| 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 | 51.4 | Low | 75.1 | Confident | 116 Ų | 116 | 89.3 Ų | 89.3 | 57% | 0.571 | 45% | 0.449 | S | S | * | . | 0 | 115 | 0 | -65.5 | 176.9 | -163.8 | 0 | 0 | 105.9 | I7 R10 L199 | M1-I7 HydrophobicContact CB-CG1 4.33Å; M1-R10 PolarHBondContact SD-NH1 3.03Å; M1-L199 WeakPolarHBondContact CE-O 3.46Å | |||
| 2 | T | 61.6 | Low | 75.6 | Confident | 151 Ų | 151 | 92.5 Ų | 92.5 | 93% | 0.926 | 45% | 0.452 | S | S | * | . | trans | -103.5 | -15.6 | -168.9 | 33.2 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 3 | D | 76.1 | Confident | 76.3 | Confident | 74 Ų | 74 | 93.7 Ų | 93.7 | 40% | 0.396 | 45% | 0.45 | S | S | . | . | trans | -90.1 | 119.3 | 179.1 | -165.7 | -14.9 | 0 | 0 | 0 | 111.6 | H5 E6 I7 | D3-H5 PolarHBondContact O-N 3.33Å; D3-H5 IonicContact OD1-CD2 3.69Å; D3-H5 IonicContact OD1-CG 3.93Å; D3-H5 PolarHBondContact OD1-N 3.48Å; D3-E6 HydrophobicContact CB-CB 4.29Å; D3-E6 HydrophobicContact CB-CG 4.07Å; D3-E6 PolarHBondContact O-N 3.37Å; D3-I7 WeakPolarHBondContact O-CG1 3.34Å; D3-I7 PolarHBondContact O-N 2.92Å | ||
| 4 | K | 73.9 | Confident | 76.9 | Confident | 162 Ų | 162 | 89.1 Ų | 89.1 | 70% | 0.704 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -57.4 | -36.1 | 174.8 | -74.1 | -177 | 175.9 | -178 | 0 | 111.5 | I7 D8 | K4-I7 PolarHBondContact O-N 3.3Å; K4-D8 WeakPolarHBondContact O-CB 3.43Å; K4-D8 VanDerWaalsContact O-CG 3.28Å; K4-D8 PolarHBondContact O-N 2.97Å |
| 5 | H | 77.6 | Confident | 77.5 | Confident | 141 Ų | 141 | 84.7 Ų | 84.7 | 65% | 0.653 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -67.3 | -39.1 | -179.1 | -71.4 | -63.5 | 0 | 0 | 0 | 112.6 | D3 A9 | D3-H5 PolarHBondContact O-N 3.33Å; D3-H5 IonicContact OD1-CD2 3.69Å; D3-H5 IonicContact OD1-CG 3.93Å; D3-H5 PolarHBondContact OD1-N 3.48Å; H5-A9 WeakPolarHBondContact O-CB 3.32Å; H5-A9 PolarHBondContact O-N 2.96Å |
| 6 | E | 80.2 | Confident | 77.9 | Confident | 104 Ų | 104 | 90.1 Ų | 90.1 | 49% | 0.486 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -66.6 | -41.3 | 175.6 | -71.4 | -167.8 | 160.5 | 0 | 0 | 111.9 | D3 A9 R10 | D3-E6 HydrophobicContact CB-CB 4.29Å; D3-E6 HydrophobicContact CB-CG 4.07Å; D3-E6 PolarHBondContact O-N 3.37Å; E6-A9 PolarHBondContact O-N 3.31Å; E6-R10 WeakPolarHBondContact O-CB 3.37Å; E6-R10 WeakPolarHBondContact O-CG 3.43Å; E6-R10 PolarHBondContact O-N 3.36Å |
| 7 | I | 79.5 | Confident | 78.4 | Confident | 27 Ų | 27 | 88 Ų | 88 | 14% | 0.138 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -60.9 | -49.2 | 176.9 | -67.1 | 170.5 | 0 | 0 | 0 | 109.6 | M1 D3 K4 A9 R10 Y11 L201 P202 | M1-I7 HydrophobicContact CB-CG1 4.33Å; D3-I7 WeakPolarHBondContact O-CG1 3.34Å; D3-I7 PolarHBondContact O-N 2.92Å; K4-I7 PolarHBondContact O-N 3.3Å; I7-A9 PolarHBondContact O-N 2.97Å; I7-R10 PolarHBondContact O-N 3.13Å; I7-Y11 HydrophobicContact CG2-CD2 3.75Å; I7-Y11 HydrophobicContact CG2-CE2 3.85Å; I7-Y11 WeakPolarHBondContact O-CD2 3.43Å; I7-Y11 PolarHBondContact O-N 3.12Å; I7-L201 HydrophobicContact CG2-CD2 4.2Å; I7-P202 HydrophobicContact CG2-CG 4.18Å |
