228 PolarHBondContact O-N 3.41Å; L226-I229 PolarHBondContact O-N 3.11Å; L226-M230 WeakPolarHBondContact O-CG 3.48Å; L226-M230 PolarHBondContact O-N 3.44Å |
| 227 | L | 93.2 | Very high | 89.5 | Confident | 52 Ų | 52 | 46.2 Ų | 46.2 | 27% | 0.272 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -61.8 | -38.7 | 175 | -73.1 | 174.1 | 0 | 0 | 0 | 111.6 | I148 V151 A152 M155 T223 G224 M230 A231 | I148-L227 HydrophobicContact CG2-CB 4Å; I148-L227 HydrophobicContact CG2-CD2 4.2Å; I148-L227 WeakPolarHBondContact CG2-O 3.4Å; V151-L227 HydrophobicContact CG1-CD1 4.24Å; A152-L227 HydrophobicContact CB-CB 3.93Å; M155-L227 HydrophobicContact SD-CD1 3.99Å; T223-L227 HydrophobicContact CG2-CD1 4.36Å; T223-L227 VanDerWaalsContact O-CG 3.3Å; T223-L227 WeakPolarHBondContact O-CG 3.23Å; T223-L227 PolarHBondContact O-N 3.23Å; G224-L227 WeakPolarHBondContact O-CB 3.47Å; G224-L227 PolarHBondContact O-N 3.41Å; L227-M230 PolarHBondContact O-N 3.03Å; L227-A231 WeakPolarHBondContact O-CB 3.31Å; L227-A231 PolarHBondContact O-N 2.99Å |
| 228 | I | 92.9 | Very high | 90.6 | Very high | 0 Ų | 0 | 40.7 Ų | 40.7 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -62.7 | -46 | 175 | -64.8 | 157.5 | 0 | 0 | 0 | 110.7 | A152 T156 F161 L164 G224 D225 L226 M230 A231 Q232 | A152-I228 HydrophobicContact CB-CD1 4.25Å; A152-I228 HydrophobicContact CB-CG1 3.57Å; T156-I228 HydrophobicContact CG2-CD1 3.42Å; T156-I228 VanDerWaalsContact CG2-CD1 3.42Å; F161-I228 HydrophobicContact CB-CD1 4.15Å; F161-I228 HydrophobicContact CD2-CD1 3.82Å; F161-I228 HydrophobicContact CD2-CG1 3.89Å; F161-I228 HydrophobicContact CE2-CG1 4.47Å; F161-I228 HydrophobicContact CG-CD1 4.45Å; L164-I228 HydrophobicContact CB-CB 4.25Å; L164-I228 HydrophobicContact CB-CD1 4.45Å; L164-I228 HydrophobicContact CB-CG2 3.56Å; L164-I228 HydrophobicContact CD1-CB 4.3Å; L164-I228 HydrophobicContact CD1-CD1 3.85Å; L164-I228 HydrophobicContact CD1-CG2 4.5Å; G224-I228 WeakPolarHBondContact O-CG1 3.28Å; G224-I228 PolarHBondContact O-N 3.27Å; D225-I228 PolarHBondContact O-N 3.45Å; L226-I228 VanDerWaalsContact C-N 3.31Å; L226-I228 PolarHBondContact O-N 3.41Å; I228-M230 VanDerWaalsContact C-N 3.32Å; I228-M230 PolarHBondContact O-N 2.86Å; I228-A231 WeakPolarHBondContact O-CB 3.3Å; I228-A231 PolarHBondContact O-N 3.16Å; I228-Q232 HydrophobicContact CG2-CG 4.3Å; I228-Q232 VanDerWaalsContact O-CG 3.3Å; I228-Q232 WeakPolarHBondContact O-CG 3.29Å; I228-Q232 PolarHBondContact O-N 2.99Å; I228-Q232 PolarHBondContact O-NE2 3.34Å |
| 229 | I | 93 | Very high | 91.3 | Very high | 53 Ų | 53 | 39.8 Ų | 39.8 | 27% | 0.272 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -60.8 | -44 | 179 | -66.9 | 169.2 | 0 | 0 | 0 | 110.3 | F171 D225 L226 A231 Q232 I233 | F171-I229 HydrophobicContact CE2-CG2 4.19Å; F171-I229 HydrophobicContact CZ-CG2 4.06Å; D225-I229 WeakPolarHBondContact O-CG1 3.22Å; D225-I229 PolarHBondContact O-N 3.33Å; D225-I229 VanDerWaalsContact O-N 3.08Å; L226-I229 PolarHBondContact O-N 3.11Å; I229-A231 VanDerWaalsContact C-N 3.34Å; I229-A231 PolarHBondContact O-N 3.38Å; I229-Q232 PolarHBondContact O-N 2.9Å; I229-I233 PolarHBondContact O-N 2.91Å; I229-I233 VanDerWaalsContact O-N 3.17Å |
| 230 | M | 94.3 | Very high | 91.8 | Very high | 108 Ų | 108 | 36.4 Ų | 36.4 | 53% | 0.532 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -61.1 | -42.1 | 175 | -70.4 | -58 | -61.2 | 0 | 0 | 112 | L226 L227 I228 Q232 I233 I234 | L226-M230 WeakPolarHBondContact O-CG 3.48Å; L226-M230 PolarHBondContact O-N 3.44Å; L227-M230 PolarHBondContact O-N 3.03Å; I228-M230 VanDerWaalsContact C-N 3.32Å; I228-M230 PolarHBondContact O-N 2.86Å; M230-Q232 PolarHBondContact O-N 3.14Å; M230-I233 WeakPolarHBondContact O-CB 3.36Å; M230-I233 PolarHBondContact O-N 3.08Å; M230-I233 HydrophobicContact SD-CD1 4.18Å; M230-I234 PolarHBondContact O-N 3.49Å |
| 231 | A | 94.8 | Very high | 92.2 | Very high | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -62.3 | -40.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | I148 M149 L227 I228 I229 I233 I234 V235 | I148-A231 HydrophobicContact CB-CB 4.12Å; I148-A231 HydrophobicContact CG2-CB 3.9Å; M149-A231 HydrophobicContact CG-CB 3.69Å; L227-A231 WeakPolarHBondContact O-CB 3.31Å; L227-A231 PolarHBondContact O-N 2.99Å; I228-A231 WeakPolarHBondContact O-CB 3.3Å; I228-A231 PolarHBondContact O-N 3.16Å; I229-A231 VanDerWaalsContact C-N 3.34Å; I229-A231 PolarHBondContact O-N 3.38Å; A231-I233 VanDerWaalsContact C-N 3.25Å; A231-I233 PolarHBondContact O-N 3.32Å; A231-I234 WeakPolarHBondContact O-CB 3.24Å; A231-I234 PolarHBondContact O-N 3.24Å; A231-V235 WeakPolarHBondContact O-CG2 3.2Å; A231-V235 PolarHBondContact O-N 3.36Å |
| 232 | Q | 94.1 | Very high | 92.5 | Very high | 3 Ų | 3 | 32.8 Ų | 32.8 | 1% | 0.014 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62.6 | -31.5 | 177.9 | -63.6 | -34.6 | -64.4 | 0 | 0 | 112.8 | R165 A167 V168 F171 I228 I229 M230 S236 | R165-Q232 PolarHBondContact O-OE1 3.27Å; A167-Q232 HydrophobicContact CB-CG 4.3Å; V168-Q232 HydrophobicContact CB-CB 4.42Å; F171-Q232 HydrophobicContact CD2-CB 4.34Å; F171-Q232 HydrophobicContact CE2-CB 4.48Å; I228-Q232 HydrophobicContact CG2-CG 4.3Å; I228-Q232 VanDerWaalsContact O-CG 3.3Å; I228-Q232 WeakPolarHBondContact O-CG 3.29Å; I228-Q232 PolarHBondContact O-N 2.99Å; I228-Q232 PolarHBondContact O-NE2 3.34Å; I229-Q232 PolarHBondContact O-N 2.9Å; M230-Q232 PolarHBondContact O-N 3.14Å; Q232-S236 WeakPolarHBondContact O-CB 3.24Å; Q232-S236 PolarHBondContact O-N 2.68Å; Q232-S236 PolarHBondContact O-OG 3.16Å |
| 233 | I | 95.1 | Very high | 92.7 | Very high | 58 Ų | 58 | 29.6 Ų | 29.6 | 30% | 0.297 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -63.6 | -46.3 | 172.1 | -63.4 | 168.8 | 0 | 0 | 0 | 109.7 | F171 I229 M230 A231 S236 V237 | F171-I233 HydrophobicContact CD1-CG1 3.84Å; F171-I233 HydrophobicContact CD2-CG1 3.84Å; F171-I233 HydrophobicContact CE1-CD1 4.04Å; F171-I233 HydrophobicContact CE1-CG1 3.73Å; F171-I233 HydrophobicContact CE2-CD1 4.5Å; F171-I233 HydrophobicContact CE2-CG1 3.72Å; F171-I233 HydrophobicContact CG-CG1 3.89Å; F171-I233 HydrophobicContact CZ-CD1 4.01Å; F171-I233 HydrophobicContact CZ-CG1 3.67Å; I229-I233 PolarHBondContact O-N 2.91Å; I229-I233 VanDerWaalsContact O-N 3.17Å; M230-I233 WeakPolarHBondContact O-CB 3.36Å; M230-I233 PolarHBondContact O-N 3.08Å; M230-I233 HydrophobicContact SD-CD1 4.18Å; A231-I233 VanDerWaalsContact C-N 3.25Å; A231-I233 PolarHBondContact O-N 3.32Å; I233-S236 WeakPolarHBondContact CA-OG 3.48Å; I233-S236 PolarHBondContact O-N 3.46Å; I233-S236 PolarHBondContact O-OG 3.36Å; I233-V237 WeakPolarHBondContact O-CG2 3.25Å; I233-V237 PolarHBondContact O-N 3.01Å |
| 234 | I | 96.1 | Very high | 92.6 | Very high | 41 Ų | 41 | 31.1 Ų | 31.1 | 21% | 0.21 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -63.4 | -44.6 | 178.8 | -59.7 | 171 | 0 | 0 | 0 | 111 | C141 T144 A145 I148 M230 A231 S236 V237 Q238 | C141-I234 HydrophobicContact CB-CG2 3.79Å; C141-I234 VanDerWaalsContact O-CG2 3.29Å; C141-I234 WeakPolarHBondContact O-CG2 3.19Å; T144-I234 HydrophobicContact CG2-CD1 4.09Å; A145-I234 HydrophobicContact CB-CB 4.09Å; A145-I234 HydrophobicContact CB-CG2 3.95Å; I148-I234 HydrophobicContact CD1-CD1 3.71Å; M230-I234 PolarHBondContact O-N 3.49Å; A231-I234 WeakPolarHBondContact O-CB 3.24Å; A231-I234 PolarHBondContact O-N 3.24Å; I234-S236 VanDerWaalsContact C-N 3.29Å; I234-S236 PolarHBondContact O-N 2.83Å; I234-V237 WeakPolarHBondContact O-CB 3.21Å; I234-V237 PolarHBondContact O-N 3.02Å; I234-Q238 PolarHBondContact O-N 3.47Å |
| 235 | V | 94.5 | Very high | 92.5 | Very high | 15 Ų | 15 | 32.6 Ų | 32.6 | 9% | 0.091 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -57.8 | -43.7 | 173.9 | 178.1 | 0 | 0 | 0 | 0 | 110.6 | A145 M149 V168 A231 V237 Q238 M239 | A145-V235 HydrophobicContact CB-CG2 3.53Å; M149-V235 HydrophobicContact CE-CG2 4.39Å; V168-V235 HydrophobicContact CG2-CB 4.14Å; V168-V235 HydrophobicContact CG2-CG1 3.79Å; A231-V235 WeakPolarHBondContact O-CG2 3.2Å; A231-V235 PolarHBondContact O-N 3.36Å; V235-V237 VanDerWaalsContact C-N 3.3Å; V235-V237 PolarHBondContact O-N 3.31Å; V235-Q238 WeakPolarHBondContact O-CB 3.28Å; V235-Q238 PolarHBondContact O-N 3.49Å; V235-M239 HydrophobicContact CG1-CE 3.9Å; V235-M239 HydrophobicContact CG1-CG 4.26Å; V235-M239 VanDerWaalsContact O-CG 3.28Å; V235-M239 WeakPolarHBondContact O-CG 3.3Å; V235-M239 PolarHBondContact O-N 2.03Å |
| 236 | S | 93.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -64.9 | -34.2 | 179.8 | 71.2 | 0 | 0 | 0 | 0 | 113.2 | F171 T172 L175 Q232 I233 I234 M239 V240 | F171-S236 WeakPolarHBondContact CB-OG 3.47Å; T172-S236 VanDerWaalsContact OG1-CB 3.3Å; T172-S236 WeakPolarHBondContact OG1-CB 3.35Å; L175-S236 WeakPolarHBondContact CD1-OG 3.49Å; Q232-S236 WeakPolarHBondContact O-CB 3.24Å; Q232-S236 PolarHBondContact O-N 2.68Å; Q232-S236 PolarHBondContact O-OG 3.16Å; I233-S236 WeakPolarHBondContact CA-OG 3.48Å; I233-S236 PolarHBondContact O-N 3.46Å; I233-S236 PolarHBondContact O-OG 3.36Å; I234-S236 VanDerWaalsContact C-N 3.29Å; I234-S236 PolarHBondContact O-N 2.83Å; S236-M239 PolarHBondContact O-N 3.06Å; S236-V240 VanDerWaalsContact O-CG2 3.31Å; S236-V240 WeakPolarHBondContact O-CG2 3.24Å; S236-V240 PolarHBondContact O-N 3.34Å; S236-V240 VanDerWaalsContact O-N 3.14Å |
| 237 | V | 94.6 | Very high | 92 | Very high | 53 Ų | 53 | 28.3 Ų | 28.3 | 32% | 0.321 | 14% | 0.142 | S | C | . | . | H | α-helix | trans | -64.2 | -47.1 | 172.8 | 171.6 | 0 | 0 | 0 | 0 | 110.4 | L175 I233 I234 V235 M239 V240 L241 | L175-V237 HydrophobicContact CD1-CG2 3.8Å; I233-V237 WeakPolarHBondContact O-CG2 3.25Å; I233-V237 PolarHBondContact O-N 3.01Å; I234-V237 WeakPolarHBondContact O-CB 3.21Å; I234-V237 PolarHBondContact O-N 3.02Å; V235-V237 VanDerWaalsContact C-N 3.3Å; V235-V237 PolarHBondContact O-N 3.31Å; V237-M239 PolarHBondContact O-N 3.09Å; V237-V240 PolarHBondContact O-N 3.3Å; V237-L241 HydrophobicContact CG1-CD1 3.85Å; V237-L241 HydrophobicContact CG1-CG 4.25Å; V237-L241 WeakPolarHBondContact O-CB 3.33Å; V237-L241 VanDerWaalsContact O-CG 3.29Å; V237-L241 WeakPolarHBondContact O-CG 3.42Å; V237-L241 PolarHBondContact O-N 3.15Å |
| 238 | Q | 94.6 | Very high | 91.5 | Very high | 2 Ų | 2 | 31.1 Ų | 31.1 | 1% | 0.009 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -53.6 | -52.3 | 174.6 | 173.1 | -166.6 | -14.8 | 0 | 0 | 111.2 | P138 C141 D142 I234 V235 V240 L241 E242 E260 | P138-Q238 HydrophobicContact CB-CG 4.25Å; C141-Q238 HydrophobicContact CB-CB 3.78Å; D142-Q238 PolarHBondContact OD1-OE1 3.3Å; I234-Q238 PolarHBondContact O-N 3.47Å; V235-Q238 WeakPolarHBondContact O-CB 3.28Å; V235-Q238 PolarHBondContact O-N 3.49Å; Q238-V240 VanDerWaalsContact C-N 3.29Å; Q238-V240 PolarHBondContact O-N 3.05Å; Q238-L241 PolarHBondContact O-N 3.29Å; Q238-L241 VanDerWaalsContact O-N 3.16Å; Q238-E242 HydrophobicContact CG-CG 4.37Å; Q238-E242 WeakPolarHBondContact CG-OE1 3.24Å; Q238-E242 PolarHBondContact NE2-OE1 3.48Å; Q238-E242 WeakPolarHBondContact O-CB 3.2Å; Q238-E242 WeakPolarHBondContact O-CG 3.33Å; Q238-E242 PolarHBondContact O-N 2.94Å; Q238-E260 PolarHBondContact NE2-OE1 3.25Å |
| 239 | M | 91.3 | Very high | 91 | Very high | 12 Ų | 12 | 33.3 Ų | 33.3 | 6% | 0.059 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.4 | -39.9 | -177.1 | -65.4 | -64.8 | 153.9 | 0 | 0 | 112.6 | T172 V235 S236 V237 E243 M338 | T172-M239 HydrophobicContact CG2-CB 4.34Å; V235-M239 HydrophobicContact CG1-CE 3.9Å; V235-M239 HydrophobicContact CG1-CG 4.26Å; V235-M239 VanDerWaalsContact O-CG 3.28Å; V235-M239 WeakPolarHBondContact O-CG 3.3Å; V235-M239 PolarHBondContact O-N 2.03Å; S236-M239 PolarHBondContact O-N 3.06Å; V237-M239 PolarHBondContact O-N 3.09Å; M239-E243 WeakPolarHBondContact O-CB 3.37Å; M239-E243 PolarHBondContact O-N 2.95Å; M239-M338 HydrophobicContact CE-CE 3.81Å; M239-M338 HydrophobicContact CG-CE 3.79Å; M239-M338 HydrophobicContact CG-SD 3.88Å; M239-M338 HydrophobicContact SD-CE 3.38Å; M239-M338 WeakPolarHBondContact SD-CE 3.49Å; M239-M338 HydrophobicContact SD-SD 4.27Å |
| 240 | V | 91.4 | Very high | 90.5 | Very high | 4 Ų | 4 | 33.9 Ų | 33.9 | 2% | 0.024 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -72 | -38.5 | 178.5 | 171.1 | 0 | 0 | 0 | 0 | 111.8 | T172 L175 F179 L180 S236 V237 Q238 K244 | T172-V240 HydrophobicContact CG2-CG2 4.22Å; L175-V240 HydrophobicContact CB-CG2 3.84Å; F179-V240 HydrophobicContact CB-CG1 3.82Å; F179-V240 HydrophobicContact CD2-CG1 4.5Å; F179-V240 HydrophobicContact CG-CG1 4.44Å; L180-V240 HydrophobicContact CD1-CG1 3.53Å; S236-V240 VanDerWaalsContact O-CG2 3.31Å; S236-V240 WeakPolarHBondContact O-CG2 3.24Å; S236-V240 PolarHBondContact O-N 3.34Å; S236-V240 VanDerWaalsContact O-N 3.14Å; V237-V240 PolarHBondContact O-N 3.3Å; Q238-V240 VanDerWaalsContact C-N 3.29Å; Q238-V240 PolarHBondContact O-N 3.05Å; V240-K244 WeakPolarHBondContact O-CB 3.46Å; V240-K244 PolarHBondContact O-N 3.33Å |
| 241 | L | 91.6 | Very high | 90 | Very high | 46 Ų | 46 | 28.8 Ų | 28.8 | 24% | 0.241 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -65.1 | -46.8 | 174.6 | -71.8 | 176.3 | 0 | 0 | 0 | 111.5 | P138 V237 Q238 E243 K244 F245 | P138-L241 HydrophobicContact CG-CB 4.18Å; V237-L241 HydrophobicContact CG1-CD1 3.85Å; V237-L241 HydrophobicContact CG1-CG 4.25Å; V237-L241 WeakPolarHBondContact O-CB 3.33Å; V237-L241 VanDerWaalsContact O-CG 3.29Å; V237-L241 WeakPolarHBondContact O-CG 3.42Å; V237-L241 PolarHBondContact O-N 3.15Å; Q238-L241 PolarHBondContact O-N 3.29Å; Q238-L241 VanDerWaalsContact O-N 3.16Å; L241-E243 VanDerWaalsContact C-N 3.34Å; L241-E243 PolarHBondContact O-N 3.37Å; L241-K244 PolarHBondContact O-N 2.77Å; L241-F245 HydrophobicContact CB-CE2 4.1Å; L241-F245 HydrophobicContact CB-CZ 4.49Å; L241-F245 HydrophobicContact CD2-CZ 4.13Å; L241-F245 WeakPolarHBondContact O-CB 3.46Å; L241-F245 VanDerWaalsContact O-CD2 3.28Å; L241-F245 WeakPolarHBondContact O-CD2 3.4Å; L241-F245 WeakPolarHBondContact O-CG 3.15Å; L241-F245 PolarHBondContact O-N 3.24Å |
| 242 | E | 90.9 | Very high | 89.7 | Confident | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -56.1 | -49.4 | 175.3 | -76.4 | 174.9 | -162.2 | 0 | 0 | 111.2 | P138 Q238 K244 F245 V246 I326 R337 | P138-E242 HydrophobicContact CB-CG 4.17Å; Q238-E242 HydrophobicContact CG-CG 4.37Å; Q238-E242 WeakPolarHBondContact CG-OE1 3.24Å; Q238-E242 PolarHBondContact NE2-OE1 3.48Å; Q238-E242 WeakPolarHBondContact O-CB 3.2Å; Q238-E242 WeakPolarHBondContact O-CG 3.33Å; Q238-E242 PolarHBondContact O-N 2.94Å; E242-K244 VanDerWaalsContact C-N 3.35Å; E242-K244 PolarHBondContact O-N 3.35Å; E242-F245 PolarHBondContact O-N 3.29Å; E242-V246 WeakPolarHBondContact O-CB 3.2Å; E242-V246 VanDerWaalsContact O-CG2 3.23Å; E242-V246 WeakPolarHBondContact O-CG2 3.43Å; E242-V246 PolarHBondContact O-N 3.36Å; E242-I326 HydrophobicContact CB-CD1 4.28Å; E242-I326 HydrophobicContact CG-CD1 4.26Å; E242-I326 WeakPolarHBondContact OE2-CD1 3.5Å; E242-R337 IonicContact OE2-CZ 3.92Å; E242-R337 IonicContact OE2-NH1 3.72Å; E242-R337 PolarHBondContact OE2-NH1 2.95Å |
| 243 | E | 90.1 | Very high | 89.6 | Confident | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -56.5 | -51.6 | 178.1 | -170.3 | 165.8 | -147.8 | 0 | 0 | 110.6 | L180 R182 M239 L241 F245 V246 Y247 T329 S333 A334 | L180-E243 HydrophobicContact CD2-CB 4.17Å; L180-E243 VanDerWaalsContact CD2-CD 3.5Å; L180-E243 HydrophobicContact CD2-CG 3.69Å; L180-E243 WeakPolarHBondContact CD2-OE2 3.47Å; R182-E243 IonicContact CZ-OE1 2.71Å; R182-E243 IonicContact CZ-OE2 3.76Å; R182-E243 IonicContact NH1-OE1 3.08Å; R182-E243 PolarHBondContact NH1-OE1 3.28Å; R182-E243 IonicContact NH1-OE2 2.86Å; R182-E243 PolarHBondContact NH1-OE2 3.44Å; R182-E243 IonicContact NH2-OE1 3.07Å; R182-E243 PolarHBondContact NH2-OE1 2.98Å; R182-E243 IonicContact NH2-OE2 2.89Å; M239-E243 WeakPolarHBondContact O-CB 3.37Å; M239-E243 PolarHBondContact O-N 2.95Å; L241-E243 VanDerWaalsContact C-N 3.34Å; L241-E243 PolarHBondContact O-N 3.37Å; E243-F245 VanDerWaalsContact C-N 3.31Å; E243-F245 PolarHBondContact O-N 3.24Å; E243-V246 PolarHBondContact O-N 2.84Å; E243-Y247 HydrophobicContact CG-CD2 3.55Å; E243-Y247 HydrophobicContact CG-CE2 3.57Å; E243-Y247 WeakPolarHBondContact O-CB 3.43Å; E243-Y247 VanDerWaalsContact O-CD2 3.23Å; E243-Y247 WeakPolarHBondContact O-CD2 3.31Å; E243-Y247 PolarHBondContact O-N 3.24Å; E243-T329 HydrophobicContact CB-CG2 3.74Å; E243-T329 HydrophobicContact CG-CG2 3.73Å; E243-S333 WeakPolarHBondContact OE1-CA 3.34Å; E243-A334 HydrophobicContact CB-CB 4.02Å; E243-A334 HydrophobicContact CG-CB 4.24Å; E243-A334 PolarHBondContact OE1-N 3.32Å; E243-A334 WeakPolarHBondContact OE2-CB 3.18Å |
| 244 | K | 88.2 | Confident | 89.4 | Confident | 89 Ų | 89 | 29.1 Ų | 29.1 | 39% | 0.387 | 14% | 0.142 | S | C | . | . | H | α-helix | trans | -57.9 | -41.9 | 179.2 | -172.6 | 170.2 | -174.3 | 162 | 0 | 112.6 | L180 V240 L241 E242 K248 | L180-K244 HydrophobicContact CD1-CB 4.2Å; V240-K244 WeakPolarHBondContact O-CB 3.46Å; V240-K244 PolarHBondContact O-N 3.33Å; L241-K244 PolarHBondContact O-N 2.77Å; E242-K244 VanDerWaalsContact C-N 3.35Å; E242-K244 PolarHBondContact O-N 3.35Å; K244-K248 WeakPolarHBondContact O-CB 3.35Å; K244-K248 PolarHBondContact O-N 3.02Å |
