| 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 | 35.8 | Very low | 35.2 | Very low | 254 Ų | 254 | 138.3 Ų | 138.3 | 100% | 1.251 | 82% | 0.819 | S | S | * | * | 0 | 100.4 | 0 | -72.8 | 176.1 | -164.2 | 0 | 0 | 108.4 | |||||
| 2 | A | 31.4 | Very low | 35.4 | Very low | 102 Ų | 102 | 135.3 Ų | 135.3 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | trans | -140.3 | 98 | 167.6 | 0 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 3 | A | 32.6 | Very low | 35.3 | Very low | 96 Ų | 96 | 135.5 Ų | 135.5 | 79% | 0.793 | 80% | 0.799 | S | S | * | * | trans | -87.9 | 107.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | Y5 | A3-Y5 PolarHBondContact O-N 3.29Š| ||
| 4 | S | 32.2 | Very low | 35.6 | Very low | 121 Ų | 121 | 137.7 Ų | 137.7 | 85% | 0.846 | 80% | 0.796 | S | S | * | * | trans | -65.9 | 101.6 | 167.8 | 25.1 | 0 | 0 | 0 | 0 | 109.3 | N6 | S4-N6 PolarHBondContact O-N 3.19Å; S4-N6 VanDerWaalsContact O-N 3.1Å | ||
| 5 | Y | 33.6 | Very low | 36 | Very low | 227 Ų | 227 | 136.3 Ų | 136.3 | 89% | 0.89 | 79% | 0.791 | S | S | * | * | trans | -74.4 | 100.3 | 170.1 | -122.5 | -93.1 | 0 | 0 | 0 | 108.7 | A3 G7 | A3-Y5 PolarHBondContact O-N 3.29Å; Y5-G7 PolarHBondContact O-N 3.34Å | ||
| 6 | N | 34.6 | Very low | 36.7 | Very low | 157 Ų | 157 | 132.3 Ų | 132.3 | 84% | 0.84 | 77% | 0.765 | S | S | * | * | trans | -69.6 | 95.4 | 175.3 | -143.9 | 5.7 | 0 | 0 | 0 | 107.9 | S4 S8 | S4-N6 PolarHBondContact O-N 3.19Å; S4-N6 VanDerWaalsContact O-N 3.1Å; N6-S8 VanDerWaalsContact C-N 3.32Å; N6-S8 PolarHBondContact O-N 3.28Å | ||
| 7 | G | 36 | Very low | 37.2 | Very low | 63 Ų | 63 | 132.5 Ų | 132.5 | 65% | 0.649 | 76% | 0.758 | S | S | * | * | trans | -66.9 | 90.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | Y5 N9 | Y5-G7 PolarHBondContact O-N 3.34Å; G7-N9 PolarHBondContact O-N 3.01Å | ||
| 8 | S | 37.6 | Very low | 38 | Very low | 96 Ų | 96 | 132.2 Ų | 132.2 | 67% | 0.671 | 75% | 0.747 | S | S | * | * | trans | -52.8 | 112.2 | 169.9 | 47.6 | 0 | 0 | 0 | 0 | 109.6 | N6 I10 | N6-S8 VanDerWaalsContact C-N 3.32Å; N6-S8 PolarHBondContact O-N 3.28Å; S8-I10 PolarHBondContact O-N 3.38Å | ||
| 9 | N | 39.1 | Very low | 38.8 | Very low | 153 Ų | 153 | 131.2 Ų | 131.2 | 82% | 0.818 | 74% | 0.744 | S | S | * | * | trans | -55.8 | 86.3 | 164.5 | -83.8 | -30.4 | 0 | 0 | 0 | 109.5 | G7 T11 | G7-N9 PolarHBondContact O-N 3.01Å; N9-T11 PolarHBondContact O-N 3.24Å; N9-T11 VanDerWaalsContact O-N 3.16Å | ||
| 10 | I | 37.8 | Very low | 40 | Very low | 135 Ų | 135 | 126 Ų | 126 | 69% | 0.692 | 71% | 0.713 | S | S | * | * | trans | -82.4 | 83.7 | 159 | -57.4 | 176.4 | 0 | 0 | 0 | 105 | S8 T12 | S8-I10 PolarHBondContact O-N 3.38Å; I10-T12 HydrophobicContact CG2-CG2 4.38Å; I10-T12 PolarHBondContact O-N 3.48Å | ||
| 11 | T | 36.8 | Very low | 41.7 | Very low | 117 Ų | 117 | 122.4 Ų | 122.4 | 72% | 0.718 | 69% | 0.694 | S | S | * | * | trans | -62.2 | 90.4 | 158.2 | 34.3 | 0 | 0 | 0 | 0 | 106.7 | N9 N13 | N9-T11 PolarHBondContact O-N 3.24Å; N9-T11 VanDerWaalsContact O-N 3.16Å; T11-N13 PolarHBondContact O-N 3.14Å | ||
| 12 | T | 38 | Very low | 43.6 | Very low | 102 Ų | 102 | 115.5 Ų | 115.5 | 63% | 0.626 | 67% | 0.668 | S | S | * | * | trans | -58.9 | 91.7 | 162.1 | 20.9 | 0 | 0 | 0 | 0 | 106.8 | I10 H14 | I10-T12 HydrophobicContact CG2-CG2 4.38Å; I10-T12 PolarHBondContact O-N 3.48Å; T12-H14 PolarHBondContact O-N 2.95Å | ||
| 13 | N | 33.6 | Very low | 46 | Very low | 139 Ų | 139 | 117.5 Ų | 117.5 | 74% | 0.743 | 65% | 0.654 | S | S | * | * | trans | -57.6 | 89.8 | 162.5 | -101.5 | -18.6 | 0 | 0 | 0 | 106.7 | T11 T15 | T11-N13 PolarHBondContact O-N 3.14Å; N13-T15 HydrophobicContact CB-CG2 4.45Å; N13-T15 PolarHBondContact O-N 2.94Å | ||
| 14 | H | 40.2 | Very low | 48.3 | Very low | 166 Ų | 166 | 117.6 Ų | 117.6 | 77% | 0.769 | 63% | 0.634 | S | S | * | * | trans | -67.5 | 68.6 | 160.6 | -77.9 | -69.7 | 0 | 0 | 0 | 107.6 | T12 N16 | T12-H14 PolarHBondContact O-N 2.95Å; H14-N16 VanDerWaalsContact C-N 3.34Å; H14-N16 PolarHBondContact O-N 3.15Å | ||
| 15 | T | 40.9 | Very low | 50.6 | Low | 116 Ų | 116 | 114.6 Ų | 114.6 | 71% | 0.712 | 61% | 0.608 | S | S | * | * | trans | -59.5 | 105.1 | 161.3 | 45.9 | 0 | 0 | 0 | 0 | 105.8 | N13 Q17 | N13-T15 HydrophobicContact CB-CG2 4.45Å; N13-T15 PolarHBondContact O-N 2.94Å; T15-Q17 PolarHBondContact O-N 3.49Å | ||
| 16 | N | 46.5 | Very low | 53 | Low | 72 Ų | 72 | 106.3 Ų | 106.3 | 39% | 0.385 | 59% | 0.587 | S | S | . | * | trans | -44.2 | 111.8 | 177.9 | -89.8 | -69.3 | 0 | 0 | 0 | 109.4 | H14 F18 V19 | H14-N16 VanDerWaalsContact C-N 3.34Å; H14-N16 PolarHBondContact O-N 3.15Å; N16-F18 PolarHBondContact O-N 3.33Å; N16-V19 HydrophobicContact CB-CG2 3.59Å; N16-V19 WeakPolarHBondContact O-CG2 3.27Å; N16-V19 PolarHBondContact O-N 3.48Å | ||
| 17 | Q | 45.4 | Very low | 55.5 | Low | 136 Ų | 136 | 104 Ų | 104 | 64% | 0.636 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.4 | -7.3 | -178.3 | -167 | 173.7 | -6.9 | 0 | 0 | 113.2 | T15 | T15-Q17 PolarHBondContact O-N 3.49Š|
| 18 | F | 52.4 | Low | 57.9 | Low | 127 Ų | 127 | 103.4 Ų | 103.4 | 56% | 0.557 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.9 | 4.6 | 179.3 | -58.4 | -74.6 | 0 | 0 | 0 | 114.3 | N16 Q20 | N16-F18 PolarHBondContact O-N 3.33Å; F18-Q20 PolarHBondContact O-N 3.06Å |
| 19 | V | 53.5 | Low | 60.1 | Low | 114 Ų | 114 | 100 Ų | 100 | 69% | 0.691 | 53% | 0.528 | S | S | * | . | trans | -73.5 | 102.1 | 176.3 | 179.2 | 0 | 0 | 0 | 0 | 108.7 | N16 | N16-V19 HydrophobicContact CB-CG2 3.59Å; N16-V19 WeakPolarHBondContact O-CG2 3.27Å; N16-V19 PolarHBondContact O-N 3.48Å | ||
| 20 | Q | 61.4 | Low | 62.5 | Low | 27 Ų | 27 | 97.8 Ų | 97.8 | 13% | 0.126 | 52% | 0.52 | C | S | . | . | trans | -77.1 | 146 | 176.2 | -58.9 | -175.1 | 11.5 | 0 | 0 | 110.1 | F18 I25 | F18-Q20 PolarHBondContact O-N 3.06Å; Q20-I25 HydrophobicContact CB-CD1 4.14Å; Q20-I25 HydrophobicContact CB-CG1 3.91Å | ||
| 21 | P | 75.8 | Confident | 65 | Low | 50 Ų | 50 | 92.7 Ų | 92.7 | 33% | 0.325 | 50% | 0.498 | S | S | . | . | trans | -63.4 | 140.3 | 174.6 | 26.7 | -34.4 | 0 | 0 | 0 | 110.4 | W23 R24 I25 | P21-W23 VanDerWaalsContact C-N 3.26Å; P21-W23 HydrophobicContact CG-CZ2 4.35Å; P21-W23 PolarHBondContact O-N 3.48Å; P21-W23 VanDerWaalsContact O-N 3.11Å; P21-R24 HydrophobicContact CG-CB 4.19Å; P21-R24 HydrophobicContact CG-CG 3.77Å; P21-R24 WeakPolarHBondContact O-CB 3.39Å; P21-R24 PolarHBondContact O-N 3.15Å; P21-I25 PolarHBondContact O-N 3.26Å | ||
| 22 | P | 76.6 | Confident | 67.4 | Low | 109 Ų | 109 | 87.6 Ų | 87.6 | 71% | 0.708 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -55.1 | -35.3 | -171.6 | -29.1 | 34.9 | 0 | 0 | 0 | 115 | R24 I25 A26 | P22-R24 VanDerWaalsContact C-N 3.31Å; P22-R24 PolarHBondContact O-N 3.35Å; P22-I25 PolarHBondContact O-N 3.37Å; P22-A26 PolarHBondContact O-N 3.08Å |
| 23 | W | 81.8 | Confident | 69.9 | Low | 144 Ų | 144 | 85.5 Ų | 85.5 | 55% | 0.545 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -64.4 | -32.3 | 178.3 | 66.6 | -98.2 | 0 | 0 | 0 | 113.1 | P21 A26 L27 | P21-W23 VanDerWaalsContact C-N 3.26Å; P21-W23 HydrophobicContact CG-CZ2 4.35Å; P21-W23 PolarHBondContact O-N 3.48Å; P21-W23 VanDerWaalsContact O-N 3.11Å; W23-A26 PolarHBondContact O-N 2.84Å; W23-L27 HydrophobicContact CE3-CD1 3.69Å; W23-L27 HydrophobicContact CZ3-CD1 3.79Å; W23-L27 WeakPolarHBondContact O-CG 3.3Å; W23-L27 PolarHBondContact O-N 3.44Å |
| 24 | R | 81.3 | Confident | 72.6 | Confident | 99 Ų | 99 | 85 Ų | 85 | 37% | 0.374 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -70.2 | -40.9 | 175.4 | -73.5 | -176.8 | -169.2 | -121.2 | 0.1 | 111 | P21 P22 A26 L27 W28 | P21-R24 HydrophobicContact CG-CB 4.19Å; P21-R24 HydrophobicContact CG-CG 3.77Å; P21-R24 WeakPolarHBondContact O-CB 3.39Å; P21-R24 PolarHBondContact O-N 3.15Å; P22-R24 VanDerWaalsContact C-N 3.31Å; P22-R24 PolarHBondContact O-N 3.35Å; R24-A26 VanDerWaalsContact C-N 3.32Å; R24-L27 PolarHBondContact O-N 2.95Å; R24-W28 VanDerWaalsContact O-CD1 3.22Å; R24-W28 PolarHBondContact O-N 3.04Å |
| 25 | I | 79.6 | Confident | 75.1 | Confident | 58 Ų | 58 | 77.1 Ų | 77.1 | 30% | 0.297 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -62.1 | -44.8 | 176.2 | -58.9 | 172.5 | 0 | 0 | 0 | 109.2 | Q20 P21 P22 L27 W28 S29 | Q20-I25 HydrophobicContact CB-CD1 4.14Å; Q20-I25 HydrophobicContact CB-CG1 3.91Å; P21-I25 PolarHBondContact O-N 3.26Å; P22-I25 PolarHBondContact O-N 3.37Å; I25-L27 PolarHBondContact O-N 3.14Å; I25-W28 PolarHBondContact O-N 3.32Å; I25-S29 WeakPolarHBondContact O-CB 3.27Å; I25-S29 PolarHBondContact O-N 3Å; I25-S29 PolarHBondContact O-OG 3.43Å |
| 26 | A | 84.8 | Confident | 77.5 | Confident | 53 Ų | 53 | 73.6 Ų | 73.6 | 44% | 0.438 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -59.6 | -45.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | P22 W23 R24 S29 V30 | P22-A26 PolarHBondContact O-N 3.08Å; W23-A26 PolarHBondContact O-N 2.84Å; R24-A26 VanDerWaalsContact C-N 3.32Å; A26-S29 WeakPolarHBondContact O-CB 3.49Å; A26-S29 PolarHBondContact O-N 2.99Å; A26-V30 WeakPolarHBondContact O-CG2 3.4Å; A26-V30 PolarHBondContact O-N 3.4Å |
| 27 | L | 87.7 | Confident | 79.7 | Confident | 108 Ų | 108 | 72 Ų | 72 | 57% | 0.565 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -61.6 | -47.1 | 176.3 | -74.5 | 173.8 | 0 | 0 | 0 | 112.5 | W23 R24 I25 S29 V30 A31 | W23-L27 HydrophobicContact CE3-CD1 3.69Å; W23-L27 HydrophobicContact CZ3-CD1 3.79Å; W23-L27 WeakPolarHBondContact O-CG 3.3Å; W23-L27 PolarHBondContact O-N 3.44Å; R24-L27 PolarHBondContact O-N 2.95Å; I25-L27 PolarHBondContact O-N 3.14Å; L27-S29 PolarHBondContact O-N 3.34Å; L27-V30 PolarHBondContact O-N 3.02Å; L27-A31 WeakPolarHBondContact O-CB 3.47Å; L27-A31 PolarHBondContact O-N 2.9Å |
| 28 | W | 85.2 | Confident | 82 | Confident | 50 Ų | 50 | 67.4 Ų | 67.4 | 19% | 0.189 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -60.5 | -38.6 | 174.9 | -80.8 | 119 | 0 | 0 | 0 | 111.5 | R24 I25 A31 Y32 Q279 L282 S283 W286 | R24-W28 VanDerWaalsContact O-CD1 3.22Å; R24-W28 PolarHBondContact O-N 3.04Å; I25-W28 PolarHBondContact O-N 3.32Å; W28-A31 PolarHBondContact O-N 3.45Å; W28-Y32 HydrophobicContact CE3-CD2 4.01Å; W28-Y32 AromaticContact CE3-CE2 3.67Å; W28-Y32 HydrophobicContact CE3-CE2 3.67Å; W28-Y32 HydrophobicContact CZ3-CE2 4.21Å; W28-Y32 WeakPolarHBondContact O-CD2 3.31Å; W28-Y32 PolarHBondContact O-N 3.46Å; W28-Q279 VanDerWaalsContact NE1-OE1 3.12Å; W28-L282 HydrophobicContact CD2-CB 4.43Å; W28-L282 HydrophobicContact CZ2-CB 4.21Å; W28-S283 VanDerWaalsContact CH2-CA 3.47Å; W28-S283 WeakPolarHBondContact CH2-OG 3.48Å; W28-S283 WeakPolarHBondContact CZ2-OG 3.42Å; W28-W286 HydrophobicContact CZ3-CB 3.72Å; W28-W286 AromaticContact CZ3-CG 3.88Å; W28-W286 HydrophobicContact CZ3-CG 3.88Å |
| 29 | S | 84.4 | Confident | 84 | Confident | 25 Ų | 25 | 61.3 Ų | 61.3 | 18% | 0.175 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -58.9 | -51.7 | 176.9 | -55 | 0 | 0 | 0 | 0 | 111.5 | I25 A26 L27 A31 Y32 S33 F83 | I25-S29 WeakPolarHBondContact O-CB 3.27Å; I25-S29 PolarHBondContact O-N 3Å; I25-S29 PolarHBondContact O-OG 3.43Å; A26-S29 WeakPolarHBondContact O-CB 3.49Å; A26-S29 PolarHBondContact O-N 2.99Å; L27-S29 PolarHBondContact O-N 3.34Å; S29-A31 VanDerWaalsContact C-N 3.3Å; S29-A31 PolarHBondContact O-N 3.03Å; S29-Y32 PolarHBondContact O-N 3.32Å; S29-S33 VanDerWaalsContact O-CB 3.27Å; S29-S33 WeakPolarHBondContact O-CB 3.15Å; S29-S33 PolarHBondContact O-N 3.01Å; S29-S33 PolarHBondContact O-OG 3.38Å; S29-F83 VanDerWaalsContact OG-CE2 3.26Å; S29-F83 WeakPolarHBondContact OG-CE2 3.41Å; S29-F83 WeakPolarHBondContact OG-CZ 3.33Å |
| 30 | V | 89.2 | Confident | 85.9 | Confident | 106 Ų | 106 | 57.2 Ų | 57.2 | 64% | 0.642 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -59.1 | -44 | 177 | 174.7 | 0 | 0 | 0 | 0 | 111 | A26 L27 S33 F34 | A26-V30 WeakPolarHBondContact O-CG2 3.4Å; A26-V30 PolarHBondContact O-N 3.4Å; L27-V30 PolarHBondContact O-N 3.02Å; V30-S33 PolarHBondContact O-N 3.39Å; V30-F34 WeakPolarHBondContact O-CB 3.4Å; V30-F34 PolarHBondContact O-N 2.78Å |
| 31 | A | 89.8 | Confident | 87.5 | Confident | 29 Ų | 29 | 62.6 Ų | 62.6 | 24% | 0.24 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64.7 | -43.4 | -179 | 0 | 0 | 0 | 0 | 0 | 113.2 | L27 W28 S29 V35 W286 | L27-A31 WeakPolarHBondContact O-CB 3.47Å; L27-A31 PolarHBondContact O-N 2.9Å; W28-A31 PolarHBondContact O-N 3.45Å; S29-A31 VanDerWaalsContact C-N 3.3Å; S29-A31 PolarHBondContact O-N 3.03Å; A31-V35 WeakPolarHBondContact O-CG2 3.48Å; A31-V35 PolarHBondContact O-N 2.85Å; A31-W286 PolarHBondContact O-NE1 3.19Å |
| 32 | Y | 88.1 | Confident | 88.4 | Confident | 9 Ų | 9 | 60.8 Ų | 60.8 | 4% | 0.035 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -71.9 | -39.1 | 176.9 | -88.1 | -87.4 | 0 | 0 | 0 | 112.2 | W28 S29 F34 V35 L36 T79 F83 L282 M285 W286 | W28-Y32 HydrophobicContact CE3-CD2 4.01Å; W28-Y32 AromaticContact CE3-CE2 3.67Å; W28-Y32 HydrophobicContact CE3-CE2 3.67Å; W28-Y32 HydrophobicContact CZ3-CE2 4.21Å; W28-Y32 WeakPolarHBondContact O-CD2 3.31Å; W28-Y32 PolarHBondContact O-N 3.46Å; S29-Y32 PolarHBondContact O-N 3.32Å; Y32-F34 VanDerWaalsContact C-N 3.31Å; Y32-F34 PolarHBondContact O-N 3.31Å; Y32-V35 PolarHBondContact O-N 2.99Å; Y32-L36 VanDerWaalsContact O-CB 3.3Å; Y32-L36 WeakPolarHBondContact O-CB 3.43Å; Y32-L36 PolarHBondContact O-N 3.26Å; Y32-T79 HydrophobicContact CD1-CG2 4.05Å; Y32-F83 HydrophobicContact CG-CD2 4.45Å; Y32-L282 PolarHBondContact OH-O 3.27Å; Y32-M285 HydrophobicContact CE1-CE 4.31Å; Y32-M285 WeakPolarHBondContact OH-CE 3.4Å; Y32-W286 AromaticContact CD2-CD1 3.91Å; Y32-W286 HydrophobicContact CE1-CB 4.33Å; Y32-W286 HydrophobicContact CE2-CB 3.9Å; Y32-W286 AromaticContact CE2-CD1 3.98Å; Y32-W286 HydrophobicContact CE2-CG 4.35Å; Y32-W286 PolarHBondContact OH-N 3.19Å; Y32-W286 VanDerWaalsContact OH-N 3.09Å |
| 33 | S | 89.2 | Confident | 89.3 | Confident | 59 Ų | 59 | 55.6 Ų | 55.6 | 41% | 0.413 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.2 | -38.9 | 175 | -66 | 0 | 0 | 0 | 0 | 111.9 | S29 V30 L36 A37 | S29-S33 VanDerWaalsContact O-CB 3.27Å; S29-S33 WeakPolarHBondContact O-CB 3.15Å; S29-S33 PolarHBondContact O-N 3.01Å; S29-S33 PolarHBondContact O-OG 3.38Å; V30-S33 PolarHBondContact O-N 3.39Å; S33-L36 PolarHBondContact O-N 3.36Å; S33-A37 WeakPolarHBondContact O-CB 3.13Å; S33-A37 PolarHBondContact O-N 2.96Å |
| 34 | F | 91.4 | Very high | 90 | Very high | 128 Ų | 128 | 52.9 Ų | 52.9 | 56% | 0.561 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -62.4 | -50.3 | 174.9 | 178.2 | -102.2 | 0 | 0 | 0 | 111.8 | V30 Y32 L36 A37 V38 M293 | V30-F34 WeakPolarHBondContact O-CB 3.4Å; V30-F34 PolarHBondContact O-N 2.78Å; Y32-F34 VanDerWaalsContact C-N 3.31Å; Y32-F34 PolarHBondContact O-N 3.31Å; F34-L36 VanDerWaalsContact C-N 3.32Å; F34-L36 PolarHBondContact O-N 3.38Å; F34-A37 PolarHBondContact O-N 3.13Å; F34-V38 HydrophobicContact CD2-CG2 4.27Å; F34-V38 HydrophobicContact CE1-CG2 4.15Å; F34-V38 HydrophobicContact CE2-CG2 3.86Å; F34-V38 HydrophobicContact CZ-CG2 3.8Å; F34-V38 WeakPolarHBondContact O-CG2 3.39Å; F34-V38 PolarHBondContact O-N 3.4Å; F34-M293 HydrophobicContact CE1-SD 4.39Å |
| 35 | V | 91.8 | Very high | 90.6 | Very high | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -58 | -46.5 | 176.7 | 171.3 | 0 | 0 | 0 | 0 | 110.8 | A31 Y32 A37 V38 A39 W286 M293 | A31-V35 WeakPolarHBondContact O-CG2 3.48Å; A31-V35 PolarHBondContact O-N 2.85Å; Y32-V35 PolarHBondContact O-N 2.99Å; V35-A37 PolarHBondContact O-N 3.5Å; V35-V38 PolarHBondContact O-N 3.29Å; V35-A39 WeakPolarHBondContact O-CB 3.49Å; V35-A39 PolarHBondContact O-N 3.49Å; V35-W286 HydrophobicContact CG2-CZ2 4.16Å; V35-M293 HydrophobicContact CB-SD 4.3Å; V35-M293 HydrophobicContact CG1-SD 4.37Å; V35-M293 HydrophobicContact CG2-CE 4.42Å; V35-M293 HydrophobicContact CG2-SD 3.8Å |
| 36 | L | 91.8 | Very high | 91.3 | Very high | 43 Ų | 43 | 46.8 Ų | 46.8 | 23% | 0.225 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -57.6 | -49.3 | 178.5 | 175.3 | 62.8 | 0 | 0 | 0 | 111.6 | Y32 S33 F34 V40 A75 | Y32-L36 VanDerWaalsContact O-CB 3.3Å; Y32-L36 WeakPolarHBondContact O-CB 3.43Å; Y32-L36 PolarHBondContact O-N 3.26Å; S33-L36 PolarHBondContact O-N 3.36Å; F34-L36 VanDerWaalsContact C-N 3.32Å; F34-L36 PolarHBondContact O-N 3.38Å; L36-V40 HydrophobicContact CD1-CG2 3.83Å; L36-V40 WeakPolarHBondContact O-CB 3.32Å; L36-V40 VanDerWaalsContact O-CG2 3.31Å; L36-V40 WeakPolarHBondContact O-CG2 3.16Å; L36-V40 PolarHBondContact O-N 2.93Å; L36-A75 HydrophobicContact CD1-CB 4.21Å; L36-A75 WeakPolarHBondContact CD1-O 3.17Å |
| 37 | A | 92.8 | Very high | 91.8 | Very high | 39 Ų | 39 | 45.7 Ų | 45.7 | 32% | 0.322 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -61 | -52.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | S33 F34 V35 A39 V40 F41 | S33-A37 WeakPolarHBondContact O-CB 3.13Å; S33-A37 PolarHBondContact O-N 2.96Å; F34-A37 PolarHBondContact O-N 3.13Å; V35-A37 PolarHBondContact O-N 3.5Å; A37-A39 PolarHBondContact O-N 3.49Å; A37-V40 PolarHBondContact O-N 3.34Å; A37-F41 HydrophobicContact CB-CD2 4.22Å; A37-F41 HydrophobicContact CB-CE2 4.34Å; A37-F41 WeakPolarHBondContact O-CB 3.44Å; A37-F41 WeakPolarHBondContact O-CD2 3.45Å; A37-F41 PolarHBondContact O-N 3.21Å |
| 38 | V | 94.1 | Very high | 92.1 | Very high | 38 Ų | 38 | 45.7 Ų | 45.7 | 23% | 0.23 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -63.5 | -42.2 | -178.2 | 179.6 | 0 | 0 | 0 | 0 | 111.3 | F34 V35 G42 M293 I297 | F34-V38 HydrophobicContact CD2-CG2 4.27Å; F34-V38 HydrophobicContact CE1-CG2 4.15Å; F34-V38 HydrophobicContact CE2-CG2 3.86Å; F34-V38 HydrophobicContact CZ-CG2 3.8Å; F34-V38 WeakPolarHBondContact O-CG2 3.39Å; F34-V38 PolarHBondContact O-N 3.4Å; V35-V38 PolarHBondContact O-N 3.29Å; V38-G42 VanDerWaalsContact O-CA 3.31Å; V38-G42 WeakPolarHBondContact O-CA 3.47Å; V38-G42 PolarHBondContact O-N 3.02Å; V38-M293 HydrophobicContact CB-CB 4.12Å; V38-M293 HydrophobicContact CG1-CB 3.86Å; V38-M293 HydrophobicContact CG1-CG 4.35Å; V38-I297 HydrophobicContact CG1-CD1 4.25Å |
| 39 | A | 93.7 | Very high | 92.3 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -64.6 | -46.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112 | V35 A37 N43 A75 T292 M293 | V35-A39 WeakPolarHBondContact O-CB 3.49Å; V35-A39 PolarHBondContact O-N 3.49Å; A37-A39 PolarHBondContact O-N 3.49Å; A39-N43 VanDerWaalsContact O-CB 3.26Å; A39-N43 WeakPolarHBondContact O-CB 3.48Å; A39-N43 PolarHBondContact O-N 3.37Å; A39-N43 PolarHBondContact O-ND2 3.17Å; A39-A75 HydrophobicContact CB-CB 3.79Å; A39-T292 VanDerWaalsContact CB-OG1 3.31Å; A39-T292 WeakPolarHBondContact CB-OG1 3.47Å; A39-M293 HydrophobicContact CB-CB 4.23Å |
| 40 | V | 94.4 | Very high | 92.7 | Very high | 28 Ų | 28 | 42.2 Ų | 42.2 | 17% | 0.17 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -68.7 | -56.9 | -179.6 | 173.6 | 0 | 0 | 0 | 0 | 110.5 | L36 A37 G42 N43 L44 A75 A76 | L36-V40 HydrophobicContact CD1-CG2 3.83Å; L36-V40 WeakPolarHBondContact O-CB 3.32Å; L36-V40 VanDerWaalsContact O-CG2 3.31Å; L36-V40 WeakPolarHBondContact O-CG2 3.16Å; L36-V40 PolarHBondContact O-N 2.93Å; A37-V40 PolarHBondContact O-N 3.34Å; V40-G42 PolarHBondContact O-N 3.43Å; V40-N43 PolarHBondContact O-N 3.32Å; V40-L44 HydrophobicContact CG1-CD1 3.76Å; V40-L44 HydrophobicContact CG1-CG 4.41Å; V40-L44 WeakPolarHBondContact O-CB 3.12Å; V40-L44 WeakPolarHBondContact O-CG 3.41Å; V40-L44 PolarHBondContact O-N 3.21Å; V40-A75 HydrophobicContact CG2-CB 3.76Å; V40-A76 HydrophobicContact CG2-CB 4.19Å |
| 41 | F | 94.5 | Very high | 92.7 | Very high | 140 Ų | 140 | 41.3 Ų | 41.3 | 61% | 0.614 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -64.7 | -43.2 | -176.6 | -69 | -65.5 | 0 | 0 | 0 | 112.1 | A37 N43 L44 I45 | A37-F41 HydrophobicContact CB-CD2 4.22Å; A37-F41 HydrophobicContact CB-CE2 4.34Å; A37-F41 WeakPolarHBondContact O-CB 3.44Å; A37-F41 WeakPolarHBondContact O-CD2 3.45Å; A37-F41 PolarHBondContact O-N 3.21Å; F41-N43 PolarHBondContact O-N 2.99Å; F41-L44 PolarHBondContact O-N 3.35Å; F41-I45 WeakPolarHBondContact O-CD1 3.44Å; F41-I45 VanDerWaalsContact O-CG1 3.24Å; F41-I45 WeakPolarHBondContact O-CG1 3.44Å; F41-I45 PolarHBondContact O-N 3.31Å |
| 42 | G | 94.3 | Very high | 92.6 | Very high | 11 Ų | 11 | 42.5 Ų | 42.5 | 11% | 0.113 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.9 | -47.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | V38 V40 I45 V46 | V38-G42 VanDerWaalsContact O-CA 3.31Å; V38-G42 WeakPolarHBondContact O-CA 3.47Å; V38-G42 PolarHBondContact O-N 3.02Å; V40-G42 PolarHBondContact O-N 3.43Å; G42-I45 PolarHBondContact O-N 2.72Å; G42-V46 WeakPolarHBondContact O-CG2 3.09Å; G42-V46 PolarHBondContact O-N 3.34Å; G42-V46 VanDerWaalsContact O-N 3.07Å |
| 43 | N | 95.4 | Very high | 92.5 | Very high | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -72.3 | -33.3 | 180 | -73.9 | -65.3 | 0 | 0 | 0 | 112.5 | A39 V40 F41 I45 V46 I47 A68 A72 T292 P296 | A39-N43 VanDerWaalsContact O-CB 3.26Å; A39-N43 WeakPolarHBondContact O-CB 3.48Å; A39-N43 PolarHBondContact O-N 3.37Å; A39-N43 PolarHBondContact O-ND2 3.17Å; V40-N43 PolarHBondContact O-N 3.32Å; F41-N43 PolarHBondContact O-N 2.99Å; N43-I45 VanDerWaalsContact C-N 3.32Å; N43-I45 PolarHBondContact O-N 3.4Å; N43-V46 WeakPolarHBondContact O-CB 3.47Å; N43-V46 PolarHBondContact O-N 2.87Å; N43-I47 VanDerWaalsContact O-CG1 3.31Å; N43-I47 WeakPolarHBondContact O-CG1 3.25Å; N43-I47 PolarHBondContact O-N 3.4Å; N43-A68 HydrophobicContact CB-CB 4.11Å; N43-A68 WeakPolarHBondContact CB-O 3.5Å; N43-A72 HydrophobicContact CB-CB 3.84Å; N43-T292 PolarHBondContact ND2-O 2.92Å; N43-P296 HydrophobicContact CB-CG 4.46Å; N43-P296 WeakPolarHBondContact OD1-CG 3.46Å |
| 44 | L | 95.8 | Very high | 92.1 | Very high | 87 Ų | 87 | 48.7 Ų | 48.7 | 46% | 0.455 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.7 | -39.9 | 171.1 | -72.7 | 175.1 | 0 | 0 | 0 | 112.1 | V40 F41 I47 W48 | V40-L44 HydrophobicContact CG1-CD1 3.76Å; V40-L44 HydrophobicContact CG1-CG 4.41Å; V40-L44 WeakPolarHBondContact O-CB 3.12Å; V40-L44 WeakPolarHBondContact O-CG 3.41Å; V40-L44 PolarHBondContact O-N 3.21Å; F41-L44 PolarHBondContact O-N 3.35Å; L44-I47 HydrophobicContact CD2-CD1 4.39Å; L44-I47 WeakPolarHBondContact O-CB 3.45Å; L44-I47 PolarHBondContact O-N 2.98Å; L44-W48 WeakPolarHBondContact O-CB 3.47Å; L44-W48 PolarHBondContact O-N 3.28Å |
| 45 | I | 94 | Very high | 91.6 | Very high | 30 Ų | 30 | 47 Ų | 47 | 15% | 0.154 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.5 | -42.1 | 174.2 | -66.2 | 162.7 | 0 | 0 | 0 | 110.6 | F41 G42 N43 I47 W48 I49 F310 A313 F314 | F41-I45 WeakPolarHBondContact O-CD1 3.44Å; F41-I45 VanDerWaalsContact O-CG1 3.24Å; F41-I45 WeakPolarHBondContact O-CG1 3.44Å; F41-I45 PolarHBondContact O-N 3.31Å; G42-I45 PolarHBondContact O-N 2.72Å; N43-I45 VanDerWaalsContact C-N 3.32Å; N43-I45 PolarHBondContact O-N 3.4Å; I45-I47 VanDerWaalsContact C-N 3.33Å; I45-I47 PolarHBondContact O-N 3.3Å; I45-W48 PolarHBondContact O-N 3.4Å; I45-I49 HydrophobicContact CG2-CD1 3.75Å; I45-I49 HydrophobicContact CG2-CG1 4.18Å; I45-I49 VanDerWaalsContact O-CG1 3.27Å; I45-I49 WeakPolarHBondContact O-CG1 3.37Å; I45-I49 PolarHBondContact O-N 3.47Å; I45-F310 HydrophobicContact CB-CD1 4.39Å; I45-F310 HydrophobicContact CB-CE1 3.87Å; I45-F310 HydrophobicContact CD1-CD1 4.49Å; I45-F310 HydrophobicContact CD1-CE1 4.32Å; I45-F310 HydrophobicContact CG2-CD1 3.53Å; I45-F310 HydrophobicContact CG2-CE1 3.41Å; I45-F310 VanDerWaalsContact CG2-CE1 3.41Å; I45-F310 HydrophobicContact CG2-CG 4.34Å; I45-F310 HydrophobicContact CG2-CZ 4.13Å; I45-A313 HydrophobicContact CG2-CB 3.99Å; I45-F314 HydrophobicContact CD1-CE1 4.4Å; I45-F314 HydrophobicContact CD1-CE2 3.76Å; I45-F314 HydrophobicContact CD1-CZ 3.51Å |
| 46 | V | 94.4 | Very high | 91.2 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -58.4 | -45.5 | 175.2 | 172 | 0 | 0 | 0 | 0 | 111.2 | G42 N43 W48 I49 I50 A68 P296 Y299 F306 F310 | G42-V46 WeakPolarHBondContact O-CG2 3.09Å; G42-V46 PolarHBondContact O-N 3.34Å; G42-V46 VanDerWaalsContact O-N 3.07Å; N43-V46 WeakPolarHBondContact O-CB 3.47Å; N43-V46 PolarHBondContact O-N 2.87Å; V46-W48 PolarHBondContact O-N 3.03Å; V46-I49 PolarHBondContact O-N 3.37Å; V46-I50 HydrophobicContact CG1-CD1 3.88Å; V46-I50 WeakPolarHBondContact O-CG1 3.47Å; V46-I50 PolarHBondContact O-N 2.96Å; V46-A68 HydrophobicContact CB-CB 4.09Å; V46-A68 HydrophobicContact CG1-CB 3.8Å; V46-P296 HydrophobicContact CG2-CB 4.05Å; V46-P296 HydrophobicContact CG2-CG 4.15Å; V46-Y299 HydrophobicContact CG1-CD2 4.34Å; V46-Y299 HydrophobicContact CG2-CD2 4.04Å; V46-F306 HydrophobicContact CG1-CE1 4.1Å; V46-F310 HydrophobicContact CG2-CE2 4.38Å; V46-F310 HydrophobicContact CG2-CZ 3.85Å |
| 47 | I | 95.1 | Very high | 90.9 | Very high | 30 Ų | 30 | 50.7 Ų | 50.7 | 15% | 0.154 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -57.4 | -49.9 | 175.2 | -69.7 | 164.7 | 0 | 0 | 0 | 110.2 | N43 L44 I45 I49 I50 L51 L65 A68 F69 | N43-I47 VanDerWaalsContact O-CG1 3.31Å; N43-I47 WeakPolarHBondContact O-CG1 3.25Å; N43-I47 PolarHBondContact O-N 3.4Å; L44-I47 HydrophobicContact CD2-CD1 4.39Å; L44-I47 WeakPolarHBondContact O-CB 3.45Å; L44-I47 PolarHBondContact O-N 2.98Å; I45-I47 VanDerWaalsContact C-N 3.33Å; I45-I47 PolarHBondContact O-N 3.3Å; I47-I49 PolarHBondContact O-N 3.02Å; I47-I50 PolarHBondContact O-N 3.19Å; I47-L51 HydrophobicContact CG2-CD1 3.7Å; I47-L51 HydrophobicContact CG2-CG 4.39Å; I47-L51 WeakPolarHBondContact O-CB 3.32Å; I47-L51 WeakPolarHBondContact O-CG 3.4Å; I47-L51 PolarHBondContact O-N 2.76Å; I47-L65 HydrophobicContact CB-CD1 4.04Å; I47-L65 HydrophobicContact CG1-CD1 3.94Å; I47-L65 HydrophobicContact CG2-CD1 3.87Å; I47-A68 HydrophobicContact CD1-CB 4.35Å; I47-A68 HydrophobicContact CG1-CB 3.81Å; I47-F69 HydrophobicContact CD1-CB 4.33Å |
| 48 | W | 93.9 | Very high | 90.6 | Very high | 108 Ų | 108 | 51.4 Ų | 51.4 | 41% | 0.409 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -59.7 | -47.1 | 179.2 | 175.8 | 79.9 | 0 | 0 | 0 | 112.5 | L44 I45 V46 I50 L51 A52 Q312 A313 | L44-W48 WeakPolarHBondContact O-CB 3.47Å; L44-W48 PolarHBondContact O-N 3.28Å; I45-W48 PolarHBondContact O-N 3.4Å; V46-W48 PolarHBondContact O-N 3.03Å; W48-I50 VanDerWaalsContact C-N 3.29Å; W48-I50 PolarHBondContact O-N 3.32Å; W48-L51 PolarHBondContact O-N 2.97Å; W48-A52 WeakPolarHBondContact O-CB 3.48Å; W48-A52 PolarHBondContact O-N 3.42Å; W48-Q312 HydrophobicContact CH2-CG 4.22Å; W48-A313 HydrophobicContact CE3-CB 4.33Å; W48-A313 HydrophobicContact CZ3-CB 3.92Å |
| 49 | I | 91.1 | Very high | 90.1 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -56.9 | -43.4 | 179.1 | -69.1 | 167.4 | 0 | 0 | 0 | 111 | I45 V46 I47 H53 M56 F306 F310 | I45-I49 HydrophobicContact CG2-CD1 3.75Å; I45-I49 HydrophobicContact CG2-CG1 4.18Å; I45-I49 VanDerWaalsContact O-CG1 3.27Å; I45-I49 WeakPolarHBondContact O-CG1 3.37Å; I45-I49 PolarHBondContact O-N 3.47Å; V46-I49 PolarHBondContact O-N 3.37Å; I47-I49 PolarHBondContact O-N 3.02Å; I49-H53 PolarHBondContact O-CD2 3.38Å; I49-H53 VanDerWaalsContact O-CD2 3.24Å; I49-H53 PolarHBondContact O-N 2.97Å; I49-M56 HydrophobicContact CG2-CE 4.2Å; I49-F306 HydrophobicContact CB-CD1 4.48Å; I49-F306 HydrophobicContact CD1-CD1 4.18Å; I49-F306 HydrophobicContact CG2-CD1 3.94Å; I49-F306 HydrophobicContact CG2-CE1 4.1Å; I49-F310 HydrophobicContact CD1-CD2 3.95Å; I49-F310 HydrophobicContact CD1-CE2 4.07Å; I49-F310 HydrophobicContact CD1-CG 4.19Å; I49-F310 HydrophobicContact CD1-CZ 4.45Å |
| 50 | I | 91.6 | Very high | 89.8 | Confident | 2 Ų | 2 | 51.2 Ų | 51.2 | 1% | 0.01 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -72.3 | -41.6 | -177.4 | -63.2 | 164.9 | 0 | 0 | 0 | 111 | V46 I47 W48 N61 L64 L65 F306 | V46-I50 HydrophobicContact CG1-CD1 3.88Å; V46-I50 WeakPolarHBondContact O-CG1 3.47Å; V46-I50 PolarHBondContact O-N 2.96Å; I47-I50 PolarHBondContact O-N 3.19Å; W48-I50 VanDerWaalsContact C-N 3.29Å; W48-I50 PolarHBondContact O-N 3.32Å; I50-N61 HydrophobicContact CG2-CB 4.23Å; I50-L64 HydrophobicContact CD1-CB 4.04Å; I50-L65 HydrophobicContact CB-CD1 4.42Å; I50-L65 HydrophobicContact CD1-CB 4.09Å; I50-L65 HydrophobicContact CG2-CB 4.34Å; I50-F306 HydrophobicContact CD1-CE1 4.19Å; I50-F306 HydrophobicContact CD1-CZ 4.1Å; I50-F306 HydrophobicContact CG1-CE1 3.96Å; I50-F306 HydrophobicContact CG1-CZ 4.04Å |
| 51 | L | 90.6 | Very high | 89.6 | Confident | 86 Ų | 86 | 50.5 Ų | 50.5 | 45% | 0.45 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -75 | -41 | -177.1 | -67.4 | -179.8 | 0 | 0 | 0 | 112.6 | I47 W48 R57 L65 | I47-L51 HydrophobicContact CG2-CD1 3.7Å; I47-L51 HydrophobicContact CG2-CG 4.39Å; I47-L51 WeakPolarHBondContact O-CB 3.32Å; I47-L51 WeakPolarHBondContact O-CG 3.4Å; I47-L51 PolarHBondContact O-N 2.76Å; W48-L51 PolarHBondContact O-N 2.97Å; L51-R57 PolarHBondContact O-NE 2.95Å; L51-R57 PolarHBondContact O-NH2 2.89Å; L51-L65 HydrophobicContact CD1-CD1 4.44Å; L51-L65 HydrophobicContact CD2-CD1 4.31Å; L51-L65 HydrophobicContact CD2-CD2 3.88Å; L51-L65 HydrophobicContact CG-CD1 4.08Å |
| 52 | A | 87.3 | Confident | 89.5 | Confident | 54 Ų | 54 | 47.4 Ų | 47.4 | 45% | 0.446 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -69.3 | -34.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | W48 | W48-A52 WeakPolarHBondContact O-CB 3.48Å; W48-A52 PolarHBondContact O-N 3.42Å |
| 53 | H | 85.6 | Confident | 89.4 | Confident | 28 Ų | 28 | 46.9 Ų | 46.9 | 13% | 0.13 | 22% | 0.222 | C | C | . | . | trans | -104.7 | 108.6 | -173.9 | -61.5 | -78.6 | 0 | 0 | 0 | 112.5 | I49 R55 M56 Q312 | I49-H53 PolarHBondContact O-CD2 3.38Å; I49-H53 VanDerWaalsContact O-CD2 3.24Å; I49-H53 PolarHBondContact O-N 2.97Å; H53-R55 PolarHBondContact O-N 3.46Å; H53-R55 VanDerWaalsContact O-N 3.11Å; H53-M56 HydrophobicContact CB-CB 4.28Å; H53-M56 HydrophobicContact CB-CG 3.95Å; H53-M56 WeakPolarHBondContact O-CB 3.49Å; H53-M56 PolarHBondContact O-N 3.25Å; H53-Q312 PolarHBondContact CE1-OE1 2.77Å | ||
| 54 | K | 81.5 | Confident | 89.3 | Confident | 171 Ų | 171 | 47.4 Ų | 47.4 | 74% | 0.743 | 22% | 0.224 | S | C | * | . | G | 310 helix | trans | -52.5 | -36.7 | 178.4 | -69 | -175.7 | -179.3 | -178.2 | 0 | 113.5 | M56 R57 | K54-M56 PolarHBondContact O-N 3.28Å; K54-R57 WeakPolarHBondContact O-CB 3.4Å; K54-R57 PolarHBondContact O-N 2.82Å; K54-R57 VanDerWaalsContact O-N 3.08Å |
| 55 | R | 80.8 | Confident | 89.2 | Confident | 92 Ų | 92 | 44.8 Ų | 44.8 | 35% | 0.347 | 21% | 0.211 | S | C | . | . | G | 310 helix | trans | -62.9 | -25.5 | 178 | -168.2 | -178.9 | -172.2 | 179.6 | 11.3 | 113.2 | H53 R57 E329 S332 | H53-R55 PolarHBondContact O-N 3.46Å; H53-R55 VanDerWaalsContact O-N 3.11Å; R55-R57 VanDerWaalsContact C-N 3.33Å; R55-E329 PolarHBondContact NH1-O 3.24Å; R55-S332 VanDerWaalsContact CZ-O 3.31Å; R55-S332 PolarHBondContact NH1-OG 3.35Å; R55-S332 PolarHBondContact NH2-OG 2.91Å |
| 56 | M | 82.6 | Confident | 89.2 | Confident | 3 Ų | 3 | 44 Ų | 44 | 2% | 0.015 | 21% | 0.207 | C | C | . | . | G | 310 helix | trans | -85.8 | -2.7 | 178.1 | -63.7 | -65.1 | -80.9 | 0 | 0 | 112.4 | I49 H53 K54 T58 N61 R305 F306 | I49-M56 HydrophobicContact CG2-CE 4.2Å; H53-M56 HydrophobicContact CB-CB 4.28Å; H53-M56 HydrophobicContact CB-CG 3.95Å; H53-M56 WeakPolarHBondContact O-CB 3.49Å; H53-M56 PolarHBondContact O-N 3.25Å; K54-M56 PolarHBondContact O-N 3.28Å; M56-T58 PolarHBondContact O-N 3.11Å; M56-N61 WeakPolarHBondContact O-CB 3.48Å; M56-N61 VanDerWaalsContact O-CG 3.29Å; M56-N61 PolarHBondContact O-ND2 3.33Å; M56-R305 HydrophobicContact CE-CB 4.03Å; M56-R305 HydrophobicContact SD-CB 3.84Å; M56-F306 HydrophobicContact CE-CD1 4.21Å; M56-F306 HydrophobicContact CE-CD2 3.97Å; M56-F306 HydrophobicContact CE-CE1 4.01Å; M56-F306 HydrophobicContact CE-CE2 3.77Å; M56-F306 HydrophobicContact CE-CG 4.19Å; M56-F306 HydrophobicContact CE-CZ 3.79Å |
| 57 | R | 84.8 | Confident | 89.2 | Confident | 118 Ų | 118 | 44 Ų | 44 | 45% | 0.445 | 21% | 0.207 | S | C | . | . | trans | -83.4 | 61 | 179.4 | -58.9 | -179.2 | -173.8 | 176.6 | -2.1 | 112 | L51 K54 R55 | L51-R57 PolarHBondContact O-NE 2.95Å; L51-R57 PolarHBondContact O-NH2 2.89Å; K54-R57 WeakPolarHBondContact O-CB 3.4Å; K54-R57 PolarHBondContact O-N 2.82Å; K54-R57 VanDerWaalsContact O-N 3.08Å; R55-R57 VanDerWaalsContact C-N 3.33Å | ||