| 8 | D | 80.2 | Confident | 78.9 | Confident | 48 Ų | 48 | 83.2 Ų | 83.2 | 26% | 0.257 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -60.7 | -45.2 | 178.7 | -77.2 | -1.2 | 0 | 0 | 0 | 112.8 | K4 Y11 R12 W207 | K4-D8 WeakPolarHBondContact O-CB 3.43Å; K4-D8 VanDerWaalsContact O-CG 3.28Å; K4-D8 PolarHBondContact O-N 2.97Å; D8-Y11 PolarHBondContact O-N 3.22Å; D8-R12 WeakPolarHBondContact O-CG 3.44Å; D8-R12 PolarHBondContact O-N 2.8Å; D8-W207 PolarHBondContact OD1-NE1 2.93Å |
| 9 | A | 81.6 | Confident | 79.3 | Confident | 46 Ų | 46 | 79.3 Ų | 79.3 | 38% | 0.38 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -63 | -43.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | H5 E6 I7 R12 Y13 | H5-A9 WeakPolarHBondContact O-CB 3.32Å; H5-A9 PolarHBondContact O-N 2.96Å; E6-A9 PolarHBondContact O-N 3.31Å; I7-A9 PolarHBondContact O-N 2.97Å; A9-R12 PolarHBondContact O-N 3.48Å; A9-Y13 WeakPolarHBondContact O-CB 3.15Å; A9-Y13 PolarHBondContact O-N 3.47Å |
| 10 | R | 81.9 | Confident | 79.8 | Confident | 113 Ų | 113 | 80.8 Ų | 80.8 | 43% | 0.426 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -64.6 | -41.5 | 175.9 | -76.2 | -178.6 | 174.3 | -155.1 | 0.2 | 111.9 | M1 E6 I7 Y13 W14 L201 | M1-R10 PolarHBondContact SD-NH1 3.03Å; E6-R10 WeakPolarHBondContact O-CB 3.37Å; E6-R10 WeakPolarHBondContact O-CG 3.43Å; E6-R10 PolarHBondContact O-N 3.36Å; I7-R10 PolarHBondContact O-N 3.13Å; R10-Y13 PolarHBondContact O-N 2.95Å; R10-W14 WeakPolarHBondContact O-CB 3.35Å; R10-W14 PolarHBondContact O-N 2.95Å; R10-L201 HydrophobicContact CB-CD2 4.05Å |
| 11 | Y | 81.6 | Confident | 80.2 | Confident | 0 Ų | 0 | 77.2 Ų | 77.2 | 0% | 0 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -60.7 | -50.4 | 174.5 | -98.1 | -72.3 | 0 | 0 | 0 | 112.1 | I7 D8 Y13 W14 R15 P196 L201 P202 V204 W207 | I7-Y11 HydrophobicContact CG2-CD2 3.75Å; I7-Y11 HydrophobicContact CG2-CE2 3.85Å; I7-Y11 WeakPolarHBondContact O-CD2 3.43Å; I7-Y11 PolarHBondContact O-N 3.12Å; D8-Y11 PolarHBondContact O-N 3.22Å; Y11-Y13 VanDerWaalsContact C-N 3.27Å; Y11-Y13 PolarHBondContact O-N 3.36Å; Y11-W14 PolarHBondContact O-N 2.73Å; Y11-R15 HydrophobicContact CD1-CG 4.39Å; Y11-R15 VanDerWaalsContact O-CB 3.23Å; Y11-R15 WeakPolarHBondContact O-CB 3.34Å; Y11-R15 WeakPolarHBondContact O-CG 3.38Å; Y11-R15 PolarHBondContact O-N 3.13Å; Y11-P196 HydrophobicContact CE1-CB 4.07Å; Y11-L201 HydrophobicContact CD1-CD1 4.44Å; Y11-L201 HydrophobicContact CD2-CD1 4.29Å; Y11-L201 HydrophobicContact CD2-CD2 4.1Å; Y11-L201 HydrophobicContact CE1-CD1 4.4Å; Y11-L201 HydrophobicContact CE2-CB 3.85Å; Y11-L201 HydrophobicContact CE2-CD1 4.26Å; Y11-L201 HydrophobicContact CE2-CD2 4.07Å; Y11-L201 HydrophobicContact CE2-CG 4.29Å; Y11-L201 HydrophobicContact CG-CD1 4.4Å; Y11-P202 HydrophobicContact CE2-CG 3.98Å; Y11-P202 VanDerWaalsContact OH-C 3.32Å; Y11-P202 PolarHBondContact OH-O 2.89Å; Y11-V204 HydrophobicContact CE1-CG2 4.08Å; Y11-W207 AromaticContact CD2-CD1 3.66Å; Y11-W207 HydrophobicContact CD2-CD2 4.02Å; Y11-W207 AromaticContact CD2-CE2 3.95Å; Y11-W207 AromaticContact CD2-CG 3.83Å; Y11-W207 HydrophobicContact CD2-CG 3.83Å; Y11-W207 AromaticContact CD2-NE1 3.71Å; Y11-W207 HydrophobicContact CE2-CB 3.93Å; Y11-W207 AromaticContact CE2-CD1 3.66Å; Y11-W207 HydrophobicContact CE2-CD2 4.18Å; Y11-W207 AromaticContact CE2-CG 3.61Å; Y11-W207 HydrophobicContact CE2-CG 3.61Å; Y11-W207 HydrophobicContact CG-CD2 4.18Å; Y11-W207 HydrophobicContact CG-CG 4.44Å |
