| 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 | 38.6 | Very low | 46.1 | Very low | 243 Ų | 243 | 147.6 Ų | 147.6 | 100% | 1.197 | 77% | 0.768 | S | S | * | * | 0 | 125.6 | 0 | -65.5 | 171.8 | 178.4 | 0 | 0 | 107.7 | |||||
| 2 | T | 38 | Very low | 46.3 | Very low | 143 Ų | 143 | 138.8 Ų | 138.8 | 88% | 0.877 | 73% | 0.733 | S | S | * | * | trans | -134.6 | 105.6 | -178.5 | 35.5 | 0 | 0 | 0 | 0 | 109.2 | S4 | T2-S4 PolarHBondContact O-N 2.68Š| ||
| 3 | T | 43.7 | Very low | 46.1 | Very low | 129 Ų | 129 | 134.2 Ų | 134.2 | 79% | 0.791 | 71% | 0.709 | S | S | * | * | trans | -82.2 | 104.6 | -176.9 | 38.2 | 0 | 0 | 0 | 0 | 110.6 | L5 | T3-L5 PolarHBondContact O-N 2.99Å; T3-L5 VanDerWaalsContact O-N 3.08Å | ||
| 4 | S | 37.1 | Very low | 46.7 | Very low | 112 Ų | 112 | 131.1 Ų | 131.1 | 78% | 0.783 | 70% | 0.698 | S | S | * | * | trans | -72.8 | 101 | 176.6 | -165.9 | 0 | 0 | 0 | 0 | 110.4 | T2 V6 | T2-S4 PolarHBondContact O-N 2.68Å; S4-V6 PolarHBondContact O-N 3Å; S4-V6 VanDerWaalsContact O-N 3.08Å | ||
| 5 | L | 49.2 | Very low | 47.3 | Very low | 151 Ų | 151 | 127.9 Ų | 127.9 | 79% | 0.791 | 68% | 0.68 | S | S | * | * | trans | -73.8 | 97.9 | 178 | -69.8 | 177 | 0 | 0 | 0 | 110.5 | T3 L7 | T3-L5 PolarHBondContact O-N 2.99Å; T3-L5 VanDerWaalsContact O-N 3.08Å; L5-L7 PolarHBondContact O-N 3.16Å | ||
| 6 | V | 49.8 | Very low | 47.9 | Very low | 113 Ų | 113 | 128.3 Ų | 128.3 | 69% | 0.685 | 68% | 0.68 | S | S | * | * | trans | -65.1 | 98.7 | 173 | -179.6 | 0 | 0 | 0 | 0 | 109.3 | S4 H8 | S4-V6 PolarHBondContact O-N 3Å; S4-V6 VanDerWaalsContact O-N 3.08Å; V6-H8 PolarHBondContact O-CD2 3.23Å; V6-H8 PolarHBondContact O-N 3.28Å | ||
| 7 | L | 48.5 | Very low | 47.9 | Very low | 162 Ų | 162 | 131.8 Ų | 131.8 | 85% | 0.848 | 68% | 0.683 | S | S | * | * | trans | -70.4 | 90.3 | 175.4 | -78.6 | 169.8 | 0 | 0 | 0 | 110.7 | L5 P9 | L5-L7 PolarHBondContact O-N 3.16Å; L7-P9 WeakPolarHBondContact O-CD 3.5Å | ||
| 8 | H | 50.7 | Low | 48.3 | Very low | 145 Ų | 145 | 130.4 Ų | 130.4 | 67% | 0.671 | 68% | 0.681 | S | S | * | * | trans | -56.7 | 122.6 | 173.8 | -83.5 | -101.9 | 0 | 0 | 0 | 111.2 | V6 R10 | V6-H8 PolarHBondContact O-CD2 3.23Å; V6-H8 PolarHBondContact O-N 3.28Å; H8-R10 PolarHBondContact O-N 3.46Å; H8-R10 VanDerWaalsContact O-N 3.08Å | ||
| 9 | P | 50.6 | Low | 48.2 | Very low | 73 Ų | 73 | 134 Ų | 134 | 47% | 0.474 | 69% | 0.686 | S | S | . | * | trans | -69.4 | 107 | 178.5 | -22.4 | 35.4 | 0 | 0 | 0 | 111.7 | L7 W11 A12 | L7-P9 WeakPolarHBondContact O-CD 3.5Å; P9-W11 HydrophobicContact CB-CG 4.48Å; P9-W11 VanDerWaalsContact CB-NE1 3.28Å; P9-W11 PolarHBondContact O-N 2.98Å; P9-A12 PolarHBondContact O-N 3.28Å | ||
| 10 | R | 52.5 | Low | 47.9 | Very low | 206 Ų | 206 | 135.4 Ų | 135.4 | 78% | 0.777 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.9 | 3.5 | -174.5 | -53.1 | -169.3 | 73 | 172 | 4.5 | 116.9 | H8 D13 T14 | H8-R10 PolarHBondContact O-N 3.46Å; H8-R10 VanDerWaalsContact O-N 3.08Å; R10-D13 WeakPolarHBondContact CA-OD2 3.38Å; R10-T14 PolarHBondContact O-OG1 3.49Å |
| 11 | W | 48.6 | Very low | 47.6 | Very low | 147 Ų | 147 | 137.8 Ų | 137.8 | 56% | 0.557 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -80.5 | -18.8 | 167.9 | 66.2 | -99.2 | 0 | 0 | 0 | 112.8 | P9 L15 F294 | P9-W11 HydrophobicContact CB-CG 4.48Å; P9-W11 VanDerWaalsContact CB-NE1 3.28Å; P9-W11 PolarHBondContact O-N 2.98Å; W11-L15 HydrophobicContact CE3-CD1 3.88Å; W11-L15 HydrophobicContact CZ3-CD1 3.85Å; W11-F294 AromaticContact CH2-CE1 3.78Å; W11-F294 HydrophobicContact CH2-CE1 3.78Å; W11-F294 HydrophobicContact CH2-CZ 4.36Å; W11-F294 AromaticContact CZ3-CE1 3.84Å; W11-F294 HydrophobicContact CZ3-CE1 3.84Å; W11-F294 HydrophobicContact CZ3-CZ 4.01Å |
| 12 | A | 47.9 | Very low | 47.4 | Very low | 41 Ų | 41 | 130.5 Ų | 130.5 | 34% | 0.339 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -67.2 | -49.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | P9 T14 L15 M16 | P9-A12 PolarHBondContact O-N 3.28Å; A12-T14 PolarHBondContact O-N 3.26Å; A12-L15 WeakPolarHBondContact O-CB 3.47Å; A12-L15 PolarHBondContact O-N 3.42Å; A12-M16 PolarHBondContact O-N 3.12Å; A12-M16 VanDerWaalsContact O-N 3.16Å |
| 13 | D | 44.4 | Very low | 47.7 | Very low | 79 Ų | 79 | 129.4 Ų | 129.4 | 42% | 0.422 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -52.5 | -41.3 | 179.4 | -35 | -27.6 | 0 | 0 | 0 | 111.6 | R10 L15 M16 Y17 | R10-D13 WeakPolarHBondContact CA-OD2 3.38Å; D13-L15 VanDerWaalsContact C-N 3.25Å; D13-L15 PolarHBondContact O-N 3.05Å; D13-M16 PolarHBondContact O-N 3.34Å; D13-Y17 PolarHBondContact O-N 3.09Å |
| 14 | T | 54.2 | Low | 47.5 | Very low | 92 Ų | 92 | 129.9 Ų | 129.9 | 56% | 0.564 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -65.1 | -26.6 | 179.6 | -52.2 | 0 | 0 | 0 | 0 | 112.8 | R10 A12 V18 | R10-T14 PolarHBondContact O-OG1 3.49Å; A12-T14 PolarHBondContact O-N 3.26Å; T14-V18 WeakPolarHBondContact O-CG2 3.38Å |
| 15 | L | 55.6 | Low | 47.6 | Very low | 82 Ų | 82 | 133 Ų | 133 | 43% | 0.429 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -84.7 | -37.3 | 176.4 | -66.4 | 174 | 0 | 0 | 0 | 111.8 | W11 A12 D13 V18 Y19 | W11-L15 HydrophobicContact CE3-CD1 3.88Å; W11-L15 HydrophobicContact CZ3-CD1 3.85Å; A12-L15 WeakPolarHBondContact O-CB 3.47Å; A12-L15 PolarHBondContact O-N 3.42Å; D13-L15 VanDerWaalsContact C-N 3.25Å; D13-L15 PolarHBondContact O-N 3.05Å; L15-V18 PolarHBondContact O-N 3.45Å; L15-Y19 PolarHBondContact O-N 3.45Å; L15-Y19 VanDerWaalsContact O-N 3.17Å |
| 16 | M | 56.7 | Low | 47.2 | Very low | 135 Ų | 135 | 132.3 Ų | 132.3 | 67% | 0.665 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -61.6 | -47.7 | 174.9 | -65.5 | -59 | -65.9 | 0 | 0 | 111.1 | A12 D13 V18 Y19 E20 | A12-M16 PolarHBondContact O-N 3.12Å; A12-M16 VanDerWaalsContact O-N 3.16Å; D13-M16 PolarHBondContact O-N 3.34Å; M16-V18 PolarHBondContact O-N 2.85Å; M16-V18 VanDerWaalsContact O-N 3.1Å; M16-Y19 PolarHBondContact O-N 2.91Å; M16-E20 PolarHBondContact O-N 3.36Å |
| 17 | Y | 47.7 | Very low | 46.6 | Very low | 187 Ų | 187 | 133.4 Ų | 133.4 | 73% | 0.733 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -64.4 | -17.2 | -179.3 | -136.3 | -88.8 | 0 | 0 | 0 | 114.4 | D13 | D13-Y17 PolarHBondContact O-N 3.09Å |
| 18 | V | 56.3 | Low | 46.8 | Very low | 108 Ų | 108 | 131.1 Ų | 131.1 | 66% | 0.655 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -91.6 | -26.6 | 173.8 | 171.9 | 0 | 0 | 0 | 0 | 111.6 | T14 L15 M16 | T14-V18 WeakPolarHBondContact O-CG2 3.38Å; L15-V18 PolarHBondContact O-N 3.45Å; M16-V18 PolarHBondContact O-N 2.85Å; M16-V18 VanDerWaalsContact O-N 3.1Å |
| 19 | Y | 45.6 | Very low | 46.5 | Very low | 198 Ų | 198 | 130.9 Ų | 130.9 | 78% | 0.776 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -81.3 | -34.7 | 178 | -155.5 | -99.9 | 0 | 0 | 0 | 112.5 | L15 M16 K21 | L15-Y19 PolarHBondContact O-N 3.45Å; L15-Y19 VanDerWaalsContact O-N 3.17Å; M16-Y19 PolarHBondContact O-N 2.91Å; Y19-K21 VanDerWaalsContact C-N 3.32Å; Y19-K21 PolarHBondContact O-N 3.17Å |
| 20 | E | 43.3 | Very low | 46 | Very low | 161 Ų | 161 | 137.1 Ų | 137.1 | 75% | 0.752 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -67.9 | -29.6 | -179.8 | -163.2 | 174.8 | -162 | 0 | 0 | 112.9 | M16 S22 | M16-E20 PolarHBondContact O-N 3.36Å; E20-S22 VanDerWaalsContact C-N 3.32Å; E20-S22 PolarHBondContact O-N 3.43Å; E20-S22 VanDerWaalsContact O-N 3.17Å |
| 21 | K | 40.8 | Very low | 45.5 | Very low | 187 Ų | 187 | 135 Ų | 135 | 81% | 0.813 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -91.5 | 53.7 | -179 | -160.1 | 168.6 | -176.4 | 165.6 | 0 | 113.4 | Y19 | Y19-K21 VanDerWaalsContact C-N 3.32Å; Y19-K21 PolarHBondContact O-N 3.17Å |
| 22 | S | 34.3 | Very low | 45.1 | Very low | 90 Ų | 90 | 136.9 Ų | 136.9 | 63% | 0.629 | 70% | 0.7 | S | S | * | * | trans | -142.6 | 84.5 | 173.3 | -171.1 | 0 | 0 | 0 | 0 | 111.5 | E20 N24 | E20-S22 VanDerWaalsContact C-N 3.32Å; E20-S22 PolarHBondContact O-N 3.43Å; E20-S22 VanDerWaalsContact O-N 3.17Å; S22-N24 PolarHBondContact O-N 3Å | ||
| 23 | P | 44.8 | Very low | 44.5 | Very low | 119 Ų | 119 | 141 Ų | 141 | 77% | 0.773 | 72% | 0.721 | S | S | * | * | trans | -61.6 | 130.3 | 171.2 | 27.3 | -33.5 | 0 | 0 | 0 | 109.9 | E25 | P23-E25 PolarHBondContact O-N 3.34Š| ||
| 24 | N | 39.8 | Very low | 44.6 | Very low | 139 Ų | 139 | 146.1 Ų | 146.1 | 74% | 0.743 | 74% | 0.744 | S | S | * | * | trans | -87.5 | 102.5 | -179.9 | 172 | 66.4 | 0 | 0 | 0 | 109.9 | S22 | S22-N24 PolarHBondContact O-N 3Š| ||
| 25 | E | 38.3 | Very low | 43.9 | Very low | 179 Ų | 179 | 150.7 Ų | 150.7 | 84% | 0.836 | 76% | 0.759 | S | S | * | * | trans | -115.4 | 115.8 | 171.5 | -92.6 | -58.5 | 147.7 | 0 | 0 | 110.2 | P23 | P23-E25 PolarHBondContact O-N 3.34Š| ||
| 26 | N | 41.5 | Very low | 42.9 | Very low | 136 Ų | 136 | 150 Ų | 150 | 73% | 0.727 | 77% | 0.772 | S | S | * | * | trans | -163.3 | 81.9 | -166.9 | -164.2 | 19.8 | 0 | 0 | 0 | 112.2 | ||||
| 27 | N | 36.8 | Very low | 42.1 | Very low | 136 Ų | 136 | 152.1 Ų | 152.1 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | trans | -175.7 | 117.1 | 146.4 | -168.8 | 1.4 | 0 | 0 | 0 | 112.2 | N29 | N27-N29 PolarHBondContact O-N 3.04Š| ||
| 28 | P | 53.5 | Low | 41.4 | Very low | 114 Ų | 114 | 148.8 Ų | 148.8 | 74% | 0.74 | 79% | 0.789 | S | S | * | * | trans | -89.8 | 95.3 | 171.4 | 34.1 | -30.4 | 0 | 0 | 0 | 111.9 | ||||
| 29 | N | 43.3 | Very low | 40.4 | Very low | 139 Ų | 139 | 146.4 Ų | 146.4 | 74% | 0.743 | 79% | 0.786 | S | S | * | * | trans | -174.6 | 114.3 | 154.5 | -104 | -43 | 0 | 0 | 0 | 113.6 | N27 | N27-N29 PolarHBondContact O-N 3.04Š| ||
| 30 | K | 40.8 | Very low | 40 | Very low | 205 Ų | 205 | 144.7 Ų | 144.7 | 89% | 0.891 | 79% | 0.791 | S | S | * | * | trans | -175.5 | 123 | 146.2 | -106.2 | 159.4 | -174.6 | 177.9 | 0 | 110.2 | ||||
| 31 | N | 41.7 | Very low | 39.8 | Very low | 160 Ų | 160 | 143.2 Ų | 143.2 | 86% | 0.856 | 80% | 0.796 | S | S | * | * | trans | -80.8 | 131.5 | 171.4 | -63.3 | -20.5 | 0 | 0 | 0 | 109.3 | ||||
| 32 | Q | 40.7 | Very low | 40 | Very low | 188 Ų | 188 | 140.5 Ų | 140.5 | 88% | 0.879 | 80% | 0.798 | S | S | * | * | trans | -133.3 | 116.5 | 158.8 | -86.3 | -175.6 | -21.4 | 0 | 0 | 110.4 | ||||
| 33 | T | 35.1 | Very low | 40.3 | Very low | 127 Ų | 127 | 140.6 Ų | 140.6 | 78% | 0.779 | 80% | 0.804 | S | S | * | * | trans | 7.5 | 126.5 | 149.1 | -41.7 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 34 | M | 46 | Very low | 40.1 | Very low | 186 Ų | 186 | 141.6 Ų | 141.6 | 92% | 0.916 | 81% | 0.808 | S | S | * | * | trans | -73.9 | 124.6 | 158.5 | -68.2 | -157.7 | -55.1 | 0 | 0 | 110 | ||||
| 35 | E | 38.5 | Very low | 40.1 | Very low | 189 Ų | 189 | 142.5 Ų | 142.5 | 88% | 0.883 | 81% | 0.808 | S | S | * | * | trans | -82.6 | 163.3 | 156.2 | -62.2 | -170.3 | 144.9 | 0 | 0 | 109.8 | ||||
| 36 | G | 36.5 | Very low | 40 | Very low | 67 Ų | 67 | 139.3 Ų | 139.3 | 69% | 0.691 | 80% | 0.804 | S | S | * | * | trans | -161.4 | -171.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 37 | L | 38 | Very low | 40 | Very low | 179 Ų | 179 | 142.4 Ų | 142.4 | 94% | 0.937 | 81% | 0.805 | S | S | * | * | trans | 80.9 | 142 | -177.5 | -52.6 | 174 | 0 | 0 | 0 | 116.5 | ||||
| 38 | S | 33.6 | Very low | 40.1 | Very low | 118 Ų | 118 | 141.8 Ų | 141.8 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | trans | 56.8 | 128.3 | 172.4 | -131.9 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 39 | G | 36.5 | Very low | 39.5 | Very low | 57 Ų | 57 | 144.7 Ų | 144.7 | 59% | 0.588 | 81% | 0.81 | S | S | * | * | cis | 106 | 104.3 | 4.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 40 | N | 35.7 | Very low | 39.7 | Very low | 163 Ų | 163 | 146.9 Ų | 146.9 | 87% | 0.872 | 82% | 0.818 | S | S | * | * | trans | 171.3 | 125.7 | 138.9 | -89.9 | -5.6 | 0 | 0 | 0 | 110.4 | ||||
| 41 | C | 38.8 | Very low | 39.4 | Very low | 129 Ų | 129 | 142.8 Ų | 142.8 | 87% | 0.872 | 82% | 0.815 | S | S | * | * | trans | -99.3 | 153.3 | 158.3 | -56.9 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 42 | P | 46.9 | Very low | 39.5 | Very low | 131 Ų | 131 | 144.3 Ų | 144.3 | 85% | 0.851 | 82% | 0.817 | S | S | * | * | trans | -113.8 | 141.4 | 139.1 | 33.7 | -28.5 | 0 | 0 | 0 | 110.1 | ||||
| 43 | A | 40.2 | Very low | 39.9 | Very low | 91 Ų | 91 | 141.5 Ų | 141.5 | 75% | 0.752 | 82% | 0.815 | S | S | * | * | trans | -98 | 161.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 44 | T | 40.8 | Very low | 40.2 | Very low | 140 Ų | 140 | 138.5 Ų | 138.5 | 86% | 0.859 | 81% | 0.81 | S | S | * | * | trans | -165 | 138.6 | 135 | 26.7 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 45 | H | 38.3 | Very low | 40 | Very low | 159 Ų | 159 | 138.6 Ų | 138.6 | 74% | 0.736 | 81% | 0.813 | S | S | * | * | trans | 85.8 | 153.7 | 147.9 | -129.7 | -98.5 | 0 | 0 | 0 | 121.7 | ||||