| 58 | T | 86.7 | Confident | 89.2 | Confident | 54 Ų | 54 | 42.7 Ų | 42.7 | 33% | 0.331 | 20% | 0.2 | S | C | . | . | trans | -96.8 | 160.9 | 174.1 | 67 | 0 | 0 | 0 | 0 | 110.5 | M56 T60 N61 Y62 | M56-T58 PolarHBondContact O-N 3.11Å; T58-T60 VanDerWaalsContact C-N 3.34Å; T58-T60 PolarHBondContact O-N 3.05Å; T58-N61 CarbonylContact O-C 3.38Å; T58-N61 WeakPolarHBondContact O-CA 3.46Å; T58-N61 PolarHBondContact O-N 2.81Å; T58-N61 VanDerWaalsContact OG1-CG 3.22Å; T58-N61 PolarHBondContact OG1-N 3.4Å; T58-N61 PolarHBondContact OG1-ND2 2.85Å; T58-Y62 VanDerWaalsContact O-CD2 3.29Å; T58-Y62 WeakPolarHBondContact O-CD2 3.4Å; T58-Y62 PolarHBondContact O-N 3.36Å | ||
| 59 | V | 84.6 | Confident | 89.3 | Confident | 27 Ų | 27 | 42.4 Ų | 42.4 | 16% | 0.164 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -50.1 | -50.9 | 177.7 | 169.1 | 0 | 0 | 0 | 0 | 112.4 | N61 Y62 F63 L135 T140 | V59-N61 PolarHBondContact O-N 3.37Å; V59-Y62 WeakPolarHBondContact O-CB 3.1Å; V59-Y62 PolarHBondContact O-N 3.48Å; V59-Y62 VanDerWaalsContact O-N 3.14Å; V59-F63 HydrophobicContact CG1-CE2 4.31Å; V59-F63 PolarHBondContact O-N 3.01Å; V59-L135 HydrophobicContact CG1-CB 4.09Å; V59-L135 WeakPolarHBondContact CG2-O 3.35Å; V59-T140 HydrophobicContact CG1-CG2 4.2Å; V59-T140 WeakPolarHBondContact CG1-OG1 3.42Å |
| 60 | T | 86.3 | Confident | 89.5 | Confident | 7 Ų | 7 | 42.4 Ų | 42.4 | 4% | 0.043 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -61.5 | -36.1 | 178.6 | -38.1 | 0 | 0 | 0 | 0 | 111.7 | T58 Y62 F63 L64 I119 D122 R123 | T58-T60 VanDerWaalsContact C-N 3.34Å; T58-T60 PolarHBondContact O-N 3.05Å; T60-Y62 VanDerWaalsContact C-N 3.34Å; T60-F63 PolarHBondContact O-N 3.07Å; T60-L64 WeakPolarHBondContact O-CG 3.47Å; T60-L64 PolarHBondContact O-N 3.24Å; T60-I119 HydrophobicContact CG2-CB 4.49Å; T60-I119 HydrophobicContact CG2-CG1 4.07Å; T60-I119 HydrophobicContact CG2-CG2 3.99Å; T60-D122 PolarHBondContact OG1-OD2 3.11Å; T60-R123 VanDerWaalsContact CB-NH2 3.33Å; T60-R123 VanDerWaalsContact CG2-NH2 3.33Å; T60-R123 PolarHBondContact OG1-NH1 3.02Å; T60-R123 PolarHBondContact OG1-NH2 2.93Å |
| 61 | N | 90.3 | Very high | 89.7 | Confident | 12 Ų | 12 | 42.7 Ų | 42.7 | 6% | 0.064 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -75.2 | -22.7 | -179.7 | -67.9 | -2.4 | 0 | 0 | 0 | 112.5 | I50 M56 T58 V59 F63 L64 L65 | I50-N61 HydrophobicContact CG2-CB 4.23Å; M56-N61 WeakPolarHBondContact O-CB 3.48Å; M56-N61 VanDerWaalsContact O-CG 3.29Å; M56-N61 PolarHBondContact O-ND2 3.33Å; T58-N61 CarbonylContact O-C 3.38Å; T58-N61 WeakPolarHBondContact O-CA 3.46Å; T58-N61 PolarHBondContact O-N 2.81Å; T58-N61 VanDerWaalsContact OG1-CG 3.22Å; T58-N61 PolarHBondContact OG1-N 3.4Å; T58-N61 PolarHBondContact OG1-ND2 2.85Å; V59-N61 PolarHBondContact O-N 3.37Å; N61-F63 VanDerWaalsContact C-N 3.34Å; N61-L64 PolarHBondContact O-N 3.38Å; N61-L65 WeakPolarHBondContact O-CB 3.24Å; N61-L65 PolarHBondContact O-N 3.32Å |
| 62 | Y | 91.9 | Very high | 89.8 | Confident | 76 Ų | 76 | 39 Ų | 39 | 30% | 0.298 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -65.4 | -37.9 | 167.8 | -78.5 | -70.1 | 0 | 0 | 0 | 111.9 | T58 V59 T60 L65 N66 | T58-Y62 VanDerWaalsContact O-CD2 3.29Å; T58-Y62 WeakPolarHBondContact O-CD2 3.4Å; T58-Y62 PolarHBondContact O-N 3.36Å; V59-Y62 WeakPolarHBondContact O-CB 3.1Å; V59-Y62 PolarHBondContact O-N 3.48Å; V59-Y62 VanDerWaalsContact O-N 3.14Å; T60-Y62 VanDerWaalsContact C-N 3.34Å; Y62-L65 HydrophobicContact CD1-CD2 4.48Å; Y62-L65 WeakPolarHBondContact O-CB 3.27Å; Y62-L65 PolarHBondContact O-N 3.22Å; Y62-N66 PolarHBondContact O-N 3.37Å |
| 63 | F | 93.2 | Very high | 90.2 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -69.2 | -38.1 | 171.7 | -69.2 | -63.4 | 0 | 0 | 0 | 112.4 | V59 T60 N61 L65 N66 L67 A118 I119 T140 V143 I144 | V59-F63 HydrophobicContact CG1-CE2 4.31Å; V59-F63 PolarHBondContact O-N 3.01Å; T60-F63 PolarHBondContact O-N 3.07Å; N61-F63 VanDerWaalsContact C-N 3.34Å; F63-L65 VanDerWaalsContact C-N 3.28Å; F63-L65 PolarHBondContact O-N 2.89Å; F63-N66 PolarHBondContact O-N 3.2Å; F63-L67 VanDerWaalsContact O-CB 3.32Å; F63-L67 WeakPolarHBondContact O-CB 3.49Å; F63-L67 PolarHBondContact O-N 2.97Å; F63-A118 HydrophobicContact CD1-CB 3.95Å; F63-A118 HydrophobicContact CD2-CB 4.29Å; F63-A118 HydrophobicContact CE1-CB 3.54Å; F63-A118 HydrophobicContact CE2-CB 3.89Å; F63-A118 HydrophobicContact CG-CB 4.32Å; F63-A118 HydrophobicContact CZ-CB 3.5Å; F63-I119 HydrophobicContact CB-CD1 3.55Å; F63-I119 HydrophobicContact CB-CG1 3.34Å; F63-I119 HydrophobicContact CD2-CG1 4.14Å; F63-I119 HydrophobicContact CG-CG1 4.01Å; F63-T140 HydrophobicContact CD2-CG2 4.17Å; F63-T140 HydrophobicContact CE1-CG2 4.22Å; F63-T140 HydrophobicContact CE2-CG2 3.72Å; F63-T140 HydrophobicContact CZ-CG2 3.74Å; F63-V143 HydrophobicContact CE1-CB 4.43Å; F63-V143 HydrophobicContact CE1-CG1 3.92Å; F63-V143 HydrophobicContact CZ-CB 4.36Å; F63-V143 HydrophobicContact CZ-CG1 4.03Å; F63-I144 HydrophobicContact CD1-CD1 4.38Å; F63-I144 HydrophobicContact CD1-CG1 4.02Å; F63-I144 HydrophobicContact CE1-CG1 3.93Å |
| 64 | L | 92.4 | Very high | 90.5 | Very high | 10 Ų | 10 | 35.9 Ų | 35.9 | 5% | 0.052 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -63.1 | -35.4 | 172.8 | -66.7 | 177.9 | 0 | 0 | 0 | 112.2 | I50 T60 N61 L67 A68 I119 Y299 F306 | I50-L64 HydrophobicContact CD1-CB 4.04Å; T60-L64 WeakPolarHBondContact O-CG 3.47Å; T60-L64 PolarHBondContact O-N 3.24Å; N61-L64 PolarHBondContact O-N 3.38Å; L64-L67 HydrophobicContact CD2-CD2 4.43Å; L64-A68 WeakPolarHBondContact O-CB 3.36Å; L64-A68 PolarHBondContact O-N 3.21Å; L64-I119 HydrophobicContact CD2-CD1 3.7Å; L64-I119 HydrophobicContact CG-CD1 4.12Å; L64-Y299 HydrophobicContact CD2-CE1 4.08Å; L64-Y299 HydrophobicContact CD2-CE2 4.05Å; L64-Y299 WeakPolarHBondContact CD2-OH 3.43Å; L64-F306 HydrophobicContact CD1-CE2 3.79Å; L64-F306 HydrophobicContact CD1-CZ 3.83Å |
| 65 | L | 94.3 | Very high | 91 | Very high | 32 Ų | 32 | 27.8 Ų | 27.8 | 17% | 0.168 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -65 | -46.9 | 173.7 | -179.6 | 71.1 | 0 | 0 | 0 | 111 | I47 I50 L51 N61 Y62 F63 L67 A68 F69 | I47-L65 HydrophobicContact CB-CD1 4.04Å; I47-L65 HydrophobicContact CG1-CD1 3.94Å; I47-L65 HydrophobicContact CG2-CD1 3.87Å; I50-L65 HydrophobicContact CB-CD1 4.42Å; I50-L65 HydrophobicContact CD1-CB 4.09Å; I50-L65 HydrophobicContact CG2-CB 4.34Å; L51-L65 HydrophobicContact CD1-CD1 4.44Å; L51-L65 HydrophobicContact CD2-CD1 4.31Å; L51-L65 HydrophobicContact CD2-CD2 3.88Å; L51-L65 HydrophobicContact CG-CD1 4.08Å; N61-L65 WeakPolarHBondContact O-CB 3.24Å; N61-L65 PolarHBondContact O-N 3.32Å; Y62-L65 HydrophobicContact CD1-CD2 4.48Å; Y62-L65 WeakPolarHBondContact O-CB 3.27Å; Y62-L65 PolarHBondContact O-N 3.22Å; F63-L65 VanDerWaalsContact C-N 3.28Å; F63-L65 PolarHBondContact O-N 2.89Å; L65-L67 VanDerWaalsContact C-N 3.34Å; L65-L67 PolarHBondContact O-N 3.42Å; L65-A68 PolarHBondContact O-N 3.04Å; L65-F69 WeakPolarHBondContact O-CB 3.34Å; L65-F69 PolarHBondContact O-N 2.91Å |
| 66 | N | 95.3 | Very high | 91.5 | Very high | 14 Ų | 14 | 25.2 Ų | 25.2 | 8% | 0.075 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -61.4 | -43.1 | 176.8 | -172.9 | 59.8 | 0 | 0 | 0 | 111.8 | Y62 F63 F69 S70 S115 I144 W148 | Y62-N66 PolarHBondContact O-N 3.37Å; F63-N66 PolarHBondContact O-N 3.2Å; N66-F69 PolarHBondContact O-N 3.3Å; N66-S70 WeakPolarHBondContact O-CB 3Å; N66-S70 PolarHBondContact O-N 2.94Å; N66-S115 PolarHBondContact ND2-OG 3.48Å; N66-I144 HydrophobicContact CB-CD1 4.22Å; N66-I144 HydrophobicContact CB-CG1 4.4Å; N66-I144 HydrophobicContact CB-CG2 4.39Å; N66-I144 WeakPolarHBondContact OD1-CG2 3.5Å; N66-W148 PolarHBondContact OD1-NE1 2.94Å |
| 67 | L | 93.6 | Very high | 91.9 | Very high | 1 Ų | 1 | 29.8 Ų | 29.8 | 1% | 0.005 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -59 | -50.9 | 174.8 | 177 | 64.8 | 0 | 0 | 0 | 111.4 | F63 L64 L65 F69 S70 D71 S112 M116 Y299 | F63-L67 VanDerWaalsContact O-CB 3.32Å; F63-L67 WeakPolarHBondContact O-CB 3.49Å; F63-L67 PolarHBondContact O-N 2.97Å; L64-L67 HydrophobicContact CD2-CD2 4.43Å; L65-L67 VanDerWaalsContact C-N 3.34Å; L65-L67 PolarHBondContact O-N 3.42Å; L67-F69 VanDerWaalsContact C-N 3.33Å; L67-F69 PolarHBondContact O-N 3.02Å; L67-S70 PolarHBondContact O-N 3.04Å; L67-D71 WeakPolarHBondContact O-CB 3.25Å; L67-D71 PolarHBondContact O-N 3.22Å; L67-S112 VanDerWaalsContact CD1-CB 3.42Å; L67-M116 HydrophobicContact CD1-CG 4.29Å; L67-M116 HydrophobicContact CD2-CG 4.08Å; L67-Y299 WeakPolarHBondContact CD2-OH 3.31Å |
| 68 | A | 95.5 | Very high | 92.1 | Very high | 1 Ų | 1 | 24.6 Ų | 24.6 | 1% | 0.008 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -63 | -38.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | N43 V46 I47 L64 L65 A72 | N43-A68 HydrophobicContact CB-CB 4.11Å; N43-A68 WeakPolarHBondContact CB-O 3.5Å; V46-A68 HydrophobicContact CB-CB 4.09Å; V46-A68 HydrophobicContact CG1-CB 3.8Å; I47-A68 HydrophobicContact CD1-CB 4.35Å; I47-A68 HydrophobicContact CG1-CB 3.81Å; L64-A68 WeakPolarHBondContact O-CB 3.36Å; L64-A68 PolarHBondContact O-N 3.21Å; L65-A68 PolarHBondContact O-N 3.04Å; A68-A72 WeakPolarHBondContact O-CB 3.16Å; A68-A72 PolarHBondContact O-N 3.35Å |
| 69 | F | 96 | Very high | 92.1 | Very high | 103 Ų | 103 | 22.2 Ų | 22.2 | 45% | 0.452 | 11% | 0.113 | S | C | . | . | H | α-helix | trans | -63.3 | -46.6 | 174.9 | 172.4 | -102 | 0 | 0 | 0 | 112.1 | I47 L65 N66 L67 S73 W148 | I47-F69 HydrophobicContact CD1-CB 4.33Å; L65-F69 WeakPolarHBondContact O-CB 3.34Å; L65-F69 PolarHBondContact O-N 2.91Å; N66-F69 PolarHBondContact O-N 3.3Å; L67-F69 VanDerWaalsContact C-N 3.33Å; L67-F69 PolarHBondContact O-N 3.02Å; F69-S73 VanDerWaalsContact O-CB 3.29Å; F69-S73 WeakPolarHBondContact O-CB 3.47Å; F69-S73 PolarHBondContact O-N 3.4Å; F69-S73 PolarHBondContact O-OG 3.04Å; F69-W148 AromaticContact CD1-CZ2 3.93Å; F69-W148 HydrophobicContact CD1-CZ2 3.93Å; F69-W148 HydrophobicContact CE1-CH2 4.13Å; F69-W148 AromaticContact CE1-CZ2 3.88Å; F69-W148 HydrophobicContact CE1-CZ2 3.88Å |
| 70 | S | 95.3 | Very high | 92.1 | Very high | 0 Ų | 0 | 22.2 Ų | 22.2 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -59.2 | -53.7 | 177.4 | -174.7 | 0 | 0 | 0 | 0 | 111.2 | N66 L67 A72 S73 M74 S108 S112 | N66-S70 WeakPolarHBondContact O-CB 3Å; N66-S70 PolarHBondContact O-N 2.94Å; L67-S70 PolarHBondContact O-N 3.04Å; S70-A72 PolarHBondContact O-N 2.87Å; S70-S73 PolarHBondContact O-N 3.4Å; S70-M74 PolarHBondContact O-N 3.21Å; S70-S108 PolarHBondContact O-OG 3.5Å; S70-S108 VanDerWaalsContact OG-C 3.29Å; S70-S108 VanDerWaalsContact OG-CA 3.24Å; S70-S108 WeakPolarHBondContact OG-CA 3.42Å; S70-S108 WeakPolarHBondContact OG-CB 3.42Å; S70-S108 PolarHBondContact OG-O 2.99Å; S70-S108 PolarHBondContact OG-OG 2.98Å; S70-S112 VanDerWaalsContact CB-OG 3.3Å; S70-S112 WeakPolarHBondContact CB-OG 3.34Å; S70-S112 PolarHBondContact OG-OG 3.14Å |
| 71 | D | 94.3 | Very high | 92.2 | Very high | 7 Ų | 7 | 22.6 Ų | 22.6 | 4% | 0.037 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -63.6 | -43.2 | -177.6 | -69.9 | -7.3 | 0 | 0 | 0 | 112.2 | L67 S73 M74 A75 S112 T292 N295 | L67-D71 WeakPolarHBondContact O-CB 3.25Å; L67-D71 PolarHBondContact O-N 3.22Å; D71-S73 VanDerWaalsContact C-N 3.34Å; D71-S73 PolarHBondContact O-N 3.21Å; D71-M74 PolarHBondContact O-N 3.07Å; D71-A75 WeakPolarHBondContact O-CB 3.44Å; D71-A75 PolarHBondContact O-N 2.69Å; D71-S112 WeakPolarHBondContact OD1-CB 3.39Å; D71-S112 PolarHBondContact OD1-OG 3Å; D71-T292 HydrophobicContact CB-CG2 4.1Å; D71-N295 PolarHBondContact OD2-ND2 3.47Å |
| 72 | A | 94.6 | Very high | 91.9 | Very high | 8 Ų | 8 | 23 Ų | 23 | 7% | 0.066 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -62.2 | -43 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | N43 A68 S70 A75 A76 | N43-A72 HydrophobicContact CB-CB 3.84Å; A68-A72 WeakPolarHBondContact O-CB 3.16Å; A68-A72 PolarHBondContact O-N 3.35Å; S70-A72 PolarHBondContact O-N 2.87Å; A72-A75 PolarHBondContact O-N 3.49Å; A72-A76 VanDerWaalsContact O-CB 3.27Å; A72-A76 WeakPolarHBondContact O-CB 3.3Å; A72-A76 PolarHBondContact O-N 2.93Å |
| 73 | S | 93.9 | Very high | 91.3 | Very high | 13 Ų | 13 | 21.8 Ų | 21.8 | 9% | 0.091 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -66.8 | -42.9 | 179.9 | -56.8 | 0 | 0 | 0 | 0 | 111 | F69 S70 D71 A76 F77 | F69-S73 VanDerWaalsContact O-CB 3.29Å; F69-S73 WeakPolarHBondContact O-CB 3.47Å; F69-S73 PolarHBondContact O-N 3.4Å; F69-S73 PolarHBondContact O-OG 3.04Å; S70-S73 PolarHBondContact O-N 3.4Å; D71-S73 VanDerWaalsContact C-N 3.34Å; D71-S73 PolarHBondContact O-N 3.21Å; S73-A76 PolarHBondContact O-N 3.49Å; S73-F77 WeakPolarHBondContact O-CB 3.38Å; S73-F77 WeakPolarHBondContact O-CD2 3.46Å; S73-F77 PolarHBondContact O-N 3.43Å |
| 74 | M | 92.6 | Very high | 90.8 | Very high | 4 Ų | 4 | 24.4 Ų | 24.4 | 2% | 0.02 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -64.5 | -41.8 | 177.1 | 175.8 | 173.3 | 179.3 | 0 | 0 | 111.5 | S70 D71 N78 T79 F104 P105 S108 V109 W255 M289 | S70-M74 PolarHBondContact O-N 3.21Å; D71-M74 PolarHBondContact O-N 3.07Å; M74-N78 HydrophobicContact CG-CB 4.3Å; M74-N78 WeakPolarHBondContact O-CA 3.33Å; M74-N78 VanDerWaalsContact O-CB 3.22Å; M74-N78 WeakPolarHBondContact O-CB 3.4Å; M74-N78 PolarHBondContact O-N 3.35Å; M74-T79 PolarHBondContact O-N 3.32Å; M74-F104 HydrophobicContact CB-CE1 4.38Å; M74-P105 HydrophobicContact CE-CB 3.94Å; M74-S108 VanDerWaalsContact CB-OG 3.29Å; M74-S108 WeakPolarHBondContact CB-OG 3.42Å; M74-V109 HydrophobicContact CE-CG2 3.72Å; M74-V109 HydrophobicContact SD-CG2 3.63Å; M74-W255 HydrophobicContact CE-CH2 4.16Å; M74-W255 HydrophobicContact CE-CZ2 4.42Å; M74-M289 HydrophobicContact CE-CE 3.63Å; M74-M289 HydrophobicContact CE-SD 3.65Å; M74-M289 HydrophobicContact CG-CE 4.13Å |
| 75 | A | 92.4 | Very high | 90.4 | Very high | 1 Ų | 1 | 26.7 Ų | 26.7 | 1% | 0.008 | 14% | 0.136 | C | C | . | . | I | π-helix | trans | -60.1 | -50.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L36 A39 V40 D71 A72 T79 S80 | L36-A75 HydrophobicContact CD1-CB 4.21Å; L36-A75 WeakPolarHBondContact CD1-O 3.17Å; A39-A75 HydrophobicContact CB-CB 3.79Å; V40-A75 HydrophobicContact CG2-CB 3.76Å; D71-A75 WeakPolarHBondContact O-CB 3.44Å; D71-A75 PolarHBondContact O-N 2.69Å; A72-A75 PolarHBondContact O-N 3.49Å; A75-T79 WeakPolarHBondContact CA-OG1 3.48Å; A75-T79 VanDerWaalsContact O-CB 3.28Å; A75-T79 WeakPolarHBondContact O-CB 3.21Å; A75-T79 PolarHBondContact O-N 3.18Å; A75-S80 PolarHBondContact O-N 3.28Å |
| 76 | A | 91.6 | Very high | 89.5 | Confident | 39 Ų | 39 | 27.3 Ų | 27.3 | 32% | 0.322 | 15% | 0.146 | S | C | . | . | I | π-helix | trans | -66.2 | -41.7 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | V40 A72 S73 S80 | V40-A76 HydrophobicContact CG2-CB 4.19Å; A72-A76 VanDerWaalsContact O-CB 3.27Å; A72-A76 WeakPolarHBondContact O-CB 3.3Å; A72-A76 PolarHBondContact O-N 2.93Å; S73-A76 PolarHBondContact O-N 3.49Å; A76-S80 WeakPolarHBondContact O-CB 3.39Å; A76-S80 PolarHBondContact O-OG 3.08Å |
| 77 | F | 90.8 | Very high | 88.5 | Confident | 99 Ų | 99 | 28.4 Ų | 28.4 | 43% | 0.434 | 16% | 0.157 | S | C | . | . | I | π-helix | trans | -99.8 | -29 | -173.6 | -59.4 | -58.8 | 0 | 0 | 0 | 114.3 | S73 I81 Y97 F100 F104 | S73-F77 WeakPolarHBondContact O-CB 3.38Å; S73-F77 WeakPolarHBondContact O-CD2 3.46Å; S73-F77 PolarHBondContact O-N 3.43Å; F77-I81 VanDerWaalsContact O-CG1 3.31Å; F77-I81 WeakPolarHBondContact O-CG1 3.2Å; F77-Y97 PolarHBondContact O-OH 2.93Å; F77-F100 HydrophobicContact CB-CE1 4Å; F77-F100 HydrophobicContact CG-CE1 4.41Å; F77-F104 HydrophobicContact CD2-CE1 4.27Å |
| 78 | N | 89.3 | Confident | 87.8 | Confident | 9 Ų | 9 | 33.9 Ų | 33.9 | 5% | 0.048 | 18% | 0.183 | C | C | . | . | I | π-helix | trans | -98.7 | -55.3 | -179.7 | -171.1 | -93.1 | 0 | 0 | 0 | 112.2 | M74 S80 I81 N82 H101 P105 | M74-N78 HydrophobicContact CG-CB 4.3Å; M74-N78 WeakPolarHBondContact O-CA 3.33Å; M74-N78 VanDerWaalsContact O-CB 3.22Å; M74-N78 WeakPolarHBondContact O-CB 3.4Å; M74-N78 PolarHBondContact O-N 3.35Å; N78-S80 VanDerWaalsContact C-N 3.32Å; N78-S80 PolarHBondContact O-N 3.02Å; N78-I81 PolarHBondContact O-N 2.91Å; N78-N82 WeakPolarHBondContact O-CB 3.39Å; N78-N82 PolarHBondContact O-N 2.9Å; N78-H101 PolarHBondContact ND2-CE1 3.32Å; N78-H101 PolarHBondContact ND2-ND1 2.87Å; N78-H101 VanDerWaalsContact ND2-ND1 3.19Å; N78-H101 PolarHBondContact ND2-O 3.31Å; N78-H101 VanDerWaalsContact ND2-O 3.1Å; N78-P105 HydrophobicContact CB-CG 4.02Å; N78-P105 VanDerWaalsContact CG-CG 3.41Å; N78-P105 WeakPolarHBondContact ND2-CG 3.27Å |
| 79 | T | 86.3 | Confident | 86.8 | Confident | 3 Ų | 3 | 35.5 Ų | 35.5 | 2% | 0.018 | 20% | 0.199 | C | C | . | . | I | π-helix | trans | -59.1 | -44 | -174.9 | -48.1 | 0 | 0 | 0 | 0 | 112.2 | Y32 M74 A75 I81 N82 F83 M289 | Y32-T79 HydrophobicContact CD1-CG2 4.05Å; M74-T79 PolarHBondContact O-N 3.32Å; A75-T79 WeakPolarHBondContact CA-OG1 3.48Å; A75-T79 VanDerWaalsContact O-CB 3.28Å; A75-T79 WeakPolarHBondContact O-CB 3.21Å; A75-T79 PolarHBondContact O-N 3.18Å; T79-I81 PolarHBondContact O-N 3.41Å; T79-N82 PolarHBondContact O-N 2.83Å; T79-F83 WeakPolarHBondContact O-CB 3.3Å; T79-F83 PolarHBondContact O-N 2.74Å; T79-M289 HydrophobicContact CG2-CE 4.39Å; T79-M289 WeakPolarHBondContact OG1-CE 3.42Å |
| 80 | S | 85.4 | Confident | 86.2 | Confident | 27 Ų | 27 | 32.9 Ų | 32.9 | 19% | 0.189 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -58.2 | -48.4 | 179.2 | 60.4 | 0 | 0 | 0 | 0 | 111.9 | A75 A76 N78 F83 I84 | A75-S80 PolarHBondContact O-N 3.28Å; A76-S80 WeakPolarHBondContact O-CB 3.39Å; A76-S80 PolarHBondContact O-OG 3.08Å; N78-S80 VanDerWaalsContact C-N 3.32Å; N78-S80 PolarHBondContact O-N 3.02Å; S80-F83 PolarHBondContact O-N 3.47Å; S80-I84 WeakPolarHBondContact O-CG1 3.46Å; S80-I84 PolarHBondContact O-N 3.29Å; S80-I84 VanDerWaalsContact O-N 3.15Å |
| 81 | I | 87.6 | Confident | 85.8 | Confident | 16 Ų | 16 | 33.4 Ų | 33.4 | 8% | 0.082 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -73.7 | -38.6 | -178 | -58.2 | -53.7 | 0 | 0 | 0 | 111.7 | F77 N78 T79 F83 I84 Y85 W91 F93 Y97 | F77-I81 VanDerWaalsContact O-CG1 3.31Å; F77-I81 WeakPolarHBondContact O-CG1 3.2Å; N78-I81 PolarHBondContact O-N 2.91Å; T79-I81 PolarHBondContact O-N 3.41Å; I81-F83 VanDerWaalsContact C-N 3.27Å; I81-F83 PolarHBondContact O-N 3Å; I81-I84 HydrophobicContact CD1-CD1 4.23Å; I81-I84 PolarHBondContact O-N 3.05Å; I81-Y85 WeakPolarHBondContact O-CB 3.38Å; I81-Y85 PolarHBondContact O-N 3.38Å; I81-W91 HydrophobicContact CG2-CH2 4.09Å; I81-W91 HydrophobicContact CG2-CZ3 4.19Å; I81-F93 HydrophobicContact CD1-CD1 4.21Å; I81-F93 HydrophobicContact CD1-CE1 3.64Å; I81-F93 HydrophobicContact CD1-CE2 4.29Å; I81-F93 HydrophobicContact CD1-CZ 3.68Å; I81-F93 HydrophobicContact CG2-CD2 3.61Å; I81-F93 HydrophobicContact CG2-CE2 3.55Å; I81-F93 HydrophobicContact CG2-CG 4.23Å; I81-F93 HydrophobicContact CG2-CZ 4.1Å; I81-Y97 HydrophobicContact CB-CE1 4.08Å; I81-Y97 HydrophobicContact CD1-CE1 4.49Å; I81-Y97 HydrophobicContact CG1-CE1 3.65Å; I81-Y97 WeakPolarHBondContact CG1-OH 3.3Å; I81-Y97 HydrophobicContact CG2-CD1 4.29Å; I81-Y97 HydrophobicContact CG2-CE1 3.8Å |
| 82 | N | 84.3 | Confident | 85.5 | Confident | 19 Ų | 19 | 38.7 Ų | 38.7 | 10% | 0.102 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62.3 | -39.6 | 176.2 | -162.7 | 0.2 | 0 | 0 | 0 | 110.9 | N78 T79 Y85 A86 M285 | N78-N82 WeakPolarHBondContact O-CB 3.39Å; N78-N82 PolarHBondContact O-N 2.9Å; T79-N82 PolarHBondContact O-N 2.83Å; N82-Y85 PolarHBondContact O-N 3.26Å; N82-A86 VanDerWaalsContact O-CB 3.26Å; N82-A86 WeakPolarHBondContact O-CB 3.31Å; N82-A86 PolarHBondContact O-N 2.93Å; N82-M285 VanDerWaalsContact CG-CE 3.47Å; N82-M285 WeakPolarHBondContact ND2-CE 3.31Å; N82-M285 PolarHBondContact ND2-SD 3.32Å; N82-M285 WeakPolarHBondContact OD1-CE 3.17Å |
| 83 | F | 79.2 | Confident | 85.1 | Confident | 52 Ų | 52 | 41.6 Ų | 41.6 | 23% | 0.228 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.3 | -47.6 | 173.1 | 171.3 | -106.7 | 0 | 0 | 0 | 112.1 | S29 Y32 T79 S80 I81 Y85 A86 A87 | S29-F83 VanDerWaalsContact OG-CE2 3.26Å; S29-F83 WeakPolarHBondContact OG-CE2 3.41Å; S29-F83 WeakPolarHBondContact OG-CZ 3.33Å; Y32-F83 HydrophobicContact CG-CD2 4.45Å; T79-F83 WeakPolarHBondContact O-CB 3.3Å; T79-F83 PolarHBondContact O-N 2.74Å; S80-F83 PolarHBondContact O-N 3.47Å; I81-F83 VanDerWaalsContact C-N 3.27Å; I81-F83 PolarHBondContact O-N 3Å; F83-Y85 VanDerWaalsContact C-N 3.32Å; F83-Y85 PolarHBondContact O-N 3.46Å; F83-A86 PolarHBondContact O-N 3.26Å; F83-A87 HydrophobicContact CE2-CB 4.42Å; F83-A87 HydrophobicContact CZ-CB 4.34Å; F83-A87 WeakPolarHBondContact O-CB 3.5Å; F83-A87 PolarHBondContact O-N 2.76Å |
| 84 | I | 83.3 | Confident | 84.9 | Confident | 55 Ų | 55 | 42.8 Ų | 42.8 | 28% | 0.282 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -59.2 | -45.3 | 176.5 | -65.2 | 165.5 | 0 | 0 | 0 | 110.6 | S80 I81 A86 A87 H88 F93 | S80-I84 WeakPolarHBondContact O-CG1 3.46Å; S80-I84 PolarHBondContact O-N 3.29Å; S80-I84 VanDerWaalsContact O-N 3.15Å; I81-I84 HydrophobicContact CD1-CD1 4.23Å; I81-I84 PolarHBondContact O-N 3.05Å; I84-A86 PolarHBondContact O-N 3.03Å; I84-A87 PolarHBondContact O-N 3.35Å; I84-H88 PolarHBondContact O-CD2 3.43Å; I84-H88 PolarHBondContact O-N 3.06Å; I84-F93 HydrophobicContact CB-CZ 4.36Å; I84-F93 HydrophobicContact CD1-CZ 4.06Å; I84-F93 HydrophobicContact CG2-CE2 4.16Å; I84-F93 HydrophobicContact CG2-CZ 3.97Å |
| 85 | Y | 83.3 | Confident | 84.8 | Confident | 57 Ų | 57 | 47.9 Ų | 47.9 | 22% | 0.224 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.1 | -40.5 | 177.9 | -178.9 | -124 | 0 | 0 | 0 | 112.2 | I81 N82 F83 G89 E90 W91 | I81-Y85 WeakPolarHBondContact O-CB 3.38Å; I81-Y85 PolarHBondContact O-N 3.38Å; N82-Y85 PolarHBondContact O-N 3.26Å; F83-Y85 VanDerWaalsContact C-N 3.32Å; F83-Y85 PolarHBondContact O-N 3.46Å; Y85-G89 VanDerWaalsContact O-CA 3.26Å; Y85-G89 WeakPolarHBondContact O-CA 3.38Å; Y85-G89 PolarHBondContact O-N 3.47Å; Y85-E90 WeakPolarHBondContact CD2-O 3.25Å; Y85-W91 HydrophobicContact CD2-CB 4.27Å; Y85-W91 AromaticContact CD2-CE3 3.9Å; Y85-W91 HydrophobicContact CD2-CE3 3.9Å; Y85-W91 HydrophobicContact CE2-CB 4Å; Y85-W91 HydrophobicContact CE2-CE3 4.26Å; Y85-W91 HydrophobicContact CG-CE3 4.08Å |
| 86 | A | 74.6 | Confident | 84.8 | Confident | 46 Ų | 46 | 51.8 Ų | 51.8 | 38% | 0.38 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -68.5 | -35 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | N82 F83 I84 L282 | N82-A86 VanDerWaalsContact O-CB 3.26Å; N82-A86 WeakPolarHBondContact O-CB 3.31Å; N82-A86 PolarHBondContact O-N 2.93Å; F83-A86 PolarHBondContact O-N 3.26Å; I84-A86 PolarHBondContact O-N 3.03Å; A86-L282 HydrophobicContact CB-CD2 4.32Å |
| 87 | A | 74.5 | Confident | 84.8 | Confident | 37 Ų | 37 | 52.7 Ų | 52.7 | 31% | 0.306 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -74.3 | -44.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | F83 I84 | F83-A87 HydrophobicContact CE2-CB 4.42Å; F83-A87 HydrophobicContact CZ-CB 4.34Å; F83-A87 WeakPolarHBondContact O-CB 3.5Å; F83-A87 PolarHBondContact O-N 2.76Å; I84-A87 PolarHBondContact O-N 3.35Å |
| 88 | H | 78.8 | Confident | 84.9 | Confident | 116 Ų | 116 | 48 Ų | 48 | 54% | 0.537 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -90.2 | -24.6 | -177.3 | -71.5 | -91.3 | 0 | 0 | 0 | 113.5 | I84 E90 Y92 | I84-H88 PolarHBondContact O-CD2 3.43Å; I84-H88 PolarHBondContact O-N 3.06Å; H88-E90 PolarHBondContact O-N 2.94Å; H88-Y92 HydrophobicContact CB-CE2 3.73Å; H88-Y92 AromaticContact CG-CE2 3.89Å |
| 89 | G | 74.6 | Confident | 85.1 | Confident | 35 Ų | 35 | 50.2 Ų | 50.2 | 36% | 0.361 | 28% | 0.275 | S | S | . | . | S | Bend | trans | 69.1 | 15.5 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y85 | Y85-G89 VanDerWaalsContact O-CA 3.26Å; Y85-G89 WeakPolarHBondContact O-CA 3.38Å; Y85-G89 PolarHBondContact O-N 3.47Å |
| 90 | E | 83.2 | Confident | 85.4 | Confident | 48 Ų | 48 | 53.5 Ų | 53.5 | 22% | 0.224 | 29% | 0.289 | C | S | . | . | S | Bend | trans | -137.3 | 141.5 | -177.1 | -77.4 | -179.4 | -177.6 | 0 | 0 | 111.6 | Y85 H88 Y92 R173 | Y85-E90 WeakPolarHBondContact CD2-O 3.25Å; H88-E90 PolarHBondContact O-N 2.94Å; E90-Y92 HydrophobicContact CB-CE1 3.83Å; E90-Y92 HydrophobicContact CB-CE2 4.25Å; E90-Y92 WeakPolarHBondContact CB-OH 3.32Å; E90-Y92 WeakPolarHBondContact OE2-CE1 3.31Å; E90-Y92 PolarHBondContact OE2-OH 3.14Å; E90-R173 HydrophobicContact CG-CB 4.26Å; E90-R173 HydrophobicContact CG-CG 3.9Å |
| 91 | W | 87.3 | Confident | 85.7 | Confident | 10 Ų | 10 | 53.1 Ų | 53.1 | 4% | 0.038 | 28% | 0.284 | C | S | . | . | trans | -93.9 | 110.2 | -179.1 | -174.9 | -93.2 | 0 | 0 | 0 | 112.3 | I81 Y85 F93 G94 Y97 C98 H101 T174 C176 | I81-W91 HydrophobicContact CG2-CH2 4.09Å; I81-W91 HydrophobicContact CG2-CZ3 4.19Å; Y85-W91 HydrophobicContact CD2-CB 4.27Å; Y85-W91 AromaticContact CD2-CE3 3.9Å; Y85-W91 HydrophobicContact CD2-CE3 3.9Å; Y85-W91 HydrophobicContact CE2-CB 4Å; Y85-W91 HydrophobicContact CE2-CE3 4.26Å; Y85-W91 HydrophobicContact CG-CE3 4.08Å; W91-F93 HydrophobicContact CD2-CD2 4.48Å; W91-F93 HydrophobicContact CH2-CD2 4.32Å; W91-F93 HydrophobicContact CZ2-CB 3.82Å; W91-F93 HydrophobicContact CZ2-CD2 4.28Å; W91-F93 HydrophobicContact CZ3-CD2 4.44Å; W91-G94 PolarHBondContact NE1-O 3.3Å; W91-Y97 HydrophobicContact CH2-CD1 4Å; W91-Y97 AromaticContact CZ2-CD1 3.94Å; W91-Y97 HydrophobicContact CZ2-CD1 3.94Å; W91-C98 HydrophobicContact CZ2-CB 3.78Å; W91-H101 HydrophobicContact CH2-CB 3.7Å; W91-H101 AromaticContact CH2-CG 3.67Å; W91-H101 HydrophobicContact CZ2-CB 4.43Å; W91-T174 HydrophobicContact CB-CG2 4.33Å; W91-T174 VanDerWaalsContact CB-O 3.29Å; W91-T174 WeakPolarHBondContact CB-O 3.09Å; W91-T174 PolarHBondContact N-O 2.84Å; W91-C176 HydrophobicContact CB-CB 4.45Å; W91-C176 HydrophobicContact CD2-CB 3.5Å; W91-C176 HydrophobicContact CE3-CB 3.67Å; W91-C176 HydrophobicContact CG-CB 3.84Å; W91-C176 HydrophobicContact CZ2-CB 4.43Å; W91-C176 HydrophobicContact CZ3-CB 4.19Å | ||
| 92 | Y | 87.4 | Confident | 85.9 | Confident | 119 Ų | 119 | 54.3 Ų | 54.3 | 47% | 0.467 | 29% | 0.291 | S | S | . | . | trans | -97.3 | -17.8 | -177.5 | -55.3 | -60 | 0 | 0 | 0 | 114.9 | H88 E90 G94 | H88-Y92 HydrophobicContact CB-CE2 3.73Å; H88-Y92 AromaticContact CG-CE2 3.89Å; E90-Y92 HydrophobicContact CB-CE1 3.83Å; E90-Y92 HydrophobicContact CB-CE2 4.25Å; E90-Y92 WeakPolarHBondContact CB-OH 3.32Å; E90-Y92 WeakPolarHBondContact OE2-CE1 3.31Å; E90-Y92 PolarHBondContact OE2-OH 3.14Å; Y92-G94 VanDerWaalsContact C-N 3.28Å; Y92-G94 PolarHBondContact O-N 3.13Å | ||
| 93 | F | 87.6 | Confident | 86.3 | Confident | 69 Ų | 69 | 55.2 Ų | 55.2 | 30% | 0.303 | 29% | 0.294 | S | S | . | . | S | Bend | trans | -86.9 | 10.7 | -164 | -53.2 | -82 | 0 | 0 | 0 | 114.8 | I81 I84 W91 Y97 | I81-F93 HydrophobicContact CD1-CD1 4.21Å; I81-F93 HydrophobicContact CD1-CE1 3.64Å; I81-F93 HydrophobicContact CD1-CE2 4.29Å; I81-F93 HydrophobicContact CD1-CZ 3.68Å; I81-F93 HydrophobicContact CG2-CD2 3.61Å; I81-F93 HydrophobicContact CG2-CE2 3.55Å; I81-F93 HydrophobicContact CG2-CG 4.23Å; I81-F93 HydrophobicContact CG2-CZ 4.1Å; I84-F93 HydrophobicContact CB-CZ 4.36Å; I84-F93 HydrophobicContact CD1-CZ 4.06Å; I84-F93 HydrophobicContact CG2-CE2 4.16Å; I84-F93 HydrophobicContact CG2-CZ 3.97Å; W91-F93 HydrophobicContact CD2-CD2 4.48Å; W91-F93 HydrophobicContact CH2-CD2 4.32Å; W91-F93 HydrophobicContact CZ2-CB 3.82Å; W91-F93 HydrophobicContact CZ2-CD2 4.28Å; W91-F93 HydrophobicContact CZ3-CD2 4.44Å; F93-Y97 HydrophobicContact CB-CD1 3.8Å; F93-Y97 HydrophobicContact CB-CG 3.85Å; F93-Y97 HydrophobicContact CG-CD1 4.26Å; F93-Y97 WeakPolarHBondContact O-CB 3.48Å |
| 94 | G | 89.6 | Confident | 87 | Confident | 38 Ų | 38 | 53.7 Ų | 53.7 | 39% | 0.392 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | 68.7 | 179.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | W91 Y92 C98 | W91-G94 PolarHBondContact NE1-O 3.3Å; Y92-G94 VanDerWaalsContact C-N 3.28Å; Y92-G94 PolarHBondContact O-N 3.13Å; G94-C98 PolarHBondContact O-N 3.01Å |
| 95 | K | 89.9 | Confident | 87.4 | Confident | 110 Ų | 110 | 52.1 Ų | 52.1 | 48% | 0.478 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -72 | -38.8 | -173.7 | -171.9 | 177.1 | -179.3 | 178.4 | 0 | 113.3 | Y97 C98 K99 T164 | K95-Y97 PolarHBondContact O-N 3.11Å; K95-C98 WeakPolarHBondContact O-CB 3.41Å; K95-C98 PolarHBondContact O-N 3.45Å; K95-K99 PolarHBondContact O-N 3.47Å; K95-K99 VanDerWaalsContact O-N 3.15Å; K95-T164 HydrophobicContact CB-CG2 4.35Å |
| 96 | A | 91.8 | Very high | 87.8 | Confident | 84 Ų | 84 | 50.6 Ų | 50.6 | 69% | 0.694 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -61 | -46.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | C98 K99 F100 | A96-C98 VanDerWaalsContact C-N 3.34Å; A96-C98 PolarHBondContact O-N 3.3Å; A96-K99 PolarHBondContact O-N 3.41Å; A96-F100 PolarHBondContact O-N 3.49Å; A96-F100 VanDerWaalsContact O-N 3.15Å |
| 97 | Y | 92.7 | Very high | 88.8 | Confident | 57 Ų | 57 | 48.5 Ų | 48.5 | 22% | 0.224 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -70.1 | -30.9 | 177.3 | -154.3 | -89.1 | 0 | 0 | 0 | 112.3 | F77 I81 W91 F93 K95 K99 F100 H101 | F77-Y97 PolarHBondContact O-OH 2.93Å; I81-Y97 HydrophobicContact CB-CE1 4.08Å; I81-Y97 HydrophobicContact CD1-CE1 4.49Å; I81-Y97 HydrophobicContact CG1-CE1 3.65Å; I81-Y97 WeakPolarHBondContact CG1-OH 3.3Å; I81-Y97 HydrophobicContact CG2-CD1 4.29Å; I81-Y97 HydrophobicContact CG2-CE1 3.8Å; W91-Y97 HydrophobicContact CH2-CD1 4Å; W91-Y97 AromaticContact CZ2-CD1 3.94Å; W91-Y97 HydrophobicContact CZ2-CD1 3.94Å; F93-Y97 HydrophobicContact CB-CD1 3.8Å; F93-Y97 HydrophobicContact CB-CG 3.85Å; F93-Y97 HydrophobicContact CG-CD1 4.26Å; F93-Y97 WeakPolarHBondContact O-CB 3.48Å; K95-Y97 PolarHBondContact O-N 3.11Å; Y97-K99 VanDerWaalsContact C-N 3.29Å; Y97-K99 PolarHBondContact O-N 3.32Å; Y97-F100 HydrophobicContact CD2-CD1 4.44Å; Y97-F100 HydrophobicContact CE2-CD1 4.04Å; Y97-F100 PolarHBondContact O-N 3.46Å; Y97-H101 HydrophobicContact CD1-CB 4.22Å; Y97-H101 HydrophobicContact CE1-CB 4.32Å; Y97-H101 WeakPolarHBondContact O-CB 3.37Å; Y97-H101 PolarHBondContact O-N 3.46Å |
| 98 | C | 92.1 | Very high | 89.7 | Confident | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.2 | -40.8 | 174.3 | 172.4 | 0 | 0 | 0 | 0 | 111.5 | W91 G94 K95 A96 N102 T163 T164 C176 | W91-C98 HydrophobicContact CZ2-CB 3.78Å; G94-C98 PolarHBondContact O-N 3.01Å; K95-C98 WeakPolarHBondContact O-CB 3.41Å; K95-C98 PolarHBondContact O-N 3.45Å; A96-C98 VanDerWaalsContact C-N 3.34Å; A96-C98 PolarHBondContact O-N 3.3Å; C98-N102 PolarHBondContact O-N 2.73Å; C98-N102 PolarHBondContact O-ND2 3.23Å; C98-T163 PolarHBondContact SG-O 3.38Å; C98-T164 HydrophobicContact CB-CG2 3.69Å; C98-C176 WeakPolarHBondContact CA-SG 3.45Å; C98-C176 HydrophobicContact CB-CB 3.87Å; C98-C176 WeakPolarHBondContact CB-SG 3.23Å; C98-C176 VanDerWaalsContact SG-CA 3.59Å; C98-C176 WeakPolarHBondContact SG-CB 3.43Å; C98-C176 CovalentContact SG-SG 2.03Å; C98-C176 PolarHBondContact SG-SG 3.45Å |
| 99 | K | 93.3 | Very high | 90.4 | Very high | 57 Ų | 57 | 41.6 Ų | 41.6 | 25% | 0.248 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -63.5 | -49.7 | 173.5 | -66.9 | -177 | 165.8 | -118.1 | 0 | 111.8 | K95 A96 Y97 H101 N102 F103 C159 Y160 S162 | K95-K99 PolarHBondContact O-N 3.47Å; K95-K99 VanDerWaalsContact O-N 3.15Å; A96-K99 PolarHBondContact O-N 3.41Å; Y97-K99 VanDerWaalsContact C-N 3.29Å; Y97-K99 PolarHBondContact O-N 3.32Å; K99-H101 VanDerWaalsContact C-N 3.33Å; K99-H101 PolarHBondContact O-N 3.42Å; K99-N102 PolarHBondContact O-N 3.31Å; K99-F103 VanDerWaalsContact O-CB 3.23Å; K99-F103 WeakPolarHBondContact O-CB 3.18Å; K99-F103 PolarHBondContact O-N 3.03Å; K99-C159 WeakPolarHBondContact CD-O 3.45Å; K99-C159 WeakPolarHBondContact CG-O 3.37Å; K99-C159 PolarHBondContact NZ-O 3.31Å; K99-Y160 PolarHBondContact NZ-O 2.89Å; K99-S162 WeakPolarHBondContact CE-O 3.27Å |