| 12 | R | 82.1 | Confident | 82 | Confident | 128 Ų | 128 | 71.7 Ų | 71.7 | 48% | 0.483 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -59.1 | -41.9 | 178.7 | -73.6 | -170.6 | -64.4 | -95.1 | -1.1 | 111.6 | D8 A9 R16 | D8-R12 WeakPolarHBondContact O-CG 3.44Å; D8-R12 PolarHBondContact O-N 2.8Å; A9-R12 PolarHBondContact O-N 3.48Å; R12-R16 WeakPolarHBondContact O-CG 3.5Å; R12-R16 PolarHBondContact O-N 3.35Å |
| 13 | Y | 84.8 | Confident | 83.4 | Confident | 108 Ų | 108 | 67.6 Ų | 67.6 | 42% | 0.424 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -61.7 | -56.5 | 175.8 | -178.6 | -91.4 | 0 | 0 | 0 | 111.3 | A9 R10 Y11 R16 H17 R191 | A9-Y13 WeakPolarHBondContact O-CB 3.15Å; A9-Y13 PolarHBondContact O-N 3.47Å; R10-Y13 PolarHBondContact O-N 2.95Å; Y11-Y13 VanDerWaalsContact C-N 3.27Å; Y11-Y13 PolarHBondContact O-N 3.36Å; Y13-R16 PolarHBondContact O-N 2.7Å; Y13-H17 AromaticContact CD1-ND1 3.68Å; Y13-H17 AromaticContact CD2-CE1 3.44Å; Y13-H17 VanDerWaalsContact CD2-CE1 3.44Å; Y13-H17 WeakPolarHBondContact CD2-CE1 3.49Å; Y13-H17 AromaticContact CD2-ND1 3.74Å; Y13-H17 AromaticContact CE1-CE1 3.85Å; Y13-H17 AromaticContact CE1-ND1 3.64Å; Y13-H17 AromaticContact CE2-CE1 3.15Å; Y13-H17 WeakPolarHBondContact CE2-CE1 3.36Å; Y13-H17 AromaticContact CE2-ND1 3.73Å; Y13-H17 AromaticContact CE2-NE2 3.99Å; Y13-H17 AromaticContact CG-CE1 3.94Å; Y13-H17 AromaticContact CG-ND1 3.74Å; Y13-H17 AromaticContact CZ-CE1 3.38Å; Y13-H17 AromaticContact CZ-ND1 3.68Å; Y13-H17 AromaticContact CZ-NE2 3.98Å; Y13-H17 PolarHBondContact O-N 3.28Å; Y13-H17 VanDerWaalsContact O-N 3.13Å; Y13-H17 PolarHBondContact O-ND1 2.97Å; Y13-R191 VanDerWaalsContact CZ-NH2 3.31Å; Y13-R191 PolarHBondContact OH-NH2 3.11Å |
| 14 | W | 84.6 | Confident | 84 | Confident | 30 Ų | 30 | 67.2 Ų | 67.2 | 11% | 0.114 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -66.9 | -40.6 | -174.8 | -77.5 | 110.6 | 0 | 0 | 0 | 112.7 | R10 Y11 R16 H17 I18 W133 R193 L199 | R10-W14 WeakPolarHBondContact O-CB 3.35Å; R10-W14 PolarHBondContact O-N 2.95Å; Y11-W14 PolarHBondContact O-N 2.73Å; W14-R16 PolarHBondContact O-N 3.44Å; W14-H17 PolarHBondContact O-N 2.6Å; W14-I18 HydrophobicContact CB-CD1 4.23Å; W14-I18 HydrophobicContact CE3-CG1 4.46Å; W14-I18 VanDerWaalsContact O-CB 3.24Å; W14-I18 WeakPolarHBondContact O-CB 3.14Å; W14-I18 WeakPolarHBondContact O-CD1 3.44Å; W14-I18 WeakPolarHBondContact O-CG1 3.36Å; W14-I18 PolarHBondContact O-N 3.02Å; W14-W133 HydrophobicContact CB-CE3 4.45Å; W14-W133 HydrophobicContact CB-CH2 3.93Å; W14-W133 HydrophobicContact CB-CZ3 3.61Å; W14-W133 HydrophobicContact CG-CH2 4.38Å; W14-W133 HydrophobicContact CG-CZ3 4.45Å; W14-R193 HydrophobicContact CE3-CG 4.38Å; W14-R193 VanDerWaalsContact CZ3-CD 3.44Å; W14-R193 HydrophobicContact CZ3-CG 4.06Å; W14-L199 HydrophobicContact CD2-CD1 3.96Å; W14-L199 HydrophobicContact CG-CD1 3.89Å |