| 245 | F | 87.6 | Confident | 89.2 | Confident | 30 Ų | 30 | 29 Ų | 29 | 13% | 0.132 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -75.1 | -41 | -177.6 | -62.4 | -24.8 | 0 | 0 | 0 | 113 | L134 F135 P138 L241 E242 E243 K248 H249 | L134-F245 HydrophobicContact CD1-CD1 3.96Å; L134-F245 HydrophobicContact CD1-CD2 4.29Å; L134-F245 HydrophobicContact CD1-CE1 3.65Å; L134-F245 HydrophobicContact CD1-CE2 4Å; L134-F245 HydrophobicContact CD1-CG 4.28Å; L134-F245 HydrophobicContact CD1-CZ 3.67Å; L134-F245 HydrophobicContact CD2-CB 3.99Å; L134-F245 HydrophobicContact CD2-CD1 3.91Å; L134-F245 HydrophobicContact CD2-CD2 4.24Å; L134-F245 HydrophobicContact CD2-CE1 4.47Å; L134-F245 HydrophobicContact CD2-CG 3.79Å; L134-F245 HydrophobicContact CG-CB 4.48Å; L134-F245 HydrophobicContact CG-CD1 4.01Å; L134-F245 HydrophobicContact CG-CD2 3.81Å; L134-F245 HydrophobicContact CG-CE1 4.15Å; L134-F245 HydrophobicContact CG-CE2 3.94Å; L134-F245 HydrophobicContact CG-CG 3.84Å; L134-F245 HydrophobicContact CG-CZ 4.11Å; L134-F245 VanDerWaalsContact O-CE2 3.29Å; L134-F245 WeakPolarHBondContact O-CE2 3.33Å; F135-F245 HydrophobicContact CZ-CB 4.42Å; P138-F245 HydrophobicContact CG-CD2 4.15Å; P138-F245 HydrophobicContact CG-CE2 3.95Å; L241-F245 HydrophobicContact CB-CE2 4.1Å; L241-F245 HydrophobicContact CB-CZ 4.49Å; L241-F245 HydrophobicContact CD2-CZ 4.13Å; L241-F245 WeakPolarHBondContact O-CB 3.46Å; L241-F245 VanDerWaalsContact O-CD2 3.28Å; L241-F245 WeakPolarHBondContact O-CD2 3.4Å; L241-F245 WeakPolarHBondContact O-CG 3.15Å; L241-F245 PolarHBondContact O-N 3.24Å; E242-F245 PolarHBondContact O-N 3.29Å; E243-F245 VanDerWaalsContact C-N 3.31Å; E243-F245 PolarHBondContact O-N 3.24Å; F245-K248 PolarHBondContact O-N 3.21Å; F245-H249 PolarHBondContact O-N 2.74Å; F245-H249 VanDerWaalsContact O-N 3.1Å; F245-H249 PolarHBondContact O-ND1 3.42Å |
| 246 | V | 86.9 | Confident | 89.1 | Confident | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -65.5 | -41.9 | 178.2 | 171.7 | 0 | 0 | 0 | 0 | 110.7 | F135 E242 E243 D250 V251 A256 I326 K330 | F135-V246 HydrophobicContact CZ-CG2 4.36Å; E242-V246 WeakPolarHBondContact O-CB 3.2Å; E242-V246 VanDerWaalsContact O-CG2 3.23Å; E242-V246 WeakPolarHBondContact O-CG2 3.43Å; E242-V246 PolarHBondContact O-N 3.36Å; E243-V246 PolarHBondContact O-N 2.84Å; V246-D250 WeakPolarHBondContact O-CA 3.12Å; V246-D250 PolarHBondContact O-N 3.16Å; V246-V251 PolarHBondContact O-N 3.32Å; V246-A256 HydrophobicContact CG2-CB 4.41Å; V246-I326 HydrophobicContact CG1-CG2 4.48Å; V246-I326 HydrophobicContact CG2-CG2 4.04Å; V246-K330 HydrophobicContact CG1-CB 3.89Å; V246-K330 HydrophobicContact CG1-CD 3.87Å; V246-K330 HydrophobicContact CG1-CG 3.89Å |
| 247 | Y | 83.6 | Confident | 89.1 | Confident | 28 Ų | 28 | 28.4 Ų | 28.4 | 11% | 0.11 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -69.7 | -45.4 | 175 | -83 | -74.4 | 0 | 0 | 0 | 112.4 | E243 H249 T329 K330 L411 | E243-Y247 HydrophobicContact CG-CD2 3.55Å; E243-Y247 HydrophobicContact CG-CE2 3.57Å; E243-Y247 WeakPolarHBondContact O-CB 3.43Å; E243-Y247 VanDerWaalsContact O-CD2 3.23Å; E243-Y247 WeakPolarHBondContact O-CD2 3.31Å; E243-Y247 PolarHBondContact O-N 3.24Å; Y247-H249 PolarHBondContact O-N 3.31Å; Y247-T329 WeakPolarHBondContact CE2-O 3.47Å; Y247-T329 PolarHBondContact OH-O 3.43Å; Y247-K330 PolarHBondContact OH-O 2.81Å; Y247-L411 HydrophobicContact CD1-CD2 4.3Å |
| 248 | K | 83.3 | Confident | 89.1 | Confident | 112 Ų | 112 | 25.9 Ų | 25.9 | 49% | 0.487 | 12% | 0.12 | S | C | . | . | H | α-helix | trans | -66.8 | -37.1 | -174.9 | -176.2 | 172.2 | -179.3 | 175.9 | 0 | 113.9 | K244 F245 | K244-K248 WeakPolarHBondContact O-CB 3.35Å; K244-K248 PolarHBondContact O-N 3.02Å; F245-K248 PolarHBondContact O-N 3.21Å |
| 249 | H | 81.2 | Confident | 89 | Confident | 46 Ų | 46 | 26.2 Ų | 26.2 | 21% | 0.213 | 12% | 0.122 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -108.1 | 7.6 | -175.8 | -57.1 | 89.2 | 0 | 0 | 0 | 113.4 | F130 L134 F245 Y247 V251 | F130-H249 HydrophobicContact CB-CB 4.26Å; L134-H249 VanDerWaalsContact CD2-CE1 3.44Å; L134-H249 WeakPolarHBondContact CD2-CE1 3.46Å; F245-H249 PolarHBondContact O-N 2.74Å; F245-H249 VanDerWaalsContact O-N 3.1Å; F245-H249 PolarHBondContact O-ND1 3.42Å; Y247-H249 PolarHBondContact O-N 3.31Å; H249-V251 HydrophobicContact CB-CG2 3.69Å; H249-V251 PolarHBondContact O-N 3.13Å; H249-V251 VanDerWaalsContact O-N 3.17Å |
| 250 | D | 82.4 | Confident | 89.1 | Confident | 64 Ų | 64 | 26 Ų | 26 | 34% | 0.342 | 12% | 0.121 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 44 | 46.6 | -174.9 | -171.1 | 27.6 | 0 | 0 | 0 | 112.8 | N125 G127 V246 K330 | N125-D250 PolarHBondContact ND2-OD2 2.92Å; G127-D250 VanDerWaalsContact CA-O 3.3Å; G127-D250 WeakPolarHBondContact CA-O 3.42Å; V246-D250 WeakPolarHBondContact O-CA 3.12Å; V246-D250 PolarHBondContact O-N 3.16Å; D250-K330 WeakPolarHBondContact OD1-CE 3.33Å; D250-K330 IonicContact OD1-NZ 2.68Å; D250-K330 PolarHBondContact OD1-NZ 3.44Å |
| 251 | V | 84.4 | Confident | 89.2 | Confident | 1 Ų | 1 | 25.8 Ų | 25.8 | 1% | 0.006 | 12% | 0.12 | C | C | . | . | trans | -69.9 | 139.6 | -173.5 | -176.1 | 0 | 0 | 0 | 0 | 110.1 | F130 F135 V246 H249 R255 A256 K330 | F130-V251 HydrophobicContact CD1-CB 4.46Å; F130-V251 HydrophobicContact CD1-CG1 4.16Å; F130-V251 HydrophobicContact CD1-CG2 3.54Å; F130-V251 HydrophobicContact CE1-CB 4.09Å; F130-V251 HydrophobicContact CE1-CG1 3.34Å; F130-V251 HydrophobicContact CE1-CG2 3.59Å; F130-V251 HydrophobicContact CG-CG2 4.17Å; F130-V251 HydrophobicContact CZ-CG1 3.76Å; F130-V251 HydrophobicContact CZ-CG2 4.24Å; F135-V251 HydrophobicContact CE2-CG2 4.39Å; F135-V251 HydrophobicContact CZ-CG1 4.45Å; F135-V251 HydrophobicContact CZ-CG2 4.48Å; V246-V251 PolarHBondContact O-N 3.32Å; H249-V251 HydrophobicContact CB-CG2 3.69Å; H249-V251 PolarHBondContact O-N 3.13Å; H249-V251 VanDerWaalsContact O-N 3.17Å; V251-R255 HydrophobicContact CG1-CB 4.43Å; V251-A256 HydrophobicContact CG1-CB 3.9Å; V251-K330 PolarHBondContact O-NZ 3.45Å | ||
| 252 | H | 89.1 | Confident | 89.4 | Confident | 38 Ų | 38 | 26.4 Ų | 26.4 | 18% | 0.176 | 12% | 0.123 | C | C | . | . | trans | -67.5 | 129.3 | 171.7 | -171 | -78.1 | 0 | 0 | 0 | 110.6 | F109 N125 L254 R255 A256 | F109-H252 HydrophobicContact CD2-CB 4.48Å; F109-H252 AromaticContact CD2-ND1 3.7Å; F109-H252 HydrophobicContact CE2-CB 3.74Å; F109-H252 AromaticContact CE2-CG 3.66Å; F109-H252 AromaticContact CE2-ND1 3.77Å; F109-H252 HydrophobicContact CZ-CB 4.44Å; N125-H252 PolarHBondContact O-CD2 3.43Å; H252-L254 PolarHBondContact ND1-N 3.27Å; H252-L254 PolarHBondContact O-N 3.04Å; H252-R255 HydrophobicContact CB-CB 4.4Å; H252-R255 WeakPolarHBondContact O-CB 3.34Å; H252-R255 PolarHBondContact O-N 3.33Å; H252-A256 PolarHBondContact O-N 3.26Å; H252-A256 VanDerWaalsContact O-N 3.1Å | ||
| 253 | P | 90.9 | Very high | 89.6 | Confident | 13 Ų | 13 | 28.2 Ų | 28.2 | 8% | 0.084 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -51.8 | -45.5 | -174.9 | -30.8 | 36.1 | 0 | 0 | 0 | 115.1 | R255 A256 V257 F323 I326 S327 K330 | P253-R255 VanDerWaalsContact C-N 3.27Å; P253-R255 PolarHBondContact O-N 3.47Å; P253-A256 PolarHBondContact O-N 3.5Å; P253-V257 WeakPolarHBondContact O-CG2 3.49Å; P253-V257 PolarHBondContact O-N 3.33Å; P253-F323 HydrophobicContact CB-CD2 3.99Å; P253-F323 HydrophobicContact CB-CE2 3.99Å; P253-I326 HydrophobicContact CB-CB 4.27Å; P253-I326 HydrophobicContact CB-CG2 3.82Å; P253-I326 HydrophobicContact CG-CG2 4.31Å; P253-S327 WeakPolarHBondContact CB-OG 3.1Å; P253-K330 HydrophobicContact CG-CD 4.21Å |
| 254 | L | 91.7 | Very high | 89.8 | Confident | 17 Ų | 17 | 28.2 Ų | 28.2 | 9% | 0.089 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -59.4 | -35.8 | 177 | -69.6 | 170.6 | 0 | 0 | 0 | 113.3 | C105 V108 F109 L112 H252 G258 F323 | C105-L254 HydrophobicContact CB-CD2 4.09Å; V108-L254 HydrophobicContact CG1-CD1 4.32Å; F109-L254 HydrophobicContact CB-CB 3.91Å; F109-L254 HydrophobicContact CD2-CB 4.08Å; F109-L254 HydrophobicContact CG-CB 4.41Å; L112-L254 HydrophobicContact CD1-CD1 3.72Å; H252-L254 PolarHBondContact ND1-N 3.27Å; H252-L254 PolarHBondContact O-N 3.04Å; L254-G258 PolarHBondContact O-N 2.99Å; L254-F323 HydrophobicContact CD2-CB 4.3Å; L254-F323 HydrophobicContact CD2-CD2 3.41Å; L254-F323 VanDerWaalsContact CD2-CD2 3.41Å; L254-F323 HydrophobicContact CD2-CE2 3.93Å; L254-F323 HydrophobicContact CD2-CG 3.93Å; L254-F323 HydrophobicContact CG-CD2 3.63Å; L254-F323 HydrophobicContact CG-CE2 3.73Å |
| 255 | R | 91.5 | Very high | 90.1 | Very high | 40 Ų | 40 | 26.7 Ų | 26.7 | 15% | 0.151 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -73.5 | -41.9 | 179.6 | -175.7 | 179.2 | 174.7 | -171.9 | -1.9 | 110.7 | L106 F109 F130 V251 H252 P253 G258 T259 | L106-R255 HydrophobicContact CD1-CG 4.41Å; F109-R255 HydrophobicContact CD1-CB 4.07Å; F109-R255 HydrophobicContact CD1-CG 4.32Å; F109-R255 HydrophobicContact CD2-CB 4.16Å; F109-R255 HydrophobicContact CE1-CB 3.91Å; F109-R255 HydrophobicContact CE1-CG 3.99Å; F109-R255 HydrophobicContact CE2-CB 4.02Å; F109-R255 HydrophobicContact CG-CB 4.17Å; F109-R255 HydrophobicContact CZ-CB 3.89Å; F109-R255 HydrophobicContact CZ-CG 4.29Å; F130-R255 HydrophobicContact CE1-CG 4.35Å; F130-R255 HydrophobicContact CZ-CG 4.32Å; V251-R255 HydrophobicContact CG1-CB 4.43Å; H252-R255 HydrophobicContact CB-CB 4.4Å; H252-R255 WeakPolarHBondContact O-CB 3.34Å; H252-R255 PolarHBondContact O-N 3.33Å; P253-R255 VanDerWaalsContact C-N 3.27Å; P253-R255 PolarHBondContact O-N 3.47Å; R255-G258 PolarHBondContact O-N 3.21Å; R255-T259 WeakPolarHBondContact O-CG2 3.2Å; R255-T259 PolarHBondContact O-N 2.83Å; R255-T259 PolarHBondContact O-OG1 3.37Å |
| 256 | A | 91.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -57.8 | -57.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | F135 V246 V251 H252 P253 G258 T259 E260 I326 | F135-A256 HydrophobicContact CD1-CB 4.46Å; F135-A256 HydrophobicContact CE1-CB 3.58Å; F135-A256 HydrophobicContact CE2-CB 4.48Å; F135-A256 HydrophobicContact CZ-CB 3.58Å; V246-A256 HydrophobicContact CG2-CB 4.41Å; V251-A256 HydrophobicContact CG1-CB 3.9Å; H252-A256 PolarHBondContact O-N 3.26Å; H252-A256 VanDerWaalsContact O-N 3.1Å; P253-A256 PolarHBondContact O-N 3.5Å; A256-G258 VanDerWaalsContact C-N 3.3Å; A256-G258 PolarHBondContact O-N 3Å; A256-T259 PolarHBondContact O-N 3.47Å; A256-T259 PolarHBondContact O-OG1 3.23Å; A256-E260 PolarHBondContact O-N 3.23Å; A256-I326 HydrophobicContact CB-CG2 4.38Å |
| 257 | V | 93.8 | Very high | 90.9 | Very high | 1 Ų | 1 | 30.4 Ų | 30.4 | 1% | 0.006 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -57.7 | -44.2 | 177.8 | 177 | 0 | 0 | 0 | 0 | 111 | E102 C105 P253 T259 E260 G261 N322 I326 | E102-V257 HydrophobicContact CB-CG1 3.83Å; E102-V257 HydrophobicContact CG-CG1 3.92Å; C105-V257 HydrophobicContact CB-CB 4.4Å; C105-V257 HydrophobicContact CB-CG1 4.21Å; P253-V257 WeakPolarHBondContact O-CG2 3.49Å; P253-V257 PolarHBondContact O-N 3.33Å; V257-T259 VanDerWaalsContact C-N 3.35Å; V257-T259 PolarHBondContact O-N 2.86Å; V257-E260 PolarHBondContact O-N 2.71Å; V257-G261 PolarHBondContact O-N 3.07Å; V257-N322 HydrophobicContact CG1-CB 3.69Å; V257-N322 HydrophobicContact CG2-CB 4.17Å; V257-N322 WeakPolarHBondContact CG2-O 3.42Å; V257-I326 HydrophobicContact CG2-CB 4.11Å; V257-I326 HydrophobicContact CG2-CG1 3.52Å |
| 258 | G | 94.6 | Very high | 91.3 | Very high | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -61.9 | -38.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | E102 L254 R255 A256 L262 | E102-G258 WeakPolarHBondContact O-CA 3.28Å; L254-G258 PolarHBondContact O-N 2.99Å; R255-G258 PolarHBondContact O-N 3.21Å; A256-G258 VanDerWaalsContact C-N 3.3Å; A256-G258 PolarHBondContact O-N 3Å; G258-L262 WeakPolarHBondContact O-CB 3.43Å; G258-L262 PolarHBondContact O-N 3.49Å; G258-L262 VanDerWaalsContact O-N 3.09Å |
| 259 | T | 93.1 | Very high | 91.8 | Very high | 10 Ų | 10 | 25.6 Ų | 25.6 | 6% | 0.061 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -73.3 | -37.8 | 176.7 | 48 | 0 | 0 | 0 | 0 | 112.8 | R255 A256 V257 L262 F263 | R255-T259 WeakPolarHBondContact O-CG2 3.2Å; R255-T259 PolarHBondContact O-N 2.83Å; R255-T259 PolarHBondContact O-OG1 3.37Å; A256-T259 PolarHBondContact O-N 3.47Å; A256-T259 PolarHBondContact O-OG1 3.23Å; V257-T259 VanDerWaalsContact C-N 3.35Å; V257-T259 PolarHBondContact O-N 2.86Å; T259-L262 PolarHBondContact O-N 2.99Å; T259-F263 WeakPolarHBondContact O-CD2 3.47Å; T259-F263 PolarHBondContact O-N 3.12Å |
| 260 | E | 93 | Very high | 92.4 | Very high | 7 Ų | 7 | 28.4 Ų | 28.4 | 3% | 0.033 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -63.5 | -50.4 | 174.6 | -175.3 | 173.8 | 178.2 | 0 | 0 | 110.8 | A139 Q238 A256 V257 L262 F263 G264 | A139-E260 HydrophobicContact CB-CG 3.88Å; Q238-E260 PolarHBondContact NE2-OE1 3.25Å; A256-E260 PolarHBondContact O-N 3.23Å; V257-E260 PolarHBondContact O-N 2.71Å; E260-L262 VanDerWaalsContact C-N 3.27Å; E260-L262 PolarHBondContact O-N 3.47Å; E260-F263 PolarHBondContact O-N 2.81Å; E260-F263 VanDerWaalsContact O-N 3.12Å; E260-G264 PolarHBondContact O-N 2.98Å |
| 261 | G | 94.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -56.7 | -37.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | V257 F265 | V257-G261 PolarHBondContact O-N 3.07Å; G261-F265 WeakPolarHBondContact O-CB 3.36Å; G261-F265 PolarHBondContact O-N 3.22Å |
| 262 | L | 95.4 | Very high | 93.2 | Very high | 58 Ų | 58 | 29.9 Ų | 29.9 | 30% | 0.304 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -62 | -49.4 | 174.9 | 175.6 | 62.8 | 0 | 0 | 0 | 112 | F103 G258 T259 E260 V266 | F103-L262 HydrophobicContact CD2-CB 3.84Å; F103-L262 HydrophobicContact CD2-CD1 4Å; F103-L262 HydrophobicContact CD2-CG 4.47Å; F103-L262 HydrophobicContact CE2-CB 4.26Å; F103-L262 HydrophobicContact CE2-CD1 3.71Å; F103-L262 HydrophobicContact CE2-CG 4.43Å; F103-L262 HydrophobicContact CZ-CD1 4.16Å; G258-L262 WeakPolarHBondContact O-CB 3.43Å; G258-L262 PolarHBondContact O-N 3.49Å; G258-L262 VanDerWaalsContact O-N 3.09Å; T259-L262 PolarHBondContact O-N 2.99Å; E260-L262 VanDerWaalsContact C-N 3.27Å; E260-L262 PolarHBondContact O-N 3.47Å; L262-V266 HydrophobicContact CD1-CG2 4.16Å; L262-V266 VanDerWaalsContact O-CG2 3.29Å; L262-V266 WeakPolarHBondContact O-CG2 3.32Å; L262-V266 PolarHBondContact O-N 3.22Å |
| 263 | F | 95.3 | Very high | 93.3 | Very high | 39 Ų | 39 | 32.9 Ų | 32.9 | 17% | 0.171 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -67.1 | -43.6 | 179.8 | -69.9 | -61.5 | 0 | 0 | 0 | 111.7 | P132 L133 F136 A139 T259 E260 V266 V267 | P132-F263 HydrophobicContact CB-CZ 4.4Å; P132-F263 VanDerWaalsContact O-CE2 3.23Å; P132-F263 WeakPolarHBondContact O-CE2 3.34Å; L133-F263 HydrophobicContact CD2-CE1 4.12Å; L133-F263 HydrophobicContact CD2-CZ 4.02Å; F136-F263 HydrophobicContact CB-CD2 4.31Å; F136-F263 HydrophobicContact CB-CE2 4.46Å; F136-F263 HydrophobicContact CB-CG 4.43Å; F136-F263 HydrophobicContact CD2-CB 4.02Å; F136-F263 AromaticContact CD2-CD1 3.72Å; F136-F263 HydrophobicContact CD2-CD1 3.72Å; F136-F263 HydrophobicContact CD2-CE1 4.32Å; F136-F263 AromaticContact CD2-CG 3.85Å; F136-F263 HydrophobicContact CD2-CG 3.85Å; F136-F263 HydrophobicContact CE2-CD1 4.46Å; A139-F263 HydrophobicContact CB-CB 3.94Å; T259-F263 WeakPolarHBondContact O-CD2 3.47Å; T259-F263 PolarHBondContact O-N 3.12Å; E260-F263 PolarHBondContact O-N 2.81Å; E260-F263 VanDerWaalsContact O-N 3.12Å; F263-V266 PolarHBondContact O-N 3.49Å; F263-V267 WeakPolarHBondContact O-CB 3.28Å; F263-V267 WeakPolarHBondContact O-CG2 3.14Å; F263-V267 PolarHBondContact O-N 3.12Å |
| 264 | G | 93.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -59.3 | -47.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | M143 E260 V266 L268 | M143-G264 VanDerWaalsContact CE-O 3.26Å; M143-G264 WeakPolarHBondContact CE-O 3.33Å; E260-G264 PolarHBondContact O-N 2.98Å; G264-V266 PolarHBondContact O-N 3.39Å; G264-L268 WeakPolarHBondContact O-CB 3.48Å; G264-L268 PolarHBondContact O-N 3.14Å |
| 265 | F | 95.1 | Very high | 93.3 | Very high | 57 Ų | 57 | 35.2 Ų | 35.2 | 25% | 0.25 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60.5 | -48 | 178.5 | 179.8 | -98.5 | 0 | 0 | 0 | 111.8 | V96 F99 L100 G261 S269 | V96-F265 HydrophobicContact CG1-CD2 3.86Å; V96-F265 HydrophobicContact CG1-CE2 3.58Å; F99-F265 HydrophobicContact CB-CB 3.89Å; L100-F265 HydrophobicContact CB-CD2 4.03Å; L100-F265 HydrophobicContact CB-CE2 4.08Å; L100-F265 HydrophobicContact CD1-CD2 4.4Å; L100-F265 HydrophobicContact CD1-CE2 4.05Å; L100-F265 HydrophobicContact CD1-CZ 4.45Å; G261-F265 WeakPolarHBondContact O-CB 3.36Å; G261-F265 PolarHBondContact O-N 3.22Å; F265-S269 WeakPolarHBondContact O-CB 3.41Å; F265-S269 PolarHBondContact O-N 3.22Å; F265-S269 PolarHBondContact O-OG 3.32Å |
| 266 | V | 95.4 | Very high | 93.1 | Very high | 70 Ų | 70 | 36 Ų | 36 | 42% | 0.424 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -64.1 | -51 | -179.2 | 170 | 0 | 0 | 0 | 0 | 111 | L262 F263 G264 L270 | L262-V266 HydrophobicContact CD1-CG2 4.16Å; L262-V266 VanDerWaalsContact O-CG2 3.29Å; L262-V266 WeakPolarHBondContact O-CG2 3.32Å; L262-V266 PolarHBondContact O-N 3.22Å; F263-V266 PolarHBondContact O-N 3.49Å; G264-V266 PolarHBondContact O-N 3.39Å; V266-L270 HydrophobicContact CG1-CD1 4.15Å; V266-L270 VanDerWaalsContact O-CG 3.29Å; V266-L270 WeakPolarHBondContact O-CG 3.31Å; V266-L270 PolarHBondContact O-N 2.92Å; V266-L270 VanDerWaalsContact O-N 3.08Å |