| 100 | F | 93.1 | Very high | 91.4 | Very high | 72 Ų | 72 | 40.2 Ų | 40.2 | 32% | 0.316 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -60.6 | -42 | 178.3 | 179.7 | -101.5 | 0 | 0 | 0 | 112.4 | F77 A96 Y97 N102 F103 F104 | F77-F100 HydrophobicContact CB-CE1 4Å; F77-F100 HydrophobicContact CG-CE1 4.41Å; A96-F100 PolarHBondContact O-N 3.49Å; A96-F100 VanDerWaalsContact O-N 3.15Å; Y97-F100 HydrophobicContact CD2-CD1 4.44Å; Y97-F100 HydrophobicContact CE2-CD1 4.04Å; Y97-F100 PolarHBondContact O-N 3.46Å; F100-N102 VanDerWaalsContact C-N 3.35Å; F100-N102 PolarHBondContact O-N 3.33Å; F100-F103 PolarHBondContact O-N 2.93Å; F100-F104 HydrophobicContact CD1-CB 4.49Å; F100-F104 HydrophobicContact CD2-CB 4.36Å; F100-F104 HydrophobicContact CE1-CB 4.13Å; F100-F104 HydrophobicContact CE1-CG 4.16Å; F100-F104 HydrophobicContact CE2-CB 3.99Å; F100-F104 AromaticContact CE2-CD2 3.67Å; F100-F104 HydrophobicContact CE2-CD2 3.67Å; F100-F104 HydrophobicContact CE2-CE2 4.43Å; F100-F104 AromaticContact CE2-CG 3.96Å; F100-F104 HydrophobicContact CE2-CG 3.96Å; F100-F104 HydrophobicContact CZ-CB 3.87Å; F100-F104 HydrophobicContact CZ-CD1 4.16Å; F100-F104 AromaticContact CZ-CD2 3.61Å; F100-F104 HydrophobicContact CZ-CD2 3.61Å; F100-F104 HydrophobicContact CZ-CE2 4.19Å; F100-F104 AromaticContact CZ-CG 3.6Å; F100-F104 HydrophobicContact CZ-CG 3.6Å; F100-F104 WeakPolarHBondContact O-CB 3.34Å; F100-F104 PolarHBondContact O-N 2.87Å |
| 101 | H | 91.2 | Very high | 92 | Very high | 19 Ų | 19 | 38 Ų | 38 | 9% | 0.088 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.2 | -36.4 | -178.1 | -179.6 | 83.6 | 0 | 0 | 0 | 113.1 | N78 W91 Y97 K99 P105 | N78-H101 PolarHBondContact ND2-CE1 3.32Å; N78-H101 PolarHBondContact ND2-ND1 2.87Å; N78-H101 VanDerWaalsContact ND2-ND1 3.19Å; N78-H101 PolarHBondContact ND2-O 3.31Å; N78-H101 VanDerWaalsContact ND2-O 3.1Å; W91-H101 HydrophobicContact CH2-CB 3.7Å; W91-H101 AromaticContact CH2-CG 3.67Å; W91-H101 HydrophobicContact CZ2-CB 4.43Å; Y97-H101 HydrophobicContact CD1-CB 4.22Å; Y97-H101 HydrophobicContact CE1-CB 4.32Å; Y97-H101 WeakPolarHBondContact O-CB 3.37Å; Y97-H101 PolarHBondContact O-N 3.46Å; K99-H101 VanDerWaalsContact C-N 3.33Å; K99-H101 PolarHBondContact O-N 3.42Å; H101-P105 WeakPolarHBondContact O-CD 3.31Å; H101-P105 VanDerWaalsContact O-CG 3.24Å; H101-P105 WeakPolarHBondContact O-CG 3.47Å |
| 102 | N | 91.6 | Very high | 92.4 | Very high | 41 Ų | 41 | 37.7 Ų | 37.7 | 22% | 0.219 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -81.9 | -33.1 | 175.4 | -74.1 | -79.3 | 0 | 0 | 0 | 112.5 | C98 K99 F100 L158 S162 C176 V178 | C98-N102 PolarHBondContact O-N 2.73Å; C98-N102 PolarHBondContact O-ND2 3.23Å; K99-N102 PolarHBondContact O-N 3.31Å; F100-N102 VanDerWaalsContact C-N 3.35Å; F100-N102 PolarHBondContact O-N 3.33Å; N102-L158 HydrophobicContact CB-CB 4.4Å; N102-L158 WeakPolarHBondContact O-CD1 3.26Å; N102-S162 VanDerWaalsContact CB-OG 3.3Å; N102-S162 WeakPolarHBondContact CB-OG 3.49Å; N102-S162 PolarHBondContact ND2-OG 3.24Å; N102-C176 PolarHBondContact ND2-SG 3.44Å; N102-V178 HydrophobicContact CB-CG2 4.47Å |
| 103 | F | 93.5 | Very high | 92.7 | Very high | 37 Ų | 37 | 32 Ų | 32 | 16% | 0.162 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -70.3 | -52.7 | 179.7 | 166.5 | -99.2 | 0 | 0 | 0 | 112.8 | K99 F100 V106 T107 I152 A155 C159 | K99-F103 VanDerWaalsContact O-CB 3.23Å; K99-F103 WeakPolarHBondContact O-CB 3.18Å; K99-F103 PolarHBondContact O-N 3.03Å; F100-F103 PolarHBondContact O-N 2.93Å; F103-V106 PolarHBondContact O-N 3.46Å; F103-T107 WeakPolarHBondContact CZ-OG1 3.49Å; F103-T107 PolarHBondContact O-N 3.43Å; F103-T107 PolarHBondContact O-OG1 2.95Å; F103-I152 HydrophobicContact CE2-CG2 4.18Å; F103-I152 HydrophobicContact CZ-CB 4.36Å; F103-I152 HydrophobicContact CZ-CG1 4.06Å; F103-I152 HydrophobicContact CZ-CG2 4.11Å; F103-A155 HydrophobicContact CD2-CB 3.4Å; F103-A155 HydrophobicContact CE2-CB 3.57Å; F103-A155 HydrophobicContact CG-CB 4.25Å; F103-C159 HydrophobicContact CB-CB 4.01Å; F103-C159 HydrophobicContact CD2-CB 3.95Å; F103-C159 HydrophobicContact CG-CB 4.24Å |
| 104 | F | 93.8 | Very high | 93.1 | Very high | 21 Ų | 21 | 31 Ų | 31 | 9% | 0.092 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -64 | -38.8 | -164.9 | -169.2 | -105.1 | 0 | 0 | 0 | 114.9 | M74 F77 F100 V106 T107 S108 | M74-F104 HydrophobicContact CB-CE1 4.38Å; F77-F104 HydrophobicContact CD2-CE1 4.27Å; F100-F104 HydrophobicContact CD1-CB 4.49Å; F100-F104 HydrophobicContact CD2-CB 4.36Å; F100-F104 HydrophobicContact CE1-CB 4.13Å; F100-F104 HydrophobicContact CE1-CG 4.16Å; F100-F104 HydrophobicContact CE2-CB 3.99Å; F100-F104 AromaticContact CE2-CD2 3.67Å; F100-F104 HydrophobicContact CE2-CD2 3.67Å; F100-F104 HydrophobicContact CE2-CE2 4.43Å; F100-F104 AromaticContact CE2-CG 3.96Å; F100-F104 HydrophobicContact CE2-CG 3.96Å; F100-F104 HydrophobicContact CZ-CB 3.87Å; F100-F104 HydrophobicContact CZ-CD1 4.16Å; F100-F104 AromaticContact CZ-CD2 3.61Å; F100-F104 HydrophobicContact CZ-CD2 3.61Å; F100-F104 HydrophobicContact CZ-CE2 4.19Å; F100-F104 AromaticContact CZ-CG 3.6Å; F100-F104 HydrophobicContact CZ-CG 3.6Å; F100-F104 WeakPolarHBondContact O-CB 3.34Å; F100-F104 PolarHBondContact O-N 2.87Å; F104-V106 PolarHBondContact O-N 2.98Å; F104-T107 PolarHBondContact O-N 3.48Å; F104-S108 WeakPolarHBondContact O-CB 3.41Å; F104-S108 PolarHBondContact O-N 3.18Å |
| 105 | P | 91.5 | Very high | 93.3 | Very high | 22 Ų | 22 | 29.1 Ų | 29.1 | 14% | 0.143 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -59 | -44.4 | 177 | -28.4 | 38.7 | 0 | 0 | 0 | 112.7 | M74 N78 H101 T107 S108 V109 | M74-P105 HydrophobicContact CE-CB 3.94Å; N78-P105 HydrophobicContact CB-CG 4.02Å; N78-P105 VanDerWaalsContact CG-CG 3.41Å; N78-P105 WeakPolarHBondContact ND2-CG 3.27Å; H101-P105 WeakPolarHBondContact O-CD 3.31Å; H101-P105 VanDerWaalsContact O-CG 3.24Å; H101-P105 WeakPolarHBondContact O-CG 3.47Å; P105-T107 VanDerWaalsContact C-N 3.33Å; P105-T107 PolarHBondContact O-N 3.45Å; P105-S108 PolarHBondContact O-N 2.79Å; P105-V109 WeakPolarHBondContact O-CB 3.47Å; P105-V109 WeakPolarHBondContact O-CG2 3.44Å; P105-V109 PolarHBondContact O-N 2.94Å |
| 106 | V | 92.4 | Very high | 93.4 | Very high | 25 Ų | 25 | 24.3 Ų | 24.3 | 15% | 0.152 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -65.1 | -42.7 | -179.9 | 177.3 | 0 | 0 | 0 | 0 | 110.4 | F103 F104 F110 L154 A155 L158 | F103-V106 PolarHBondContact O-N 3.46Å; F104-V106 PolarHBondContact O-N 2.98Å; V106-F110 VanDerWaalsContact O-CB 3.25Å; V106-F110 WeakPolarHBondContact O-CB 3.33Å; V106-F110 PolarHBondContact O-N 3.03Å; V106-L154 HydrophobicContact CG1-CD2 4.29Å; V106-L154 HydrophobicContact CG1-CG 4.33Å; V106-A155 HydrophobicContact CB-CB 4.07Å; V106-A155 HydrophobicContact CG1-CB 4.13Å; V106-L158 HydrophobicContact CB-CD1 4.15Å; V106-L158 HydrophobicContact CG2-CD1 3.42Å; V106-L158 VanDerWaalsContact CG2-CD1 3.42Å |
| 107 | T | 95 | Very high | 93.5 | Very high | 1 Ų | 1 | 21 Ų | 21 | 1% | 0.006 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -61.4 | -46.1 | 176.2 | -53.4 | 0 | 0 | 0 | 0 | 111.7 | F103 F104 P105 A111 W148 A151 I152 A155 | F103-T107 WeakPolarHBondContact CZ-OG1 3.49Å; F103-T107 PolarHBondContact O-N 3.43Å; F103-T107 PolarHBondContact O-OG1 2.95Å; F104-T107 PolarHBondContact O-N 3.48Å; P105-T107 VanDerWaalsContact C-N 3.33Å; P105-T107 PolarHBondContact O-N 3.45Å; T107-A111 WeakPolarHBondContact O-CB 3.47Å; T107-A111 PolarHBondContact O-N 3.35Å; T107-W148 HydrophobicContact CG2-CE3 3.69Å; T107-W148 HydrophobicContact CG2-CZ3 3.61Å; T107-A151 HydrophobicContact CG2-CB 3.67Å; T107-I152 HydrophobicContact CG2-CG1 4.1Å; T107-A155 VanDerWaalsContact OG1-CB 3.22Å; T107-A155 WeakPolarHBondContact OG1-CB 3.15Å |
| 108 | S | 94.4 | Very high | 93.6 | Very high | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -66.9 | -47.9 | -178.3 | 176.5 | 0 | 0 | 0 | 0 | 112.4 | S70 M74 F104 P105 F110 A111 S112 | S70-S108 PolarHBondContact O-OG 3.5Å; S70-S108 VanDerWaalsContact OG-C 3.29Å; S70-S108 VanDerWaalsContact OG-CA 3.24Å; S70-S108 WeakPolarHBondContact OG-CA 3.42Å; S70-S108 WeakPolarHBondContact OG-CB 3.42Å; S70-S108 PolarHBondContact OG-O 2.99Å; S70-S108 PolarHBondContact OG-OG 2.98Å; M74-S108 VanDerWaalsContact CB-OG 3.29Å; M74-S108 WeakPolarHBondContact CB-OG 3.42Å; F104-S108 WeakPolarHBondContact O-CB 3.41Å; F104-S108 PolarHBondContact O-N 3.18Å; P105-S108 PolarHBondContact O-N 2.79Å; S108-F110 VanDerWaalsContact C-N 3.31Å; S108-F110 PolarHBondContact O-N 3.25Å; S108-A111 PolarHBondContact O-N 3.3Å; S108-A111 VanDerWaalsContact O-N 3.13Å; S108-S112 WeakPolarHBondContact O-CB 3.46Å; S108-S112 PolarHBondContact O-N 3.34Å; S108-S112 PolarHBondContact O-OG 2.9Å; S108-S112 VanDerWaalsContact O-OG 3.11Å |
| 109 | V | 93.4 | Very high | 93.5 | Very high | 8 Ų | 8 | 19.4 Ų | 19.4 | 5% | 0.048 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -63 | -41.1 | 179.4 | -179.4 | 0 | 0 | 0 | 0 | 110.6 | M74 P105 S112 I113 V198 F251 W255 | M74-V109 HydrophobicContact CE-CG2 3.72Å; M74-V109 HydrophobicContact SD-CG2 3.63Å; P105-V109 WeakPolarHBondContact O-CB 3.47Å; P105-V109 WeakPolarHBondContact O-CG2 3.44Å; P105-V109 PolarHBondContact O-N 2.94Å; V109-S112 PolarHBondContact O-N 3.5Å; V109-I113 WeakPolarHBondContact O-CG2 3.37Å; V109-I113 PolarHBondContact O-N 3.3Å; V109-V198 HydrophobicContact CB-CG1 4.14Å; V109-V198 HydrophobicContact CG1-CG1 3.43Å; V109-V198 VanDerWaalsContact CG1-CG1 3.43Å; V109-F251 HydrophobicContact CG1-CE2 4.47Å; V109-F251 HydrophobicContact CG1-CZ 4.23Å; V109-W255 HydrophobicContact CB-CH2 4.35Å; V109-W255 HydrophobicContact CB-CZ2 4.44Å; V109-W255 HydrophobicContact CG1-CH2 4.05Å; V109-W255 HydrophobicContact CG1-CZ2 3.95Å; V109-W255 HydrophobicContact CG1-CZ3 4.35Å; V109-W255 HydrophobicContact CG2-CH2 3.35Å; V109-W255 HydrophobicContact CG2-CZ2 3.5Å; V109-W255 HydrophobicContact CG2-CZ3 4.23Å |
| 110 | F | 95.6 | Very high | 93.4 | Very high | 7 Ų | 7 | 16.7 Ų | 16.7 | 3% | 0.031 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -59 | -48.9 | 173.1 | -172.1 | -74.3 | 0 | 0 | 0 | 110.9 | V106 S108 S112 I113 Y114 I147 L150 A151 L154 V198 | V106-F110 VanDerWaalsContact O-CB 3.25Å; V106-F110 WeakPolarHBondContact O-CB 3.33Å; V106-F110 PolarHBondContact O-N 3.03Å; S108-F110 VanDerWaalsContact C-N 3.31Å; S108-F110 PolarHBondContact O-N 3.25Å; F110-S112 VanDerWaalsContact C-N 3.3Å; F110-S112 PolarHBondContact O-N 3.02Å; F110-I113 WeakPolarHBondContact O-CG2 3.24Å; F110-I113 PolarHBondContact O-N 3.47Å; F110-Y114 AromaticContact CD1-CD2 3.6Å; F110-Y114 HydrophobicContact CD1-CD2 3.6Å; F110-Y114 HydrophobicContact CD1-CE2 4.03Å; F110-Y114 HydrophobicContact CD1-CG 4.29Å; F110-Y114 AromaticContact CD2-CD2 4Å; F110-Y114 HydrophobicContact CD2-CD2 4Å; F110-Y114 AromaticContact CD2-CE2 3.63Å; F110-Y114 HydrophobicContact CD2-CE2 3.63Å; F110-Y114 AromaticContact CE1-CD2 3.47Å; F110-Y114 HydrophobicContact CE1-CD2 3.47Å; F110-Y114 VanDerWaalsContact CE1-CD2 3.47Å; F110-Y114 AromaticContact CE1-CE2 3.68Å; F110-Y114 HydrophobicContact CE1-CE2 3.68Å; F110-Y114 AromaticContact CE1-CG 3.92Å; F110-Y114 HydrophobicContact CE1-CG 3.92Å; F110-Y114 AromaticContact CE2-CD2 3.87Å; F110-Y114 HydrophobicContact CE2-CD2 3.87Å; F110-Y114 AromaticContact CE2-CE2 3.23Å; F110-Y114 HydrophobicContact CE2-CE2 3.23Å; F110-Y114 AromaticContact CE2-CZ 3.79Å; F110-Y114 AromaticContact CG-CD2 3.88Å; F110-Y114 HydrophobicContact CG-CD2 3.88Å; F110-Y114 HydrophobicContact CG-CE2 4.02Å; F110-Y114 AromaticContact CZ-CD2 3.6Å; F110-Y114 HydrophobicContact CZ-CD2 3.6Å; F110-Y114 HydrophobicContact CZ-CE1 4.26Å; F110-Y114 AromaticContact CZ-CE2 3.25Å; F110-Y114 HydrophobicContact CZ-CE2 3.25Å; F110-Y114 HydrophobicContact CZ-CG 4.24Å; F110-Y114 AromaticContact CZ-CZ 3.6Å; F110-Y114 WeakPolarHBondContact O-CB 3.29Å; F110-Y114 VanDerWaalsContact O-CD2 3.32Å; F110-Y114 WeakPolarHBondContact O-CD2 3.11Å; F110-Y114 PolarHBondContact O-N 3.35Å; F110-I147 HydrophobicContact CD1-CG2 4.2Å; F110-I147 HydrophobicContact CE1-CG2 4.3Å; F110-L150 HydrophobicContact CE1-CB 3.9Å; F110-L150 HydrophobicContact CZ-CB 3.86Å; F110-A151 HydrophobicContact CB-CB 3.88Å; F110-A151 HydrophobicContact CD1-CB 3.5Å; F110-A151 VanDerWaalsContact CD1-CB 3.5Å; F110-A151 HydrophobicContact CE1-CB 4.24Å; F110-A151 HydrophobicContact CG-CB 3.84Å; F110-L154 HydrophobicContact CD2-CD2 3.59Å; F110-L154 HydrophobicContact CE2-CD2 3.98Å; F110-V198 HydrophobicContact CB-CG2 4.34Å; F110-V198 HydrophobicContact CD2-CG2 3.89Å |
| 111 | A | 95.8 | Very high | 93.2 | Very high | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -60.4 | -40.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | T107 S108 S115 I147 W148 | T107-A111 WeakPolarHBondContact O-CB 3.47Å; T107-A111 PolarHBondContact O-N 3.35Å; S108-A111 PolarHBondContact O-N 3.3Å; S108-A111 VanDerWaalsContact O-N 3.13Å; A111-S115 VanDerWaalsContact O-CB 3.3Å; A111-S115 WeakPolarHBondContact O-CB 3.32Å; A111-S115 PolarHBondContact O-N 2.68Å; A111-S115 VanDerWaalsContact O-N 3.08Å; A111-S115 PolarHBondContact O-OG 3.49Å; A111-I147 HydrophobicContact CB-CG2 4.17Å; A111-W148 HydrophobicContact CB-CD2 4.33Å; A111-W148 HydrophobicContact CB-CH2 4.41Å; A111-W148 HydrophobicContact CB-CZ2 4.03Å |
| 112 | S | 94.3 | Very high | 93.1 | Very high | 4 Ų | 4 | 15.2 Ų | 15.2 | 3% | 0.028 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -64.9 | -52.1 | 178.7 | -66.2 | 0 | 0 | 0 | 0 | 111.8 | L67 S70 D71 S108 V109 F110 Y114 S115 M116 | L67-S112 VanDerWaalsContact CD1-CB 3.42Å; S70-S112 VanDerWaalsContact CB-OG 3.3Å; S70-S112 WeakPolarHBondContact CB-OG 3.34Å; S70-S112 PolarHBondContact OG-OG 3.14Å; D71-S112 WeakPolarHBondContact OD1-CB 3.39Å; D71-S112 PolarHBondContact OD1-OG 3Å; S108-S112 WeakPolarHBondContact O-CB 3.46Å; S108-S112 PolarHBondContact O-N 3.34Å; S108-S112 PolarHBondContact O-OG 2.9Å; S108-S112 VanDerWaalsContact O-OG 3.11Å; V109-S112 PolarHBondContact O-N 3.5Å; F110-S112 VanDerWaalsContact C-N 3.3Å; F110-S112 PolarHBondContact O-N 3.02Å; S112-Y114 PolarHBondContact O-N 3.2Å; S112-S115 WeakPolarHBondContact O-CB 3.31Å; S112-S115 PolarHBondContact O-N 3.39Å; S112-M116 PolarHBondContact O-N 2.84Å |
| 113 | I | 94.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 15.3 Ų | 15.3 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -69.8 | -36.6 | -175.4 | -165.6 | 55 | 0 | 0 | 0 | 113.1 | V109 F110 S115 M116 T117 V198 P202 M206 F251 | V109-I113 WeakPolarHBondContact O-CG2 3.37Å; V109-I113 PolarHBondContact O-N 3.3Å; F110-I113 WeakPolarHBondContact O-CG2 3.24Å; F110-I113 PolarHBondContact O-N 3.47Å; I113-S115 VanDerWaalsContact C-N 3.33Å; I113-M116 HydrophobicContact CD1-CE 4.47Å; I113-M116 HydrophobicContact CD1-SD 4.29Å; I113-M116 WeakPolarHBondContact O-CB 3.26Å; I113-M116 PolarHBondContact O-N 2.97Å; I113-T117 PolarHBondContact O-N 3.33Å; I113-T117 PolarHBondContact O-OG1 3.04Å; I113-V198 HydrophobicContact CG2-CG1 4.4Å; I113-P202 HydrophobicContact CD1-CB 4.47Å; I113-P202 HydrophobicContact CG1-CB 3.65Å; I113-P202 HydrophobicContact CG1-CG 3.59Å; I113-P202 HydrophobicContact CG2-CG 4.17Å; I113-M206 HydrophobicContact CD1-CE 3.4Å; I113-M206 VanDerWaalsContact CD1-CE 3.4Å; I113-M206 HydrophobicContact CG1-CE 4.3Å; I113-F251 HydrophobicContact CB-CE1 4.36Å; I113-F251 HydrophobicContact CB-CE2 4.45Å; I113-F251 HydrophobicContact CB-CZ 3.93Å; I113-F251 HydrophobicContact CD1-CD1 3.48Å; I113-F251 VanDerWaalsContact CD1-CD1 3.48Å; I113-F251 HydrophobicContact CD1-CD2 4.3Å; I113-F251 HydrophobicContact CD1-CE1 3.28Å; I113-F251 HydrophobicContact CD1-CE2 4.12Å; I113-F251 HydrophobicContact CD1-CG 4.01Å; I113-F251 HydrophobicContact CD1-CZ 3.63Å; I113-F251 HydrophobicContact CG1-CD1 4.44Å; I113-F251 HydrophobicContact CG1-CE1 3.76Å; I113-F251 HydrophobicContact CG1-CZ 3.87Å |
| 114 | Y | 95.6 | Very high | 92.6 | Very high | 47 Ų | 47 | 16.2 Ų | 16.2 | 18% | 0.184 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -73.2 | -27.7 | 175.4 | -82 | -93.2 | 0 | 0 | 0 | 112.1 | F110 S112 T117 A118 L197 L201 | F110-Y114 AromaticContact CD1-CD2 3.6Å; F110-Y114 HydrophobicContact CD1-CD2 3.6Å; F110-Y114 HydrophobicContact CD1-CE2 4.03Å; F110-Y114 HydrophobicContact CD1-CG 4.29Å; F110-Y114 AromaticContact CD2-CD2 4Å; F110-Y114 HydrophobicContact CD2-CD2 4Å; F110-Y114 AromaticContact CD2-CE2 3.63Å; F110-Y114 HydrophobicContact CD2-CE2 3.63Å; F110-Y114 AromaticContact CE1-CD2 3.47Å; F110-Y114 HydrophobicContact CE1-CD2 3.47Å; F110-Y114 VanDerWaalsContact CE1-CD2 3.47Å; F110-Y114 AromaticContact CE1-CE2 3.68Å; F110-Y114 HydrophobicContact CE1-CE2 3.68Å; F110-Y114 AromaticContact CE1-CG 3.92Å; F110-Y114 HydrophobicContact CE1-CG 3.92Å; F110-Y114 AromaticContact CE2-CD2 3.87Å; F110-Y114 HydrophobicContact CE2-CD2 3.87Å; F110-Y114 AromaticContact CE2-CE2 3.23Å; F110-Y114 HydrophobicContact CE2-CE2 3.23Å; F110-Y114 AromaticContact CE2-CZ 3.79Å; F110-Y114 AromaticContact CG-CD2 3.88Å; F110-Y114 HydrophobicContact CG-CD2 3.88Å; F110-Y114 HydrophobicContact CG-CE2 4.02Å; F110-Y114 AromaticContact CZ-CD2 3.6Å; F110-Y114 HydrophobicContact CZ-CD2 3.6Å; F110-Y114 HydrophobicContact CZ-CE1 4.26Å; F110-Y114 AromaticContact CZ-CE2 3.25Å; F110-Y114 HydrophobicContact CZ-CE2 3.25Å; F110-Y114 HydrophobicContact CZ-CG 4.24Å; F110-Y114 AromaticContact CZ-CZ 3.6Å; F110-Y114 WeakPolarHBondContact O-CB 3.29Å; F110-Y114 VanDerWaalsContact O-CD2 3.32Å; F110-Y114 WeakPolarHBondContact O-CD2 3.11Å; F110-Y114 PolarHBondContact O-N 3.35Å; S112-Y114 PolarHBondContact O-N 3.2Å; Y114-T117 PolarHBondContact O-N 3.38Å; Y114-A118 WeakPolarHBondContact O-CB 3.16Å; Y114-A118 PolarHBondContact O-N 3.23Å; Y114-L197 WeakPolarHBondContact CE2-O 3.41Å; Y114-L197 PolarHBondContact OH-O 3.49Å; Y114-L201 HydrophobicContact CE1-CD2 4.46Å |
| 115 | S | 94.4 | Very high | 92.2 | Very high | 0 Ų | 0 | 18.2 Ų | 18.2 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -65.3 | -43.8 | 168.7 | -60.6 | 0 | 0 | 0 | 0 | 111.3 | N66 A111 S112 I113 T117 A118 I119 | N66-S115 PolarHBondContact ND2-OG 3.48Å; A111-S115 VanDerWaalsContact O-CB 3.3Å; A111-S115 WeakPolarHBondContact O-CB 3.32Å; A111-S115 PolarHBondContact O-N 2.68Å; A111-S115 VanDerWaalsContact O-N 3.08Å; A111-S115 PolarHBondContact O-OG 3.49Å; S112-S115 WeakPolarHBondContact O-CB 3.31Å; S112-S115 PolarHBondContact O-N 3.39Å; I113-S115 VanDerWaalsContact C-N 3.33Å; S115-T117 VanDerWaalsContact C-N 3.3Å; S115-T117 PolarHBondContact O-N 3Å; S115-A118 PolarHBondContact O-N 2.68Å; S115-I119 WeakPolarHBondContact O-CB 3.27Å; S115-I119 WeakPolarHBondContact O-CD1 3.32Å; S115-I119 WeakPolarHBondContact O-CG1 3.35Å; S115-I119 PolarHBondContact O-N 2.96Å |
| 116 | M | 91.8 | Very high | 91.9 | Very high | 9 Ų | 9 | 18.3 Ų | 18.3 | 4% | 0.044 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -61.1 | -39.3 | 173.3 | -70.2 | 177.5 | 53.1 | 0 | 0 | 112.3 | L67 S112 I113 I119 A120 M206 V247 V248 F251 | L67-M116 HydrophobicContact CD1-CG 4.29Å; L67-M116 HydrophobicContact CD2-CG 4.08Å; S112-M116 PolarHBondContact O-N 2.84Å; I113-M116 HydrophobicContact CD1-CE 4.47Å; I113-M116 HydrophobicContact CD1-SD 4.29Å; I113-M116 WeakPolarHBondContact O-CB 3.26Å; I113-M116 PolarHBondContact O-N 2.97Å; M116-I119 WeakPolarHBondContact O-CB 3.32Å; M116-I119 PolarHBondContact O-N 3.36Å; M116-A120 PolarHBondContact O-N 3.48Å; M116-M206 HydrophobicContact CB-SD 3.91Å; M116-M206 HydrophobicContact CE-SD 4.39Å; M116-V247 HydrophobicContact CE-CB 4.3Å; M116-V247 HydrophobicContact CE-CG1 3.47Å; M116-V247 VanDerWaalsContact CE-CG1 3.47Å; M116-V247 HydrophobicContact SD-CG1 4.03Å; M116-V248 HydrophobicContact CE-CG2 3.99Å; M116-F251 HydrophobicContact CE-CB 4.13Å; M116-F251 HydrophobicContact SD-CD2 4.42Å |
| 117 | T | 94.3 | Very high | 91.5 | Very high | 13 Ų | 13 | 18.4 Ų | 18.4 | 8% | 0.08 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -65.2 | -45.7 | 176.3 | -55.1 | 0 | 0 | 0 | 0 | 111.3 | I113 Y114 S115 I119 A120 V121 P202 V205 M206 | I113-T117 PolarHBondContact O-N 3.33Å; I113-T117 PolarHBondContact O-OG1 3.04Å; Y114-T117 PolarHBondContact O-N 3.38Å; S115-T117 VanDerWaalsContact C-N 3.3Å; S115-T117 PolarHBondContact O-N 3Å; T117-I119 VanDerWaalsContact C-N 3.28Å; T117-I119 PolarHBondContact O-N 3.44Å; T117-A120 VanDerWaalsContact O-CB 3.29Å; T117-A120 WeakPolarHBondContact O-CB 3.43Å; T117-A120 PolarHBondContact O-N 3.44Å; T117-A120 VanDerWaalsContact O-N 3.08Å; T117-V121 WeakPolarHBondContact O-CG2 3.32Å; T117-V121 PolarHBondContact O-N 3.42Å; T117-P202 WeakPolarHBondContact OG1-CB 3.29Å; T117-V205 HydrophobicContact CG2-CB 4.09Å; T117-V205 HydrophobicContact CG2-CG1 3.6Å; T117-M206 HydrophobicContact CG2-CG 4.34Å |
| 118 | A | 93.2 | Very high | 91 | Very high | 16 Ų | 16 | 20.4 Ų | 20.4 | 13% | 0.132 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -62.6 | -37.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | F63 Y114 S115 A120 V121 D122 | F63-A118 HydrophobicContact CD1-CB 3.95Å; F63-A118 HydrophobicContact CD2-CB 4.29Å; F63-A118 HydrophobicContact CE1-CB 3.54Å; F63-A118 HydrophobicContact CE2-CB 3.89Å; F63-A118 HydrophobicContact CG-CB 4.32Å; F63-A118 HydrophobicContact CZ-CB 3.5Å; Y114-A118 WeakPolarHBondContact O-CB 3.16Å; Y114-A118 PolarHBondContact O-N 3.23Å; S115-A118 PolarHBondContact O-N 2.68Å; A118-A120 VanDerWaalsContact C-N 3.34Å; A118-V121 PolarHBondContact O-N 3.23Å; A118-D122 PolarHBondContact O-N 2.8Å |
| 119 | I | 91.1 | Very high | 90.5 | Very high | 9 Ų | 9 | 23.5 Ų | 23.5 | 5% | 0.046 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -60.9 | -42.1 | 172.3 | -76.1 | 167.9 | 0 | 0 | 0 | 111.3 | T60 F63 L64 S115 M116 T117 D122 R123 M244 | T60-I119 HydrophobicContact CG2-CB 4.49Å; T60-I119 HydrophobicContact CG2-CG1 4.07Å; T60-I119 HydrophobicContact CG2-CG2 3.99Å; F63-I119 HydrophobicContact CB-CD1 3.55Å; F63-I119 HydrophobicContact CB-CG1 3.34Å; F63-I119 HydrophobicContact CD2-CG1 4.14Å; F63-I119 HydrophobicContact CG-CG1 4.01Å; L64-I119 HydrophobicContact CD2-CD1 3.7Å; L64-I119 HydrophobicContact CG-CD1 4.12Å; S115-I119 WeakPolarHBondContact O-CB 3.27Å; S115-I119 WeakPolarHBondContact O-CD1 3.32Å; S115-I119 WeakPolarHBondContact O-CG1 3.35Å; S115-I119 PolarHBondContact O-N 2.96Å; M116-I119 WeakPolarHBondContact O-CB 3.32Å; M116-I119 PolarHBondContact O-N 3.36Å; T117-I119 VanDerWaalsContact C-N 3.28Å; T117-I119 PolarHBondContact O-N 3.44Å; I119-D122 PolarHBondContact O-N 3.37Å; I119-R123 WeakPolarHBondContact O-CG 3.24Å; I119-R123 PolarHBondContact O-N 2.91Å; I119-R123 VanDerWaalsContact O-N 3.16Å; I119-M244 HydrophobicContact CB-CE 4.33Å; I119-M244 HydrophobicContact CG2-CE 2.92Å |
| 120 | A | 90.2 | Very high | 89.9 | Confident | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -61.7 | -46.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | M116 T117 A118 R123 Y124 M206 Y210 | M116-A120 PolarHBondContact O-N 3.48Å; T117-A120 VanDerWaalsContact O-CB 3.29Å; T117-A120 WeakPolarHBondContact O-CB 3.43Å; T117-A120 PolarHBondContact O-N 3.44Å; T117-A120 VanDerWaalsContact O-N 3.08Å; A118-A120 VanDerWaalsContact C-N 3.34Å; A120-R123 PolarHBondContact O-N 3.3Å; A120-Y124 PolarHBondContact O-N 3.22Å; A120-M206 HydrophobicContact CB-CG 4.05Å; A120-Y210 VanDerWaalsContact CA-OH 3.3Å; A120-Y210 WeakPolarHBondContact CA-OH 3.23Å; A120-Y210 HydrophobicContact CB-CD2 4.41Å; A120-Y210 HydrophobicContact CB-CE1 4.09Å; A120-Y210 HydrophobicContact CB-CE2 3.53Å; A120-Y210 VanDerWaalsContact CB-OH 3.22Å; A120-Y210 WeakPolarHBondContact CB-OH 3.32Å |
| 121 | V | 90.3 | Very high | 89.2 | Confident | 57 Ų | 57 | 35.8 Ų | 35.8 | 35% | 0.345 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -64.6 | -42.3 | 178.3 | 175.1 | 0 | 0 | 0 | 0 | 111.7 | T117 A118 R123 Y124 M125 T209 | T117-V121 WeakPolarHBondContact O-CG2 3.32Å; T117-V121 PolarHBondContact O-N 3.42Å; A118-V121 PolarHBondContact O-N 3.23Å; V121-R123 VanDerWaalsContact C-N 3.26Å; V121-R123 PolarHBondContact O-N 3.46Å; V121-Y124 WeakPolarHBondContact O-CB 3.46Å; V121-Y124 PolarHBondContact O-N 2.99Å; V121-M125 HydrophobicContact CG1-CG 4.45Å; V121-M125 WeakPolarHBondContact O-CG 3.32Å; V121-M125 PolarHBondContact O-N 2.62Å; V121-T209 HydrophobicContact CG2-CG2 4.5Å |
| 122 | D | 88.3 | Confident | 88.4 | Confident | 3 Ų | 3 | 41.5 Ų | 41.5 | 2% | 0.016 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -59.9 | -37.3 | 174.9 | 169.2 | 63.6 | 0 | 0 | 0 | 111.7 | T60 A118 I119 A126 R134 | T60-D122 PolarHBondContact OG1-OD2 3.11Å; A118-D122 PolarHBondContact O-N 2.8Å; I119-D122 PolarHBondContact O-N 3.37Å; D122-A126 VanDerWaalsContact O-CB 3.3Å; D122-A126 WeakPolarHBondContact O-CB 3.36Å; D122-A126 PolarHBondContact O-N 3.36Å; D122-R134 IonicContact OD1-CZ 3.04Å; D122-R134 IonicContact OD1-NE 3.78Å; D122-R134 IonicContact OD1-NH2 3.83Å; D122-R134 PolarHBondContact OD1-NH2 3.36Å; D122-R134 IonicContact OD2-NH2 3.19Å; D122-R134 PolarHBondContact OD2-NH2 3.18Å |
| 123 | R | 86 | Confident | 87.5 | Confident | 43 Ų | 43 | 47.2 Ų | 47.2 | 16% | 0.162 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -72 | -42.4 | 175.8 | -71.8 | -73 | 161.4 | -92.5 | 1 | 113.1 | T60 I119 A120 V121 M125 A126 I127 M244 | T60-R123 VanDerWaalsContact CB-NH2 3.33Å; T60-R123 VanDerWaalsContact CG2-NH2 3.33Å; T60-R123 PolarHBondContact OG1-NH1 3.02Å; T60-R123 PolarHBondContact OG1-NH2 2.93Å; I119-R123 WeakPolarHBondContact O-CG 3.24Å; I119-R123 PolarHBondContact O-N 2.91Å; I119-R123 VanDerWaalsContact O-N 3.16Å; A120-R123 PolarHBondContact O-N 3.3Å; V121-R123 VanDerWaalsContact C-N 3.26Å; V121-R123 PolarHBondContact O-N 3.46Å; R123-M125 VanDerWaalsContact C-N 3.3Å; R123-M125 PolarHBondContact O-N 2.97Å; R123-A126 PolarHBondContact O-N 3.05Å; R123-I127 WeakPolarHBondContact O-CB 3.48Å; R123-I127 VanDerWaalsContact O-CG1 3.3Å; R123-I127 WeakPolarHBondContact O-CG1 3.22Å; R123-I127 PolarHBondContact O-N 3.38Å; R123-M244 HydrophobicContact CB-CE 4.38Å; R123-M244 HydrophobicContact CG-CE 3.31Å; R123-M244 HydrophobicContact CG-SD 3.54Å; R123-M244 VanDerWaalsContact CG-SD 3.54Å |
| 124 | Y | 87.7 | Confident | 86.8 | Confident | 56 Ų | 56 | 53.6 Ų | 53.6 | 22% | 0.22 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -52.9 | -52.3 | 172.5 | 171 | -91.2 | 0 | 0 | 0 | 110.3 | A120 V121 A126 I127 I128 I212 V213 | A120-Y124 PolarHBondContact O-N 3.22Å; V121-Y124 WeakPolarHBondContact O-CB 3.46Å; V121-Y124 PolarHBondContact O-N 2.99Å; Y124-A126 PolarHBondContact O-N 2.87Å; Y124-I127 PolarHBondContact O-N 3.37Å; Y124-I128 HydrophobicContact CD2-CG1 3.81Å; Y124-I128 HydrophobicContact CE2-CB 4.27Å; Y124-I128 HydrophobicContact CE2-CG1 3.69Å; Y124-I128 HydrophobicContact CE2-CG2 4.43Å; Y124-I128 HydrophobicContact CG-CG1 4.42Å; Y124-I128 WeakPolarHBondContact O-CB 3.3Å; Y124-I128 WeakPolarHBondContact O-CG1 3.22Å; Y124-I128 PolarHBondContact O-N 2.82Å; Y124-I212 HydrophobicContact CD2-CG2 4.45Å; Y124-I212 HydrophobicContact CE2-CB 4.3Å; Y124-I212 HydrophobicContact CE2-CD1 4.18Å; Y124-I212 HydrophobicContact CE2-CG2 3.87Å; Y124-V213 HydrophobicContact CD2-CG2 4.11Å |
| 125 | M | 87.1 | Confident | 86 | Confident | 63 Ų | 63 | 54.4 Ų | 54.4 | 31% | 0.31 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -60.3 | -43.5 | 178.6 | -69.9 | -60.1 | -66.1 | 0 | 0 | 112.3 | V121 R123 I127 H129 K132 | V121-M125 HydrophobicContact CG1-CG 4.45Å; V121-M125 WeakPolarHBondContact O-CG 3.32Å; V121-M125 PolarHBondContact O-N 2.62Å; R123-M125 VanDerWaalsContact C-N 3.3Å; R123-M125 PolarHBondContact O-N 2.97Å; M125-I127 VanDerWaalsContact C-N 3.28Å; M125-I127 PolarHBondContact O-N 3.21Å; M125-H129 HydrophobicContact CE-CB 4.3Å; M125-H129 CarbonylContact O-C 3.55Å; M125-H129 WeakPolarHBondContact O-CA 3.36Å; M125-H129 PolarHBondContact O-N 2.88Å; M125-K132 HydrophobicContact CE-CB 4.17Å; M125-K132 HydrophobicContact CE-CD 4.04Å |
| 126 | A | 84.4 | Confident | 85.6 | Confident | 24 Ų | 24 | 57.6 Ų | 57.6 | 20% | 0.198 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -68.1 | -23.4 | -179 | 0 | 0 | 0 | 0 | 0 | 114.5 | D122 R123 Y124 | D122-A126 VanDerWaalsContact O-CB 3.3Å; D122-A126 WeakPolarHBondContact O-CB 3.36Å; D122-A126 PolarHBondContact O-N 3.36Å; R123-A126 PolarHBondContact O-N 3.05Å; Y124-A126 PolarHBondContact O-N 2.87Å |
| 127 | I | 83.5 | Confident | 85.2 | Confident | 27 Ų | 27 | 59.3 Ų | 59.3 | 14% | 0.138 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -98.3 | -45.8 | -176.7 | -65.5 | 166.8 | 0 | 0 | 0 | 110.7 | R123 Y124 M125 V213 L217 V241 | R123-I127 WeakPolarHBondContact O-CB 3.48Å; R123-I127 VanDerWaalsContact O-CG1 3.3Å; R123-I127 WeakPolarHBondContact O-CG1 3.22Å; R123-I127 PolarHBondContact O-N 3.38Å; Y124-I127 PolarHBondContact O-N 3.37Å; M125-I127 VanDerWaalsContact C-N 3.28Å; M125-I127 PolarHBondContact O-N 3.21Å; I127-V213 HydrophobicContact CD1-CG1 3.48Å; I127-V213 VanDerWaalsContact CD1-CG1 3.48Å; I127-L217 HydrophobicContact CD1-CD1 4.22Å; I127-L217 HydrophobicContact CG2-CD2 4.19Å; I127-L217 HydrophobicContact CG2-CG 4.29Å; I127-V241 HydrophobicContact CD1-CG2 3.82Å |
| 128 | I | 84.6 | Confident | 85 | Confident | 42 Ų | 42 | 67.3 Ų | 67.3 | 22% | 0.215 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -86 | -33.8 | -174.2 | -55 | -57.7 | 0 | 0 | 0 | 112 | Y124 P130 I212 T216 | Y124-I128 HydrophobicContact CD2-CG1 3.81Å; Y124-I128 HydrophobicContact CE2-CB 4.27Å; Y124-I128 HydrophobicContact CE2-CG1 3.69Å; Y124-I128 HydrophobicContact CE2-CG2 4.43Å; Y124-I128 HydrophobicContact CG-CG1 4.42Å; Y124-I128 WeakPolarHBondContact O-CB 3.3Å; Y124-I128 WeakPolarHBondContact O-CG1 3.22Å; Y124-I128 PolarHBondContact O-N 2.82Å; I128-P130 VanDerWaalsContact C-CD 3.46Å; I128-P130 WeakPolarHBondContact O-CD 3.06Å; I128-I212 HydrophobicContact CD1-CG2 4.22Å; I128-I212 HydrophobicContact CG1-CG2 4.48Å; I128-T216 HydrophobicContact CD1-CG2 3.8Å; I128-T216 VanDerWaalsContact CD1-OG1 3.24Å; I128-T216 WeakPolarHBondContact CD1-OG1 3.37Å |
| 129 | H | 83.7 | Confident | 84.9 | Confident | 65 Ų | 65 | 70.1 Ų | 70.1 | 30% | 0.301 | 37% | 0.369 | S | S | . | . | trans | -126.7 | 64.8 | -176.5 | -62.9 | -48.5 | 0 | 0 | 0 | 112.2 | M125 L131 K132 | M125-H129 HydrophobicContact CE-CB 4.3Å; M125-H129 CarbonylContact O-C 3.55Å; M125-H129 WeakPolarHBondContact O-CA 3.36Å; M125-H129 PolarHBondContact O-N 2.88Å; H129-L131 PolarHBondContact O-N 3.26Å; H129-L131 VanDerWaalsContact O-N 3.13Å; H129-K132 HydrophobicContact CB-CB 4.15Å; H129-K132 HydrophobicContact CB-CD 4.04Å; H129-K132 HydrophobicContact CB-CG 4.11Å; H129-K132 PolarHBondContact O-N 3.21Å; H129-K132 VanDerWaalsContact O-N 3.09Å | ||
| 130 | P | 82 | Confident | 84.8 | Confident | 99 Ų | 99 | 69.7 Ų | 69.7 | 64% | 0.643 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -23 | -173.8 | 26.3 | -35.6 | 0 | 0 | 0 | 114.4 | I128 | I128-P130 VanDerWaalsContact C-CD 3.46Å; I128-P130 WeakPolarHBondContact O-CD 3.06Å |
| 131 | L | 79.6 | Confident | 84.8 | Confident | 174 Ų | 174 | 73.2 Ų | 73.2 | 91% | 0.911 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.3 | -12.4 | 179.6 | -61.2 | 176 | 0 | 0 | 0 | 113.4 | H129 | H129-L131 PolarHBondContact O-N 3.26Å; H129-L131 VanDerWaalsContact O-N 3.13Å |
| 132 | K | 80.4 | Confident | 85.1 | Confident | 121 Ų | 121 | 72.1 Ų | 72.1 | 53% | 0.526 | 39% | 0.389 | S | S | . | . | S | Bend | trans | -79.6 | 138.5 | 176 | -73.5 | -171.1 | 177.2 | 179.5 | 0 | 109.7 | M125 H129 R134 | M125-K132 HydrophobicContact CE-CB 4.17Å; M125-K132 HydrophobicContact CE-CD 4.04Å; H129-K132 HydrophobicContact CB-CB 4.15Å; H129-K132 HydrophobicContact CB-CD 4.04Å; H129-K132 HydrophobicContact CB-CG 4.11Å; H129-K132 PolarHBondContact O-N 3.21Å; H129-K132 VanDerWaalsContact O-N 3.09Å; K132-R134 PolarHBondContact O-N 3.24Å |
| 133 | P | 75.2 | Confident | 85.4 | Confident | 123 Ų | 123 | 74.3 Ų | 74.3 | 80% | 0.799 | 40% | 0.403 | S | S | * | . | P | Polyproline II helix | trans | -59.8 | 133.5 | 179 | 22.2 | -30.7 | 0 | 0 | 0 | 110.6 | ||