| 15 | R | 85.3 | Confident | 84.7 | Confident | 23 Ų | 23 | 59.5 Ų | 59.5 | 9% | 0.087 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -57.4 | -50.6 | 177.3 | -72.9 | 177.4 | 60 | -171.1 | -12.7 | 111.4 | Y11 H17 I18 L19 W133 Y134 E138 | Y11-R15 HydrophobicContact CD1-CG 4.39Å; Y11-R15 VanDerWaalsContact O-CB 3.23Å; Y11-R15 WeakPolarHBondContact O-CB 3.34Å; Y11-R15 WeakPolarHBondContact O-CG 3.38Å; Y11-R15 PolarHBondContact O-N 3.13Å; R15-H17 PolarHBondContact O-N 3.13Å; R15-I18 PolarHBondContact O-N 3.47Å; R15-L19 WeakPolarHBondContact O-CB 3.43Å; R15-L19 PolarHBondContact O-N 2.86Å; R15-W133 HydrophobicContact CG-CE3 4.23Å; R15-Y134 HydrophobicContact CB-CE1 4.23Å; R15-Y134 HydrophobicContact CG-CE1 4.45Å; R15-Y134 VanDerWaalsContact NE-CE1 3.3Å; R15-Y134 PolarHBondContact O-OH 3.32Å; R15-E138 IonicContact CZ-OE1 3.59Å; R15-E138 IonicContact CZ-OE2 3.86Å; R15-E138 IonicContact NH1-OE1 2.93Å; R15-E138 PolarHBondContact NH1-OE1 3.41Å; R15-E138 IonicContact NH1-OE2 2.92Å; R15-E138 IonicContact NH2-OE1 3.42Å; R15-E138 PolarHBondContact NH2-OE1 2.96Å; R15-E138 IonicContact NH2-OE2 3.21Å; R15-E138 PolarHBondContact NH2-OE2 3.11Å |
| 16 | R | 84.9 | Confident | 85.3 | Confident | 171 Ų | 171 | 53.1 Ų | 53.1 | 65% | 0.645 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -58.7 | -46.4 | 177.2 | -71.5 | 178.5 | -178.4 | -177.9 | 0.5 | 112 | R12 Y13 W14 L20 | R12-R16 WeakPolarHBondContact O-CG 3.5Å; R12-R16 PolarHBondContact O-N 3.35Å; Y13-R16 PolarHBondContact O-N 2.7Å; W14-R16 PolarHBondContact O-N 3.44Å; R16-L20 VanDerWaalsContact O-CG 3.3Å; R16-L20 WeakPolarHBondContact O-CG 3.38Å; R16-L20 PolarHBondContact O-N 2.87Å |
| 17 | H | 85.8 | Confident | 85.7 | Confident | 54 Ų | 54 | 48.4 Ų | 48.4 | 25% | 0.25 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -68.4 | -40.7 | -178.8 | -73.9 | 96.6 | 0 | 0 | 0 | 112.9 | Y13 W14 R15 L20 T21 R191 | Y13-H17 AromaticContact CD1-ND1 3.68Å; Y13-H17 AromaticContact CD2-CE1 3.44Å; Y13-H17 VanDerWaalsContact CD2-CE1 3.44Å; Y13-H17 WeakPolarHBondContact CD2-CE1 3.49Å; Y13-H17 AromaticContact CD2-ND1 3.74Å; Y13-H17 AromaticContact CE1-CE1 3.85Å; Y13-H17 AromaticContact CE1-ND1 3.64Å; Y13-H17 AromaticContact CE2-CE1 3.15Å; Y13-H17 WeakPolarHBondContact CE2-CE1 3.36Å; Y13-H17 AromaticContact CE2-ND1 3.73Å; Y13-H17 AromaticContact CE2-NE2 3.99Å; Y13-H17 AromaticContact CG-CE1 3.94Å; Y13-H17 AromaticContact CG-ND1 3.74Å; Y13-H17 AromaticContact CZ-CE1 3.38Å; Y13-H17 AromaticContact CZ-ND1 3.68Å; Y13-H17 AromaticContact CZ-NE2 3.98Å; Y13-H17 PolarHBondContact O-N 3.28Å; Y13-H17 VanDerWaalsContact O-N 3.13Å; Y13-H17 PolarHBondContact O-ND1 2.97Å; W14-H17 PolarHBondContact O-N 2.6Å; R15-H17 PolarHBondContact O-N 3.13Å; H17-L20 PolarHBondContact O-N 2.84Å; H17-T21 WeakPolarHBondContact O-CB 3.42Å; H17-T21 PolarHBondContact O-N 3.33Å; H17-T21 PolarHBondContact O-OG1 2.66Å; H17-R191 PolarHBondContact CD2-NH2 3.07Å; H17-R191 PolarHBondContact NE2-NH2 3.26Å; H17-R191 VanDerWaalsContact NE2-NH2 3.11Å |
| 18 | I | 86.7 | Confident | 86.2 | Confident | 1 Ų | 1 | 47.8 Ų | 47.8 | 1% | 0.005 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -64.5 | -45.3 | 179.3 | -72.8 | 170.4 | 0 | 0 | 0 | 109.5 | W14 R15 T21 I22 W133 R193 | W14-I18 HydrophobicContact CB-CD1 4.23Å; W14-I18 HydrophobicContact CE3-CG1 4.46Å; W14-I18 VanDerWaalsContact O-CB 3.24Å; W14-I18 WeakPolarHBondContact O-CB 3.14Å; W14-I18 WeakPolarHBondContact O-CD1 3.44Å; W14-I18 WeakPolarHBondContact O-CG1 3.36Å; W14-I18 PolarHBondContact O-N 3.02Å; R15-I18 PolarHBondContact O-N 3.47Å; I18-T21 PolarHBondContact O-N 3.08Å; I18-I22 