| 46 | C | 37.2 | Very low | 39.7 | Very low | 112 Ų | 112 | 133.3 Ų | 133.3 | 76% | 0.757 | 81% | 0.809 | S | S | * | * | trans | 62 | 84.3 | -179.7 | -58.7 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 47 | R | 40.8 | Very low | 39.7 | Very low | 201 Ų | 201 | 141.6 Ų | 141.6 | 76% | 0.758 | 82% | 0.819 | S | S | * | * | cis | 90.8 | 117 | 31.6 | -158.3 | -157.4 | 168.3 | 135.1 | 6.9 | 114.3 | ||||
| 48 | D | 39.8 | Very low | 39.9 | Very low | 122 Ų | 122 | 141.9 Ų | 141.9 | 65% | 0.652 | 82% | 0.816 | S | S | * | * | trans | 62.7 | 145.8 | 168 | -54.7 | -28.3 | 0 | 0 | 0 | 116.6 | ||||
| 49 | L | 41.3 | Very low | 40.2 | Very low | 175 Ų | 175 | 142 Ų | 142 | 92% | 0.916 | 82% | 0.816 | S | S | * | * | cis | -131.6 | 163.2 | 25.4 | -74.1 | 160.4 | 0 | 0 | 0 | 114.8 | ||||
| 50 | M | 46.5 | Very low | 40.1 | Very low | 185 Ų | 185 | 142.1 Ų | 142.1 | 91% | 0.911 | 82% | 0.818 | S | S | * | * | trans | -108 | 140.1 | 176.4 | -98.6 | 154.5 | 40.4 | 0 | 0 | 112.3 | ||||
| 51 | S | 33.5 | Very low | 40.1 | Very low | 119 Ų | 119 | 140.8 Ų | 140.8 | 83% | 0.832 | 82% | 0.816 | S | S | * | * | trans | -167.8 | 105.6 | 151.1 | 49.6 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 52 | H | 44.2 | Very low | 40.1 | Very low | 192 Ų | 192 | 142 Ų | 142 | 89% | 0.889 | 81% | 0.812 | S | S | * | * | trans | -126.1 | 145.6 | 149 | -75.6 | -41.2 | 0 | 0 | 0 | 105.9 | ||||
| 53 | P | 50 | Low | 39.6 | Very low | 130 Ų | 130 | 140.4 Ų | 140.4 | 84% | 0.844 | 81% | 0.81 | S | S | * | * | -133.4 | -167.6 | 61.2 | 21.9 | 3.2 | 0 | 0 | 0 | 112.3 | |||||
| 54 | G | 40.3 | Very low | 39.7 | Very low | 64 Ų | 64 | 142.7 Ų | 142.7 | 66% | 0.66 | 82% | 0.815 | S | S | * | * | cis | 132.8 | 142.1 | -6.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 55 | L | 42.9 | Very low | 39.4 | Very low | 187 Ų | 187 | 144.8 Ų | 144.8 | 98% | 0.979 | 81% | 0.814 | S | S | * | * | trans | 90.7 | 147.7 | 169.8 | -52.2 | 178.1 | 0 | 0 | 0 | 120.7 | ||||
| 56 | G | 32.7 | Very low | 39.3 | Very low | 78 Ų | 78 | 145.5 Ų | 145.5 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | trans | 93.3 | 106.6 | 169.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 57 | R | 34.7 | Very low | 39.1 | Very low | 241 Ų | 241 | 143.9 Ų | 143.9 | 91% | 0.909 | 82% | 0.82 | S | S | * | * | cis | 98.6 | 96.7 | 21.6 | -163.5 | -170 | -167.8 | -121.3 | 3.3 | 115.9 | ||||
| 58 | H | 42.6 | Very low | 38.8 | Very low | 186 Ų | 186 | 139 Ų | 139 | 86% | 0.861 | 82% | 0.817 | S | S | * | * | trans | -172 | 177.4 | 141.6 | 58.6 | -89.8 | 0 | 0 | 0 | 110 | ||||
| 59 | S | 40.2 | Very low | 38.5 | Very low | 119 Ų | 119 | 140.7 Ų | 140.7 | 83% | 0.832 | 82% | 0.823 | S | S | * | * | -173.7 | 146.9 | -65.3 | -165.5 | 0 | 0 | 0 | 0 | 109 | |||||
| 60 | G | 34.9 | Very low | 38.3 | Very low | 61 Ų | 61 | 142.1 Ų | 142.1 | 63% | 0.629 | 82% | 0.817 | S | S | * | * | trans | 113.4 | 114.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 61 | T | 36.2 | Very low | 37.9 | Very low | 134 Ų | 134 | 137.2 Ų | 137.2 | 82% | 0.822 | 80% | 0.802 | S | S | * | * | cis | 67.9 | 119.5 | 40.2 | -27.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 62 | I | 38.5 | Very low | 37.8 | Very low | 156 Ų | 156 | 138 Ų | 138 | 80% | 0.8 | 80% | 0.797 | S | S | * | * | -158.2 | 128.7 | 60.2 | -76.1 | 168.3 | 0 | 0 | 0 | 107.3 | |||||
| 63 | A | 36.6 | Very low | 37.6 | Very low | 97 Ų | 97 | 136 Ų | 136 | 80% | 0.802 | 79% | 0.79 | S | S | * | * | 80.7 | 158 | 81.3 | 0 | 0 | 0 | 0 | 0 | 117.3 | |||||
| 64 | T | 41.5 | Very low | 36.8 | Very low | 139 Ų | 139 | 135.3 Ų | 135.3 | 85% | 0.853 | 79% | 0.789 | S | S | * | * | trans | -107 | 144 | -161.2 | -33.3 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 65 | H | 34.4 | Very low | 36.8 | Very low | 183 Ų | 183 | 137.2 Ų | 137.2 | 85% | 0.847 | 79% | 0.792 | S | S | * | * | trans | -159.8 | 171.7 | 147.9 | -149 | -105.2 | 0 | 0 | 0 | 114.8 | ||||
| 66 | Q | 36.9 | Very low | 37.3 | Very low | 174 Ų | 174 | 133.7 Ų | 133.7 | 81% | 0.813 | 78% | 0.781 | S | S | * | * | trans | -113.5 | 154.1 | 173.3 | -62.2 | -172 | 49.6 | 0 | 0 | 112.7 | ||||
| 67 | G | 32.1 | Very low | 37.3 | Very low | 79 Ų | 79 | 136.4 Ų | 136.4 | 81% | 0.814 | 78% | 0.777 | S | S | * | * | trans | 66.6 | 177.6 | 161.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 68 | S | 35.4 | Very low | 37.4 | Very low | 98 Ų | 98 | 130.9 Ų | 130.9 | 69% | 0.685 | 77% | 0.77 | S | S | * | * | cis | -167.3 | 162.3 | -17.2 | -164.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 69 | M | 34 | Very low | 37 | Very low | 157 Ų | 157 | 125.5 Ų | 125.5 | 77% | 0.773 | 77% | 0.765 | S | S | * | * | trans | 65.5 | 152.1 | 177 | -50.8 | -60.8 | 158.5 | 0 | 0 | 114.5 | ||||
| 70 | Y | 35.5 | Very low | 36.8 | Very low | 205 Ų | 205 | 131.8 Ų | 131.8 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | cis | -148.8 | 168.1 | 1.3 | -138.1 | -154.1 | 0 | 0 | 0 | 107.3 | ||||
| 71 | S | 38.4 | Very low | 36.8 | Very low | 83 Ų | 83 | 137.8 Ų | 137.8 | 58% | 0.58 | 78% | 0.782 | S | S | * | * | cis | -129.7 | -138.9 | 11.6 | -55.1 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 72 | D | 32.3 | Very low | 36.8 | Very low | 136 Ų | 136 | 137 Ų | 137 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | cis | -155.7 | -170.7 | -0.7 | -141 | -70.6 | 0 | 0 | 0 | 111.8 | ||||
| 73 | I | 38.9 | Very low | 37.2 | Very low | 148 Ų | 148 | 135.2 Ų | 135.2 | 76% | 0.759 | 78% | 0.779 | S | S | * | * | trans | -75.1 | 132.7 | -171.8 | -63.7 | 160.7 | 0 | 0 | 0 | 111.6 | ||||
| 74 | S | 33.6 | Very low | 37.1 | Very low | 116 Ų | 116 | 135 Ų | 135 | 81% | 0.811 | 78% | 0.778 | S | S | * | * | -161.6 | -179.6 | 60.6 | -155.6 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 75 | S | 39.7 | Very low | 37.6 | Very low | 104 Ų | 104 | 134.1 Ų | 134.1 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | trans | -131.5 | 176.2 | -174.1 | -151.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 76 | P | 54.9 | Low | 37.7 | Very low | 114 Ų | 114 | 134.2 Ų | 134.2 | 74% | 0.74 | 78% | 0.775 | S | S | * | * | cis | -124.4 | -151.1 | -7.2 | 38.1 | -15.7 | 0 | 0 | 0 | 110.6 | ||||
| 77 | D | 32.8 | Very low | 37.7 | Very low | 134 Ų | 134 | 131.7 Ų | 131.7 | 72% | 0.717 | 77% | 0.772 | S | S | * | * | cis | -157.5 | 165.4 | -0.5 | -160.3 | 7.8 | 0 | 0 | 0 | 112.5 | ||||
| 78 | T | 35.5 | Very low | 37.8 | Very low | 126 Ų | 126 | 133 Ų | 133 | 77% | 0.773 | 77% | 0.768 | S | S | * | * | trans | 62.8 | 140.6 | 168 | 72.2 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 79 | G | 35 | Very low | 37.8 | Very low | 73 Ų | 73 | 133.5 Ų | 133.5 | 75% | 0.753 | 77% | 0.772 | S | S | * | * | cis | 126.3 | 78.6 | -8.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 80 | R | 36.2 | Very low | 38 | Very low | 250 Ų | 250 | 131.4 Ų | 131.4 | 94% | 0.943 | 77% | 0.773 | S | S | * | * | trans | -143.1 | 120.2 | 169 | -73.7 | -165.8 | 175.3 | -87.7 | -6.1 | 113.9 | ||||
| 81 | Q | 33.8 | Very low | 38.3 | Very low | 187 Ų | 187 | 128 Ų | 128 | 87% | 0.874 | 78% | 0.776 | S | S | * | * | trans | -91.3 | 152.8 | 164.7 | -164.5 | 80.9 | -1.7 | 0 | 0 | 109.3 | ||||
| 82 | C | 36.6 | Very low | 38.3 | Very low | 118 Ų | 118 | 129 Ų | 129 | 80% | 0.797 | 78% | 0.783 | S | S | * | * | trans | -73.2 | 160.5 | 168 | -52.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 83 | P | 48.3 | Very low | 38.5 | Very low | 119 Ų | 119 | 131.2 Ų | 131.2 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | -152.3 | 163.4 | 93.3 | 40 | -23.3 | 0 | 0 | 0 | 117.5 | |||||
| 84 | A | 34.3 | Very low | 38.3 | Very low | 93 Ų | 93 | 129.3 Ų | 129.3 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | trans | 64 | 149.6 | 150.5 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 85 | P | 51.9 | Low | 38.5 | Very low | 120 Ų | 120 | 135 Ų | 135 | 78% | 0.779 | 80% | 0.799 | S | S | * | * | trans | -93.8 | 158.1 | 176.9 | 37.7 | -34.9 | 0 | 0 | 0 | 113.7 | ||||
| 86 | Q | 35.2 | Very low | 38.1 | Very low | 185 Ų | 185 | 133.2 Ų | 133.2 | 86% | 0.864 | 80% | 0.797 | S | S | * | * | trans | -136.4 | 164.7 | 168.7 | -81.2 | -66.4 | -9.8 | 0 | 0 | 110.6 | ||||
| 87 | T | 36.4 | Very low | 37.5 | Very low | 121 Ų | 121 | 137.7 Ų | 137.7 | 74% | 0.742 | 80% | 0.801 | S | S | * | * | trans | -109.4 | 162.6 | -162.7 | 54.2 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 88 | S | 36.1 | Very low | 38.6 | Very low | 106 Ų | 106 | 136.6 Ų | 136.6 | 74% | 0.741 | 80% | 0.801 | S | S | * | * | trans | 88.6 | 157 | 152 | 84.1 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 89 | S | 35.5 | Very low | 39 | Very low | 108 Ų | 108 | 140.3 Ų | 140.3 | 76% | 0.755 | 81% | 0.807 | S | S | * | * | trans | 85.7 | 111.4 | 159.1 | -48.8 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 90 | S | 37.7 | Very low | 38.8 | Very low | 114 Ų | 114 | 140.7 Ų | 140.7 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | trans | -50.4 | 172.3 | 168.2 | -37.5 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 91 | P | 42.2 | Very low | 39 | Very low | 133 Ų | 133 | 134.3 Ų | 134.3 | 86% | 0.864 | 80% | 0.796 | S | S | * | * | -121.5 | 172.5 | 108.6 | 36.4 | -35.6 | 0 | 0 | 0 | 114 | |||||
| 92 | S | 37.1 | Very low | 39.7 | Very low | 105 Ų | 105 | 130.9 Ų | 130.9 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | trans | -99.6 | 149.5 | -167.6 | 49.9 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 93 | L | 36.6 | Very low | 40 | Very low | 182 Ų | 182 | 133.8 Ų | 133.8 | 95% | 0.953 | 79% | 0.785 | S | S | * | * | trans | -131.2 | 153.4 | 144.6 | -75.1 | 178.5 | 0 | 0 | 0 | 108 | ||||
| 94 | S | 35.8 | Very low | 39.7 | Very low | 108 Ų | 108 | 139.8 Ų | 139.8 | 76% | 0.755 | 79% | 0.794 | S | S | * | * | trans | -135.3 | 167.4 | -164.4 | -167.2 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 95 | Y | 36.4 | Very low | 39.7 | Very low | 234 Ų | 234 | 138.3 Ų | 138.3 | 92% | 0.918 | 79% | 0.788 | S | S | * | * | trans | 80.4 | 143.8 | 164.6 | -122.2 | -101.1 | 0 | 0 | 0 | 119.7 | ||||
| 96 | G | 31.8 | Very low | 39 | Very low | 68 Ų | 68 | 139.1 Ų | 139.1 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | trans | 111.5 | 76.6 | 154 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 97 | Y | 42.5 | Very low | 39.2 | Very low | 208 Ų | 208 | 141.5 Ų | 141.5 | 82% | 0.816 | 80% | 0.796 | S | S | * | * | trans | -120.9 | 125.2 | 163.8 | -165.7 | -79.6 | 0 | 0 | 0 | 110.9 | ||||
| 98 | P | 55.7 | Low | 39.2 | Very low | 111 Ų | 111 | 142.8 Ų | 142.8 | 72% | 0.721 | 80% | 0.797 | S | S | * | * | trans | -121.4 | 161.4 | 159.8 | 33.7 | -20.7 | 0 | 0 | 0 | 113.3 | ||||
| 99 | F | 44.1 | Very low | 39 | Very low | 203 Ų | 203 | 142.7 Ų | 142.7 | 89% | 0.89 | 80% | 0.797 | S | S | * | * | trans | -80.6 | 156.4 | -173.5 | -74.7 | -117.2 | 0 | 0 | 0 | 113.4 | ||||
| 100 | G | 31.4 | Very low | 39.1 | Very low | 82 Ų | 82 | 145.3 Ų | 145.3 | 85% | 0.845 | 80% | 0.797 | S | S | * | * | trans | 173.7 | 90.9 | 167.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 101 | N | 39.9 | Very low | 38.9 | Very low | 116 Ų | 116 | 145.5 Ų | 145.5 | 62% | 0.62 | 80% | 0.798 | S | S | * | * | trans | -99.2 | 151.8 | 169.2 | -161.6 | 9.2 | 0 | 0 | 0 | 108.3 | Y103 | N101-Y103 WeakPolarHBondContact ND2-CE2 3.48Å; N101-Y103 PolarHBondContact OD1-N 3.47Å | ||
| 102 | P | 48.6 | Very low | 38.7 | Very low | 114 Ų | 114 | 147.5 Ų | 147.5 | 74% | 0.74 | 80% | 0.796 | S | S | * | * | -149.9 | 131.4 | 88.7 | 35.3 | -15.6 | 0 | 0 | 0 | 117.2 | |||||
| 103 | Y | 42.8 | Very low | 38.6 | Very low | 180 Ų | 180 | 149.3 Ų | 149.3 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | trans | 33.8 | 117.2 | 131.7 | -61.6 | -78.3 | 0 | 0 | 0 | 121.2 | N101 | N101-Y103 WeakPolarHBondContact ND2-CE2 3.48Å; N101-Y103 PolarHBondContact OD1-N 3.47Å | ||
| 104 | Y | 41.4 | Very low | 38.7 | Very low | 244 Ų | 244 | 147.7 Ų | 147.7 | 96% | 0.957 | 80% | 0.795 | S | S | * | * | -143.7 | 75.4 | 129.6 | -94.8 | -70 | 0 | 0 | 0 | 110.8 | |||||
| 105 | G | 34.8 | Very low | 38.8 | Very low | 63 Ų | 63 | 149.6 Ų | 149.6 | 65% | 0.649 | 80% | 0.796 | S | S | * | * | trans | -96.9 | 110 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | R107 | G105-R107 PolarHBondContact O-N 3.2Š| ||
| 106 | C | 36.1 | Very low | 38.9 | Very low | 136 Ų | 136 | 145.9 Ų | 145.9 | 92% | 0.919 | 79% | 0.791 | S | S | * | * | trans | -66.2 | 99.9 | 177.6 | -63.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 107 | R | 41.2 | Very low | 39.2 | Very low | 235 Ų | 235 | 150.6 Ų | 150.6 | 89% | 0.887 | 80% | 0.795 | S | S | * | * | trans | -74.1 | 130.5 | 164 | -72 | -66.1 | -169.9 | -147.1 | 1.9 | 109.6 | G105 S109 | G105-R107 PolarHBondContact O-N 3.2Å; R107-S109 PolarHBondContact O-N 3.45Å | ||