| 267 | V | 94.9 | Very high | 93 | Very high | 37 Ų | 37 | 42.5 Ų | 42.5 | 22% | 0.224 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -66.8 | -44.4 | -176.2 | 172.1 | 0 | 0 | 0 | 0 | 110.9 | F136 M140 M143 F263 L270 L271 | F136-V267 HydrophobicContact CE2-CG2 4.11Å; M140-V267 HydrophobicContact CE-CB 3.92Å; M140-V267 HydrophobicContact CE-CG1 4.02Å; M140-V267 HydrophobicContact CE-CG2 3.86Å; M140-V267 HydrophobicContact SD-CG1 4.06Å; M140-V267 HydrophobicContact SD-CG2 4.35Å; M143-V267 HydrophobicContact CE-CB 3.69Å; M143-V267 HydrophobicContact CE-CG1 3.72Å; M143-V267 HydrophobicContact SD-CB 4.4Å; M143-V267 HydrophobicContact SD-CG1 3.75Å; F263-V267 WeakPolarHBondContact O-CB 3.28Å; F263-V267 WeakPolarHBondContact O-CG2 3.14Å; F263-V267 PolarHBondContact O-N 3.12Å; V267-L270 PolarHBondContact O-N 3.33Å; V267-L271 HydrophobicContact CG1-CD1 4.09Å; V267-L271 WeakPolarHBondContact O-CG 3.25Å; V267-L271 PolarHBondContact O-N 3.13Å |
| 268 | L | 92.9 | Very high | 92.7 | Very high | 2 Ų | 2 | 46.6 Ų | 46.6 | 1% | 0.01 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -68.9 | -39.2 | -178.8 | -171.3 | 62.2 | 0 | 0 | 0 | 111.7 | F92 A95 V96 F99 M143 G264 L270 L271 L272 | F92-L268 HydrophobicContact CD1-CD1 4.3Å; A95-L268 HydrophobicContact CB-CD2 3.58Å; V96-L268 HydrophobicContact CB-CD2 4.48Å; V96-L268 HydrophobicContact CG2-CB 4.13Å; V96-L268 HydrophobicContact CG2-CD2 3.63Å; V96-L268 HydrophobicContact CG2-CG 3.65Å; F99-L268 HydrophobicContact CD2-CB 4.35Å; F99-L268 HydrophobicContact CD2-CD2 3.81Å; F99-L268 HydrophobicContact CE2-CB 4.49Å; F99-L268 HydrophobicContact CE2-CD2 3.89Å; M143-L268 HydrophobicContact CE-CB 3.74Å; M143-L268 HydrophobicContact CG-CD1 4.29Å; M143-L268 HydrophobicContact SD-CB 4.17Å; M143-L268 HydrophobicContact SD-CD1 4.2Å; G264-L268 WeakPolarHBondContact O-CB 3.48Å; G264-L268 PolarHBondContact O-N 3.14Å; L268-L270 VanDerWaalsContact C-N 3.27Å; L268-L270 PolarHBondContact O-N 3.09Å; L268-L271 CarbonylContact O-C 3.31Å; L268-L271 WeakPolarHBondContact O-CA 3.43Å; L268-L271 WeakPolarHBondContact O-CB 3.32Å; L268-L271 PolarHBondContact O-N 3.35Å; L268-L272 PolarHBondContact O-N 2.93Å |
| 269 | S | 93.6 | Very high | 92.2 | Very high | 37 Ų | 37 | 52.8 Ų | 52.8 | 26% | 0.259 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -61.6 | -37 | 174.5 | -61.4 | 0 | 0 | 0 | 0 | 112 | F265 L272 | F265-S269 WeakPolarHBondContact O-CB 3.41Å; F265-S269 PolarHBondContact O-N 3.22Å; F265-S269 PolarHBondContact O-OG 3.32Å; S269-L272 PolarHBondContact O-N 2.87Å |
| 270 | L | 94.3 | Very high | 91.7 | Very high | 106 Ų | 106 | 54.1 Ų | 54.1 | 56% | 0.555 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -69.1 | -35.3 | 173.2 | -70.7 | 173.8 | 0 | 0 | 0 | 112 | V266 V267 L268 I273 P274 | V266-L270 HydrophobicContact CG1-CD1 4.15Å; V266-L270 VanDerWaalsContact O-CG 3.29Å; V266-L270 WeakPolarHBondContact O-CG 3.31Å; V266-L270 PolarHBondContact O-N 2.92Å; V266-L270 VanDerWaalsContact O-N 3.08Å; V267-L270 PolarHBondContact O-N 3.33Å; L268-L270 VanDerWaalsContact C-N 3.27Å; L268-L270 PolarHBondContact O-N 3.09Å; L270-I273 HydrophobicContact CD2-CD1 4.46Å; L270-I273 PolarHBondContact O-N 3.14Å; L270-P274 WeakPolarHBondContact O-CD 3.22Å |
| 271 | L | 92.2 | Very high | 91.1 | Very high | 68 Ų | 68 | 55.3 Ų | 55.3 | 36% | 0.356 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -69.6 | -28.2 | 175.8 | -74.1 | 172.3 | 0 | 0 | 0 | 113.1 | M143 V267 L268 I273 P274 M275 | M143-L271 HydrophobicContact SD-CD1 3.78Å; V267-L271 HydrophobicContact CG1-CD1 4.09Å; V267-L271 WeakPolarHBondContact O-CG 3.25Å; V267-L271 PolarHBondContact O-N 3.13Å; L268-L271 CarbonylContact O-C 3.31Å; L268-L271 WeakPolarHBondContact O-CA 3.43Å; L268-L271 WeakPolarHBondContact O-CB 3.32Å; L268-L271 PolarHBondContact O-N 3.35Å; L271-I273 PolarHBondContact O-N 2.99Å; L271-I273 VanDerWaalsContact O-N 3.13Å; L271-P274 WeakPolarHBondContact O-CD 3.46Å; L271-P274 VanDerWaalsContact O-CG 3.22Å; L271-P274 WeakPolarHBondContact O-CG 3.4Å; L271-M275 HydrophobicContact CB-CE 4.24Å; L271-M275 HydrophobicContact CB-SD 4.45Å; L271-M275 WeakPolarHBondContact O-CB 3.26Å; L271-M275 WeakPolarHBondContact O-CG 3.29Å; L271-M275 PolarHBondContact O-N 3.31Å; L271-M275 VanDerWaalsContact O-N 3.11Å |
| 272 | L | 90.9 | Very high | 90.1 | Very high | 27 Ų | 27 | 62.9 Ų | 62.9 | 14% | 0.141 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -57.4 | -28.7 | 174.1 | -71.9 | -173.3 | 0 | 0 | 0 | 112.8 | F92 V96 L268 S269 M275 Y276 E292 A294 | F92-L272 HydrophobicContact CB-CD2 3.65Å; V96-L272 HydrophobicContact CG2-CD1 3.68Å; V96-L272 HydrophobicContact CG2-CG 4.16Å; L268-L272 PolarHBondContact O-N 2.93Å; S269-L272 PolarHBondContact O-N 2.87Å; L272-M275 HydrophobicContact CD2-SD 4.24Å; L272-M275 PolarHBondContact O-N 3.1Å; L272-Y276 PolarHBondContact O-N 3.5Å; L272-Y276 VanDerWaalsContact O-N 3.1Å; L272-E292 HydrophobicContact CD2-CB 4.37Å; L272-E292 HydrophobicContact CD2-CG 3.93Å; L272-A294 HydrophobicContact CD1-CB 4.34Å |
| 273 | I | 92.1 | Very high | 88.9 | Confident | 101 Ų | 101 | 66.1 Ų | 66.1 | 52% | 0.518 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.2 | -58.9 | 179.4 | -56.5 | 171.4 | 0 | 0 | 0 | 111.3 | L270 L271 M275 Y276 F277 | L270-I273 HydrophobicContact CD2-CD1 4.46Å; L270-I273 PolarHBondContact O-N 3.14Å; L271-I273 PolarHBondContact O-N 2.99Å; L271-I273 VanDerWaalsContact O-N 3.13Å; I273-M275 VanDerWaalsContact C-N 3.33Å; I273-M275 PolarHBondContact O-N 3.32Å; I273-Y276 WeakPolarHBondContact O-CB 3.48Å; I273-Y276 PolarHBondContact O-N 3.43Å; I273-F277 HydrophobicContact CG2-CE2 4.43Å; I273-F277 WeakPolarHBondContact O-CD2 3.16Å |
| 274 | P | 91.7 | Very high | 87.9 | Confident | 59 Ų | 59 | 64.5 Ų | 64.5 | 38% | 0.383 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -64.9 | -33.9 | 174.7 | 23.8 | -33.1 | 0 | 0 | 0 | 112.9 | L270 L271 Y276 F277 I278 | L270-P274 WeakPolarHBondContact O-CD 3.22Å; L271-P274 WeakPolarHBondContact O-CD 3.46Å; L271-P274 VanDerWaalsContact O-CG 3.22Å; L271-P274 WeakPolarHBondContact O-CG 3.4Å; P274-Y276 PolarHBondContact O-N 3.47Å; P274-F277 PolarHBondContact O-N 3.47Å; P274-I278 HydrophobicContact CB-CD1 4.45Å; P274-I278 WeakPolarHBondContact O-CG1 3.48Å; P274-I278 PolarHBondContact O-N 3.48Å; P274-I278 VanDerWaalsContact O-N 3.17Å |
| 275 | M | 89.1 | Confident | 87 | Confident | 21 Ų | 21 | 69.3 Ų | 69.3 | 10% | 0.103 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -59.6 | -31.7 | 178.6 | -68.3 | 178.6 | 166.5 | 0 | 0 | 113.1 | F92 L271 L272 I273 F277 L291 E292 | F92-M275 HydrophobicContact CB-SD 4.29Å; F92-M275 HydrophobicContact CD1-CE 3.85Å; F92-M275 HydrophobicContact CD1-SD 3.91Å; F92-M275 HydrophobicContact CD2-SD 4.24Å; F92-M275 HydrophobicContact CE1-CE 3.7Å; F92-M275 HydrophobicContact CE1-SD 4.26Å; F92-M275 HydrophobicContact CG-CE 4.41Å; F92-M275 HydrophobicContact CG-SD 3.9Å; F92-M275 HydrophobicContact CZ-CE 4.15Å; L271-M275 HydrophobicContact CB-CE 4.24Å; L271-M275 HydrophobicContact CB-SD 4.45Å; L271-M275 WeakPolarHBondContact O-CB 3.26Å; L271-M275 WeakPolarHBondContact O-CG 3.29Å; L271-M275 PolarHBondContact O-N 3.31Å; L271-M275 VanDerWaalsContact O-N 3.11Å; L272-M275 HydrophobicContact CD2-SD 4.24Å; L272-M275 PolarHBondContact O-N 3.1Å; I273-M275 VanDerWaalsContact C-N 3.33Å; I273-M275 PolarHBondContact O-N 3.32Å; M275-F277 PolarHBondContact O-N 3.36Å; M275-L291 HydrophobicContact CB-CB 4.41Å; M275-L291 HydrophobicContact CB-CD2 4.48Å; M275-L291 HydrophobicContact CE-CD2 4.27Å; M275-L291 HydrophobicContact CG-CD2 3.95Å; M275-L291 HydrophobicContact SD-CD2 4.46Å; M275-E292 HydrophobicContact CB-CB 4.16Å; M275-E292 PolarHBondContact O-N 3.24Å |
| 276 | Y | 88.8 | Confident | 86.2 | Confident | 57 Ų | 57 | 66.7 Ų | 66.7 | 22% | 0.224 | 35% | 0.352 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.5 | -23.8 | 174.6 | 178.2 | -93.1 | 0 | 0 | 0 | 114.3 | L272 I273 P274 R288 E292 D293 L295 | L272-Y276 PolarHBondContact O-N 3.5Å; L272-Y276 VanDerWaalsContact O-N 3.1Å; I273-Y276 WeakPolarHBondContact O-CB 3.48Å; I273-Y276 PolarHBondContact O-N 3.43Å; P274-Y276 PolarHBondContact O-N 3.47Å; Y276-R288 PolarHBondContact O-NH2 3.44Å; Y276-R288 PolarHBondContact OH-NH1 2.74Å; Y276-E292 WeakPolarHBondContact CA-O 3.47Å; Y276-D293 WeakPolarHBondContact CE2-OD1 3.42Å; Y276-L295 HydrophobicContact CE2-CB 4.41Å; Y276-L295 HydrophobicContact CE2-CD1 3.83Å; Y276-L295 HydrophobicContact CE2-CG 4.09Å |
| 277 | F | 88.6 | Confident | 85.5 | Confident | 135 Ų | 135 | 66 Ų | 66 | 59% | 0.592 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.3 | -19 | -178.5 | -63 | -73.7 | 0 | 0 | 0 | 113.6 | I273 P274 M275 H279 | I273-F277 HydrophobicContact CG2-CE2 4.43Å; I273-F277 WeakPolarHBondContact O-CD2 3.16Å; P274-F277 PolarHBondContact O-N 3.47Å; M275-F277 PolarHBondContact O-N 3.36Å; F277-H279 PolarHBondContact O-CE1 3.35Å; F277-H279 PolarHBondContact O-N 2.94Å; F277-H279 PolarHBondContact O-ND1 2.91Å |
| 278 | I | 87.3 | Confident | 84.9 | Confident | 87 Ų | 87 | 67.7 Ų | 67.7 | 45% | 0.446 | 35% | 0.351 | S | S | . | . | trans | -79.4 | 117.7 | -179 | -65.5 | 164.2 | 0 | 0 | 0 | 109.1 | P274 V280 V290 L291 | P274-I278 HydrophobicContact CB-CD1 4.45Å; P274-I278 WeakPolarHBondContact O-CG1 3.48Å; P274-I278 PolarHBondContact O-N 3.48Å; P274-I278 VanDerWaalsContact O-N 3.17Å; I278-V280 HydrophobicContact CG2-CG1 3.98Å; I278-V290 CarbonylContact O-C 3.59Å; I278-V290 WeakPolarHBondContact O-CA 3.37Å; I278-V290 WeakPolarHBondContact O-CB 3.28Å; I278-L291 PolarHBondContact O-N 3.16Å | ||
| 279 | H | 84.8 | Confident | 84.5 | Confident | 131 Ų | 131 | 70.5 Ų | 70.5 | 61% | 0.606 | 36% | 0.364 | S | S | * | . | B | Isolated β-bridge | trans | -88.8 | 127 | 175.4 | -63.5 | 71.5 | 0 | 0 | 0 | 109.2 | F277 Q289 | F277-H279 PolarHBondContact O-CE1 3.35Å; F277-H279 PolarHBondContact O-N 2.94Å; F277-H279 PolarHBondContact O-ND1 2.91Å; H279-Q289 CarbonylContact C-O 3.56Å; H279-Q289 WeakPolarHBondContact CA-O 3.48Å |
| 280 | V | 81.9 | Confident | 84.2 | Confident | 38 Ų | 38 | 68.8 Ų | 68.8 | 23% | 0.23 | 35% | 0.352 | C | S | . | . | trans | -115.3 | -0.1 | -176.6 | -63.5 | 0 | 0 | 0 | 0 | 113 | I278 F283 Q289 L291 | I278-V280 HydrophobicContact CG2-CG1 3.98Å; V280-F283 HydrophobicContact CB-CB 4.13Å; V280-F283 HydrophobicContact CG2-CB 4.07Å; V280-F283 WeakPolarHBondContact O-CD2 3.36Å; V280-Q289 PolarHBondContact N-O 2.98Å; V280-L291 HydrophobicContact CG1-CB 3.89Å; V280-L291 HydrophobicContact CG1-CD1 4Å; V280-L291 HydrophobicContact CG1-CG 4.44Å; V280-L291 HydrophobicContact CG2-CB 4.44Å; V280-L291 HydrophobicContact CG2-CD1 4.41Å | ||
| 281 | G | 80.8 | Confident | 83.8 | Confident | 32 Ų | 32 | 65.8 Ų | 65.8 | 33% | 0.33 | 34% | 0.336 | S | S | . | . | G | 310 helix | trans | 60.1 | -138.1 | -178.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | F283 S284 Q289 | G281-F283 PolarHBondContact O-N 3.48Å; G281-S284 PolarHBondContact O-N 2.86Å; G281-Q289 PolarHBondContact N-O 3.47Å; G281-Q289 PolarHBondContact O-OE1 2.95Å |
| 282 | D | 72.9 | Confident | 83.6 | Confident | 158 Ų | 158 | 62.6 Ų | 62.6 | 85% | 0.845 | 32% | 0.32 | S | S | * | . | G | 310 helix | trans | -61 | -4.9 | -172.2 | -56 | -27.7 | 0 | 0 | 0 | 115.3 | S284 | D282-S284 PolarHBondContact O-N 3.34Š|
| 283 | F | 71.1 | Confident | 83.6 | Confident | 126 Ų | 126 | 61.8 Ų | 61.8 | 55% | 0.553 | 32% | 0.315 | S | S | * | . | G | 310 helix | trans | -76 | -9.2 | 174.4 | -76 | -75.6 | 0 | 0 | 0 | 114.1 | N154 V280 G281 | N154-F283 PolarHBondContact ND2-O 3.19Å; V280-F283 HydrophobicContact CB-CB 4.13Å; V280-F283 HydrophobicContact CG2-CB 4.07Å; V280-F283 WeakPolarHBondContact O-CD2 3.36Å; G281-F283 PolarHBondContact O-N 3.48Å |
| 284 | S | 75.2 | Confident | 83.5 | Confident | 5 Ų | 5 | 57.7 Ų | 57.7 | 4% | 0.035 | 30% | 0.297 | C | S | . | . | trans | -126.9 | 136.5 | 178.8 | -172.3 | 0 | 0 | 0 | 0 | 111.9 | G281 D282 N286 Q289 V290 | G281-S284 PolarHBondContact O-N 2.86Å; D282-S284 PolarHBondContact O-N 3.34Å; S284-N286 VanDerWaalsContact C-N 3.25Å; S284-N286 PolarHBondContact O-N 2.9Å; S284-N286 VanDerWaalsContact OG-CG 3.25Å; S284-N286 PolarHBondContact OG-N 3.37Å; S284-N286 PolarHBondContact OG-ND2 3.07Å; S284-Q289 PolarHBondContact O-NE2 3.01Å; S284-Q289 PolarHBondContact O-OE1 3.03Å; S284-V290 WeakPolarHBondContact CB-O 3.36Å; S284-V290 PolarHBondContact OG-O 3.3Å | ||
| 285 | D | 73 | Confident | 83.4 | Confident | 101 Ų | 101 | 59.3 Ų | 59.3 | 54% | 0.54 | 30% | 0.302 | S | S | . | . | trans | -82.5 | -1.1 | 176.5 | -65.7 | -43.4 | 0 | 0 | 0 | 113.2 | ||||
| 286 | N | 80 | Confident | 83.5 | Confident | 2 Ų | 2 | 58.3 Ų | 58.3 | 1% | 0.011 | 30% | 0.297 | C | S | . | . | S | Bend | trans | -77.5 | 151.1 | -178.4 | 72 | 49.9 | 0 | 0 | 0 | 112.1 | S284 R288 Q289 V290 | S284-N286 VanDerWaalsContact C-N 3.25Å; S284-N286 PolarHBondContact O-N 2.9Å; S284-N286 VanDerWaalsContact OG-CG 3.25Å; S284-N286 PolarHBondContact OG-N 3.37Å; S284-N286 PolarHBondContact OG-ND2 3.07Å; N286-R288 PolarHBondContact O-N 2.99Å; N286-R288 PolarHBondContact OD1-N 2.92Å; N286-Q289 PolarHBondContact O-N 3.42Å; N286-Q289 PolarHBondContact O-NE2 2.9Å; N286-Q289 WeakPolarHBondContact OD1-CA 3.35Å; N286-Q289 PolarHBondContact OD1-N 3.15Å; N286-V290 PolarHBondContact ND2-O 3.49Å; N286-V290 PolarHBondContact OD1-N 3.38Å |
| 287 | P | 80.3 | Confident | 83.6 | Confident | 55 Ų | 55 | 55.6 Ų | 55.6 | 36% | 0.357 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.7 | -23.9 | -175.2 | -26.3 | 34.1 | 0 | 0 | 0 | 114.7 | N83 H86 | N83-P287 HydrophobicContact CB-CG 4.27Å; H86-P287 VanDerWaalsContact CE1-CG 3.48Å; H86-P287 WeakPolarHBondContact CE1-CG 3.32Å; H86-P287 VanDerWaalsContact NE2-CD 3.29Å; H86-P287 WeakPolarHBondContact NE2-CD 3.42Å |
| 288 | R | 82.2 | Confident | 83.8 | Confident | 74 Ų | 74 | 55.5 Ų | 55.5 | 28% | 0.279 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.9 | -6.1 | -179.9 | -74.8 | -178.1 | 55.3 | -136.3 | -4.3 | 113.4 | Y276 N286 V290 D293 | Y276-R288 PolarHBondContact O-NH2 3.44Å; Y276-R288 PolarHBondContact OH-NH1 2.74Å; N286-R288 PolarHBondContact O-N 2.99Å; N286-R288 PolarHBondContact OD1-N 2.92Å; R288-V290 HydrophobicContact CB-CG1 4.16Å; R288-V290 HydrophobicContact CB-CG2 4.11Å; R288-V290 PolarHBondContact O-N 3.17Å; R288-V290 VanDerWaalsContact O-N 3.16Å; R288-D293 WeakPolarHBondContact CD-OD2 3.49Å; R288-D293 IonicContact CZ-OD2 3.96Å; R288-D293 IonicContact NE-OD2 2.72Å; R288-D293 IonicContact NH1-OD1 2.82Å; R288-D293 IonicContact NH1-OD2 3.94Å; R288-D293 PolarHBondContact NH1-OD2 3.17Å |
| 289 | Q | 84.5 | Confident | 84 | Confident | 61 Ų | 61 | 53.3 Ų | 53.3 | 29% | 0.285 | 28% | 0.277 | S | S | . | . | trans | 52.4 | 34 | -178.1 | -57.2 | -72.6 | -70.1 | 0 | 0 | 112.2 | H279 V280 G281 S284 N286 | H279-Q289 CarbonylContact C-O 3.56Å; H279-Q289 WeakPolarHBondContact CA-O 3.48Å; V280-Q289 PolarHBondContact N-O 2.98Å; G281-Q289 PolarHBondContact N-O 3.47Å; G281-Q289 PolarHBondContact O-OE1 2.95Å; S284-Q289 PolarHBondContact O-NE2 3.01Å; S284-Q289 PolarHBondContact O-OE1 3.03Å; N286-Q289 PolarHBondContact O-N 3.42Å; N286-Q289 PolarHBondContact O-NE2 2.9Å; N286-Q289 WeakPolarHBondContact OD1-CA 3.35Å; N286-Q289 PolarHBondContact OD1-N 3.15Å | ||
| 290 | V | 87.9 | Confident | 84.3 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 25% | 0.249 | C | C | . | . | B | Isolated β-bridge | trans | -94.5 | 160.6 | 175.2 | -65.6 | 0 | 0 | 0 | 0 | 110.3 | I278 S284 N286 R288 E292 D293 | I278-V290 CarbonylContact O-C 3.59Å; I278-V290 WeakPolarHBondContact O-CA 3.37Å; I278-V290 WeakPolarHBondContact O-CB 3.28Å; S284-V290 WeakPolarHBondContact CB-O 3.36Å; S284-V290 PolarHBondContact OG-O 3.3Å; N286-V290 PolarHBondContact ND2-O 3.49Å; N286-V290 PolarHBondContact OD1-N 3.38Å; R288-V290 HydrophobicContact CB-CG1 4.16Å; R288-V290 HydrophobicContact CB-CG2 4.11Å; R288-V290 PolarHBondContact O-N 3.17Å; R288-V290 VanDerWaalsContact O-N 3.16Å; V290-E292 VanDerWaalsContact C-N 3.29Å; V290-E292 PolarHBondContact O-N 3.06Å; V290-D293 HydrophobicContact CG2-CB 3.96Å |
| 291 | L | 84.4 | Confident | 84.8 | Confident | 43 Ų | 43 | 46.4 Ų | 46.4 | 23% | 0.225 | 24% | 0.244 | C | C | . | . | S | Bend | trans | -61.6 | -39.8 | -176.8 | -173.1 | 61.6 | 0 | 0 | 0 | 112.1 | F92 M275 I278 V280 | F92-L291 HydrophobicContact CE2-CD1 3.95Å; F92-L291 HydrophobicContact CE2-CD2 4.39Å; F92-L291 HydrophobicContact CE2-CG 3.86Å; F92-L291 HydrophobicContact CZ-CD1 4.44Å; F92-L291 HydrophobicContact CZ-CD2 4.5Å; F92-L291 HydrophobicContact CZ-CG 4.42Å; M275-L291 HydrophobicContact CB-CB 4.41Å; M275-L291 HydrophobicContact CB-CD2 4.48Å; M275-L291 HydrophobicContact CE-CD2 4.27Å; M275-L291 HydrophobicContact CG-CD2 3.95Å; M275-L291 HydrophobicContact SD-CD2 4.46Å; I278-L291 PolarHBondContact O-N 3.16Å; V280-L291 HydrophobicContact CG1-CB 3.89Å; V280-L291 HydrophobicContact CG1-CD1 4Å; V280-L291 HydrophobicContact CG1-CG 4.44Å; V280-L291 HydrophobicContact CG2-CB 4.44Å; V280-L291 HydrophobicContact CG2-CD1 4.41Å |
| 292 | E | 88.4 | Confident | 85.3 | Confident | 2 Ų | 2 | 47.9 Ų | 47.9 | 1% | 0.009 | 26% | 0.259 | C | S | . | . | trans | -151.1 | 125.6 | 171.2 | -173.1 | 76.5 | 172.2 | 0 | 0 | 110.6 | H90 P91 F92 V93 L272 M275 Y276 V290 | H90-E292 WeakPolarHBondContact CA-OE1 3.5Å; H90-E292 WeakPolarHBondContact CB-OE1 3.3Å; H90-E292 IonicContact ND1-OE1 3.2Å; P91-E292 VanDerWaalsContact CD-OE2 3.26Å; P91-E292 WeakPolarHBondContact CD-OE2 3.35Å; P91-E292 WeakPolarHBondContact CG-OE2 3.35Å; F92-E292 HydrophobicContact CB-CB 4.23Å; F92-E292 HydrophobicContact CB-CG 3.9Å; F92-E292 HydrophobicContact CD2-CB 4.04Å; F92-E292 HydrophobicContact CD2-CG 4.44Å; F92-E292 PolarHBondContact N-OE1 3.17Å; V93-E292 WeakPolarHBondContact CB-OE1 3.38Å; V93-E292 HydrophobicContact CG2-CG 4.19Å; V93-E292 WeakPolarHBondContact CG2-OE1 3.4Å; V93-E292 PolarHBondContact N-OE1 3.33Å; L272-E292 HydrophobicContact CD2-CB 4.37Å; L272-E292 HydrophobicContact CD2-CG 3.93Å; M275-E292 HydrophobicContact CB-CB 4.16Å; M275-E292 PolarHBondContact O-N 3.24Å; Y276-E292 WeakPolarHBondContact CA-O 3.47Å; V290-E292 VanDerWaalsContact C-N 3.29Å; V290-E292 PolarHBondContact O-N 3.06Å | ||