HydrophobicContact CG2-CD1 3.47Å; I18-I22 VanDerWaalsContact CG2-CD1 3.47Å; I18-I22 HydrophobicContact CG2-CG1 4.18Å; I18-I22 WeakPolarHBondContact O-CB 3.19Å; I18-I22 WeakPolarHBondContact O-CG1 3.3Å; I18-I22 PolarHBondContact O-N 3.26Å; I18-W133 HydrophobicContact CD1-CD2 3.39Å; I18-W133 HydrophobicContact CD1-CE3 3.73Å; I18-W133 HydrophobicContact CD1-CG 4.02Å; I18-W133 HydrophobicContact CD1-CH2 3.57Å; I18-W133 HydrophobicContact CD1-CZ2 3.23Å; I18-W133 HydrophobicContact CD1-CZ3 3.82Å; I18-W133 HydrophobicContact CG2-CG 4.46Å; I18-R193 HydrophobicContact CD1-CB 4.5Å |
| 19 | L | 87.4 | Confident | 86.6 | Confident | 9 Ų | 9 | 45.5 Ų | 45.5 | 5% | 0.047 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60 | -49.8 | 175.3 | -176.2 | 77.2 | 0 | 0 | 0 | 112.5 | R15 T21 I22 W23 L130 Y134 W142 L145 | R15-L19 WeakPolarHBondContact O-CB 3.43Å; R15-L19 PolarHBondContact O-N 2.86Å; L19-T21 PolarHBondContact O-N 2.74Å; L19-I22 PolarHBondContact O-N 3.06Å; L19-W23 WeakPolarHBondContact O-CB 3.49Å; L19-W23 PolarHBondContact O-N 3.46Å; L19-L130 HydrophobicContact CD1-CD2 4.15Å; L19-Y134 WeakPolarHBondContact CB-OH 3.25Å; L19-W142 HydrophobicContact CD1-CE3 4.22Å; L19-W142 HydrophobicContact CD2-CD2 4.43Å; L19-W142 HydrophobicContact CD2-CE3 3.21Å; L19-W142 HydrophobicContact CD2-CH2 4.45Å; L19-W142 HydrophobicContact CD2-CZ3 3.23Å; L19-W142 HydrophobicContact CG-CE3 4.28Å; L19-L145 HydrophobicContact CD2-CD2 3.57Å; L19-L145 HydrophobicContact CD2-CG 4.21Å |
| 20 | L | 88.5 | Confident | 86.7 | Confident | 110 Ų | 110 | 44.8 Ų | 44.8 | 58% | 0.576 | 19% | 0.188 | S | C | * | . | H | α-helix | trans | -58.6 | -39.9 | 178.3 | -72.7 | 171.3 | 0 | 0 | 0 | 111.4 | R16 H17 L24 | R16-L20 VanDerWaalsContact O-CG 3.3Å; R16-L20 WeakPolarHBondContact O-CG 3.38Å; R16-L20 PolarHBondContact O-N 2.87Å; H17-L20 PolarHBondContact O-N 2.84Å; L20-L24 WeakPolarHBondContact O-CB 3.34Å; L20-L24 PolarHBondContact O-N 3.41Å |
| 21 | T | 88 | Confident | 86.8 | Confident | 6 Ų | 6 | 39.4 Ų | 39.4 | 4% | 0.037 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -69.3 | -44.6 | -179.8 | -54.6 | 0 | 0 | 0 | 0 | 111.2 | H17 I18 L19 G25 F187 L188 R191 L192 | H17-T21 WeakPolarHBondContact O-CB 3.42Å; H17-T21 PolarHBondContact O-N 3.33Å; H17-T21 PolarHBondContact O-OG1 2.66Å; I18-T21 PolarHBondContact O-N 3.08Å; L19-T21 PolarHBondContact O-N 2.74Å; T21-G25 PolarHBondContact O-N 3.26Å; T21-F187 HydrophobicContact CG2-CD1 4.44Å; T21-F187 HydrophobicContact CG2-CE1 4.14Å; T21-L188 HydrophobicContact CG2-CD2 3.33Å; T21-L188 WeakPolarHBondContact O-CD2 2.96Å; T21-R191 HydrophobicContact CG2-CB 4.09Å; T21-R191 HydrophobicContact CG2-CG 4.26Å; T21-R191 WeakPolarHBondContact OG1-CG 3.3Å; T21-L192 HydrophobicContact CG2-CD1 3.45Å; T21-L192 VanDerWaalsContact CG2-CD1 3.45Å |