| 108 | L | 35.8 | Very low | 38.8 | Very low | 148 Ų | 148 | 149.7 Ų | 149.7 | 78% | 0.775 | 80% | 0.798 | S | S | * | * | trans | -84.8 | 99.5 | 174.6 | -177.5 | 68.9 | 0 | 0 | 0 | 109.4 | H110 | L108-H110 PolarHBondContact O-N 2.96Å; L108-H110 PolarHBondContact O-ND1 3.22Å | ||
| 109 | S | 30.8 | Very low | 38 | Very low | 105 Ų | 105 | 152.7 Ų | 152.7 | 73% | 0.734 | 80% | 0.8 | S | S | * | * | trans | -60.3 | 115.7 | 179.8 | -55.2 | 0 | 0 | 0 | 0 | 111.7 | R107 S111 | R107-S109 PolarHBondContact O-N 3.45Å; S109-S111 PolarHBondContact O-N 3.41Å | ||
| 110 | H | 38.6 | Very low | 37.6 | Very low | 162 Ų | 162 | 148.9 Ų | 148.9 | 75% | 0.75 | 80% | 0.796 | S | S | * | * | trans | -81.1 | 99.2 | 168 | -77.8 | 57.5 | 0 | 0 | 0 | 108.8 | L108 H112 | L108-H110 PolarHBondContact O-N 2.96Å; L108-H110 PolarHBondContact O-ND1 3.22Å; H110-H112 PolarHBondContact O-N 2.86Å; H110-H112 VanDerWaalsContact O-N 3.09Å | ||
| 111 | S | 33.5 | Very low | 37.7 | Very low | 118 Ų | 118 | 150.9 Ų | 150.9 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | trans | -77.7 | 90.1 | 178.8 | 56.6 | 0 | 0 | 0 | 0 | 111.5 | S109 N113 | S109-S111 PolarHBondContact O-N 3.41Å; S111-N113 PolarHBondContact O-N 3.29Å | ||
| 112 | H | 38.8 | Very low | 37.2 | Very low | 176 Ų | 176 | 150.7 Ų | 150.7 | 82% | 0.815 | 80% | 0.803 | S | S | * | * | trans | -68.6 | 104.5 | 160.7 | -94.8 | -101 | 0 | 0 | 0 | 109.6 | H110 | H110-H112 PolarHBondContact O-N 2.86Å; H110-H112 VanDerWaalsContact O-N 3.09Å | ||
| 113 | N | 34.9 | Very low | 36.3 | Very low | 143 Ų | 143 | 155.9 Ų | 155.9 | 77% | 0.765 | 81% | 0.81 | S | S | * | * | trans | -175.4 | 116.1 | 133.4 | -111.2 | -75.9 | 0 | 0 | 0 | 112.2 | S111 | S111-N113 PolarHBondContact O-N 3.29Š| ||
| 114 | V | 38.2 | Very low | 36.1 | Very low | 148 Ų | 148 | 155.4 Ų | 155.4 | 90% | 0.897 | 81% | 0.813 | S | S | * | * | trans | -141.8 | 89.3 | 150.8 | -83.8 | 0 | 0 | 0 | 0 | 107.7 | L116 | V114-L116 PolarHBondContact O-N 3.29Š| ||
| 115 | N | 36.7 | Very low | 35.9 | Very low | 148 Ų | 148 | 149.3 Ų | 149.3 | 79% | 0.791 | 80% | 0.803 | S | S | * | * | trans | -81.3 | 109.6 | 165.2 | -173.8 | -25.2 | 0 | 0 | 0 | 108 | ||||
| 116 | L | 38.5 | Very low | 35.8 | Very low | 155 Ų | 155 | 151.4 Ų | 151.4 | 81% | 0.812 | 82% | 0.815 | S | S | * | * | trans | -139.7 | 135.3 | 165.7 | -163.9 | 68.9 | 0 | 0 | 0 | 108.3 | V114 Q118 | V114-L116 PolarHBondContact O-N 3.29Å; L116-Q118 PolarHBondContact O-N 3.14Å | ||
| 117 | Q | 38 | Very low | 35.7 | Very low | 167 Ų | 167 | 152.7 Ų | 152.7 | 78% | 0.78 | 81% | 0.807 | S | S | * | * | trans | -44.2 | 115.4 | -164.4 | -63.1 | 178.9 | 11.9 | 0 | 0 | 114.6 | ||||
| 118 | Q | 35.9 | Very low | 35.5 | Very low | 189 Ų | 189 | 149.6 Ų | 149.6 | 88% | 0.883 | 80% | 0.8 | S | S | * | * | trans | -87 | 110.9 | 153.9 | -69.3 | -174 | -4.7 | 0 | 0 | 108.1 | L116 P120 | L116-Q118 PolarHBondContact O-N 3.14Å; Q118-P120 WeakPolarHBondContact O-CD 3.33Å | ||
| 119 | K | 37.4 | Very low | 35.5 | Very low | 174 Ų | 174 | 153.1 Ų | 153.1 | 76% | 0.757 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -71 | 123.7 | 163.4 | -71.3 | -178.3 | 176.3 | -178.8 | 0 | 108.1 | C121 | K119-C121 PolarHBondContact O-N 2.99Š|
| 120 | P | 36.7 | Very low | 35.6 | Very low | 124 Ų | 124 | 152 Ų | 152 | 81% | 0.805 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 124.3 | 163.9 | -15.7 | 30.9 | 0 | 0 | 0 | 108.5 | Q118 | Q118-P120 WeakPolarHBondContact O-CD 3.33Š|
| 121 | C | 32.4 | Very low | 35.4 | Very low | 123 Ų | 123 | 151.7 Ų | 151.7 | 83% | 0.831 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 133.6 | 166.9 | -67.6 | 0 | 0 | 0 | 0 | 108.8 | K119 Y123 | K119-C121 PolarHBondContact O-N 2.99Å; C121-Y123 PolarHBondContact O-N 2.8Å |
| 122 | S | 29.3 | Very low | 36.6 | Very low | 112 Ų | 112 | 150.6 Ų | 150.6 | 78% | 0.783 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 125 | 180 | -55.7 | 0 | 0 | 0 | 0 | 111.5 | ||
| 123 | Y | 31.3 | Very low | 36.4 | Very low | 224 Ų | 224 | 148 Ų | 148 | 88% | 0.878 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 129.5 | 162.6 | -133.2 | -95 | 0 | 0 | 0 | 108.1 | C121 | C121-Y123 PolarHBondContact O-N 2.8Š|
| 124 | H | 37.8 | Very low | 36.4 | Very low | 169 Ų | 169 | 146.1 Ų | 146.1 | 78% | 0.782 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 132.3 | 176.2 | -81.4 | -102.1 | 0 | 0 | 0 | 110.4 | ||
| 125 | P | 37.7 | Very low | 36.2 | Very low | 116 Ų | 116 | 145.8 Ų | 145.8 | 75% | 0.753 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 137.2 | 161.9 | -15.4 | 30.2 | 0 | 0 | 0 | 109.7 | ||
| 126 | A | 33.3 | Very low | 36 | Very low | 107 Ų | 107 | 142.4 Ų | 142.4 | 88% | 0.884 | 79% | 0.789 | S | S | * | * | trans | -92.8 | 112.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 127 | E | 33.2 | Very low | 36 | Very low | 163 Ų | 163 | 142.9 Ų | 142.9 | 76% | 0.762 | 79% | 0.792 | S | S | * | * | trans | -118 | 122.4 | 163.3 | -70.7 | -165.2 | -173.1 | 0 | 0 | 109.9 | ||||
| 128 | K | 37.7 | Very low | 36.4 | Very low | 171 Ų | 171 | 139.9 Ų | 139.9 | 74% | 0.743 | 79% | 0.787 | S | S | * | * | 168.9 | 137.8 | 101.9 | -86 | -153.9 | 177.7 | -169.3 | 0 | 113 | |||||
| 129 | Y | 34.1 | Very low | 36.3 | Very low | 222 Ų | 222 | 137.3 Ų | 137.3 | 87% | 0.871 | 78% | 0.784 | S | S | * | * | trans | 31.6 | 137.4 | 138.8 | -74.5 | -99.7 | 0 | 0 | 0 | 121.9 | ||||
| 130 | G | 34.4 | Very low | 36.1 | Very low | 80 Ų | 80 | 136.5 Ų | 136.5 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | trans | 137 | 116.5 | 138.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 131 | D | 32.8 | Very low | 36.2 | Very low | 156 Ų | 156 | 140 Ų | 140 | 83% | 0.834 | 79% | 0.789 | S | S | * | * | trans | -111.3 | -168.4 | 173.6 | -161.4 | 33.4 | 0 | 0 | 0 | 109.7 | ||||
| 132 | P | 60.3 | Low | 36.3 | Very low | 95 Ų | 95 | 141 Ų | 141 | 62% | 0.617 | 79% | 0.785 | S | S | * | * | -106 | -178.4 | -100.7 | 36.9 | -23.4 | 0 | 0 | 0 | 114.5 | |||||
| 133 | T | 34.6 | Very low | 36.5 | Very low | 123 Ų | 123 | 140.8 Ų | 140.8 | 76% | 0.755 | 78% | 0.784 | S | S | * | * | 153.7 | 154.8 | 129.3 | -65.9 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 134 | S | 35.2 | Very low | 36.8 | Very low | 103 Ų | 103 | 136 Ų | 136 | 72% | 0.72 | 78% | 0.783 | S | S | * | * | trans | 78.5 | 122.3 | 171.3 | 66.1 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 135 | T | 33.9 | Very low | 36.7 | Very low | 140 Ų | 140 | 137.8 Ų | 137.8 | 86% | 0.859 | 78% | 0.783 | S | S | * | * | cis | 91.5 | 121.6 | 46.1 | -65.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 136 | A | 32.5 | Very low | 36.8 | Very low | 78 Ų | 78 | 137.2 Ų | 137.2 | 65% | 0.645 | 79% | 0.788 | S | S | * | * | cis | -167 | 158.4 | -2.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 137 | L | 37.2 | Very low | 37.2 | Very low | 164 Ų | 164 | 140.6 Ų | 140.6 | 86% | 0.859 | 78% | 0.783 | S | S | * | * | trans | 50.4 | 165.8 | 144.8 | -65.4 | 175.9 | 0 | 0 | 0 | 121.8 | ||||
| 138 | P | 46.1 | Very low | 37.6 | Very low | 105 Ų | 105 | 140.8 Ų | 140.8 | 68% | 0.682 | 78% | 0.784 | S | S | * | * | cis | -130.1 | -179.7 | -37.5 | 38.4 | -23.6 | 0 | 0 | 0 | 112.7 | ||||
| 139 | T | 34.5 | Very low | 37.4 | Very low | 135 Ų | 135 | 141.8 Ų | 141.8 | 83% | 0.828 | 79% | 0.788 | S | S | * | * | 172 | 141.7 | 128.9 | -70.9 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 140 | E | 34 | Very low | 37.6 | Very low | 157 Ų | 157 | 135.7 Ų | 135.7 | 73% | 0.734 | 78% | 0.784 | S | S | * | * | trans | -41 | 138.6 | 172.9 | -60.4 | -69.6 | 114 | 0 | 0 | 117.2 | ||||
| 141 | E | 37.3 | Very low | 37.7 | Very low | 196 Ų | 196 | 140.5 Ų | 140.5 | 92% | 0.916 | 78% | 0.783 | S | S | * | * | -162.2 | 147 | 106 | -165.8 | 166.4 | -174.8 | 0 | 0 | 110.2 | |||||
| 142 | L | 36 | Very low | 38.2 | Very low | 145 Ų | 145 | 143.5 Ų | 143.5 | 76% | 0.759 | 78% | 0.784 | S | S | * | * | trans | -110.1 | 124.4 | -164.2 | -81.9 | 170.1 | 0 | 0 | 0 | 116.2 | ||||
| 143 | S | 32.9 | Very low | 37.5 | Very low | 108 Ų | 108 | 143.1 Ų | 143.1 | 76% | 0.755 | 78% | 0.781 | S | S | * | * | trans | 36.5 | 108 | 133 | -167.5 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 144 | S | 36.9 | Very low | 37.5 | Very low | 124 Ų | 124 | 143 Ų | 143 | 87% | 0.867 | 79% | 0.785 | S | S | * | * | trans | -166.7 | 139.8 | 141.2 | -85.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 145 | R | 35.7 | Very low | 37.8 | Very low | 205 Ų | 205 | 147.1 Ų | 147.1 | 77% | 0.774 | 79% | 0.791 | S | S | * | * | cis | -153.2 | 119.5 | -1.9 | 162.2 | -171.7 | 165.5 | 117 | -9.1 | 107.7 | ||||
| 146 | A | 41 | Very low | 38.3 | Very low | 105 Ų | 105 | 145.3 Ų | 145.3 | 87% | 0.868 | 79% | 0.79 | S | S | * | * | trans | -99.3 | 96.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 147 | K | 40.3 | Very low | 38.3 | Very low | 177 Ų | 177 | 146.9 Ų | 146.9 | 77% | 0.77 | 80% | 0.796 | S | S | * | * | trans | -173.1 | 122.4 | 160 | -119 | 170.7 | -177.6 | 173.5 | 0 | 111.6 | ||||
| 148 | E | 41.8 | Very low | 38.7 | Very low | 168 Ų | 168 | 144.4 Ų | 144.4 | 79% | 0.785 | 79% | 0.793 | S | S | * | * | trans | -178.2 | 92.1 | 138 | -98.7 | 148.9 | -128.8 | 0 | 0 | 107.7 | ||||
| 149 | F | 33.4 | Very low | 38.4 | Very low | 191 Ų | 191 | 149.3 Ų | 149.3 | 84% | 0.838 | 80% | 0.799 | S | S | * | * | 85.8 | 91.6 | 96 | -130.3 | -82.8 | 0 | 0 | 0 | 112.7 | |||||
| 150 | A | 38 | Very low | 38.9 | Very low | 94 Ų | 94 | 150.1 Ų | 150.1 | 78% | 0.777 | 79% | 0.794 | S | S | * | * | trans | -82.3 | 135.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 151 | F | 36.4 | Very low | 39.6 | Very low | 181 Ų | 181 | 147.3 Ų | 147.3 | 79% | 0.794 | 80% | 0.797 | S | S | * | * | trans | -148.2 | 68.8 | 164.6 | -153.8 | -90.3 | 0 | 0 | 0 | 111.8 | ||||
| 152 | Y | 45.1 | Very low | 40 | Very low | 219 Ų | 219 | 144 Ų | 144 | 86% | 0.859 | 79% | 0.79 | S | S | * | * | trans | -98.9 | 122.6 | 164.3 | -93.3 | -80.4 | 0 | 0 | 0 | 109.4 | S154 | Y152-S154 PolarHBondContact O-N 3.24Å; Y152-S154 VanDerWaalsContact O-N 3.1Å | ||
| 153 | P | 45.4 | Very low | 40.8 | Very low | 87 Ų | 87 | 142.6 Ų | 142.6 | 57% | 0.565 | 79% | 0.79 | S | S | * | * | trans | -67.6 | 106.2 | 176.8 | -22.6 | 34.7 | 0 | 0 | 0 | 112.2 | F155 | P153-F155 HydrophobicContact CB-CD2 4.47Å; P153-F155 HydrophobicContact CB-CE2 4.25Å; P153-F155 PolarHBondContact O-N 3.06Å | ||
| 154 | S | 32.7 | Very low | 41.4 | Very low | 120 Ų | 120 | 141.4 Ų | 141.4 | 84% | 0.839 | 79% | 0.794 | S | S | * | * | trans | -72.2 | 92.7 | 172.9 | -66.3 | 0 | 0 | 0 | 0 | 111.4 | Y152 A156 | Y152-S154 PolarHBondContact O-N 3.24Å; Y152-S154 VanDerWaalsContact O-N 3.1Å; S154-A156 PolarHBondContact O-N 3.47Å | ||
| 155 | F | 43 | Very low | 41.8 | Very low | 191 Ų | 191 | 144.5 Ų | 144.5 | 84% | 0.838 | 79% | 0.788 | S | S | * | * | trans | -76.5 | 97.9 | 162.4 | -78.4 | -80.7 | 0 | 0 | 0 | 109.8 | P153 S157 | P153-F155 HydrophobicContact CB-CD2 4.47Å; P153-F155 HydrophobicContact CB-CE2 4.25Å; P153-F155 PolarHBondContact O-N 3.06Å; F155-S157 PolarHBondContact O-N 2.97Å | ||
| 156 | A | 43 | Very low | 42.5 | Very low | 102 Ų | 102 | 142.9 Ų | 142.9 | 84% | 0.843 | 79% | 0.794 | S | S | * | * | trans | -67.1 | 110.1 | 168 | 0 | 0 | 0 | 0 | 0 | 109.5 | S154 | S154-A156 PolarHBondContact O-N 3.47Š| ||
| 157 | S | 33.4 | Very low | 42.8 | Very low | 110 Ų | 110 | 143 Ų | 143 | 77% | 0.769 | 78% | 0.78 | S | S | * | * | trans | -118.2 | 92.8 | 171.3 | -170.2 | 0 | 0 | 0 | 0 | 109.5 | F155 Y159 | F155-S157 PolarHBondContact O-N 2.97Å; S157-Y159 PolarHBondContact O-N 2.91Å | ||
| 158 | S | 46.4 | Very low | 43.7 | Very low | 113 Ų | 113 | 141.9 Ų | 141.9 | 79% | 0.79 | 78% | 0.779 | S | S | * | * | trans | -93.4 | 79.7 | -176.7 | 55.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 159 | Y | 39.9 | Very low | 43.8 | Very low | 208 Ų | 208 | 138.4 Ų | 138.4 | 82% | 0.816 | 77% | 0.773 | S | S | * | * | trans | -132.7 | 107 | 174 | -101.8 | -84.5 | 0 | 0 | 0 | 114.1 | S157 | S157-Y159 PolarHBondContact O-N 2.91Š| ||
| 160 | Q | 44.4 | Very low | 44.4 | Very low | 152 Ų | 152 | 135.4 Ų | 135.4 | 71% | 0.71 | 77% | 0.771 | S | S | * | * | trans | 39.6 | 105.9 | 141.5 | -60.3 | -64.4 | -20 | 0 | 0 | 118.2 | V162 | Q160-V162 PolarHBondContact O-N 3.28Š| ||
| 161 | A | 48.1 | Very low | 44.8 | Very low | 97 Ų | 97 | 137 Ų | 137 | 80% | 0.802 | 77% | 0.771 | S | S | * | * | trans | -70.8 | 111.2 | 154.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | P163 | A161-P163 WeakPolarHBondContact O-CD 3.24Š| ||
| 162 | V | 47.1 | Very low | 45.2 | Very low | 128 Ų | 128 | 133.3 Ų | 133.3 | 78% | 0.776 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 119.9 | -178.1 | 177.9 | 0 | 0 | 0 | 0 | 110.2 | Q160 | Q160-V162 PolarHBondContact O-N 3.28Š|
| 163 | P | 50.9 | Low | 45 | Very low | 115 Ų | 115 | 126.7 Ų | 126.7 | 75% | 0.747 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 152.6 | 172.3 | -20.3 | 34.4 | 0 | 0 | 0 | 111.9 | A161 | A161-P163 WeakPolarHBondContact O-CD 3.24Š|