| 134 | R | 79.6 | Confident | 85.8 | Confident | 134 Ų | 134 | 73.5 Ų | 73.5 | 51% | 0.506 | 40% | 0.401 | S | S | . | . | P | Polyproline II helix | trans | -73.1 | 160.1 | 178 | -59.8 | -173.5 | 73.1 | 161.6 | 2.9 | 110.6 | D122 K132 S136 | D122-R134 IonicContact OD1-CZ 3.04Å; D122-R134 IonicContact OD1-NE 3.78Å; D122-R134 IonicContact OD1-NH2 3.83Å; D122-R134 PolarHBondContact OD1-NH2 3.36Å; D122-R134 IonicContact OD2-NH2 3.19Å; D122-R134 PolarHBondContact OD2-NH2 3.18Å; K132-R134 PolarHBondContact O-N 3.24Å; R134-S136 PolarHBondContact O-N 3.14Å |
| 135 | L | 79.1 | Confident | 86.2 | Confident | 65 Ų | 65 | 74.9 Ų | 74.9 | 34% | 0.34 | 42% | 0.415 | S | S | . | . | P | Polyproline II helix | trans | -53.2 | 126.8 | 172.8 | -65.7 | 172.6 | 0 | 0 | 0 | 109.9 | V59 V139 | V59-L135 HydrophobicContact CG1-CB 4.09Å; V59-L135 WeakPolarHBondContact CG2-O 3.35Å; L135-V139 HydrophobicContact CD2-CG1 3.83Å |
| 136 | S | 85.4 | Confident | 86.7 | Confident | 66 Ų | 66 | 75.4 Ų | 75.4 | 46% | 0.462 | 43% | 0.425 | S | S | . | . | P | Polyproline II helix | trans | -73.3 | 158.3 | 173.2 | 178.1 | 0 | 0 | 0 | 0 | 110.5 | R134 K138 V139 T140 | R134-S136 PolarHBondContact O-N 3.14Å; S136-K138 PolarHBondContact O-N 3.04Å; S136-V139 PolarHBondContact O-N 2.65Å; S136-V139 VanDerWaalsContact O-N 3.15Å; S136-T140 PolarHBondContact O-N 3.01Å; S136-T140 PolarHBondContact O-OG1 3.24Å |
| 137 | A | 83.9 | Confident | 87.2 | Confident | 45 Ų | 45 | 74.9 Ų | 74.9 | 37% | 0.372 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -55.6 | -39.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | T140 T141 | A137-T140 WeakPolarHBondContact O-CB 3.45Å; A137-T140 PolarHBondContact O-N 3.09Å; A137-T141 PolarHBondContact O-N 3.42Å; A137-T141 PolarHBondContact O-OG1 2.96Å |
| 138 | K | 89.2 | Confident | 87.9 | Confident | 181 Ų | 181 | 76 Ų | 76 | 79% | 0.787 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -62.6 | -45.1 | 176.8 | -65.5 | -175.8 | 179.9 | -179.2 | 0 | 112.2 | S136 T140 T141 G142 | S136-K138 PolarHBondContact O-N 3.04Å; K138-T140 VanDerWaalsContact C-N 3.33Å; K138-T141 PolarHBondContact O-N 2.89Å; K138-G142 PolarHBondContact O-N 3.21Å |
| 139 | V | 90.8 | Very high | 88.5 | Confident | 75 Ų | 75 | 77 Ų | 77 | 46% | 0.455 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -64.7 | -41.5 | 177.6 | 179.7 | 0 | 0 | 0 | 0 | 110.1 | L135 S136 T141 G142 V143 | L135-V139 HydrophobicContact CD2-CG1 3.83Å; S136-V139 PolarHBondContact O-N 2.65Å; S136-V139 VanDerWaalsContact O-N 3.15Å; V139-T141 PolarHBondContact O-N 2.89Å; V139-G142 WeakPolarHBondContact O-CA 3.41Å; V139-G142 PolarHBondContact O-N 2.74Å; V139-G142 VanDerWaalsContact O-N 3.14Å; V139-V143 HydrophobicContact CG1-CG2 4.43Å; V139-V143 WeakPolarHBondContact O-CG2 3.3Å; V139-V143 PolarHBondContact O-N 2.9Å |
| 140 | T | 90.3 | Very high | 89.1 | Confident | 0 Ų | 0 | 78.8 Ų | 78.8 | 0% | 0 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -59.4 | -47.1 | 177.7 | -53.5 | 0 | 0 | 0 | 0 | 111.6 | V59 F63 S136 A137 K138 G142 V143 I144 | V59-T140 HydrophobicContact CG1-CG2 4.2Å; V59-T140 WeakPolarHBondContact CG1-OG1 3.42Å; F63-T140 HydrophobicContact CD2-CG2 4.17Å; F63-T140 HydrophobicContact CE1-CG2 4.22Å; F63-T140 HydrophobicContact CE2-CG2 3.72Å; F63-T140 HydrophobicContact CZ-CG2 3.74Å; S136-T140 PolarHBondContact O-N 3.01Å; S136-T140 PolarHBondContact O-OG1 3.24Å; A137-T140 WeakPolarHBondContact O-CB 3.45Å; A137-T140 PolarHBondContact O-N 3.09Å; K138-T140 VanDerWaalsContact C-N 3.33Å; T140-G142 VanDerWaalsContact C-N 3.33Å; T140-G142 PolarHBondContact O-N 2.93Å; T140-V143 PolarHBondContact O-N 3.22Å; T140-I144 HydrophobicContact CG2-CD1 4.32Å; T140-I144 WeakPolarHBondContact O-CG1 3.13Å; T140-I144 PolarHBondContact O-N 3.48Å |
| 141 | T | 90.6 | Very high | 89.8 | Confident | 74 Ų | 74 | 74 Ų | 74 | 45% | 0.454 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -61.1 | -42.2 | 174.1 | -57.6 | 0 | 0 | 0 | 0 | 111.5 | A137 K138 V139 V143 I144 V145 | A137-T141 PolarHBondContact O-N 3.42Å; A137-T141 PolarHBondContact O-OG1 2.96Å; K138-T141 PolarHBondContact O-N 2.89Å; V139-T141 PolarHBondContact O-N 2.89Å; T141-V143 PolarHBondContact O-N 3.08Å; T141-I144 PolarHBondContact O-N 3.46Å; T141-V145 WeakPolarHBondContact O-CG2 3.38Å; T141-V145 PolarHBondContact O-N 2.71Å |
| 142 | G | 94.8 | Very high | 90.5 | Very high | 35 Ų | 35 | 69.5 Ų | 69.5 | 36% | 0.361 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -57.8 | -45.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | K138 V139 T140 I144 V145 C146 | K138-G142 PolarHBondContact O-N 3.21Å; V139-G142 WeakPolarHBondContact O-CA 3.41Å; V139-G142 PolarHBondContact O-N 2.74Å; V139-G142 VanDerWaalsContact O-N 3.14Å; T140-G142 VanDerWaalsContact C-N 3.33Å; T140-G142 PolarHBondContact O-N 2.93Å; G142-I144 PolarHBondContact O-N 2.91Å; G142-V145 PolarHBondContact O-N 3.25Å; G142-C146 PolarHBondContact O-N 3.01Å; G142-C146 PolarHBondContact O-SG 2.89Å |
| 143 | V | 95.1 | Very high | 91.3 | Very high | 49 Ų | 49 | 68.7 Ų | 68.7 | 30% | 0.297 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -60.8 | -43.5 | 175.8 | 173.2 | 0 | 0 | 0 | 0 | 111.2 | F63 V139 T140 T141 V145 C146 I147 | F63-V143 HydrophobicContact CE1-CB 4.43Å; F63-V143 HydrophobicContact CE1-CG1 3.92Å; F63-V143 HydrophobicContact CZ-CB 4.36Å; F63-V143 HydrophobicContact CZ-CG1 4.03Å; V139-V143 HydrophobicContact CG1-CG2 4.43Å; V139-V143 WeakPolarHBondContact O-CG2 3.3Å; V139-V143 PolarHBondContact O-N 2.9Å; T140-V143 PolarHBondContact O-N 3.22Å; T141-V143 PolarHBondContact O-N 3.08Å; V143-V145 PolarHBondContact O-N 2.96Å; V143-C146 PolarHBondContact O-N 3.16Å; V143-I147 HydrophobicContact CG1-CD1 3.86Å; V143-I147 HydrophobicContact CG1-CG1 4.38Å; V143-I147 VanDerWaalsContact O-CG1 3.27Å; V143-I147 WeakPolarHBondContact O-CG1 3.35Å; V143-I147 PolarHBondContact O-N 3Å |
| 144 | I | 95.1 | Very high | 92.2 | Very high | 25 Ų | 25 | 63.9 Ų | 63.9 | 13% | 0.128 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -60.5 | -46.5 | 177 | -68.9 | 165.7 | 0 | 0 | 0 | 110.7 | F63 N66 T140 T141 G142 C146 I147 W148 | F63-I144 HydrophobicContact CD1-CD1 4.38Å; F63-I144 HydrophobicContact CD1-CG1 4.02Å; F63-I144 HydrophobicContact CE1-CG1 3.93Å; N66-I144 HydrophobicContact CB-CD1 4.22Å; N66-I144 HydrophobicContact CB-CG1 4.4Å; N66-I144 HydrophobicContact CB-CG2 4.39Å; N66-I144 WeakPolarHBondContact OD1-CG2 3.5Å; T140-I144 HydrophobicContact CG2-CD1 4.32Å; T140-I144 WeakPolarHBondContact O-CG1 3.13Å; T140-I144 PolarHBondContact O-N 3.48Å; T141-I144 PolarHBondContact O-N 3.46Å; G142-I144 PolarHBondContact O-N 2.91Å; I144-C146 VanDerWaalsContact C-N 3.34Å; I144-C146 PolarHBondContact O-N 3.27Å; I144-I147 WeakPolarHBondContact O-CB 3.31Å; I144-I147 PolarHBondContact O-N 3.38Å; I144-W148 VanDerWaalsContact O-CD1 3.27Å; I144-W148 PolarHBondContact O-N 2.91Å |
| 145 | V | 95.8 | Very high | 92.9 | Very high | 85 Ų | 85 | 57.5 Ų | 57.5 | 52% | 0.515 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -60 | -44.9 | 176.9 | 172.1 | 0 | 0 | 0 | 0 | 111 | T141 G142 V143 I147 W148 S149 | T141-V145 WeakPolarHBondContact O-CG2 3.38Å; T141-V145 PolarHBondContact O-N 2.71Å; G142-V145 PolarHBondContact O-N 3.25Å; V143-V145 PolarHBondContact O-N 2.96Å; V145-I147 VanDerWaalsContact C-N 3.34Å; V145-I147 PolarHBondContact O-N 3.09Å; V145-W148 PolarHBondContact O-N 3.45Å; V145-S149 PolarHBondContact O-N 2.94Å; V145-S149 PolarHBondContact O-OG 3.33Å; V145-S149 VanDerWaalsContact O-OG 3.11Å |
| 146 | C | 96.8 | Very high | 93.6 | Very high | 75 Ų | 75 | 60.1 Ų | 60.1 | 51% | 0.507 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -60 | -42.8 | 176 | -68.8 | 0 | 0 | 0 | 0 | 112.4 | G142 V143 I144 W148 S149 L150 | G142-C146 PolarHBondContact O-N 3.01Å; G142-C146 PolarHBondContact O-SG 2.89Å; V143-C146 PolarHBondContact O-N 3.16Å; I144-C146 VanDerWaalsContact C-N 3.34Å; I144-C146 PolarHBondContact O-N 3.27Å; C146-W148 PolarHBondContact O-N 3.47Å; C146-S149 PolarHBondContact O-N 3.43Å; C146-L150 VanDerWaalsContact O-CG 3.31Å; C146-L150 WeakPolarHBondContact O-CG 3.31Å; C146-L150 PolarHBondContact O-N 3.36Å |
| 147 | I | 96.6 | Very high | 93.9 | Very high | 12 Ų | 12 | 58.7 Ų | 58.7 | 6% | 0.062 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -58.3 | -48.3 | 176.8 | -72.4 | 167.1 | 0 | 0 | 0 | 110.3 | F110 A111 V143 I144 V145 L150 A151 | F110-I147 HydrophobicContact CD1-CG2 4.2Å; F110-I147 HydrophobicContact CE1-CG2 4.3Å; A111-I147 HydrophobicContact CB-CG2 4.17Å; V143-I147 HydrophobicContact CG1-CD1 3.86Å; V143-I147 HydrophobicContact CG1-CG1 4.38Å; V143-I147 VanDerWaalsContact O-CG1 3.27Å; V143-I147 WeakPolarHBondContact O-CG1 3.35Å; V143-I147 PolarHBondContact O-N 3Å; I144-I147 WeakPolarHBondContact O-CB 3.31Å; I144-I147 PolarHBondContact O-N 3.38Å; V145-I147 VanDerWaalsContact C-N 3.34Å; V145-I147 PolarHBondContact O-N 3.09Å; I147-L150 PolarHBondContact O-N 3.13Å; I147-A151 VanDerWaalsContact O-CB 3.26Å; I147-A151 WeakPolarHBondContact O-CB 3.39Å; I147-A151 PolarHBondContact O-N 3.37Å |
| 148 | W | 97.1 | Very high | 94.2 | Very high | 50 Ų | 50 | 57.3 Ų | 57.3 | 19% | 0.189 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -63.5 | -43.1 | 178.3 | -82.1 | 98.8 | 0 | 0 | 0 | 112.3 | N66 F69 T107 A111 I144 V145 C146 L150 A151 I152 | N66-W148 PolarHBondContact OD1-NE1 2.94Å; F69-W148 AromaticContact CD1-CZ2 3.93Å; F69-W148 HydrophobicContact CD1-CZ2 3.93Å; F69-W148 HydrophobicContact CE1-CH2 4.13Å; F69-W148 AromaticContact CE1-CZ2 3.88Å; F69-W148 HydrophobicContact CE1-CZ2 3.88Å; T107-W148 HydrophobicContact CG2-CE3 3.69Å; T107-W148 HydrophobicContact CG2-CZ3 3.61Å; A111-W148 HydrophobicContact CB-CD2 4.33Å; A111-W148 HydrophobicContact CB-CH2 4.41Å; A111-W148 HydrophobicContact CB-CZ2 4.03Å; I144-W148 VanDerWaalsContact O-CD1 3.27Å; I144-W148 PolarHBondContact O-N 2.91Å; V145-W148 PolarHBondContact O-N 3.45Å; C146-W148 PolarHBondContact O-N 3.47Å; W148-L150 PolarHBondContact O-N 2.93Å; W148-A151 WeakPolarHBondContact O-CB 3.04Å; W148-A151 PolarHBondContact O-N 3.41Å; W148-I152 WeakPolarHBondContact O-CD1 3.4Å; W148-I152 WeakPolarHBondContact O-CG1 3.36Å; W148-I152 PolarHBondContact O-N 3.49Å |
| 149 | S | 97.2 | Very high | 94.3 | Very high | 63 Ų | 63 | 50.6 Ų | 50.6 | 44% | 0.441 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -59.4 | -46.9 | 176.8 | -62.5 | 0 | 0 | 0 | 0 | 111.9 | V145 C146 A151 I152 V153 | V145-S149 PolarHBondContact O-N 2.94Å; V145-S149 PolarHBondContact O-OG 3.33Å; V145-S149 VanDerWaalsContact O-OG 3.11Å; C146-S149 PolarHBondContact O-N 3.43Å; S149-A151 VanDerWaalsContact C-N 3.34Å; S149-A151 PolarHBondContact O-N 2.88Å; S149-I152 PolarHBondContact O-N 3.29Å; S149-V153 WeakPolarHBondContact O-CG2 3.36Å; S149-V153 PolarHBondContact O-N 3.48Å |
| 150 | L | 96.6 | Very high | 94.3 | Very high | 103 Ų | 103 | 54.2 Ų | 54.2 | 54% | 0.539 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64 | -39.3 | 176.9 | -68.1 | 173 | 0 | 0 | 0 | 112 | F110 C146 I147 W148 I152 V153 L154 | F110-L150 HydrophobicContact CE1-CB 3.9Å; F110-L150 HydrophobicContact CZ-CB 3.86Å; C146-L150 VanDerWaalsContact O-CG 3.31Å; C146-L150 WeakPolarHBondContact O-CG 3.31Å; C146-L150 PolarHBondContact O-N 3.36Å; I147-L150 PolarHBondContact O-N 3.13Å; W148-L150 PolarHBondContact O-N 2.93Å; L150-I152 VanDerWaalsContact C-N 3.34Å; L150-I152 PolarHBondContact O-N 3.44Å; L150-V153 PolarHBondContact O-N 2.93Å; L150-L154 WeakPolarHBondContact O-CB 3.27Å; L150-L154 PolarHBondContact O-N 3.28Å |
| 151 | A | 96.1 | Very high | 94.3 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -62.4 | -40.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | T107 F110 I147 W148 S149 A155 | T107-A151 HydrophobicContact CG2-CB 3.67Å; F110-A151 HydrophobicContact CB-CB 3.88Å; F110-A151 HydrophobicContact CD1-CB 3.5Å; F110-A151 VanDerWaalsContact CD1-CB 3.5Å; F110-A151 HydrophobicContact CE1-CB 4.24Å; F110-A151 HydrophobicContact CG-CB 3.84Å; I147-A151 VanDerWaalsContact O-CB 3.26Å; I147-A151 WeakPolarHBondContact O-CB 3.39Å; I147-A151 PolarHBondContact O-N 3.37Å; W148-A151 WeakPolarHBondContact O-CB 3.04Å; W148-A151 PolarHBondContact O-N 3.41Å; S149-A151 VanDerWaalsContact C-N 3.34Å; S149-A151 PolarHBondContact O-N 2.88Å; A151-A155 VanDerWaalsContact O-CB 3.31Å; A151-A155 WeakPolarHBondContact O-CB 3.32Å; A151-A155 PolarHBondContact O-N 3.37Å |
| 152 | I | 95.8 | Very high | 94.3 | Very high | 78 Ų | 78 | 53.3 Ų | 53.3 | 40% | 0.4 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -67.2 | -45 | 176.8 | -67.2 | 164.9 | 0 | 0 | 0 | 110.2 | F103 T107 W148 S149 L150 L154 A155 F156 | F103-I152 HydrophobicContact CE2-CG2 4.18Å; F103-I152 HydrophobicContact CZ-CB 4.36Å; F103-I152 HydrophobicContact CZ-CG1 4.06Å; F103-I152 HydrophobicContact CZ-CG2 4.11Å; T107-I152 HydrophobicContact CG2-CG1 4.1Å; W148-I152 WeakPolarHBondContact O-CD1 3.4Å; W148-I152 WeakPolarHBondContact O-CG1 3.36Å; W148-I152 PolarHBondContact O-N 3.49Å; S149-I152 PolarHBondContact O-N 3.29Å; L150-I152 VanDerWaalsContact C-N 3.34Å; L150-I152 PolarHBondContact O-N 3.44Å; I152-L154 VanDerWaalsContact C-N 3.33Å; I152-L154 PolarHBondContact O-N 3.36Å; I152-A155 PolarHBondContact O-N 3.02Å; I152-F156 WeakPolarHBondContact O-CB 3.42Å; I152-F156 PolarHBondContact O-N 3.41Å |
| 153 | V | 96.1 | Very high | 94.1 | Very high | 105 Ų | 105 | 53.1 Ų | 53.1 | 64% | 0.636 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -59.2 | -44.9 | 177.5 | 171 | 0 | 0 | 0 | 0 | 110.8 | S149 L150 A155 F156 | S149-V153 WeakPolarHBondContact O-CG2 3.36Å; S149-V153 PolarHBondContact O-N 3.48Å; L150-V153 PolarHBondContact O-N 2.93Å; V153-A155 VanDerWaalsContact C-N 3.35Å; V153-A155 PolarHBondContact O-N 2.71Å; V153-F156 PolarHBondContact O-N 2.91Å |
| 154 | L | 94.2 | Very high | 93.7 | Very high | 21 Ų | 21 | 52.7 Ų | 52.7 | 11% | 0.11 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -65 | -37.1 | 178.1 | -176.9 | 63.7 | 0 | 0 | 0 | 112.8 | V106 F110 L150 I152 P157 Y190 I193 V194 L197 V198 | V106-L154 HydrophobicContact CG1-CD2 4.29Å; V106-L154 HydrophobicContact CG1-CG 4.33Å; F110-L154 HydrophobicContact CD2-CD2 3.59Å; F110-L154 HydrophobicContact CE2-CD2 3.98Å; L150-L154 WeakPolarHBondContact O-CB 3.27Å; L150-L154 PolarHBondContact O-N 3.28Å; I152-L154 VanDerWaalsContact C-N 3.33Å; I152-L154 PolarHBondContact O-N 3.36Å; L154-P157 WeakPolarHBondContact O-CD 3.46Å; L154-Y190 WeakPolarHBondContact O-CE2 3.28Å; L154-Y190 PolarHBondContact O-OH 3.26Å; L154-I193 HydrophobicContact CD1-CG2 4.22Å; L154-V194 HydrophobicContact CD1-CG2 4.2Å; L154-V194 HydrophobicContact CD2-CG2 4.49Å; L154-V194 HydrophobicContact CG-CG2 4.35Å; L154-L197 HydrophobicContact CD1-CD1 3.94Å; L154-L197 HydrophobicContact CD2-CB 4.42Å; L154-L197 HydrophobicContact CD2-CD1 4.4Å; L154-V198 HydrophobicContact CD2-CG2 3.78Å |
| 155 | A | 94.4 | Very high | 93.2 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -84.1 | -14.3 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | F103 V106 T107 A151 I152 V153 L158 C159 | F103-A155 HydrophobicContact CD2-CB 3.4Å; F103-A155 HydrophobicContact CE2-CB 3.57Å; F103-A155 HydrophobicContact CG-CB 4.25Å; V106-A155 HydrophobicContact CB-CB 4.07Å; V106-A155 HydrophobicContact CG1-CB 4.13Å; T107-A155 VanDerWaalsContact OG1-CB 3.22Å; T107-A155 WeakPolarHBondContact OG1-CB 3.15Å; A151-A155 VanDerWaalsContact O-CB 3.31Å; A151-A155 WeakPolarHBondContact O-CB 3.32Å; A151-A155 PolarHBondContact O-N 3.37Å; I152-A155 PolarHBondContact O-N 3.02Å; V153-A155 VanDerWaalsContact C-N 3.35Å; V153-A155 PolarHBondContact O-N 2.71Å; A155-L158 WeakPolarHBondContact O-CB 3.17Å; A155-L158 PolarHBondContact O-N 2.98Å; A155-L158 VanDerWaalsContact O-N 3.09Å; A155-C159 PolarHBondContact O-N 3.18Å |
| 156 | F | 92.9 | Very high | 92.4 | Very high | 121 Ų | 121 | 55.5 Ų | 55.5 | 53% | 0.531 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -54.3 | -44.5 | -176.1 | 178.3 | -96.5 | 0 | 0 | 0 | 114.3 | I152 V153 L158 C159 Y160 | I152-F156 WeakPolarHBondContact O-CB 3.42Å; I152-F156 PolarHBondContact O-N 3.41Å; V153-F156 PolarHBondContact O-N 2.91Å; F156-L158 VanDerWaalsContact C-N 3.25Å; F156-L158 PolarHBondContact O-N 3.45Å; F156-C159 WeakPolarHBondContact O-CB 3.48Å; F156-C159 PolarHBondContact O-N 3.28Å; F156-Y160 HydrophobicContact CZ-CD2 4.39Å; F156-Y160 PolarHBondContact O-N 2.94Å |
| 157 | P | 92 | Very high | 91.5 | Very high | 35 Ų | 35 | 56.7 Ų | 56.7 | 23% | 0.227 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -56.5 | -38.3 | 177.4 | -27.1 | 36.9 | 0 | 0 | 0 | 113.1 | L154 C159 Y160 F161 W180 Y190 | L154-P157 WeakPolarHBondContact O-CD 3.46Å; P157-C159 PolarHBondContact O-N 2.98Å; P157-Y160 PolarHBondContact O-N 3.15Å; P157-F161 HydrophobicContact CB-CD2 4.33Å; P157-F161 HydrophobicContact CB-CE2 4.43Å; P157-F161 WeakPolarHBondContact O-CD2 3.36Å; P157-F161 PolarHBondContact O-N 2.77Å; P157-W180 HydrophobicContact CB-CH2 3.79Å; P157-W180 HydrophobicContact CB-CZ3 4.12Å; P157-Y190 HydrophobicContact CB-CD2 4.43Å; P157-Y190 HydrophobicContact CB-CE2 4.12Å; P157-Y190 HydrophobicContact CG-CE2 4.09Å |
| 158 | L | 90.1 | Very high | 90.2 | Very high | 17 Ų | 17 | 67.5 Ų | 67.5 | 9% | 0.089 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.5 | -42.9 | 176.5 | -65.8 | 170.7 | 0 | 0 | 0 | 111.3 | N102 V106 A155 F156 Y160 S162 V178 W180 Y190 | N102-L158 HydrophobicContact CB-CB 4.4Å; N102-L158 WeakPolarHBondContact O-CD1 3.26Å; V106-L158 HydrophobicContact CB-CD1 4.15Å; V106-L158 HydrophobicContact CG2-CD1 3.42Å; V106-L158 VanDerWaalsContact CG2-CD1 3.42Å; A155-L158 WeakPolarHBondContact O-CB 3.17Å; A155-L158 PolarHBondContact O-N 2.98Å; A155-L158 VanDerWaalsContact O-N 3.09Å; F156-L158 VanDerWaalsContact C-N 3.25Å; F156-L158 PolarHBondContact O-N 3.45Å; L158-Y160 VanDerWaalsContact C-N 3.32Å; L158-Y160 PolarHBondContact O-N 2.81Å; L158-S162 WeakPolarHBondContact O-CB 3.34Å; L158-S162 PolarHBondContact O-N 3.24Å; L158-S162 PolarHBondContact O-OG 3.47Å; L158-V178 HydrophobicContact CD2-CG1 4.28Å; L158-V178 HydrophobicContact CD2-CG2 4.14Å; L158-W180 HydrophobicContact CD2-CZ2 3.99Å; L158-Y190 HydrophobicContact CD1-CE1 3.76Å; L158-Y190 WeakPolarHBondContact CD1-OH 3.41Å; L158-Y190 HydrophobicContact CD2-CD1 4.31Å; L158-Y190 HydrophobicContact CD2-CE1 3.67Å; L158-Y190 HydrophobicContact CG-CE1 3.65Å; L158-Y190 WeakPolarHBondContact CG-OH 3.29Å |
| 159 | C | 91.6 | Very high | 88.7 | Confident | 40 Ų | 40 | 69.2 Ų | 69.2 | 27% | 0.27 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -63.6 | -39.2 | 176.4 | -171.8 | 0 | 0 | 0 | 0 | 112.1 | K99 F103 A155 F156 P157 | K99-C159 WeakPolarHBondContact CD-O 3.45Å; K99-C159 WeakPolarHBondContact CG-O 3.37Å; K99-C159 PolarHBondContact NZ-O 3.31Å; F103-C159 HydrophobicContact CB-CB 4.01Å; F103-C159 HydrophobicContact CD2-CB 3.95Å; F103-C159 HydrophobicContact CG-CB 4.24Å; A155-C159 PolarHBondContact O-N 3.18Å; F156-C159 WeakPolarHBondContact O-CB 3.48Å; F156-C159 PolarHBondContact O-N 3.28Å; P157-C159 PolarHBondContact O-N 2.98Å |
| 160 | Y | 91.6 | Very high | 86.7 | Confident | 150 Ų | 150 | 74.4 Ų | 74.4 | 59% | 0.588 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -68.4 | -52.5 | -178.6 | -172.9 | -97.2 | 0 | 0 | 0 | 111.6 | K99 F156 P157 L158 | K99-Y160 PolarHBondContact NZ-O 2.89Å; F156-Y160 HydrophobicContact CZ-CD2 4.39Å; F156-Y160 PolarHBondContact O-N 2.94Å; P157-Y160 PolarHBondContact O-N 3.15Å; L158-Y160 VanDerWaalsContact C-N 3.32Å; L158-Y160 PolarHBondContact O-N 2.81Å |
| 161 | F | 90.7 | Very high | 85.3 | Confident | 54 Ų | 54 | 72.8 Ų | 72.8 | 24% | 0.237 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -83.4 | -10.4 | -174.9 | -65.5 | -63.4 | 0 | 0 | 0 | 114.7 | P157 T163 V178 A179 W180 P181 | P157-F161 HydrophobicContact CB-CD2 4.33Å; P157-F161 HydrophobicContact CB-CE2 4.43Å; P157-F161 WeakPolarHBondContact O-CD2 3.36Å; P157-F161 PolarHBondContact O-N 2.77Å; F161-T163 PolarHBondContact O-N 3.11Å; F161-V178 HydrophobicContact CB-CG1 3.71Å; F161-A179 WeakPolarHBondContact CD1-O 3.48Å; F161-A179 PolarHBondContact O-N 3.49Å; F161-W180 HydrophobicContact CD2-CD2 4.48Å; F161-W180 AromaticContact CD2-CE3 3.69Å; F161-W180 HydrophobicContact CD2-CE3 3.69Å; F161-W180 HydrophobicContact CD2-CH2 4.25Å; F161-W180 AromaticContact CD2-CZ3 3.56Å; F161-W180 HydrophobicContact CD2-CZ3 3.56Å; F161-W180 AromaticContact CE2-CE3 3.98Å; F161-W180 HydrophobicContact CE2-CE3 3.98Å; F161-W180 AromaticContact CE2-CZ3 3.76Å; F161-W180 HydrophobicContact CE2-CZ3 3.76Å; F161-W180 HydrophobicContact CG-CE3 4.33Å; F161-P181 HydrophobicContact CD1-CG 4.48Å; F161-P181 HydrophobicContact CE1-CG 3.71Å; F161-P181 HydrophobicContact CZ-CG 3.98Å |
| 162 | S | 90.3 | Very high | 84.2 | Confident | 1 Ų | 1 | 79.6 Ų | 79.6 | 1% | 0.007 | 40% | 0.395 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.1 | 128.1 | 175.8 | -72.3 | 0 | 0 | 0 | 0 | 112.1 | K99 N102 L158 | K99-S162 WeakPolarHBondContact CE-O 3.27Å; N102-S162 VanDerWaalsContact CB-OG 3.3Å; N102-S162 WeakPolarHBondContact CB-OG 3.49Å; N102-S162 PolarHBondContact ND2-OG 3.24Å; L158-S162 WeakPolarHBondContact O-CB 3.34Å; L158-S162 PolarHBondContact O-N 3.24Å; L158-S162 PolarHBondContact O-OG 3.47Å |
| 163 | T | 89.5 | Confident | 83.4 | Confident | 32 Ų | 32 | 79.8 Ų | 79.8 | 20% | 0.196 | 39% | 0.391 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.1 | 163.7 | 178.1 | -163.8 | 0 | 0 | 0 | 0 | 111.5 | C98 F161 Y177 A179 | C98-T163 PolarHBondContact SG-O 3.38Å; F161-T163 PolarHBondContact O-N 3.11Å; T163-Y177 HydrophobicContact CG2-CD1 4.41Å; T163-Y177 HydrophobicContact CG2-CE1 3.75Å; T163-Y177 HydrophobicContact CG2-CE2 4.36Å; T163-Y177 PolarHBondContact N-O 3.34Å; T163-Y177 PolarHBondContact O-N 2.93Å; T163-A179 HydrophobicContact CG2-CB 3.84Å |
| 164 | T | 88.1 | Confident | 82.9 | Confident | 39 Ų | 39 | 76.8 Ų | 76.8 | 24% | 0.239 | 37% | 0.373 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.6 | 134.8 | 174.9 | 52.6 | 0 | 0 | 0 | 0 | 109.3 | K95 C98 I175 | K95-T164 HydrophobicContact CB-CG2 4.35Å; C98-T164 HydrophobicContact CB-CG2 3.69Å; T164-I175 VanDerWaalsContact CA-O 3.31Å; T164-I175 WeakPolarHBondContact CA-O 3.4Å |
| 165 | Q | 83.6 | Confident | 82.5 | Confident | 95 Ų | 95 | 77.4 Ų | 77.4 | 44% | 0.444 | 38% | 0.376 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.1 | 130 | 171.5 | -179.4 | -174.5 | 59.8 | 0 | 0 | 109.5 | K167 I175 Y177 | Q165-K167 PolarHBondContact O-N 2.96Å; Q165-I175 PolarHBondContact N-O 3.28Å; Q165-I175 WeakPolarHBondContact O-CG1 3.24Å; Q165-I175 PolarHBondContact O-N 3.43Å; Q165-Y177 HydrophobicContact CB-CD1 4.42Å; Q165-Y177 HydrophobicContact CB-CE1 3.55Å |
| 166 | T | 80.2 | Confident | 82.2 | Confident | 74 Ų | 74 | 78.3 Ų | 78.3 | 45% | 0.454 | 38% | 0.382 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.2 | 109.4 | 170.2 | -52.9 | 0 | 0 | 0 | 0 | 108.2 | R168 T174 | T166-R168 PolarHBondContact O-N 2.94Å; T166-T174 PolarHBondContact OG1-OG1 2.99Å; T166-T174 VanDerWaalsContact OG1-OG1 3.14Å |
| 167 | K | 76.1 | Confident | 81.8 | Confident | 101 Ų | 101 | 76 Ų | 76 | 44% | 0.439 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.5 | 123.8 | 172.9 | -72.3 | -170.1 | 172.4 | -179.6 | 0 | 108.6 | Q165 T169 R173 I175 | Q165-K167 PolarHBondContact O-N 2.96Å; K167-T169 PolarHBondContact O-N 3.02Å; K167-R173 PolarHBondContact N-O 3.07Å; K167-R173 PolarHBondContact O-N 3.46Å; K167-I175 HydrophobicContact CD-CD1 4.39Å |
| 168 | R | 70.4 | Confident | 81.6 | Confident | 239 Ų | 239 | 75.6 Ų | 75.6 | 90% | 0.902 | 37% | 0.367 | S | S | * | . | trans | -75.3 | 39.6 | 171.9 | -65.6 | -176.1 | 172.9 | 175.4 | -2.6 | 112 | T166 | T166-R168 PolarHBondContact O-N 2.94Š| ||
| 169 | T | 66.1 | Low | 81.4 | Confident | 86 Ų | 86 | 76.3 Ų | 76.3 | 53% | 0.528 | 38% | 0.376 | S | S | . | . | S | Bend | trans | -88 | 158.9 | 170.4 | -41.4 | 0 | 0 | 0 | 0 | 107.8 | K167 P171 Q172 | K167-T169 PolarHBondContact O-N 3.02Å; T169-P171 CarbonylContact C-O 3.55Å; T169-P171 CarbonylContact O-C 2.89Å; T169-Q172 WeakPolarHBondContact O-CA 3.48Å; T169-Q172 PolarHBondContact O-N 3.39Å |
| 170 | I | 55.1 | Low | 81.1 | Confident | 171 Ų | 171 | 75.7 Ų | 75.7 | 88% | 0.877 | 37% | 0.368 | S | S | * | . | S | Bend | trans | -100.6 | 117.2 | 172.2 | -58.7 | 171.4 | 0 | 0 | 0 | 107 | ||
| 171 | P | 65.8 | Low | 80.7 | Confident | 70 Ų | 70 | 72.6 Ų | 72.6 | 46% | 0.455 | 37% | 0.366 | S | S | . | . | S | Bend | cis | -73.3 | 152.9 | -2.6 | 31.1 | -34.9 | 0 | 0 | 0 | 113.2 | T169 R173 | T169-P171 CarbonylContact C-O 3.55Å; T169-P171 CarbonylContact O-C 2.89Å; P171-R173 PolarHBondContact O-N 3.42Å |
| 172 | Q | 73.9 | Confident | 80.2 | Confident | 143 Ų | 143 | 74.5 Ų | 74.5 | 67% | 0.668 | 38% | 0.379 | S | S | * | . | P | Polyproline II helix | trans | -64.5 | 124 | 178.2 | -73.3 | -175.5 | -14.1 | 0 | 0 | 109.6 | T169 | T169-Q172 WeakPolarHBondContact O-CA 3.48Å; T169-Q172 PolarHBondContact O-N 3.39Å |
| 173 | R | 79.5 | Confident | 79.3 | Confident | 81 Ų | 81 | 79.9 Ų | 79.9 | 31% | 0.306 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.8 | 128.1 | -179.2 | -68.2 | -170.9 | 175 | 165.7 | 0.3 | 111.5 | E90 K167 P171 | E90-R173 HydrophobicContact CG-CB 4.26Å; E90-R173 HydrophobicContact CG-CG 3.9Å; K167-R173 PolarHBondContact N-O 3.07Å; K167-R173 PolarHBondContact O-N 3.46Å; P171-R173 PolarHBondContact O-N 3.42Å |
| 174 | T | 84.3 | Confident | 78.4 | Confident | 42 Ų | 42 | 84.9 Ų | 84.9 | 26% | 0.258 | 42% | 0.424 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.9 | 126.7 | 171.2 | -59.8 | 0 | 0 | 0 | 0 | 109.3 | W91 T166 | W91-T174 HydrophobicContact CB-CG2 4.33Å; W91-T174 VanDerWaalsContact CB-O 3.29Å; W91-T174 WeakPolarHBondContact CB-O 3.09Å; W91-T174 PolarHBondContact N-O 2.84Å; T166-T174 PolarHBondContact OG1-OG1 2.99Å; T166-T174 VanDerWaalsContact OG1-OG1 3.14Å |
| 175 | I | 85.8 | Confident | 78 | Confident | 35 Ų | 35 | 88.6 Ų | 88.6 | 18% | 0.179 | 44% | 0.442 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.5 | 145.3 | 176.3 | 58.3 | 160.6 | 0 | 0 | 0 | 110.6 | T164 Q165 K167 Y177 | T164-I175 VanDerWaalsContact CA-O 3.31Å; T164-I175 WeakPolarHBondContact CA-O 3.4Å; Q165-I175 PolarHBondContact N-O 3.28Å; Q165-I175 WeakPolarHBondContact O-CG1 3.24Å; Q165-I175 PolarHBondContact O-N 3.43Å; K167-I175 HydrophobicContact CD-CD1 4.39Å; I175-Y177 HydrophobicContact CD1-CD1 4.18Å; I175-Y177 HydrophobicContact CG1-CD1 4.35Å |
| 176 | C | 88.8 | Confident | 78 | Confident | 18 Ų | 18 | 86 Ų | 86 | 12% | 0.122 | 43% | 0.431 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 124.8 | 169.7 | 172.1 | 0 | 0 | 0 | 0 | 108.6 | W91 C98 N102 | W91-C176 HydrophobicContact CB-CB 4.45Å; W91-C176 HydrophobicContact CD2-CB 3.5Å; W91-C176 HydrophobicContact CE3-CB 3.67Å; W91-C176 HydrophobicContact CG-CB 3.84Å; W91-C176 HydrophobicContact CZ2-CB 4.43Å; W91-C176 HydrophobicContact CZ3-CB 4.19Å; C98-C176 WeakPolarHBondContact CA-SG 3.45Å; C98-C176 HydrophobicContact CB-CB 3.87Å; C98-C176 WeakPolarHBondContact CB-SG 3.23Å; C98-C176 VanDerWaalsContact SG-CA 3.59Å; C98-C176 WeakPolarHBondContact SG-CB 3.43Å; C98-C176 CovalentContact SG-SG 2.03Å; C98-C176 PolarHBondContact SG-SG 3.45Å; N102-C176 PolarHBondContact ND2-SG 3.44Å |
| 177 | Y | 85.4 | Confident | 78.2 | Confident | 72 Ų | 72 | 84.4 Ų | 84.4 | 28% | 0.282 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.8 | 162.2 | 179.1 | 74.5 | -74.4 | 0 | 0 | 0 | 111.6 | T163 Q165 I175 A179 M183 | T163-Y177 HydrophobicContact CG2-CD1 4.41Å; T163-Y177 HydrophobicContact CG2-CE1 3.75Å; T163-Y177 HydrophobicContact CG2-CE2 4.36Å; T163-Y177 PolarHBondContact N-O 3.34Å; T163-Y177 PolarHBondContact O-N 2.93Å; Q165-Y177 HydrophobicContact CB-CD1 4.42Å; Q165-Y177 HydrophobicContact CB-CE1 3.55Å; I175-Y177 HydrophobicContact CD1-CD1 4.18Å; I175-Y177 HydrophobicContact CG1-CD1 4.35Å; Y177-A179 HydrophobicContact CD2-CB 4.44Å; Y177-A179 HydrophobicContact CE2-CB 3.76Å; Y177-M183 HydrophobicContact CD2-CE 4.4Å; Y177-M183 HydrophobicContact CE2-CE 4.12Å |
| 178 | V | 87 | Confident | 78.7 | Confident | 27 Ų | 27 | 82.9 Ų | 82.9 | 16% | 0.164 | 42% | 0.417 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 113.3 | 177.7 | -170.5 | 0 | 0 | 0 | 0 | 109.2 | N102 L158 F161 W180 | N102-V178 HydrophobicContact CB-CG2 4.47Å; L158-V178 HydrophobicContact CD2-CG1 4.28Å; L158-V178 HydrophobicContact CD2-CG2 4.14Å; F161-V178 HydrophobicContact CB-CG1 3.71Å; V178-W180 HydrophobicContact CG1-CD2 4.21Å; V178-W180 HydrophobicContact CG1-CG 4.32Å; V178-W180 HydrophobicContact CG1-CZ2 4.09Å; V178-W180 PolarHBondContact O-N 2.88Å |
| 179 | A | 86.1 | Confident | 79.6 | Confident | 33 Ų | 33 | 76.9 Ų | 76.9 | 27% | 0.273 | 40% | 0.4 | S | S | . | . | trans | -89 | 75.5 | -178.2 | 0 | 0 | 0 | 0 | 0 | 111 | F161 T163 Y177 | F161-A179 WeakPolarHBondContact CD1-O 3.48Å; F161-A179 PolarHBondContact O-N 3.49Å; T163-A179 HydrophobicContact CG2-CB 3.84Å; Y177-A179 HydrophobicContact CD2-CB 4.44Å; Y177-A179 HydrophobicContact CE2-CB 3.76Å | ||
| 180 | W | 85.8 | Confident | 80.7 | Confident | 27 Ų | 27 | 73.8 Ų | 73.8 | 10% | 0.102 | 38% | 0.379 | C | S | . | . | trans | -63.7 | 140.5 | 173.3 | -66.4 | 104.4 | 0 | 0 | 0 | 111.5 | P157 L158 F161 V178 N182 D186 S187 Y190 | P157-W180 HydrophobicContact CB-CH2 3.79Å; P157-W180 HydrophobicContact CB-CZ3 4.12Å; L158-W180 HydrophobicContact CD2-CZ2 3.99Å; F161-W180 HydrophobicContact CD2-CD2 4.48Å; F161-W180 AromaticContact CD2-CE3 3.69Å; F161-W180 HydrophobicContact CD2-CE3 3.69Å; F161-W180 HydrophobicContact CD2-CH2 4.25Å; F161-W180 AromaticContact CD2-CZ3 3.56Å; F161-W180 HydrophobicContact CD2-CZ3 3.56Å; F161-W180 AromaticContact CE2-CE3 3.98Å; F161-W180 HydrophobicContact CE2-CE3 3.98Å; F161-W180 AromaticContact CE2-CZ3 3.76Å; F161-W180 HydrophobicContact CE2-CZ3 3.76Å; F161-W180 HydrophobicContact CG-CE3 4.33Å; V178-W180 HydrophobicContact CG1-CD2 4.21Å; V178-W180 HydrophobicContact CG1-CG 4.32Å; V178-W180 HydrophobicContact CG1-CZ2 4.09Å; V178-W180 PolarHBondContact O-N 2.88Å; W180-N182 PolarHBondContact O-N 3.27Å; W180-D186 HydrophobicContact CB-CB 4.34Å; W180-D186 HydrophobicContact CD2-CB 4.43Å; W180-D186 HydrophobicContact CE3-CB 4.02Å; W180-S187 VanDerWaalsContact CD1-CB 3.47Å; W180-Y190 AromaticContact CH2-CD1 3.96Å; W180-Y190 HydrophobicContact CH2-CD1 3.96Å; W180-Y190 AromaticContact CH2-CD2 3.69Å; W180-Y190 HydrophobicContact CH2-CD2 3.69Å; W180-Y190 HydrophobicContact CH2-CE2 4.3Å; W180-Y190 AromaticContact CH2-CG 3.5Å; W180-Y190 HydrophobicContact CH2-CG 3.5Å; W180-Y190 VanDerWaalsContact CH2-CG 3.5Å; W180-Y190 AromaticContact CZ2-CD1 3.66Å; W180-Y190 HydrophobicContact CZ2-CD1 3.66Å; W180-Y190 HydrophobicContact CZ2-CD2 4.26Å; W180-Y190 HydrophobicContact CZ2-CE1 4.28Å; W180-Y190 AromaticContact CZ2-CG 3.65Å; W180-Y190 HydrophobicContact CZ2-CG 3.65Å | ||
| 181 | P | 82.4 | Confident | 82.4 | Confident | 85 Ų | 85 | 67.4 Ų | 67.4 | 55% | 0.552 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -55.3 | -52.4 | 177.2 | -23.5 | 33.1 | 0 | 0 | 0 | 111.7 | F161 | F161-P181 HydrophobicContact CD1-CG 4.48Å; F161-P181 HydrophobicContact CE1-CG 3.71Å; F161-P181 HydrophobicContact CZ-CG 3.98Å |
| 182 | N | 80.8 | Confident | 83.6 | Confident | 94 Ų | 94 | 66.9 Ų | 66.9 | 50% | 0.503 | 34% | 0.338 | S | S | . | . | S | Bend | trans | -102 | 99.9 | 165.8 | -58.2 | -55.5 | 0 | 0 | 0 | 109 | W180 K184 D186 | W180-N182 PolarHBondContact O-N 3.27Å; N182-K184 PolarHBondContact O-N 2.65Å; N182-D186 HydrophobicContact CB-CB 4.49Å; N182-D186 WeakPolarHBondContact CB-OD2 3.32Å; N182-D186 PolarHBondContact N-OD2 2.77Å; N182-D186 PolarHBondContact ND2-OD2 3.02Å; N182-D186 WeakPolarHBondContact O-CB 3.4Å; N182-D186 PolarHBondContact O-N 3.27Å |
| 183 | M | 69.9 | Low | 84.6 | Confident | 114 Ų | 114 | 63.6 Ų | 63.6 | 56% | 0.562 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.8 | -22 | -174.8 | -66.6 | -125.3 | 116.4 | 0 | 0 | 115.1 | Y177 S187 | Y177-M183 HydrophobicContact CD2-CE 4.4Å; Y177-M183 HydrophobicContact CE2-CE 4.12Å; M183-S187 WeakPolarHBondContact O-CB 3.37Å |