| 293 | D | 90.1 | Very high | 86.2 | Confident | 9 Ų | 9 | 47.5 Ų | 47.5 | 5% | 0.048 | 25% | 0.247 | C | C | . | . | trans | -100.8 | 85.8 | 167.8 | -162.3 | -28.7 | 0 | 0 | 0 | 111 | H90 Y276 R288 V290 L295 D296 A297 | H90-D293 PolarHBondContact CE1-O 2.64Å; H90-D293 PolarHBondContact ND1-O 3.28Å; Y276-D293 WeakPolarHBondContact CE2-OD1 3.42Å; R288-D293 WeakPolarHBondContact CD-OD2 3.49Å; R288-D293 IonicContact CZ-OD2 3.96Å; R288-D293 IonicContact NE-OD2 2.72Å; R288-D293 IonicContact NH1-OD1 2.82Å; R288-D293 IonicContact NH1-OD2 3.94Å; R288-D293 PolarHBondContact NH1-OD2 3.17Å; V290-D293 HydrophobicContact CG2-CB 3.96Å; D293-L295 PolarHBondContact O-N 3.35Å; D293-L295 PolarHBondContact OD1-N 3.05Å; D293-L295 VanDerWaalsContact OD1-N 3.16Å; D293-D296 HydrophobicContact CB-CB 3.92Å; D293-D296 PolarHBondContact O-N 2.97Å; D293-D296 PolarHBondContact OD1-N 2.96Å; D293-A297 PolarHBondContact O-N 2.88Å | ||
| 294 | A | 90.3 | Very high | 87.2 | Confident | 16 Ų | 16 | 44.5 Ų | 44.5 | 13% | 0.132 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -64.1 | -28.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | V93 L272 A297 F298 | V93-A294 HydrophobicContact CG2-CB 3.71Å; L272-A294 HydrophobicContact CD1-CB 4.34Å; A294-A297 WeakPolarHBondContact O-CB 3.17Å; A294-F298 WeakPolarHBondContact O-CD2 3.33Å; A294-F298 PolarHBondContact O-N 3.16Å |
| 295 | L | 90.4 | Very high | 88 | Confident | 92 Ų | 92 | 48.6 Ų | 48.6 | 48% | 0.482 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -70.6 | -41.8 | 178.6 | -64.5 | -179.2 | 0 | 0 | 0 | 110.6 | C80 Y276 D293 A297 F298 C299 | C80-L295 VanDerWaalsContact SG-C 3.54Å; C80-L295 PolarHBondContact SG-O 3Å; Y276-L295 HydrophobicContact CE2-CB 4.41Å; Y276-L295 HydrophobicContact CE2-CD1 3.83Å; Y276-L295 HydrophobicContact CE2-CG 4.09Å; D293-L295 PolarHBondContact O-N 3.35Å; D293-L295 PolarHBondContact OD1-N 3.05Å; D293-L295 VanDerWaalsContact OD1-N 3.16Å; L295-A297 VanDerWaalsContact C-N 3.29Å; L295-A297 PolarHBondContact O-N 3.31Å; L295-F298 PolarHBondContact O-N 2.99Å; L295-F298 VanDerWaalsContact O-N 3.15Å; L295-C299 PolarHBondContact O-N 3.45Å; L295-C299 VanDerWaalsContact O-N 3.09Å |
| 296 | D | 90.3 | Very high | 88.9 | Confident | 1 Ų | 1 | 48 Ų | 48 | 1% | 0.005 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -59.2 | -42.3 | 175.9 | -158 | 81.5 | 0 | 0 | 0 | 111.6 | G79 C80 H86 H90 D293 F298 C299 Q300 | G79-D296 WeakPolarHBondContact CA-OD1 3.41Å; G79-D296 WeakPolarHBondContact CA-OD2 3.15Å; C80-D296 PolarHBondContact N-OD1 3.32Å; H86-D296 IonicContact CE1-OD1 2.79Å; H86-D296 IonicContact CE1-OD2 4Å; H86-D296 PolarHBondContact CE1-OD2 3.01Å; H86-D296 IonicContact NE2-OD2 3.79Å; H86-D296 PolarHBondContact NE2-OD2 2.94Å; H90-D296 IonicContact NE2-OD2 3.74Å; D293-D296 HydrophobicContact CB-CB 3.92Å; D293-D296 PolarHBondContact O-N 2.97Å; D293-D296 PolarHBondContact OD1-N 2.96Å; D296-F298 VanDerWaalsContact C-N 3.31Å; D296-F298 PolarHBondContact O-N 3.41Å; D296-C299 WeakPolarHBondContact O-CB 3.18Å; D296-C299 PolarHBondContact O-N 2.88Å; D296-Q300 WeakPolarHBondContact O-CG 3.5Å; D296-Q300 PolarHBondContact O-N 3.25Å; D296-Q300 PolarHBondContact OD2-NE2 2.98Å |
| 297 | A | 90.8 | Very high | 89.5 | Confident | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -54.5 | -45.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | F88 H90 V93 D293 A294 L295 Q300 I301 | F88-A297 HydrophobicContact CE2-CB 4.18Å; F88-A297 HydrophobicContact CZ-CB 4.49Å; H90-A297 HydrophobicContact CB-CB 4.01Å; H90-A297 PolarHBondContact NE2-N 3.31Å; V93-A297 HydrophobicContact CB-CB 4.48Å; V93-A297 HydrophobicContact CG1-CB 4.21Å; V93-A297 HydrophobicContact CG2-CB 4.09Å; D293-A297 PolarHBondContact O-N 2.88Å; A294-A297 WeakPolarHBondContact O-CB 3.17Å; L295-A297 VanDerWaalsContact C-N 3.29Å; L295-A297 PolarHBondContact O-N 3.31Å; A297-Q300 PolarHBondContact O-N 3.25Å; A297-I301 WeakPolarHBondContact O-CD1 3.22Å; A297-I301 WeakPolarHBondContact O-CG1 3.4Å; A297-I301 PolarHBondContact O-N 3Å |
| 298 | F | 92.5 | Very high | 90.1 | Very high | 133 Ų | 133 | 49.1 Ų | 49.1 | 58% | 0.583 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -66.9 | -36.3 | 177.8 | -69 | -62 | 0 | 0 | 0 | 112.8 | A294 L295 D296 I301 G302 | A294-F298 WeakPolarHBondContact O-CD2 3.33Å; A294-F298 PolarHBondContact O-N 3.16Å; L295-F298 PolarHBondContact O-N 2.99Å; L295-F298 VanDerWaalsContact O-N 3.15Å; D296-F298 VanDerWaalsContact C-N 3.31Å; D296-F298 PolarHBondContact O-N 3.41Å; F298-I301 HydrophobicContact CD1-CD1 4.43Å; F298-G302 PolarHBondContact O-N 3.32Å; F298-G302 VanDerWaalsContact O-N 3.08Å |
| 299 | C | 91.9 | Very high | 90.7 | Very high | 40 Ų | 40 | 50.3 Ų | 50.3 | 27% | 0.27 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -63.7 | -47.4 | 172.5 | -76.5 | 0 | 0 | 0 | 0 | 111.5 | C80 L295 D296 I301 G302 Y303 | C80-C299 WeakPolarHBondContact CA-SG 3.33Å; C80-C299 HydrophobicContact CB-CB 3.97Å; C80-C299 WeakPolarHBondContact CB-SG 3.42Å; C80-C299 WeakPolarHBondContact SG-CB 3.17Å; C80-C299 CovalentContact SG-SG 2.03Å; C80-C299 PolarHBondContact SG-SG 2.77Å; L295-C299 PolarHBondContact O-N 3.45Å; L295-C299 VanDerWaalsContact O-N 3.09Å; D296-C299 WeakPolarHBondContact O-CB 3.18Å; D296-C299 PolarHBondContact O-N 2.88Å; C299-I301 VanDerWaalsContact C-N 3.3Å; C299-I301 PolarHBondContact O-N 3.39Å; C299-G302 WeakPolarHBondContact O-CA 3.43Å; C299-G302 PolarHBondContact O-N 3.43Å; C299-Y303 HydrophobicContact CB-CE2 4.5Å; C299-Y303 WeakPolarHBondContact O-CD2 3.29Å; C299-Y303 PolarHBondContact O-N 3.39Å |
| 300 | Q | 90.8 | Very high | 91.1 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -58.6 | -42.5 | 178.6 | -71.6 | -171 | -8.1 | 0 | 0 | 111.7 | A77 H86 F88 D296 A297 G302 Y303 K304 I307 | A77-Q300 HydrophobicContact CB-CB 3.93Å; A77-Q300 HydrophobicContact CB-CG 4.09Å; H86-Q300 PolarHBondContact CD2-NE2 2.67Å; H86-Q300 VanDerWaalsContact CD2-NE2 3.27Å; H86-Q300 PolarHBondContact CE1-NE2 3.07Å; H86-Q300 PolarHBondContact NE2-NE2 3.38Å; F88-Q300 HydrophobicContact CD2-CB 4.24Å; D296-Q300 WeakPolarHBondContact O-CG 3.5Å; D296-Q300 PolarHBondContact O-N 3.25Å; D296-Q300 PolarHBondContact OD2-NE2 2.98Å; A297-Q300 PolarHBondContact O-N 3.25Å; Q300-G302 VanDerWaalsContact C-N 3.31Å; Q300-G302 PolarHBondContact O-N 3.14Å; Q300-Y303 PolarHBondContact O-N 3.23Å; Q300-K304 PolarHBondContact O-N 3.25Å; Q300-I307 HydrophobicContact CB-CD1 4.33Å |
| 301 | I | 92.9 | Very high | 91.3 | Very high | 25 Ų | 25 | 48.6 Ų | 48.6 | 13% | 0.128 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -59.6 | -42 | 173.7 | -69.7 | 163.3 | 0 | 0 | 0 | 111.4 | F88 A297 F298 C299 K304 I307 L308 L311 | F88-I301 HydrophobicContact CE2-CD1 4.47Å; F88-I301 HydrophobicContact CE2-CG1 4.19Å; A297-I301 WeakPolarHBondContact O-CD1 3.22Å; A297-I301 WeakPolarHBondContact O-CG1 3.4Å; A297-I301 PolarHBondContact O-N 3Å; F298-I301 HydrophobicContact CD1-CD1 4.43Å; C299-I301 VanDerWaalsContact C-N 3.3Å; C299-I301 PolarHBondContact O-N 3.39Å; I301-K304 CarbonylContact O-C 3.51Å; I301-K304 VanDerWaalsContact O-C 3.31Å; I301-K304 PolarHBondContact O-N 3.44Å; I301-I307 HydrophobicContact CG1-CB 4.37Å; I301-I307 HydrophobicContact CG1-CG2 3.86Å; I301-L308 HydrophobicContact CG2-CB 3.95Å; I301-L308 HydrophobicContact CG2-CD1 4.37Å; I301-L311 HydrophobicContact CD1-CD1 3.55Å; I301-L311 HydrophobicContact CG1-CD1 4.02Å |
| 302 | G | 91.1 | Very high | 91.8 | Very high | 63 Ų | 63 | 51 Ų | 51 | 65% | 0.649 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -64.2 | -39.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | F298 C299 Q300 | F298-G302 PolarHBondContact O-N 3.32Å; F298-G302 VanDerWaalsContact O-N 3.08Å; C299-G302 WeakPolarHBondContact O-CA 3.43Å; C299-G302 PolarHBondContact O-N 3.43Å; Q300-G302 VanDerWaalsContact C-N 3.31Å; Q300-G302 PolarHBondContact O-N 3.14Å |
| 303 | Y | 91.4 | Very high | 92 | Very high | 150 Ų | 150 | 52.1 Ų | 52.1 | 59% | 0.588 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -74.5 | -35.3 | 177.4 | -74.6 | -67.4 | 0 | 0 | 0 | 113.1 | K78 C299 Q300 | K78-Y303 HydrophobicContact CB-CD2 4.04Å; K78-Y303 HydrophobicContact CB-CE2 4.18Å; K78-Y303 HydrophobicContact CB-CG 4.38Å; K78-Y303 WeakPolarHBondContact O-CD2 3.26Å; C299-Y303 HydrophobicContact CB-CE2 4.5Å; C299-Y303 WeakPolarHBondContact O-CD2 3.29Å; C299-Y303 PolarHBondContact O-N 3.39Å; Q300-Y303 PolarHBondContact O-N 3.23Å |
| 304 | K | 92.5 | Very high | 92.1 | Very high | 63 Ų | 63 | 52 Ų | 52 | 27% | 0.274 | 29% | 0.288 | S | S | . | . | trans | -130.4 | 86.5 | -176.8 | -167.9 | 169.5 | -179 | 173.1 | 0 | 110.3 | F75 S76 A77 Q300 I301 L306 I307 | F75-K304 HydrophobicContact CB-CD 4.44Å; F75-K304 HydrophobicContact CD1-CD 4.3Å; S76-K304 WeakPolarHBondContact O-CD 2.98Å; S76-K304 PolarHBondContact O-NZ 2.81Å; A77-K304 HydrophobicContact CB-CB 4.06Å; A77-K304 HydrophobicContact CB-CD 4.45Å; Q300-K304 PolarHBondContact O-N 3.25Å; I301-K304 CarbonylContact O-C 3.51Å; I301-K304 VanDerWaalsContact O-C 3.31Å; I301-K304 PolarHBondContact O-N 3.44Å; K304-L306 HydrophobicContact CG-CB 4.45Å; K304-L306 PolarHBondContact O-N 2.79Å; K304-I307 HydrophobicContact CB-CD1 4.02Å; K304-I307 HydrophobicContact CB-CG1 4.27Å; K304-I307 HydrophobicContact CD-CD1 4.44Å; K304-I307 HydrophobicContact CD-CG1 4.49Å; K304-I307 HydrophobicContact CG-CD1 4.46Å; K304-I307 HydrophobicContact CG-CG1 4.31Å; K304-I307 WeakPolarHBondContact O-CB 3.49Å; K304-I307 WeakPolarHBondContact O-CG1 3.44Å; K304-I307 PolarHBondContact O-N 2.83Å | ||
| 305 | P | 91.4 | Very high | 92.2 | Very high | 91 Ų | 91 | 52.4 Ų | 52.4 | 59% | 0.591 | 29% | 0.288 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66 | -11 | -174.6 | 26.7 | -35.8 | 0 | 0 | 0 | 114 | I307 L308 L309 | P305-I307 PolarHBondContact O-N 3.22Å; P305-L308 VanDerWaalsContact O-CB 3.3Å; P305-L308 WeakPolarHBondContact O-CB 3.43Å; P305-L308 PolarHBondContact O-N 3.08Å; P305-L308 VanDerWaalsContact O-N 3.11Å; P305-L309 PolarHBondContact O-N 3Å |
| 306 | L | 93.1 | Very high | 92.5 | Very high | 89 Ų | 89 | 51.9 Ų | 51.9 | 47% | 0.466 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -61.4 | -28.7 | 169.5 | -70.6 | 173.4 | 0 | 0 | 0 | 112.5 | F75 K304 L308 L309 A310 | F75-L306 HydrophobicContact CE1-CB 4.37Å; F75-L306 HydrophobicContact CE2-CB 4.39Å; F75-L306 HydrophobicContact CZ-CB 3.96Å; K304-L306 HydrophobicContact CG-CB 4.45Å; K304-L306 PolarHBondContact O-N 2.79Å; L306-L308 VanDerWaalsContact C-N 3.31Å; L306-L309 WeakPolarHBondContact O-CB 3.08Å; L306-L309 PolarHBondContact O-N 2.86Å; L306-A310 PolarHBondContact O-N 2.83Å; L306-A310 VanDerWaalsContact O-N 3.16Å |
| 307 | I | 93 | Very high | 92.7 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -62.3 | -42.8 | 173.1 | -60.3 | 174.1 | 0 | 0 | 0 | 109.6 | F75 A77 F88 Q300 I301 K304 P305 L309 A310 L311 | F75-I307 HydrophobicContact CB-CD1 4.01Å; F75-I307 HydrophobicContact CB-CG1 3.69Å; F75-I307 HydrophobicContact CD2-CG1 3.77Å; F75-I307 HydrophobicContact CG-CG1 3.93Å; A77-I307 HydrophobicContact CB-CD1 4.1Å; F88-I307 HydrophobicContact CD1-CG2 4.39Å; F88-I307 HydrophobicContact CD2-CD1 3.98Å; F88-I307 HydrophobicContact CD2-CG2 3.68Å; F88-I307 HydrophobicContact CE1-CG2 4.3Å; F88-I307 HydrophobicContact CE2-CG2 3.62Å; F88-I307 HydrophobicContact CG-CD1 4.49Å; F88-I307 HydrophobicContact CG-CG2 4.13Å; F88-I307 HydrophobicContact CZ-CG2 3.95Å; Q300-I307 HydrophobicContact CB-CD1 4.33Å; I301-I307 HydrophobicContact CG1-CB 4.37Å; I301-I307 HydrophobicContact CG1-CG2 3.86Å; K304-I307 HydrophobicContact CB-CD1 4.02Å; K304-I307 HydrophobicContact CB-CG1 4.27Å; K304-I307 HydrophobicContact CD-CD1 4.44Å; K304-I307 HydrophobicContact CD-CG1 4.49Å; K304-I307 HydrophobicContact CG-CD1 4.46Å; K304-I307 HydrophobicContact CG-CG1 4.31Å; K304-I307 WeakPolarHBondContact O-CB 3.49Å; K304-I307 WeakPolarHBondContact O-CG1 3.44Å; K304-I307 PolarHBondContact O-N 2.83Å; P305-I307 PolarHBondContact O-N 3.22Å; I307-L309 VanDerWaalsContact C-N 3.28Å; I307-L309 PolarHBondContact O-N 2.79Å; I307-A310 PolarHBondContact O-N 3.35Å; I307-A310 VanDerWaalsContact O-N 3.14Å; I307-L311 HydrophobicContact CG2-CD1 3.99Å; I307-L311 HydrophobicContact CG2-CG 4.23Å; I307-L311 WeakPolarHBondContact O-CG 3.47Å; I307-L311 PolarHBondContact O-N 3.38Å |
| 308 | L | 92.9 | Very high | 92.9 | Very high | 79 Ų | 79 | 52.2 Ų | 52.2 | 41% | 0.414 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -59 | -40.2 | 176.4 | -176.1 | 60.7 | 0 | 0 | 0 | 111.9 | I301 P305 L306 L311 L312 | I301-L308 HydrophobicContact CG2-CB 3.95Å; I301-L308 HydrophobicContact CG2-CD1 4.37Å; P305-L308 VanDerWaalsContact O-CB 3.3Å; P305-L308 WeakPolarHBondContact O-CB 3.43Å; P305-L308 PolarHBondContact O-N 3.08Å; P305-L308 VanDerWaalsContact O-N 3.11Å; L306-L308 VanDerWaalsContact C-N 3.31Å; L308-L311 PolarHBondContact O-N 2.79Å; L308-L312 HydrophobicContact CD1-CD1 4.35Å; L308-L312 HydrophobicContact CD1-CG 4.16Å; L308-L312 HydrophobicContact CG-CD1 3.99Å; L308-L312 HydrophobicContact CG-CG 4.25Å; L308-L312 WeakPolarHBondContact O-CB 3.48Å; L308-L312 VanDerWaalsContact O-CG 3.26Å; L308-L312 WeakPolarHBondContact O-CG 3.43Å; L308-L312 PolarHBondContact O-N 3.45Å |
| 309 | L | 93.4 | Very high | 93 | Very high | 100 Ų | 100 | 46.5 Ų | 46.5 | 52% | 0.524 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -63 | -42.9 | 177.2 | -179.3 | 62.5 | 0 | 0 | 0 | 111.6 | W71 P305 L306 I307 L312 G313 | W71-L309 HydrophobicContact CH2-CD2 4.41Å; P305-L309 PolarHBondContact O-N 3Å; L306-L309 WeakPolarHBondContact O-CB 3.08Å; L306-L309 PolarHBondContact O-N 2.86Å; I307-L309 VanDerWaalsContact C-N 3.28Å; I307-L309 PolarHBondContact O-N 2.79Å; L309-L312 PolarHBondContact O-N 3.19Å; L309-G313 PolarHBondContact O-N 3.2Å |
| 310 | A | 93 | Very high | 93.2 | Very high | 1 Ų | 1 | 49.5 Ų | 49.5 | 1% | 0.008 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -63.2 | -44.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | W71 A72 F75 L306 I307 G313 N314 | W71-A310 HydrophobicContact CD2-CB 4.3Å; W71-A310 HydrophobicContact CE3-CB 3.67Å; W71-A310 HydrophobicContact CZ3-CB 4.17Å; A72-A310 HydrophobicContact CB-CB 3.91Å; F75-A310 HydrophobicContact CE2-CB 4.25Å; L306-A310 PolarHBondContact O-N 2.83Å; L306-A310 VanDerWaalsContact O-N 3.16Å; I307-A310 PolarHBondContact O-N 3.35Å; I307-A310 VanDerWaalsContact O-N 3.14Å; A310-G313 PolarHBondContact O-N 3.47Å; A310-N314 WeakPolarHBondContact O-CB 3.31Å; A310-N314 PolarHBondContact O-N 2.97Å |
| 311 | L | 93.3 | Very high | 93.4 | Very high | 23 Ų | 23 | 50.3 Ų | 50.3 | 12% | 0.12 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64.3 | -41.5 | 176.9 | -66.4 | 177 | 0 | 0 | 0 | 112.5 | A72 F88 Q94 I301 I307 L308 N314 T315 | A72-L311 HydrophobicContact CB-CD2 4.19Å; F88-L311 HydrophobicContact CE1-CD2 4.09Å; F88-L311 HydrophobicContact CZ-CD1 3.95Å; F88-L311 HydrophobicContact CZ-CD2 4.25Å; Q94-L311 HydrophobicContact CG-CD2 3.79Å; I301-L311 HydrophobicContact CD1-CD1 3.55Å; I301-L311 HydrophobicContact CG1-CD1 4.02Å; I307-L311 HydrophobicContact CG2-CD1 3.99Å; I307-L311 HydrophobicContact CG2-CG 4.23Å; I307-L311 WeakPolarHBondContact O-CG 3.47Å; I307-L311 PolarHBondContact O-N 3.38Å; L308-L311 PolarHBondContact O-N 2.79Å; L311-N314 WeakPolarHBondContact O-CB 3.32Å; L311-N314 PolarHBondContact O-N 3.24Å; L311-T315 WeakPolarHBondContact O-CB 3.35Å; L311-T315 PolarHBondContact O-N 3.4Å; L311-T315 PolarHBondContact O-OG1 2.9Å |
| 312 | L | 93.3 | Very high | 93.4 | Very high | 93 Ų | 93 | 50 Ų | 50 | 49% | 0.487 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -65.9 | -42.6 | 175.6 | -73.8 | 174.9 | 0 | 0 | 0 | 111.8 | L308 L309 N314 T315 V316 | L308-L312 HydrophobicContact CD1-CD1 4.35Å; L308-L312 HydrophobicContact CD1-CG 4.16Å; L308-L312 HydrophobicContact CG-CD1 3.99Å; L308-L312 HydrophobicContact CG-CG 4.25Å; L308-L312 WeakPolarHBondContact O-CB 3.48Å; L308-L312 VanDerWaalsContact O-CG 3.26Å; L308-L312 WeakPolarHBondContact O-CG 3.43Å; L308-L312 PolarHBondContact O-N 3.45Å; L309-L312 PolarHBondContact O-N 3.19Å; L312-N314 VanDerWaalsContact C-N 3.27Å; L312-N314 PolarHBondContact O-N 3.1Å; L312-T315 PolarHBondContact O-N 3.13Å; L312-V316 WeakPolarHBondContact O-CB 3.45Å; L312-V316 WeakPolarHBondContact O-CG2 3.38Å; L312-V316 PolarHBondContact O-N 3.35Å |
| 313 | G | 92.9 | Very high | 93.6 | Very high | 27 Ų | 27 | 49 Ų | 49 | 28% | 0.278 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -57.3 | -44.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | L309 A310 S317 | L309-G313 PolarHBondContact O-N 3.2Å; A310-G313 PolarHBondContact O-N 3.47Å; G313-S317 VanDerWaalsContact O-CB 3.24Å; G313-S317 WeakPolarHBondContact O-CB 3.49Å; G313-S317 PolarHBondContact O-N 3.31Å; G313-S317 PolarHBondContact O-OG 3.03Å |