| 164 | G | 46.7 | Very low | 44.6 | Very low | 82 Ų | 82 | 129.7 Ų | 129.7 | 85% | 0.845 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 139.7 | -169.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 165 | Y | 44.7 | Very low | 44.6 | Very low | 189 Ų | 189 | 129 Ų | 129 | 74% | 0.741 | 77% | 0.768 | S | S | * | * | trans | -132.6 | 82.4 | 163.4 | -168.7 | -121.6 | 0 | 0 | 0 | 109.6 | D167 | Y165-D167 HydrophobicContact CD1-CB 4.39Å; Y165-D167 HydrophobicContact CE1-CB 3.79Å; Y165-D167 HydrophobicContact CE2-CB 4.09Å; Y165-D167 PolarHBondContact OH-OD1 2.87Å | ||
| 166 | L | 50.6 | Low | 44.2 | Very low | 172 Ų | 172 | 128.8 Ų | 128.8 | 90% | 0.901 | 77% | 0.769 | S | S | * | * | trans | -91.7 | 92.4 | 158.5 | -80 | 176.4 | 0 | 0 | 0 | 107.1 | M168 | L166-M168 PolarHBondContact O-N 2.63Š| ||
| 167 | D | 48.5 | Very low | 44.1 | Very low | 107 Ų | 107 | 128.8 Ų | 128.8 | 57% | 0.572 | 76% | 0.76 | S | S | * | * | trans | -68.1 | 102.2 | 174.8 | -164.2 | 47 | 0 | 0 | 0 | 109.6 | Y165 | Y165-D167 HydrophobicContact CD1-CB 4.39Å; Y165-D167 HydrophobicContact CE1-CB 3.79Å; Y165-D167 HydrophobicContact CE2-CB 4.09Å; Y165-D167 PolarHBondContact OH-OD1 2.87Å | ||
| 168 | M | 57.9 | Low | 44.1 | Very low | 153 Ų | 153 | 131.1 Ų | 131.1 | 75% | 0.754 | 76% | 0.759 | S | S | * | * | trans | -100.4 | 111.4 | 167.8 | -86 | -94.4 | 61 | 0 | 0 | 108 | L166 V170 | L166-M168 PolarHBondContact O-N 2.63Å; M168-V170 PolarHBondContact O-N 3.49Å | ||
| 169 | S | 44.4 | Very low | 44.4 | Very low | 95 Ų | 95 | 129.7 Ų | 129.7 | 66% | 0.664 | 75% | 0.747 | S | S | * | * | trans | -63.4 | 92.1 | -175.1 | 37.6 | 0 | 0 | 0 | 0 | 112.5 | V171 | S169-V171 PolarHBondContact O-N 3.29Š| ||
| 170 | V | 46.3 | Very low | 44.2 | Very low | 129 Ų | 129 | 128.5 Ų | 128.5 | 78% | 0.782 | 74% | 0.741 | S | S | * | * | trans | -66.8 | 113.2 | 165.7 | 174.7 | 0 | 0 | 0 | 0 | 108.3 | M168 P172 | M168-V170 PolarHBondContact O-N 3.49Å; V170-P172 WeakPolarHBondContact O-CD 3.41Å | ||
| 171 | V | 46.8 | Very low | 43.9 | Very low | 128 Ų | 128 | 129.4 Ų | 129.4 | 78% | 0.776 | 75% | 0.745 | S | S | * | * | trans | -83.9 | 115.8 | 165.9 | -179 | 0 | 0 | 0 | 0 | 108.4 | S169 G173 | S169-V171 PolarHBondContact O-N 3.29Å; V171-G173 PolarHBondContact O-N 3.38Å | ||
| 172 | P | 43.6 | Very low | 43.6 | Very low | 102 Ų | 102 | 131.7 Ų | 131.7 | 66% | 0.662 | 74% | 0.744 | S | S | * | * | trans | -72.4 | 127.4 | 175 | -14.9 | 31.5 | 0 | 0 | 0 | 110.2 | V170 | V170-P172 WeakPolarHBondContact O-CD 3.41Š| ||
| 173 | G | 42.3 | Very low | 43.2 | Very low | 80 Ų | 80 | 130 Ų | 130 | 83% | 0.825 | 74% | 0.744 | S | S | * | * | trans | -75.8 | 136.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | V171 | V171-G173 PolarHBondContact O-N 3.38Š| ||
| 174 | I | 36.8 | Very low | 43.1 | Very low | 150 Ų | 150 | 132.5 Ų | 132.5 | 77% | 0.769 | 75% | 0.75 | S | S | * | * | trans | -129.7 | 105.2 | 177.2 | -63.9 | -179.5 | 0 | 0 | 0 | 110.9 | ||||
| 175 | S | 31.7 | Very low | 43.1 | Very low | 106 Ų | 106 | 135.9 Ų | 135.9 | 74% | 0.741 | 75% | 0.747 | S | S | * | * | trans | 66.9 | 152.9 | 150.6 | 76.6 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 176 | H | 35 | Very low | 43.1 | Very low | 187 Ų | 187 | 132.4 Ų | 132.4 | 87% | 0.866 | 75% | 0.747 | S | S | * | * | trans | 89.9 | 144.4 | 157.4 | -113.3 | -110.6 | 0 | 0 | 0 | 119.9 | ||||
| 177 | P | 41.7 | Very low | 43.1 | Very low | 101 Ų | 101 | 133 Ų | 133 | 66% | 0.656 | 75% | 0.748 | S | S | * | * | trans | -128.5 | -168.2 | -150.4 | 46.7 | -32.2 | 0 | 0 | 0 | 116.1 | ||||
| 178 | E | 31.9 | Very low | 43 | Very low | 159 Ų | 159 | 136.9 Ų | 136.9 | 74% | 0.743 | 76% | 0.763 | S | S | * | * | trans | 79.3 | 154.3 | 169 | -89.7 | -135.4 | 74.1 | 0 | 0 | 119.4 | R180 | E178-R180 IonicContact OE1-CZ 2.67Å; E178-R180 IonicContact OE1-NH1 3.46Å; E178-R180 PolarHBondContact OE1-NH1 2.59Å; E178-R180 IonicContact OE1-NH2 3.92Å | ||
| 179 | P | 54.2 | Low | 42.5 | Very low | 84 Ų | 84 | 132.8 Ų | 132.8 | 55% | 0.545 | 76% | 0.759 | S | S | . | * | trans | -123.1 | -169.8 | -157.9 | 44.5 | -30.3 | 0 | 0 | 0 | 114.6 | ||||
| 180 | R | 34.2 | Very low | 42.1 | Very low | 182 Ų | 182 | 138.8 Ų | 138.8 | 69% | 0.687 | 77% | 0.769 | S | S | * | * | trans | 85.2 | 141.4 | -174.4 | -47 | 157.6 | -167.2 | 92.3 | -3.5 | 110.4 | E178 | E178-R180 IonicContact OE1-CZ 2.67Å; E178-R180 IonicContact OE1-NH1 3.46Å; E178-R180 PolarHBondContact OE1-NH1 2.59Å; E178-R180 IonicContact OE1-NH2 3.92Å | ||
| 181 | H | 37.9 | Very low | 41.9 | Very low | 171 Ų | 171 | 141.4 Ų | 141.4 | 79% | 0.792 | 77% | 0.773 | S | S | * | * | cis | -132.3 | 174.2 | 23 | -82.2 | -88.2 | 0 | 0 | 0 | 115 | ||||
| 182 | D | 41.8 | Very low | 41.4 | Very low | 145 Ų | 145 | 141.2 Ų | 141.2 | 78% | 0.775 | 76% | 0.763 | S | S | * | * | trans | -59 | 146 | -178.6 | -52.5 | -106.5 | 0 | 0 | 0 | 116.1 | ||||
| 183 | A | 38.9 | Very low | 41.7 | Very low | 94 Ų | 94 | 145 Ų | 145 | 78% | 0.777 | 76% | 0.764 | S | S | * | * | trans | -154.2 | 87.5 | 153.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | I185 | A183-I185 PolarHBondContact O-N 3.06Š| ||
| 184 | L | 48.9 | Very low | 42.1 | Very low | 166 Ų | 166 | 145 Ų | 145 | 87% | 0.869 | 76% | 0.757 | S | S | * | * | trans | -74.5 | 116.4 | 172.8 | -73.7 | 172.2 | 0 | 0 | 0 | 110.7 | ||||
| 185 | I | 46.6 | Very low | 42.7 | Very low | 153 Ų | 153 | 144.3 Ų | 144.3 | 79% | 0.785 | 75% | 0.754 | S | S | * | * | trans | -115.6 | 115 | 164.4 | -59.4 | -64.9 | 0 | 0 | 0 | 108.1 | A183 M187 | A183-I185 PolarHBondContact O-N 3.06Å; I185-M187 PolarHBondContact O-N 3.16Å | ||
| 186 | P | 46.1 | Very low | 43.1 | Very low | 116 Ų | 116 | 144.4 Ų | 144.4 | 75% | 0.753 | 75% | 0.754 | S | S | * | * | trans | -64.2 | 124.6 | 177.7 | -24 | 35.1 | 0 | 0 | 0 | 112.7 | E188 | P186-E188 PolarHBondContact O-N 2.69Š| ||
| 187 | M | 49.8 | Very low | 43.7 | Very low | 186 Ų | 186 | 141.7 Ų | 141.7 | 92% | 0.916 | 75% | 0.746 | S | S | * | * | trans | -89.2 | 74.7 | 177 | -176.8 | 78.6 | 80 | 0 | 0 | 110.5 | I185 | I185-M187 PolarHBondContact O-N 3.16Š| ||
| 188 | E | 46.9 | Very low | 43.4 | Very low | 188 Ų | 188 | 140.2 Ų | 140.2 | 88% | 0.879 | 75% | 0.75 | S | S | * | * | trans | -122.1 | 114.7 | 179.7 | -155.6 | 65.7 | -106.9 | 0 | 0 | 110.3 | P186 | P186-E188 PolarHBondContact O-N 2.69Š| ||
| 189 | G | 46.1 | Very low | 44.2 | Very low | 66 Ų | 66 | 143.7 Ų | 143.7 | 68% | 0.68 | 76% | 0.756 | S | S | * | * | trans | 149.1 | -1.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 119.3 | Q191 | G189-Q191 PolarHBondContact O-N 2.96Š| ||
| 190 | Y | 37.4 | Very low | 44 | Very low | 222 Ų | 222 | 147 Ų | 147 | 87% | 0.871 | 77% | 0.77 | S | S | * | * | trans | -90.5 | 79.3 | 178.4 | -136 | -89.7 | 0 | 0 | 0 | 112.6 | H192 | Y190-H192 VanDerWaalsContact C-N 3.31Å; Y190-H192 PolarHBondContact O-N 3.1Å | ||
| 191 | Q | 41.3 | Very low | 44 | Very low | 184 Ų | 184 | 141.4 Ų | 141.4 | 86% | 0.86 | 77% | 0.768 | S | S | * | * | trans | -67.1 | 84.1 | 175.9 | -80.5 | -74 | -51.3 | 0 | 0 | 111.8 | G189 | G189-Q191 PolarHBondContact O-N 2.96Š| ||
| 192 | H | 37.4 | Very low | 44.2 | Very low | 123 Ų | 123 | 142.1 Ų | 142.1 | 57% | 0.569 | 77% | 0.771 | S | S | * | * | trans | -66.4 | 132.5 | 174.6 | -167.9 | -96.2 | 0 | 0 | 0 | 110.5 | Y190 A194 | Y190-H192 VanDerWaalsContact C-N 3.31Å; Y190-H192 PolarHBondContact O-N 3.1Å; H192-A194 PolarHBondContact O-N 3.17Å | ||
| 193 | W | 48.8 | Very low | 44.5 | Very low | 181 Ų | 181 | 141.4 Ų | 141.4 | 69% | 0.686 | 77% | 0.772 | S | S | * | * | trans | -48.7 | 94.3 | -171.3 | 44.4 | -82.4 | 0 | 0 | 0 | 114.3 | L195 | W193-L195 HydrophobicContact CE3-CD1 4.09Å; W193-L195 HydrophobicContact CE3-CG 4.03Å; W193-L195 HydrophobicContact CZ3-CD1 3.85Å; W193-L195 HydrophobicContact CZ3-CG 4.24Å; W193-L195 PolarHBondContact O-N 3.3Å | ||
| 194 | A | 50 | Low | 44.4 | Very low | 81 Ų | 81 | 146.9 Ų | 146.9 | 67% | 0.669 | 77% | 0.774 | S | S | * | * | trans | -73.2 | 96.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | H192 S196 | H192-A194 PolarHBondContact O-N 3.17Å; A194-S196 PolarHBondContact O-N 3.16Å | ||
| 195 | L | 50.3 | Low | 44 | Very low | 135 Ų | 135 | 145.2 Ų | 145.2 | 71% | 0.707 | 78% | 0.775 | S | S | * | * | trans | -74.8 | 75.9 | 164.4 | -74.9 | 178.4 | 0 | 0 | 0 | 110.2 | W193 N197 | W193-L195 HydrophobicContact CE3-CD1 4.09Å; W193-L195 HydrophobicContact CE3-CG 4.03Å; W193-L195 HydrophobicContact CZ3-CD1 3.85Å; W193-L195 HydrophobicContact CZ3-CG 4.24Å; W193-L195 PolarHBondContact O-N 3.3Å; L195-N197 VanDerWaalsContact C-N 3.26Å; L195-N197 PolarHBondContact O-N 3.3Å | ||
| 196 | S | 40.5 | Very low | 43.4 | Very low | 108 Ų | 108 | 142.9 Ų | 142.9 | 76% | 0.755 | 77% | 0.773 | S | S | * | * | trans | -68.5 | 78.9 | 178.1 | -60.8 | 0 | 0 | 0 | 0 | 112.5 | A194 | A194-S196 PolarHBondContact O-N 3.16Š| ||
| 197 | N | 47.3 | Very low | 43.1 | Very low | 130 Ų | 130 | 145.8 Ų | 145.8 | 70% | 0.695 | 77% | 0.773 | S | S | * | * | trans | -110 | 54.9 | 163.2 | -77.3 | -51.4 | 0 | 0 | 0 | 109.7 | L195 W199 | L195-N197 VanDerWaalsContact C-N 3.26Å; L195-N197 PolarHBondContact O-N 3.3Å; N197-W199 PolarHBondContact O-NE1 2.9Å; N197-W199 VanDerWaalsContact O-NE1 3.1Å | ||
| 198 | G | 35.1 | Very low | 42.8 | Very low | 71 Ų | 71 | 144.3 Ų | 144.3 | 73% | 0.732 | 76% | 0.764 | S | S | * | * | trans | -98.2 | 121.2 | 163.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 199 | W | 48.6 | Very low | 42.2 | Very low | 231 Ų | 231 | 144.6 Ų | 144.6 | 88% | 0.875 | 77% | 0.765 | S | S | * | * | trans | -131.2 | 45.9 | -173.6 | 24.9 | -68.2 | 0 | 0 | 0 | 112.1 | N197 | N197-W199 PolarHBondContact O-NE1 2.9Å; N197-W199 VanDerWaalsContact O-NE1 3.1Å | ||
| 200 | D | 49.4 | Very low | 41.8 | Very low | 155 Ų | 155 | 147.1 Ų | 147.1 | 83% | 0.829 | 77% | 0.768 | S | S | * | * | trans | -144.9 | 154.5 | 144.7 | -161 | -4.7 | 0 | 0 | 0 | 108.3 | ||||
| 201 | G | 35.8 | Very low | 42.3 | Very low | 63 Ų | 63 | 144.5 Ų | 144.5 | 65% | 0.649 | 76% | 0.763 | S | S | * | * | trans | 161.2 | 33.8 | -170.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | V203 | G201-V203 PolarHBondContact O-N 3.18Š| ||
| 202 | Q | 42.4 | Very low | 42.1 | Very low | 186 Ų | 186 | 141.6 Ų | 141.6 | 87% | 0.869 | 76% | 0.763 | S | S | * | * | trans | -76.3 | 80.6 | 179.1 | -169.3 | -164.5 | -89.5 | 0 | 0 | 112.4 | ||||
| 203 | V | 47.5 | Very low | 42.1 | Very low | 131 Ų | 131 | 140.2 Ų | 140.2 | 79% | 0.794 | 76% | 0.764 | S | S | * | * | trans | -132.3 | 115.7 | 169.6 | -74.5 | 0 | 0 | 0 | 0 | 113.8 | G201 | G201-V203 PolarHBondContact O-N 3.18Š| ||
| 204 | Y | 36.5 | Very low | 42.2 | Very low | 208 Ų | 208 | 136.8 Ų | 136.8 | 82% | 0.816 | 76% | 0.755 | S | S | * | * | trans | 55.6 | 101.4 | 149.3 | -151.3 | -96.7 | 0 | 0 | 0 | 119.7 | S206 | Y204-S206 PolarHBondContact O-N 3.39Š| ||
| 205 | C | 40.1 | Very low | 42.1 | Very low | 132 Ų | 132 | 142 Ų | 142 | 89% | 0.892 | 77% | 0.771 | S | S | * | * | trans | -74.8 | 110.4 | 160.4 | -72.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 206 | S | 34.3 | Very low | 42.1 | Very low | 104 Ų | 104 | 145.8 Ų | 145.8 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | trans | -75 | 152.5 | 159.4 | -85.9 | 0 | 0 | 0 | 0 | 111.7 | Y204 | Y204-S206 PolarHBondContact O-N 3.39Š| ||
| 207 | K | 39.8 | Very low | 42.1 | Very low | 176 Ų | 176 | 147.5 Ų | 147.5 | 77% | 0.765 | 77% | 0.77 | S | S | * | * | trans | -83.8 | 154.8 | -170.8 | -170.9 | 175.9 | 176.7 | -177.8 | 0 | 112.9 | ||||
| 208 | E | 42.9 | Very low | 42.1 | Very low | 155 Ų | 155 | 145 Ų | 145 | 72% | 0.724 | 76% | 0.762 | S | S | * | * | trans | 19 | 113.3 | 173.9 | -89.3 | 83.8 | 124.4 | 0 | 0 | 119.6 | ||||
| 209 | Q | 34.9 | Very low | 42.6 | Very low | 194 Ų | 194 | 147.2 Ų | 147.2 | 91% | 0.907 | 77% | 0.767 | S | S | * | * | trans | -149.4 | 141.4 | 132.4 | -140.7 | 170.3 | 21.3 | 0 | 0 | 115.3 | ||||
| 210 | T | 37.7 | Very low | 42.5 | Very low | 119 Ų | 119 | 144.5 Ų | 144.5 | 73% | 0.73 | 76% | 0.761 | S | S | * | * | trans | -23.7 | 132.9 | 178.3 | -51.8 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 211 | Q | 46.9 | Very low | 42.7 | Very low | 167 Ų | 167 | 142.6 Ų | 142.6 | 78% | 0.78 | 76% | 0.757 | S | S | * | * | trans | 5.9 | 119.2 | 153.7 | -53 | -176.1 | 27.5 | 0 | 0 | 119.4 | ||||
| 212 | S | 37.8 | Very low | 43.3 | Very low | 123 Ų | 123 | 146.9 Ų | 146.9 | 86% | 0.86 | 77% | 0.765 | S | S | * | * | trans | -130.8 | 68.4 | 157.3 | 55.9 | 0 | 0 | 0 | 0 | 111.6 | H214 | S212-H214 PolarHBondContact O-N 3.34Š| ||