| 184 | K | 71.3 | Confident | 85.2 | Confident | 137 Ų | 137 | 60.4 Ų | 60.4 | 60% | 0.596 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100 | -59.5 | -174.6 | -57 | -179.5 | 172.6 | 174.9 | 0 | 111.3 | N182 F188 | N182-K184 PolarHBondContact O-N 2.65Å; K184-F188 VanDerWaalsContact O-CB 3.28Å; K184-F188 WeakPolarHBondContact O-CB 3.29Å; K184-F188 PolarHBondContact O-N 3.09Å; K184-F188 VanDerWaalsContact O-N 3.14Å |
| 185 | D | 79.6 | Confident | 85.6 | Confident | 117 Ų | 117 | 58.8 Ų | 58.8 | 63% | 0.626 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -78.8 | -45.3 | -167.5 | -54.4 | -33.3 | 0 | 0 | 0 | 111.4 | S187 F188 M189 | D185-S187 PolarHBondContact O-N 2.94Å; D185-F188 PolarHBondContact O-N 2.87Å; D185-M189 VanDerWaalsContact O-CB 3.24Å; D185-M189 WeakPolarHBondContact O-CB 3.34Å; D185-M189 PolarHBondContact O-N 3.36Å |
| 186 | D | 84.3 | Confident | 86 | Confident | 40 Ų | 40 | 60.4 Ų | 60.4 | 21% | 0.214 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -65.3 | -43 | 179.2 | -58.8 | -17.9 | 0 | 0 | 0 | 111.1 | W180 N182 F188 Y190 | W180-D186 HydrophobicContact CB-CB 4.34Å; W180-D186 HydrophobicContact CD2-CB 4.43Å; W180-D186 HydrophobicContact CE3-CB 4.02Å; N182-D186 HydrophobicContact CB-CB 4.49Å; N182-D186 WeakPolarHBondContact CB-OD2 3.32Å; N182-D186 PolarHBondContact N-OD2 2.77Å; N182-D186 PolarHBondContact ND2-OD2 3.02Å; N182-D186 WeakPolarHBondContact O-CB 3.4Å; N182-D186 PolarHBondContact O-N 3.27Å; D186-F188 PolarHBondContact O-N 3.35Å; D186-Y190 VanDerWaalsContact O-CB 3.25Å; D186-Y190 WeakPolarHBondContact O-CB 3.26Å; D186-Y190 PolarHBondContact O-N 3.25Å |
| 187 | S | 84.4 | Confident | 86.3 | Confident | 41 Ų | 41 | 62.1 Ų | 62.1 | 29% | 0.287 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63.9 | -42 | 178.5 | -173.8 | 0 | 0 | 0 | 0 | 111.9 | W180 M183 D185 H191 | W180-S187 VanDerWaalsContact CD1-CB 3.47Å; M183-S187 WeakPolarHBondContact O-CB 3.37Å; D185-S187 PolarHBondContact O-N 2.94Å; S187-H191 WeakPolarHBondContact O-CB 3.43Å; S187-H191 PolarHBondContact O-N 3.44Å; S187-H191 VanDerWaalsContact O-N 3.15Å |
| 188 | F | 85.7 | Confident | 86.6 | Confident | 69 Ų | 69 | 58.9 Ų | 58.9 | 30% | 0.303 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -70 | -47.4 | 179.5 | -177.6 | -103.9 | 0 | 0 | 0 | 111 | K184 D185 D186 Y190 H191 I192 L267 | K184-F188 VanDerWaalsContact O-CB 3.28Å; K184-F188 WeakPolarHBondContact O-CB 3.29Å; K184-F188 PolarHBondContact O-N 3.09Å; K184-F188 VanDerWaalsContact O-N 3.14Å; D185-F188 PolarHBondContact O-N 2.87Å; D186-F188 PolarHBondContact O-N 3.35Å; F188-Y190 PolarHBondContact O-N 2.9Å; F188-H191 PolarHBondContact O-N 3.27Å; F188-H191 VanDerWaalsContact O-N 3.12Å; F188-I192 HydrophobicContact CD1-CG1 4.2Å; F188-I192 HydrophobicContact CE1-CD1 4.29Å; F188-I192 HydrophobicContact CE1-CG1 3.86Å; F188-I192 HydrophobicContact CE2-CD1 4.37Å; F188-I192 HydrophobicContact CE2-CG1 4.45Å; F188-I192 HydrophobicContact CZ-CD1 3.95Å; F188-I192 HydrophobicContact CZ-CG1 4Å; F188-I192 WeakPolarHBondContact O-CG1 3.46Å; F188-I192 PolarHBondContact O-N 2.95Å; F188-L267 HydrophobicContact CE2-CD2 4.43Å; F188-L267 HydrophobicContact CE2-CG 4.4Å; F188-L267 HydrophobicContact CZ-CD2 3.93Å; F188-L267 HydrophobicContact CZ-CG 4.3Å |
| 189 | M | 89.1 | Confident | 86.9 | Confident | 112 Ų | 112 | 58.9 Ų | 58.9 | 55% | 0.552 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -57.2 | -47.2 | 176.9 | -177.2 | -176.6 | 68.5 | 0 | 0 | 111.5 | D185 H191 I192 I193 | D185-M189 VanDerWaalsContact O-CB 3.24Å; D185-M189 WeakPolarHBondContact O-CB 3.34Å; D185-M189 PolarHBondContact O-N 3.36Å; M189-H191 VanDerWaalsContact C-N 3.31Å; M189-H191 PolarHBondContact O-N 3Å; M189-I192 PolarHBondContact O-N 2.88Å; M189-I193 HydrophobicContact CG-CD1 4.08Å; M189-I193 WeakPolarHBondContact O-CG1 3.33Å; M189-I193 PolarHBondContact O-N 3.4Å |
| 190 | Y | 90.8 | Very high | 87.4 | Confident | 22 Ų | 22 | 60.4 Ų | 60.4 | 9% | 0.086 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -58.2 | -44.4 | 175.8 | 178.8 | -96.7 | 0 | 0 | 0 | 111.6 | L154 P157 L158 W180 D186 F188 I192 I193 V194 | L154-Y190 WeakPolarHBondContact O-CE2 3.28Å; L154-Y190 PolarHBondContact O-OH 3.26Å; P157-Y190 HydrophobicContact CB-CD2 4.43Å; P157-Y190 HydrophobicContact CB-CE2 4.12Å; P157-Y190 HydrophobicContact CG-CE2 4.09Å; L158-Y190 HydrophobicContact CD1-CE1 3.76Å; L158-Y190 WeakPolarHBondContact CD1-OH 3.41Å; L158-Y190 HydrophobicContact CD2-CD1 4.31Å; L158-Y190 HydrophobicContact CD2-CE1 3.67Å; L158-Y190 HydrophobicContact CG-CE1 3.65Å; L158-Y190 WeakPolarHBondContact CG-OH 3.29Å; W180-Y190 AromaticContact CH2-CD1 3.96Å; W180-Y190 HydrophobicContact CH2-CD1 3.96Å; W180-Y190 AromaticContact CH2-CD2 3.69Å; W180-Y190 HydrophobicContact CH2-CD2 3.69Å; W180-Y190 HydrophobicContact CH2-CE2 4.3Å; W180-Y190 AromaticContact CH2-CG 3.5Å; W180-Y190 HydrophobicContact CH2-CG 3.5Å; W180-Y190 VanDerWaalsContact CH2-CG 3.5Å; W180-Y190 AromaticContact CZ2-CD1 3.66Å; W180-Y190 HydrophobicContact CZ2-CD1 3.66Å; W180-Y190 HydrophobicContact CZ2-CD2 4.26Å; W180-Y190 HydrophobicContact CZ2-CE1 4.28Å; W180-Y190 AromaticContact CZ2-CG 3.65Å; W180-Y190 HydrophobicContact CZ2-CG 3.65Å; D186-Y190 VanDerWaalsContact O-CB 3.25Å; D186-Y190 WeakPolarHBondContact O-CB 3.26Å; D186-Y190 PolarHBondContact O-N 3.25Å; F188-Y190 PolarHBondContact O-N 2.9Å; Y190-I192 VanDerWaalsContact C-N 3.32Å; Y190-I192 PolarHBondContact O-N 3.03Å; Y190-I193 PolarHBondContact O-N 3.02Å; Y190-V194 HydrophobicContact CD1-CG2 4.05Å; Y190-V194 HydrophobicContact CE1-CG2 3.5Å; Y190-V194 HydrophobicContact CE2-CG2 4.04Å; Y190-V194 VanDerWaalsContact CZ-CG2 3.49Å; Y190-V194 WeakPolarHBondContact O-CG2 3.38Å; Y190-V194 PolarHBondContact O-N 2.88Å |
| 191 | H | 89 | Confident | 87.8 | Confident | 37 Ų | 37 | 62.6 Ų | 62.6 | 17% | 0.171 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -65.3 | -35.6 | 179.6 | -139.1 | 95.9 | 0 | 0 | 0 | 112.8 | S187 F188 M189 T195 F262 | S187-H191 WeakPolarHBondContact O-CB 3.43Å; S187-H191 PolarHBondContact O-N 3.44Å; S187-H191 VanDerWaalsContact O-N 3.15Å; F188-H191 PolarHBondContact O-N 3.27Å; F188-H191 VanDerWaalsContact O-N 3.12Å; M189-H191 VanDerWaalsContact C-N 3.31Å; M189-H191 PolarHBondContact O-N 3Å; H191-T195 WeakPolarHBondContact O-CB 3.32Å; H191-T195 PolarHBondContact O-N 3.41Å; H191-T195 PolarHBondContact O-OG1 3.47Å; H191-F262 VanDerWaalsContact CD2-CB 3.44Å; H191-F262 WeakPolarHBondContact CD2-CB 3.5Å; H191-F262 AromaticContact CD2-CG 3.86Å; H191-F262 AromaticContact CE1-CD1 3.35Å; H191-F262 WeakPolarHBondContact CE1-CD1 3.33Å; H191-F262 AromaticContact CE1-CD2 3.77Å; H191-F262 AromaticContact CE1-CE1 3.75Å; H191-F262 AromaticContact CE1-CG 3.35Å; H191-F262 WeakPolarHBondContact CE1-CG 3.3Å; H191-F262 AromaticContact ND1-CD1 3.89Å; H191-F262 WeakPolarHBondContact NE2-CB 3.21Å; H191-F262 AromaticContact NE2-CD1 3.66Å; H191-F262 AromaticContact NE2-CD2 3.46Å; H191-F262 WeakPolarHBondContact NE2-CD2 3.39Å; H191-F262 AromaticContact NE2-CG 3.13Å; H191-F262 WeakPolarHBondContact NE2-CG 3.32Å |
| 192 | I | 91.9 | Very high | 88.4 | Confident | 59 Ų | 59 | 58.5 Ų | 58.5 | 30% | 0.303 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -64.7 | -47.8 | 173.1 | -67.5 | -63.4 | 0 | 0 | 0 | 110.5 | F188 M189 Y190 V194 T195 V196 I263 | F188-I192 HydrophobicContact CD1-CG1 4.2Å; F188-I192 HydrophobicContact CE1-CD1 4.29Å; F188-I192 HydrophobicContact CE1-CG1 3.86Å; F188-I192 HydrophobicContact CE2-CD1 4.37Å; F188-I192 HydrophobicContact CE2-CG1 4.45Å; F188-I192 HydrophobicContact CZ-CD1 3.95Å; F188-I192 HydrophobicContact CZ-CG1 4Å; F188-I192 WeakPolarHBondContact O-CG1 3.46Å; F188-I192 PolarHBondContact O-N 2.95Å; M189-I192 PolarHBondContact O-N 2.88Å; Y190-I192 VanDerWaalsContact C-N 3.32Å; Y190-I192 PolarHBondContact O-N 3.03Å; I192-V194 VanDerWaalsContact C-N 3.34Å; I192-V194 PolarHBondContact O-N 2.81Å; I192-T195 PolarHBondContact O-N 2.94Å; I192-T195 VanDerWaalsContact O-N 3.16Å; I192-V196 HydrophobicContact CG2-CG2 4.46Å; I192-V196 WeakPolarHBondContact O-CG2 2.85Å; I192-V196 PolarHBondContact O-N 3.47Å; I192-I263 HydrophobicContact CD1-CD1 4.46Å; I192-I263 HydrophobicContact CD1-CG1 4.1Å |
| 193 | I | 93.8 | Very high | 89 | Confident | 74 Ų | 74 | 55.5 Ų | 55.5 | 38% | 0.379 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -57.7 | -47.9 | 177.1 | -67.6 | 166.2 | 0 | 0 | 0 | 110.5 | L154 M189 Y190 T195 V196 L197 | L154-I193 HydrophobicContact CD1-CG2 4.22Å; M189-I193 HydrophobicContact CG-CD1 4.08Å; M189-I193 WeakPolarHBondContact O-CG1 3.33Å; M189-I193 PolarHBondContact O-N 3.4Å; Y190-I193 PolarHBondContact O-N 3.02Å; I193-T195 VanDerWaalsContact C-N 3.35Å; I193-T195 PolarHBondContact O-N 3.44Å; I193-V196 PolarHBondContact O-N 3.48Å; I193-L197 HydrophobicContact CG2-CD1 3.84Å; I193-L197 HydrophobicContact CG2-CG 4.47Å; I193-L197 WeakPolarHBondContact O-CG 3.28Å; I193-L197 PolarHBondContact O-N 3.46Å |
| 194 | V | 92.2 | Very high | 90.2 | Very high | 13 Ų | 13 | 53.9 Ų | 53.9 | 8% | 0.079 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60.6 | -44.2 | 176.7 | 170 | 0 | 0 | 0 | 0 | 111 | L154 Y190 I192 V196 L197 V198 | L154-V194 HydrophobicContact CD1-CG2 4.2Å; L154-V194 HydrophobicContact CD2-CG2 4.49Å; L154-V194 HydrophobicContact CG-CG2 4.35Å; Y190-V194 HydrophobicContact CD1-CG2 4.05Å; Y190-V194 HydrophobicContact CE1-CG2 3.5Å; Y190-V194 HydrophobicContact CE2-CG2 4.04Å; Y190-V194 VanDerWaalsContact CZ-CG2 3.49Å; Y190-V194 WeakPolarHBondContact O-CG2 3.38Å; Y190-V194 PolarHBondContact O-N 2.88Å; I192-V194 VanDerWaalsContact C-N 3.34Å; I192-V194 PolarHBondContact O-N 2.81Å; V194-V196 VanDerWaalsContact C-N 3.34Å; V194-V196 PolarHBondContact O-N 2.94Å; V194-L197 PolarHBondContact O-N 3.22Å; V194-V198 HydrophobicContact CG1-CB 4.36Å; V194-V198 HydrophobicContact CG1-CG2 3.98Å; V194-V198 WeakPolarHBondContact O-CA 3.43Å; V194-V198 WeakPolarHBondContact O-CB 3.48Å; V194-V198 WeakPolarHBondContact O-CG2 3.45Å; V194-V198 PolarHBondContact O-N 3.23Å |
| 195 | T | 92.9 | Very high | 91.3 | Very high | 9 Ų | 9 | 49.8 Ų | 49.8 | 6% | 0.055 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.1 | -40.7 | 178.5 | -59.9 | 0 | 0 | 0 | 0 | 111.7 | H191 I192 I193 Y199 V200 H259 I263 | H191-T195 WeakPolarHBondContact O-CB 3.32Å; H191-T195 PolarHBondContact O-N 3.41Å; H191-T195 PolarHBondContact O-OG1 3.47Å; I192-T195 PolarHBondContact O-N 2.94Å; I192-T195 VanDerWaalsContact O-N 3.16Å; I193-T195 VanDerWaalsContact C-N 3.35Å; I193-T195 PolarHBondContact O-N 3.44Å; T195-Y199 WeakPolarHBondContact O-CA 3.29Å; T195-Y199 VanDerWaalsContact O-CB 3.25Å; T195-Y199 WeakPolarHBondContact O-CB 3.38Å; T195-Y199 PolarHBondContact O-N 3.02Å; T195-Y199 VanDerWaalsContact O-N 3.08Å; T195-V200 HydrophobicContact CG2-CG2 4.45Å; T195-V200 PolarHBondContact O-N 3.44Å; T195-H259 HydrophobicContact CG2-CB 3.93Å; T195-H259 PolarHBondContact OG1-ND1 2.94Å; T195-I263 HydrophobicContact CG2-CD1 4.3Å |
| 196 | V | 94.8 | Very high | 91.9 | Very high | 68 Ų | 68 | 44.2 Ų | 44.2 | 41% | 0.412 | 24% | 0.237 | S | C | . | . | I | π-helix | trans | -65 | -48.3 | 177.2 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | I192 I193 V194 V200 L201 | I192-V196 HydrophobicContact CG2-CG2 4.46Å; I192-V196 WeakPolarHBondContact O-CG2 2.85Å; I192-V196 PolarHBondContact O-N 3.47Å; I193-V196 PolarHBondContact O-N 3.48Å; V194-V196 VanDerWaalsContact C-N 3.34Å; V194-V196 PolarHBondContact O-N 2.94Å; V196-V200 PolarHBondContact O-N 3.38Å; V196-L201 VanDerWaalsContact O-CB 3.25Å; V196-L201 WeakPolarHBondContact O-CB 3.36Å; V196-L201 PolarHBondContact O-N 3.38Å |
| 197 | L | 94.7 | Very high | 92.2 | Very high | 54 Ų | 54 | 43.8 Ų | 43.8 | 28% | 0.283 | 24% | 0.242 | S | C | . | . | I | π-helix | trans | -77.5 | -38.5 | -174.1 | -66.3 | 177.6 | 0 | 0 | 0 | 113.7 | Y114 L154 I193 V194 L201 P202 | Y114-L197 WeakPolarHBondContact CE2-O 3.41Å; Y114-L197 PolarHBondContact OH-O 3.49Å; L154-L197 HydrophobicContact CD1-CD1 3.94Å; L154-L197 HydrophobicContact CD2-CB 4.42Å; L154-L197 HydrophobicContact CD2-CD1 4.4Å; I193-L197 HydrophobicContact CG2-CD1 3.84Å; I193-L197 HydrophobicContact CG2-CG 4.47Å; I193-L197 WeakPolarHBondContact O-CG 3.28Å; I193-L197 PolarHBondContact O-N 3.46Å; V194-L197 PolarHBondContact O-N 3.22Å; L197-L201 HydrophobicContact CD2-CD1 4.36Å; L197-P202 WeakPolarHBondContact O-CD 3.3Å |
| 198 | V | 93.1 | Very high | 92.6 | Very high | 5 Ų | 5 | 46.5 Ų | 46.5 | 3% | 0.03 | 25% | 0.253 | C | S | . | . | I | π-helix | trans | -91.2 | -19.8 | -174.1 | -178.1 | 0 | 0 | 0 | 0 | 112.2 | V109 F110 I113 L154 V194 | V109-V198 HydrophobicContact CB-CG1 4.14Å; V109-V198 HydrophobicContact CG1-CG1 3.43Å; V109-V198 VanDerWaalsContact CG1-CG1 3.43Å; F110-V198 HydrophobicContact CB-CG2 4.34Å; F110-V198 HydrophobicContact CD2-CG2 3.89Å; I113-V198 HydrophobicContact CG2-CG1 4.4Å; L154-V198 HydrophobicContact CD2-CG2 3.78Å; V194-V198 HydrophobicContact CG1-CB 4.36Å; V194-V198 HydrophobicContact CG1-CG2 3.98Å; V194-V198 WeakPolarHBondContact O-CA 3.43Å; V194-V198 WeakPolarHBondContact O-CB 3.48Å; V194-V198 WeakPolarHBondContact O-CG2 3.45Å; V194-V198 PolarHBondContact O-N 3.23Å |
| 199 | Y | 93.3 | Very high | 92.9 | Very high | 26 Ų | 26 | 44 Ų | 44 | 10% | 0.102 | 24% | 0.243 | C | C | . | . | I | π-helix | trans | -124.4 | -63.9 | -175.8 | -174.2 | -99.2 | 0 | 0 | 0 | 112.8 | T195 P202 L203 F251 A252 W255 L256 H259 | T195-Y199 WeakPolarHBondContact O-CA 3.29Å; T195-Y199 VanDerWaalsContact O-CB 3.25Å; T195-Y199 WeakPolarHBondContact O-CB 3.38Å; T195-Y199 PolarHBondContact O-N 3.02Å; T195-Y199 VanDerWaalsContact O-N 3.08Å; Y199-P202 WeakPolarHBondContact O-CD 3.22Å; Y199-P202 WeakPolarHBondContact O-CG 3.47Å; Y199-L203 HydrophobicContact CD1-CD1 3.97Å; Y199-L203 HydrophobicContact CD2-CD1 3.79Å; Y199-L203 HydrophobicContact CE1-CD1 3.64Å; Y199-L203 HydrophobicContact CE2-CD1 3.45Å; Y199-L203 VanDerWaalsContact CE2-CD1 3.45Å; Y199-L203 HydrophobicContact CG-CD1 4.02Å; Y199-L203 VanDerWaalsContact O-CB 3.26Å; Y199-L203 WeakPolarHBondContact O-CB 3.45Å; Y199-L203 WeakPolarHBondContact O-CD1 3.45Å; Y199-L203 WeakPolarHBondContact O-CG 3.46Å; Y199-L203 PolarHBondContact O-N 2.9Å; Y199-F251 HydrophobicContact CD2-CE1 4.3Å; Y199-A252 PolarHBondContact OH-O 3.32Å; Y199-A252 VanDerWaalsContact OH-O 3.12Å; Y199-W255 HydrophobicContact CD2-CB 3.87Å; Y199-W255 HydrophobicContact CE2-CB 3.78Å; Y199-L256 HydrophobicContact CE1-CD1 4.22Å; Y199-L256 WeakPolarHBondContact OH-CB 3.31Å; Y199-H259 AromaticContact CD2-CD2 3.58Å; Y199-H259 AromaticContact CD2-NE2 3.87Å; Y199-H259 AromaticContact CG-CD2 3.54Å; Y199-H259 AromaticContact CG-NE2 3.83Å |
| 200 | V | 95 | Very high | 92.9 | Very high | 66 Ų | 66 | 39.4 Ų | 39.4 | 40% | 0.4 | 22% | 0.22 | S | C | . | . | I | π-helix | trans | -66.4 | -55 | -170.1 | -179.3 | 0 | 0 | 0 | 0 | 112.5 | T195 V196 L203 V204 | T195-V200 HydrophobicContact CG2-CG2 4.45Å; T195-V200 PolarHBondContact O-N 3.44Å; V196-V200 PolarHBondContact O-N 3.38Å; V200-L203 PolarHBondContact O-N 2.99Å; V200-V204 HydrophobicContact CG1-CG2 4.32Å; V200-V204 WeakPolarHBondContact O-CG2 3.37Å; V200-V204 PolarHBondContact O-N 3.38Å |
| 201 | L | 95.1 | Very high | 92.8 | Very high | 72 Ų | 72 | 42.4 Ų | 42.4 | 38% | 0.377 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -57 | -53.3 | -177.1 | -177.4 | 154.3 | 0 | 0 | 0 | 112.6 | Y114 V196 L197 L203 V204 V205 | Y114-L201 HydrophobicContact CE1-CD2 4.46Å; V196-L201 VanDerWaalsContact O-CB 3.25Å; V196-L201 WeakPolarHBondContact O-CB 3.36Å; V196-L201 PolarHBondContact O-N 3.38Å; L197-L201 HydrophobicContact CD2-CD1 4.36Å; L201-L203 VanDerWaalsContact C-N 3.33Å; L201-L203 PolarHBondContact O-N 3.35Å; L201-V204 PolarHBondContact O-N 2.95Å; L201-V205 HydrophobicContact CD2-CG2 4.35Å; L201-V205 WeakPolarHBondContact O-CG2 3.3Å; L201-V205 PolarHBondContact O-N 2.87Å |
| 202 | P | 94.5 | Very high | 92.9 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -66.2 | -34.8 | -179.9 | 23.8 | -33.3 | 0 | 0 | 0 | 112.5 | I113 T117 L197 Y199 V205 M206 | I113-P202 HydrophobicContact CD1-CB 4.47Å; I113-P202 HydrophobicContact CG1-CB 3.65Å; I113-P202 HydrophobicContact CG1-CG 3.59Å; I113-P202 HydrophobicContact CG2-CG 4.17Å; T117-P202 WeakPolarHBondContact OG1-CB 3.29Å; L197-P202 WeakPolarHBondContact O-CD 3.3Å; Y199-P202 WeakPolarHBondContact O-CD 3.22Å; Y199-P202 WeakPolarHBondContact O-CG 3.47Å; P202-V205 PolarHBondContact O-N 3.3Å; P202-M206 HydrophobicContact CB-CE 4.48Å; P202-M206 WeakPolarHBondContact O-CB 3.41Å; P202-M206 VanDerWaalsContact O-CG 3.29Å; P202-M206 WeakPolarHBondContact O-CG 3.15Å; P202-M206 PolarHBondContact O-N 2.85Å |
| 203 | L | 93.8 | Very high | 92.7 | Very high | 30 Ų | 30 | 41 Ų | 41 | 16% | 0.157 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -64.7 | -38.6 | 174.8 | -75.8 | 177.7 | 0 | 0 | 0 | 112.6 | Y199 V200 L201 M206 G207 V248 F251 A252 | Y199-L203 HydrophobicContact CD1-CD1 3.97Å; Y199-L203 HydrophobicContact CD2-CD1 3.79Å; Y199-L203 HydrophobicContact CE1-CD1 3.64Å; Y199-L203 HydrophobicContact CE2-CD1 3.45Å; Y199-L203 VanDerWaalsContact CE2-CD1 3.45Å; Y199-L203 HydrophobicContact CG-CD1 4.02Å; Y199-L203 VanDerWaalsContact O-CB 3.26Å; Y199-L203 WeakPolarHBondContact O-CB 3.45Å; Y199-L203 WeakPolarHBondContact O-CD1 3.45Å; Y199-L203 WeakPolarHBondContact O-CG 3.46Å; Y199-L203 PolarHBondContact O-N 2.9Å; V200-L203 PolarHBondContact O-N 2.99Å; L201-L203 VanDerWaalsContact C-N 3.33Å; L201-L203 PolarHBondContact O-N 3.35Å; L203-M206 HydrophobicContact CD2-CE 3.97Å; L203-G207 WeakPolarHBondContact O-CA 3.46Å; L203-G207 PolarHBondContact O-N 3.15Å; L203-V248 HydrophobicContact CD2-CG1 3.95Å; L203-F251 HydrophobicContact CD2-CD1 4.47Å; L203-A252 HydrophobicContact CD1-CB 4.03Å; L203-A252 HydrophobicContact CD2-CB 3.87Å |
| 204 | V | 94.5 | Very high | 92.3 | Very high | 80 Ų | 80 | 38.2 Ų | 38.2 | 49% | 0.485 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -64.5 | -47.7 | 174.8 | 170.3 | 0 | 0 | 0 | 0 | 110.5 | V200 L201 M206 G207 I208 | V200-V204 HydrophobicContact CG1-CG2 4.32Å; V200-V204 WeakPolarHBondContact O-CG2 3.37Å; V200-V204 PolarHBondContact O-N 3.38Å; L201-V204 PolarHBondContact O-N 2.95Å; V204-M206 PolarHBondContact O-N 3.34Å; V204-G207 PolarHBondContact O-N 3.25Å; V204-I208 HydrophobicContact CG1-CD1 3.77Å; V204-I208 HydrophobicContact CG1-CG1 4.47Å; V204-I208 WeakPolarHBondContact O-CG1 3.24Å; V204-I208 PolarHBondContact O-N 2.6Å |
| 205 | V | 94.6 | Very high | 92.1 | Very high | 51 Ų | 51 | 43.2 Ų | 43.2 | 31% | 0.309 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -60.3 | -46.4 | 178.2 | 174.9 | 0 | 0 | 0 | 0 | 111 | T117 L201 P202 T209 | T117-V205 HydrophobicContact CG2-CB 4.09Å; T117-V205 HydrophobicContact CG2-CG1 3.6Å; L201-V205 HydrophobicContact CD2-CG2 4.35Å; L201-V205 WeakPolarHBondContact O-CG2 3.3Å; L201-V205 PolarHBondContact O-N 2.87Å; P202-V205 PolarHBondContact O-N 3.3Å; V205-T209 WeakPolarHBondContact O-CB 3.4Å; V205-T209 VanDerWaalsContact O-CG2 3.28Å; V205-T209 WeakPolarHBondContact O-CG2 3.37Å; V205-T209 PolarHBondContact O-N 3.33Å; V205-T209 PolarHBondContact O-OG1 3.22Å |
| 206 | M | 92.3 | Very high | 91.7 | Very high | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -65.1 | -42.1 | 176.3 | -72 | -169.8 | -65.4 | 0 | 0 | 111.9 | I113 M116 T117 A120 P202 L203 V204 I208 T209 Y210 V248 | I113-M206 HydrophobicContact CD1-CE 3.4Å; I113-M206 VanDerWaalsContact CD1-CE 3.4Å; I113-M206 HydrophobicContact CG1-CE 4.3Å; M116-M206 HydrophobicContact CB-SD 3.91Å; M116-M206 HydrophobicContact CE-SD 4.39Å; T117-M206 HydrophobicContact CG2-CG 4.34Å; A120-M206 HydrophobicContact CB-CG 4.05Å; P202-M206 HydrophobicContact CB-CE 4.48Å; P202-M206 WeakPolarHBondContact O-CB 3.41Å; P202-M206 VanDerWaalsContact O-CG 3.29Å; P202-M206 WeakPolarHBondContact O-CG 3.15Å; P202-M206 PolarHBondContact O-N 2.85Å; L203-M206 HydrophobicContact CD2-CE 3.97Å; V204-M206 PolarHBondContact O-N 3.34Å; M206-I208 PolarHBondContact O-N 3.33Å; M206-T209 WeakPolarHBondContact CA-OG1 3.43Å; M206-T209 PolarHBondContact O-N 3.24Å; M206-T209 PolarHBondContact O-OG1 2.86Å; M206-Y210 HydrophobicContact CB-CD2 4.05Å; M206-Y210 HydrophobicContact CB-CE2 3.97Å; M206-Y210 HydrophobicContact CG-CE2 4.24Å; M206-Y210 WeakPolarHBondContact O-CB 3.48Å; M206-Y210 WeakPolarHBondContact O-CD2 3.46Å; M206-Y210 PolarHBondContact O-N 2.93Å; M206-Y210 HydrophobicContact SD-CE2 4.48Å; M206-V248 HydrophobicContact CB-CG1 4.32Å; M206-V248 HydrophobicContact CB-CG2 4.39Å; M206-V248 HydrophobicContact CE-CG1 4.09Å; M206-V248 HydrophobicContact CE-CG2 4.21Å; M206-V248 HydrophobicContact SD-CG1 4.47Å; M206-V248 HydrophobicContact SD-CG2 3.64Å |
| 207 | G | 91.4 | Very high | 91.2 | Very high | 31 Ų | 31 | 43.4 Ų | 43.4 | 32% | 0.32 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -58.8 | -48.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | L203 V204 T211 | L203-G207 WeakPolarHBondContact O-CA 3.46Å; L203-G207 PolarHBondContact O-N 3.15Å; V204-G207 PolarHBondContact O-N 3.25Å; G207-T211 VanDerWaalsContact O-CB 3.23Å; G207-T211 WeakPolarHBondContact O-CB 3.47Å; G207-T211 PolarHBondContact O-N 3.25Å; G207-T211 PolarHBondContact O-OG1 2.65Å |
| 208 | I | 92.3 | Very high | 90.7 | Very high | 98 Ų | 98 | 47.9 Ų | 47.9 | 50% | 0.503 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -62.1 | -52 | 177.2 | -66.2 | 167.3 | 0 | 0 | 0 | 110.4 | V204 M206 Y210 T211 I212 | V204-I208 HydrophobicContact CG1-CD1 3.77Å; V204-I208 HydrophobicContact CG1-CG1 4.47Å; V204-I208 WeakPolarHBondContact O-CG1 3.24Å; V204-I208 PolarHBondContact O-N 2.6Å; M206-I208 PolarHBondContact O-N 3.33Å; I208-Y210 PolarHBondContact O-N 3.46Å; I208-T211 PolarHBondContact O-N 2.97Å; I208-I212 HydrophobicContact CG2-CD1 3.84Å; I208-I212 WeakPolarHBondContact O-CG1 3.25Å; I208-I212 PolarHBondContact O-N 3.02Å |
| 209 | T | 91.3 | Very high | 89.6 | Confident | 17 Ų | 17 | 50.7 Ų | 50.7 | 10% | 0.104 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62 | -44.1 | -176.4 | 50.7 | 0 | 0 | 0 | 0 | 112.3 | V121 V205 M206 V213 | V121-T209 HydrophobicContact CG2-CG2 4.5Å; V205-T209 WeakPolarHBondContact O-CB 3.4Å; V205-T209 VanDerWaalsContact O-CG2 3.28Å; V205-T209 WeakPolarHBondContact O-CG2 3.37Å; V205-T209 PolarHBondContact O-N 3.33Å; V205-T209 PolarHBondContact O-OG1 3.22Å; M206-T209 WeakPolarHBondContact CA-OG1 3.43Å; M206-T209 PolarHBondContact O-N 3.24Å; M206-T209 PolarHBondContact O-OG1 2.86Å; T209-V213 WeakPolarHBondContact O-CB 3.4Å; T209-V213 WeakPolarHBondContact O-CG2 3.18Å; T209-V213 PolarHBondContact O-N 3.11Å |
| 210 | Y | 89.1 | Confident | 88.4 | Confident | 16 Ų | 16 | 51.9 Ų | 51.9 | 6% | 0.063 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -72.6 | -30.9 | 177.7 | -70.7 | -55.7 | 0 | 0 | 0 | 113.3 | A120 M206 I208 G214 M244 I245 V248 | A120-Y210 VanDerWaalsContact CA-OH 3.3Å; A120-Y210 WeakPolarHBondContact CA-OH 3.23Å; A120-Y210 HydrophobicContact CB-CD2 4.41Å; A120-Y210 HydrophobicContact CB-CE1 4.09Å; A120-Y210 HydrophobicContact CB-CE2 3.53Å; A120-Y210 VanDerWaalsContact CB-OH 3.22Å; A120-Y210 WeakPolarHBondContact CB-OH 3.32Å; M206-Y210 HydrophobicContact CB-CD2 4.05Å; M206-Y210 HydrophobicContact CB-CE2 3.97Å; M206-Y210 HydrophobicContact CG-CE2 4.24Å; M206-Y210 WeakPolarHBondContact O-CB 3.48Å; M206-Y210 WeakPolarHBondContact O-CD2 3.46Å; M206-Y210 PolarHBondContact O-N 2.93Å; M206-Y210 HydrophobicContact SD-CE2 4.48Å; I208-Y210 PolarHBondContact O-N 3.46Å; Y210-G214 PolarHBondContact O-N 2.75Å; Y210-M244 HydrophobicContact CE1-CB 3.61Å; Y210-M244 HydrophobicContact CE1-SD 4.43Å; Y210-M244 WeakPolarHBondContact OH-CB 3.38Å; Y210-I245 HydrophobicContact CD1-CG1 4.45Å; Y210-I245 HydrophobicContact CG-CG1 4.27Å; Y210-V248 HydrophobicContact CD2-CG2 4.07Å; Y210-V248 HydrophobicContact CE2-CG2 3.52Å |
| 211 | T | 89.9 | Confident | 86.5 | Confident | 84 Ų | 84 | 57.5 Ų | 57.5 | 52% | 0.515 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -64.2 | -48.4 | 173.8 | -59.6 | 0 | 0 | 0 | 0 | 110.4 | G207 I208 V213 G214 L215 | G207-T211 VanDerWaalsContact O-CB 3.23Å; G207-T211 WeakPolarHBondContact O-CB 3.47Å; G207-T211 PolarHBondContact O-N 3.25Å; G207-T211 PolarHBondContact O-OG1 2.65Å; I208-T211 PolarHBondContact O-N 2.97Å; T211-V213 PolarHBondContact O-N 2.7Å; T211-G214 PolarHBondContact O-N 2.65Å; T211-L215 HydrophobicContact CG2-CD1 4.06Å; T211-L215 HydrophobicContact CG2-CG 4.42Å; T211-L215 WeakPolarHBondContact O-CG 3.2Å; T211-L215 PolarHBondContact O-N 3.08Å |
| 212 | I | 90.2 | Very high | 84.7 | Confident | 65 Ų | 65 | 59 Ų | 59 | 33% | 0.333 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -59.9 | -48.9 | 177.1 | -63 | 165.1 | 0 | 0 | 0 | 110.4 | Y124 I128 I208 G214 L215 T216 | Y124-I212 HydrophobicContact CD2-CG2 4.45Å; Y124-I212 HydrophobicContact CE2-CB 4.3Å; Y124-I212 HydrophobicContact CE2-CD1 4.18Å; Y124-I212 HydrophobicContact CE2-CG2 3.87Å; I128-I212 HydrophobicContact CD1-CG2 4.22Å; I128-I212 HydrophobicContact CG1-CG2 4.48Å; I208-I212 HydrophobicContact CG2-CD1 3.84Å; I208-I212 WeakPolarHBondContact O-CG1 3.25Å; I208-I212 PolarHBondContact O-N 3.02Å; I212-G214 VanDerWaalsContact C-N 3.3Å; I212-G214 PolarHBondContact O-N 2.82Å; I212-L215 PolarHBondContact O-N 2.91Å; I212-T216 PolarHBondContact O-N 3.23Å; I212-T216 PolarHBondContact O-OG1 3.46Å |
| 213 | V | 87.4 | Confident | 82.7 | Confident | 1 Ų | 1 | 63.6 Ų | 63.6 | 1% | 0.006 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -60.5 | -40 | 178.5 | 170.2 | 0 | 0 | 0 | 0 | 111.9 | Y124 I127 T209 T211 L217 V241 | Y124-V213 HydrophobicContact CD2-CG2 4.11Å; I127-V213 HydrophobicContact CD1-CG1 3.48Å; I127-V213 VanDerWaalsContact CD1-CG1 3.48Å; T209-V213 WeakPolarHBondContact O-CB 3.4Å; T209-V213 WeakPolarHBondContact O-CG2 3.18Å; T209-V213 PolarHBondContact O-N 3.11Å; T211-V213 PolarHBondContact O-N 2.7Å; V213-L217 HydrophobicContact CG1-CD1 3.92Å; V213-L217 WeakPolarHBondContact O-CB 3.38Å; V213-L217 WeakPolarHBondContact O-CG 3.48Å; V213-L217 PolarHBondContact O-N 2.99Å; V213-V241 HydrophobicContact CG1-CB 4.36Å; V213-V241 HydrophobicContact CG1-CG1 3.9Å; V213-V241 HydrophobicContact CG1-CG2 3.51Å |
| 214 | G | 86.6 | Confident | 80.9 | Confident | 16 Ų | 16 | 65.8 Ų | 65.8 | 17% | 0.165 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.3 | -49.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y210 T211 I212 T216 L217 W218 | Y210-G214 PolarHBondContact O-N 2.75Å; T211-G214 PolarHBondContact O-N 2.65Å; I212-G214 VanDerWaalsContact C-N 3.3Å; I212-G214 PolarHBondContact O-N 2.82Å; G214-T216 PolarHBondContact O-N 3.36Å; G214-L217 PolarHBondContact O-N 2.86Å; G214-W218 PolarHBondContact O-N 3.25Å |
| 215 | L | 87.4 | Confident | 78.9 | Confident | 119 Ų | 119 | 70.1 Ų | 70.1 | 62% | 0.623 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -61.2 | -42.2 | 177.4 | -69 | 174.8 | 0 | 0 | 0 | 111.8 | T211 I212 L217 G219 | T211-L215 HydrophobicContact CG2-CD1 4.06Å; T211-L215 HydrophobicContact CG2-CG 4.42Å; T211-L215 WeakPolarHBondContact O-CG 3.2Å; T211-L215 PolarHBondContact O-N 3.08Å; I212-L215 PolarHBondContact O-N 2.91Å; L215-L217 PolarHBondContact O-N 2.87Å; L215-G219 VanDerWaalsContact O-CA 3.25Å; L215-G219 WeakPolarHBondContact O-CA 3.26Å; L215-G219 PolarHBondContact O-N 2.85Å |
| 216 | T | 85.3 | Confident | 77.3 | Confident | 71 Ų | 71 | 69.1 Ų | 69.1 | 44% | 0.436 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -66.6 | -36.6 | 177.4 | -52.8 | 0 | 0 | 0 | 0 | 112.8 | I128 I212 G214 | I128-T216 HydrophobicContact CD1-CG2 3.8Å; I128-T216 VanDerWaalsContact CD1-OG1 3.24Å; I128-T216 WeakPolarHBondContact CD1-OG1 3.37Å; I212-T216 PolarHBondContact O-N 3.23Å; I212-T216 PolarHBondContact O-OG1 3.46Å; G214-T216 PolarHBondContact O-N 3.36Å |
| 217 | L | 83.2 | Confident | 76.1 | Confident | 10 Ų | 10 | 72.6 Ų | 72.6 | 5% | 0.052 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -80.2 | -24.7 | -178.2 | -74.8 | 175.9 | 0 | 0 | 0 | 114.3 | I127 V213 G214 L215 L234 K237 R238 V241 | I127-L217 HydrophobicContact CD1-CD1 4.22Å; I127-L217 HydrophobicContact CG2-CD2 4.19Å; I127-L217 HydrophobicContact CG2-CG 4.29Å; V213-L217 HydrophobicContact CG1-CD1 3.92Å; V213-L217 WeakPolarHBondContact O-CB 3.38Å; V213-L217 WeakPolarHBondContact O-CG 3.48Å; V213-L217 PolarHBondContact O-N 2.99Å; G214-L217 PolarHBondContact O-N 2.86Å; L215-L217 PolarHBondContact O-N 2.87Å; L217-L234 HydrophobicContact CD2-CD2 4.25Å; L217-K237 HydrophobicContact CD1-CB 4.47Å; L217-K237 HydrophobicContact CD2-CB 4.08Å; L217-K237 HydrophobicContact CD2-CD 4.35Å; L217-R238 HydrophobicContact CB-CG 4.25Å; L217-R238 HydrophobicContact CD1-CG 4.45Å; L217-R238 PolarHBondContact O-NE 3.46Å; L217-R238 PolarHBondContact O-NH2 3.04Å; L217-V241 HydrophobicContact CD1-CB 4.17Å; L217-V241 HydrophobicContact CD1-CG2 3.63Å |
| 218 | W | 83.8 | Confident | 75.1 | Confident | 148 Ų | 148 | 78.1 Ų | 78.1 | 56% | 0.561 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -105.9 | -26.5 | 179.9 | -95.9 | -95.4 | 0 | 0 | 0 | 114.2 | G214 R238 | G214-W218 PolarHBondContact O-N 3.25Å; W218-R238 HydrophobicContact CE3-CG 4.06Å; W218-R238 HydrophobicContact CH2-CB 3.65Å; W218-R238 HydrophobicContact CH2-CG 3.65Å; W218-R238 HydrophobicContact CZ2-CB 4.31Å; W218-R238 HydrophobicContact CZ2-CG 4.16Å; W218-R238 HydrophobicContact CZ3-CB 3.96Å; W218-R238 HydrophobicContact CZ3-CG 3.59Å |
| 219 | G | 70.4 | Confident | 74 | Confident | 64 Ų | 64 | 79.3 Ų | 79.3 | 66% | 0.66 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -95.3 | -2.9 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | L215 E221 | L215-G219 VanDerWaalsContact O-CA 3.25Å; L215-G219 WeakPolarHBondContact O-CA 3.26Å; L215-G219 PolarHBondContact O-N 2.85Å; G219-E221 PolarHBondContact O-N 3.46Å |
| 220 | G | 67.6 | Low | 73.2 | Confident | 50 Ų | 50 | 83.4 Ų | 83.4 | 52% | 0.515 | 49% | 0.486 | S | S | . | . | S | Bend | trans | -71.3 | 114 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | I222 | G220-I222 PolarHBondContact O-N 3.47Š|
| 221 | E | 56.2 | Low | 72.5 | Confident | 185 Ų | 185 | 86.8 Ų | 86.8 | 86% | 0.864 | 50% | 0.502 | S | S | * | . | trans | -56.2 | 130.8 | 165.4 | -88 | 175 | 138.2 | 0 | 0 | 109 | G219 P223 | G219-E221 PolarHBondContact O-N 3.46Å; E221-P223 WeakPolarHBondContact O-CD 3.32Å | ||
| 222 | I | 57.8 | Low | 71.8 | Confident | 104 Ų | 104 | 84.9 Ų | 84.9 | 53% | 0.533 | 50% | 0.499 | S | S | . | . | trans | -73 | 107.1 | 179.9 | -57.5 | 159.1 | 0 | 0 | 0 | 105.8 | G220 G224 | G220-I222 PolarHBondContact O-N 3.47Å; I222-G224 PolarHBondContact O-N 3.14Å | ||
| 223 | P | 52.4 | Low | 71.1 | Confident | 96 Ų | 96 | 87.4 Ų | 87.4 | 62% | 0.623 | 51% | 0.509 | S | S | * | . | trans | -65.1 | 130.4 | 171.6 | -9.9 | 28.4 | 0 | 0 | 0 | 106.3 | E221 S226 | E221-P223 WeakPolarHBondContact O-CD 3.32Å; P223-S226 PolarHBondContact O-OG 2.97Å | ||
| 224 | G | 55.2 | Low | 70.7 | Confident | 75 Ų | 75 | 88.6 Ų | 88.6 | 77% | 0.773 | 52% | 0.516 | S | S | * | . | S | Bend | trans | -47 | 150.1 | -171.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | I222 | I222-G224 PolarHBondContact O-N 3.14Š|
| 225 | D | 52.8 | Low | 70.3 | Confident | 172 Ų | 172 | 97.5 Ų | 97.5 | 92% | 0.92 | 54% | 0.544 | S | S | * | . | trans | 56 | 47.6 | 174 | -151.9 | 22.5 | 0 | 0 | 0 | 115.9 | ||||
| 226 | S | 59.9 | Low | 69.8 | Low | 30 Ų | 30 | 94.5 Ų | 94.5 | 21% | 0.21 | 54% | 0.537 | C | S | . | . | trans | -89.9 | 111.4 | 173.7 | 37.9 | 0 | 0 | 0 | 0 | 111 | P223 H231 | P223-S226 PolarHBondContact O-OG 2.97Å; S226-H231 PolarHBondContact O-CD2 3.43Å | ||
| 227 | S | 67.2 | Low | 69.4 | Low | 73 Ų | 73 | 95.6 Ų | 95.6 | 51% | 0.51 | 54% | 0.536 | S | S | . | . | trans | -27.5 | 140.8 | 173.8 | 65.6 | 0 | 0 | 0 | 0 | 115.1 | N229 Y230 | S227-N229 PolarHBondContact O-N 3.01Å; S227-Y230 WeakPolarHBondContact O-CB 3.46Å; S227-Y230 PolarHBondContact O-N 3.48Å | ||
| 228 | D | 70.6 | Confident | 69.5 | Low | 146 Ų | 146 | 98.8 Ų | 98.8 | 78% | 0.781 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -43.5 | -31.7 | 176.1 | -89.4 | -25.1 | 0 | 0 | 0 | 114.3 | Y230 H231 G232 | D228-Y230 VanDerWaalsContact C-N 3.32Å; D228-Y230 PolarHBondContact O-N 3.43Å; D228-H231 PolarHBondContact O-N 3.2Å; D228-G232 PolarHBondContact O-N 3.23Å |