| 314 | N | 92.4 | Very high | 93.7 | Very high | 7 Ų | 7 | 41.9 Ų | 41.9 | 4% | 0.037 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.5 | -58.6 | 174 | -170.3 | 33.1 | 0 | 0 | 0 | 111.7 | N65 A310 L311 L312 V316 S317 I318 | N65-N314 PolarHBondContact O-OD1 2.84Å; N65-N314 PolarHBondContact OD1-OD1 2.94Å; A310-N314 WeakPolarHBondContact O-CB 3.31Å; A310-N314 PolarHBondContact O-N 2.97Å; L311-N314 WeakPolarHBondContact O-CB 3.32Å; L311-N314 PolarHBondContact O-N 3.24Å; L312-N314 VanDerWaalsContact C-N 3.27Å; L312-N314 PolarHBondContact O-N 3.1Å; N314-V316 PolarHBondContact O-N 3.25Å; N314-S317 PolarHBondContact O-N 3.13Å; N314-S317 VanDerWaalsContact O-N 3.16Å; N314-S317 PolarHBondContact O-OG 3.3Å; N314-I318 WeakPolarHBondContact O-CD1 3.48Å; N314-I318 VanDerWaalsContact O-CG1 3.3Å; N314-I318 WeakPolarHBondContact O-CG1 3.26Å; N314-I318 PolarHBondContact O-N 2.93Å; N314-I318 WeakPolarHBondContact OD1-CD1 3.48Å |
| 315 | T | 94 | Very high | 93.8 | Very high | 24 Ų | 24 | 38.9 Ų | 38.9 | 15% | 0.147 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -54.6 | -45.9 | -179 | -67.2 | 0 | 0 | 0 | 0 | 113.2 | G97 L311 L312 I318 A319 | G97-T315 WeakPolarHBondContact O-CG2 3.4Å; G97-T315 PolarHBondContact O-OG1 3.35Å; L311-T315 WeakPolarHBondContact O-CB 3.35Å; L311-T315 PolarHBondContact O-N 3.4Å; L311-T315 PolarHBondContact O-OG1 2.9Å; L312-T315 PolarHBondContact O-N 3.13Å; T315-I318 PolarHBondContact O-N 3.5Å; T315-A319 PolarHBondContact O-N 3.44Å |
| 316 | V | 95 | Very high | 93.8 | Very high | 81 Ų | 81 | 34.6 Ų | 34.6 | 49% | 0.491 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -67.2 | -44.2 | 179.5 | 172.7 | 0 | 0 | 0 | 0 | 111 | L312 N314 I318 A319 F320 | L312-V316 WeakPolarHBondContact O-CB 3.45Å; L312-V316 WeakPolarHBondContact O-CG2 3.38Å; L312-V316 PolarHBondContact O-N 3.35Å; N314-V316 PolarHBondContact O-N 3.25Å; V316-I318 VanDerWaalsContact C-N 3.29Å; V316-I318 PolarHBondContact O-N 3.49Å; V316-A319 WeakPolarHBondContact O-CB 3.31Å; V316-A319 PolarHBondContact O-N 3.35Å; V316-F320 HydrophobicContact CG1-CD2 4.06Å; V316-F320 HydrophobicContact CG1-CE2 3.77Å; V316-F320 VanDerWaalsContact O-CD2 3.28Å; V316-F320 WeakPolarHBondContact O-CD2 3.4Å; V316-F320 PolarHBondContact O-N 2.9Å |
| 317 | S | 95.2 | Very high | 93.8 | Very high | 7 Ų | 7 | 30.4 Ų | 30.4 | 5% | 0.049 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -64.1 | -34.5 | 179.9 | 69.5 | 0 | 0 | 0 | 0 | 112.7 | T61 N65 G313 N314 F320 F321 | T61-S317 WeakPolarHBondContact O-CB 3.38Å; N65-S317 WeakPolarHBondContact CA-OG 3.21Å; N65-S317 VanDerWaalsContact CB-OG 3.25Å; N65-S317 WeakPolarHBondContact CB-OG 3.26Å; N65-S317 PolarHBondContact N-OG 3.42Å; G313-S317 VanDerWaalsContact O-CB 3.24Å; G313-S317 WeakPolarHBondContact O-CB 3.49Å; G313-S317 PolarHBondContact O-N 3.31Å; G313-S317 PolarHBondContact O-OG 3.03Å; N314-S317 PolarHBondContact O-N 3.13Å; N314-S317 VanDerWaalsContact O-N 3.16Å; N314-S317 PolarHBondContact O-OG 3.3Å; S317-F320 PolarHBondContact O-N 3.19Å; S317-F321 VanDerWaalsContact O-CB 3.25Å; S317-F321 WeakPolarHBondContact O-CB 3.3Å; S317-F321 PolarHBondContact O-N 3.29Å |
| 318 | I | 94 | Very high | 93.7 | Very high | 1 Ų | 1 | 30.5 Ų | 30.5 | 1% | 0.005 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -62.7 | -42.4 | 175 | -74.3 | 161.2 | 0 | 0 | 0 | 111.6 | N65 M98 E102 N314 T315 V316 F320 F321 N322 | N65-I318 HydrophobicContact CB-CG1 4.17Å; N65-I318 VanDerWaalsContact CG-CG1 3.46Å; N65-I318 VanDerWaalsContact ND2-CG1 3.33Å; N65-I318 WeakPolarHBondContact ND2-CG1 3.36Å; M98-I318 HydrophobicContact CB-CD1 3.68Å; M98-I318 HydrophobicContact CB-CG2 4.36Å; M98-I318 HydrophobicContact CG-CD1 3.75Å; M98-I318 HydrophobicContact CG-CG1 4.29Å; M98-I318 HydrophobicContact CG-CG2 3.65Å; M98-I318 WeakPolarHBondContact O-CG2 3.47Å; E102-I318 HydrophobicContact CG-CG2 4Å; N314-I318 WeakPolarHBondContact O-CD1 3.48Å; N314-I318 VanDerWaalsContact O-CG1 3.3Å; N314-I318 WeakPolarHBondContact O-CG1 3.26Å; N314-I318 PolarHBondContact O-N 2.93Å; N314-I318 WeakPolarHBondContact OD1-CD1 3.48Å; T315-I318 PolarHBondContact O-N 3.5Å; V316-I318 VanDerWaalsContact C-N 3.29Å; V316-I318 PolarHBondContact O-N 3.49Å; I318-F320 VanDerWaalsContact C-N 3.34Å; I318-F320 PolarHBondContact O-N 3.48Å; I318-F321 PolarHBondContact O-N 3.01Å; I318-N322 WeakPolarHBondContact CG2-ND2 3.45Å; I318-N322 PolarHBondContact O-N 3.17Å; I318-N322 PolarHBondContact O-ND2 3.45Å |
| 319 | A | 95.3 | Very high | 93.6 | Very high | 12 Ų | 12 | 26.7 Ų | 26.7 | 10% | 0.099 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -57.2 | -48.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | G101 T315 V316 F323 | G101-A319 VanDerWaalsContact O-CB 3.3Å; G101-A319 WeakPolarHBondContact O-CB 3.47Å; T315-A319 PolarHBondContact O-N 3.44Å; V316-A319 WeakPolarHBondContact O-CB 3.31Å; V316-A319 PolarHBondContact O-N 3.35Å; A319-F323 VanDerWaalsContact O-CB 3.29Å; A319-F323 WeakPolarHBondContact O-CB 3.37Å; A319-F323 PolarHBondContact O-N 2.87Å |
| 320 | F | 95.9 | Very high | 93.4 | Very high | 104 Ų | 104 | 23.7 Ų | 23.7 | 46% | 0.456 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -68.7 | -39.4 | 177 | -71.6 | -75.5 | 0 | 0 | 0 | 113 | T61 V316 S317 I318 F323 A324 | T61-F320 HydrophobicContact CG2-CB 3.67Å; T61-F320 HydrophobicContact CG2-CG 4.43Å; V316-F320 HydrophobicContact CG1-CD2 4.06Å; V316-F320 HydrophobicContact CG1-CE2 3.77Å; V316-F320 VanDerWaalsContact O-CD2 3.28Å; V316-F320 WeakPolarHBondContact O-CD2 3.4Å; V316-F320 PolarHBondContact O-N 2.9Å; S317-F320 PolarHBondContact O-N 3.19Å; I318-F320 VanDerWaalsContact C-N 3.34Å; I318-F320 PolarHBondContact O-N 3.48Å; F320-F323 PolarHBondContact O-N 2.97Å; F320-A324 VanDerWaalsContact O-CB 3.23Å; F320-A324 WeakPolarHBondContact O-CB 3.4Å; F320-A324 PolarHBondContact O-N 3.37Å |
| 321 | F | 94.5 | Very high | 93 | Very high | 17 Ų | 17 | 26.6 Ų | 26.6 | 8% | 0.075 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -60.4 | -49.9 | 179.1 | 171.4 | -102.9 | 0 | 0 | 0 | 111.4 | M58 T61 S317 I318 A324 G325 D341 | M58-F321 HydrophobicContact CE-CE2 3.64Å; M58-F321 HydrophobicContact CE-CZ 3.9Å; M58-F321 HydrophobicContact CG-CD2 3.84Å; M58-F321 HydrophobicContact CG-CE2 3.72Å; M58-F321 WeakPolarHBondContact O-CD2 3.42Å; T61-F321 WeakPolarHBondContact OG1-CA 3.47Å; T61-F321 PolarHBondContact OG1-N 2.71Å; S317-F321 VanDerWaalsContact O-CB 3.25Å; S317-F321 WeakPolarHBondContact O-CB 3.3Å; S317-F321 PolarHBondContact O-N 3.29Å; I318-F321 PolarHBondContact O-N 3.01Å; F321-A324 PolarHBondContact O-N 3.44Å; F321-G325 PolarHBondContact O-N 3.43Å; F321-D341 WeakPolarHBondContact CZ-OD1 3.19Å |
| 322 | N | 93.5 | Very high | 92.6 | Very high | 18 Ų | 18 | 27.1 Ų | 27.1 | 10% | 0.096 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -70.9 | -38 | -179.9 | -79.9 | -55.5 | 0 | 0 | 0 | 112.3 | E102 V257 I318 G325 I326 R337 | E102-N322 HydrophobicContact CG-CB 4.22Å; E102-N322 WeakPolarHBondContact CG-ND2 3.34Å; E102-N322 PolarHBondContact OE1-ND2 2.85Å; V257-N322 HydrophobicContact CG1-CB 3.69Å; V257-N322 HydrophobicContact CG2-CB 4.17Å; V257-N322 WeakPolarHBondContact CG2-O 3.42Å; I318-N322 WeakPolarHBondContact CG2-ND2 3.45Å; I318-N322 PolarHBondContact O-N 3.17Å; I318-N322 PolarHBondContact O-ND2 3.45Å; N322-G325 PolarHBondContact O-N 2.97Å; N322-I326 PolarHBondContact O-N 3.03Å; N322-R337 PolarHBondContact OD1-NH2 2.96Å |
| 323 | F | 95.1 | Very high | 92.1 | Very high | 43 Ų | 43 | 23.1 Ų | 23.1 | 19% | 0.189 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -58.2 | -49.4 | 171.4 | 166.1 | -106.7 | 0 | 0 | 0 | 111.8 | P253 L254 A319 F320 G325 S327 | P253-F323 HydrophobicContact CB-CD2 3.99Å; P253-F323 HydrophobicContact CB-CE2 3.99Å; L254-F323 HydrophobicContact CD2-CB 4.3Å; L254-F323 HydrophobicContact CD2-CD2 3.41Å; L254-F323 VanDerWaalsContact CD2-CD2 3.41Å; L254-F323 HydrophobicContact CD2-CE2 3.93Å; L254-F323 HydrophobicContact CD2-CG 3.93Å; L254-F323 HydrophobicContact CG-CD2 3.63Å; L254-F323 HydrophobicContact CG-CE2 3.73Å; A319-F323 VanDerWaalsContact O-CB 3.29Å; A319-F323 WeakPolarHBondContact O-CB 3.37Å; A319-F323 PolarHBondContact O-N 2.87Å; F320-F323 PolarHBondContact O-N 2.97Å; F323-G325 VanDerWaalsContact C-N 3.33Å; F323-S327 VanDerWaalsContact O-CB 3.3Å; F323-S327 WeakPolarHBondContact O-CB 3.44Å; F323-S327 PolarHBondContact O-N 3.18Å; F323-S327 PolarHBondContact O-OG 3.08Å |
| 324 | A | 94.9 | Very high | 91.7 | Very high | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -64.3 | -39.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | L57 M58 F320 F321 S327 V328 | L57-A324 HydrophobicContact CB-CB 4.31Å; L57-A324 HydrophobicContact CD2-CB 4.04Å; L57-A324 HydrophobicContact CG-CB 4.07Å; M58-A324 HydrophobicContact CB-CB 3.83Å; F320-A324 VanDerWaalsContact O-CB 3.23Å; F320-A324 WeakPolarHBondContact O-CB 3.4Å; F320-A324 PolarHBondContact O-N 3.37Å; F321-A324 PolarHBondContact O-N 3.44Å; A324-S327 CarbonylContact O-C 3.5Å; A324-S327 WeakPolarHBondContact O-CB 3.46Å; A324-S327 PolarHBondContact O-N 3.47Å; A324-V328 WeakPolarHBondContact O-CG2 3.39Å; A324-V328 PolarHBondContact O-N 3.09Å |
| 325 | G | 92.9 | Very high | 91 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -59 | -54.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | F321 N322 F323 S327 V328 T329 R337 | F321-G325 PolarHBondContact O-N 3.43Å; N322-G325 PolarHBondContact O-N 2.97Å; F323-G325 VanDerWaalsContact C-N 3.33Å; G325-S327 VanDerWaalsContact C-N 3.26Å; G325-S327 PolarHBondContact O-N 3.37Å; G325-V328 PolarHBondContact O-N 2.99Å; G325-T329 PolarHBondContact O-N 3.18Å; G325-T329 PolarHBondContact O-OG1 2.98Å; G325-R337 WeakPolarHBondContact O-CD 3.43Å |
| 326 | I | 92.8 | Very high | 90.4 | Very high | 0 Ų | 0 | 21.2 Ų | 21.2 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -62.3 | -37.2 | 176.1 | -65.2 | -68.4 | 0 | 0 | 0 | 111.1 | E242 V246 P253 A256 V257 N322 T329 K330 | E242-I326 HydrophobicContact CB-CD1 4.28Å; E242-I326 HydrophobicContact CG-CD1 4.26Å; E242-I326 WeakPolarHBondContact OE2-CD1 3.5Å; V246-I326 HydrophobicContact CG1-CG2 4.48Å; V246-I326 HydrophobicContact CG2-CG2 4.04Å; P253-I326 HydrophobicContact CB-CB 4.27Å; P253-I326 HydrophobicContact CB-CG2 3.82Å; P253-I326 HydrophobicContact CG-CG2 4.31Å; A256-I326 HydrophobicContact CB-CG2 4.38Å; V257-I326 HydrophobicContact CG2-CB 4.11Å; V257-I326 HydrophobicContact CG2-CG1 3.52Å; N322-I326 PolarHBondContact O-N 3.03Å; I326-T329 WeakPolarHBondContact O-CB 3.21Å; I326-T329 PolarHBondContact O-N 3.42Å; I326-K330 WeakPolarHBondContact O-CB 3.39Å; I326-K330 PolarHBondContact O-N 2.88Å |
| 327 | S | 92.6 | Very high | 90.1 | Very high | 2 Ų | 2 | 17.6 Ų | 17.6 | 1% | 0.014 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -63.9 | -41.7 | 176.1 | -57.8 | 0 | 0 | 0 | 0 | 111.8 | P253 F323 A324 G325 K330 E331 | P253-S327 WeakPolarHBondContact CB-OG 3.1Å; F323-S327 VanDerWaalsContact O-CB 3.3Å; F323-S327 WeakPolarHBondContact O-CB 3.44Å; F323-S327 PolarHBondContact O-N 3.18Å; F323-S327 PolarHBondContact O-OG 3.08Å; A324-S327 CarbonylContact O-C 3.5Å; A324-S327 WeakPolarHBondContact O-CB 3.46Å; A324-S327 PolarHBondContact O-N 3.47Å; G325-S327 VanDerWaalsContact C-N 3.26Å; G325-S327 PolarHBondContact O-N 3.37Å; S327-K330 PolarHBondContact O-N 2.96Å; S327-E331 VanDerWaalsContact O-CB 3.28Å; S327-E331 WeakPolarHBondContact O-CB 3.46Å; S327-E331 VanDerWaalsContact O-CG 3.25Å; S327-E331 WeakPolarHBondContact O-CG 3.3Å; S327-E331 PolarHBondContact O-N 3.27Å |
| 328 | V | 91.8 | Very high | 89.7 | Confident | 1 Ų | 1 | 17.4 Ų | 17.4 | 1% | 0.006 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -63.5 | -41.2 | 173 | 169.4 | 0 | 0 | 0 | 0 | 111.1 | L54 A324 G325 K330 E331 I332 S333 T336 R337 L340 | L54-V328 HydrophobicContact CB-CG2 3.91Å; A324-V328 WeakPolarHBondContact O-CG2 3.39Å; A324-V328 PolarHBondContact O-N 3.09Å; G325-V328 PolarHBondContact O-N 2.99Å; V328-K330 VanDerWaalsContact C-N 3.3Å; V328-K330 PolarHBondContact O-N 3.1Å; V328-E331 PolarHBondContact O-N 2.99Å; V328-I332 HydrophobicContact CG1-CD1 4.41Å; V328-I332 WeakPolarHBondContact O-CA 3.33Å; V328-I332 WeakPolarHBondContact O-CB 3.5Å; V328-I332 PolarHBondContact O-N 2.97Å; V328-S333 PolarHBondContact O-N 3.38Å; V328-T336 HydrophobicContact CG1-CG2 4.12Å; V328-R337 HydrophobicContact CG1-CB 4.26Å; V328-L340 HydrophobicContact CG1-CD1 3.95Å; V328-L340 HydrophobicContact CG2-CD1 3.97Å |
| 329 | T | 89.9 | Confident | 89 | Confident | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -59.3 | -43.4 | 175.7 | -64 | 0 | 0 | 0 | 0 | 111.6 | E243 Y247 G325 I326 S333 A334 R337 | E243-T329 HydrophobicContact CB-CG2 3.74Å; E243-T329 HydrophobicContact CG-CG2 3.73Å; Y247-T329 WeakPolarHBondContact CE2-O 3.47Å; Y247-T329 PolarHBondContact OH-O 3.43Å; G325-T329 PolarHBondContact O-N 3.18Å; G325-T329 PolarHBondContact O-OG1 2.98Å; I326-T329 WeakPolarHBondContact O-CB 3.21Å; I326-T329 PolarHBondContact O-N 3.42Å; T329-S333 WeakPolarHBondContact O-CA 3.45Å; T329-S333 PolarHBondContact O-N 3.28Å; T329-A334 HydrophobicContact CG2-CB 3.96Å; T329-R337 WeakPolarHBondContact OG1-CD 3.41Å |
| 330 | K | 88.4 | Confident | 88.6 | Confident | 36 Ų | 36 | 17.3 Ų | 17.3 | 16% | 0.157 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -71.3 | -38 | 179.4 | -170.2 | 173.9 | -176.5 | 170.7 | 0 | 113.3 | V246 Y247 D250 V251 P253 I326 S327 V328 R407 | V246-K330 HydrophobicContact CG1-CB 3.89Å; V246-K330 HydrophobicContact CG1-CD 3.87Å; V246-K330 HydrophobicContact CG1-CG 3.89Å; Y247-K330 PolarHBondContact OH-O 2.81Å; D250-K330 WeakPolarHBondContact OD1-CE 3.33Å; D250-K330 IonicContact OD1-NZ 2.68Å; D250-K330 PolarHBondContact OD1-NZ 3.44Å; V251-K330 PolarHBondContact O-NZ 3.45Å; P253-K330 HydrophobicContact CG-CD 4.21Å; I326-K330 WeakPolarHBondContact O-CB 3.39Å; I326-K330 PolarHBondContact O-N 2.88Å; S327-K330 PolarHBondContact O-N 2.96Å; V328-K330 VanDerWaalsContact C-N 3.3Å; V328-K330 PolarHBondContact O-N 3.1Å; K330-R407 PolarHBondContact O-NH2 3.04Å |
| 331 | E | 86.3 | Confident | 88 | Confident | 63 Ų | 63 | 13.1 Ų | 13.1 | 29% | 0.294 | 7% | 0.065 | S | C | . | . | H | α-helix | trans | -87.7 | -26.6 | -175.4 | -69.6 | -61.2 | 150.4 | 0 | 0 | 113.6 | Y50 Q51 L54 S327 V328 R407 | Y50-E331 HydrophobicContact CE1-CG 3.97Å; Q51-E331 HydrophobicContact CG-CB 4.37Å; Q51-E331 PolarHBondContact NE2-O 3.28Å; L54-E331 HydrophobicContact CD1-CG 4.05Å; S327-E331 VanDerWaalsContact O-CB 3.28Å; S327-E331 WeakPolarHBondContact O-CB 3.46Å; S327-E331 VanDerWaalsContact O-CG 3.25Å; S327-E331 WeakPolarHBondContact O-CG 3.3Å; S327-E331 PolarHBondContact O-N 3.27Å; V328-E331 PolarHBondContact O-N 2.99Å; E331-R407 VanDerWaalsContact O-CZ 3.27Å; E331-R407 PolarHBondContact O-NH1 3.45Å; E331-R407 PolarHBondContact O-NH2 2.91Å |
| 332 | I | 84.5 | Confident | 87.3 | Confident | 33 Ų | 33 | 13.1 Ų | 13.1 | 17% | 0.169 | 7% | 0.066 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -129.8 | -78.5 | -176.4 | -46.5 | 178.5 | 0 | 0 | 0 | 110.2 | W47 Q51 V328 T336 | W47-I332 HydrophobicContact CD2-CD1 4.41Å; W47-I332 HydrophobicContact CZ2-CD1 4.37Å; Q51-I332 HydrophobicContact CB-CD1 4.14Å; Q51-I332 HydrophobicContact CG-CD1 4.11Å; Q51-I332 HydrophobicContact CG-CG1 4.07Å; V328-I332 HydrophobicContact CG1-CD1 4.41Å; V328-I332 WeakPolarHBondContact O-CA 3.33Å; V328-I332 WeakPolarHBondContact O-CB 3.5Å; V328-I332 PolarHBondContact O-N 2.97Å; I332-T336 HydrophobicContact CB-CG2 4.38Å; I332-T336 HydrophobicContact CD1-CG2 4.13Å; I332-T336 HydrophobicContact CG2-CG2 4.01Å; I332-T336 VanDerWaalsContact CG2-OG1 3.25Å; I332-T336 WeakPolarHBondContact CG2-OG1 3.44Å |
| 333 | S | 83 | Confident | 86.7 | Confident | 10 Ų | 10 | 15.5 Ų | 15.5 | 7% | 0.07 | 8% | 0.079 | C | C | . | . | trans | -178.1 | 161.4 | 177.1 | 64.1 | 0 | 0 | 0 | 0 | 112 | E243 V328 T329 T335 T336 R337 | E243-S333 WeakPolarHBondContact OE1-CA 3.34Å; V328-S333 PolarHBondContact O-N 3.38Å; T329-S333 WeakPolarHBondContact O-CA 3.45Å; T329-S333 PolarHBondContact O-N 3.28Å; S333-T335 VanDerWaalsContact C-N 3.25Å; S333-T335 PolarHBondContact O-N 2.95Å; S333-T335 PolarHBondContact OG-OG1 3.04Å; S333-T336 PolarHBondContact O-N 3.1Å; S333-T336 PolarHBondContact OG-N 2.96Å; S333-T336 PolarHBondContact OG-OG1 2.98Å; S333-R337 PolarHBondContact O-N 3.16Å | ||
| 334 | A | 83.3 | Confident | 86.2 | Confident | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -64.4 | -30.6 | 172 | 0 | 0 | 0 | 0 | 0 | 112.7 | E243 T329 R337 M338 | E243-A334 HydrophobicContact CB-CB 4.02Å; E243-A334 HydrophobicContact CG-CB 4.24Å; E243-A334 PolarHBondContact OE1-N 3.32Å; E243-A334 WeakPolarHBondContact OE2-CB 3.18Å; T329-A334 HydrophobicContact CG2-CB 3.96Å; A334-R337 WeakPolarHBondContact O-CB 3.21Å; A334-R337 PolarHBondContact O-N 2.85Å; A334-M338 WeakPolarHBondContact O-CG 3.43Å; A334-M338 PolarHBondContact O-N 3.25Å |
| 335 | T | 78.4 | Confident | 85.5 | Confident | 11 Ų | 11 | 14.6 Ų | 14.6 | 7% | 0.067 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -69.1 | -38.4 | 177.9 | 58.9 | 0 | 0 | 0 | 0 | 111.2 | T172 S333 R337 M338 V339 Y378 | T172-T335 HydrophobicContact CG2-CG2 4.21Å; S333-T335 VanDerWaalsContact C-N 3.25Å; S333-T335 PolarHBondContact O-N 2.95Å; S333-T335 PolarHBondContact OG-OG1 3.04Å; T335-R337 VanDerWaalsContact C-N 3.35Å; T335-M338 PolarHBondContact O-N 3.09Å; T335-V339 WeakPolarHBondContact O-CG2 3.32Å; T335-V339 PolarHBondContact O-N 2.91Å; T335-Y378 HydrophobicContact CG2-CE1 4.34Å |
| 336 | T | 81.9 | Confident | 84.8 | Confident | 6 Ų | 6 | 17.3 Ų | 17.3 | 4% | 0.037 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -63.1 | -39.9 | 171.5 | -55.4 | 0 | 0 | 0 | 0 | 111.8 | W47 V328 I332 S333 M338 V339 L340 | W47-T336 HydrophobicContact CH2-CG2 4.13Å; W47-T336 HydrophobicContact CZ2-CG2 4.06Å; V328-T336 HydrophobicContact CG1-CG2 4.12Å; I332-T336 HydrophobicContact CB-CG2 4.38Å; I332-T336 HydrophobicContact CD1-CG2 4.13Å; I332-T336 HydrophobicContact CG2-CG2 4.01Å; I332-T336 VanDerWaalsContact CG2-OG1 3.25Å; I332-T336 WeakPolarHBondContact CG2-OG1 3.44Å; S333-T336 PolarHBondContact O-N 3.1Å; S333-T336 PolarHBondContact OG-N 2.96Å; S333-T336 PolarHBondContact OG-OG1 2.98Å; T336-M338 VanDerWaalsContact C-N 3.31Å; T336-M338 PolarHBondContact O-N 3.27Å; T336-V339 PolarHBondContact O-N 3.23Å; T336-L340 WeakPolarHBondContact O-CG 3.29Å; T336-L340 PolarHBondContact O-N 3.28Å |