| 213 | T | 38.8 | Very low | 43.6 | Very low | 95 Ų | 95 | 143.8 Ų | 143.8 | 58% | 0.583 | 76% | 0.759 | S | S | * | * | trans | -80.6 | 113.8 | -174.8 | 37.9 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 214 | H | 48.8 | Very low | 43.8 | Very low | 109 Ų | 109 | 143.2 Ų | 143.2 | 51% | 0.505 | 76% | 0.756 | S | S | . | * | trans | 71.7 | 48.4 | 150.1 | -48.6 | -45.7 | 0 | 0 | 0 | 120.6 | S212 W216 K217 | S212-H214 PolarHBondContact O-N 3.34Å; H214-W216 PolarHBondContact O-N 3.39Å; H214-K217 HydrophobicContact CB-CB 4.39Å; H214-K217 PolarHBondContact O-N 2.88Å | ||
| 215 | L | 49.7 | Very low | 44.8 | Very low | 189 Ų | 189 | 138.9 Ų | 138.9 | 99% | 0.99 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.4 | -2.4 | 169.6 | -68.3 | 178.2 | 0 | 0 | 0 | 116.4 | ||
| 216 | W | 49.1 | Very low | 45.2 | Very low | 215 Ų | 215 | 140.2 Ų | 140.2 | 81% | 0.814 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.7 | -0 | 179.3 | 64.7 | -96.2 | 0 | 0 | 0 | 115.4 | H214 | H214-W216 PolarHBondContact O-N 3.39Š|
| 217 | K | 41.1 | Very low | 45.5 | Very low | 145 Ų | 145 | 143.1 Ų | 143.1 | 63% | 0.63 | 75% | 0.753 | S | S | * | * | trans | -89.6 | 107 | 173.4 | -100.3 | -179.2 | 168.6 | -178 | 0 | 109.7 | H214 S219 | H214-K217 HydrophobicContact CB-CB 4.39Å; H214-K217 PolarHBondContact O-N 2.88Å; K217-S219 PolarHBondContact O-N 2.67Å | ||
| 218 | S | 46.2 | Very low | 46 | Very low | 76 Ų | 76 | 140.9 Ų | 140.9 | 53% | 0.531 | 76% | 0.756 | S | S | . | * | trans | -61.2 | 126.7 | 169.7 | 56 | 0 | 0 | 0 | 0 | 110.6 | F220 | S218-F220 PolarHBondContact O-N 2.89Š| ||
| 219 | S | 47.2 | Very low | 46.3 | Very low | 119 Ų | 119 | 140.4 Ų | 140.4 | 83% | 0.832 | 75% | 0.754 | S | S | * | * | trans | -69 | 120.2 | 174.9 | -166.7 | 0 | 0 | 0 | 0 | 110.6 | K217 | K217-S219 PolarHBondContact O-N 2.67Š| ||
| 220 | F | 44.8 | Very low | 47.3 | Very low | 173 Ų | 173 | 135.6 Ų | 135.6 | 76% | 0.759 | 74% | 0.737 | S | S | * | * | trans | -133.7 | 134.2 | 160.5 | -72.3 | -75.2 | 0 | 0 | 0 | 106.4 | S218 | S218-F220 PolarHBondContact O-N 2.89Š| ||
| 221 | P | 54.4 | Low | 47.9 | Very low | 115 Ų | 115 | 134.5 Ų | 134.5 | 75% | 0.747 | 74% | 0.735 | S | S | * | * | trans | -67.3 | 149.8 | -176.7 | 27.8 | -34.4 | 0 | 0 | 0 | 111.8 | ||||
| 222 | D | 48.8 | Very low | 48.4 | Very low | 153 Ų | 153 | 131.9 Ų | 131.9 | 82% | 0.818 | 73% | 0.726 | S | S | * | * | trans | -71.5 | 125.3 | -179.8 | -178.1 | 20 | 0 | 0 | 0 | 111.6 | ||||
| 223 | V | 47.9 | Very low | 49 | Very low | 122 Ų | 122 | 136 Ų | 136 | 74% | 0.739 | 72% | 0.724 | S | S | * | * | trans | -143.7 | 94.7 | 169.3 | -173.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 224 | V | 51.7 | Low | 50 | Low | 119 Ų | 119 | 141.7 Ų | 141.7 | 72% | 0.721 | 74% | 0.735 | S | S | * | * | trans | 51.5 | 106.9 | 150.5 | -170.1 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 225 | P | 57.6 | Low | 50.4 | Low | 117 Ų | 117 | 147.9 Ų | 147.9 | 76% | 0.76 | 75% | 0.754 | S | S | * | * | trans | -92.7 | 103.3 | -174.9 | 34.6 | -34.2 | 0 | 0 | 0 | 115 | ||||
| 226 | L | 49.7 | Very low | 51.1 | Low | 159 Ų | 159 | 142.5 Ų | 142.5 | 83% | 0.832 | 74% | 0.744 | S | S | * | * | trans | -146.6 | 83.4 | 164.2 | -78.4 | -177.8 | 0 | 0 | 0 | 113.6 | ||||
| 227 | Q | 40.4 | Very low | 52.5 | Low | 166 Ų | 166 | 143.5 Ų | 143.5 | 78% | 0.776 | 75% | 0.748 | S | S | * | * | trans | -171.6 | 126.4 | 149.9 | -97.5 | -49.3 | -29.3 | 0 | 0 | 109.9 | E229 | Q227-E229 PolarHBondContact O-N 3.23Å; Q227-E229 VanDerWaalsContact O-N 3.09Å | ||
| 228 | P | 50.3 | Low | 54.6 | Low | 128 Ų | 128 | 146.4 Ų | 146.4 | 83% | 0.831 | 76% | 0.76 | S | S | * | * | trans | -82.3 | 43.1 | 172.9 | 35.5 | -37.4 | 0 | 0 | 0 | 113.3 | ||||
| 229 | E | 47.9 | Very low | 56.6 | Low | 146 Ų | 146 | 151.4 Ų | 151.4 | 68% | 0.682 | 77% | 0.773 | S | S | * | * | trans | -76.8 | 139.3 | 173.4 | -112.9 | -59 | 156.6 | 0 | 0 | 111.4 | Q227 S231 | Q227-E229 PolarHBondContact O-N 3.23Å; Q227-E229 VanDerWaalsContact O-N 3.09Å; E229-S231 PolarHBondContact O-N 3.46Å; E229-S231 VanDerWaalsContact O-N 3.16Å | ||
| 230 | V | 56.5 | Low | 58.8 | Low | 93 Ų | 93 | 157.1 Ų | 157.1 | 56% | 0.564 | 78% | 0.776 | S | S | * | * | trans | -80.7 | 101.9 | -169.8 | -85 | 0 | 0 | 0 | 0 | 110.7 | N232 | V230-N232 PolarHBondContact O-N 3.02Å; V230-N232 PolarHBondContact O-ND2 3.5Å | ||
| 231 | S | 50 | Low | 61.1 | Low | 96 Ų | 96 | 155 Ų | 155 | 67% | 0.671 | 78% | 0.777 | S | S | * | * | trans | -60.7 | 74.9 | 178.5 | -167.2 | 0 | 0 | 0 | 0 | 113.8 | E229 Y233 | E229-S231 PolarHBondContact O-N 3.46Å; E229-S231 VanDerWaalsContact O-N 3.16Å; S231-Y233 VanDerWaalsContact C-N 3.25Å; S231-Y233 PolarHBondContact O-N 3.3Å | ||
| 232 | N | 58.2 | Low | 63.1 | Low | 111 Ų | 111 | 154.6 Ų | 154.6 | 59% | 0.594 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | -1.1 | -179.9 | -72 | -52.6 | 0 | 0 | 0 | 112.9 | V230 R234 | V230-N232 PolarHBondContact O-N 3.02Å; V230-N232 PolarHBondContact O-ND2 3.5Å; N232-R234 VanDerWaalsContact C-N 3.32Å; N232-R234 PolarHBondContact O-N 2.93Å |
| 233 | Y | 50 | Low | 65.4 | Low | 209 Ų | 209 | 150.7 Ų | 150.7 | 82% | 0.82 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.1 | -5.2 | -170.3 | -59.3 | -72.8 | 0 | 0 | 0 | 114.6 | S231 R235 | S231-Y233 VanDerWaalsContact C-N 3.25Å; S231-Y233 PolarHBondContact O-N 3.3Å; Y233-R235 PolarHBondContact O-N 3.37Å |
| 234 | R | 58.6 | Low | 67.8 | Low | 215 Ų | 215 | 148.5 Ų | 148.5 | 81% | 0.811 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -77.5 | 80.9 | 172.4 | -67 | -59.1 | -147.5 | -161.7 | 7.5 | 111.6 | N232 | N232-R234 VanDerWaalsContact C-N 3.32Å; N232-R234 PolarHBondContact O-N 2.93Å |
| 235 | R | 58.7 | Low | 70 | Confident | 239 Ų | 239 | 152.1 Ų | 152.1 | 90% | 0.902 | 74% | 0.742 | S | S | * | * | S | Bend | trans | 60.1 | 92.1 | -178.9 | -88.3 | -177.5 | -85.5 | -112.5 | 0.4 | 113.5 | Y233 R237 | Y233-R235 PolarHBondContact O-N 3.37Å; R235-R237 VanDerWaalsContact C-N 3.32Å; R235-R237 PolarHBondContact O-N 3.03Å |
| 236 | G | 63.4 | Low | 71.9 | Confident | 77 Ų | 77 | 152.1 Ų | 152.1 | 79% | 0.794 | 74% | 0.735 | S | S | * | * | trans | -64.5 | 67.7 | -173.5 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 237 | R | 78.7 | Confident | 74.2 | Confident | 236 Ų | 236 | 146 Ų | 146 | 89% | 0.891 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 121.5 | 156.8 | -79 | -161.8 | -88 | -130.8 | 1.8 | 109.2 | R235 K239 | R235-R237 VanDerWaalsContact C-N 3.32Å; R235-R237 PolarHBondContact O-N 3.03Å; R237-K239 PolarHBondContact O-N 2.85Å |
| 238 | K | 85.2 | Confident | 77 | Confident | 205 Ų | 205 | 141 Ų | 141 | 89% | 0.891 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 124.5 | 178.8 | -171.1 | 155.8 | -175.9 | 163.5 | 0 | 110.6 | R240 | K238-R240 PolarHBondContact O-N 3.35Š|
| 239 | K | 88.9 | Confident | 79.3 | Confident | 182 Ų | 182 | 141.4 Ų | 141.4 | 79% | 0.791 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -51 | 131 | -177.4 | -173.8 | 175.1 | -179.1 | 177.1 | 0 | 110.1 | R237 V241 | R237-K239 PolarHBondContact O-N 2.85Å; K239-V241 PolarHBondContact O-N 3.48Å |
| 240 | R | 92.4 | Very high | 81.6 | Confident | 239 Ų | 239 | 137.1 Ų | 137.1 | 90% | 0.902 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 120.7 | 177.4 | -82.5 | -176.5 | 161.1 | 131.5 | -3 | 109.7 | K238 | K238-R240 PolarHBondContact O-N 3.35Š|
| 241 | V | 93.9 | Very high | 83.6 | Confident | 127 Ų | 127 | 132.7 Ų | 132.7 | 77% | 0.77 | 62% | 0.622 | S | S | * | * | P | Polyproline II helix | trans | -88.5 | 127.3 | 170.7 | -176.4 | 0 | 0 | 0 | 0 | 108.1 | K239 | K239-V241 PolarHBondContact O-N 3.48Š|
| 242 | P | 96.2 | Very high | 85.9 | Confident | 107 Ų | 107 | 132 Ų | 132 | 70% | 0.695 | 61% | 0.608 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 150.4 | 173.7 | 30.9 | -34 | 0 | 0 | 0 | 111 | ||
| 243 | Y | 97.9 | Very high | 87.8 | Confident | 71 Ų | 71 | 132.5 Ų | 132.5 | 28% | 0.278 | 61% | 0.605 | S | S | . | * | P | Polyproline II helix | trans | -71.6 | 143.5 | 172.5 | -59.2 | -56 | 0 | 0 | 0 | 110.9 | L248 L275 W283 | Y243-L248 HydrophobicContact CD2-CD2 4.3Å; Y243-L275 HydrophobicContact CD1-CD1 3.85Å; Y243-L275 HydrophobicContact CD1-CD2 3.77Å; Y243-L275 HydrophobicContact CD1-CG 4.49Å; Y243-L275 HydrophobicContact CE1-CD1 3.85Å; Y243-L275 HydrophobicContact CE1-CD2 3.67Å; Y243-L275 HydrophobicContact CE1-CG 4.43Å; Y243-W283 AromaticContact CD2-CD1 3.88Å; Y243-W283 AromaticContact CE2-CD1 3.74Å |
| 244 | T | 98.3 | Very high | 90.1 | Very high | 76 Ų | 76 | 124.3 Ų | 124.3 | 47% | 0.466 | 57% | 0.574 | S | S | . | * | P | Polyproline II helix | trans | -73.3 | 160.6 | 178.9 | 76.7 | 0 | 0 | 0 | 0 | 111.5 | L246 Q247 L248 | T244-L246 PolarHBondContact O-N 2.88Å; T244-Q247 PolarHBondContact O-N 2.69Å; T244-Q247 VanDerWaalsContact O-N 3.16Å; T244-Q247 WeakPolarHBondContact OG1-CG 3.44Å; T244-Q247 PolarHBondContact OG1-N 3.26Å; T244-L248 WeakPolarHBondContact O-CG 3.46Å; T244-L248 PolarHBondContact O-N 3.39Å |
| 245 | K | 97.8 | Very high | 91.9 | Very high | 196 Ų | 196 | 114.2 Ų | 114.2 | 85% | 0.852 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -55.3 | -37 | 176.4 | -66.3 | -174.3 | 179.1 | -178.2 | 0 | 112.5 | K249 | K245-K249 WeakPolarHBondContact O-CB 3.4Å; K245-K249 PolarHBondContact O-N 3.23Å |
| 246 | L | 97.3 | Very high | 93.8 | Very high | 117 Ų | 117 | 106.6 Ų | 106.6 | 61% | 0.613 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -69.3 | -43.8 | 177.7 | -177.4 | 61.9 | 0 | 0 | 0 | 112.2 | T244 L248 K249 E250 | T244-L246 PolarHBondContact O-N 2.88Å; L246-L248 VanDerWaalsContact C-N 3.33Å; L246-L248 PolarHBondContact O-N 3.04Å; L246-K249 PolarHBondContact O-N 3.36Å; L246-E250 PolarHBondContact O-N 2.93Å |
| 247 | Q | 98.1 | Very high | 95.3 | Very high | 31 Ų | 31 | 106 Ų | 106 | 15% | 0.145 | 52% | 0.517 | C | S | . | . | H | α-helix | trans | -60.1 | -44.4 | 175.5 | -70 | 174.5 | -29.1 | 0 | 0 | 111.2 | T244 L251 T273 L275 | T244-Q247 PolarHBondContact O-N 2.69Å; T244-Q247 VanDerWaalsContact O-N 3.16Å; T244-Q247 WeakPolarHBondContact OG1-CG 3.44Å; T244-Q247 PolarHBondContact OG1-N 3.26Å; Q247-L251 WeakPolarHBondContact O-CB 3.33Å; Q247-L251 WeakPolarHBondContact O-CD1 3.32Å; Q247-L251 VanDerWaalsContact O-CG 3.23Å; Q247-L251 WeakPolarHBondContact O-CG 3.44Å; Q247-L251 PolarHBondContact O-N 2.76Å; Q247-L251 VanDerWaalsContact O-N 3.14Å; Q247-T273 WeakPolarHBondContact CG-O 3.46Å; Q247-T273 PolarHBondContact NE2-O 3.48Å; Q247-L275 HydrophobicContact CB-CD1 4.31Å; Q247-L275 HydrophobicContact CG-CD1 4.42Å; Q247-L275 HydrophobicContact CG-CG 4.47Å |
| 248 | L | 98.2 | Very high | 96.2 | Very high | 59 Ų | 59 | 96.8 Ų | 96.8 | 31% | 0.309 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.2 | -43 | 176.6 | -67.8 | 174.3 | 0 | 0 | 0 | 112 | Y243 T244 L246 E250 L251 E252 | Y243-L248 HydrophobicContact CD2-CD2 4.3Å; T244-L248 WeakPolarHBondContact O-CG 3.46Å; T244-L248 PolarHBondContact O-N 3.39Å; L246-L248 VanDerWaalsContact C-N 3.33Å; L246-L248 PolarHBondContact O-N 3.04Å; L248-E250 PolarHBondContact O-N 2.97Å; L248-L251 PolarHBondContact O-N 3.23Å; L248-E252 WeakPolarHBondContact O-CB 3.23Å; L248-E252 WeakPolarHBondContact O-CG 3.42Å; L248-E252 PolarHBondContact O-N 3.42Å |
| 249 | K | 98.1 | Very high | 96.7 | Very high | 137 Ų | 137 | 91.1 Ų | 91.1 | 60% | 0.596 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -55.8 | -50.4 | 178.1 | -176.7 | -174.3 | 175.9 | -173.3 | 0 | 112.5 | K245 L246 E252 K253 | K245-K249 WeakPolarHBondContact O-CB 3.4Å; K245-K249 PolarHBondContact O-N 3.23Å; L246-K249 PolarHBondContact O-N 3.36Å; K249-E252 PolarHBondContact O-N 3.38Å; K249-K253 VanDerWaalsContact O-CB 3.24Å; K249-K253 WeakPolarHBondContact O-CB 3.35Å; K249-K253 PolarHBondContact O-N 2.95Å |
| 250 | E | 97.8 | Very high | 97.2 | Very high | 57 Ų | 57 | 89 Ų | 89 | 27% | 0.266 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -70.5 | -34.2 | -179.1 | -70.5 | -61.6 | 119.8 | 0 | 0 | 112.4 | L246 L248 K253 E254 T273 | L246-E250 PolarHBondContact O-N 2.93Å; L248-E250 PolarHBondContact O-N 2.97Å; E250-K253 WeakPolarHBondContact OE1-CD 3.42Å; E250-K253 IonicContact OE1-NZ 2.99Å; E250-K253 PolarHBondContact OE1-NZ 3.38Å; E250-K253 WeakPolarHBondContact OE2-CD 3.2Å; E250-K253 IonicContact OE2-NZ 2.68Å; E250-K253 PolarHBondContact OE2-NZ 2.8Å; E250-E254 PolarHBondContact O-N 3.5Å; E250-T273 HydrophobicContact CB-CG2 4.01Å |