| 22 | I | 89.5 | Confident | 87 | Confident | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -63.2 | -46.1 | 175 | -71 | 170.9 | 0 | 0 | 0 | 110.7 | I18 L19 G25 Y26 C126 L129 W146 L192 | I18-I22 HydrophobicContact CG2-CD1 3.47Å; I18-I22 VanDerWaalsContact CG2-CD1 3.47Å; I18-I22 HydrophobicContact CG2-CG1 4.18Å; I18-I22 WeakPolarHBondContact O-CB 3.19Å; I18-I22 WeakPolarHBondContact O-CG1 3.3Å; I18-I22 PolarHBondContact O-N 3.26Å; L19-I22 PolarHBondContact O-N 3.06Å; I22-G25 PolarHBondContact O-N 3.04Å; I22-Y26 VanDerWaalsContact O-CB 3.25Å; I22-Y26 WeakPolarHBondContact O-CB 3.46Å; I22-Y26 PolarHBondContact O-N 3.19Å; I22-C126 HydrophobicContact CG2-CB 3.74Å; I22-C126 WeakPolarHBondContact CG2-SG 3.19Å; I22-L129 HydrophobicContact CD1-CB 3.43Å; I22-L129 VanDerWaalsContact CD1-CB 3.43Å; I22-L129 HydrophobicContact CD1-CD1 3.62Å; I22-L129 HydrophobicContact CD1-CG 4.13Å; I22-L129 HydrophobicContact CG1-CD1 3.81Å; I22-W146 HydrophobicContact CG2-CG 4.44Å; I22-L192 HydrophobicContact CG1-CD1 3.91Å |
| 23 | W | 90.4 | Very high | 87 | Confident | 65 Ų | 65 | 34.1 Ų | 34.1 | 25% | 0.246 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -59.1 | -50.5 | 179.2 | -176.1 | 98.8 | 0 | 0 | 0 | 110.6 | L19 Y26 A27 L145 T148 A149 V152 | L19-W23 WeakPolarHBondContact O-CB 3.49Å; L19-W23 PolarHBondContact O-N 3.46Å; W23-Y26 PolarHBondContact O-N 3.45Å; W23-A27 VanDerWaalsContact O-CB 3.31Å; W23-A27 WeakPolarHBondContact O-CB 3.24Å; W23-A27 PolarHBondContact O-N 3.38Å; W23-L145 VanDerWaalsContact CD1-O 3.22Å; W23-L145 PolarHBondContact NE1-O 3.13Å; W23-T148 PolarHBondContact NE1-OG1 3.39Å; W23-A149 HydrophobicContact CB-CB 4.48Å; W23-A149 HydrophobicContact CD2-CB 4.01Å; W23-A149 HydrophobicContact CG-CB 3.8Å; W23-A149 VanDerWaalsContact O-CB 3.29Å; W23-A149 WeakPolarHBondContact O-CB 3.45Å; W23-V152 HydrophobicContact CH2-CB 4.11Å; W23-V152 HydrophobicContact CH2-CG1 3.86Å; W23-V152 HydrophobicContact CH2-CG2 4.32Å; W23-V152 HydrophobicContact CZ2-CB 3.95Å; W23-V152 HydrophobicContact CZ2-CG1 4.21Å; W23-V152 HydrophobicContact CZ2-CG2 3.86Å |
| 24 | L | 89.6 | Confident | 86.8 | Confident | 66 Ų | 66 | 32.5 Ų | 32.5 | 35% | 0.346 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -66.7 | -40.9 | -179.8 | -179.6 | 132 | 0 | 0 | 0 | 111.9 | L20 L28 V184 | L20-L24 WeakPolarHBondContact O-CB 3.34Å; L20-L24 PolarHBondContact O-N 3.41Å; L24-L28 PolarHBondContact O-N 3.4Å; L24-L28 VanDerWaalsContact O-N 3.1Å; L24-V184 HydrophobicContact CD2-CB 4.13Å; L24-V184 HydrophobicContact CD2-CG1 3.25Å; L24-V184 HydrophobicContact CD2-CG2 3.76Å; L24-V184 HydrophobicContact CG-CG1 4.37Å |
| 25 | G | 89.2 | Confident | 86.6 | Confident | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -62.6 | -44 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | T21 I22 L28 F29 | T21-G25 PolarHBondContact O-N 3.26Å; I22-G25 PolarHBondContact O-N 3.04Å; G25-L28 PolarHBondContact O-N 2.93Å; G25-F29 WeakPolarHBondContact O-CD2 3.2Å; G25-F29 PolarHBondContact O-N 2.59Å |
| 26 | Y | 89.3 | Confident | 86.2 | Confident | 6 Ų | 6 | 30.1 Ų | 30.1 | 2% | 0.024 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -71.4 | -37.1 | 179.4 | -162.8 | -113 | 0 | 0 | 0 | 112.8 | I22 W23 L28 F29 Y30 S123 W146 A149 H150 | I22-Y26 VanDerWaalsContact O-CB 3.25Å; I22-Y26 WeakPolarHBondContact O-CB 3.46Å; I22-Y26 PolarHBondContact O-N 3.19Å; W23-Y26 PolarHBondContact O-N 3.45Å; Y26-L28 PolarHBondContact O-N 3.05Å; Y26-F29 WeakPolarHBondContact O-CB 3.23Å; Y26-F29 PolarHBondContact O-N 3.33Å; Y26-Y30 HydrophobicContact CD1-CD2 4.07Å; Y26-Y30 HydrophobicContact CD1-CE2 4.04Å; Y26-Y30 AromaticContact CE1-CD2 3.82Å; Y26-Y30 HydrophobicContact CE1-CD2 3.82Å; Y26-Y30 AromaticContact