| 337 | R | 88.5 | Confident | 84.3 | Confident | 5 Ų | 5 | 20 Ų | 20 | 2% | 0.019 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -55.9 | -46.3 | 172.3 | -178.2 | -173.4 | 175.9 | 177.1 | -5.2 | 110.8 | M58 E242 N322 G325 V328 T329 S333 A334 T335 V339 L340 D341 | M58-R337 HydrophobicContact CE-CG 3.58Å; M58-R337 WeakPolarHBondContact CE-O 3.42Å; M58-R337 HydrophobicContact SD-CG 4.01Å; E242-R337 IonicContact OE2-CZ 3.92Å; E242-R337 IonicContact OE2-NH1 3.72Å; E242-R337 PolarHBondContact OE2-NH1 2.95Å; N322-R337 PolarHBondContact OD1-NH2 2.96Å; G325-R337 WeakPolarHBondContact O-CD 3.43Å; V328-R337 HydrophobicContact CG1-CB 4.26Å; T329-R337 WeakPolarHBondContact OG1-CD 3.41Å; S333-R337 PolarHBondContact O-N 3.16Å; A334-R337 WeakPolarHBondContact O-CB 3.21Å; A334-R337 PolarHBondContact O-N 2.85Å; T335-R337 VanDerWaalsContact C-N 3.35Å; R337-V339 VanDerWaalsContact C-N 3.33Å; R337-V339 PolarHBondContact O-N 3.21Å; R337-L340 PolarHBondContact O-N 2.74Å; R337-D341 PolarHBondContact O-N 2.72Å |
| 338 | M | 86.4 | Confident | 83.9 | Confident | 4 Ų | 4 | 20.2 Ų | 20.2 | 2% | 0.02 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -64.3 | -35.4 | 177.5 | -65.5 | -57.3 | 91.4 | 0 | 0 | 113.1 | V168 T172 M239 A334 T335 T336 D341 S342 | V168-M338 HydrophobicContact CB-SD 4.32Å; V168-M338 HydrophobicContact CG1-CB 4.22Å; V168-M338 HydrophobicContact CG1-CG 4.19Å; V168-M338 HydrophobicContact CG1-SD 3.65Å; V168-M338 HydrophobicContact CG2-CG 4.49Å; V168-M338 HydrophobicContact CG2-SD 3.66Å; T172-M338 HydrophobicContact CG2-CG 4.16Å; M239-M338 HydrophobicContact CE-CE 3.81Å; M239-M338 HydrophobicContact CG-CE 3.79Å; M239-M338 HydrophobicContact CG-SD 3.88Å; M239-M338 HydrophobicContact SD-CE 3.38Å; M239-M338 WeakPolarHBondContact SD-CE 3.49Å; M239-M338 HydrophobicContact SD-SD 4.27Å; A334-M338 WeakPolarHBondContact O-CG 3.43Å; A334-M338 PolarHBondContact O-N 3.25Å; T335-M338 PolarHBondContact O-N 3.09Å; T336-M338 VanDerWaalsContact C-N 3.31Å; T336-M338 PolarHBondContact O-N 3.27Å; M338-D341 WeakPolarHBondContact O-CB 3.48Å; M338-D341 PolarHBondContact O-N 2.94Å; M338-S342 PolarHBondContact O-N 3.21Å; M338-S342 PolarHBondContact O-OG 2.9Å |
| 339 | V | 79.9 | Confident | 83.2 | Confident | 4 Ų | 4 | 23.4 Ų | 23.4 | 2% | 0.024 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -65 | -44.5 | 174 | 172.2 | 0 | 0 | 0 | 0 | 111.5 | I169 T335 T336 R337 D341 S342 L343 T375 Y378 N379 | I169-V339 HydrophobicContact CD1-CG2 3.64Å; T335-V339 WeakPolarHBondContact O-CG2 3.32Å; T335-V339 PolarHBondContact O-N 2.91Å; T336-V339 PolarHBondContact O-N 3.23Å; R337-V339 VanDerWaalsContact C-N 3.33Å; R337-V339 PolarHBondContact O-N 3.21Å; V339-D341 PolarHBondContact O-N 3.44Å; V339-S342 PolarHBondContact O-N 2.8Å; V339-L343 PolarHBondContact O-N 3.41Å; V339-T375 HydrophobicContact CB-CG2 4.13Å; V339-T375 HydrophobicContact CG1-CG2 3.78Å; V339-T375 HydrophobicContact CG2-CG2 3.9Å; V339-Y378 HydrophobicContact CG2-CD1 4.47Å; V339-N379 HydrophobicContact CB-CB 4.44Å; V339-N379 HydrophobicContact CG1-CB 3.95Å; V339-N379 VanDerWaalsContact CG1-ND2 3.32Å; V339-N379 WeakPolarHBondContact CG1-ND2 3.43Å; V339-N379 HydrophobicContact CG2-CB 3.94Å |
| 340 | L | 85.8 | Confident | 82.8 | Confident | 6 Ų | 6 | 26.9 Ų | 26.9 | 3% | 0.031 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61.4 | -34.7 | 174.4 | -66.4 | 175.1 | 0 | 0 | 0 | 111.1 | A55 M58 L59 V328 T336 R337 L343 R344 | A55-L340 HydrophobicContact CB-CD1 3.75Å; A55-L340 HydrophobicContact CB-CD2 3.86Å; A55-L340 HydrophobicContact CB-CG 4.49Å; M58-L340 HydrophobicContact CE-CB 4.12Å; M58-L340 HydrophobicContact SD-CB 3.81Å; M58-L340 HydrophobicContact SD-CD1 3.82Å; L59-L340 HydrophobicContact CD1-CD2 4.12Å; L59-L340 HydrophobicContact CD2-CB 4.43Å; L59-L340 WeakPolarHBondContact CD2-O 3.5Å; L59-L340 HydrophobicContact CG-CD2 4.26Å; V328-L340 HydrophobicContact CG1-CD1 3.95Å; V328-L340 HydrophobicContact CG2-CD1 3.97Å; T336-L340 WeakPolarHBondContact O-CG 3.29Å; T336-L340 PolarHBondContact O-N 3.28Å; R337-L340 PolarHBondContact O-N 2.74Å; L340-L343 HydrophobicContact CD2-CD1 4.34Å; L340-L343 PolarHBondContact O-N 2.74Å; L340-R344 PolarHBondContact O-N 2.97Å |
| 341 | D | 83.3 | Confident | 82.7 | Confident | 17 Ų | 17 | 27.4 Ų | 27.4 | 9% | 0.091 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -63.8 | -42.3 | 174.7 | -153.1 | 61.4 | 0 | 0 | 0 | 112.8 | M58 F321 R337 M338 V339 L343 R344 T345 | M58-D341 HydrophobicContact CE-CB 4.34Å; F321-D341 WeakPolarHBondContact CZ-OD1 3.19Å; R337-D341 PolarHBondContact O-N 2.72Å; M338-D341 WeakPolarHBondContact O-CB 3.48Å; M338-D341 PolarHBondContact O-N 2.94Å; V339-D341 PolarHBondContact O-N 3.44Å; D341-L343 VanDerWaalsContact C-N 3.32Å; D341-L343 PolarHBondContact O-N 3.35Å; D341-R344 WeakPolarHBondContact O-CB 3.3Å; D341-R344 PolarHBondContact O-N 3.29Å; D341-R344 IonicContact OD1-CZ 2.69Å; D341-R344 IonicContact OD1-NE 2.85Å; D341-R344 PolarHBondContact OD1-NE 2.83Å; D341-R344 VanDerWaalsContact OD1-NE 3.07Å; D341-R344 IonicContact OD1-NH1 2.68Å; D341-R344 IonicContact OD1-NH2 3.95Å; D341-R344 PolarHBondContact OD1-NH2 3.4Å; D341-R344 IonicContact OD2-CZ 3.87Å; D341-R344 IonicContact OD2-NH2 3.76Å; D341-R344 PolarHBondContact OD2-NH2 3.43Å; D341-T345 PolarHBondContact O-N 2.97Å |
| 342 | S | 79.6 | Confident | 82.3 | Confident | 16 Ų | 16 | 24.4 Ų | 24.4 | 11% | 0.112 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -66.1 | -31.3 | 172.8 | -63 | 0 | 0 | 0 | 0 | 113.1 | M338 V339 T345 | M338-S342 PolarHBondContact O-N 3.21Å; M338-S342 PolarHBondContact O-OG 2.9Å; V339-S342 PolarHBondContact O-N 2.8Å; S342-T345 PolarHBondContact O-OG1 3.38Å |
| 343 | L | 81.5 | Confident | 82.1 | Confident | 68 Ų | 68 | 25.3 Ų | 25.3 | 36% | 0.356 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -71.7 | -34.9 | 174.3 | -73.5 | 175.2 | 0 | 0 | 0 | 111.8 | L59 V339 L340 D341 T345 L346 V347 | L59-L343 HydrophobicContact CD2-CB 3.64Å; V339-L343 PolarHBondContact O-N 3.41Å; L340-L343 HydrophobicContact CD2-CD1 4.34Å; L340-L343 PolarHBondContact O-N 2.74Å; D341-L343 VanDerWaalsContact C-N 3.32Å; D341-L343 PolarHBondContact O-N 3.35Å; L343-T345 VanDerWaalsContact C-N 3.3Å; L343-T345 PolarHBondContact O-N 2.78Å; L343-L346 WeakPolarHBondContact O-CB 3.36Å; L343-L346 PolarHBondContact O-N 3.19Å; L343-V347 PolarHBondContact O-N 3.27Å |
| 344 | R | 85 | Confident | 82.1 | Confident | 16 Ų | 16 | 29 Ų | 29 | 6% | 0.06 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.5 | -41.1 | 173.4 | 169.4 | -168.9 | 69.9 | 159.1 | 0.3 | 111.6 | L59 G62 L340 D341 L346 V347 I348 | L59-R344 HydrophobicContact CD2-CB 4.2Å; G62-R344 VanDerWaalsContact CA-CD 3.5Å; G62-R344 WeakPolarHBondContact O-CD 3.34Å; L340-R344 PolarHBondContact O-N 2.97Å; D341-R344 WeakPolarHBondContact O-CB 3.3Å; D341-R344 PolarHBondContact O-N 3.29Å; D341-R344 IonicContact OD1-CZ 2.69Å; D341-R344 IonicContact OD1-NE 2.85Å; D341-R344 PolarHBondContact OD1-NE 2.83Å; D341-R344 VanDerWaalsContact OD1-NE 3.07Å; D341-R344 IonicContact OD1-NH1 2.68Å; D341-R344 IonicContact OD1-NH2 3.95Å; D341-R344 PolarHBondContact OD1-NH2 3.4Å; D341-R344 IonicContact OD2-CZ 3.87Å; D341-R344 IonicContact OD2-NH2 3.76Å; D341-R344 PolarHBondContact OD2-NH2 3.43Å; R344-L346 VanDerWaalsContact C-N 3.29Å; R344-L346 PolarHBondContact O-N 3.04Å; R344-V347 PolarHBondContact O-N 3.07Å; R344-V347 VanDerWaalsContact O-N 3.14Å; R344-I348 HydrophobicContact CG-CD1 3.73Å; R344-I348 HydrophobicContact CG-CG1 4.44Å; R344-I348 WeakPolarHBondContact O-CD1 3.2Å; R344-I348 WeakPolarHBondContact O-CG1 3.44Å; R344-I348 PolarHBondContact O-N 3.32Å |
| 345 | T | 79.7 | Confident | 82.2 | Confident | 9 Ų | 9 | 33.6 Ų | 33.6 | 6% | 0.055 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -62.5 | -36.5 | 178.9 | 64.2 | 0 | 0 | 0 | 0 | 112 | D341 S342 L343 I348 W349 | D341-T345 PolarHBondContact O-N 2.97Å; S342-T345 PolarHBondContact O-OG1 3.38Å; L343-T345 VanDerWaalsContact C-N 3.3Å; L343-T345 PolarHBondContact O-N 2.78Å; T345-I348 PolarHBondContact O-N 3.29Å; T345-W349 WeakPolarHBondContact O-CB 3.41Å; T345-W349 PolarHBondContact O-N 3.48Å |
| 346 | L | 77.5 | Confident | 82.2 | Confident | 56 Ų | 56 | 36 Ų | 36 | 29% | 0.293 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -60.3 | -46.8 | 171.6 | -178 | 140.2 | 0 | 0 | 0 | 112.2 | L343 R344 I348 W349 V350 F368 L372 | L343-L346 WeakPolarHBondContact O-CB 3.36Å; L343-L346 PolarHBondContact O-N 3.19Å; R344-L346 VanDerWaalsContact C-N 3.29Å; R344-L346 PolarHBondContact O-N 3.04Å; L346-I348 VanDerWaalsContact C-N 3.31Å; L346-I348 PolarHBondContact O-N 3.5Å; L346-W349 PolarHBondContact O-N 2.95Å; L346-V350 HydrophobicContact CD2-CG2 4.2Å; L346-V350 HydrophobicContact CG-CG2 4.49Å; L346-V350 WeakPolarHBondContact O-CG2 3.31Å; L346-V350 PolarHBondContact O-N 2.85Å; L346-F368 HydrophobicContact CB-CE1 4.2Å; L346-F368 HydrophobicContact CB-CZ 3.72Å; L346-F368 HydrophobicContact CD1-CE1 3.82Å; L346-F368 HydrophobicContact CD1-CZ 4.15Å; L346-F368 HydrophobicContact CG-CE1 4.13Å; L346-F368 HydrophobicContact CG-CZ 4.18Å; L346-L372 HydrophobicContact CB-CD1 4.42Å; L346-L372 HydrophobicContact CD1-CD1 3.18Å; L346-L372 HydrophobicContact CG-CD1 4.39Å |
| 347 | V | 83.6 | Confident | 81.9 | Confident | 58 Ų | 58 | 39.2 Ų | 39.2 | 35% | 0.352 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -60.7 | -45 | -179.8 | 176.5 | 0 | 0 | 0 | 0 | 110.1 | S63 L343 R344 W349 V350 V351 | S63-V347 VanDerWaalsContact OG-CG1 3.31Å; S63-V347 WeakPolarHBondContact OG-CG1 3.36Å; L343-V347 PolarHBondContact O-N 3.27Å; R344-V347 PolarHBondContact O-N 3.07Å; R344-V347 VanDerWaalsContact O-N 3.14Å; V347-W349 VanDerWaalsContact C-N 3.34Å; V347-W349 PolarHBondContact O-N 3.29Å; V347-V350 PolarHBondContact O-N 3.41Å; V347-V351 HydrophobicContact CG1-CG2 4.42Å; V347-V351 WeakPolarHBondContact O-CB 3.38Å; V347-V351 VanDerWaalsContact O-CG2 3.29Å; V347-V351 WeakPolarHBondContact O-CG2 3.31Å; V347-V351 PolarHBondContact O-N 3.12Å |
| 348 | I | 82.9 | Confident | 80.9 | Confident | 5 Ų | 5 | 41.7 Ų | 41.7 | 3% | 0.026 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.4 | -43.2 | 177.7 | -65.3 | 157.9 | 0 | 0 | 0 | 111 | T66 L67 R344 T345 L346 V351 S352 | T66-I348 VanDerWaalsContact CB-CD1 3.46Å; T66-I348 HydrophobicContact CG2-CD1 3.76Å; T66-I348 HydrophobicContact CG2-CG1 4.48Å; T66-I348 HydrophobicContact CG2-CG2 4.23Å; L67-I348 HydrophobicContact CD2-CG2 4.34Å; R344-I348 HydrophobicContact CG-CD1 3.73Å; R344-I348 HydrophobicContact CG-CG1 4.44Å; R344-I348 WeakPolarHBondContact O-CD1 3.2Å; R344-I348 WeakPolarHBondContact O-CG1 3.44Å; R344-I348 PolarHBondContact O-N 3.32Å; T345-I348 PolarHBondContact O-N 3.29Å; L346-I348 VanDerWaalsContact C-N 3.31Å; L346-I348 PolarHBondContact O-N 3.5Å; I348-V351 PolarHBondContact O-N 3.07Å; I348-S352 WeakPolarHBondContact O-CB 3.34Å; I348-S352 PolarHBondContact O-N 2.97Å; I348-S352 PolarHBondContact O-OG 3.16Å |
| 349 | W | 78.8 | Confident | 79.9 | Confident | 69 Ų | 69 | 49.9 Ų | 49.9 | 26% | 0.261 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.3 | -48.4 | 178.8 | 177.8 | 78 | 0 | 0 | 0 | 112 | T345 L346 V347 V351 S352 L353 F360 V365 | T345-W349 WeakPolarHBondContact O-CB 3.41Å; T345-W349 PolarHBondContact O-N 3.48Å; L346-W349 PolarHBondContact O-N 2.95Å; V347-W349 VanDerWaalsContact C-N 3.34Å; V347-W349 PolarHBondContact O-N 3.29Å; W349-V351 PolarHBondContact O-N 3.43Å; W349-S352 PolarHBondContact O-N 2.93Å; W349-L353 HydrophobicContact CD2-CD1 3.91Å; W349-L353 VanDerWaalsContact CE2-CD1 3.42Å; W349-L353 HydrophobicContact CE3-CD1 4.22Å; W349-L353 HydrophobicContact CH2-CD1 3.68Å; W349-L353 HydrophobicContact CZ2-CD1 3.32Å; W349-L353 HydrophobicContact CZ2-CG 4.5Å; W349-L353 HydrophobicContact CZ3-CD1 4.11Å; W349-L353 PolarHBondContact O-N 3.47Å; W349-F360 HydrophobicContact CH2-CE2 4.43Å; W349-F360 HydrophobicContact CZ2-CD2 4.37Å; W349-F360 HydrophobicContact CZ2-CE2 4.27Å; W349-V365 HydrophobicContact CH2-CG2 4.3Å; W349-V365 HydrophobicContact CZ2-CG2 3.8Å |
| 350 | V | 81.1 | Confident | 79.3 | Confident | 72 Ų | 72 | 56.2 Ų | 56.2 | 44% | 0.436 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -60 | -45.7 | 177.4 | 172.5 | 0 | 0 | 0 | 0 | 111.2 | L346 V347 L353 A354 | L346-V350 HydrophobicContact CD2-CG2 4.2Å; L346-V350 HydrophobicContact CG-CG2 4.49Å; L346-V350 WeakPolarHBondContact O-CG2 3.31Å; L346-V350 PolarHBondContact O-N 2.85Å; V347-V350 PolarHBondContact O-N 3.41Å; V350-L353 PolarHBondContact O-N 3.46Å; V350-A354 WeakPolarHBondContact O-CB 3.36Å; V350-A354 PolarHBondContact O-N 3.22Å |
| 351 | V | 84.8 | Confident | 78.3 | Confident | 47 Ų | 47 | 61.1 Ų | 61.1 | 29% | 0.285 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -66.3 | -41.5 | 178.7 | 173.6 | 0 | 0 | 0 | 0 | 111.1 | L67 V347 I348 W349 L353 A354 L355 | L67-V351 HydrophobicContact CD1-CB 4.32Å; L67-V351 HydrophobicContact CD1-CG1 3.77Å; L67-V351 HydrophobicContact CD2-CB 4.49Å; L67-V351 HydrophobicContact CD2-CG1 4Å; V347-V351 HydrophobicContact CG1-CG2 4.42Å; V347-V351 WeakPolarHBondContact O-CB 3.38Å; V347-V351 VanDerWaalsContact O-CG2 3.29Å; V347-V351 WeakPolarHBondContact O-CG2 3.31Å; V347-V351 PolarHBondContact O-N 3.12Å; I348-V351 PolarHBondContact O-N 3.07Å; W349-V351 PolarHBondContact O-N 3.43Å; V351-L353 VanDerWaalsContact C-N 3.33Å; V351-L353 PolarHBondContact O-N 3.3Å; V351-A354 PolarHBondContact O-N 3.36Å; V351-L355 HydrophobicContact CG1-CD1 3.8Å; V351-L355 HydrophobicContact CG1-CG 4.27Å; V351-L355 WeakPolarHBondContact O-CB 3.33Å; V351-L355 WeakPolarHBondContact O-CG 3.46Å; V351-L355 PolarHBondContact O-N 3.28Å |
| 352 | S | 79.4 | Confident | 77.6 | Confident | 1 Ų | 1 | 62.6 Ų | 62.6 | 1% | 0.007 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -63.4 | -38.8 | 178.6 | -62.5 | 0 | 0 | 0 | 0 | 112 | I348 W349 G356 W357 | I348-S352 WeakPolarHBondContact O-CB 3.34Å; I348-S352 PolarHBondContact O-N 2.97Å; I348-S352 PolarHBondContact O-OG 3.16Å; W349-S352 PolarHBondContact O-N 2.93Å; S352-G356 PolarHBondContact O-N 3.18Å; S352-W357 PolarHBondContact O-N 3Å |
| 353 | L | 79.7 | Confident | 77 | Confident | 51 Ų | 51 | 66.3 Ų | 66.3 | 27% | 0.267 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -66.2 | -43.3 | 172.1 | -74.9 | 178.2 | 0 | 0 | 0 | 112.1 | W349 V350 V351 L355 G356 E358 F360 | W349-L353 HydrophobicContact CD2-CD1 3.91Å; W349-L353 VanDerWaalsContact CE2-CD1 3.42Å; W349-L353 HydrophobicContact CE3-CD1 4.22Å; W349-L353 HydrophobicContact CH2-CD1 3.68Å; W349-L353 HydrophobicContact CZ2-CD1 3.32Å; W349-L353 HydrophobicContact CZ2-CG 4.5Å; W349-L353 HydrophobicContact CZ3-CD1 4.11Å; W349-L353 PolarHBondContact O-N 3.47Å; V350-L353 PolarHBondContact O-N 3.46Å; V351-L353 VanDerWaalsContact C-N 3.33Å; V351-L353 PolarHBondContact O-N 3.3Å; L353-L355 VanDerWaalsContact C-N 3.27Å; L353-L355 PolarHBondContact O-N 2.84Å; L353-G356 PolarHBondContact O-N 2.91Å; L353-E358 HydrophobicContact CD2-CB 4.1Å; L353-F360 HydrophobicContact CD1-CD2 4.41Å |
| 354 | A | 83.9 | Confident | 76.4 | Confident | 87 Ų | 87 | 64.4 Ų | 64.4 | 72% | 0.719 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -62.7 | -33.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | V350 V351 G356 | V350-A354 WeakPolarHBondContact O-CB 3.36Å; V350-A354 PolarHBondContact O-N 3.22Å; V351-A354 PolarHBondContact O-N 3.36Å; A354-G356 VanDerWaalsContact C-N 3.31Å |
| 355 | L | 83.6 | Confident | 75.8 | Confident | 98 Ų | 98 | 65 Ų | 65 | 51% | 0.513 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.6 | -5.3 | 175.2 | -65.2 | 175.2 | 0 | 0 | 0 | 113.6 | V351 L353 W357 | V351-L355 HydrophobicContact CG1-CD1 3.8Å; V351-L355 HydrophobicContact CG1-CG 4.27Å; V351-L355 WeakPolarHBondContact O-CB 3.33Å; V351-L355 WeakPolarHBondContact O-CG 3.46Å; V351-L355 PolarHBondContact O-N 3.28Å; L353-L355 VanDerWaalsContact C-N 3.27Å; L353-L355 PolarHBondContact O-N 2.84Å; L355-W357 VanDerWaalsContact C-N 3.3Å; L355-W357 HydrophobicContact CB-CD2 4.06Å; L355-W357 HydrophobicContact CB-CG 4.03Å; L355-W357 HydrophobicContact CD1-CD2 4.13Å; L355-W357 HydrophobicContact CD1-CE3 4.17Å; L355-W357 HydrophobicContact CD1-CH2 3.93Å; L355-W357 HydrophobicContact CD1-CZ2 3.84Å; L355-W357 HydrophobicContact CD1-CZ3 4.09Å; L355-W357 PolarHBondContact O-N 3.45Å |
| 356 | G | 79.1 | Confident | 75.8 | Confident | 62 Ų | 62 | 69.3 Ų | 69.3 | 64% | 0.639 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.8 | 20.4 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | S352 L353 A354 | S352-G356 PolarHBondContact O-N 3.18Å; L353-G356 PolarHBondContact O-N 2.91Å; A354-G356 VanDerWaalsContact C-N 3.31Å |