| 251 | L | 98.3 | Very high | 97.4 | Very high | 0 Ų | 0 | 78.6 Ų | 78.6 | 0% | 0 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -64.6 | -41.4 | 172.7 | -74 | 164.7 | 0 | 0 | 0 | 112.3 | Q247 L248 Y255 I269 L275 V280 W283 F284 | Q247-L251 WeakPolarHBondContact O-CB 3.33Å; Q247-L251 WeakPolarHBondContact O-CD1 3.32Å; Q247-L251 VanDerWaalsContact O-CG 3.23Å; Q247-L251 WeakPolarHBondContact O-CG 3.44Å; Q247-L251 PolarHBondContact O-N 2.76Å; Q247-L251 VanDerWaalsContact O-N 3.14Å; L248-L251 PolarHBondContact O-N 3.23Å; L251-Y255 VanDerWaalsContact O-CB 3.31Å; L251-Y255 WeakPolarHBondContact O-CB 3.49Å; L251-Y255 PolarHBondContact O-N 2.67Å; L251-I269 HydrophobicContact CD2-CG2 3.77Å; L251-I269 HydrophobicContact CG-CG2 4.41Å; L251-L275 HydrophobicContact CD1-CD1 3.94Å; L251-V280 HydrophobicContact CD2-CG1 4.07Å; L251-V280 HydrophobicContact CD2-CG2 4.47Å; L251-W283 HydrophobicContact CB-CD2 3.94Å; L251-W283 HydrophobicContact CB-CE3 3.96Å; L251-W283 HydrophobicContact CB-CH2 3.81Å; L251-W283 HydrophobicContact CB-CZ2 3.78Å; L251-W283 HydrophobicContact CB-CZ3 3.9Å; L251-W283 HydrophobicContact CD1-CB 4.5Å; L251-W283 HydrophobicContact CD1-CD2 3.96Å; L251-W283 HydrophobicContact CD1-CG 3.85Å; L251-W283 HydrophobicContact CD2-CD2 4.15Å; L251-W283 HydrophobicContact CD2-CE3 4.04Å; L251-W283 HydrophobicContact CD2-CG 4.38Å; L251-W283 HydrophobicContact CG-CD2 4.25Å; L251-W283 HydrophobicContact CG-CE3 4.44Å; L251-W283 WeakPolarHBondContact O-CZ3 3.2Å; L251-F284 HydrophobicContact CD2-CD2 4.46Å; L251-F284 HydrophobicContact CD2-CE2 4.06Å |
| 252 | E | 98.1 | Very high | 97.6 | Very high | 80 Ų | 80 | 76.7 Ų | 76.7 | 37% | 0.374 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -75.5 | -35.8 | -179.7 | -70.5 | -169.4 | 135.2 | 0 | 0 | 112.9 | L248 K249 Y255 A256 W283 R287 | L248-E252 WeakPolarHBondContact O-CB 3.23Å; L248-E252 WeakPolarHBondContact O-CG 3.42Å; L248-E252 PolarHBondContact O-N 3.42Å; K249-E252 PolarHBondContact O-N 3.38Å; E252-Y255 PolarHBondContact O-N 3.17Å; E252-A256 PolarHBondContact O-N 3.18Å; E252-W283 HydrophobicContact CB-CH2 4.48Å; E252-W283 HydrophobicContact CG-CH2 3.61Å; E252-W283 HydrophobicContact CG-CZ2 3.56Å; E252-R287 IonicContact OE1-NE 3.91Å; E252-R287 PolarHBondContact OE1-NE 3.08Å |
| 253 | K | 97.8 | Very high | 97.7 | Very high | 123 Ų | 123 | 78.4 Ų | 78.4 | 54% | 0.535 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -56 | -50.3 | 170.2 | 171.2 | -172.5 | 171.4 | -166.8 | 0 | 112.2 | K249 E250 A256 G257 | K249-K253 VanDerWaalsContact O-CB 3.24Å; K249-K253 WeakPolarHBondContact O-CB 3.35Å; K249-K253 PolarHBondContact O-N 2.95Å; E250-K253 WeakPolarHBondContact OE1-CD 3.42Å; E250-K253 IonicContact OE1-NZ 2.99Å; E250-K253 PolarHBondContact OE1-NZ 3.38Å; E250-K253 WeakPolarHBondContact OE2-CD 3.2Å; E250-K253 IonicContact OE2-NZ 2.68Å; E250-K253 PolarHBondContact OE2-NZ 2.8Å; K253-A256 PolarHBondContact O-N 3.37Å; K253-G257 PolarHBondContact O-N 3.34Å |
| 254 | E | 97.8 | Very high | 97.7 | Very high | 36 Ų | 36 | 79 Ų | 79 | 17% | 0.168 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -71.2 | -29.7 | 176.6 | -82.3 | -76.9 | 177.5 | 0 | 0 | 112.5 | E250 G257 S258 K265 I269 F284 | E250-E254 PolarHBondContact O-N 3.5Å; E254-G257 PolarHBondContact O-N 3.03Å; E254-S258 PolarHBondContact O-N 3.17Å; E254-K265 IonicContact OE1-NZ 3.38Å; E254-K265 WeakPolarHBondContact OE2-CD 3.3Å; E254-K265 VanDerWaalsContact OE2-CE 3.31Å; E254-K265 WeakPolarHBondContact OE2-CE 3.38Å; E254-K265 IonicContact OE2-NZ 3.69Å; E254-K265 PolarHBondContact OE2-NZ 3.23Å; E254-I269 HydrophobicContact CB-CD1 3.68Å; E254-I269 HydrophobicContact CG-CD1 3.76Å; E254-I269 HydrophobicContact CG-CG1 4.09Å; E254-F284 HydrophobicContact CB-CZ 4.25Å |
| 255 | Y | 98 | Very high | 97.6 | Very high | 3 Ų | 3 | 77.9 Ų | 77.9 | 1% | 0.012 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -68.9 | -30.3 | 173.1 | -168.3 | -96.1 | 0 | 0 | 0 | 114 | L251 E252 S258 K259 W283 F284 R287 R288 E291 | L251-Y255 VanDerWaalsContact O-CB 3.31Å; L251-Y255 WeakPolarHBondContact O-CB 3.49Å; L251-Y255 PolarHBondContact O-N 2.67Å; E252-Y255 PolarHBondContact O-N 3.17Å; Y255-S258 WeakPolarHBondContact CA-O 3.28Å; Y255-S258 CarbonylContact O-C 3.42Å; Y255-K259 HydrophobicContact CD1-CD 4.19Å; Y255-K259 HydrophobicContact CE1-CD 3.54Å; Y255-K259 HydrophobicContact CE2-CB 4.44Å; Y255-K259 HydrophobicContact CE2-CD 4.24Å; Y255-W283 HydrophobicContact CD2-CZ3 4.04Å; Y255-W283 HydrophobicContact CG-CH2 4.36Å; Y255-W283 HydrophobicContact CG-CZ3 4.17Å; Y255-F284 AromaticContact CD2-CD1 3.76Å; Y255-F284 HydrophobicContact CD2-CD1 3.76Å; Y255-F284 AromaticContact CD2-CE1 3.75Å; Y255-F284 HydrophobicContact CD2-CE1 3.75Å; Y255-F284 HydrophobicContact CE2-CD1 4.32Å; Y255-R287 HydrophobicContact CD1-CG 3.68Å; Y255-R287 HydrophobicContact CD2-CB 4.11Å; Y255-R287 HydrophobicContact CD2-CG 3.69Å; Y255-R287 HydrophobicContact CE1-CG 3.62Å; Y255-R287 HydrophobicContact CE2-CB 3.87Å; Y255-R287 HydrophobicContact CE2-CG 3.62Å; Y255-R287 HydrophobicContact CG-CG 3.73Å; Y255-R288 HydrophobicContact CE2-CG 3.89Å; Y255-R288 WeakPolarHBondContact OH-CA 3.41Å; Y255-R288 WeakPolarHBondContact OH-CG 3.31Å; Y255-E291 WeakPolarHBondContact CE1-OE1 3.44Å; Y255-E291 WeakPolarHBondContact CE1-OE2 3.43Å; Y255-E291 PolarHBondContact OH-OE2 3.25Å |
| 256 | A | 97.3 | Very high | 97.7 | Very high | 80 Ų | 80 | 71.9 Ų | 71.9 | 66% | 0.661 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -66.8 | -45.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | E252 K253 | E252-A256 PolarHBondContact O-N 3.18Å; K253-A256 PolarHBondContact O-N 3.37Å |
| 257 | G | 96.3 | Very high | 97.7 | Very high | 63 Ų | 63 | 72.6 Ų | 72.6 | 65% | 0.649 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -72.8 | -25.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115 | K253 E254 | K253-G257 PolarHBondContact O-N 3.34Å; E254-G257 PolarHBondContact O-N 3.03Å |
| 258 | S | 96.6 | Very high | 97.7 | Very high | 43 Ų | 43 | 78.8 Ų | 78.8 | 30% | 0.301 | 39% | 0.388 | S | S | . | . | trans | -158.7 | 131.3 | 169.7 | 178.2 | 0 | 0 | 0 | 0 | 112.5 | E254 Y255 F260 | E254-S258 PolarHBondContact O-N 3.17Å; Y255-S258 WeakPolarHBondContact CA-O 3.28Å; Y255-S258 CarbonylContact O-C 3.42Å; S258-F260 WeakPolarHBondContact CB-O 3.35Å; S258-F260 PolarHBondContact O-N 3.37Å; S258-F260 PolarHBondContact OG-N 3.35Å; S258-F260 VanDerWaalsContact OG-N 3.17Å; S258-F260 PolarHBondContact OG-O 2.98Å | ||
| 259 | K | 96.9 | Very high | 97.7 | Very high | 87 Ų | 87 | 76.5 Ų | 76.5 | 38% | 0.378 | 38% | 0.376 | S | S | . | . | S | Bend | trans | -67.5 | -13.8 | 174.1 | -51.7 | -61.5 | -177.8 | 175.4 | 0 | 113.4 | Y255 R288 E291 | Y255-K259 HydrophobicContact CD1-CD 4.19Å; Y255-K259 HydrophobicContact CE1-CD 3.54Å; Y255-K259 HydrophobicContact CE2-CB 4.44Å; Y255-K259 HydrophobicContact CE2-CD 4.24Å; K259-R288 WeakPolarHBondContact O-CD 3.41Å; K259-E291 IonicContact NZ-OE1 2.8Å; K259-E291 PolarHBondContact NZ-OE1 3.2Å; K259-E291 IonicContact NZ-OE2 3.9Å; K259-E291 PolarHBondContact NZ-OE2 2.79Å |
| 260 | F | 97.6 | Very high | 97.7 | Very high | 137 Ų | 137 | 71.1 Ų | 71.1 | 60% | 0.601 | 36% | 0.356 | S | S | * | . | S | Bend | trans | -128.8 | 140.7 | -178.1 | -67.2 | -101.9 | 0 | 0 | 0 | 111.6 | S258 | S258-F260 WeakPolarHBondContact CB-O 3.35Å; S258-F260 PolarHBondContact O-N 3.37Å; S258-F260 PolarHBondContact OG-N 3.35Å; S258-F260 VanDerWaalsContact OG-N 3.17Å; S258-F260 PolarHBondContact OG-O 2.98Å |
| 261 | I | 97.4 | Very high | 97.7 | Very high | 20 Ų | 20 | 72 Ų | 72 | 10% | 0.103 | 37% | 0.373 | C | S | . | . | trans | -108.6 | 113 | -171.2 | -165 | 69.1 | 0 | 0 | 0 | 113.2 | K265 R266 I269 F284 | I261-K265 HydrophobicContact CD1-CB 3.43Å; I261-K265 VanDerWaalsContact CD1-CB 3.43Å; I261-K265 HydrophobicContact CD1-CD 4.35Å; I261-K265 HydrophobicContact CG1-CB 4.28Å; I261-R266 HydrophobicContact CG1-CB 3.89Å; I261-R266 PolarHBondContact O-NH2 2.9Å; I261-I269 HydrophobicContact CD1-CD1 3.54Å; I261-I269 HydrophobicContact CG1-CD1 4.33Å; I261-F284 HydrophobicContact CB-CD1 3.86Å; I261-F284 HydrophobicContact CB-CD2 4.16Å; I261-F284 HydrophobicContact CB-CE1 3.91Å; I261-F284 HydrophobicContact CB-CE2 4.22Å; I261-F284 HydrophobicContact CB-CG 4Å; I261-F284 HydrophobicContact CB-CZ 4.1Å; I261-F284 HydrophobicContact CD1-CE1 4.27Å; I261-F284 HydrophobicContact CD1-CE2 4.18Å; I261-F284 HydrophobicContact CD1-CZ 3.83Å; I261-F284 HydrophobicContact CG1-CE2 4.23Å; I261-F284 HydrophobicContact CG1-CZ 4.24Å; I261-F284 HydrophobicContact CG2-CB 4.12Å; I261-F284 HydrophobicContact CG2-CD1 4.16Å; I261-F284 HydrophobicContact CG2-CD2 4.09Å; I261-F284 HydrophobicContact CG2-CG 3.86Å | ||
| 262 | T | 98.1 | Very high | 97.7 | Very high | 87 Ų | 87 | 75 Ų | 75 | 53% | 0.534 | 40% | 0.404 | S | S | . | . | trans | -67.5 | 161.9 | 174.4 | 61.3 | 0 | 0 | 0 | 0 | 111.7 | D264 K265 R266 | T262-D264 PolarHBondContact O-N 3.21Å; T262-K265 PolarHBondContact O-N 2.71Å; T262-R266 VanDerWaalsContact O-CB 3.24Å; T262-R266 WeakPolarHBondContact O-CB 3.31Å; T262-R266 PolarHBondContact O-N 3.26Å | ||
| 263 | K | 97.9 | Very high | 97.6 | Very high | 144 Ų | 144 | 71.7 Ų | 71.7 | 63% | 0.626 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -54.4 | -48.6 | -177.8 | -170.5 | -179.5 | 179.7 | -175.3 | 0 | 112 | R266 R267 | K263-R266 WeakPolarHBondContact O-CB 3.49Å; K263-R266 PolarHBondContact O-N 3.46Å; K263-R267 WeakPolarHBondContact O-CG 3.41Å; K263-R267 PolarHBondContact O-N 3.35Å |
| 264 | D | 97.8 | Very high | 97.6 | Very high | 82 Ų | 82 | 72.8 Ų | 72.8 | 44% | 0.439 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -81.2 | -29.1 | -173.2 | -58.2 | -71.8 | 0 | 0 | 0 | 114 | T262 R267 R268 | T262-D264 PolarHBondContact O-N 3.21Å; D264-R267 IonicContact OD1-CZ 2.8Å; D264-R267 IonicContact OD1-NH1 3.5Å; D264-R267 PolarHBondContact OD1-NH1 3.3Å; D264-R268 WeakPolarHBondContact O-CG 3.44Å; D264-R268 PolarHBondContact O-N 2.76Å |
| 265 | K | 97.4 | Very high | 97.6 | Very high | 54 Ų | 54 | 71.5 Ų | 71.5 | 24% | 0.235 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -65 | -41.8 | 165.6 | -75.3 | -170.2 | 158.2 | -153.9 | 0 | 110.9 | E254 I261 T262 R267 R268 I269 | E254-K265 IonicContact OE1-NZ 3.38Å; E254-K265 WeakPolarHBondContact OE2-CD 3.3Å; E254-K265 VanDerWaalsContact OE2-CE 3.31Å; E254-K265 WeakPolarHBondContact OE2-CE 3.38Å; E254-K265 IonicContact OE2-NZ 3.69Å; E254-K265 PolarHBondContact OE2-NZ 3.23Å; I261-K265 HydrophobicContact CD1-CB 3.43Å; I261-K265 VanDerWaalsContact CD1-CB 3.43Å; I261-K265 HydrophobicContact CD1-CD 4.35Å; I261-K265 HydrophobicContact CG1-CB 4.28Å; T262-K265 PolarHBondContact O-N 2.71Å; K265-R267 PolarHBondContact O-N 2.92Å; K265-R268 PolarHBondContact O-N 2.98Å; K265-I269 WeakPolarHBondContact O-CG1 3.37Å; K265-I269 PolarHBondContact O-N 3.49Å |
| 266 | R | 98.4 | Very high | 97.6 | Very high | 69 Ų | 69 | 74 Ų | 74 | 26% | 0.26 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -59.4 | -45.5 | 176.5 | -170.7 | -170.2 | -56 | 170.8 | 5.3 | 112.2 | I261 T262 K263 I269 S270 E277 V280 T281 | I261-R266 HydrophobicContact CG1-CB 3.89Å; I261-R266 PolarHBondContact O-NH2 2.9Å; T262-R266 VanDerWaalsContact O-CB 3.24Å; T262-R266 WeakPolarHBondContact O-CB 3.31Å; T262-R266 PolarHBondContact O-N 3.26Å; K263-R266 WeakPolarHBondContact O-CB 3.49Å; K263-R266 PolarHBondContact O-N 3.46Å; R266-I269 PolarHBondContact O-N 3.32Å; R266-S270 WeakPolarHBondContact O-CB 3.43Å; R266-S270 PolarHBondContact O-N 3.08Å; R266-E277 VanDerWaalsContact CD-OE2 3.3Å; R266-E277 WeakPolarHBondContact CD-OE2 3.36Å; R266-E277 HydrophobicContact CG-CB 4.04Å; R266-E277 HydrophobicContact CG-CG 4.08Å; R266-V280 HydrophobicContact CG-CB 4.22Å; R266-V280 HydrophobicContact CG-CG1 4.07Å; R266-T281 WeakPolarHBondContact CD-OG1 3.24Å; R266-T281 PolarHBondContact NE-OG1 3.32Å |
| 267 | R | 98.4 | Very high | 97.6 | Very high | 133 Ų | 133 | 73.6 Ų | 73.6 | 50% | 0.502 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -58.8 | -47.4 | 173.2 | -74.1 | 172.4 | 62.4 | -123.3 | -6.1 | 112.2 | K263 D264 K265 S270 A271 E277 | K263-R267 WeakPolarHBondContact O-CG 3.41Å; K263-R267 PolarHBondContact O-N 3.35Å; D264-R267 IonicContact OD1-CZ 2.8Å; D264-R267 IonicContact OD1-NH1 3.5Å; D264-R267 PolarHBondContact OD1-NH1 3.3Å; K265-R267 PolarHBondContact O-N 2.92Å; R267-S270 WeakPolarHBondContact O-CB 3.34Å; R267-S270 PolarHBondContact O-N 2.58Å; R267-A271 PolarHBondContact O-N 2.94Å; R267-E277 VanDerWaalsContact CG-OE1 3.3Å; R267-E277 WeakPolarHBondContact CG-OE1 3.3Å |
| 268 | R | 98.2 | Very high | 97.7 | Very high | 160 Ų | 160 | 79.8 Ų | 79.8 | 60% | 0.604 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -61.8 | -46 | 177.7 | -75.5 | -170.6 | -73.3 | 143.8 | -14.7 | 112.9 | D264 K265 S270 A271 G272 | D264-R268 WeakPolarHBondContact O-CG 3.44Å; D264-R268 PolarHBondContact O-N 2.76Å; K265-R268 PolarHBondContact O-N 2.98Å; R268-S270 VanDerWaalsContact C-N 3.34Å; R268-A271 PolarHBondContact O-N 3.04Å; R268-G272 PolarHBondContact O-N 3.29Å |