CE1-CE2 3.32Å; Y26-Y30 HydrophobicContact CE1-CE2 3.32Å; Y26-Y30 HydrophobicContact CE2-CE2 4.14Å; Y26-Y30 AromaticContact CZ-CE2 3.41Å; Y26-Y30 VanDerWaalsContact CZ-CE2 3.41Å; Y26-Y30 PolarHBondContact O-N 2.98Å; Y26-Y30 VanDerWaalsContact O-N 3.09Å; Y26-S123 PolarHBondContact OH-OG 2.93Å; Y26-S123 VanDerWaalsContact OH-OG 3.04Å; Y26-W146 AromaticContact CD1-CE2 3.78Å; Y26-W146 AromaticContact CD1-CZ2 3.99Å; Y26-W146 HydrophobicContact CD1-CZ2 3.99Å; Y26-W146 AromaticContact CD1-NE1 3.31Å; Y26-W146 VanDerWaalsContact CD1-NE1 3.31Å; Y26-W146 HydrophobicContact CD2-CZ2 4.01Å; Y26-W146 AromaticContact CD2-NE1 3.88Å; Y26-W146 AromaticContact CE1-CE2 3.84Å; Y26-W146 AromaticContact CE1-CZ2 3.64Å; Y26-W146 HydrophobicContact CE1-CZ2 3.64Å; Y26-W146 AromaticContact CE1-NE1 3.87Å; Y26-W146 AromaticContact CE2-CZ2 3.69Å; Y26-W146 HydrophobicContact CE2-CZ2 3.69Å; Y26-W146 AromaticContact CG-CE2 3.97Å; Y26-W146 HydrophobicContact CG-CZ2 4.14Å; Y26-W146 AromaticContact CG-NE1 3.28Å; Y26-W146 VanDerWaalsContact CG-NE1 3.28Å; Y26-W146 AromaticContact CZ-CZ2 3.45Å; Y26-W146 VanDerWaalsContact CZ-CZ2 3.45Å; Y26-A149 HydrophobicContact CD1-CB 4.2Å; Y26-H150 HydrophobicContact CE1-CB 4.21Å |
| 27 | A | 89 | Confident | 85.7 | Confident | 5 Ų | 5 | 25.3 Ų | 25.3 | 4% | 0.041 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -56.8 | -42.8 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | W23 Y30 F31 A149 G153 | W23-A27 VanDerWaalsContact O-CB 3.31Å; W23-A27 WeakPolarHBondContact O-CB 3.24Å; W23-A27 PolarHBondContact O-N 3.38Å; A27-Y30 PolarHBondContact O-N 2.85Å; A27-F31 WeakPolarHBondContact O-CB 3.47Å; A27-F31 PolarHBondContact O-N 2.84Å; A27-A149 WeakPolarHBondContact CA-O 3.47Å; A27-A149 HydrophobicContact CB-CB 4.1Å; A27-G153 WeakPolarHBondContact O-CA 3.15Å |
| 28 | L | 89.3 | Confident | 85.2 | Confident | 14 Ų | 14 | 24.3 Ų | 24.3 | 7% | 0.073 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -72.7 | -30.4 | 178 | -72.5 | -134.9 | 0 | 0 | 0 | 114 | L24 G25 Y26 Y30 F31 T32 L89 M180 V184 | L24-L28 PolarHBondContact O-N 3.4Å; L24-L28 VanDerWaalsContact O-N 3.1Å; G25-L28 PolarHBondContact O-N 2.93Å; Y26-L28 PolarHBondContact O-N 3.05Å; L28-Y30 VanDerWaalsContact C-N 3.3Å; L28-Y30 PolarHBondContact O-N 2.9Å; L28-F31 HydrophobicContact CD2-CB 4.11Å; L28-F31 HydrophobicContact CD2-CG 4.3Å; L28-F31 WeakPolarHBondContact O-CB 3.42Å; L28-F31 PolarHBondContact O-N 2.95Å; L28-T32 WeakPolarHBondContact O-CG2 3.24Å; L28-T32 PolarHBondContact O-N 3Å; L28-T32 PolarHBondContact O-OG1 3.02Å; L28-L89 HydrophobicContact CB-CD1 4.08Å; L28-L89 HydrophobicContact CB-CD2 4.19Å; L28-M180 VanDerWaalsContact CD1-C 3.48Å; L28-M180 HydrophobicContact CD1-CB 3.86Å; L28-M180 WeakPolarHBondContact CD1-O 3.3Å; L28-V184 HydrophobicContact CD1-CB 3.79Å; L28-V184 HydrophobicContact CD1-CG1 4.33Å; L28-V184 HydrophobicContact CD1-CG2 3.47Å; L28-V184 VanDerWaalsContact CD1-CG2 3.47Å; L28-V184 HydrophobicContact CG-CB 4.36Å; L28-V184 HydrophobicContact CG-CG1 4.38Å; L28-V184 HydrophobicContact CG-CG2 4.13Å |