| 357 | W | 75.1 | Confident | 75.8 | Confident | 72 Ų | 72 | 66.7 Ų | 66.7 | 27% | 0.273 | 37% | 0.368 | S | S | . | . | trans | -82.7 | -9.9 | -179.1 | -66.6 | -4.9 | 0 | 0 | 0 | 114.1 | L67 K70 W71 M74 S352 L355 | L67-W357 HydrophobicContact CD2-CE3 4.43Å; L67-W357 HydrophobicContact CD2-CZ3 3.87Å; K70-W357 HydrophobicContact CB-CZ3 4.43Å; K70-W357 HydrophobicContact CD-CE3 3.73Å; K70-W357 HydrophobicContact CD-CZ3 4.12Å; K70-W357 HydrophobicContact CG-CE3 4.12Å; K70-W357 HydrophobicContact CG-CZ3 4.13Å; W71-W357 HydrophobicContact CB-CH2 4.32Å; M74-W357 HydrophobicContact SD-CD2 4.04Å; M74-W357 HydrophobicContact SD-CG 4.41Å; M74-W357 HydrophobicContact SD-CZ2 4.04Å; S352-W357 PolarHBondContact O-N 3Å; L355-W357 VanDerWaalsContact C-N 3.3Å; L355-W357 HydrophobicContact CB-CD2 4.06Å; L355-W357 HydrophobicContact CB-CG 4.03Å; L355-W357 HydrophobicContact CD1-CD2 4.13Å; L355-W357 HydrophobicContact CD1-CE3 4.17Å; L355-W357 HydrophobicContact CD1-CH2 3.93Å; L355-W357 HydrophobicContact CD1-CZ2 3.84Å; L355-W357 HydrophobicContact CD1-CZ3 4.09Å; L355-W357 PolarHBondContact O-N 3.45Å | ||
| 358 | E | 67.5 | Low | 75.4 | Confident | 58 Ų | 58 | 65 Ų | 65 | 27% | 0.271 | 36% | 0.356 | S | S | . | . | S | Bend | trans | -136.5 | 147.3 | -177.3 | -70.6 | -63.8 | 156.5 | 0 | 0 | 111 | K70 L353 | K70-E358 IonicContact NZ-OE1 2.69Å; K70-E358 PolarHBondContact NZ-OE1 2.8Å; L353-E358 HydrophobicContact CD2-CB 4.1Å |
| 359 | K | 66.4 | Low | 75.3 | Confident | 176 Ų | 176 | 69.2 Ų | 69.2 | 77% | 0.765 | 38% | 0.378 | S | S | * | . | trans | -94.9 | 136.7 | 174.4 | -68.3 | -177.2 | -178 | 175.3 | 0 | 110.5 | H361 | K359-H361 PolarHBondContact O-N 3.46Å; K359-H361 PolarHBondContact O-ND1 2.94Å; K359-H361 VanDerWaalsContact O-ND1 3.08Å | ||
| 360 | F | 66.1 | Low | 75.6 | Confident | 137 Ų | 137 | 67.8 Ų | 67.8 | 60% | 0.601 | 38% | 0.377 | S | S | * | . | trans | -74.3 | 113.6 | -177.1 | -174.7 | -93.6 | 0 | 0 | 0 | 112 | W349 L353 V365 | W349-F360 HydrophobicContact CH2-CE2 4.43Å; W349-F360 HydrophobicContact CZ2-CD2 4.37Å; W349-F360 HydrophobicContact CZ2-CE2 4.27Å; L353-F360 HydrophobicContact CD1-CD2 4.41Å; F360-V365 HydrophobicContact CD2-CG2 4.34Å; F360-V365 HydrophobicContact CE2-CG2 3.66Å; F360-V365 HydrophobicContact CZ-CG2 3.85Å | ||
| 361 | H | 65.8 | Low | 75.7 | Confident | 109 Ų | 109 | 64.8 Ų | 64.8 | 51% | 0.505 | 36% | 0.359 | S | S | . | . | trans | -110.6 | 109.6 | 173.2 | -65.2 | 91.9 | 0 | 0 | 0 | 110.5 | K359 L363 Q364 V365 | K359-H361 PolarHBondContact O-N 3.46Å; K359-H361 PolarHBondContact O-ND1 2.94Å; K359-H361 VanDerWaalsContact O-ND1 3.08Å; H361-L363 VanDerWaalsContact C-N 3.33Å; H361-L363 PolarHBondContact O-N 3.2Å; H361-Q364 HydrophobicContact CB-CB 4.44Å; H361-Q364 HydrophobicContact CB-CG 4.29Å; H361-Q364 PolarHBondContact O-N 3.44Å; H361-V365 PolarHBondContact O-N 3.45Å | ||
| 362 | G | 67.8 | Low | 75.4 | Confident | 48 Ų | 48 | 65 Ų | 65 | 50% | 0.495 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -63.4 | -29.3 | -171 | 0 | 0 | 0 | 0 | 0 | 115.7 | V365 L366 | G362-V365 PolarHBondContact O-N 3.28Å; G362-L366 PolarHBondContact O-N 3.29Å |
| 363 | L | 67.9 | Low | 75.6 | Confident | 93 Ų | 93 | 68.3 Ų | 68.3 | 49% | 0.487 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -72.7 | -35.8 | -179.6 | -145.7 | 74.4 | 0 | 0 | 0 | 112.1 | A205 H361 V365 L366 G367 | A205-L363 HydrophobicContact CB-CD2 3.69Å; A205-L363 HydrophobicContact CB-CG 4.2Å; H361-L363 VanDerWaalsContact C-N 3.33Å; H361-L363 PolarHBondContact O-N 3.2Å; L363-V365 VanDerWaalsContact C-N 3.34Å; L363-L366 PolarHBondContact O-N 3.09Å; L363-G367 PolarHBondContact O-N 3.41Å |
| 364 | Q | 67.8 | Low | 75.8 | Confident | 29 Ų | 29 | 65.9 Ų | 65.9 | 14% | 0.136 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -68.9 | -34.4 | 175.9 | -67.2 | 179.7 | -26.5 | 0 | 0 | 111.4 | S159 M163 H361 L366 G367 F368 | S159-Q364 VanDerWaalsContact CB-OE1 3.27Å; S159-Q364 PolarHBondContact OG-NE2 2.89Å; S159-Q364 VanDerWaalsContact OG-NE2 3.08Å; S159-Q364 PolarHBondContact OG-OE1 3.25Å; S159-Q364 VanDerWaalsContact OG-OE1 3.12Å; M163-Q364 HydrophobicContact CE-CB 3.78Å; M163-Q364 HydrophobicContact CE-CG 3.8Å; M163-Q364 HydrophobicContact SD-CB 4.06Å; M163-Q364 VanDerWaalsContact SD-O 3.41Å; H361-Q364 HydrophobicContact CB-CB 4.44Å; H361-Q364 HydrophobicContact CB-CG 4.29Å; H361-Q364 PolarHBondContact O-N 3.44Å; Q364-L366 VanDerWaalsContact C-N 3.3Å; Q364-L366 PolarHBondContact O-N 3.24Å; Q364-G367 PolarHBondContact O-N 2.96Å; Q364-F368 WeakPolarHBondContact O-CB 3.14Å; Q364-F368 PolarHBondContact O-N 3.02Å |
| 365 | V | 73.1 | Confident | 75.6 | Confident | 28 Ų | 28 | 62.1 Ų | 62.1 | 17% | 0.17 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -61.3 | -38.6 | 174.8 | 177.3 | 0 | 0 | 0 | 0 | 111.7 | W349 F360 H361 G362 L363 F368 L369 | W349-V365 HydrophobicContact CH2-CG2 4.3Å; W349-V365 HydrophobicContact CZ2-CG2 3.8Å; F360-V365 HydrophobicContact CD2-CG2 4.34Å; F360-V365 HydrophobicContact CE2-CG2 3.66Å; F360-V365 HydrophobicContact CZ-CG2 3.85Å; H361-V365 PolarHBondContact O-N 3.45Å; G362-V365 PolarHBondContact O-N 3.28Å; L363-V365 VanDerWaalsContact C-N 3.34Å; V365-F368 PolarHBondContact O-N 3.27Å; V365-L369 HydrophobicContact CG1-CD1 4.12Å; V365-L369 HydrophobicContact CG1-CG 4.33Å; V365-L369 WeakPolarHBondContact O-CB 3.47Å; V365-L369 VanDerWaalsContact O-CG 3.28Å; V365-L369 WeakPolarHBondContact O-CG 3.36Å; V365-L369 PolarHBondContact O-N 2.96Å |
| 366 | L | 79.6 | Confident | 75.3 | Confident | 100 Ų | 100 | 58.6 Ų | 58.6 | 52% | 0.524 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.7 | -49.1 | 176.1 | -177 | 66.6 | 0 | 0 | 0 | 111.2 | G362 L363 Q364 F368 L369 V370 | G362-L366 PolarHBondContact O-N 3.29Å; L363-L366 PolarHBondContact O-N 3.09Å; Q364-L366 VanDerWaalsContact C-N 3.3Å; Q364-L366 PolarHBondContact O-N 3.24Å; L366-F368 VanDerWaalsContact C-N 3.29Å; L366-F368 PolarHBondContact O-N 3.13Å; L366-L369 PolarHBondContact O-N 3.38Å; L366-V370 VanDerWaalsContact O-CG2 3.3Å; L366-V370 WeakPolarHBondContact O-CG2 3.48Å; L366-V370 PolarHBondContact O-N 2.92Å; L366-V370 VanDerWaalsContact O-N 3.08Å |
| 367 | G | 77.1 | Confident | 75.4 | Confident | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -58.3 | -42.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L363 Q364 V370 L371 | L363-G367 PolarHBondContact O-N 3.41Å; Q364-G367 PolarHBondContact O-N 2.96Å; G367-V370 PolarHBondContact O-N 3.37Å; G367-L371 WeakPolarHBondContact O-CG 3.39Å; G367-L371 PolarHBondContact O-N 3.2Å |
| 368 | F | 76.1 | Confident | 75.4 | Confident | 23 Ų | 23 | 54.1 Ų | 54.1 | 10% | 0.101 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -62.4 | -43.7 | 176.5 | -174.7 | -110.7 | 0 | 0 | 0 | 113.4 | M163 L346 Q364 V365 L366 V370 L371 L372 | M163-F368 HydrophobicContact CG-CB 4.45Å; M163-F368 HydrophobicContact CG-CD2 4.14Å; M163-F368 HydrophobicContact SD-CB 4.17Å; L346-F368 HydrophobicContact CB-CE1 4.2Å; L346-F368 HydrophobicContact CB-CZ 3.72Å; L346-F368 HydrophobicContact CD1-CE1 3.82Å; L346-F368 HydrophobicContact CD1-CZ 4.15Å; L346-F368 HydrophobicContact CG-CE1 4.13Å; L346-F368 HydrophobicContact CG-CZ 4.18Å; Q364-F368 WeakPolarHBondContact O-CB 3.14Å; Q364-F368 PolarHBondContact O-N 3.02Å; V365-F368 PolarHBondContact O-N 3.27Å; L366-F368 VanDerWaalsContact C-N 3.29Å; L366-F368 PolarHBondContact O-N 3.13Å; F368-V370 VanDerWaalsContact C-N 3.32Å; F368-V370 PolarHBondContact O-N 3.45Å; F368-L371 PolarHBondContact O-N 2.94Å; F368-L372 HydrophobicContact CE1-CD1 4.39Å; F368-L372 HydrophobicContact CZ-CD1 4.48Å; F368-L372 WeakPolarHBondContact O-CB 3.4Å; F368-L372 PolarHBondContact O-N 2.76Å |
| 369 | L | 81.7 | Confident | 75.4 | Confident | 93 Ų | 93 | 53.7 Ų | 53.7 | 49% | 0.487 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.5 | -37.5 | 176.4 | -73.3 | 173.4 | 0 | 0 | 0 | 112.2 | V365 L366 T373 | V365-L369 HydrophobicContact CG1-CD1 4.12Å; V365-L369 HydrophobicContact CG1-CG 4.33Å; V365-L369 WeakPolarHBondContact O-CB 3.47Å; V365-L369 VanDerWaalsContact O-CG 3.28Å; V365-L369 WeakPolarHBondContact O-CG 3.36Å; V365-L369 PolarHBondContact O-N 2.96Å; L366-L369 PolarHBondContact O-N 3.38Å; L369-T373 WeakPolarHBondContact O-CB 3.5Å; L369-T373 PolarHBondContact O-N 2.99Å; L369-T373 PolarHBondContact O-OG1 3.48Å |
| 370 | V | 85.1 | Confident | 75.6 | Confident | 40 Ų | 40 | 45.8 Ų | 45.8 | 24% | 0.242 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -65.9 | -47.7 | 175.9 | 176.4 | 0 | 0 | 0 | 0 | 110.4 | I194 L366 G367 F368 L372 T373 G374 | I194-V370 HydrophobicContact CG2-CG1 3.98Å; L366-V370 VanDerWaalsContact O-CG2 3.3Å; L366-V370 WeakPolarHBondContact O-CG2 3.48Å; L366-V370 PolarHBondContact O-N 2.92Å; L366-V370 VanDerWaalsContact O-N 3.08Å; G367-V370 PolarHBondContact O-N 3.37Å; F368-V370 VanDerWaalsContact C-N 3.32Å; F368-V370 PolarHBondContact O-N 3.45Å; V370-L372 VanDerWaalsContact C-N 3.32Å; V370-L372 PolarHBondContact O-N 3.12Å; V370-T373 PolarHBondContact O-N 3.19Å; V370-G374 PolarHBondContact O-N 2.85Å |
| 371 | L | 81.8 | Confident | 75.7 | Confident | 9 Ų | 9 | 44.6 Ų | 44.6 | 5% | 0.047 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -58.2 | -43.6 | 175.7 | -73.6 | 169.3 | 0 | 0 | 0 | 112.1 | M163 T195 L199 V202 G367 F368 G374 T375 | M163-L371 HydrophobicContact CB-CD1 3.99Å; T195-L371 HydrophobicContact CG2-CD2 3.61Å; T195-L371 WeakPolarHBondContact O-CD2 3.44Å; L199-L371 HydrophobicContact CD2-CD1 4.46Å; L199-L371 HydrophobicContact CD2-CD2 3.84Å; L199-L371 HydrophobicContact CG-CD2 3.86Å; V202-L371 HydrophobicContact CG2-CD1 4.15Å; G367-L371 WeakPolarHBondContact O-CG 3.39Å; G367-L371 PolarHBondContact O-N 3.2Å; F368-L371 PolarHBondContact O-N 2.94Å; L371-G374 PolarHBondContact O-N 3.04Å; L371-T375 WeakPolarHBondContact O-CB 3.35Å; L371-T375 PolarHBondContact O-N 2.9Å; L371-T375 PolarHBondContact O-OG1 3.39Å |
| 372 | L | 79.7 | Confident | 75.9 | Confident | 51 Ų | 51 | 41 Ų | 41 | 27% | 0.267 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -65.6 | -40.2 | 178.2 | -169.2 | 143.8 | 0 | 0 | 0 | 111.7 | L346 F368 V370 T375 A376 | L346-L372 HydrophobicContact CB-CD1 4.42Å; L346-L372 HydrophobicContact CD1-CD1 3.18Å; L346-L372 HydrophobicContact CG-CD1 4.39Å; F368-L372 HydrophobicContact CE1-CD1 4.39Å; F368-L372 HydrophobicContact CZ-CD1 4.48Å; F368-L372 WeakPolarHBondContact O-CB 3.4Å; F368-L372 PolarHBondContact O-N 2.76Å; V370-L372 VanDerWaalsContact C-N 3.32Å; V370-L372 PolarHBondContact O-N 3.12Å; L372-T375 PolarHBondContact O-N 3.08Å; L372-A376 VanDerWaalsContact O-CB 3.26Å; L372-A376 WeakPolarHBondContact O-CB 3.37Å; L372-A376 PolarHBondContact O-N 3.38Å |
| 373 | T | 83.6 | Confident | 75.8 | Confident | 71 Ų | 71 | 40.1 Ų | 40.1 | 44% | 0.436 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.9 | -43.9 | 176 | -57.5 | 0 | 0 | 0 | 0 | 111.1 | L369 V370 T375 A376 L377 | L369-T373 WeakPolarHBondContact O-CB 3.5Å; L369-T373 PolarHBondContact O-N 2.99Å; L369-T373 PolarHBondContact O-OG1 3.48Å; V370-T373 PolarHBondContact O-N 3.19Å; T373-T375 PolarHBondContact O-N 3.4Å; T373-A376 PolarHBondContact O-N 3.27Å; T373-L377 HydrophobicContact CG2-CD1 4.05Å; T373-L377 WeakPolarHBondContact O-CB 3.5Å; T373-L377 WeakPolarHBondContact O-CG 3.44Å; T373-L377 PolarHBondContact O-N 3.06Å |
| 374 | G | 84.2 | Confident | 75.5 | Confident | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.9 | -45.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | G191 V370 L371 L377 Y378 | G191-G374 WeakPolarHBondContact CA-O 3.3Å; V370-G374 PolarHBondContact O-N 2.85Å; L371-G374 PolarHBondContact O-N 3.04Å; G374-L377 PolarHBondContact O-N 3.08Å; G374-Y378 WeakPolarHBondContact O-CB 3.42Å; G374-Y378 PolarHBondContact O-N 3.17Å |
| 375 | T | 78.9 | Confident | 75.3 | Confident | 8 Ų | 8 | 44.1 Ų | 44.1 | 5% | 0.049 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -62.9 | -44.1 | 176.5 | -56.7 | 0 | 0 | 0 | 0 | 111.9 | I169 V339 L371 L372 T373 Y378 N379 | I169-T375 HydrophobicContact CD1-CG2 3.99Å; V339-T375 HydrophobicContact CB-CG2 4.13Å; V339-T375 HydrophobicContact CG1-CG2 3.78Å; V339-T375 HydrophobicContact CG2-CG2 3.9Å; L371-T375 WeakPolarHBondContact O-CB 3.35Å; L371-T375 PolarHBondContact O-N 2.9Å; L371-T375 PolarHBondContact O-OG1 3.39Å; L372-T375 PolarHBondContact O-N 3.08Å; T373-T375 PolarHBondContact O-N 3.4Å; T375-Y378 WeakPolarHBondContact O-CB 3.36Å; T375-Y378 PolarHBondContact O-N 2.56Å; T375-N379 PolarHBondContact O-N 3.3Å; T375-N379 VanDerWaalsContact O-N 3.09Å |
| 376 | A | 77.6 | Confident | 74.8 | Confident | 24 Ų | 24 | 45.4 Ų | 45.4 | 20% | 0.198 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -65.6 | -37.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | L372 T373 N379 G380 L381 | L372-A376 VanDerWaalsContact O-CB 3.26Å; L372-A376 WeakPolarHBondContact O-CB 3.37Å; L372-A376 PolarHBondContact O-N 3.38Å; T373-A376 PolarHBondContact O-N 3.27Å; A376-N379 PolarHBondContact O-N 2.9Å; A376-G380 PolarHBondContact O-N 3.27Å; A376-L381 HydrophobicContact CB-CB 4.17Å; A376-L381 HydrophobicContact CB-CD2 4.02Å; A376-L381 VanDerWaalsContact O-CB 3.28Å; A376-L381 WeakPolarHBondContact O-CB 3.35Å; A376-L381 PolarHBondContact O-N 2.73Å |
| 377 | L | 79.8 | Confident | 73.8 | Confident | 36 Ų | 36 | 43.4 Ų | 43.4 | 19% | 0.188 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65 | -44.5 | 173.7 | -79.9 | 165.9 | 0 | 0 | 0 | 111.4 | I194 T373 G374 N379 G380 H382 | I194-L377 HydrophobicContact CD1-CD1 3.22Å; T373-L377 HydrophobicContact CG2-CD1 4.05Å; T373-L377 WeakPolarHBondContact O-CB 3.5Å; T373-L377 WeakPolarHBondContact O-CG 3.44Å; T373-L377 PolarHBondContact O-N 3.06Å; G374-L377 PolarHBondContact O-N 3.08Å; L377-N379 VanDerWaalsContact C-N 3.28Å; L377-N379 PolarHBondContact O-N 3.08Å; L377-G380 PolarHBondContact O-N 2.84Å; L377-G380 VanDerWaalsContact O-N 3.14Å; L377-H382 HydrophobicContact CD2-CB 4.01Å; L377-H382 PolarHBondContact O-CE1 3.19Å; L377-H382 PolarHBondContact O-ND1 3.37Å |
| 378 | Y | 75.3 | Confident | 73 | Confident | 4 Ų | 4 | 53.8 Ų | 53.8 | 2% | 0.016 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -56.3 | -43.9 | 177 | -172.6 | -83.2 | 0 | 0 | 0 | 112 | I169 L184 Q188 I192 T335 V339 G374 T375 G380 | I169-Y378 HydrophobicContact CD1-CD1 3.79Å; I169-Y378 HydrophobicContact CD1-CE1 4.42Å; I169-Y378 HydrophobicContact CD1-CG 3.86Å; I169-Y378 HydrophobicContact CG1-CD1 4.28Å; I169-Y378 HydrophobicContact CG1-CE1 4.45Å; I169-Y378 HydrophobicContact CG1-CG 4.38Å; L184-Y378 HydrophobicContact CD2-CE2 4.2Å; L184-Y378 WeakPolarHBondContact CD2-OH 3.4Å; Q188-Y378 HydrophobicContact CB-CD2 3.71Å; Q188-Y378 HydrophobicContact CB-CE2 3.59Å; Q188-Y378 HydrophobicContact CB-CG 4.36Å; Q188-Y378 HydrophobicContact CG-CD1 4.26Å; Q188-Y378 HydrophobicContact CG-CD2 3.96Å; Q188-Y378 HydrophobicContact CG-CE1 4.19Å; Q188-Y378 HydrophobicContact CG-CE2 3.9Å; Q188-Y378 HydrophobicContact CG-CG 4.14Å; Q188-Y378 VanDerWaalsContact CG-O 3.22Å; Q188-Y378 WeakPolarHBondContact CG-O 3.28Å; Q188-Y378 VanDerWaalsContact O-CD2 3.28Å; Q188-Y378 WeakPolarHBondContact O-CD2 3.49Å; I192-Y378 HydrophobicContact CD1-CD2 4.43Å; I192-Y378 HydrophobicContact CD1-CE2 3.9Å; I192-Y378 HydrophobicContact CG1-CD2 3.87Å; I192-Y378 HydrophobicContact CG1-CE2 3.82Å; T335-Y378 HydrophobicContact CG2-CE1 4.34Å; V339-Y378 HydrophobicContact CG2-CD1 4.47Å; G374-Y378 WeakPolarHBondContact O-CB 3.42Å; G374-Y378 PolarHBondContact O-N 3.17Å; T375-Y378 WeakPolarHBondContact O-CB 3.36Å; T375-Y378 PolarHBondContact O-N 2.56Å; Y378-G380 PolarHBondContact O-N 2.86Å |
| 379 | N | 69.2 | Low | 72.6 | Confident | 49 Ų | 49 | 56.9 Ų | 56.9 | 26% | 0.262 | 30% | 0.304 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.7 | 9.7 | -176.9 | -150.7 | 21.3 | 0 | 0 | 0 | 114.2 | V339 T375 A376 L377 L381 | V339-N379 HydrophobicContact CB-CB 4.44Å; V339-N379 HydrophobicContact CG1-CB 3.95Å; V339-N379 VanDerWaalsContact CG1-ND2 3.32Å; V339-N379 WeakPolarHBondContact CG1-ND2 3.43Å; V339-N379 HydrophobicContact CG2-CB 3.94Å; T375-N379 PolarHBondContact O-N 3.3Å; T375-N379 VanDerWaalsContact O-N 3.09Å; A376-N379 PolarHBondContact O-N 2.9Å; L377-N379 VanDerWaalsContact C-N 3.28Å; L377-N379 PolarHBondContact O-N 3.08Å; N379-L381 PolarHBondContact O-N 3.42Å |
| 380 | G | 69.6 | Low | 71.3 | Confident | 10 Ų | 10 | 57.8 Ų | 57.8 | 10% | 0.103 | 32% | 0.315 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 70.6 | 16.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | A376 L377 Y378 H382 R383 P384 | A376-G380 PolarHBondContact O-N 3.27Å; L377-G380 PolarHBondContact O-N 2.84Å; L377-G380 VanDerWaalsContact O-N 3.14Å; Y378-G380 PolarHBondContact O-N 2.86Å; G380-H382 PolarHBondContact O-N 3.32Å; G380-H382 VanDerWaalsContact O-N 3.12Å; G380-R383 WeakPolarHBondContact O-CB 3.38Å; G380-R383 VanDerWaalsContact O-CG 3.25Å; G380-R383 WeakPolarHBondContact O-CG 3.21Å; G380-R383 PolarHBondContact O-N 2.71Å; G380-P384 WeakPolarHBondContact O-CD 3.25Å |
| 381 | L | 69.3 | Low | 70.1 | Confident | 111 Ų | 111 | 66.5 Ų | 66.5 | 58% | 0.581 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -22 | -180 | -159.3 | 73.9 | 0 | 0 | 0 | 112.2 | A376 N379 R383 P384 | A376-L381 HydrophobicContact CB-CB 4.17Å; A376-L381 HydrophobicContact CB-CD2 4.02Å; A376-L381 VanDerWaalsContact O-CB 3.28Å; A376-L381 WeakPolarHBondContact O-CB 3.35Å; A376-L381 PolarHBondContact O-N 2.73Å; N379-L381 PolarHBondContact O-N 3.42Å; L381-R383 VanDerWaalsContact C-N 3.26Å; L381-R383 PolarHBondContact O-N 2.91Å; L381-P384 WeakPolarHBondContact O-CD 3.33Å; L381-P384 WeakPolarHBondContact O-CG 3.37Å |
| 382 | H | 69.1 | Low | 68.8 | Low | 35 Ų | 35 | 67.6 Ų | 67.6 | 16% | 0.162 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -66.3 | -24.9 | 170.3 | 63.5 | -82.4 | 0 | 0 | 0 | 112.9 | S187 L377 G380 L385 L386 | S187-H382 VanDerWaalsContact CB-CE1 3.42Å; S187-H382 WeakPolarHBondContact CB-CE1 3.42Å; L377-H382 HydrophobicContact CD2-CB 4.01Å; L377-H382 PolarHBondContact O-CE1 3.19Å; L377-H382 PolarHBondContact O-ND1 3.37Å; G380-H382 PolarHBondContact O-N 3.32Å; G380-H382 VanDerWaalsContact O-N 3.12Å; H382-L385 WeakPolarHBondContact O-CB 3.29Å; H382-L385 PolarHBondContact O-N 3.29Å; H382-L386 HydrophobicContact CB-CD1 3.88Å; H382-L386 VanDerWaalsContact O-CB 3.31Å; H382-L386 WeakPolarHBondContact O-CB 3.37Å; H382-L386 WeakPolarHBondContact O-CD1 3.3Å; H382-L386 PolarHBondContact O-N 2.94Å |