| 269 | I | 97.7 | Very high | 97.8 | Very high | 11 Ų | 11 | 81.2 Ų | 81.2 | 6% | 0.056 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -62.8 | -43.1 | 174.9 | -63.7 | 170.6 | 0 | 0 | 0 | 110.4 | L251 E254 I261 K265 R266 A271 G272 T273 V280 F284 | L251-I269 HydrophobicContact CD2-CG2 3.77Å; L251-I269 HydrophobicContact CG-CG2 4.41Å; E254-I269 HydrophobicContact CB-CD1 3.68Å; E254-I269 HydrophobicContact CG-CD1 3.76Å; E254-I269 HydrophobicContact CG-CG1 4.09Å; I261-I269 HydrophobicContact CD1-CD1 3.54Å; I261-I269 HydrophobicContact CG1-CD1 4.33Å; K265-I269 WeakPolarHBondContact O-CG1 3.37Å; K265-I269 PolarHBondContact O-N 3.49Å; R266-I269 PolarHBondContact O-N 3.32Å; I269-A271 PolarHBondContact O-N 3.31Å; I269-G272 PolarHBondContact O-N 3.37Å; I269-T273 HydrophobicContact CG2-CG2 3.96Å; I269-T273 WeakPolarHBondContact O-CB 3.47Å; I269-T273 WeakPolarHBondContact O-CG2 3.38Å; I269-T273 PolarHBondContact O-N 3.36Å; I269-T273 PolarHBondContact O-OG1 3.08Å; I269-V280 HydrophobicContact CB-CG1 4.34Å; I269-V280 HydrophobicContact CD1-CG1 4.4Å; I269-V280 HydrophobicContact CG2-CG1 4.03Å; I269-V280 HydrophobicContact CG2-CG2 3.92Å; I269-F284 HydrophobicContact CD1-CE2 4.14Å; I269-F284 HydrophobicContact CD1-CZ 4.34Å |
| 270 | S | 98.4 | Very high | 97.9 | Very high | 25 Ų | 25 | 77.1 Ų | 77.1 | 18% | 0.175 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -56 | -49 | -180 | -179.1 | 0 | 0 | 0 | 0 | 111.5 | R266 R267 R268 N274 L275 E277 | R266-S270 WeakPolarHBondContact O-CB 3.43Å; R266-S270 PolarHBondContact O-N 3.08Å; R267-S270 WeakPolarHBondContact O-CB 3.34Å; R267-S270 PolarHBondContact O-N 2.58Å; R268-S270 VanDerWaalsContact C-N 3.34Å; S270-N274 PolarHBondContact O-N 3.45Å; S270-N274 VanDerWaalsContact O-N 3.12Å; S270-L275 CarbonylContact C-O 3.59Å; S270-L275 WeakPolarHBondContact CA-O 3.32Å; S270-L275 VanDerWaalsContact CB-O 3.28Å; S270-L275 WeakPolarHBondContact CB-O 3.43Å; S270-L275 PolarHBondContact O-N 3.11Å; S270-L275 PolarHBondContact OG-O 3.49Å; S270-E277 PolarHBondContact OG-N 3.1Å |
| 271 | A | 97.9 | Very high | 97.9 | Very high | 75 Ų | 75 | 72.1 Ų | 72.1 | 62% | 0.62 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -63.5 | -50.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | R267 R268 I269 T273 | R267-A271 PolarHBondContact O-N 2.94Å; R268-A271 PolarHBondContact O-N 3.04Å; I269-A271 PolarHBondContact O-N 3.31Å; A271-T273 VanDerWaalsContact C-N 3.27Å; A271-T273 PolarHBondContact O-N 3.12Å |
| 272 | G | 97.1 | Very high | 97.9 | Very high | 64 Ų | 64 | 74.1 Ų | 74.1 | 66% | 0.66 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -68.9 | -18.3 | -176.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | R268 I269 | R268-G272 PolarHBondContact O-N 3.29Å; I269-G272 PolarHBondContact O-N 3.37Å |
| 273 | T | 97 | Very high | 98 | Very high | 9 Ų | 9 | 71 Ų | 71 | 6% | 0.055 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -112 | -5.7 | -178 | 61.1 | 0 | 0 | 0 | 0 | 114.2 | Q247 E250 I269 A271 L275 | Q247-T273 WeakPolarHBondContact CG-O 3.46Å; Q247-T273 PolarHBondContact NE2-O 3.48Å; E250-T273 HydrophobicContact CB-CG2 4.01Å; I269-T273 HydrophobicContact CG2-CG2 3.96Å; I269-T273 WeakPolarHBondContact O-CB 3.47Å; I269-T273 WeakPolarHBondContact O-CG2 3.38Å; I269-T273 PolarHBondContact O-N 3.36Å; I269-T273 PolarHBondContact O-OG1 3.08Å; A271-T273 VanDerWaalsContact C-N 3.27Å; A271-T273 PolarHBondContact O-N 3.12Å; T273-L275 PolarHBondContact O-N 2.96Å |
| 274 | N | 97.8 | Very high | 98 | Very high | 146 Ų | 146 | 64.4 Ų | 64.4 | 78% | 0.781 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.4 | 38.4 | -170 | -66.4 | -66.5 | 0 | 0 | 0 | 113 | S270 | S270-N274 PolarHBondContact O-N 3.45Å; S270-N274 VanDerWaalsContact O-N 3.12Å |
| 275 | L | 97.4 | Very high | 98 | Very high | 10 Ų | 10 | 65 Ų | 65 | 5% | 0.052 | 33% | 0.326 | C | S | . | . | trans | -113.2 | 141.8 | 174 | -64.8 | -178.7 | 0 | 0 | 0 | 109.4 | Y243 Q247 L251 S270 T273 Q279 V280 | Y243-L275 HydrophobicContact CD1-CD1 3.85Å; Y243-L275 HydrophobicContact CD1-CD2 3.77Å; Y243-L275 HydrophobicContact CD1-CG 4.49Å; Y243-L275 HydrophobicContact CE1-CD1 3.85Å; Y243-L275 HydrophobicContact CE1-CD2 3.67Å; Y243-L275 HydrophobicContact CE1-CG 4.43Å; Q247-L275 HydrophobicContact CB-CD1 4.31Å; Q247-L275 HydrophobicContact CG-CD1 4.42Å; Q247-L275 HydrophobicContact CG-CG 4.47Å; L251-L275 HydrophobicContact CD1-CD1 3.94Å; S270-L275 CarbonylContact C-O 3.59Å; S270-L275 WeakPolarHBondContact CA-O 3.32Å; S270-L275 VanDerWaalsContact CB-O 3.28Å; S270-L275 WeakPolarHBondContact CB-O 3.43Å; S270-L275 PolarHBondContact O-N 3.11Å; S270-L275 PolarHBondContact OG-O 3.49Å; T273-L275 PolarHBondContact O-N 2.96Å; L275-Q279 HydrophobicContact CB-CB 4.31Å; L275-V280 HydrophobicContact CB-CG2 4.21Å | ||
| 276 | S | 98.3 | Very high | 98 | Very high | 54 Ų | 54 | 67.1 Ų | 67.1 | 38% | 0.378 | 34% | 0.34 | S | S | . | . | trans | -62.3 | 148.6 | 173.2 | 63.3 | 0 | 0 | 0 | 0 | 111.7 | R278 Q279 V280 | S276-R278 PolarHBondContact O-N 2.92Å; S276-Q279 WeakPolarHBondContact O-CA 3.18Å; S276-Q279 WeakPolarHBondContact O-CB 3.36Å; S276-Q279 PolarHBondContact O-N 3.39Å; S276-Q279 WeakPolarHBondContact OG-CG 3.35Å; S276-Q279 PolarHBondContact OG-N 3.33Å; S276-Q279 PolarHBondContact OG-OE1 2.85Å; S276-V280 PolarHBondContact O-N 3.38Å | ||
| 277 | E | 98.3 | Very high | 98 | Very high | 72 Ų | 72 | 66.5 Ų | 66.5 | 34% | 0.336 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -51.1 | -32.1 | 173.1 | -73.5 | -164.2 | -129.9 | 0 | 0 | 112.9 | R266 R267 S270 T281 | R266-E277 VanDerWaalsContact CD-OE2 3.3Å; R266-E277 WeakPolarHBondContact CD-OE2 3.36Å; R266-E277 HydrophobicContact CG-CB 4.04Å; R266-E277 HydrophobicContact CG-CG 4.08Å; R267-E277 VanDerWaalsContact CG-OE1 3.3Å; R267-E277 WeakPolarHBondContact CG-OE1 3.3Å; S270-E277 PolarHBondContact OG-N 3.1Å; E277-T281 WeakPolarHBondContact O-CB 3.43Å; E277-T281 PolarHBondContact O-N 3.11Å; E277-T281 PolarHBondContact O-OG1 3.35Å |
| 278 | R | 97.9 | Very high | 98 | Very high | 193 Ų | 193 | 64.4 Ų | 64.4 | 73% | 0.728 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -66.8 | -43.6 | 174.3 | -170.6 | -178.9 | -179.4 | -160.1 | 2.3 | 112.1 | S276 T281 I282 | S276-R278 PolarHBondContact O-N 2.92Å; R278-T281 PolarHBondContact O-N 3.2Å; R278-I282 HydrophobicContact CG-CD1 3.93Å; R278-I282 WeakPolarHBondContact O-CB 3.44Å; R278-I282 VanDerWaalsContact O-CG1 3.27Å; R278-I282 WeakPolarHBondContact O-CG1 3.37Å; R278-I282 PolarHBondContact O-N 3.24Å |
| 279 | Q | 98.1 | Very high | 98 | Very high | 74 Ų | 74 | 60.3 Ų | 60.3 | 35% | 0.346 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63.6 | -42.9 | 174.5 | -76.6 | 161.6 | -70.5 | 0 | 0 | 111.7 | L275 S276 T281 I282 W283 | L275-Q279 HydrophobicContact CB-CB 4.31Å; S276-Q279 WeakPolarHBondContact O-CA 3.18Å; S276-Q279 WeakPolarHBondContact O-CB 3.36Å; S276-Q279 PolarHBondContact O-N 3.39Å; S276-Q279 WeakPolarHBondContact OG-CG 3.35Å; S276-Q279 PolarHBondContact OG-N 3.33Å; S276-Q279 PolarHBondContact OG-OE1 2.85Å; Q279-T281 VanDerWaalsContact C-N 3.35Å; Q279-T281 PolarHBondContact O-N 3.48Å; Q279-I282 PolarHBondContact O-N 3.23Å; Q279-W283 WeakPolarHBondContact O-CB 3.27Å; Q279-W283 PolarHBondContact O-N 3.34Å |
| 280 | V | 98.3 | Very high | 97.9 | Very high | 0 Ų | 0 | 64.2 Ų | 64.2 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -58.3 | -47.7 | 173.7 | 179.6 | 0 | 0 | 0 | 0 | 110.2 | L251 R266 I269 L275 S276 I282 W283 F284 | L251-V280 HydrophobicContact CD2-CG1 4.07Å; L251-V280 HydrophobicContact CD2-CG2 4.47Å; R266-V280 HydrophobicContact CG-CB 4.22Å; R266-V280 HydrophobicContact CG-CG1 4.07Å; I269-V280 HydrophobicContact CB-CG1 4.34Å; I269-V280 HydrophobicContact CD1-CG1 4.4Å; I269-V280 HydrophobicContact CG2-CG1 4.03Å; I269-V280 HydrophobicContact CG2-CG2 3.92Å; L275-V280 HydrophobicContact CB-CG2 4.21Å; S276-V280 PolarHBondContact O-N 3.38Å; V280-I282 PolarHBondContact O-N 3.3Å; V280-W283 PolarHBondContact O-N 2.95Å; V280-F284 HydrophobicContact CG1-CD2 4.04Å; V280-F284 HydrophobicContact CG1-CE2 4.12Å; V280-F284 WeakPolarHBondContact O-CD2 3.49Å; V280-F284 PolarHBondContact O-N 3.14Å |
| 281 | T | 98.3 | Very high | 97.8 | Very high | 32 Ų | 32 | 65.5 Ų | 65.5 | 20% | 0.196 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60.5 | -45.9 | 178.3 | -55.6 | 0 | 0 | 0 | 0 | 112.3 | R266 E277 R278 Q279 W283 F284 Q285 | R266-T281 WeakPolarHBondContact CD-OG1 3.24Å; R266-T281 PolarHBondContact NE-OG1 3.32Å; E277-T281 WeakPolarHBondContact O-CB 3.43Å; E277-T281 PolarHBondContact O-N 3.11Å; E277-T281 PolarHBondContact O-OG1 3.35Å; R278-T281 PolarHBondContact O-N 3.2Å; Q279-T281 VanDerWaalsContact C-N 3.35Å; Q279-T281 PolarHBondContact O-N 3.48Å; T281-W283 VanDerWaalsContact C-N 3.34Å; T281-W283 PolarHBondContact O-N 3Å; T281-F284 PolarHBondContact O-N 2.97Å; T281-Q285 WeakPolarHBondContact O-CG 3.39Å; T281-Q285 PolarHBondContact O-N 3.44Å |
| 282 | I | 98.3 | Very high | 97.7 | Very high | 63 Ų | 63 | 69.6 Ų | 69.6 | 32% | 0.323 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64.3 | -38.5 | 177 | -71.2 | 167.2 | 0 | 0 | 0 | 111 | R278 Q279 V280 Q285 N286 | R278-I282 HydrophobicContact CG-CD1 3.93Å; R278-I282 WeakPolarHBondContact O-CB 3.44Å; R278-I282 VanDerWaalsContact O-CG1 3.27Å; R278-I282 WeakPolarHBondContact O-CG1 3.37Å; R278-I282 PolarHBondContact O-N 3.24Å; Q279-I282 PolarHBondContact O-N 3.23Å; V280-I282 PolarHBondContact O-N 3.3Å; I282-Q285 PolarHBondContact O-N 3.32Å; I282-N286 WeakPolarHBondContact O-CB 3.38Å; I282-N286 VanDerWaalsContact O-CG 3.27Å; I282-N286 PolarHBondContact O-N 3.43Å; I282-N286 PolarHBondContact O-ND2 3.33Å |
| 283 | W | 98.4 | Very high | 97.5 | Very high | 22 Ų | 22 | 73.4 Ų | 73.4 | 8% | 0.083 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -63.5 | -45.5 | 175.8 | -172.6 | 103.2 | 0 | 0 | 0 | 111.2 | Y243 L251 E252 Y255 Q279 V280 T281 Q285 N286 R287 | Y243-W283 AromaticContact CD2-CD1 3.88Å; Y243-W283 AromaticContact CE2-CD1 3.74Å; L251-W283 HydrophobicContact CB-CD2 3.94Å; L251-W283 HydrophobicContact CB-CE3 3.96Å; L251-W283 HydrophobicContact CB-CH2 3.81Å; L251-W283 HydrophobicContact CB-CZ2 3.78Å; L251-W283 HydrophobicContact CB-CZ3 3.9Å; L251-W283 HydrophobicContact CD1-CB 4.5Å; L251-W283 HydrophobicContact CD1-CD2 3.96Å; L251-W283 HydrophobicContact CD1-CG 3.85Å; L251-W283 HydrophobicContact CD2-CD2 4.15Å; L251-W283 HydrophobicContact CD2-CE3 4.04Å; L251-W283 HydrophobicContact CD2-CG 4.38Å; L251-W283 HydrophobicContact CG-CD2 4.25Å; L251-W283 HydrophobicContact CG-CE3 4.44Å; L251-W283 WeakPolarHBondContact O-CZ3 3.2Å; E252-W283 HydrophobicContact CB-CH2 4.48Å; E252-W283 HydrophobicContact CG-CH2 3.61Å; E252-W283 HydrophobicContact CG-CZ2 3.56Å; Y255-W283 HydrophobicContact CD2-CZ3 4.04Å; Y255-W283 HydrophobicContact CG-CH2 4.36Å; Y255-W283 HydrophobicContact CG-CZ3 4.17Å; Q279-W283 WeakPolarHBondContact O-CB 3.27Å; Q279-W283 PolarHBondContact O-N 3.34Å; V280-W283 PolarHBondContact O-N 2.95Å; T281-W283 VanDerWaalsContact C-N 3.34Å; T281-W283 PolarHBondContact O-N 3Å; W283-Q285 VanDerWaalsContact C-N 3.31Å; W283-Q285 PolarHBondContact O-N 3.12Å; W283-N286 PolarHBondContact O-N 3.45Å; W283-R287 HydrophobicContact CD2-CB 4.43Å; W283-R287 HydrophobicContact CE3-CB 4Å; W283-R287 HydrophobicContact CH2-CB 3.92Å; W283-R287 HydrophobicContact CH2-CG 3.57Å; W283-R287 HydrophobicContact CZ2-CB 4.36Å; W283-R287 HydrophobicContact CZ2-CG 4.17Å; W283-R287 HydrophobicContact CZ3-CB 3.73Å; W283-R287 HydrophobicContact CZ3-CG 3.79Å; W283-R287 WeakPolarHBondContact O-CB 3.27Å; W283-R287 PolarHBondContact O-N 3.32Å |
| 284 | F | 98.6 | Very high | 97.2 | Very high | 4 Ų | 4 | 76.9 Ų | 76.9 | 2% | 0.018 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -65.3 | -28.9 | 176.2 | -90.7 | -100.6 | 0 | 0 | 0 | 113.5 | L251 E254 Y255 I261 I269 V280 T281 R288 | L251-F284 HydrophobicContact CD2-CD2 4.46Å; L251-F284 HydrophobicContact CD2-CE2 4.06Å; E254-F284 HydrophobicContact CB-CZ 4.25Å; Y255-F284 AromaticContact CD2-CD1 3.76Å; Y255-F284 HydrophobicContact CD2-CD1 3.76Å; Y255-F284 AromaticContact CD2-CE1 3.75Å; Y255-F284 HydrophobicContact CD2-CE1 3.75Å; Y255-F284 HydrophobicContact CE2-CD1 4.32Å; I261-F284 HydrophobicContact CB-CD1 3.86Å; I261-F284 HydrophobicContact CB-CD2 4.16Å; I261-F284 HydrophobicContact CB-CE1 3.91Å; I261-F284 HydrophobicContact CB-CE2 4.22Å; I261-F284 HydrophobicContact CB-CG 4Å; I261-F284 HydrophobicContact CB-CZ 4.1Å; I261-F284 HydrophobicContact CD1-CE1 4.27Å; I261-F284 HydrophobicContact CD1-CE2 4.18Å; I261-F284 HydrophobicContact CD1-CZ 3.83Å; I261-F284 HydrophobicContact CG1-CE2 4.23Å; I261-F284 HydrophobicContact CG1-CZ 4.24Å; I261-F284 HydrophobicContact CG2-CB 4.12Å; I261-F284 HydrophobicContact CG2-CD1 4.16Å; I261-F284 HydrophobicContact CG2-CD2 4.09Å; I261-F284 HydrophobicContact CG2-CG 3.86Å; I269-F284 HydrophobicContact CD1-CE2 4.14Å; I269-F284 HydrophobicContact CD1-CZ 4.34Å; V280-F284 HydrophobicContact CG1-CD2 4.04Å; V280-F284 HydrophobicContact CG1-CE2 4.12Å; V280-F284 WeakPolarHBondContact O-CD2 3.49Å; V280-F284 PolarHBondContact O-N 3.14Å; T281-F284 PolarHBondContact O-N 2.97Å; F284-R288 PolarHBondContact O-N 3.31Å; F284-R288 PolarHBondContact O-NE 3.02Å |