| 229 | N | 70.8 | Confident | 69.4 | Low | 124 Ų | 124 | 96.4 Ų | 96.4 | 66% | 0.663 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -62.3 | -32.5 | 176.5 | -68.4 | -35.5 | 0 | 0 | 0 | 113.9 | S227 Q233 | S227-N229 PolarHBondContact O-N 3.01Å; N229-Q233 WeakPolarHBondContact O-CG 3.06Å; N229-Q233 PolarHBondContact O-N 3.36Å; N229-Q233 PolarHBondContact O-NE2 3.05Å |
| 230 | Y | 74.2 | Confident | 69.8 | Low | 102 Ų | 102 | 96.1 Ų | 96.1 | 40% | 0.4 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -72.7 | -45.6 | 176.8 | -178.6 | -107.9 | 0 | 0 | 0 | 111.2 | S227 D228 G232 Q233 L234 | S227-Y230 WeakPolarHBondContact O-CB 3.46Å; S227-Y230 PolarHBondContact O-N 3.48Å; D228-Y230 VanDerWaalsContact C-N 3.32Å; D228-Y230 PolarHBondContact O-N 3.43Å; Y230-G232 VanDerWaalsContact C-N 3.3Å; Y230-G232 PolarHBondContact O-N 2.98Å; Y230-Q233 PolarHBondContact O-N 2.83Å; Y230-L234 HydrophobicContact CD1-CD1 3.65Å; Y230-L234 HydrophobicContact CE1-CD1 3.17Å; Y230-L234 HydrophobicContact CE1-CG 4.2Å; Y230-L234 HydrophobicContact CE2-CD1 4.36Å; Y230-L234 HydrophobicContact CG-CD1 4.4Å; Y230-L234 PolarHBondContact O-N 3.49Å |
| 231 | H | 74.8 | Confident | 70.5 | Confident | 88 Ų | 88 | 93.8 Ų | 93.8 | 41% | 0.407 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.9 | -40.7 | 173.8 | -77.3 | -77 | 0 | 0 | 0 | 112.1 | S226 D228 L234 R235 | S226-H231 PolarHBondContact O-CD2 3.43Å; D228-H231 PolarHBondContact O-N 3.2Å; H231-L234 PolarHBondContact O-N 2.99Å; H231-R235 WeakPolarHBondContact O-CB 3.49Å; H231-R235 PolarHBondContact O-N 3.46Å |
| 232 | G | 74.1 | Confident | 71.8 | Confident | 43 Ų | 43 | 91.4 Ų | 91.4 | 44% | 0.443 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.2 | -45.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | D228 Y230 R235 A236 | D228-G232 PolarHBondContact O-N 3.23Å; Y230-G232 VanDerWaalsContact C-N 3.3Å; Y230-G232 PolarHBondContact O-N 2.98Å; G232-R235 PolarHBondContact O-N 2.82Å; G232-A236 PolarHBondContact O-N 3.37Å |
| 233 | Q | 75.5 | Confident | 73 | Confident | 118 Ų | 118 | 87.2 Ų | 87.2 | 55% | 0.551 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -65.3 | -42.1 | 177.9 | -74.4 | 177.1 | 70.8 | 0 | 0 | 112.7 | N229 Y230 A236 K237 | N229-Q233 WeakPolarHBondContact O-CG 3.06Å; N229-Q233 PolarHBondContact O-N 3.36Å; N229-Q233 PolarHBondContact O-NE2 3.05Å; Y230-Q233 PolarHBondContact O-N 2.83Å; Q233-A236 PolarHBondContact O-N 2.92Å; Q233-K237 WeakPolarHBondContact O-CG 3.16Å; Q233-K237 PolarHBondContact O-N 3.47Å |
| 234 | L | 78.9 | Confident | 74.5 | Confident | 27 Ų | 27 | 83.3 Ų | 83.3 | 14% | 0.141 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -60.6 | -47.2 | 174.4 | -87.6 | 163.5 | 0 | 0 | 0 | 111.8 | L217 Y230 H231 A236 K237 R238 | L217-L234 HydrophobicContact CD2-CD2 4.25Å; Y230-L234 HydrophobicContact CD1-CD1 3.65Å; Y230-L234 HydrophobicContact CE1-CD1 3.17Å; Y230-L234 HydrophobicContact CE1-CG 4.2Å; Y230-L234 HydrophobicContact CE2-CD1 4.36Å; Y230-L234 HydrophobicContact CG-CD1 4.4Å; Y230-L234 PolarHBondContact O-N 3.49Å; H231-L234 PolarHBondContact O-N 2.99Å; L234-A236 VanDerWaalsContact C-N 3.3Å; L234-A236 PolarHBondContact O-N 2.96Å; L234-K237 PolarHBondContact O-N 3.47Å; L234-R238 WeakPolarHBondContact O-CG 3.26Å; L234-R238 PolarHBondContact O-N 3.17Å |
| 235 | R | 79.2 | Confident | 76 | Confident | 202 Ų | 202 | 82.9 Ų | 82.9 | 76% | 0.762 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -60.2 | -40.9 | 178.1 | -171.9 | -179.7 | -83.1 | -173.9 | -3.9 | 111.2 | H231 G232 K239 | H231-R235 WeakPolarHBondContact O-CB 3.49Å; H231-R235 PolarHBondContact O-N 3.46Å; G232-R235 PolarHBondContact O-N 2.82Å; R235-K239 WeakPolarHBondContact O-CB 3.5Å; R235-K239 PolarHBondContact O-N 2.97Å |
| 236 | A | 75 | Confident | 77.7 | Confident | 57 Ų | 57 | 77.4 Ų | 77.4 | 47% | 0.471 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -63.7 | -44.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | G232 Q233 L234 K239 V240 | G232-A236 PolarHBondContact O-N 3.37Å; Q233-A236 PolarHBondContact O-N 2.92Å; L234-A236 VanDerWaalsContact C-N 3.3Å; L234-A236 PolarHBondContact O-N 2.96Å; A236-K239 PolarHBondContact O-N 3.12Å; A236-V240 WeakPolarHBondContact O-CG2 3.46Å; A236-V240 PolarHBondContact O-N 3.45Å |
| 237 | K | 78.8 | Confident | 78.9 | Confident | 94 Ų | 94 | 76.3 Ų | 76.3 | 41% | 0.409 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -61.7 | -47 | 176.3 | -73.2 | -179.2 | -179.8 | -176.3 | 0 | 111.9 | L217 Q233 L234 K239 V240 V241 | L217-K237 HydrophobicContact CD1-CB 4.47Å; L217-K237 HydrophobicContact CD2-CB 4.08Å; L217-K237 HydrophobicContact CD2-CD 4.35Å; Q233-K237 WeakPolarHBondContact O-CG 3.16Å; Q233-K237 PolarHBondContact O-N 3.47Å; L234-K237 PolarHBondContact O-N 3.47Å; K237-K239 VanDerWaalsContact C-N 3.3Å; K237-K239 PolarHBondContact O-N 2.93Å; K237-V240 PolarHBondContact O-N 3.39Å; K237-V241 WeakPolarHBondContact O-CG2 3.39Å; K237-V241 PolarHBondContact O-N 3.25Å |
| 238 | R | 84.4 | Confident | 79.8 | Confident | 77 Ų | 77 | 73.6 Ų | 73.6 | 29% | 0.291 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -58.3 | -40.6 | 176.2 | -72.9 | -177.5 | -174.7 | 164.1 | 3.3 | 112.1 | L217 W218 L234 V240 V241 K242 | L217-R238 HydrophobicContact CB-CG 4.25Å; L217-R238 HydrophobicContact CD1-CG 4.45Å; L217-R238 PolarHBondContact O-NE 3.46Å; L217-R238 PolarHBondContact O-NH2 3.04Å; W218-R238 HydrophobicContact CE3-CG 4.06Å; W218-R238 HydrophobicContact CH2-CB 3.65Å; W218-R238 HydrophobicContact CH2-CG 3.65Å; W218-R238 HydrophobicContact CZ2-CB 4.31Å; W218-R238 HydrophobicContact CZ2-CG 4.16Å; W218-R238 HydrophobicContact CZ3-CB 3.96Å; W218-R238 HydrophobicContact CZ3-CG 3.59Å; L234-R238 WeakPolarHBondContact O-CG 3.26Å; L234-R238 PolarHBondContact O-N 3.17Å; R238-V240 PolarHBondContact O-N 2.91Å; R238-V241 PolarHBondContact O-N 3.25Å; R238-K242 WeakPolarHBondContact O-CB 3.26Å; R238-K242 PolarHBondContact O-N 3.17Å |
| 239 | K | 82.6 | Confident | 80.8 | Confident | 98 Ų | 98 | 70.3 Ų | 70.3 | 43% | 0.426 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61 | -44.3 | 177.3 | -169.7 | -178.5 | -173.6 | -168.6 | 0 | 112.2 | R235 A236 K237 M243 L302 | R235-K239 WeakPolarHBondContact O-CB 3.5Å; R235-K239 PolarHBondContact O-N 2.97Å; A236-K239 PolarHBondContact O-N 3.12Å; K237-K239 VanDerWaalsContact C-N 3.3Å; K237-K239 PolarHBondContact O-N 2.93Å; K239-M243 WeakPolarHBondContact O-CB 3.19Å; K239-M243 PolarHBondContact O-N 3.49Å; K239-L302 WeakPolarHBondContact CE-O 3.17Å |
| 240 | V | 78.7 | Confident | 81.8 | Confident | 58 Ų | 58 | 66 Ų | 66 | 35% | 0.352 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -64.9 | -44.8 | 177.7 | 174.3 | 0 | 0 | 0 | 0 | 110.8 | A236 K237 R238 M243 M244 | A236-V240 WeakPolarHBondContact O-CG2 3.46Å; A236-V240 PolarHBondContact O-N 3.45Å; K237-V240 PolarHBondContact O-N 3.39Å; R238-V240 PolarHBondContact O-N 2.91Å; V240-M243 WeakPolarHBondContact O-CB 3.46Å; V240-M243 PolarHBondContact O-N 2.87Å; V240-M244 HydrophobicContact CG1-SD 3.67Å; V240-M244 WeakPolarHBondContact O-CG 3.42Å; V240-M244 PolarHBondContact O-N 3.04Å; V240-M244 VanDerWaalsContact O-N 3.13Å |
| 241 | V | 80.7 | Confident | 82.5 | Confident | 1 Ų | 1 | 61.8 Ų | 61.8 | 1% | 0.006 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -65.7 | -43.9 | 178.6 | 173.5 | 0 | 0 | 0 | 0 | 111.7 | I127 V213 L217 K237 R238 M243 M244 I245 | I127-V241 HydrophobicContact CD1-CG2 3.82Å; V213-V241 HydrophobicContact CG1-CB 4.36Å; V213-V241 HydrophobicContact CG1-CG1 3.9Å; V213-V241 HydrophobicContact CG1-CG2 3.51Å; L217-V241 HydrophobicContact CD1-CB 4.17Å; L217-V241 HydrophobicContact CD1-CG2 3.63Å; K237-V241 WeakPolarHBondContact O-CG2 3.39Å; K237-V241 PolarHBondContact O-N 3.25Å; R238-V241 PolarHBondContact O-N 3.25Å; V241-M243 VanDerWaalsContact C-N 3.28Å; V241-M243 PolarHBondContact O-N 3.09Å; V241-M244 PolarHBondContact O-N 3.18Å; V241-I245 HydrophobicContact CG1-CD1 3.91Å; V241-I245 HydrophobicContact CG1-CG1 4.37Å; V241-I245 WeakPolarHBondContact O-CG1 3.32Å; V241-I245 PolarHBondContact O-N 3.27Å |
| 242 | K | 84.5 | Confident | 83.2 | Confident | 135 Ų | 135 | 58.6 Ų | 58.6 | 59% | 0.587 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -56.5 | -44.2 | 174.8 | -176.8 | 177.6 | -179.9 | 177 | 0 | 111.4 | R238 M244 I245 V246 | R238-K242 WeakPolarHBondContact O-CB 3.26Å; R238-K242 PolarHBondContact O-N 3.17Å; K242-M244 VanDerWaalsContact C-N 3.27Å; K242-M244 PolarHBondContact O-N 2.93Å; K242-I245 PolarHBondContact O-N 3.42Å; K242-V246 VanDerWaalsContact O-CG2 3.3Å; K242-V246 WeakPolarHBondContact O-CG2 3.07Å; K242-V246 PolarHBondContact O-N 3.3Å |
| 243 | M | 83.8 | Confident | 84.2 | Confident | 15 Ų | 15 | 61.7 Ų | 61.7 | 7% | 0.074 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -56.1 | -44.7 | 174.8 | 168 | 179.1 | 152.6 | 0 | 0 | 111.7 | K239 V240 V241 V246 V247 I298 Y299 L302 N303 | K239-M243 WeakPolarHBondContact O-CB 3.19Å; K239-M243 PolarHBondContact O-N 3.49Å; V240-M243 WeakPolarHBondContact O-CB 3.46Å; V240-M243 PolarHBondContact O-N 2.87Å; V241-M243 VanDerWaalsContact C-N 3.28Å; V241-M243 PolarHBondContact O-N 3.09Å; M243-V246 PolarHBondContact O-N 3.31Å; M243-V247 WeakPolarHBondContact O-CG2 2.99Å; M243-V247 PolarHBondContact O-N 3.39Å; M243-V247 VanDerWaalsContact O-N 3.11Å; M243-I298 HydrophobicContact CG-CG2 4.04Å; M243-Y299 HydrophobicContact CE-CD1 3.18Å; M243-Y299 HydrophobicContact CE-CE1 3.57Å; M243-Y299 HydrophobicContact CE-CG 4.22Å; M243-L302 VanDerWaalsContact CA-CD1 3.5Å; M243-L302 HydrophobicContact CB-CB 3.81Å; M243-L302 HydrophobicContact CB-CD1 3.61Å; M243-L302 HydrophobicContact CB-CG 4.35Å; M243-L302 HydrophobicContact CG-CB 3.82Å; M243-L302 HydrophobicContact CG-CD1 3.87Å; M243-L302 HydrophobicContact CG-CG 4.48Å; M243-L302 HydrophobicContact SD-CB 3.84Å; M243-N303 HydrophobicContact SD-CB 4.08Å |
| 244 | M | 82.3 | Confident | 85 | Confident | 14 Ų | 14 | 56.4 Ų | 56.4 | 7% | 0.069 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -71.9 | -38.6 | -175.8 | -63.9 | 164.2 | 102.1 | 0 | 0 | 112.4 | I119 R123 Y210 V240 V241 K242 V246 V247 V248 | I119-M244 HydrophobicContact CB-CE 4.33Å; I119-M244 HydrophobicContact CG2-CE 2.92Å; R123-M244 HydrophobicContact CB-CE 4.38Å; R123-M244 HydrophobicContact CG-CE 3.31Å; R123-M244 HydrophobicContact CG-SD 3.54Å; R123-M244 VanDerWaalsContact CG-SD 3.54Å; Y210-M244 HydrophobicContact CE1-CB 3.61Å; Y210-M244 HydrophobicContact CE1-SD 4.43Å; Y210-M244 WeakPolarHBondContact OH-CB 3.38Å; V240-M244 HydrophobicContact CG1-SD 3.67Å; V240-M244 WeakPolarHBondContact O-CG 3.42Å; V240-M244 PolarHBondContact O-N 3.04Å; V240-M244 VanDerWaalsContact O-N 3.13Å; V241-M244 PolarHBondContact O-N 3.18Å; K242-M244 VanDerWaalsContact C-N 3.27Å; K242-M244 PolarHBondContact O-N 2.93Å; M244-V246 VanDerWaalsContact C-N 3.3Å; M244-V246 PolarHBondContact O-N 3.47Å; M244-V247 PolarHBondContact O-N 3.36Å; M244-V248 WeakPolarHBondContact O-CG2 3.44Å; M244-V248 PolarHBondContact O-N 3.07Å |
| 245 | I | 86.6 | Confident | 85.6 | Confident | 67 Ų | 67 | 55.9 Ų | 55.9 | 34% | 0.344 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -57.8 | -45.3 | 171.1 | -66.8 | 168.6 | 0 | 0 | 0 | 110.3 | Y210 V241 K242 V247 V248 V249 | Y210-I245 HydrophobicContact CD1-CG1 4.45Å; Y210-I245 HydrophobicContact CG-CG1 4.27Å; V241-I245 HydrophobicContact CG1-CD1 3.91Å; V241-I245 HydrophobicContact CG1-CG1 4.37Å; V241-I245 WeakPolarHBondContact O-CG1 3.32Å; V241-I245 PolarHBondContact O-N 3.27Å; K242-I245 PolarHBondContact O-N 3.42Å; I245-V247 VanDerWaalsContact C-N 3.34Å; I245-V247 PolarHBondContact O-N 2.84Å; I245-V248 PolarHBondContact O-N 3Å; I245-V249 HydrophobicContact CG2-CG2 4.18Å; I245-V249 WeakPolarHBondContact O-CG2 3.24Å; I245-V249 PolarHBondContact O-N 2.91Å |
| 246 | V | 88.8 | Confident | 86.3 | Confident | 56 Ų | 56 | 49.9 Ų | 49.9 | 34% | 0.339 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -59.7 | -43.8 | 177.8 | 170.9 | 0 | 0 | 0 | 0 | 111.5 | K242 M243 M244 V248 T250 I298 | K242-V246 VanDerWaalsContact O-CG2 3.3Å; K242-V246 WeakPolarHBondContact O-CG2 3.07Å; K242-V246 PolarHBondContact O-N 3.3Å; M243-V246 PolarHBondContact O-N 3.31Å; M244-V246 VanDerWaalsContact C-N 3.3Å; M244-V246 PolarHBondContact O-N 3.47Å; V246-V248 PolarHBondContact O-N 2.85Å; V246-T250 VanDerWaalsContact O-CB 3.31Å; V246-T250 WeakPolarHBondContact O-CB 3.34Å; V246-T250 PolarHBondContact O-N 3.13Å; V246-T250 PolarHBondContact O-OG1 3.1Å; V246-I298 HydrophobicContact CG1-CD1 4.25Å; V246-I298 HydrophobicContact CG1-CG1 4.4Å |
| 247 | V | 85.4 | Confident | 87.2 | Confident | 8 Ų | 8 | 49 Ų | 49 | 5% | 0.048 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.7 | -45.7 | 176.6 | -176.5 | 0 | 0 | 0 | 0 | 111 | M116 M243 M244 I245 T250 F251 I298 Y299 | M116-V247 HydrophobicContact CE-CB 4.3Å; M116-V247 HydrophobicContact CE-CG1 3.47Å; M116-V247 VanDerWaalsContact CE-CG1 3.47Å; M116-V247 HydrophobicContact SD-CG1 4.03Å; M243-V247 WeakPolarHBondContact O-CG2 2.99Å; M243-V247 PolarHBondContact O-N 3.39Å; M243-V247 VanDerWaalsContact O-N 3.11Å; M244-V247 PolarHBondContact O-N 3.36Å; I245-V247 VanDerWaalsContact C-N 3.34Å; I245-V247 PolarHBondContact O-N 2.84Å; V247-T250 PolarHBondContact O-N 3.19Å; V247-F251 PolarHBondContact O-N 3.42Å; V247-I298 HydrophobicContact CB-CD1 4.47Å; V247-I298 HydrophobicContact CG2-CB 4.31Å; V247-I298 HydrophobicContact CG2-CD1 3.93Å; V247-I298 HydrophobicContact CG2-CG2 3.64Å; V247-Y299 HydrophobicContact CG2-CE1 4.23Å |
| 248 | V | 87.1 | Confident | 87.8 | Confident | 16 Ų | 16 | 47.1 Ų | 47.1 | 10% | 0.097 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.7 | -46.8 | -179.1 | 175 | 0 | 0 | 0 | 0 | 112.2 | M116 L203 M206 Y210 M244 I245 V246 T250 F251 A252 | M116-V248 HydrophobicContact CE-CG2 3.99Å; L203-V248 HydrophobicContact CD2-CG1 3.95Å; M206-V248 HydrophobicContact CB-CG1 4.32Å; M206-V248 HydrophobicContact CB-CG2 4.39Å; M206-V248 HydrophobicContact CE-CG1 4.09Å; M206-V248 HydrophobicContact CE-CG2 4.21Å; M206-V248 HydrophobicContact SD-CG1 4.47Å; M206-V248 HydrophobicContact SD-CG2 3.64Å; Y210-V248 HydrophobicContact CD2-CG2 4.07Å; Y210-V248 HydrophobicContact CE2-CG2 3.52Å; M244-V248 WeakPolarHBondContact O-CG2 3.44Å; M244-V248 PolarHBondContact O-N 3.07Å; I245-V248 PolarHBondContact O-N 3Å; V246-V248 PolarHBondContact O-N 2.85Å; V248-T250 VanDerWaalsContact C-N 3.29Å; V248-T250 PolarHBondContact O-N 2.82Å; V248-F251 PolarHBondContact O-N 3.32Å; V248-A252 WeakPolarHBondContact O-CB 3.4Å; V248-A252 PolarHBondContact O-N 3.47Å |
| 249 | V | 90.9 | Very high | 88.1 | Confident | 76 Ų | 76 | 43.8 Ų | 43.8 | 46% | 0.461 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -62 | -42.2 | 178.1 | 171.6 | 0 | 0 | 0 | 0 | 110.1 | I245 F251 A252 L253 | I245-V249 HydrophobicContact CG2-CG2 4.18Å; I245-V249 WeakPolarHBondContact O-CG2 3.24Å; I245-V249 PolarHBondContact O-N 2.91Å; V249-F251 PolarHBondContact O-N 2.87Å; V249-A252 PolarHBondContact O-N 2.88Å; V249-L253 HydrophobicContact CG1-CD1 3.78Å; V249-L253 HydrophobicContact CG1-CG 4.24Å; V249-L253 WeakPolarHBondContact O-CB 3.32Å; V249-L253 VanDerWaalsContact O-CG 3.27Å; V249-L253 WeakPolarHBondContact O-CG 3.25Å; V249-L253 PolarHBondContact O-N 3.42Å |
| 250 | T | 91.3 | Very high | 88.5 | Confident | 34 Ų | 34 | 42.9 Ų | 42.9 | 21% | 0.209 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60.4 | -47.3 | 176.3 | -55.6 | 0 | 0 | 0 | 0 | 111 | V246 V247 V248 L253 C254 Y294 | V246-T250 VanDerWaalsContact O-CB 3.31Å; V246-T250 WeakPolarHBondContact O-CB 3.34Å; V246-T250 PolarHBondContact O-N 3.13Å; V246-T250 PolarHBondContact O-OG1 3.1Å; V247-T250 PolarHBondContact O-N 3.19Å; V248-T250 VanDerWaalsContact C-N 3.29Å; V248-T250 PolarHBondContact O-N 2.82Å; T250-L253 PolarHBondContact O-N 3.29Å; T250-C254 WeakPolarHBondContact O-CB 3.27Å; T250-C254 PolarHBondContact O-N 3.38Å; T250-C254 PolarHBondContact O-SG 2.94Å; T250-Y294 HydrophobicContact CG2-CD2 3.37Å; T250-Y294 HydrophobicContact CG2-CE2 4.1Å; T250-Y294 HydrophobicContact CG2-CG 3.86Å |
| 251 | F | 88.2 | Confident | 89 | Confident | 14 Ų | 14 | 41.8 Ų | 41.8 | 6% | 0.061 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -59.4 | -48.6 | 176.2 | -178.8 | -88.3 | 0 | 0 | 0 | 111.9 | V109 I113 M116 Y199 L203 V247 V248 V249 L253 C254 W255 | V109-F251 HydrophobicContact CG1-CE2 4.47Å; V109-F251 HydrophobicContact CG1-CZ 4.23Å; I113-F251 HydrophobicContact CB-CE1 4.36Å; I113-F251 HydrophobicContact CB-CE2 4.45Å; I113-F251 HydrophobicContact CB-CZ 3.93Å; I113-F251 HydrophobicContact CD1-CD1 3.48Å; I113-F251 VanDerWaalsContact CD1-CD1 3.48Å; I113-F251 HydrophobicContact CD1-CD2 4.3Å; I113-F251 HydrophobicContact CD1-CE1 3.28Å; I113-F251 HydrophobicContact CD1-CE2 4.12Å; I113-F251 HydrophobicContact CD1-CG 4.01Å; I113-F251 HydrophobicContact CD1-CZ 3.63Å; I113-F251 HydrophobicContact CG1-CD1 4.44Å; I113-F251 HydrophobicContact CG1-CE1 3.76Å; I113-F251 HydrophobicContact CG1-CZ 3.87Å; M116-F251 HydrophobicContact CE-CB 4.13Å; M116-F251 HydrophobicContact SD-CD2 4.42Å; Y199-F251 HydrophobicContact CD2-CE1 4.3Å; L203-F251 HydrophobicContact CD2-CD1 4.47Å; V247-F251 PolarHBondContact O-N 3.42Å; V248-F251 PolarHBondContact O-N 3.32Å; V249-F251 PolarHBondContact O-N 2.87Å; F251-L253 PolarHBondContact O-N 2.86Å; F251-C254 PolarHBondContact O-N 3.06Å; F251-W255 AromaticContact CD2-CD1 3.61Å; F251-W255 AromaticContact CD2-NE1 3.83Å; F251-W255 HydrophobicContact CE1-CB 4.5Å; F251-W255 HydrophobicContact CE1-CG 4.31Å; F251-W255 AromaticContact CE2-CD1 3.42Å; F251-W255 VanDerWaalsContact CE2-CD1 3.42Å; F251-W255 HydrophobicContact CE2-CG 4.17Å; F251-W255 AromaticContact CE2-NE1 3.43Å; F251-W255 AromaticContact CZ-CD1 3.68Å; F251-W255 HydrophobicContact CZ-CD2 4.47Å; F251-W255 HydrophobicContact CZ-CG 4Å; F251-W255 AromaticContact CZ-NE1 3.99Å; F251-W255 PolarHBondContact O-N 2.9Å |
| 252 | A | 91.1 | Very high | 89.2 | Confident | 20 Ų | 20 | 44.2 Ų | 44.2 | 17% | 0.165 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -57.5 | -49.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y199 L203 V248 V249 C254 W255 L256 | Y199-A252 PolarHBondContact OH-O 3.32Å; Y199-A252 VanDerWaalsContact OH-O 3.12Å; L203-A252 HydrophobicContact CD1-CB 4.03Å; L203-A252 HydrophobicContact CD2-CB 3.87Å; V248-A252 WeakPolarHBondContact O-CB 3.4Å; V248-A252 PolarHBondContact O-N 3.47Å; V249-A252 PolarHBondContact O-N 2.88Å; A252-C254 VanDerWaalsContact C-N 3.35Å; A252-C254 PolarHBondContact O-N 3.13Å; A252-W255 PolarHBondContact O-N 3.48Å; A252-L256 WeakPolarHBondContact O-CB 3.22Å; A252-L256 PolarHBondContact O-N 2.93Å |
| 253 | L | 93.9 | Very high | 89.3 | Confident | 109 Ų | 109 | 40.3 Ų | 40.3 | 57% | 0.571 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -66.5 | -34.6 | -179.4 | -67.7 | 176.5 | 0 | 0 | 0 | 113 | V249 T250 F251 P257 | V249-L253 HydrophobicContact CG1-CD1 3.78Å; V249-L253 HydrophobicContact CG1-CG 4.24Å; V249-L253 WeakPolarHBondContact O-CB 3.32Å; V249-L253 VanDerWaalsContact O-CG 3.27Å; V249-L253 WeakPolarHBondContact O-CG 3.25Å; V249-L253 PolarHBondContact O-N 3.42Å; T250-L253 PolarHBondContact O-N 3.29Å; F251-L253 PolarHBondContact O-N 2.86Å; L253-P257 VanDerWaalsContact O-CD 3.24Å; L253-P257 WeakPolarHBondContact O-CD 3.46Å |
| 254 | C | 93.6 | Very high | 89.5 | Confident | 7 Ų | 7 | 41.3 Ų | 41.3 | 5% | 0.047 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -72.9 | -38.1 | 179.6 | -66.5 | 0 | 0 | 0 | 0 | 112.6 | T250 F251 A252 L287 | T250-C254 WeakPolarHBondContact O-CB 3.27Å; T250-C254 PolarHBondContact O-N 3.38Å; T250-C254 PolarHBondContact O-SG 2.94Å; F251-C254 PolarHBondContact O-N 3.06Å; A252-C254 VanDerWaalsContact C-N 3.35Å; A252-C254 PolarHBondContact O-N 3.13Å; C254-L287 HydrophobicContact CB-CG 4.49Å |
| 255 | W | 91.7 | Very high | 89.5 | Confident | 16 Ų | 16 | 41.9 Ų | 41.9 | 6% | 0.061 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -90.9 | -21.4 | -175.8 | -76.9 | 88 | 0 | 0 | 0 | 113.9 | M74 V109 Y199 F251 A252 Y258 H259 A288 S291 | M74-W255 HydrophobicContact CE-CH2 4.16Å; M74-W255 HydrophobicContact CE-CZ2 4.42Å; V109-W255 HydrophobicContact CB-CH2 4.35Å; V109-W255 HydrophobicContact CB-CZ2 4.44Å; V109-W255 HydrophobicContact CG1-CH2 4.05Å; V109-W255 HydrophobicContact CG1-CZ2 3.95Å; V109-W255 HydrophobicContact CG1-CZ3 4.35Å; V109-W255 HydrophobicContact CG2-CH2 3.35Å; V109-W255 HydrophobicContact CG2-CZ2 3.5Å; V109-W255 HydrophobicContact CG2-CZ3 4.23Å; Y199-W255 HydrophobicContact CD2-CB 3.87Å; Y199-W255 HydrophobicContact CE2-CB 3.78Å; F251-W255 AromaticContact CD2-CD1 3.61Å; F251-W255 AromaticContact CD2-NE1 3.83Å; F251-W255 HydrophobicContact CE1-CB 4.5Å; F251-W255 HydrophobicContact CE1-CG 4.31Å; F251-W255 AromaticContact CE2-CD1 3.42Å; F251-W255 VanDerWaalsContact CE2-CD1 3.42Å; F251-W255 HydrophobicContact CE2-CG 4.17Å; F251-W255 AromaticContact CE2-NE1 3.43Å; F251-W255 AromaticContact CZ-CD1 3.68Å; F251-W255 HydrophobicContact CZ-CD2 4.47Å; F251-W255 HydrophobicContact CZ-CG 4Å; F251-W255 AromaticContact CZ-NE1 3.99Å; F251-W255 PolarHBondContact O-N 2.9Å; A252-W255 PolarHBondContact O-N 3.48Å; W255-Y258 HydrophobicContact CE3-CD1 4.1Å; W255-Y258 HydrophobicContact CE3-CG 4.35Å; W255-Y258 HydrophobicContact CZ3-CD1 4.08Å; W255-Y258 HydrophobicContact CZ3-CE1 4.26Å; W255-Y258 HydrophobicContact CZ3-CG 4.38Å; W255-Y258 WeakPolarHBondContact O-CB 3.42Å; W255-Y258 PolarHBondContact O-N 3.42Å; W255-H259 AromaticContact CE3-NE2 3.95Å; W255-H259 PolarHBondContact O-CD2 3.05Å; W255-H259 VanDerWaalsContact O-CD2 3.25Å; W255-H259 PolarHBondContact O-N 3.27Å; W255-A288 HydrophobicContact CD2-CB 4.37Å; W255-A288 HydrophobicContact CE3-CB 4.36Å; W255-A288 HydrophobicContact CH2-CB 4.45Å; W255-A288 HydrophobicContact CZ2-CB 4.48Å; W255-A288 HydrophobicContact CZ3-CB 4.4Å; W255-S291 PolarHBondContact NE1-OG 3.41Å |
| 256 | L | 93 | Very high | 89.2 | Confident | 76 Ų | 76 | 40.1 Ų | 40.1 | 40% | 0.398 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -53.6 | -50.4 | 179.3 | 179.9 | 66.4 | 0 | 0 | 0 | 112.9 | Y199 A252 Y258 H259 V260 | Y199-L256 HydrophobicContact CE1-CD1 4.22Å; Y199-L256 WeakPolarHBondContact OH-CB 3.31Å; A252-L256 WeakPolarHBondContact O-CB 3.22Å; A252-L256 PolarHBondContact O-N 2.93Å; L256-Y258 PolarHBondContact O-N 3.22Å; L256-H259 PolarHBondContact O-N 3.45Å; L256-V260 HydrophobicContact CD1-CG2 3.86Å; L256-V260 HydrophobicContact CG-CG2 4.16Å; L256-V260 WeakPolarHBondContact O-CB 3.46Å; L256-V260 VanDerWaalsContact O-CG2 3.28Å; L256-V260 WeakPolarHBondContact O-CG2 3.28Å; L256-V260 PolarHBondContact O-N 3.11Å |
| 257 | P | 93.7 | Very high | 88.9 | Confident | 39 Ų | 39 | 43.7 Ų | 43.7 | 25% | 0.253 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -64.7 | -30.6 | -176.9 | -24.7 | 39.7 | 0 | 0 | 0 | 112.3 | L253 Y261 I284 L287 | L253-P257 VanDerWaalsContact O-CD 3.24Å; L253-P257 WeakPolarHBondContact O-CD 3.46Å; P257-Y261 WeakPolarHBondContact O-CB 3.45Å; P257-Y261 PolarHBondContact O-N 3.29Å; P257-I284 HydrophobicContact CB-CD1 4.47Å; P257-I284 HydrophobicContact CB-CG1 4.1Å; P257-I284 HydrophobicContact CB-CG2 4.15Å; P257-L287 HydrophobicContact CG-CD2 3.84Å |
| 258 | Y | 91 | Very high | 88.7 | Confident | 53 Ų | 53 | 46.7 Ų | 46.7 | 21% | 0.208 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.7 | -54.2 | 176 | -178.2 | -87.4 | 0 | 0 | 0 | 110.9 | W255 L256 V260 Y261 F262 I284 A288 | W255-Y258 HydrophobicContact CE3-CD1 4.1Å; W255-Y258 HydrophobicContact CE3-CG 4.35Å; W255-Y258 HydrophobicContact CZ3-CD1 4.08Å; W255-Y258 HydrophobicContact CZ3-CE1 4.26Å; W255-Y258 HydrophobicContact CZ3-CG 4.38Å; W255-Y258 WeakPolarHBondContact O-CB 3.42Å; W255-Y258 PolarHBondContact O-N 3.42Å; L256-Y258 PolarHBondContact O-N 3.22Å; Y258-V260 PolarHBondContact O-N 2.91Å; Y258-Y261 WeakPolarHBondContact O-CB 3.42Å; Y258-Y261 PolarHBondContact O-N 3.12Å; Y258-F262 HydrophobicContact CD1-CD2 4.02Å; Y258-F262 HydrophobicContact CD1-CE2 4.21Å; Y258-F262 HydrophobicContact CD2-CD2 4.41Å; Y258-F262 AromaticContact CD2-CE2 3.95Å; Y258-F262 HydrophobicContact CD2-CE2 3.95Å; Y258-F262 AromaticContact CE1-CD2 3.71Å; Y258-F262 HydrophobicContact CE1-CD2 3.71Å; Y258-F262 AromaticContact CE1-CE2 3.66Å; Y258-F262 HydrophobicContact CE1-CE2 3.66Å; Y258-F262 HydrophobicContact CE2-CD2 4.17Å; Y258-F262 AromaticContact CE2-CE2 3.4Å; Y258-F262 HydrophobicContact CE2-CE2 3.4Å; Y258-F262 VanDerWaalsContact CE2-CE2 3.4Å; Y258-F262 HydrophobicContact CE2-CZ 4.29Å; Y258-F262 HydrophobicContact CG-CD2 4.34Å; Y258-F262 HydrophobicContact CG-CE2 4.33Å; Y258-F262 AromaticContact CZ-CD2 3.79Å; Y258-F262 AromaticContact CZ-CE2 3.21Å; Y258-F262 WeakPolarHBondContact O-CD2 3.26Å; Y258-F262 PolarHBondContact O-N 3.43Å; Y258-F262 WeakPolarHBondContact OH-CE2 3.46Å; Y258-I284 HydrophobicContact CD2-CG2 4.44Å; Y258-A288 HydrophobicContact CD2-CB 4.26Å; Y258-A288 HydrophobicContact CG-CB 4.45Å |
| 259 | H | 90.8 | Very high | 88 | Confident | 8 Ų | 8 | 50.9 Ų | 50.9 | 4% | 0.037 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64.3 | -40.9 | 179.3 | -69.3 | -67.8 | 0 | 0 | 0 | 112.4 | T195 Y199 W255 L256 Y261 F262 I263 | T195-H259 HydrophobicContact CG2-CB 3.93Å; T195-H259 PolarHBondContact OG1-ND1 2.94Å; Y199-H259 AromaticContact CD2-CD2 3.58Å; Y199-H259 AromaticContact CD2-NE2 3.87Å; Y199-H259 AromaticContact CG-CD2 3.54Å; Y199-H259 AromaticContact CG-NE2 3.83Å; W255-H259 AromaticContact CE3-NE2 3.95Å; W255-H259 PolarHBondContact O-CD2 3.05Å; W255-H259 VanDerWaalsContact O-CD2 3.25Å; W255-H259 PolarHBondContact O-N 3.27Å; L256-H259 PolarHBondContact O-N 3.45Å; H259-Y261 VanDerWaalsContact C-N 3.33Å; H259-Y261 PolarHBondContact O-N 3.06Å; H259-F262 PolarHBondContact O-N 3.29Å; H259-I263 VanDerWaalsContact O-CG1 3.3Å; H259-I263 WeakPolarHBondContact O-CG1 3.49Å; H259-I263 PolarHBondContact O-N 3.49Å |
| 260 | V | 90.9 | Very high | 87.1 | Confident | 79 Ų | 79 | 53 Ų | 53 | 48% | 0.479 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -60.9 | -42.7 | 176.5 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | L256 Y258 I263 A264 | L256-V260 HydrophobicContact CD1-CG2 3.86Å; L256-V260 HydrophobicContact CG-CG2 4.16Å; L256-V260 WeakPolarHBondContact O-CB 3.46Å; L256-V260 VanDerWaalsContact O-CG2 3.28Å; L256-V260 WeakPolarHBondContact O-CG2 3.28Å; L256-V260 PolarHBondContact O-N 3.11Å; Y258-V260 PolarHBondContact O-N 2.91Å; V260-I263 PolarHBondContact O-N 3.28Å; V260-A264 WeakPolarHBondContact O-CB 3.25Å; V260-A264 PolarHBondContact O-N 3.08Å |
| 261 | Y | 89.1 | Confident | 86.1 | Confident | 35 Ų | 35 | 54.5 Ų | 54.5 | 14% | 0.137 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -59.8 | -47.2 | 177.5 | 173.9 | -90.5 | 0 | 0 | 0 | 112.4 | P257 Y258 H259 A264 T265 I277 V280 Y281 I284 | P257-Y261 WeakPolarHBondContact O-CB 3.45Å; P257-Y261 PolarHBondContact O-N 3.29Å; Y258-Y261 WeakPolarHBondContact O-CB 3.42Å; Y258-Y261 PolarHBondContact O-N 3.12Å; H259-Y261 VanDerWaalsContact C-N 3.33Å; H259-Y261 PolarHBondContact O-N 3.06Å; Y261-A264 PolarHBondContact O-N 3.05Å; Y261-T265 HydrophobicContact CD1-CG2 4.5Å; Y261-T265 HydrophobicContact CD2-CG2 4.28Å; Y261-T265 HydrophobicContact CE1-CG2 4.17Å; Y261-T265 HydrophobicContact CE2-CG2 3.96Å; Y261-T265 WeakPolarHBondContact O-CB 3.44Å; Y261-T265 WeakPolarHBondContact O-CG2 3.2Å; Y261-T265 PolarHBondContact O-N 2.86Å; Y261-T265 PolarHBondContact O-OG1 3.27Å; Y261-I277 HydrophobicContact CE2-CD1 3.62Å; Y261-I277 HydrophobicContact CE2-CG1 4.04Å; Y261-I277 WeakPolarHBondContact OH-CG1 3.43Å; Y261-V280 HydrophobicContact CD2-CG1 4.29Å; Y261-V280 HydrophobicContact CE2-CG1 4.4Å; Y261-Y281 HydrophobicContact CD1-CD2 4.26Å; Y261-Y281 AromaticContact CE1-CD2 3.65Å; Y261-Y281 HydrophobicContact CE1-CD2 3.65Å; Y261-Y281 HydrophobicContact CE1-CE2 4.35Å; Y261-Y281 AromaticContact CZ-CD2 3.96Å; Y261-I284 HydrophobicContact CD2-CD1 3.81Å; Y261-I284 HydrophobicContact CG-CD1 4.04Å |
| 262 | F | 85.4 | Confident | 85.1 | Confident | 51 Ų | 51 | 57 Ų | 57 | 22% | 0.224 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -67.6 | -37.7 | 179.9 | -82.9 | -78.6 | 0 | 0 | 0 | 112.7 | H191 Y258 H259 T265 G266 Y281 | H191-F262 VanDerWaalsContact CD2-CB 3.44Å; H191-F262 WeakPolarHBondContact CD2-CB 3.5Å; H191-F262 AromaticContact CD2-CG 3.86Å; H191-F262 AromaticContact CE1-CD1 3.35Å; H191-F262 WeakPolarHBondContact CE1-CD1 3.33Å; H191-F262 AromaticContact CE1-CD2 3.77Å; H191-F262 AromaticContact CE1-CE1 3.75Å; H191-F262 AromaticContact CE1-CG 3.35Å; H191-F262 WeakPolarHBondContact CE1-CG 3.3Å; H191-F262 AromaticContact ND1-CD1 3.89Å; H191-F262 WeakPolarHBondContact NE2-CB 3.21Å; H191-F262 AromaticContact NE2-CD1 3.66Å; H191-F262 AromaticContact NE2-CD2 3.46Å; H191-F262 WeakPolarHBondContact NE2-CD2 3.39Å; H191-F262 AromaticContact NE2-CG 3.13Å; H191-F262 WeakPolarHBondContact NE2-CG 3.32Å; Y258-F262 HydrophobicContact CD1-CD2 4.02Å; Y258-F262 HydrophobicContact CD1-CE2 4.21Å; Y258-F262 HydrophobicContact CD2-CD2 4.41Å; Y258-F262 AromaticContact CD2-CE2 3.95Å; Y258-F262 HydrophobicContact CD2-CE2 3.95Å; Y258-F262 AromaticContact CE1-CD2 3.71Å; Y258-F262 HydrophobicContact CE1-CD2 3.71Å; Y258-F262 AromaticContact CE1-CE2 3.66Å; Y258-F262 HydrophobicContact CE1-CE2 3.66Å; Y258-F262 HydrophobicContact CE2-CD2 4.17Å; Y258-F262 AromaticContact CE2-CE2 3.4Å; Y258-F262 HydrophobicContact CE2-CE2 3.4Å; Y258-F262 VanDerWaalsContact CE2-CE2 3.4Å; Y258-F262 HydrophobicContact CE2-CZ 4.29Å; Y258-F262 HydrophobicContact CG-CD2 4.34Å; Y258-F262 HydrophobicContact CG-CE2 4.33Å; Y258-F262 AromaticContact CZ-CD2 3.79Å; Y258-F262 AromaticContact CZ-CE2 3.21Å; Y258-F262 WeakPolarHBondContact O-CD2 3.26Å; Y258-F262 PolarHBondContact O-N 3.43Å; Y258-F262 WeakPolarHBondContact OH-CE2 3.46Å; H259-F262 PolarHBondContact O-N 3.29Å; F262-T265 PolarHBondContact O-OG1 2.93Å; F262-G266 PolarHBondContact O-N 3.17Å; F262-Y281 HydrophobicContact CE2-CE2 4.37Å; F262-Y281 HydrophobicContact CZ-CE2 4.13Å |
| 263 | I | 87.6 | Confident | 84.1 | Confident | 54 Ų | 54 | 64.3 Ų | 64.3 | 28% | 0.277 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -65.8 | -48.3 | 174.8 | -66.9 | 168 | 0 | 0 | 0 | 110.3 | I192 T195 H259 V260 T265 G266 L267 | I192-I263 HydrophobicContact CD1-CD1 4.46Å; I192-I263 HydrophobicContact CD1-CG1 4.1Å; T195-I263 HydrophobicContact CG2-CD1 4.3Å; H259-I263 VanDerWaalsContact O-CG1 3.3Å; H259-I263 WeakPolarHBondContact O-CG1 3.49Å; H259-I263 PolarHBondContact O-N 3.49Å; V260-I263 PolarHBondContact O-N 3.28Å; I263-T265 PolarHBondContact O-N 3.44Å; I263-G266 PolarHBondContact O-N 3.01Å; I263-L267 HydrophobicContact CG2-CD1 3.94Å; I263-L267 HydrophobicContact CG2-CG 4.45Å; I263-L267 WeakPolarHBondContact O-CG 3.25Å; I263-L267 PolarHBondContact O-N 3.35Å |
| 264 | A | 87.1 | Confident | 83.2 | Confident | 36 Ų | 36 | 67.2 Ų | 67.2 | 30% | 0.298 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -62.9 | -43.4 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | V260 Y261 G266 L267 N268 L271 | V260-A264 WeakPolarHBondContact O-CB 3.25Å; V260-A264 PolarHBondContact O-N 3.08Å; Y261-A264 PolarHBondContact O-N 3.05Å; A264-G266 VanDerWaalsContact C-N 3.34Å; A264-L267 PolarHBondContact O-N 2.92Å; A264-N268 PolarHBondContact O-N 3.29Å; A264-L271 HydrophobicContact CB-CD1 4.38Å |
| 265 | T | 82.8 | Confident | 82 | Confident | 25 Ų | 25 | 73.9 Ų | 73.9 | 15% | 0.153 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -72.2 | -27.6 | 177.1 | 54 | 0 | 0 | 0 | 0 | 113 | Y261 F262 I263 | Y261-T265 HydrophobicContact CD1-CG2 4.5Å; Y261-T265 HydrophobicContact CD2-CG2 4.28Å; Y261-T265 HydrophobicContact CE1-CG2 4.17Å; Y261-T265 HydrophobicContact CE2-CG2 3.96Å; Y261-T265 WeakPolarHBondContact O-CB 3.44Å; Y261-T265 WeakPolarHBondContact O-CG2 3.2Å; Y261-T265 PolarHBondContact O-N 2.86Å; Y261-T265 PolarHBondContact O-OG1 3.27Å; F262-T265 PolarHBondContact O-OG1 2.93Å; I263-T265 PolarHBondContact O-N 3.44Å |
| 266 | G | 79.8 | Confident | 81.2 | Confident | 30 Ų | 30 | 80.5 Ų | 80.5 | 31% | 0.309 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -66.5 | -44.7 | 170.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | F262 I263 A264 | F262-G266 PolarHBondContact O-N 3.17Å; I263-G266 PolarHBondContact O-N 3.01Å; A264-G266 VanDerWaalsContact C-N 3.34Å |