| 383 | R | 65.3 | Low | 67.7 | Low | 28 Ų | 28 | 66.9 Ų | 66.9 | 11% | 0.106 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61.4 | -51.1 | -175.5 | -62.4 | -176.3 | 172.4 | -150.4 | 0.7 | 113.9 | M45 G380 L381 L385 L386 A387 M396 D399 D400 | M45-R383 HydrophobicContact CE-CB 4.4Å; G380-R383 WeakPolarHBondContact O-CB 3.38Å; G380-R383 VanDerWaalsContact O-CG 3.25Å; G380-R383 WeakPolarHBondContact O-CG 3.21Å; G380-R383 PolarHBondContact O-N 2.71Å; L381-R383 VanDerWaalsContact C-N 3.26Å; L381-R383 PolarHBondContact O-N 2.91Å; R383-L385 VanDerWaalsContact C-N 3.26Å; R383-L385 PolarHBondContact O-N 2.98Å; R383-L386 CarbonylContact O-C 3.6Å; R383-L386 PolarHBondContact O-N 3.47Å; R383-A387 VanDerWaalsContact O-CB 3.28Å; R383-A387 WeakPolarHBondContact O-CB 3.47Å; R383-A387 PolarHBondContact O-N 2.93Å; R383-M396 HydrophobicContact CB-CE 3.99Å; R383-M396 HydrophobicContact CB-SD 3.93Å; R383-M396 HydrophobicContact CG-CE 3.83Å; R383-M396 HydrophobicContact CG-SD 4.09Å; R383-D399 IonicContact NH2-OD2 3.93Å; R383-D400 IonicContact CZ-OD1 3.76Å; R383-D400 IonicContact NH1-OD1 3.66Å; R383-D400 PolarHBondContact NH1-OD1 3.45Å; R383-D400 IonicContact NH1-OD2 3.92Å |
| 384 | P | 62.3 | Low | 66.1 | Low | 84 Ų | 84 | 68.6 Ų | 68.6 | 55% | 0.545 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -64.2 | -29.3 | 175.3 | 23 | -33.7 | 0 | 0 | 0 | 113.3 | G380 L381 | G380-P384 WeakPolarHBondContact O-CD 3.25Å; L381-P384 WeakPolarHBondContact O-CD 3.33Å; L381-P384 WeakPolarHBondContact O-CG 3.37Å |
| 385 | L | 63 | Low | 64.8 | Low | 123 Ų | 123 | 77.8 Ų | 77.8 | 64% | 0.644 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -69.8 | -41.6 | 173.8 | -69.8 | 171.8 | 0 | 0 | 0 | 111.7 | H382 R383 | H382-L385 WeakPolarHBondContact O-CB 3.29Å; H382-L385 PolarHBondContact O-N 3.29Å; R383-L385 VanDerWaalsContact C-N 3.26Å; R383-L385 PolarHBondContact O-N 2.98Å |
| 386 | L | 62.6 | Low | 63.8 | Low | 54 Ų | 54 | 78.6 Ų | 78.6 | 28% | 0.283 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -79.9 | -22 | 178.6 | -81.9 | 152.2 | 0 | 0 | 0 | 113.4 | H382 R383 R388 I389 C392 M396 | H382-L386 HydrophobicContact CB-CD1 3.88Å; H382-L386 VanDerWaalsContact O-CB 3.31Å; H382-L386 WeakPolarHBondContact O-CB 3.37Å; H382-L386 WeakPolarHBondContact O-CD1 3.3Å; H382-L386 PolarHBondContact O-N 2.94Å; R383-L386 CarbonylContact O-C 3.6Å; R383-L386 PolarHBondContact O-N 3.47Å; L386-R388 PolarHBondContact O-N 3.49Å; L386-I389 HydrophobicContact CD2-CD1 4.25Å; L386-I389 WeakPolarHBondContact O-CA 3.31Å; L386-I389 VanDerWaalsContact O-CB 3.31Å; L386-I389 WeakPolarHBondContact O-CB 3.36Å; L386-I389 PolarHBondContact O-N 3.35Å; L386-C392 HydrophobicContact CB-CB 4.36Å; L386-C392 HydrophobicContact CD2-CB 4.36Å; L386-M396 HydrophobicContact CB-CE 3.74Å; L386-M396 HydrophobicContact CD1-CE 4.29Å |
| 387 | A | 58.8 | Low | 62.7 | Low | 59 Ų | 59 | 81.9 Ų | 81.9 | 49% | 0.488 | 42% | 0.417 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.8 | -17.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | R383 I389 | R383-A387 VanDerWaalsContact O-CB 3.28Å; R383-A387 WeakPolarHBondContact O-CB 3.47Å; R383-A387 PolarHBondContact O-N 2.93Å; A387-I389 PolarHBondContact O-N 3.48Å |
| 388 | R | 60.1 | Low | 61.4 | Low | 217 Ų | 217 | 86.1 Ų | 86.1 | 82% | 0.819 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.2 | -8.3 | 166.3 | -65.2 | -170.9 | 176.7 | -175.7 | -0.2 | 113.1 | L386 | L386-R388 PolarHBondContact O-N 3.49Š|
| 389 | I | 67.9 | Low | 60.5 | Low | 88 Ų | 88 | 89.3 Ų | 89.3 | 45% | 0.451 | 46% | 0.456 | S | S | . | . | S | Bend | trans | -109.7 | 112.4 | 179.1 | -54 | -177.3 | 0 | 0 | 0 | 109.2 | L386 A387 W391 C392 | L386-I389 HydrophobicContact CD2-CD1 4.25Å; L386-I389 WeakPolarHBondContact O-CA 3.31Å; L386-I389 VanDerWaalsContact O-CB 3.31Å; L386-I389 WeakPolarHBondContact O-CB 3.36Å; L386-I389 PolarHBondContact O-N 3.35Å; A387-I389 PolarHBondContact O-N 3.48Å; I389-W391 VanDerWaalsContact C-N 3.31Å; I389-W391 PolarHBondContact O-N 3.27Å; I389-W391 VanDerWaalsContact O-N 3.13Å; I389-C392 PolarHBondContact O-N 3.01Å; I389-C392 VanDerWaalsContact O-N 3.12Å |
| 390 | P | 55.3 | Low | 59.8 | Low | 113 Ų | 113 | 88.9 Ų | 88.9 | 73% | 0.734 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -57.8 | -32.7 | -168.1 | -26.3 | 32.2 | 0 | 0 | 0 | 115.9 | ||
| 391 | W | 58.7 | Low | 58.9 | Low | 222 Ų | 222 | 95.4 Ų | 95.4 | 84% | 0.841 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -76.4 | -23.9 | -177.6 | -172.6 | 65.7 | 0 | 0 | 0 | 113.4 | I389 | I389-W391 VanDerWaalsContact C-N 3.31Å; I389-W391 PolarHBondContact O-N 3.27Å; I389-W391 VanDerWaalsContact O-N 3.13Å |
| 392 | C | 55.9 | Low | 58.1 | Low | 33 Ų | 33 | 92 Ų | 92 | 22% | 0.223 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -84.1 | -25.1 | 179.4 | -73.3 | 0 | 0 | 0 | 0 | 112.9 | L386 I389 T394 R395 M396 | L386-C392 HydrophobicContact CB-CB 4.36Å; L386-C392 HydrophobicContact CD2-CB 4.36Å; I389-C392 PolarHBondContact O-N 3.01Å; I389-C392 VanDerWaalsContact O-N 3.12Å; C392-T394 PolarHBondContact O-N 2.97Å; C392-R395 PolarHBondContact O-N 2.85Å; C392-M396 WeakPolarHBondContact O-CG 3.37Å; C392-M396 PolarHBondContact O-N 2.69Å |
| 393 | A | 54.7 | Low | 57.4 | Low | 36 Ų | 36 | 93.7 Ų | 93.7 | 30% | 0.298 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.7 | -38.6 | -178 | 0 | 0 | 0 | 0 | 0 | 113.1 | R395 M396 | A393-R395 VanDerWaalsContact C-N 3.35Å; A393-R395 PolarHBondContact O-N 3.24Å; A393-M396 PolarHBondContact O-N 3.5Å |
| 394 | T | 51 | Low | 57 | Low | 107 Ų | 107 | 97.5 Ų | 97.5 | 66% | 0.656 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -67.4 | -33.3 | -178.6 | -48.6 | 0 | 0 | 0 | 0 | 113 | C392 M396 | C392-T394 PolarHBondContact O-N 2.97Å; T394-M396 VanDerWaalsContact C-N 3.34Å |
| 395 | R | 56.5 | Low | 56.7 | Low | 192 Ų | 192 | 95.5 Ų | 95.5 | 73% | 0.725 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -75 | -25.7 | 179.2 | -164.4 | 174.9 | -178.6 | 176.7 | 0.8 | 112.2 | C392 A393 | C392-R395 PolarHBondContact O-N 2.85Å; A393-R395 VanDerWaalsContact C-N 3.35Å; A393-R395 PolarHBondContact O-N 3.24Å |
| 396 | M | 57.9 | Low | 56.6 | Low | 25 Ų | 25 | 91.4 Ų | 91.4 | 12% | 0.123 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -74.9 | -35 | -177.7 | -71.2 | 179.8 | 171.8 | 0 | 0 | 113.5 | R383 L386 C392 A393 T394 L398 D399 D400 | R383-M396 HydrophobicContact CB-CE 3.99Å; R383-M396 HydrophobicContact CB-SD 3.93Å; R383-M396 HydrophobicContact CG-CE 3.83Å; R383-M396 HydrophobicContact CG-SD 4.09Å; L386-M396 HydrophobicContact CB-CE 3.74Å; L386-M396 HydrophobicContact CD1-CE 4.29Å; C392-M396 WeakPolarHBondContact O-CG 3.37Å; C392-M396 PolarHBondContact O-N 2.69Å; A393-M396 PolarHBondContact O-N 3.5Å; T394-M396 VanDerWaalsContact C-N 3.34Å; M396-L398 PolarHBondContact O-N 3.02Å; M396-D399 PolarHBondContact O-N 3.32Å; M396-D400 PolarHBondContact O-N 3.39Å |
| 397 | N | 54.2 | Low | 56.5 | Low | 94 Ų | 94 | 92.8 Ų | 92.8 | 50% | 0.503 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.6 | -25.3 | 179.7 | -74.6 | -19.8 | 0 | 0 | 0 | 113.4 | ||
| 398 | L | 53.6 | Low | 56.7 | Low | 125 Ų | 125 | 96 Ų | 96 | 65% | 0.654 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -77.4 | -29.2 | 178.3 | -69.6 | 166.4 | 0 | 0 | 0 | 113.1 | M396 | M396-L398 PolarHBondContact O-N 3.02Å |
| 399 | D | 55.8 | Low | 57.1 | Low | 70 Ų | 70 | 93.6 Ų | 93.6 | 37% | 0.374 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -77 | -29.2 | 178.9 | -73.8 | -20 | 0 | 0 | 0 | 111.4 | R383 M396 G402 S403 | R383-D399 IonicContact NH2-OD2 3.93Å; M396-D399 PolarHBondContact O-N 3.32Å; D399-G402 PolarHBondContact O-N 3.08Å; D399-S403 PolarHBondContact O-N 3.49Å |
| 400 | D | 53.6 | Low | 56.8 | Low | 40 Ų | 40 | 90.9 Ų | 90.9 | 21% | 0.214 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -74.8 | -39.3 | -177.2 | -76.3 | -8.4 | 0 | 0 | 0 | 112.8 | R383 M396 G402 S403 D404 | R383-D400 IonicContact CZ-OD1 3.76Å; R383-D400 IonicContact NH1-OD1 3.66Å; R383-D400 PolarHBondContact NH1-OD1 3.45Å; R383-D400 IonicContact NH1-OD2 3.92Å; M396-D400 PolarHBondContact O-N 3.39Å; D400-G402 PolarHBondContact O-N 3.3Å; D400-S403 PolarHBondContact O-N 3.25Å; D400-S403 VanDerWaalsContact O-N 3.13Å; D400-D404 PolarHBondContact O-N 3.43Å |
| 401 | E | 51.3 | Low | 57.1 | Low | 147 Ų | 147 | 89.4 Ų | 89.4 | 69% | 0.687 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -59.3 | -29.7 | 173.6 | -72.5 | -171.8 | 146.5 | 0 | 0 | 112.4 | A405 | E401-A405 WeakPolarHBondContact O-CB 3.45Å; E401-A405 PolarHBondContact O-N 3.42Å |
| 402 | G | 52.8 | Low | 57.3 | Low | 40 Ų | 40 | 83.8 Ų | 83.8 | 41% | 0.412 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -71.8 | -37.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | D399 D400 E406 | D399-G402 PolarHBondContact O-N 3.08Å; D400-G402 PolarHBondContact O-N 3.3Å; G402-E406 VanDerWaalsContact O-CB 3.31Å; G402-E406 WeakPolarHBondContact O-CB 3.43Å; G402-E406 PolarHBondContact O-N 3.46Å |
| 403 | S | 54.9 | Low | 57.5 | Low | 71 Ų | 71 | 90.1 Ų | 90.1 | 50% | 0.497 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -69.9 | -41.8 | -178.4 | -179.3 | 0 | 0 | 0 | 0 | 112.1 | D399 D400 E406 R407 | D399-S403 PolarHBondContact O-N 3.49Å; D400-S403 PolarHBondContact O-N 3.25Å; D400-S403 VanDerWaalsContact O-N 3.13Å; S403-E406 PolarHBondContact O-N 3.35Å; S403-R407 PolarHBondContact O-N 3.07Å |
| 404 | D | 55.5 | Low | 57.2 | Low | 107 Ų | 107 | 89.3 Ų | 89.3 | 57% | 0.572 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -69.8 | -41 | 178.9 | -73 | -22.2 | 0 | 0 | 0 | 111.4 | D400 E406 R407 E408 | D400-D404 PolarHBondContact O-N 3.43Å; D404-E406 VanDerWaalsContact C-N 3.29Å; D404-E406 PolarHBondContact O-N 3.39Å; D404-R407 PolarHBondContact O-N 3.46Å; D404-E408 PolarHBondContact O-N 3.06Å |
| 405 | A | 57.1 | Low | 56.9 | Low | 42 Ų | 42 | 93.7 Ų | 93.7 | 35% | 0.347 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64 | -33 | 174 | 0 | 0 | 0 | 0 | 0 | 112.8 | E401 R409 | E401-A405 WeakPolarHBondContact O-CB 3.45Å; E401-A405 PolarHBondContact O-N 3.42Å; A405-R409 WeakPolarHBondContact O-CG 3.26Å; A405-R409 PolarHBondContact O-N 3.08Å; A405-R409 VanDerWaalsContact O-N 3.14Å |
| 406 | E | 61.5 | Low | 56.2 | Low | 37 Ų | 37 | 90.4 Ų | 90.4 | 17% | 0.173 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -69.9 | -40.4 | 174.4 | -172 | 176 | 124.5 | 0 | 0 | 111.8 | R182 R183 G402 S403 D404 R409 L410 | R182-E406 WeakPolarHBondContact CA-OE1 3.23Å; R182-E406 WeakPolarHBondContact CB-OE1 3.22Å; R182-E406 WeakPolarHBondContact CD-OE1 3.48Å; R182-E406 WeakPolarHBondContact CG-OE1 3.3Å; R182-E406 IonicContact NE-OE1 3Å; R183-E406 PolarHBondContact N-OE1 3.5Å; R183-E406 PolarHBondContact N-OE2 3Å; G402-E406 VanDerWaalsContact O-CB 3.31Å; G402-E406 WeakPolarHBondContact O-CB 3.43Å; G402-E406 PolarHBondContact O-N 3.46Å; S403-E406 PolarHBondContact O-N 3.35Å; D404-E406 VanDerWaalsContact C-N 3.29Å; D404-E406 PolarHBondContact O-N 3.39Å; E406-R409 WeakPolarHBondContact O-CB 3.28Å; E406-R409 PolarHBondContact O-N 3.36Å; E406-L410 PolarHBondContact O-N 2.92Å |
| 407 | R | 60.5 | Low | 55.3 | Low | 83 Ų | 83 | 94.5 Ų | 94.5 | 31% | 0.313 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.8 | -42.2 | 174 | -171.3 | 176.9 | 179.6 | 159.3 | 3.3 | 111.7 | K330 E331 S403 D404 R409 L410 L411 | K330-R407 PolarHBondContact O-NH2 3.04Å; E331-R407 VanDerWaalsContact O-CZ 3.27Å; E331-R407 PolarHBondContact O-NH1 3.45Å; E331-R407 PolarHBondContact O-NH2 2.91Å; S403-R407 PolarHBondContact O-N 3.07Å; D404-R407 PolarHBondContact O-N 3.46Å; R407-R409 VanDerWaalsContact C-N 3.33Å; R407-R409 PolarHBondContact O-N 2.89Å; R407-L410 PolarHBondContact O-N 3.49Å; R407-L411 WeakPolarHBondContact O-CG 3.5Å; R407-L411 PolarHBondContact O-N 3.49Å |
| 408 | E | 62.3 | Low | 54.6 | Low | 128 Ų | 128 | 94.6 Ų | 94.6 | 60% | 0.598 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.4 | -35.8 | 174.9 | -76.2 | -169.3 | 158.7 | 0 | 0 | 113 | D404 L411 N412 | D404-E408 PolarHBondContact O-N 3.06Å; E408-L411 PolarHBondContact O-N 3.16Å; E408-N412 WeakPolarHBondContact O-CB 3.39Å; E408-N412 PolarHBondContact O-N 3.35Å; E408-N412 PolarHBondContact O-ND2 2.71Å |
| 409 | R | 67.8 | Low | 53.8 | Low | 165 Ų | 165 | 93.1 Ų | 93.1 | 62% | 0.623 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.6 | -44.2 | 174.6 | -75.9 | 172.5 | -177.3 | -173.4 | 1.6 | 112.3 | A405 E406 R407 L411 N412 E413 | A405-R409 WeakPolarHBondContact O-CG 3.26Å; A405-R409 PolarHBondContact O-N 3.08Å; A405-R409 VanDerWaalsContact O-N 3.14Å; E406-R409 WeakPolarHBondContact O-CB 3.28Å; E406-R409 PolarHBondContact O-N 3.36Å; R407-R409 VanDerWaalsContact C-N 3.33Å; R407-R409 PolarHBondContact O-N 2.89Å; R409-L411 VanDerWaalsContact C-N 3.3Å; R409-L411 PolarHBondContact O-N 3.48Å; R409-N412 PolarHBondContact O-N 3.43Å; R409-N412 VanDerWaalsContact O-N 3.17Å; R409-E413 PolarHBondContact O-N 2.82Å |
| 410 | L | 61.8 | Low | 53 | Low | 31 Ų | 31 | 98.8 Ų | 98.8 | 16% | 0.162 | 53% | 0.529 | C | S | . | . | H | α-helix | trans | -62.5 | -38.4 | 177.4 | -71.2 | 172.8 | 0 | 0 | 0 | 112.1 | E406 R407 G414 | E406-L410 PolarHBondContact O-N 2.92Å; R407-L410 PolarHBondContact O-N 3.49Å; L410-G414 PolarHBondContact O-N 3.19Å |
| 411 | L | 62.3 | Low | 52.5 | Low | 83 Ų | 83 | 104 Ų | 104 | 44% | 0.435 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -67.5 | -36.2 | 175 | -67.9 | 170.8 | 0 | 0 | 0 | 112.2 | Y247 R407 E408 R409 | Y247-L411 HydrophobicContact CD1-CD2 4.3Å; R407-L411 WeakPolarHBondContact O-CG 3.5Å; R407-L411 PolarHBondContact O-N 3.49Å; E408-L411 PolarHBondContact O-N 3.16Å; R409-L411 VanDerWaalsContact C-N 3.3Å; R409-L411 PolarHBondContact O-N 3.48Å |
| 412 | N | 62 | Low | 52 | Low | 103 Ų | 103 | 107 Ų | 107 | 55% | 0.551 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -77.3 | -35.6 | -178.9 | -78.6 | -24.6 | 0 | 0 | 0 | 113.5 | E408 R409 G414 R415 | E408-N412 WeakPolarHBondContact O-CB 3.39Å; E408-N412 PolarHBondContact O-N 3.35Å; E408-N412 PolarHBondContact O-ND2 2.71Å; R409-N412 PolarHBondContact O-N 3.43Å; R409-N412 VanDerWaalsContact O-N 3.17Å; N412-G414 PolarHBondContact O-N 3.21Å; N412-R415 PolarHBondContact O-N 2.97Å |
| 413 | E | 60 | Low | 52 | Low | 167 Ų | 167 | 110.4 Ų | 110.4 | 78% | 0.78 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -66.7 | -21.5 | 172.2 | -79.2 | -168.8 | 159.7 | 0 | 0 | 113.1 | R409 | R409-E413 PolarHBondContact O-N 2.82Å |
| 414 | G | 47.9 | Very low | 51.8 | Low | 19 Ų | 19 | 112.4 Ų | 112.4 | 20% | 0.196 | 60% | 0.599 | C | S | . | * | H | α-helix | trans | -78.3 | -21.4 | 176 | 0 | 0 | 0 | 0 | 0 | 114.5 | L410 N412 V416 | L410-G414 PolarHBondContact O-N 3.19Å; N412-G414 PolarHBondContact O-N 3.21Å; G414-V416 PolarHBondContact O-N 3.39Å |
| 415 | R | 44.8 | Very low | 51.6 | Low | 199 Ų | 199 | 112.7 Ų | 112.7 | 75% | 0.751 | 60% | 0.601 | S | S | * | * | trans | -85.7 | 91.5 | 175.2 | -72.5 | -177.2 | -176.9 | 176.2 | 2.2 | 109.5 | N412 | N412-R415 PolarHBondContact O-N 2.97Š| ||
| 416 | V | 42.9 | Very low | 51.3 | Low | 123 Ų | 123 | 116.9 Ų | 116.9 | 75% | 0.745 | 62% | 0.616 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 125.6 | 159.3 | -178.5 | 0 | 0 | 0 | 0 | 106.8 | G414 A418 | G414-V416 PolarHBondContact O-N 3.39Å; V416-A418 PolarHBondContact O-N 3.44Å; V416-A418 VanDerWaalsContact O-N 3.13Å |
| 417 | P | 39.6 | Very low | 50.7 | Low | 111 Ų | 111 | 121.9 Ų | 121.9 | 72% | 0.721 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 122.5 | 174.1 | 23.6 | -29.6 | 0 | 0 | 0 | 107.4 | S419 | P417-S419 PolarHBondContact O-N 2.86Š|
| 418 | A | 37.7 | Very low | 50 | Low | 96 Ų | 96 | 124.5 Ų | 124.5 | 79% | 0.793 | 67% | 0.665 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 116.7 | 165.8 | 0 | 0 | 0 | 0 | 0 | 106.3 | V416 E420 | V416-A418 PolarHBondContact O-N 3.44Å; V416-A418 VanDerWaalsContact O-N 3.13Å; A418-E420 PolarHBondContact O-N 3.08Å |
| 419 | S | 38.7 | Very low | 49.2 | Very low | 94 Ų | 94 | 124.2 Ų | 124.2 | 66% | 0.657 | 67% | 0.67 | S | S | * | * | trans | -55.4 | 110.5 | 171.2 | 43.7 | 0 | 0 | 0 | 0 | 107.7 | P417 D421 | P417-S419 PolarHBondContact O-N 2.86Å; S419-D421 VanDerWaalsContact C-N 3.28Å; S419-D421 PolarHBondContact O-N 3.12Å | ||
| 420 | E | 39 | Very low | 47.7 | Very low | 188 Ų | 188 | 121.1 Ų | 121.1 | 88% | 0.879 | 67% | 0.674 | S | S | * | * | trans | -65.1 | 96.8 | 157.7 | -74.7 | -177.1 | 143.5 | 0 | 0 | 106.2 | A418 T422 | A418-E420 PolarHBondContact O-N 3.08Å; E420-T422 PolarHBondContact O-N 3.08Å | ||
| 421 | D | 43 | Very low | 46.5 | Very low | 150 Ų | 150 | 128.6 Ų | 128.6 | 80% | 0.802 | 72% | 0.717 | S | S | * | * | trans | -71.3 | 105.1 | 166.5 | -76.3 | -26.3 | 0 | 0 | 0 | 107.9 | S419 | S419-D421 VanDerWaalsContact C-N 3.28Å; S419-D421 PolarHBondContact O-N 3.12Å | ||
| 422 | T | 40.6 | Very low | 45.1 | Very low | 210 Ų | 210 | 132.7 Ų | 132.7 | 100% | 1.288 | 74% | 0.742 | S | S | * | * | trans | -70.3 | 0 | 158.9 | 36.7 | 0 | 0 | 0 | 0 | 112.4 | E420 | E420-T422 PolarHBondContact O-N 3.08Š|
Retrieved 422 of 422 residues in 227 ms
(Link to these results)