| 285 | Q | 98.4 | Very high | 96.6 | Very high | 94 Ų | 94 | 74.5 Ų | 74.5 | 44% | 0.439 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -68.4 | -51.9 | 169.2 | -70.4 | 169 | -2.2 | 0 | 0 | 110.9 | T281 I282 W283 R287 R288 V289 | T281-Q285 WeakPolarHBondContact O-CG 3.39Å; T281-Q285 PolarHBondContact O-N 3.44Å; I282-Q285 PolarHBondContact O-N 3.32Å; W283-Q285 VanDerWaalsContact C-N 3.31Å; W283-Q285 PolarHBondContact O-N 3.12Å; Q285-R287 VanDerWaalsContact C-N 3.32Å; Q285-R287 PolarHBondContact O-N 3.31Å; Q285-R288 PolarHBondContact O-N 3.25Å; Q285-V289 WeakPolarHBondContact O-CG2 3.48Å; Q285-V289 PolarHBondContact O-N 2.79Å; Q285-V289 VanDerWaalsContact O-N 3.12Å |
| 286 | N | 98.1 | Very high | 95.8 | Very high | 100 Ų | 100 | 77.4 Ų | 77.4 | 54% | 0.535 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -61 | -38 | 179.3 | -71.4 | -26.8 | 0 | 0 | 0 | 112.6 | I282 W283 V289 K290 | I282-N286 WeakPolarHBondContact O-CB 3.38Å; I282-N286 VanDerWaalsContact O-CG 3.27Å; I282-N286 PolarHBondContact O-N 3.43Å; I282-N286 PolarHBondContact O-ND2 3.33Å; W283-N286 PolarHBondContact O-N 3.45Å; N286-V289 PolarHBondContact O-N 2.98Å; N286-K290 WeakPolarHBondContact O-CB 3.36Å; N286-K290 PolarHBondContact O-N 2.99Å |
| 287 | R | 98.1 | Very high | 94.7 | Very high | 56 Ų | 56 | 82.6 Ų | 82.6 | 21% | 0.211 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -67.1 | -38.2 | -178.9 | -172 | 63 | -180 | 68.7 | -2 | 112.4 | E252 Y255 W283 Q285 K290 E291 | E252-R287 IonicContact OE1-NE 3.91Å; E252-R287 PolarHBondContact OE1-NE 3.08Å; Y255-R287 HydrophobicContact CD1-CG 3.68Å; Y255-R287 HydrophobicContact CD2-CB 4.11Å; Y255-R287 HydrophobicContact CD2-CG 3.69Å; Y255-R287 HydrophobicContact CE1-CG 3.62Å; Y255-R287 HydrophobicContact CE2-CB 3.87Å; Y255-R287 HydrophobicContact CE2-CG 3.62Å; Y255-R287 HydrophobicContact CG-CG 3.73Å; W283-R287 HydrophobicContact CD2-CB 4.43Å; W283-R287 HydrophobicContact CE3-CB 4Å; W283-R287 HydrophobicContact CH2-CB 3.92Å; W283-R287 HydrophobicContact CH2-CG 3.57Å; W283-R287 HydrophobicContact CZ2-CB 4.36Å; W283-R287 HydrophobicContact CZ2-CG 4.17Å; W283-R287 HydrophobicContact CZ3-CB 3.73Å; W283-R287 HydrophobicContact CZ3-CG 3.79Å; W283-R287 WeakPolarHBondContact O-CB 3.27Å; W283-R287 PolarHBondContact O-N 3.32Å; Q285-R287 VanDerWaalsContact C-N 3.32Å; Q285-R287 PolarHBondContact O-N 3.31Å; R287-K290 PolarHBondContact O-N 2.94Å; R287-E291 IonicContact NH1-OE1 2.95Å; R287-E291 PolarHBondContact NH1-OE1 3.37Å; R287-E291 WeakPolarHBondContact O-CB 3.48Å; R287-E291 PolarHBondContact O-N 3.45Å |
| 288 | R | 97.7 | Very high | 93.4 | Very high | 88 Ų | 88 | 82.2 Ų | 82.2 | 33% | 0.332 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -66.2 | -41.5 | 170.9 | -74.7 | -178.7 | -67.3 | 145 | 0.6 | 112.4 | Y255 K259 F284 Q285 K290 E291 K292 | Y255-R288 HydrophobicContact CE2-CG 3.89Å; Y255-R288 WeakPolarHBondContact OH-CA 3.41Å; Y255-R288 WeakPolarHBondContact OH-CG 3.31Å; K259-R288 WeakPolarHBondContact O-CD 3.41Å; F284-R288 PolarHBondContact O-N 3.31Å; F284-R288 PolarHBondContact O-NE 3.02Å; Q285-R288 PolarHBondContact O-N 3.25Å; R288-K290 VanDerWaalsContact C-N 3.35Å; R288-E291 PolarHBondContact O-N 3.1Å; R288-K292 PolarHBondContact O-N 3.19Å |
| 289 | V | 97.8 | Very high | 91.7 | Very high | 74 Ų | 74 | 81.3 Ų | 81.3 | 45% | 0.448 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.1 | -40.3 | 175.3 | 173.9 | 0 | 0 | 0 | 0 | 111.3 | Q285 N286 K293 | Q285-V289 WeakPolarHBondContact O-CG2 3.48Å; Q285-V289 PolarHBondContact O-N 2.79Å; Q285-V289 VanDerWaalsContact O-N 3.12Å; N286-V289 PolarHBondContact O-N 2.98Å; V289-K293 HydrophobicContact CG1-CD 4.43Å; V289-K293 WeakPolarHBondContact O-CG 3.42Å; V289-K293 PolarHBondContact O-N 2.9Å; V289-K293 VanDerWaalsContact O-N 3.12Å |
| 290 | K | 96.2 | Very high | 89.8 | Confident | 93 Ų | 93 | 82.5 Ų | 82.5 | 40% | 0.404 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -62.8 | -45.6 | 175 | -160.6 | -166.3 | -175.6 | -164.8 | 0 | 111.2 | N286 R287 R288 K293 F294 | N286-K290 WeakPolarHBondContact O-CB 3.36Å; N286-K290 PolarHBondContact O-N 2.99Å; R287-K290 PolarHBondContact O-N 2.94Å; R288-K290 VanDerWaalsContact C-N 3.35Å; K290-K293 PolarHBondContact O-N 2.98Å; K290-F294 HydrophobicContact CD-CE2 3.84Å; K290-F294 HydrophobicContact CD-CZ 4.42Å; K290-F294 HydrophobicContact CG-CD2 4.22Å; K290-F294 HydrophobicContact CG-CE2 3.65Å; K290-F294 HydrophobicContact CG-CZ 4.26Å; K290-F294 VanDerWaalsContact O-CD2 3.27Å; K290-F294 WeakPolarHBondContact O-CD2 3.41Å; K290-F294 PolarHBondContact O-N 2.99Å; K290-F294 VanDerWaalsContact O-N 3.1Å |
| 291 | E | 95.8 | Very high | 87.9 | Confident | 53 Ų | 53 | 86 Ų | 86 | 25% | 0.248 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -60.8 | -49.2 | 177.4 | -169 | 161.6 | -106.8 | 0 | 0 | 112 | Y255 K259 R287 R288 K293 F294 V295 | Y255-E291 WeakPolarHBondContact CE1-OE1 3.44Å; Y255-E291 WeakPolarHBondContact CE1-OE2 3.43Å; Y255-E291 PolarHBondContact OH-OE2 3.25Å; K259-E291 IonicContact NZ-OE1 2.8Å; K259-E291 PolarHBondContact NZ-OE1 3.2Å; K259-E291 IonicContact NZ-OE2 3.9Å; K259-E291 PolarHBondContact NZ-OE2 2.79Å; R287-E291 IonicContact NH1-OE1 2.95Å; R287-E291 PolarHBondContact NH1-OE1 3.37Å; R287-E291 WeakPolarHBondContact O-CB 3.48Å; R287-E291 PolarHBondContact O-N 3.45Å; R288-E291 PolarHBondContact O-N 3.1Å; E291-K293 VanDerWaalsContact C-N 3.29Å; E291-K293 PolarHBondContact O-N 3.35Å; E291-F294 PolarHBondContact O-N 3.3Å; E291-F294 VanDerWaalsContact O-N 3.11Å; E291-V295 WeakPolarHBondContact O-CG2 3.38Å; E291-V295 PolarHBondContact O-N 3.02Å |
| 292 | K | 95.3 | Very high | 85.9 | Confident | 161 Ų | 161 | 90.1 Ų | 90.1 | 70% | 0.7 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -57.2 | -41.7 | 176 | -169 | 173.7 | 75.9 | 164.1 | 0 | 112.2 | R288 F294 V295 S296 | R288-K292 PolarHBondContact O-N 3.19Å; K292-F294 VanDerWaalsContact C-N 3.35Å; K292-F294 PolarHBondContact O-N 3.19Å; K292-V295 PolarHBondContact O-N 3.09Å; K292-S296 PolarHBondContact O-N 3.25Å; K292-S296 PolarHBondContact O-OG 3.1Å |
| 293 | K | 93.8 | Very high | 83.7 | Confident | 144 Ų | 144 | 93.9 Ų | 93.9 | 63% | 0.626 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -65.3 | -33.2 | 177.9 | -76.4 | -177.5 | 176.3 | -167.4 | 0 | 113.4 | V289 K290 E291 S296 K297 | V289-K293 HydrophobicContact CG1-CD 4.43Å; V289-K293 WeakPolarHBondContact O-CG 3.42Å; V289-K293 PolarHBondContact O-N 2.9Å; V289-K293 VanDerWaalsContact O-N 3.12Å; K290-K293 PolarHBondContact O-N 2.98Å; E291-K293 VanDerWaalsContact C-N 3.29Å; E291-K293 PolarHBondContact O-N 3.35Å; K293-S296 WeakPolarHBondContact CA-OG 3.36Å; K293-S296 PolarHBondContact O-OG 3.05Å; K293-K297 PolarHBondContact O-N 3.36Å |
| 294 | F | 90.5 | Very high | 81.6 | Confident | 82 Ų | 82 | 99.4 Ų | 99.4 | 36% | 0.36 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -71.7 | -47.9 | 173.9 | -71.5 | -50.9 | 0 | 0 | 0 | 111.6 | W11 K290 E291 K292 S296 K297 S298 | W11-F294 AromaticContact CH2-CE1 3.78Å; W11-F294 HydrophobicContact CH2-CE1 3.78Å; W11-F294 HydrophobicContact CH2-CZ 4.36Å; W11-F294 AromaticContact CZ3-CE1 3.84Å; W11-F294 HydrophobicContact CZ3-CE1 3.84Å; W11-F294 HydrophobicContact CZ3-CZ 4.01Å; K290-F294 HydrophobicContact CD-CE2 3.84Å; K290-F294 HydrophobicContact CD-CZ 4.42Å; K290-F294 HydrophobicContact CG-CD2 4.22Å; K290-F294 HydrophobicContact CG-CE2 3.65Å; K290-F294 HydrophobicContact CG-CZ 4.26Å; K290-F294 VanDerWaalsContact O-CD2 3.27Å; K290-F294 WeakPolarHBondContact O-CD2 3.41Å; K290-F294 PolarHBondContact O-N 2.99Å; K290-F294 VanDerWaalsContact O-N 3.1Å; E291-F294 PolarHBondContact O-N 3.3Å; E291-F294 VanDerWaalsContact O-N 3.11Å; K292-F294 VanDerWaalsContact C-N 3.35Å; K292-F294 PolarHBondContact O-N 3.19Å; F294-S296 VanDerWaalsContact C-N 3.29Å; F294-S296 PolarHBondContact O-N 2.84Å; F294-K297 PolarHBondContact O-N 3.21Å; F294-S298 PolarHBondContact O-N 3.45Å; F294-S298 PolarHBondContact O-OG 3.19Å |
| 295 | V | 85.8 | Confident | 79.2 | Confident | 96 Ų | 96 | 106.8 Ų | 106.8 | 58% | 0.582 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -59.7 | -38.2 | 178.8 | 175.4 | 0 | 0 | 0 | 0 | 112 | E291 K292 S298 K299 | E291-V295 WeakPolarHBondContact O-CG2 3.38Å; E291-V295 PolarHBondContact O-N 3.02Å; K292-V295 PolarHBondContact O-N 3.09Å; V295-S298 PolarHBondContact O-OG 3.39Å; V295-K299 PolarHBondContact O-N 3.4Å |
| 296 | S | 80 | Confident | 76.7 | Confident | 70 Ų | 70 | 108 Ų | 108 | 49% | 0.49 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -66.1 | -36.8 | 173.4 | 54.6 | 0 | 0 | 0 | 0 | 112.9 | K292 K293 F294 T300 | K292-S296 PolarHBondContact O-N 3.25Å; K292-S296 PolarHBondContact O-OG 3.1Å; K293-S296 WeakPolarHBondContact CA-OG 3.36Å; K293-S296 PolarHBondContact O-OG 3.05Å; F294-S296 VanDerWaalsContact C-N 3.29Å; F294-S296 PolarHBondContact O-N 2.84Å; S296-T300 PolarHBondContact O-OG1 3.19Å |
| 297 | K | 76.3 | Confident | 73.9 | Confident | 164 Ų | 164 | 113.4 Ų | 113.4 | 71% | 0.713 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -78.9 | -35.7 | -176.1 | -171.7 | 166.7 | -178.5 | 173.6 | 0 | 112.9 | K293 F294 T300 S301 | K293-K297 PolarHBondContact O-N 3.36Å; F294-K297 PolarHBondContact O-N 3.21Å; K297-T300 PolarHBondContact O-N 3.34Å; K297-S301 PolarHBondContact O-N 3.29Å |
| 298 | S | 70.1 | Confident | 72.7 | Confident | 64 Ų | 64 | 116.3 Ų | 116.3 | 45% | 0.448 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -66 | -39.3 | 173.8 | 55 | 0 | 0 | 0 | 0 | 111.9 | F294 V295 T300 S301 N302 | F294-S298 PolarHBondContact O-N 3.45Å; F294-S298 PolarHBondContact O-OG 3.19Å; V295-S298 PolarHBondContact O-OG 3.39Å; S298-T300 VanDerWaalsContact C-N 3.29Å; S298-T300 PolarHBondContact O-N 3.19Å; S298-S301 PolarHBondContact O-N 3.29Å; S298-S301 VanDerWaalsContact O-N 3.11Å; S298-N302 PolarHBondContact O-N 2.92Å; S298-N302 PolarHBondContact O-OD1 2.87Å |
| 299 | K | 62.3 | Low | 71.3 | Confident | 173 Ų | 173 | 117.7 Ų | 117.7 | 75% | 0.752 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -62.4 | -32.5 | 177.6 | -170.4 | 164.3 | -176.9 | 172.1 | 0 | 113.2 | V295 | V295-K299 PolarHBondContact O-N 3.4Å |
| 300 | T | 58.9 | Low | 69.9 | Low | 100 Ų | 100 | 120.2 Ų | 120.2 | 61% | 0.613 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -72.5 | -39.8 | 172.2 | -46.8 | 0 | 0 | 0 | 0 | 112.2 | S296 K297 S298 N302 H303 | S296-T300 PolarHBondContact O-OG1 3.19Å; K297-T300 PolarHBondContact O-N 3.34Å; S298-T300 VanDerWaalsContact C-N 3.29Å; S298-T300 PolarHBondContact O-N 3.19Å; T300-N302 VanDerWaalsContact C-N 3.3Å; T300-N302 PolarHBondContact O-N 3.24Å; T300-H303 PolarHBondContact O-N 3.48Å |
| 301 | S | 57.3 | Low | 68.3 | Low | 72 Ų | 72 | 121.8 Ų | 121.8 | 50% | 0.503 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -61.6 | -36.6 | -177.2 | -155.8 | 0 | 0 | 0 | 0 | 113.1 | K297 S298 H303 | K297-S301 PolarHBondContact O-N 3.29Å; S298-S301 PolarHBondContact O-N 3.29Å; S298-S301 VanDerWaalsContact O-N 3.11Å; S301-H303 VanDerWaalsContact C-N 3.29Å; S301-H303 PolarHBondContact O-N 3.07Å |
| 302 | N | 55.5 | Low | 66.6 | Low | 120 Ų | 120 | 126.1 Ų | 126.1 | 64% | 0.642 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -75.2 | -14.3 | -176 | -67.9 | 7.5 | 0 | 0 | 0 | 113.9 | S298 T300 M304 | S298-N302 PolarHBondContact O-N 2.92Å; S298-N302 PolarHBondContact O-OD1 2.87Å; T300-N302 VanDerWaalsContact C-N 3.3Å; T300-N302 PolarHBondContact O-N 3.24Å; N302-M304 VanDerWaalsContact C-N 3.34Å |
| 303 | H | 53.3 | Low | 64.7 | Low | 142 Ų | 142 | 123.7 Ų | 123.7 | 66% | 0.657 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -78.2 | -20 | -179.9 | -162.8 | -15.1 | 0 | 0 | 0 | 112.7 | T300 S301 H305 | T300-H303 PolarHBondContact O-N 3.48Å; S301-H303 VanDerWaalsContact C-N 3.29Å; S301-H303 PolarHBondContact O-N 3.07Å; H303-H305 VanDerWaalsContact C-N 3.33Å; H303-H305 PolarHBondContact O-N 2.95Å |
| 304 | M | 53 | Low | 62.6 | Low | 138 Ų | 138 | 122.3 Ų | 122.3 | 68% | 0.68 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -89.9 | 9.7 | -173.3 | -56.3 | -72 | 86.6 | 0 | 0 | 114.2 | N302 | N302-M304 VanDerWaalsContact C-N 3.34Š|
| 305 | H | 49.6 | Very low | 60.5 | Low | 159 Ų | 159 | 125.4 Ų | 125.4 | 74% | 0.736 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -131.4 | 42.1 | -178.9 | -67.6 | -65.8 | 0 | 0 | 0 | 111.8 | H303 | H303-H305 VanDerWaalsContact C-N 3.33Å; H303-H305 PolarHBondContact O-N 2.95Å |
| 306 | T | 44.8 | Very low | 58.4 | Low | 120 Ų | 120 | 127.8 Ų | 127.8 | 74% | 0.736 | 69% | 0.689 | S | S | * | * | trans | -147.5 | 59.1 | 175.9 | -45.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 307 | T | 39.5 | Very low | 56.4 | Low | 212 Ų | 212 | 133.1 Ų | 133.1 | 100% | 1.301 | 71% | 0.707 | S | S | * | * | trans | -146 | 0 | 163 | -42.3 | 0 | 0 | 0 | 0 | 107.2 |
Retrieved 307 of 307 residues in 309.4 ms
(Link to these results)