| 267 | L | 83.6 | Confident | 80.5 | Confident | 131 Ų | 131 | 78.3 Ų | 78.3 | 69% | 0.686 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -73.6 | -42.2 | 179.6 | -67.5 | 173.4 | 0 | 0 | 0 | 112.8 | F188 I263 A264 | F188-L267 HydrophobicContact CE2-CD2 4.43Å; F188-L267 HydrophobicContact CE2-CG 4.4Å; F188-L267 HydrophobicContact CZ-CD2 3.93Å; F188-L267 HydrophobicContact CZ-CG 4.3Å; I263-L267 HydrophobicContact CG2-CD1 3.94Å; I263-L267 HydrophobicContact CG2-CG 4.45Å; I263-L267 WeakPolarHBondContact O-CG 3.25Å; I263-L267 PolarHBondContact O-N 3.35Å; A264-L267 PolarHBondContact O-N 2.92Å |
| 268 | N | 80.9 | Confident | 79.6 | Confident | 72 Ų | 72 | 79.3 Ų | 79.3 | 39% | 0.385 | 39% | 0.389 | S | S | . | . | trans | -125.8 | 101.1 | -176.9 | -168.7 | -11.9 | 0 | 0 | 0 | 112.4 | A264 L270 L271 | A264-N268 PolarHBondContact O-N 3.29Å; N268-L270 PolarHBondContact O-N 3.18Å; N268-L270 VanDerWaalsContact OD1-CB 3.29Å; N268-L270 WeakPolarHBondContact OD1-CB 3.4Å; N268-L270 PolarHBondContact OD1-N 3.45Å; N268-L270 VanDerWaalsContact OD1-N 3.07Å; N268-L271 HydrophobicContact CB-CD1 3.93Å; N268-L271 HydrophobicContact CB-CG 4.28Å; N268-L271 WeakPolarHBondContact O-CB 3.17Å; N268-L271 PolarHBondContact O-N 2.95Å | ||
| 269 | K | 71.8 | Confident | 79.1 | Confident | 103 Ų | 103 | 78.6 Ų | 78.6 | 45% | 0.448 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -70.2 | -15.2 | -178.3 | -60.6 | -172.7 | -177.8 | -173.6 | 0 | 113.9 | L271 S272 | K269-L271 VanDerWaalsContact C-N 3.27Å; K269-S272 PolarHBondContact O-N 3.02Å |
| 270 | L | 71.4 | Confident | 78.8 | Confident | 122 Ų | 122 | 81.3 Ų | 81.3 | 64% | 0.639 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -67.2 | -33.1 | 174.3 | -64.9 | 164.2 | 0 | 0 | 0 | 110.8 | N268 S272 K273 W274 | N268-L270 PolarHBondContact O-N 3.18Å; N268-L270 VanDerWaalsContact OD1-CB 3.29Å; N268-L270 WeakPolarHBondContact OD1-CB 3.4Å; N268-L270 PolarHBondContact OD1-N 3.45Å; N268-L270 VanDerWaalsContact OD1-N 3.07Å; L270-S272 VanDerWaalsContact C-N 3.3Å; L270-S272 PolarHBondContact O-N 3.37Å; L270-K273 PolarHBondContact O-N 3.08Å; L270-W274 VanDerWaalsContact O-CD1 3.26Å |
| 271 | L | 71.3 | Confident | 78.5 | Confident | 65 Ų | 65 | 81 Ų | 81 | 34% | 0.34 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.5 | -36.1 | 176.2 | -68.3 | 167.8 | 0 | 0 | 0 | 112 | A264 N268 K269 K273 W274 I277 | A264-L271 HydrophobicContact CB-CD1 4.38Å; N268-L271 HydrophobicContact CB-CD1 3.93Å; N268-L271 HydrophobicContact CB-CG 4.28Å; N268-L271 WeakPolarHBondContact O-CB 3.17Å; N268-L271 PolarHBondContact O-N 2.95Å; K269-L271 VanDerWaalsContact C-N 3.27Å; L271-K273 PolarHBondContact O-N 3.04Å; L271-W274 WeakPolarHBondContact O-CB 3.49Å; L271-W274 PolarHBondContact O-N 2.84Å; L271-I277 WeakPolarHBondContact O-CD1 3.29Å |
| 272 | S | 67.5 | Low | 78.2 | Confident | 66 Ų | 66 | 80 Ų | 80 | 46% | 0.462 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -66.8 | -21 | 179.2 | -179.3 | 0 | 0 | 0 | 0 | 113.2 | K269 L270 | K269-S272 PolarHBondContact O-N 3.02Å; L270-S272 VanDerWaalsContact C-N 3.3Å; L270-S272 PolarHBondContact O-N 3.37Å |
| 273 | K | 70.1 | Confident | 78.3 | Confident | 174 Ų | 174 | 80 Ų | 80 | 76% | 0.757 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.3 | 0 | 179 | -64.8 | -175.1 | 179.5 | -177.9 | 0 | 113.7 | L270 L271 | L270-K273 PolarHBondContact O-N 3.08Å; L271-K273 PolarHBondContact O-N 3.04Å |
| 274 | W | 74.6 | Confident | 78.5 | Confident | 170 Ų | 170 | 78.7 Ų | 78.7 | 64% | 0.644 | 39% | 0.391 | S | S | * | . | trans | -70.1 | 139.2 | -177.8 | -88.1 | 41.2 | 0 | 0 | 0 | 112.7 | L270 L271 Y276 I277 | L270-W274 VanDerWaalsContact O-CD1 3.26Å; L271-W274 WeakPolarHBondContact O-CB 3.49Å; L271-W274 PolarHBondContact O-N 2.84Å; W274-Y276 PolarHBondContact O-N 3.34Å; W274-Y276 VanDerWaalsContact O-N 3.12Å; W274-I277 HydrophobicContact CB-CB 4.47Å; W274-I277 VanDerWaalsContact O-CB 3.3Å; W274-I277 WeakPolarHBondContact O-CB 3.38Å; W274-I277 WeakPolarHBondContact O-CG2 3.4Å; W274-I277 PolarHBondContact O-N 3.38Å | ||
| 275 | K | 68.2 | Low | 78.5 | Confident | 147 Ų | 147 | 77.3 Ų | 77.3 | 64% | 0.639 | 38% | 0.379 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | -31.6 | -177.1 | -171.9 | 177.5 | 179.1 | -179.8 | 0 | 113.8 | ||
| 276 | Y | 75.7 | Confident | 78.8 | Confident | 154 Ų | 154 | 79.4 Ų | 79.4 | 60% | 0.604 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.5 | 1.8 | -178.1 | -62 | -69.9 | 0 | 0 | 0 | 114.4 | W274 Q278 Q279 V280 | W274-Y276 PolarHBondContact O-N 3.34Å; W274-Y276 VanDerWaalsContact O-N 3.12Å; Y276-Q278 PolarHBondContact O-N 2.79Å; Y276-Q279 PolarHBondContact O-N 3.19Å; Y276-Q279 VanDerWaalsContact O-N 3.08Å; Y276-V280 PolarHBondContact O-N 3.4Å |
| 277 | I | 78.6 | Confident | 79.4 | Confident | 30 Ų | 30 | 80.4 Ų | 80.4 | 15% | 0.154 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -60.1 | -33.4 | -173 | -160.6 | 66.2 | 0 | 0 | 0 | 112.7 | Y261 L271 W274 V280 Y281 | Y261-I277 HydrophobicContact CE2-CD1 3.62Å; Y261-I277 HydrophobicContact CE2-CG1 4.04Å; Y261-I277 WeakPolarHBondContact OH-CG1 3.43Å; L271-I277 WeakPolarHBondContact O-CD1 3.29Å; W274-I277 HydrophobicContact CB-CB 4.47Å; W274-I277 VanDerWaalsContact O-CB 3.3Å; W274-I277 WeakPolarHBondContact O-CB 3.38Å; W274-I277 WeakPolarHBondContact O-CG2 3.4Å; W274-I277 PolarHBondContact O-N 3.38Å; I277-V280 PolarHBondContact O-N 3.43Å; I277-Y281 WeakPolarHBondContact O-CB 3.45Å; I277-Y281 PolarHBondContact O-N 3.28Å |
| 278 | Q | 74 | Confident | 79.7 | Confident | 61 Ų | 61 | 74.2 Ų | 74.2 | 29% | 0.285 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -66.8 | -38.3 | 178.8 | -168.2 | -175 | 7.2 | 0 | 0 | 112.1 | Y276 Y281 L282 | Y276-Q278 PolarHBondContact O-N 2.79Å; Q278-Y281 PolarHBondContact O-N 2.89Å; Q278-L282 VanDerWaalsContact O-CG 3.32Å; Q278-L282 WeakPolarHBondContact O-CG 3.12Å; Q278-L282 PolarHBondContact O-N 3.31Å |
| 279 | Q | 80.1 | Confident | 80.1 | Confident | 37 Ų | 37 | 71.1 Ų | 71.1 | 17% | 0.173 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -69.6 | -38.4 | 176.9 | -66.5 | -65.7 | -40.4 | 0 | 0 | 111.2 | W28 Y276 L282 S283 | W28-Q279 VanDerWaalsContact NE1-OE1 3.12Å; Y276-Q279 PolarHBondContact O-N 3.19Å; Y276-Q279 VanDerWaalsContact O-N 3.08Å; Q279-L282 PolarHBondContact O-N 3.33Å; Q279-S283 WeakPolarHBondContact O-CB 3.31Å; Q279-S283 PolarHBondContact O-N 2.83Å; Q279-S283 PolarHBondContact O-OG 3.4Å |
| 280 | V | 85.4 | Confident | 81 | Confident | 65 Ų | 65 | 66.2 Ų | 66.2 | 39% | 0.394 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62.3 | -48.3 | 173.9 | 175.9 | 0 | 0 | 0 | 0 | 110 | Y261 Y276 I277 L282 S283 I284 | Y261-V280 HydrophobicContact CD2-CG1 4.29Å; Y261-V280 HydrophobicContact CE2-CG1 4.4Å; Y276-V280 PolarHBondContact O-N 3.4Å; I277-V280 PolarHBondContact O-N 3.43Å; V280-L282 PolarHBondContact O-N 3.31Å; V280-S283 PolarHBondContact O-N 3.22Å; V280-I284 HydrophobicContact CG1-CD1 3.59Å; V280-I284 HydrophobicContact CG1-CG1 4.31Å; V280-I284 WeakPolarHBondContact O-CB 3.35Å; V280-I284 VanDerWaalsContact O-CG1 3.25Å; V280-I284 WeakPolarHBondContact O-CG1 3.49Å; V280-I284 PolarHBondContact O-N 2.74Å |
| 281 | Y | 83.5 | Confident | 82 | Confident | 72 Ų | 72 | 60.9 Ų | 60.9 | 28% | 0.282 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -59.2 | -46.4 | 177.2 | 178 | -104.1 | 0 | 0 | 0 | 112.4 | Y261 F262 I277 Q278 S283 I284 M285 | Y261-Y281 HydrophobicContact CD1-CD2 4.26Å; Y261-Y281 AromaticContact CE1-CD2 3.65Å; Y261-Y281 HydrophobicContact CE1-CD2 3.65Å; Y261-Y281 HydrophobicContact CE1-CE2 4.35Å; Y261-Y281 AromaticContact CZ-CD2 3.96Å; F262-Y281 HydrophobicContact CE2-CE2 4.37Å; F262-Y281 HydrophobicContact CZ-CE2 4.13Å; I277-Y281 WeakPolarHBondContact O-CB 3.45Å; I277-Y281 PolarHBondContact O-N 3.28Å; Q278-Y281 PolarHBondContact O-N 2.89Å; Y281-S283 VanDerWaalsContact C-N 3.33Å; Y281-S283 PolarHBondContact O-N 3.22Å; Y281-I284 PolarHBondContact O-N 3.26Å; Y281-M285 HydrophobicContact CE1-CE 4.27Å; Y281-M285 HydrophobicContact CE1-SD 3.7Å; Y281-M285 WeakPolarHBondContact O-CB 3.11Å; Y281-M285 PolarHBondContact O-N 2.86Å; Y281-M285 PolarHBondContact OH-SD 2.92Å; Y281-M285 VanDerWaalsContact OH-SD 3.39Å |
| 282 | L | 83.1 | Confident | 82.9 | Confident | 15 Ų | 15 | 57.8 Ų | 57.8 | 8% | 0.079 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -60.2 | -42.5 | 176.3 | -73.4 | 171.3 | 0 | 0 | 0 | 111.8 | W28 Y32 A86 Q278 Q279 V280 M285 W286 | W28-L282 HydrophobicContact CD2-CB 4.43Å; W28-L282 HydrophobicContact CZ2-CB 4.21Å; Y32-L282 PolarHBondContact OH-O 3.27Å; A86-L282 HydrophobicContact CB-CD2 4.32Å; Q278-L282 VanDerWaalsContact O-CG 3.32Å; Q278-L282 WeakPolarHBondContact O-CG 3.12Å; Q278-L282 PolarHBondContact O-N 3.31Å; Q279-L282 PolarHBondContact O-N 3.33Å; V280-L282 PolarHBondContact O-N 3.31Å; L282-M285 HydrophobicContact CD2-CE 4.49Å; L282-M285 PolarHBondContact O-N 3.05Å; L282-W286 VanDerWaalsContact O-CB 3.23Å; L282-W286 WeakPolarHBondContact O-CB 3.23Å; L282-W286 PolarHBondContact O-N 3.21Å |
| 283 | S | 88.5 | Confident | 84.1 | Confident | 52 Ų | 52 | 55.3 Ų | 55.3 | 36% | 0.364 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -65.3 | -44.3 | 178.6 | -52.9 | 0 | 0 | 0 | 0 | 112.5 | W28 Q279 V280 Y281 W286 L287 | W28-S283 VanDerWaalsContact CH2-CA 3.47Å; W28-S283 WeakPolarHBondContact CH2-OG 3.48Å; W28-S283 WeakPolarHBondContact CZ2-OG 3.42Å; Q279-S283 WeakPolarHBondContact O-CB 3.31Å; Q279-S283 PolarHBondContact O-N 2.83Å; Q279-S283 PolarHBondContact O-OG 3.4Å; V280-S283 PolarHBondContact O-N 3.22Å; Y281-S283 VanDerWaalsContact C-N 3.33Å; Y281-S283 PolarHBondContact O-N 3.22Å; S283-W286 PolarHBondContact O-N 3.48Å; S283-L287 WeakPolarHBondContact O-CB 3.22Å; S283-L287 PolarHBondContact O-N 2.98Å |
| 284 | I | 90.6 | Very high | 85.1 | Confident | 25 Ų | 25 | 49.8 Ų | 49.8 | 13% | 0.128 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66 | -43.6 | 178.5 | -71.4 | 176.7 | 0 | 0 | 0 | 110.7 | P257 Y258 Y261 V280 Y281 L287 A288 | P257-I284 HydrophobicContact CB-CD1 4.47Å; P257-I284 HydrophobicContact CB-CG1 4.1Å; P257-I284 HydrophobicContact CB-CG2 4.15Å; Y258-I284 HydrophobicContact CD2-CG2 4.44Å; Y261-I284 HydrophobicContact CD2-CD1 3.81Å; Y261-I284 HydrophobicContact CG-CD1 4.04Å; V280-I284 HydrophobicContact CG1-CD1 3.59Å; V280-I284 HydrophobicContact CG1-CG1 4.31Å; V280-I284 WeakPolarHBondContact O-CB 3.35Å; V280-I284 VanDerWaalsContact O-CG1 3.25Å; V280-I284 WeakPolarHBondContact O-CG1 3.49Å; V280-I284 PolarHBondContact O-N 2.74Å; Y281-I284 PolarHBondContact O-N 3.26Å; I284-L287 PolarHBondContact O-N 3.35Å; I284-A288 PolarHBondContact O-N 3.44Å |
| 285 | M | 86.4 | Confident | 85.9 | Confident | 7 Ų | 7 | 42.2 Ų | 42.2 | 3% | 0.034 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -66.6 | -42.4 | 177.9 | -170.7 | 169 | 83.9 | 0 | 0 | 111.1 | Y32 N82 Y281 L282 L287 A288 M289 | Y32-M285 HydrophobicContact CE1-CE 4.31Å; Y32-M285 WeakPolarHBondContact OH-CE 3.4Å; N82-M285 VanDerWaalsContact CG-CE 3.47Å; N82-M285 WeakPolarHBondContact ND2-CE 3.31Å; N82-M285 PolarHBondContact ND2-SD 3.32Å; N82-M285 WeakPolarHBondContact OD1-CE 3.17Å; Y281-M285 HydrophobicContact CE1-CE 4.27Å; Y281-M285 HydrophobicContact CE1-SD 3.7Å; Y281-M285 WeakPolarHBondContact O-CB 3.11Å; Y281-M285 PolarHBondContact O-N 2.86Å; Y281-M285 PolarHBondContact OH-SD 2.92Å; Y281-M285 VanDerWaalsContact OH-SD 3.39Å; L282-M285 HydrophobicContact CD2-CE 4.49Å; L282-M285 PolarHBondContact O-N 3.05Å; M285-L287 VanDerWaalsContact C-N 3.31Å; M285-L287 PolarHBondContact O-N 3.46Å; M285-A288 PolarHBondContact O-N 3.15Å; M285-M289 HydrophobicContact CG-CG 4.37Å; M285-M289 VanDerWaalsContact O-CG 3.26Å; M285-M289 WeakPolarHBondContact O-CG 3.2Å; M285-M289 PolarHBondContact O-N 3.48Å |
| 286 | W | 89.8 | Confident | 86.9 | Confident | 70 Ų | 70 | 35.4 Ų | 35.4 | 27% | 0.265 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -57.2 | -46.6 | 174.8 | 178 | 85.3 | 0 | 0 | 0 | 111.2 | W28 A31 Y32 V35 L282 S283 M289 S290 | W28-W286 HydrophobicContact CZ3-CB 3.72Å; W28-W286 AromaticContact CZ3-CG 3.88Å; W28-W286 HydrophobicContact CZ3-CG 3.88Å; A31-W286 PolarHBondContact O-NE1 3.19Å; Y32-W286 AromaticContact CD2-CD1 3.91Å; Y32-W286 HydrophobicContact CE1-CB 4.33Å; Y32-W286 HydrophobicContact CE2-CB 3.9Å; Y32-W286 AromaticContact CE2-CD1 3.98Å; Y32-W286 HydrophobicContact CE2-CG 4.35Å; Y32-W286 PolarHBondContact OH-N 3.19Å; Y32-W286 VanDerWaalsContact OH-N 3.09Å; V35-W286 HydrophobicContact CG2-CZ2 4.16Å; L282-W286 VanDerWaalsContact O-CB 3.23Å; L282-W286 WeakPolarHBondContact O-CB 3.23Å; L282-W286 PolarHBondContact O-N 3.21Å; S283-W286 PolarHBondContact O-N 3.48Å; W286-M289 PolarHBondContact O-N 3.47Å; W286-S290 WeakPolarHBondContact O-CB 3.43Å; W286-S290 PolarHBondContact O-N 3.25Å |
| 287 | L | 92.6 | Very high | 87.7 | Confident | 51 Ų | 51 | 31.8 Ų | 31.8 | 27% | 0.267 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -62.1 | -44.8 | 177.7 | -178.4 | 63.8 | 0 | 0 | 0 | 111.8 | C254 P257 S283 I284 M285 S290 | C254-L287 HydrophobicContact CB-CG 4.49Å; P257-L287 HydrophobicContact CG-CD2 3.84Å; S283-L287 WeakPolarHBondContact O-CB 3.22Å; S283-L287 PolarHBondContact O-N 2.98Å; I284-L287 PolarHBondContact O-N 3.35Å; M285-L287 VanDerWaalsContact C-N 3.31Å; M285-L287 PolarHBondContact O-N 3.46Å; L287-S290 WeakPolarHBondContact O-CB 3.42Å; L287-S290 PolarHBondContact O-N 3.05Å; L287-S290 PolarHBondContact O-OG 3.23Å |
| 288 | A | 90.6 | Very high | 88.2 | Confident | 1 Ų | 1 | 31.1 Ų | 31.1 | 1% | 0.008 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -60.1 | -47.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | W255 Y258 I284 M285 S290 S291 | W255-A288 HydrophobicContact CD2-CB 4.37Å; W255-A288 HydrophobicContact CE3-CB 4.36Å; W255-A288 HydrophobicContact CH2-CB 4.45Å; W255-A288 HydrophobicContact CZ2-CB 4.48Å; W255-A288 HydrophobicContact CZ3-CB 4.4Å; Y258-A288 HydrophobicContact CD2-CB 4.26Å; Y258-A288 HydrophobicContact CG-CB 4.45Å; I284-A288 PolarHBondContact O-N 3.44Å; M285-A288 PolarHBondContact O-N 3.15Å; A288-S290 VanDerWaalsContact C-N 3.28Å; A288-S290 PolarHBondContact O-N 2.94Å; A288-S291 WeakPolarHBondContact O-CB 3.3Å; A288-S291 PolarHBondContact O-N 3.25Å; A288-S291 PolarHBondContact O-OG 2.97Å |
| 289 | M | 88.1 | Confident | 88.8 | Confident | 7 Ų | 7 | 28.5 Ų | 28.5 | 3% | 0.034 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -65.8 | -32.2 | 178.6 | -60.5 | -48.4 | -80 | 0 | 0 | 112.2 | M74 T79 M285 W286 S291 T292 | M74-M289 HydrophobicContact CE-CE 3.63Å; M74-M289 HydrophobicContact CE-SD 3.65Å; M74-M289 HydrophobicContact CG-CE 4.13Å; T79-M289 HydrophobicContact CG2-CE 4.39Å; T79-M289 WeakPolarHBondContact OG1-CE 3.42Å; M285-M289 HydrophobicContact CG-CG 4.37Å; M285-M289 VanDerWaalsContact O-CG 3.26Å; M285-M289 WeakPolarHBondContact O-CG 3.2Å; M285-M289 PolarHBondContact O-N 3.48Å; W286-M289 PolarHBondContact O-N 3.47Å; M289-S291 PolarHBondContact O-N 2.86Å; M289-S291 VanDerWaalsContact O-N 3.14Å; M289-T292 PolarHBondContact O-N 2.78Å; M289-T292 PolarHBondContact O-OG1 2.97Å |
| 290 | S | 91.8 | Very high | 89.2 | Confident | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -60.8 | -21.2 | 177.3 | 83.3 | 0 | 0 | 0 | 0 | 112.9 | W286 L287 A288 T292 M293 Y294 | W286-S290 WeakPolarHBondContact O-CB 3.43Å; W286-S290 PolarHBondContact O-N 3.25Å; L287-S290 WeakPolarHBondContact O-CB 3.42Å; L287-S290 PolarHBondContact O-N 3.05Å; L287-S290 PolarHBondContact O-OG 3.23Å; A288-S290 VanDerWaalsContact C-N 3.28Å; A288-S290 PolarHBondContact O-N 2.94Å; S290-T292 PolarHBondContact O-N 3.33Å; S290-T292 VanDerWaalsContact O-N 3.09Å; S290-M293 VanDerWaalsContact O-CG 3.27Å; S290-M293 WeakPolarHBondContact O-CG 3.34Å; S290-M293 PolarHBondContact O-N 3.49Å; S290-Y294 VanDerWaalsContact O-CD2 3.24Å; S290-Y294 WeakPolarHBondContact O-CD2 3.22Å; S290-Y294 WeakPolarHBondContact O-CE2 3.13Å; S290-Y294 VanDerWaalsContact OG-CE2 3.32Å; S290-Y294 WeakPolarHBondContact OG-CE2 3.35Å; S290-Y294 PolarHBondContact OG-OH 2.93Å |
| 291 | S | 91.4 | Very high | 89.2 | Confident | 9 Ų | 9 | 29.1 Ų | 29.1 | 6% | 0.063 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -55.2 | -32.7 | 176.4 | 79.3 | 0 | 0 | 0 | 0 | 112.8 | W255 A288 M289 M293 | W255-S291 PolarHBondContact NE1-OG 3.41Å; A288-S291 WeakPolarHBondContact O-CB 3.3Å; A288-S291 PolarHBondContact O-N 3.25Å; A288-S291 PolarHBondContact O-OG 2.97Å; M289-S291 PolarHBondContact O-N 2.86Å; M289-S291 VanDerWaalsContact O-N 3.14Å; S291-M293 VanDerWaalsContact C-N 3.3Å; S291-M293 PolarHBondContact O-N 3.44Å |
| 292 | T | 90.2 | Very high | 89 | Confident | 1 Ų | 1 | 28 Ų | 28 | 1% | 0.006 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -70.1 | -23.4 | -179.1 | 62.3 | 0 | 0 | 0 | 0 | 113.4 | A39 N43 D71 M289 S290 | A39-T292 VanDerWaalsContact CB-OG1 3.31Å; A39-T292 WeakPolarHBondContact CB-OG1 3.47Å; N43-T292 PolarHBondContact ND2-O 2.92Å; D71-T292 HydrophobicContact CB-CG2 4.1Å; M289-T292 PolarHBondContact O-N 2.78Å; M289-T292 PolarHBondContact O-OG1 2.97Å; S290-T292 PolarHBondContact O-N 3.33Å; S290-T292 VanDerWaalsContact O-N 3.09Å |
| 293 | M | 92.5 | Very high | 89 | Confident | 13 Ų | 13 | 29 Ų | 29 | 6% | 0.064 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -86 | -27.3 | -178 | 92.3 | -173.5 | 165.3 | 0 | 0 | 112.7 | F34 V35 V38 A39 S290 S291 N295 I297 | F34-M293 HydrophobicContact CE1-SD 4.39Å; V35-M293 HydrophobicContact CB-SD 4.3Å; V35-M293 HydrophobicContact CG1-SD 4.37Å; V35-M293 HydrophobicContact CG2-CE 4.42Å; V35-M293 HydrophobicContact CG2-SD 3.8Å; V38-M293 HydrophobicContact CB-CB 4.12Å; V38-M293 HydrophobicContact CG1-CB 3.86Å; V38-M293 HydrophobicContact CG1-CG 4.35Å; A39-M293 HydrophobicContact CB-CB 4.23Å; S290-M293 VanDerWaalsContact O-CG 3.27Å; S290-M293 WeakPolarHBondContact O-CG 3.34Å; S290-M293 PolarHBondContact O-N 3.49Å; S291-M293 VanDerWaalsContact C-N 3.3Å; S291-M293 PolarHBondContact O-N 3.44Å; M293-N295 PolarHBondContact O-N 3.31Å; M293-I297 WeakPolarHBondContact O-CD1 3.38Å; M293-I297 WeakPolarHBondContact O-CG1 3.38Å |
| 294 | Y | 92.1 | Very high | 88.7 | Confident | 58 Ų | 58 | 28.2 Ų | 28.2 | 23% | 0.227 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -72.5 | -28.7 | -176.3 | -58.6 | -54.1 | 0 | 0 | 0 | 113 | T250 S290 I297 I298 | T250-Y294 HydrophobicContact CG2-CD2 3.37Å; T250-Y294 HydrophobicContact CG2-CE2 4.1Å; T250-Y294 HydrophobicContact CG2-CG 3.86Å; S290-Y294 VanDerWaalsContact O-CD2 3.24Å; S290-Y294 WeakPolarHBondContact O-CD2 3.22Å; S290-Y294 WeakPolarHBondContact O-CE2 3.13Å; S290-Y294 VanDerWaalsContact OG-CE2 3.32Å; S290-Y294 WeakPolarHBondContact OG-CE2 3.35Å; S290-Y294 PolarHBondContact OG-OH 2.93Å; Y294-I297 WeakPolarHBondContact O-CB 3.32Å; Y294-I297 PolarHBondContact O-N 2.74Å; Y294-I297 VanDerWaalsContact O-N 3.14Å; Y294-I298 WeakPolarHBondContact O-CB 3.4Å; Y294-I298 WeakPolarHBondContact O-CG1 3.35Å; Y294-I298 PolarHBondContact O-N 3.23Å |
| 295 | N | 90.1 | Very high | 88.4 | Confident | 12 Ų | 12 | 31.8 Ų | 31.8 | 6% | 0.064 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -55 | -57.6 | -176.4 | -72.7 | -19.1 | 0 | 0 | 0 | 112.5 | D71 M293 I297 I298 Y299 | D71-N295 PolarHBondContact OD2-ND2 3.47Å; M293-N295 PolarHBondContact O-N 3.31Å; N295-I297 VanDerWaalsContact C-N 3.31Å; N295-I297 PolarHBondContact O-N 2.88Å; N295-I298 PolarHBondContact O-N 3.42Å; N295-Y299 HydrophobicContact CB-CE2 4.13Å; N295-Y299 VanDerWaalsContact O-CD1 3.31Å; N295-Y299 WeakPolarHBondContact O-CD1 3.23Å; N295-Y299 VanDerWaalsContact O-CD2 3.25Å; N295-Y299 WeakPolarHBondContact O-CD2 3.44Å; N295-Y299 PolarHBondContact O-N 2.87Å |
| 296 | P | 90.4 | Very high | 88.3 | Confident | 4 Ų | 4 | 31.4 Ų | 31.4 | 3% | 0.026 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -55 | -40.8 | 173.4 | -27.4 | 33.9 | 0 | 0 | 0 | 114.5 | N43 V46 Y299 C300 F310 | N43-P296 HydrophobicContact CB-CG 4.46Å; N43-P296 WeakPolarHBondContact OD1-CG 3.46Å; V46-P296 HydrophobicContact CG2-CB 4.05Å; V46-P296 HydrophobicContact CG2-CG 4.15Å; P296-Y299 PolarHBondContact O-N 2.97Å; P296-C300 WeakPolarHBondContact O-CB 3.04Å; P296-C300 PolarHBondContact O-N 2.75Å; P296-F310 HydrophobicContact CB-CZ 4.01Å |
| 297 | I | 91 | Very high | 88.2 | Confident | 78 Ų | 78 | 32.9 Ų | 32.9 | 40% | 0.4 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -63.5 | -48.5 | -178.9 | -60.5 | 171.6 | 0 | 0 | 0 | 109.8 | V38 M293 Y294 N295 Y299 C300 C301 | V38-I297 HydrophobicContact CG1-CD1 4.25Å; M293-I297 WeakPolarHBondContact O-CD1 3.38Å; M293-I297 WeakPolarHBondContact O-CG1 3.38Å; Y294-I297 WeakPolarHBondContact O-CB 3.32Å; Y294-I297 PolarHBondContact O-N 2.74Å; Y294-I297 VanDerWaalsContact O-N 3.14Å; N295-I297 VanDerWaalsContact C-N 3.31Å; N295-I297 PolarHBondContact O-N 2.88Å; I297-Y299 VanDerWaalsContact C-N 3.28Å; I297-Y299 PolarHBondContact O-N 3.46Å; I297-C300 PolarHBondContact O-N 3.16Å; I297-C301 PolarHBondContact O-N 2.94Å; I297-C301 PolarHBondContact O-SG 3.44Å; I297-C301 VanDerWaalsContact O-SG 3.32Å |
| 298 | I | 89.6 | Confident | 87.9 | Confident | 16 Ų | 16 | 30.5 Ų | 30.5 | 8% | 0.082 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.1 | -41.7 | 177.9 | -65.3 | 164.9 | 0 | 0 | 0 | 110.2 | M243 V246 V247 Y294 N295 C301 L302 | M243-I298 HydrophobicContact CG-CG2 4.04Å; V246-I298 HydrophobicContact CG1-CD1 4.25Å; V246-I298 HydrophobicContact CG1-CG1 4.4Å; V247-I298 HydrophobicContact CB-CD1 4.47Å; V247-I298 HydrophobicContact CG2-CB 4.31Å; V247-I298 HydrophobicContact CG2-CD1 3.93Å; V247-I298 HydrophobicContact CG2-CG2 3.64Å; Y294-I298 WeakPolarHBondContact O-CB 3.4Å; Y294-I298 WeakPolarHBondContact O-CG1 3.35Å; Y294-I298 PolarHBondContact O-N 3.23Å; N295-I298 PolarHBondContact O-N 3.42Å; I298-C301 PolarHBondContact O-N 3.29Å; I298-L302 HydrophobicContact CG2-CD1 3.8Å; I298-L302 HydrophobicContact CG2-CG 4.44Å; I298-L302 WeakPolarHBondContact O-CB 3.07Å; I298-L302 PolarHBondContact O-N 2.97Å |
| 299 | Y | 87.6 | Confident | 87.6 | Confident | 5 Ų | 5 | 30.4 Ų | 30.4 | 2% | 0.02 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -65 | -42 | 178.3 | -57.3 | -18.2 | 0 | 0 | 0 | 112 | V46 L64 L67 M243 V247 N295 P296 I297 N303 | V46-Y299 HydrophobicContact CG1-CD2 4.34Å; V46-Y299 HydrophobicContact CG2-CD2 4.04Å; L64-Y299 HydrophobicContact CD2-CE1 4.08Å; L64-Y299 HydrophobicContact CD2-CE2 4.05Å; L64-Y299 WeakPolarHBondContact CD2-OH 3.43Å; L67-Y299 WeakPolarHBondContact CD2-OH 3.31Å; M243-Y299 HydrophobicContact CE-CD1 3.18Å; M243-Y299 HydrophobicContact CE-CE1 3.57Å; M243-Y299 HydrophobicContact CE-CG 4.22Å; V247-Y299 HydrophobicContact CG2-CE1 4.23Å; N295-Y299 HydrophobicContact CB-CE2 4.13Å; N295-Y299 VanDerWaalsContact O-CD1 3.31Å; N295-Y299 WeakPolarHBondContact O-CD1 3.23Å; N295-Y299 VanDerWaalsContact O-CD2 3.25Å; N295-Y299 WeakPolarHBondContact O-CD2 3.44Å; N295-Y299 PolarHBondContact O-N 2.87Å; P296-Y299 PolarHBondContact O-N 2.97Å; I297-Y299 VanDerWaalsContact C-N 3.28Å; I297-Y299 PolarHBondContact O-N 3.46Å; Y299-N303 WeakPolarHBondContact O-CB 3.42Å; Y299-N303 PolarHBondContact O-N 3.26Å |
| 300 | C | 87.8 | Confident | 87.6 | Confident | 37 Ų | 37 | 30.9 Ų | 30.9 | 25% | 0.25 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64 | -43.2 | 176.4 | -171.4 | 0 | 0 | 0 | 0 | 112.1 | P296 I297 R307 F310 | P296-C300 WeakPolarHBondContact O-CB 3.04Å; P296-C300 PolarHBondContact O-N 2.75Å; I297-C300 PolarHBondContact O-N 3.16Å; C300-R307 WeakPolarHBondContact O-CB 3.48Å; C300-R307 WeakPolarHBondContact O-CD 3.42Å; C300-F310 HydrophobicContact CB-CD2 3.66Å; C300-F310 HydrophobicContact CB-CE2 3.86Å; C300-F310 HydrophobicContact CB-CG 4.26Å |
| 301 | C | 85.6 | Confident | 87.3 | Confident | 78 Ų | 78 | 33.9 Ų | 33.9 | 53% | 0.527 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -72.5 | -40.7 | -178.3 | -66.6 | 0 | 0 | 0 | 0 | 112.8 | I297 I298 | I297-C301 PolarHBondContact O-N 2.94Å; I297-C301 PolarHBondContact O-SG 3.44Å; I297-C301 VanDerWaalsContact O-SG 3.32Å; I298-C301 PolarHBondContact O-N 3.29Å |
| 302 | L | 80.2 | Confident | 87.1 | Confident | 50 Ų | 50 | 35.9 Ų | 35.9 | 26% | 0.262 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -104.1 | -18.3 | -165.8 | -57.7 | -178 | 0 | 0 | 0 | 114.4 | K239 M243 I298 | K239-L302 WeakPolarHBondContact CE-O 3.17Å; M243-L302 VanDerWaalsContact CA-CD1 3.5Å; M243-L302 HydrophobicContact CB-CB 3.81Å; M243-L302 HydrophobicContact CB-CD1 3.61Å; M243-L302 HydrophobicContact CB-CG 4.35Å; M243-L302 HydrophobicContact CG-CB 3.82Å; M243-L302 HydrophobicContact CG-CD1 3.87Å; M243-L302 HydrophobicContact CG-CG 4.48Å; M243-L302 HydrophobicContact SD-CB 3.84Å; I298-L302 HydrophobicContact CG2-CD1 3.8Å; I298-L302 HydrophobicContact CG2-CG 4.44Å; I298-L302 WeakPolarHBondContact O-CB 3.07Å; I298-L302 PolarHBondContact O-N 2.97Å |
| 303 | N | 82.6 | Confident | 86.8 | Confident | 36 Ų | 36 | 36.6 Ų | 36.6 | 19% | 0.193 | 18% | 0.182 | C | C | . | . | trans | -114.8 | 115.5 | 179.6 | -169.7 | -36.5 | 0 | 0 | 0 | 111.7 | M243 Y299 R305 F306 R307 | M243-N303 HydrophobicContact SD-CB 4.08Å; Y299-N303 WeakPolarHBondContact O-CB 3.42Å; Y299-N303 PolarHBondContact O-N 3.26Å; N303-R305 VanDerWaalsContact C-N 3.27Å; N303-R305 PolarHBondContact O-N 3.41Å; N303-R305 PolarHBondContact OD1-N 2.91Å; N303-R305 VanDerWaalsContact OD1-N 3.11Å; N303-F306 HydrophobicContact CB-CB 4.18Å; N303-F306 HydrophobicContact CB-CD2 3.84Å; N303-F306 WeakPolarHBondContact ND2-CD2 3.3Å; N303-F306 PolarHBondContact O-N 3.35Å; N303-R307 WeakPolarHBondContact O-CB 3.39Å; N303-R307 PolarHBondContact O-N 2.96Å | ||
| 304 | S | 81.6 | Confident | 86.5 | Confident | 34 Ų | 34 | 39.4 Ų | 39.4 | 24% | 0.238 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -59.6 | -37.2 | -176 | 61 | 0 | 0 | 0 | 0 | 112.7 | R307 A308 E329 | S304-R307 WeakPolarHBondContact O-CB 3.4Å; S304-R307 PolarHBondContact O-N 3.41Å; S304-A308 WeakPolarHBondContact O-CB 3.2Å; S304-A308 PolarHBondContact O-N 2.97Å; S304-E329 WeakPolarHBondContact CB-OE2 3.37Å; S304-E329 PolarHBondContact OG-OE1 3.14Å; S304-E329 PolarHBondContact OG-OE2 3.5Å |
| 305 | R | 83.9 | Confident | 86 | Confident | 100 Ų | 100 | 42.3 Ų | 42.3 | 38% | 0.377 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -70.9 | -41.2 | -179.3 | -55.1 | -175.9 | -146 | 162.3 | 5.5 | 111.9 | M56 N303 A308 G309 E329 | M56-R305 HydrophobicContact CE-CB 4.03Å; M56-R305 HydrophobicContact SD-CB 3.84Å; N303-R305 VanDerWaalsContact C-N 3.27Å; N303-R305 PolarHBondContact O-N 3.41Å; N303-R305 PolarHBondContact OD1-N 2.91Å; N303-R305 VanDerWaalsContact OD1-N 3.11Å; R305-A308 PolarHBondContact O-N 3.03Å; R305-G309 PolarHBondContact O-N 3.26Å; R305-E329 PolarHBondContact N-OE2 3.35Å |
| 306 | F | 85.2 | Confident | 85.4 | Confident | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -65.2 | -43.3 | 173.3 | -83.1 | -73.7 | 0 | 0 | 0 | 110.3 | V46 I49 I50 M56 L64 N303 A308 G309 F310 | V46-F306 HydrophobicContact CG1-CE1 4.1Å; I49-F306 HydrophobicContact CB-CD1 4.48Å; I49-F306 HydrophobicContact CD1-CD1 4.18Å; I49-F306 HydrophobicContact CG2-CD1 3.94Å; I49-F306 HydrophobicContact CG2-CE1 4.1Å; I50-F306 HydrophobicContact CD1-CE1 4.19Å; I50-F306 HydrophobicContact CD1-CZ 4.1Å; I50-F306 HydrophobicContact CG1-CE1 3.96Å; I50-F306 HydrophobicContact CG1-CZ 4.04Å; M56-F306 HydrophobicContact CE-CD1 4.21Å; M56-F306 HydrophobicContact CE-CD2 3.97Å; M56-F306 HydrophobicContact CE-CE1 4.01Å; M56-F306 HydrophobicContact CE-CE2 3.77Å; M56-F306 HydrophobicContact CE-CG 4.19Å; M56-F306 HydrophobicContact CE-CZ 3.79Å; L64-F306 HydrophobicContact CD1-CE2 3.79Å; L64-F306 HydrophobicContact CD1-CZ 3.83Å; N303-F306 HydrophobicContact CB-CB 4.18Å; N303-F306 HydrophobicContact CB-CD2 3.84Å; N303-F306 WeakPolarHBondContact ND2-CD2 3.3Å; N303-F306 PolarHBondContact O-N 3.35Å; F306-A308 VanDerWaalsContact C-N 3.32Å; F306-A308 PolarHBondContact O-N 2.03Å; F306-G309 CarbonylContact O-C 3.21Å; F306-G309 WeakPolarHBondContact O-CA 3.47Å; F306-G309 PolarHBondContact O-N 3.46Å; F306-F310 HydrophobicContact CB-CD2 4.39Å; F306-F310 HydrophobicContact CB-CE2 4.38Å; F306-F310 WeakPolarHBondContact O-CD2 3.42Å; F306-F310 PolarHBondContact O-N 3.43Å |
| 307 | R | 87.6 | Confident | 85.1 | Confident | 101 Ų | 101 | 53.3 Ų | 53.3 | 38% | 0.381 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -56.6 | -44.3 | 175.6 | -167.5 | 168.5 | 58.9 | -156.5 | 6.5 | 112.7 | C300 N303 S304 G309 F310 K311 | C300-R307 WeakPolarHBondContact O-CB 3.48Å; C300-R307 WeakPolarHBondContact O-CD 3.42Å; N303-R307 WeakPolarHBondContact O-CB 3.39Å; N303-R307 PolarHBondContact O-N 2.96Å; S304-R307 WeakPolarHBondContact O-CB 3.4Å; S304-R307 PolarHBondContact O-N 3.41Å; R307-G309 VanDerWaalsContact C-N 3.34Å; R307-F310 PolarHBondContact O-N 2.82Å; R307-K311 WeakPolarHBondContact O-CG 3.15Å; R307-K311 PolarHBondContact O-N 3.02Å |
| 308 | A | 85.7 | Confident | 84.3 | Confident | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -59.1 | -44.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | S304 R305 F306 K311 Q312 D326 L330 | S304-A308 WeakPolarHBondContact O-CB 3.2Å; S304-A308 PolarHBondContact O-N 2.97Å; R305-A308 PolarHBondContact O-N 3.03Å; F306-A308 VanDerWaalsContact C-N 3.32Å; F306-A308 PolarHBondContact O-N 2.03Å; A308-K311 PolarHBondContact O-N 2.58Å; A308-Q312 PolarHBondContact O-N 2.87Å; A308-D326 HydrophobicContact CB-CB 3.74Å; A308-L330 HydrophobicContact CB-CD1 4.16Å; A308-L330 HydrophobicContact CB-CG 4.2Å |
| 309 | G | 85.6 | Confident | 83.8 | Confident | 0 Ų | 0 | 63.6 Ų | 63.6 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.8 | -41.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | R305 F306 R307 Q312 A313 | R305-G309 PolarHBondContact O-N 3.26Å; F306-G309 CarbonylContact O-C 3.21Å; F306-G309 WeakPolarHBondContact O-CA 3.47Å; F306-G309 PolarHBondContact O-N 3.46Å; R307-G309 VanDerWaalsContact C-N 3.34Å; G309-Q312 WeakPolarHBondContact O-CB 3.5Å; G309-Q312 PolarHBondContact O-N 3.24Å; G309-A313 PolarHBondContact O-N 3.46Å |
| 310 | F | 87 | Confident | 83.4 | Confident | 17 Ų | 17 | 66 Ų | 66 | 8% | 0.075 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.4 | -44.6 | 175.1 | -83.6 | -74.8 | 0 | 0 | 0 | 111.6 | I45 V46 I49 P296 C300 F306 R307 Q312 A313 F314 | I45-F310 HydrophobicContact CB-CD1 4.39Å; I45-F310 HydrophobicContact CB-CE1 3.87Å; I45-F310 HydrophobicContact CD1-CD1 4.49Å; I45-F310 HydrophobicContact CD1-CE1 4.32Å; I45-F310 HydrophobicContact CG2-CD1 3.53Å; I45-F310 HydrophobicContact CG2-CE1 3.41Å; I45-F310 VanDerWaalsContact CG2-CE1 3.41Å; I45-F310 HydrophobicContact CG2-CG 4.34Å; I45-F310 HydrophobicContact CG2-CZ 4.13Å; V46-F310 HydrophobicContact CG2-CE2 4.38Å; V46-F310 HydrophobicContact CG2-CZ 3.85Å; I49-F310 HydrophobicContact CD1-CD2 3.95Å; I49-F310 HydrophobicContact CD1-CE2 4.07Å; I49-F310 HydrophobicContact CD1-CG 4.19Å; I49-F310 HydrophobicContact CD1-CZ 4.45Å; P296-F310 HydrophobicContact CB-CZ 4.01Å; C300-F310 HydrophobicContact CB-CD2 3.66Å; C300-F310 HydrophobicContact CB-CE2 3.86Å; C300-F310 HydrophobicContact CB-CG 4.26Å; F306-F310 HydrophobicContact CB-CD2 4.39Å; F306-F310 HydrophobicContact CB-CE2 4.38Å; F306-F310 WeakPolarHBondContact O-CD2 3.42Å; F306-F310 PolarHBondContact O-N 3.43Å; R307-F310 PolarHBondContact O-N 2.82Å; F310-Q312 PolarHBondContact O-N 3.09Å; F310-A313 PolarHBondContact O-N 3.23Å; F310-A313 VanDerWaalsContact O-N 3.17Å; F310-F314 HydrophobicContact CD1-CE2 4.08Å; F310-F314 VanDerWaalsContact O-CD2 3.25Å; F310-F314 WeakPolarHBondContact O-CD2 3.39Å; F310-F314 PolarHBondContact O-N 3.06Å |
| 311 | K | 86.8 | Confident | 82.7 | Confident | 63 Ų | 63 | 73.1 Ų | 73.1 | 27% | 0.274 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -59.6 | -37.7 | 174 | -69.9 | 178.2 | -178.8 | 176.8 | 0 | 111.9 | R307 A308 F314 R315 I320 V322 D326 | R307-K311 WeakPolarHBondContact O-CG 3.15Å; R307-K311 PolarHBondContact O-N 3.02Å; A308-K311 PolarHBondContact O-N 2.58Å; K311-F314 CarbonylContact O-C 3.58Å; K311-F314 PolarHBondContact O-N 3.14Å; K311-R315 PolarHBondContact O-N 3Å; K311-I320 HydrophobicContact CB-CG2 3.87Å; K311-I320 HydrophobicContact CG-CG2 4.1Å; K311-I320 WeakPolarHBondContact O-CG2 3.4Å; K311-V322 HydrophobicContact CB-CG2 4.14Å; K311-V322 VanDerWaalsContact O-CG2 3.3Å; K311-V322 WeakPolarHBondContact O-CG2 3.21Å; K311-D326 VanDerWaalsContact CD-OD2 3.27Å; K311-D326 WeakPolarHBondContact CD-OD2 3.17Å; K311-D326 IonicContact NZ-OD1 3.63Å; K311-D326 PolarHBondContact NZ-OD1 3.07Å; K311-D326 IonicContact NZ-OD2 3.02Å; K311-D326 PolarHBondContact NZ-OD2 3.23Å |
| 312 | Q | 85.3 | Confident | 82.2 | Confident | 50 Ų | 50 | 71.3 Ų | 71.3 | 23% | 0.234 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -65.6 | -41.7 | 175.7 | -171.7 | 175.7 | -5.1 | 0 | 0 | 112.1 | W48 H53 A308 G309 F310 F314 R315 L330 | W48-Q312 HydrophobicContact CH2-CG 4.22Å; H53-Q312 PolarHBondContact CE1-OE1 2.77Å; A308-Q312 PolarHBondContact O-N 2.87Å; G309-Q312 WeakPolarHBondContact O-CB 3.5Å; G309-Q312 PolarHBondContact O-N 3.24Å; F310-Q312 PolarHBondContact O-N 3.09Å; Q312-F314 VanDerWaalsContact C-N 3.33Å; Q312-F314 PolarHBondContact O-N 3.01Å; Q312-R315 WeakPolarHBondContact O-CB 3.37Å; Q312-R315 WeakPolarHBondContact O-CD 3.48Å; Q312-R315 VanDerWaalsContact O-CG 3.27Å; Q312-R315 WeakPolarHBondContact O-CG 3.4Å; Q312-R315 PolarHBondContact O-N 3.47Å; Q312-L330 VanDerWaalsContact OE1-CD1 3.25Å |
| 313 | A | 84.6 | Confident | 82.1 | Confident | 16 Ų | 16 | 71.5 Ų | 71.5 | 13% | 0.132 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -63.8 | -37.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | I45 W48 G309 F310 R315 W316 | I45-A313 HydrophobicContact CG2-CB 3.99Å; W48-A313 HydrophobicContact CE3-CB 4.33Å; W48-A313 HydrophobicContact CZ3-CB 3.92Å; G309-A313 PolarHBondContact O-N 3.46Å; F310-A313 PolarHBondContact O-N 3.23Å; F310-A313 VanDerWaalsContact O-N 3.17Å; A313-R315 PolarHBondContact O-N 3.31Å; A313-W316 WeakPolarHBondContact O-CH2 3.29Å; A313-W316 WeakPolarHBondContact O-CZ2 3.36Å |
| 314 | F | 85.9 | Confident | 81.4 | Confident | 72 Ų | 72 | 74.1 Ų | 74.1 | 32% | 0.316 | 36% | 0.357 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.2 | 29.3 | 179.4 | -64.2 | -73.5 | 0 | 0 | 0 | 113.8 | I45 F310 K311 Q312 W316 C317 I320 | I45-F314 HydrophobicContact CD1-CE1 4.4Å; I45-F314 HydrophobicContact CD1-CE2 3.76Å; I45-F314 HydrophobicContact CD1-CZ 3.51Å; F310-F314 HydrophobicContact CD1-CE2 4.08Å; F310-F314 VanDerWaalsContact O-CD2 3.25Å; F310-F314 WeakPolarHBondContact O-CD2 3.39Å; F310-F314 PolarHBondContact O-N 3.06Å; K311-F314 CarbonylContact O-C 3.58Å; K311-F314 PolarHBondContact O-N 3.14Å; Q312-F314 VanDerWaalsContact C-N 3.33Å; Q312-F314 PolarHBondContact O-N 3.01Å; F314-W316 PolarHBondContact O-N 3.05Å; F314-W316 VanDerWaalsContact O-N 3.13Å; F314-C317 WeakPolarHBondContact O-CB 3.28Å; F314-C317 PolarHBondContact O-N 3.35Å; F314-I320 HydrophobicContact CB-CD1 3.34Å; F314-I320 HydrophobicContact CG-CD1 4.16Å |
| 315 | R | 81.8 | Confident | 80.8 | Confident | 120 Ų | 120 | 81.2 Ų | 81.2 | 45% | 0.453 | 38% | 0.379 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.8 | -25.9 | 178 | -92.6 | 176.3 | 163 | -168.2 | -2.2 | 114.4 | K311 Q312 A313 C317 V322 E327 | K311-R315 PolarHBondContact O-N 3Å; Q312-R315 WeakPolarHBondContact O-CB 3.37Å; Q312-R315 WeakPolarHBondContact O-CD 3.48Å; Q312-R315 VanDerWaalsContact O-CG 3.27Å; Q312-R315 WeakPolarHBondContact O-CG 3.4Å; Q312-R315 PolarHBondContact O-N 3.47Å; A313-R315 PolarHBondContact O-N 3.31Å; R315-C317 VanDerWaalsContact C-N 3.3Å; R315-V322 HydrophobicContact CG-CB 4.33Å; R315-V322 HydrophobicContact CG-CG2 3.32Å; R315-E327 IonicContact NH2-OE2 2.84Å; R315-E327 PolarHBondContact NH2-OE2 3.15Å |
| 316 | W | 78.3 | Confident | 80.5 | Confident | 208 Ų | 208 | 77.4 Ų | 77.4 | 79% | 0.788 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.3 | -11.1 | 178 | 53.4 | 60.7 | 0 | 0 | 0 | 113.5 | A313 F314 | A313-W316 WeakPolarHBondContact O-CH2 3.29Å; A313-W316 WeakPolarHBondContact O-CZ2 3.36Å; F314-W316 PolarHBondContact O-N 3.05Å; F314-W316 VanDerWaalsContact O-N 3.13Å |
| 317 | C | 83.1 | Confident | 79.9 | Confident | 39 Ų | 39 | 81 Ų | 81 | 26% | 0.264 | 38% | 0.383 | S | S | . | . | S | Bend | trans | -83.1 | 131.3 | 179.4 | -68.5 | 0 | 0 | 0 | 0 | 110.5 | F314 R315 F319 I320 | F314-C317 WeakPolarHBondContact O-CB 3.28Å; F314-C317 PolarHBondContact O-N 3.35Å; R315-C317 VanDerWaalsContact C-N 3.3Å; C317-F319 PolarHBondContact O-N 2.96Å; C317-I320 HydrophobicContact CB-CD1 4.09Å; C317-I320 HydrophobicContact CB-CG1 4.36Å; C317-I320 PolarHBondContact O-N 3.49Å; C317-I320 VanDerWaalsContact O-N 3.08Å |
| 318 | P | 75.2 | Confident | 79 | Confident | 117 Ų | 117 | 80 Ų | 80 | 76% | 0.76 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.1 | -21.1 | -174.7 | 23.9 | -33.3 | 0 | 0 | 0 | 113.8 | ||
| 319 | F | 78.3 | Confident | 78.5 | Confident | 193 Ų | 193 | 83.5 Ų | 83.5 | 85% | 0.846 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.1 | -7.5 | -179.3 | -53.5 | -70.8 | 0 | 0 | 0 | 114.1 | C317 | C317-F319 PolarHBondContact O-N 2.96Š|
| 320 | I | 78.9 | Confident | 77.9 | Confident | 55 Ų | 55 | 84.1 Ų | 84.1 | 28% | 0.282 | 41% | 0.405 | S | S | . | . | trans | -113.4 | 103.2 | -170.6 | -64.8 | 173.7 | 0 | 0 | 0 | 110.2 | K311 F314 C317 | K311-I320 HydrophobicContact CB-CG2 3.87Å; K311-I320 HydrophobicContact CG-CG2 4.1Å; K311-I320 WeakPolarHBondContact O-CG2 3.4Å; F314-I320 HydrophobicContact CB-CD1 3.34Å; F314-I320 HydrophobicContact CG-CD1 4.16Å; C317-I320 HydrophobicContact CB-CD1 4.09Å; C317-I320 HydrophobicContact CB-CG1 4.36Å; C317-I320 PolarHBondContact O-N 3.49Å; C317-I320 VanDerWaalsContact O-N 3.08Å | ||
| 321 | K | 74.4 | Confident | 76.9 | Confident | 187 Ų | 187 | 91 Ų | 91 | 81% | 0.813 | 43% | 0.43 | S | S | * | . | P | Polyproline II helix | trans | -90.5 | 116.2 | 171.1 | -64.2 | -175.9 | -178.5 | -179.7 | 0 | 109.5 | S323 | K321-S323 PolarHBondContact O-N 3.41Š|
| 322 | V | 75.3 | Confident | 75.4 | Confident | 39 Ų | 39 | 89.4 Ų | 89.4 | 24% | 0.236 | 43% | 0.427 | C | S | . | . | P | Polyproline II helix | trans | -81 | 117.2 | 172.3 | -178.1 | 0 | 0 | 0 | 0 | 109 | K311 R315 D326 | K311-V322 HydrophobicContact CB-CG2 4.14Å; K311-V322 VanDerWaalsContact O-CG2 3.3Å; K311-V322 WeakPolarHBondContact O-CG2 3.21Å; R315-V322 HydrophobicContact CG-CB 4.33Å; R315-V322 HydrophobicContact CG-CG2 3.32Å; V322-D326 HydrophobicContact CG1-CB 4.26Å |
| 323 | S | 76.6 | Confident | 73.8 | Confident | 54 Ų | 54 | 91.9 Ų | 91.9 | 38% | 0.378 | 45% | 0.446 | S | S | . | . | P | Polyproline II helix | trans | -81 | 150 | 177.1 | -178.7 | 0 | 0 | 0 | 0 | 110.7 | K321 Y325 D326 E327 | K321-S323 PolarHBondContact O-N 3.41Å; S323-Y325 PolarHBondContact O-N 2.89Å; S323-Y325 VanDerWaalsContact O-N 3.14Å; S323-Y325 PolarHBondContact OG-N 3.44Å; S323-D326 PolarHBondContact N-OD2 2.92Å; S323-D326 VanDerWaalsContact N-OD2 3.15Å; S323-D326 WeakPolarHBondContact O-CB 3.25Å; S323-D326 PolarHBondContact O-N 3.41Å; S323-E327 PolarHBondContact O-N 3.43Å |
| 324 | S | 68.6 | Low | 71.9 | Confident | 92 Ų | 92 | 100.5 Ų | 100.5 | 64% | 0.643 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -55.7 | -28 | 170.5 | -50.6 | 0 | 0 | 0 | 0 | 112.4 | E327 L328 | S324-E327 PolarHBondContact O-N 2.88Å; S324-L328 WeakPolarHBondContact O-CD1 3.24Å; S324-L328 VanDerWaalsContact O-CG 3.31Å; S324-L328 WeakPolarHBondContact O-CG 3.45Å; S324-L328 PolarHBondContact O-N 2.77Å |
| 325 | Y | 69.6 | Low | 70 | Confident | 183 Ų | 183 | 102.7 Ų | 102.7 | 72% | 0.718 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -65.3 | -38.1 | 172.6 | -77.6 | -85.1 | 0 | 0 | 0 | 113.2 | S323 E327 L328 E329 | S323-Y325 PolarHBondContact O-N 2.89Å; S323-Y325 VanDerWaalsContact O-N 3.14Å; S323-Y325 PolarHBondContact OG-N 3.44Å; Y325-E327 VanDerWaalsContact C-N 3.32Å; Y325-L328 PolarHBondContact O-N 2.77Å; Y325-E329 PolarHBondContact O-N 3.21Å |
| 326 | D | 76.7 | Confident | 68.1 | Low | 19 Ų | 19 | 101 Ų | 101 | 10% | 0.102 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -66 | -38.8 | 178.2 | -65 | -52 | 0 | 0 | 0 | 110 | A308 K311 V322 S323 E329 L330 | A308-D326 HydrophobicContact CB-CB 3.74Å; K311-D326 VanDerWaalsContact CD-OD2 3.27Å; K311-D326 WeakPolarHBondContact CD-OD2 3.17Å; K311-D326 IonicContact NZ-OD1 3.63Å; K311-D326 PolarHBondContact NZ-OD1 3.07Å; K311-D326 IonicContact NZ-OD2 3.02Å; K311-D326 PolarHBondContact NZ-OD2 3.23Å; V322-D326 HydrophobicContact CG1-CB 4.26Å; S323-D326 PolarHBondContact N-OD2 2.92Å; S323-D326 VanDerWaalsContact N-OD2 3.15Å; S323-D326 WeakPolarHBondContact O-CB 3.25Å; S323-D326 PolarHBondContact O-N 3.41Å; D326-E329 PolarHBondContact O-N 3.37Å; D326-L330 WeakPolarHBondContact O-CG 3.37Å; D326-L330 PolarHBondContact O-N 3.18Å |
| 327 | E | 73.8 | Confident | 66.1 | Low | 76 Ų | 76 | 97.8 Ų | 97.8 | 36% | 0.355 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -69.1 | -38.1 | 176.2 | -162.6 | 166.8 | 151.8 | 0 | 0 | 111.9 | R315 S323 S324 Y325 L330 R331 | R315-E327 IonicContact NH2-OE2 2.84Å; R315-E327 PolarHBondContact NH2-OE2 3.15Å; S323-E327 PolarHBondContact O-N 3.43Å; S324-E327 PolarHBondContact O-N 2.88Å; Y325-E327 VanDerWaalsContact C-N 3.32Å; E327-L330 PolarHBondContact O-N 3.15Å; E327-R331 WeakPolarHBondContact O-CB 3.46Å; E327-R331 PolarHBondContact O-N 3.12Å; E327-R331 IonicContact OE1-NH1 3.2Å |
| 328 | L | 68.3 | Low | 63.9 | Low | 81 Ų | 81 | 100.6 Ų | 100.6 | 42% | 0.424 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.8 | -41 | 172.7 | -75.7 | 163 | 0 | 0 | 0 | 112.4 | S324 Y325 L330 R331 S332 L335 | S324-L328 WeakPolarHBondContact O-CD1 3.24Å; S324-L328 VanDerWaalsContact O-CG 3.31Å; S324-L328 WeakPolarHBondContact O-CG 3.45Å; S324-L328 PolarHBondContact O-N 2.77Å; Y325-L328 PolarHBondContact O-N 2.77Å; L328-L330 PolarHBondContact O-N 2.87Å; L328-R331 PolarHBondContact O-N 3.42Å; L328-S332 WeakPolarHBondContact O-CB 3.42Å; L328-S332 PolarHBondContact O-N 2.96Å; L328-L335 HydrophobicContact CD2-CD1 3.75Å |
| 329 | E | 74.4 | Confident | 62 | Low | 73 Ų | 73 | 104.9 Ų | 104.9 | 34% | 0.341 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.3 | -35.1 | 175.4 | -84.4 | -144.6 | 168 | 0 | 0 | 112.1 | R55 S304 R305 Y325 D326 | R55-E329 PolarHBondContact NH1-O 3.24Å; S304-E329 WeakPolarHBondContact CB-OE2 3.37Å; S304-E329 PolarHBondContact OG-OE1 3.14Å; S304-E329 PolarHBondContact OG-OE2 3.5Å; R305-E329 PolarHBondContact N-OE2 3.35Å; Y325-E329 PolarHBondContact O-N 3.21Å; D326-E329 PolarHBondContact O-N 3.37Å |
| 330 | L | 72.2 | Confident | 60 | Low | 12 Ų | 12 | 101.4 Ų | 101.4 | 6% | 0.063 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -82.2 | -26.5 | 178.4 | -66.1 | 168.9 | 0 | 0 | 0 | 113.2 | A308 Q312 D326 E327 L328 | A308-L330 HydrophobicContact CB-CD1 4.16Å; A308-L330 HydrophobicContact CB-CG 4.2Å; Q312-L330 VanDerWaalsContact OE1-CD1 3.25Å; D326-L330 WeakPolarHBondContact O-CG 3.37Å; D326-L330 PolarHBondContact O-N 3.18Å; E327-L330 PolarHBondContact O-N 3.15Å; L328-L330 PolarHBondContact O-N 2.87Å |
| 331 | R | 68 | Low | 58 | Low | 163 Ų | 163 | 102 Ų | 102 | 62% | 0.615 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -106.2 | -13.4 | -171.3 | -154 | 175 | -172.8 | -177.1 | 0.1 | 115.5 | E327 L328 T333 | E327-R331 WeakPolarHBondContact O-CB 3.46Å; E327-R331 PolarHBondContact O-N 3.12Å; E327-R331 IonicContact OE1-NH1 3.2Å; L328-R331 PolarHBondContact O-N 3.42Å; R331-T333 VanDerWaalsContact C-N 3.32Å; R331-T333 PolarHBondContact O-N 3Å |
| 332 | S | 55.3 | Low | 56.4 | Low | 28 Ų | 28 | 97 Ų | 97 | 20% | 0.196 | 49% | 0.487 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.5 | 79.6 | -173.5 | 144.8 | 0 | 0 | 0 | 0 | 113.8 | R55 L328 | R55-S332 VanDerWaalsContact CZ-O 3.31Å; R55-S332 PolarHBondContact NH1-OG 3.35Å; R55-S332 PolarHBondContact NH2-OG 2.91Å; L328-S332 WeakPolarHBondContact O-CB 3.42Å; L328-S332 PolarHBondContact O-N 2.96Å |
| 333 | T | 50.2 | Low | 54.5 | Low | 103 Ų | 103 | 101.5 Ų | 101.5 | 63% | 0.632 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -113.2 | -21.1 | 151.3 | 14.2 | 0 | 0 | 0 | 0 | 111.6 | R331 | R331-T333 VanDerWaalsContact C-N 3.32Å; R331-T333 PolarHBondContact O-N 3Å |
| 334 | R | 46.2 | Very low | 52.7 | Low | 196 Ų | 196 | 107.8 Ų | 107.8 | 74% | 0.74 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -81.5 | -33 | -175.1 | -68.3 | -172.1 | -170.1 | -174.1 | 1.3 | 114.9 | T338 | R334-T338 PolarHBondContact O-OG1 3.4Å |
| 335 | L | 44.9 | Very low | 51.4 | Low | 118 Ų | 118 | 108.8 Ų | 108.8 | 62% | 0.618 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -80.2 | -27.2 | -171.6 | -84.8 | 153.3 | 0 | 0 | 0 | 114.5 | L328 | L328-L335 HydrophobicContact CD2-CD1 3.75Å |
| 336 | T | 41.4 | Very low | 50 | Low | 86 Ų | 86 | 107.3 Ų | 107.3 | 53% | 0.528 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -82.2 | -30 | -179.1 | -37.3 | 0 | 0 | 0 | 0 | 112.2 | Q340 | T336-Q340 PolarHBondContact O-N 3.48Å |
| 337 | Q | 37.6 | Very low | 48.1 | Very low | 139 Ų | 139 | 112.3 Ų | 112.3 | 65% | 0.65 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -69.4 | -40 | 177.8 | -162.5 | 169.1 | 6.9 | 0 | 0 | 111.2 | R339 Q340 S341 | Q337-R339 PolarHBondContact O-N 3.39Å; Q337-Q340 PolarHBondContact O-N 2.93Å; Q337-S341 PolarHBondContact O-N 2.93Å; Q337-S341 PolarHBondContact O-OG 2.95Å |
| 338 | T | 37.1 | Very low | 46.5 | Very low | 99 Ų | 99 | 119.4 Ų | 119.4 | 61% | 0.607 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -69.5 | -32.5 | 179.5 | -34.3 | 0 | 0 | 0 | 0 | 113 | R334 S342 | R334-T338 PolarHBondContact O-OG1 3.4Å; T338-S342 PolarHBondContact O-N 2.91Å; T338-S342 VanDerWaalsContact O-N 3.15Å |
| 339 | R | 34.7 | Very low | 45.1 | Very low | 206 Ų | 206 | 123.5 Ų | 123.5 | 78% | 0.777 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -75.1 | -30.9 | 178.8 | -143.7 | 179.9 | -177.6 | -171.5 | 0.3 | 112.7 | Q337 | Q337-R339 PolarHBondContact O-N 3.39Å |
| 340 | Q | 36.7 | Very low | 43.4 | Very low | 120 Ų | 120 | 127.4 Ų | 127.4 | 56% | 0.561 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -74.4 | -41.8 | 170.9 | -84.4 | -177.1 | -26.5 | 0 | 0 | 112 | T336 Q337 S342 M343 Y344 | T336-Q340 PolarHBondContact O-N 3.48Å; Q337-Q340 PolarHBondContact O-N 2.93Å; Q340-S342 VanDerWaalsContact C-N 3.28Å; Q340-S342 PolarHBondContact O-N 3.28Å; Q340-M343 PolarHBondContact O-N 3.27Å; Q340-M343 VanDerWaalsContact O-N 3.14Å; Q340-Y344 WeakPolarHBondContact O-CD2 3.47Å; Q340-Y344 PolarHBondContact O-N 2.86Å |
| 341 | S | 35.8 | Very low | 41.7 | Very low | 68 Ų | 68 | 134.3 Ų | 134.3 | 48% | 0.476 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -60.7 | -36.1 | 177.3 | -59.2 | 0 | 0 | 0 | 0 | 112.9 | Q337 M343 Y344 T345 | Q337-S341 PolarHBondContact O-N 2.93Å; Q337-S341 PolarHBondContact O-OG 2.95Å; S341-M343 VanDerWaalsContact C-N 3.34Å; S341-M343 PolarHBondContact O-N 3.16Å; S341-Y344 PolarHBondContact O-N 3.21Å; S341-T345 PolarHBondContact O-N 3.41Å; S341-T345 PolarHBondContact O-OG1 3.05Å |
| 342 | S | 40.8 | Very low | 39.9 | Very low | 81 Ų | 81 | 132.6 Ų | 132.6 | 57% | 0.566 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -71.4 | -24.1 | 177.1 | -173.6 | 0 | 0 | 0 | 0 | 114.1 | T338 Q340 | T338-S342 PolarHBondContact O-N 2.91Å; T338-S342 VanDerWaalsContact O-N 3.15Å; Q340-S342 VanDerWaalsContact C-N 3.28Å; Q340-S342 PolarHBondContact O-N 3.28Å |
| 343 | M | 36.7 | Very low | 38.7 | Very low | 135 Ų | 135 | 139.2 Ų | 139.2 | 67% | 0.665 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -79.9 | -30.5 | 176.3 | -93.9 | 175.4 | 46.9 | 0 | 0 | 112.5 | Q340 S341 T345 T347 | Q340-M343 PolarHBondContact O-N 3.27Å; Q340-M343 VanDerWaalsContact O-N 3.14Å; S341-M343 VanDerWaalsContact C-N 3.34Å; S341-M343 PolarHBondContact O-N 3.16Å; M343-T345 VanDerWaalsContact C-N 3.32Å; M343-T347 PolarHBondContact O-OG1 2.81Å |
| 344 | Y | 38.9 | Very low | 37.7 | Very low | 186 Ų | 186 | 140 Ų | 140 | 73% | 0.729 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -75.6 | -19.6 | 175.8 | -73.6 | -73.1 | 0 | 0 | 0 | 113.5 | Q340 S341 | Q340-Y344 WeakPolarHBondContact O-CD2 3.47Å; Q340-Y344 PolarHBondContact O-N 2.86Å; S341-Y344 PolarHBondContact O-N 3.21Å |
| 345 | T | 41 | Very low | 37 | Very low | 112 Ų | 112 | 136 Ų | 136 | 69% | 0.687 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -90.4 | -13.6 | 177.1 | -27.8 | 0 | 0 | 0 | 0 | 113.5 | S341 M343 | S341-T345 PolarHBondContact O-N 3.41Å; S341-T345 PolarHBondContact O-OG1 3.05Å; M343-T345 VanDerWaalsContact C-N 3.32Å |
| 346 | L | 38.5 | Very low | 36.1 | Very low | 152 Ų | 152 | 136 Ų | 136 | 80% | 0.796 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -100.4 | 5.9 | 178.2 | -148.4 | 107.9 | 0 | 0 | 0 | 114 | ||
| 347 | T | 37.7 | Very low | 35.4 | Very low | 124 Ų | 124 | 141.9 Ų | 141.9 | 76% | 0.761 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -113.2 | 13.6 | 174.4 | -14.4 | 0 | 0 | 0 | 0 | 112.9 | M343 | M343-T347 PolarHBondContact O-OG1 2.81Š|
| 348 | R | 39.6 | Very low | 35 | Very low | 226 Ų | 226 | 142.2 Ų | 142.2 | 85% | 0.853 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -128 | 33.6 | -179 | -154.6 | -174 | 170.4 | 158.6 | -1.7 | 113.3 | ||
| 349 | M | 40.4 | Very low | 34.8 | Very low | 167 Ų | 167 | 142.7 Ų | 142.7 | 82% | 0.823 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -138.6 | 94.9 | 156.4 | -72.7 | -176.3 | 93.5 | 0 | 0 | 106 | ||
| 350 | D | 38.4 | Very low | 34.5 | Very low | 154 Ų | 154 | 137.6 Ų | 137.6 | 82% | 0.824 | 74% | 0.735 | S | S | * | * | trans | 161.2 | 81.5 | 148.6 | -80.2 | -16.2 | 0 | 0 | 0 | 108.7 | ||||
| 351 | N | 36 | Very low | 34.2 | Very low | 158 Ų | 158 | 141.2 Ų | 141.2 | 85% | 0.845 | 75% | 0.752 | S | S | * | * | trans | -162.1 | 60.6 | 150.5 | -102 | -7.8 | 0 | 0 | 0 | 107.7 | ||||
| 352 | T | 29.3 | Very low | 33.7 | Very low | 127 Ų | 127 | 141.4 Ų | 141.4 | 78% | 0.779 | 77% | 0.765 | S | S | * | * | trans | -92.8 | 94.5 | 159.3 | -37.2 | 0 | 0 | 0 | 0 | 105.3 | V354 | T352-V354 PolarHBondContact O-N 2.9Š| ||
| 353 | M | 29.9 | Very low | 33.1 | Very low | 167 Ų | 167 | 146.1 Ų | 146.1 | 82% | 0.823 | 78% | 0.783 | S | S | * | * | trans | -63.3 | 104.1 | 165.5 | -73.3 | -168.8 | -169.2 | 0 | 0 | 107.2 | V355 | M353-V355 PolarHBondContact O-N 3.45Š| ||
| 354 | V | 29.7 | Very low | 32.8 | Very low | 119 Ų | 119 | 142.4 Ų | 142.4 | 72% | 0.721 | 78% | 0.78 | S | S | * | * | trans | -76.2 | 103.4 | 165.2 | 179.8 | 0 | 0 | 0 | 0 | 106.1 | T352 V356 | T352-V354 PolarHBondContact O-N 2.9Å; V354-V356 HydrophobicContact CG1-CG2 4.17Å; V354-V356 PolarHBondContact O-N 3.47Å | ||
| 355 | V | 31.3 | Very low | 32.2 | Very low | 113 Ų | 113 | 139.1 Ų | 139.1 | 69% | 0.685 | 78% | 0.784 | S | S | * | * | trans | -72.6 | 103.6 | 169.5 | 178.8 | 0 | 0 | 0 | 0 | 106.7 | M353 Y357 | M353-V355 PolarHBondContact O-N 3.45Å; V355-Y357 HydrophobicContact CG1-CD2 4.07Å; V355-Y357 HydrophobicContact CG1-CE2 4.42Å | ||
| 356 | V | 27.5 | Very low | 31.6 | Very low | 118 Ų | 118 | 137.8 Ų | 137.8 | 72% | 0.715 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 116.9 | 167.8 | -178.8 | 0 | 0 | 0 | 0 | 106.8 | V354 | V354-V356 HydrophobicContact CG1-CG2 4.17Å; V354-V356 PolarHBondContact O-N 3.47Å |
| 357 | Y | 26.3 | Very low | 31.1 | Very low | 209 Ų | 209 | 138.7 Ų | 138.7 | 82% | 0.82 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 120.9 | 169.2 | -114 | -90.9 | 0 | 0 | 0 | 107.9 | V355 | V355-Y357 HydrophobicContact CG1-CD2 4.07Å; V355-Y357 HydrophobicContact CG1-CE2 4.42Å |
| 358 | D | 29 | Very low | 30.5 | Very low | 146 Ų | 146 | 136.5 Ų | 136.5 | 78% | 0.781 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 135 | 164.6 | -93.5 | -41.9 | 0 | 0 | 0 | 109.8 | ||
| 359 | P | 32.2 | Very low | 29.9 | Very low | 109 Ų | 109 | 129.2 Ų | 129.2 | 71% | 0.708 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -95.9 | 146.9 | 175.5 | 35.1 | -28.7 | 0 | 0 | 0 | 112.9 | ||
| 360 | A | 29.6 | Very low | 29.2 | Very low | 99 Ų | 99 | 128.3 Ų | 128.3 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | trans | 73.2 | 147.6 | 160.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 361 | E | 29.1 | Very low | 28.7 | Very low | 195 Ų | 195 | 124.5 Ų | 124.5 | 91% | 0.911 | 79% | 0.787 | S | S | * | * | cis | -141.9 | 148.6 | 15.1 | -67.1 | 173.5 | 136 | 0 | 0 | 106.1 | ||||
| 362 | G | 26.9 | Very low | 28.3 | Very low | 73 Ų | 73 | 129 Ų | 129 | 75% | 0.753 | 79% | 0.792 | S | S | * | * | 122.8 | 126 | 65.7 | 0 | 0 | 0 | 0 | 0 | 109 | |||||
| 363 | D | 28.3 | Very low | 28.4 | Very low | 179 Ų | 179 | 132.2 Ų | 132.2 | 96% | 0.957 | 80% | 0.796 | S | S | * | * | trans | 94.9 | 138.9 | 150.1 | -131 | 0.8 | 0 | 0 | 0 | 122.1 | ||||
| 364 | G | 28.5 | Very low | 28.3 | Very low | 58 Ų | 58 | 133 Ų | 133 | 60% | 0.598 | 80% | 0.797 | S | S | * | * | trans | 110.8 | 66.5 | 148.1 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 365 | S | 27.4 | Very low | 28.3 | Very low | 116 Ų | 116 | 132 Ų | 132 | 81% | 0.811 | 80% | 0.795 | S | S | * | * | trans | 38.5 | 120.4 | 134.5 | 66.3 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 366 | A | 28.2 | Very low | 28.2 | Very low | 85 Ų | 85 | 135 Ų | 135 | 70% | 0.702 | 81% | 0.806 | S | S | * | * | 85.9 | 122.7 | 114.2 | 0 | 0 | 0 | 0 | 0 | 123.6 | |||||
| 367 | I | 27.9 | Very low | 28.4 | Very low | 171 Ų | 171 | 135 Ų | 135 | 88% | 0.877 | 81% | 0.809 | S | S | * | * | trans | 86.6 | 113.6 | 138.5 | -59.6 | 157.3 | 0 | 0 | 0 | 120.3 | ||||
| 368 | G | 25.6 | Very low | 28.6 | Very low | 77 Ų | 77 | 128.9 Ų | 128.9 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | 98.3 | 130.8 | 121 | 0 | 0 | 0 | 0 | 0 | 119.6 | |||||
| 369 | G | 25.7 | Very low | 28.6 | Very low | 73 Ų | 73 | 133.5 Ų | 133.5 | 75% | 0.753 | 82% | 0.815 | S | S | * | * | trans | 112.7 | 103.2 | 143.2 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 370 | T | 26.9 | Very low | 28.4 | Very low | 148 Ų | 148 | 137.6 Ų | 137.6 | 91% | 0.908 | 82% | 0.822 | S | S | * | * | trans | 4 | 134.3 | 142.6 | 54.9 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 371 | G | 27.2 | Very low | 28.3 | Very low | 75 Ų | 75 | 142.3 Ų | 142.3 | 77% | 0.773 | 82% | 0.819 | S | S | * | * | 109.9 | 132 | 129.5 | 0 | 0 | 0 | 0 | 0 | 118.9 | |||||
| 372 | R | 27.6 | Very low | 28.1 | Very low | 251 Ų | 251 | 138.2 Ų | 138.2 | 95% | 0.947 | 81% | 0.812 | S | S | * | * | trans | 78.9 | 121.6 | 154.3 | -87.3 | 178 | 170.9 | 164.7 | -2.9 | 120.7 | ||||
| 373 | K | 32.3 | Very low | 28.3 | Very low | 196 Ų | 196 | 143.5 Ų | 143.5 | 85% | 0.852 | 81% | 0.81 | S | S | * | * | trans | -29.2 | 133.7 | 151.1 | -62.4 | 172.3 | 176.6 | 177.9 | 0 | 113.1 | ||||
| 374 | H | 28.2 | Very low | 28.2 | Very low | 184 Ų | 184 | 141.4 Ų | 141.4 | 85% | 0.852 | 80% | 0.803 | S | S | * | * | trans | -168.4 | 130.7 | 132 | -110 | -77.8 | 0 | 0 | 0 | 112.7 | ||||
| 375 | S | 28.1 | Very low | 28.2 | Very low | 98 Ų | 98 | 144.8 Ų | 144.8 | 69% | 0.685 | 81% | 0.813 | S | S | * | * | trans | 43.7 | 113.6 | 147 | 49.5 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 376 | L | 30.7 | Very low | 28.1 | Very low | 174 Ų | 174 | 144.4 Ų | 144.4 | 91% | 0.911 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 132.9 | 155.2 | -74.4 | 140.2 | 0 | 0 | 0 | 111.6 | ||
| 377 | P | 32 | Very low | 28.2 | Very low | 119 Ų | 119 | 151.3 Ų | 151.3 | 77% | 0.773 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -89.8 | 139.7 | 157 | 10.4 | 7.3 | 0 | 0 | 0 | 110.6 | R379 | P377-R379 PolarHBondContact O-N 2.92Š|
| 378 | G | 29.7 | Very low | 28.2 | Very low | 80 Ų | 80 | 152.5 Ų | 152.5 | 83% | 0.825 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 125.7 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | K380 | G378-K380 PolarHBondContact O-N 3.3Š|
| 379 | R | 29.5 | Very low | 28.2 | Very low | 243 Ų | 243 | 154.8 Ų | 154.8 | 92% | 0.917 | 82% | 0.818 | S | S | * | * | trans | -82.8 | 104.8 | 174.6 | -162.8 | 174.5 | -173.8 | 179.5 | 2.7 | 109.4 | P377 R381 | P377-R379 PolarHBondContact O-N 2.92Å; R379-R381 PolarHBondContact O-N 2.91Å | ||
| 380 | K | 26.6 | Very low | 28.3 | Very low | 195 Ų | 195 | 160.1 Ų | 160.1 | 85% | 0.848 | 82% | 0.823 | S | S | * | * | trans | -62.5 | 116.1 | 163.6 | -76.9 | -178.8 | 177 | 177.8 | 0 | 108.3 | G378 S382 | G378-K380 PolarHBondContact O-N 3.3Å; K380-S382 PolarHBondContact O-N 3.02Å | ||
| 381 | R | 29 | Very low | 28.3 | Very low | 199 Ų | 199 | 160.9 Ų | 160.9 | 75% | 0.751 | 82% | 0.82 | S | S | * | * | trans | -78.4 | 102.4 | 165.5 | -95.3 | 179.8 | 172.5 | 167.5 | -0.7 | 107.9 | R379 Y383 | R379-R381 PolarHBondContact O-N 2.91Å; R381-Y383 HydrophobicContact CB-CD2 4.46Å; R381-Y383 HydrophobicContact CB-CE2 4.03Å | ||
| 382 | S | 24.8 | Very low | 28.2 | Very low | 108 Ų | 108 | 161.8 Ų | 161.8 | 76% | 0.755 | 82% | 0.82 | S | S | * | * | trans | -82.8 | 114.8 | 161.9 | -70 | 0 | 0 | 0 | 0 | 108.3 | K380 | K380-S382 PolarHBondContact O-N 3.02Š| ||
| 383 | Y | 30.3 | Very low | 28.2 | Very low | 185 Ų | 185 | 154.7 Ų | 154.7 | 73% | 0.725 | 82% | 0.815 | S | S | * | * | trans | -85.2 | 111.1 | 166.5 | -71.3 | -89.9 | 0 | 0 | 0 | 107.3 | R381 | R381-Y383 HydrophobicContact CB-CD2 4.46Å; R381-Y383 HydrophobicContact CB-CE2 4.03Å | ||
| 384 | V | 25.8 | Very low | 27.9 | Very low | 134 Ų | 134 | 151.3 Ų | 151.3 | 81% | 0.812 | 82% | 0.815 | S | S | * | * | trans | -95.1 | 103.5 | 165.7 | 179.1 | 0 | 0 | 0 | 0 | 106.8 | S386 | V384-S386 PolarHBondContact O-N 3.49Š| ||
| 385 | T | 28.1 | Very low | 27.8 | Very low | 130 Ų | 130 | 146.7 Ų | 146.7 | 80% | 0.798 | 80% | 0.804 | S | S | * | * | trans | -76.1 | 102 | 164.4 | 22.7 | 0 | 0 | 0 | 0 | 107.9 | R387 | T385-R387 PolarHBondContact O-N 3.1Š| ||
| 386 | S | 27.1 | Very low | 27.8 | Very low | 108 Ų | 108 | 148.9 Ų | 148.9 | 76% | 0.755 | 81% | 0.808 | S | S | * | * | trans | -72.6 | 113 | 167 | -169.7 | 0 | 0 | 0 | 0 | 108.5 | V384 | V384-S386 PolarHBondContact O-N 3.49Š| ||
| 387 | R | 28.4 | Very low | 27.7 | Very low | 230 Ų | 230 | 146.3 Ų | 146.3 | 87% | 0.868 | 80% | 0.799 | S | S | * | * | trans | -69.1 | 143.8 | 167.6 | -79.2 | -178.5 | -178.5 | 177.5 | 0.7 | 108.9 | T385 T389 | T385-R387 PolarHBondContact O-N 3.1Å; R387-T389 PolarHBondContact O-N 3.18Å | ||
| 388 | H | 28.1 | Very low | 27.4 | Very low | 196 Ų | 196 | 145.6 Ų | 145.6 | 91% | 0.907 | 80% | 0.803 | S | S | * | * | trans | -31.2 | 118.3 | 169.8 | -83.2 | -70.9 | 0 | 0 | 0 | 113.9 | ||||
| 389 | T | 27 | Very low | 27.3 | Very low | 124 Ų | 124 | 147.6 Ų | 147.6 | 76% | 0.761 | 80% | 0.799 | S | S | * | * | trans | -80.2 | 124.5 | 159.3 | -30.5 | 0 | 0 | 0 | 0 | 108.1 | R387 | R387-T389 PolarHBondContact O-N 3.18Š| ||
| 390 | E | 26.9 | Very low | 27.2 | Very low | 186 Ų | 186 | 145.9 Ų | 145.9 | 87% | 0.869 | 80% | 0.798 | S | S | * | * | trans | -53.5 | 137.6 | 161.7 | -71.8 | 171.1 | 133.8 | 0 | 0 | 110 | ||||
| 391 | I | 27.1 | Very low | 27.2 | Very low | 163 Ų | 163 | 142.2 Ų | 142.2 | 84% | 0.836 | 79% | 0.792 | S | S | * | * | trans | -119.2 | 104.5 | 156.1 | -64 | -179.4 | 0 | 0 | 0 | 106.7 | ||||
| 392 | A | 26 | Very low | 27.1 | Very low | 94 Ų | 94 | 142.1 Ų | 142.1 | 78% | 0.777 | 80% | 0.8 | S | S | * | * | trans | -60.1 | 139 | 159.9 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 393 | A | 26.1 | Very low | 27.2 | Very low | 102 Ų | 102 | 144.9 Ų | 144.9 | 84% | 0.843 | 81% | 0.807 | S | S | * | * | trans | -116.6 | 111.9 | 164.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 394 | C | 25.8 | Very low | 27.1 | Very low | 126 Ų | 126 | 139.2 Ų | 139.2 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | trans | -146.7 | 139.9 | 162.8 | -114.9 | 0 | 0 | 0 | 0 | 104.3 | ||||
| 395 | S | 28 | Very low | 27.2 | Very low | 87 Ų | 87 | 138.4 Ų | 138.4 | 61% | 0.608 | 81% | 0.805 | S | S | * | * | cis | -155.5 | 165.4 | 10.5 | -62.3 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 396 | D | 27.3 | Very low | 27.3 | Very low | 144 Ų | 144 | 136.7 Ų | 136.7 | 77% | 0.77 | 80% | 0.804 | S | S | * | * | 154.1 | 150.9 | 89.1 | -99.5 | -26.8 | 0 | 0 | 0 | 105.5 | |||||
| 397 | T | 28.7 | Very low | 27.8 | Very low | 120 Ų | 120 | 137.1 Ų | 137.1 | 74% | 0.736 | 81% | 0.805 | S | S | * | * | cis | -166.8 | 141.5 | -6.5 | -3.3 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 398 | A | 26.1 | Very low | 27.8 | Very low | 103 Ų | 103 | 131.3 Ų | 131.3 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | trans | -169 | 108.7 | 144.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 399 | V | 27.8 | Very low | 27.9 | Very low | 123 Ų | 123 | 126.4 Ų | 126.4 | 75% | 0.745 | 79% | 0.793 | S | S | * | * | trans | -57.4 | 134.7 | 175.9 | 169.4 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 400 | K | 26.3 | Very low | 28.2 | Very low | 206 Ų | 206 | 129.4 Ų | 129.4 | 90% | 0.896 | 80% | 0.798 | S | S | * | * | -161.2 | 115.2 | 129.6 | -114.9 | 175.9 | -176.7 | 179.2 | 0 | 112.5 | |||||
| 401 | T | 26.8 | Very low | 28.9 | Very low | 118 Ų | 118 | 125.3 Ų | 125.3 | 72% | 0.724 | 79% | 0.788 | S | S | * | * | trans | -62.6 | 139.8 | 171 | -9.6 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 402 | Q | 27.6 | Very low | 29.2 | Very low | 197 Ų | 197 | 127.1 Ų | 127.1 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | trans | -167.4 | 132.3 | 131.2 | -112.8 | 170.7 | -1.8 | 0 | 0 | 113 | ||||
| 403 | N | 27.1 | Very low | 29.4 | Very low | 166 Ų | 166 | 131.6 Ų | 131.6 | 89% | 0.888 | 80% | 0.797 | S | S | * | * | trans | -61.3 | 159.5 | 175.5 | -69.5 | -31.9 | 0 | 0 | 0 | 113.7 | ||||
| 404 | G | 27.5 | Very low | 29.8 | Very low | 66 Ų | 66 | 136.4 Ų | 136.4 | 68% | 0.68 | 80% | 0.799 | S | S | * | * | trans | 154.9 | 93.3 | 149.4 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 405 | S | 28 | Very low | 31.2 | Very low | 117 Ų | 117 | 139.5 Ų | 139.5 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | trans | 48.2 | 120.1 | 133.9 | 52.7 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 406 | A | 30.8 | Very low | 31.3 | Very low | 95 Ų | 95 | 142.2 Ų | 142.2 | 79% | 0.785 | 83% | 0.829 | S | S | * | * | trans | -64.4 | 159.6 | 148.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 407 | P | 36.7 | Very low | 31.6 | Very low | 117 Ų | 117 | 142.1 Ų | 142.1 | 76% | 0.76 | 83% | 0.832 | S | S | * | * | -150.4 | 154.6 | 99.7 | 38.4 | -20.4 | 0 | 0 | 0 | 117.6 | |||||
| 408 | S | 28.8 | Very low | 31.7 | Very low | 107 Ų | 107 | 143.3 Ų | 143.3 | 75% | 0.748 | 84% | 0.837 | S | S | * | * | trans | 27.2 | 131.2 | 143.4 | 64 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 409 | A | 29.8 | Very low | 32 | Very low | 94 Ų | 94 | 145.6 Ų | 145.6 | 78% | 0.777 | 84% | 0.836 | S | S | * | * | 45.7 | 135.3 | 126.3 | 0 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 410 | Q | 32.8 | Very low | 32.3 | Very low | 186 Ų | 186 | 147.1 Ų | 147.1 | 87% | 0.869 | 84% | 0.842 | S | S | * | * | cis | -172.5 | -176.8 | 46.7 | -112.4 | -126.5 | -29.9 | 0 | 0 | 109.7 | ||||
| 411 | P | 42.6 | Very low | 32.7 | Very low | 101 Ų | 101 | 143.1 Ų | 143.1 | 66% | 0.656 | 84% | 0.838 | S | S | * | * | trans | -99.3 | 165.3 | -151.4 | 40.9 | -35.3 | 0 | 0 | 0 | 115.3 | ||||
| 412 | E | 32.5 | Very low | 33.1 | Very low | 201 Ų | 201 | 144.9 Ų | 144.9 | 94% | 0.939 | 85% | 0.847 | S | S | * | * | trans | -139.3 | 151.1 | 165 | -89.7 | -161 | 146.5 | 0 | 0 | 114.2 | ||||
| 413 | E | 30.2 | Very low | 33.6 | Very low | 187 Ų | 187 | 140.9 Ų | 140.9 | 87% | 0.874 | 84% | 0.841 | S | S | * | * | trans | -81.9 | 160.3 | -163 | -79 | 164.4 | 133.4 | 0 | 0 | 114.7 | ||||
| 414 | F | 35.5 | Very low | 34.1 | Very low | 203 Ų | 203 | 138.8 Ų | 138.8 | 89% | 0.89 | 84% | 0.837 | S | S | * | * | trans | -71.3 | 150.4 | 163 | -87.9 | -99.4 | 0 | 0 | 0 | 111.7 | ||||
| 415 | P | 54.1 | Low | 34.7 | Very low | 192 Ų | 192 | 145.5 Ų | 145.5 | 100% | 1.247 | 85% | 0.851 | S | S | * | * | trans | -93.5 | 0 | 136.8 | 1.4 | 16.8 | 0 | 0 | 0 | 112.3 |
Retrieved 415 of 415 residues in 931.5 ms
(Link to these results)