| 29 | F | 89.1 | Confident | 84.8 | Confident | 0 Ų | 0 | 24.3 Ų | 24.3 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -58.8 | -43.9 | 167.8 | -84.1 | -68.6 | 0 | 0 | 0 | 111.5 | G25 Y26 T32 R33 M85 L89 T92 Q119 | G25-F29 WeakPolarHBondContact O-CD2 3.2Å; G25-F29 PolarHBondContact O-N 2.59Å; Y26-F29 WeakPolarHBondContact O-CB 3.23Å; Y26-F29 PolarHBondContact O-N 3.33Å; F29-T32 PolarHBondContact O-N 2.89Å; F29-T32 PolarHBondContact O-OG1 2.78Å; F29-R33 PolarHBondContact O-N 3.1Å; F29-R33 VanDerWaalsContact O-N 3.14Å; F29-M85 HydrophobicContact CD2-CE 4.35Å; F29-M85 HydrophobicContact CE2-CE 4.12Å; F29-M85 HydrophobicContact CE2-CG 3.91Å; F29-L89 HydrophobicContact CD1-CD1 3.84Å; F29-L89 HydrophobicContact CD2-CD1 3.96Å; F29-L89 HydrophobicContact CE1-CB 4.13Å; F29-L89 HydrophobicContact CE1-CD1 3.99Å; F29-L89 HydrophobicContact CE2-CB 3.97Å; F29-L89 HydrophobicContact CE2-CD1 4.09Å; F29-L89 HydrophobicContact CE2-CG 4.49Å; F29-L89 HydrophobicContact CG-CD1 3.84Å; F29-L89 HydrophobicContact CZ-CB 3.67Å; F29-L89 HydrophobicContact CZ-CD1 4.12Å; F29-L89 HydrophobicContact CZ-CG 4.47Å; F29-T92 HydrophobicContact CD1-CG2 4.19Å; F29-T92 HydrophobicContact CE1-CG2 3.99Å; F29-Q119 HydrophobicContact CD1-CB 4.38Å; F29-Q119 HydrophobicContact CD1-CG 4.24Å |
| 30 | Y | 84.3 | Confident | 84.1 | Confident | 32 Ų | 32 | 25 Ų | 25 | 13% | 0.125 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -69.1 | -37.2 | 175 | -91.2 | -94.7 | 0 | 0 | 0 | 113.1 | Y26 A27 L28 T32 R33 K34 H150 | Y26-Y30 HydrophobicContact CD1-CD2 4.07Å; Y26-Y30 HydrophobicContact CD1-CE2 4.04Å; Y26-Y30 AromaticContact CE1-CD2 3.82Å; Y26-Y30 HydrophobicContact CE1-CD2 3.82Å; Y26-Y30 AromaticContact CE1-CE2 3.32Å; Y26-Y30 HydrophobicContact CE1-CE2 3.32Å; Y26-Y30 HydrophobicContact CE2-CE2 4.14Å; Y26-Y30 AromaticContact CZ-CE2 3.41Å; Y26-Y30 VanDerWaalsContact CZ-CE2 3.41Å; Y26-Y30 PolarHBondContact O-N 2.98Å; Y26-Y30 VanDerWaalsContact O-N 3.09Å; A27-Y30 PolarHBondContact O-N 2.85Å; L28-Y30 VanDerWaalsContact C-N 3.3Å; L28-Y30 PolarHBondContact O-N 2.9Å; Y30-T32 VanDerWaalsContact C-N 3.3Å; Y30-T32 PolarHBondContact O-N 3.19Å; Y30-R33 VanDerWaalsContact CE1-NH1 3.32Å; Y30-R33 WeakPolarHBondContact O-CA 3.49Å; Y30-R33 VanDerWaalsContact O-CB 3.28Å; Y30-R33 WeakPolarHBondContact O-CB 3.16Å; Y30-R33 PolarHBondContact O-N 3.24Å; Y30-R33 PolarHBondContact OH-NH1 3.44Å; Y30-K34 PolarHBondContact O-N 3.03Å; Y30-H150 HydrophobicContact CD1-CB 3.97Å; Y30-H150 HydrophobicContact CD2-CB 3.79Å; Y30-H150 HydrophobicContact CE1-CB 3.8Å; Y30-H150 HydrophobicContact CE2-CB 3.62Å; Y30-H150 HydrophobicContact CG-CB 3.96Å |
| 31 | F | 83.3 | Confident | 83.3 | Confident | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -55.3 | -48.2 | 173.7 | -166.5 | -92.7 | 0 | 0 | 0 | 110.4 | A27 L28 R33 S35 L156 I157 V160 A177 M180 | A27-F31 WeakPolarHBondContact O-CB 3.47Å; A27-F31 PolarHBondContact O-N 2.84Å; L28-F31 HydrophobicContact CD2-CB 4.11Å; L28-F31 HydrophobicContact CD2-CG 4.3Å; L28-F31 WeakPolarHBondContact O-CB 3.42Å; L28-F31 PolarHBondContact O-N 2.95Å; F31-R33 VanDerWaalsContact C-N 3.25Å; F31-R33 PolarHBondContact O-N 3.42Å; F31-S35 PolarHBondContact O-N 3.39Å; F31-L156 HydrophobicContact CD2-CB 4.22Å; F31-L156 HydrophobicContact CD2-CD2 4.32Å; F31-L156 HydrophobicContact CD2-CG 4.41Å; F31-L156 HydrophobicContact CE2-CB 4.08Å; F31-L156 HydrophobicContact CE2-CD2 3.99Å; F31-L156 HydrophobicContact CE2-CG 3.88Å; F31-I157 HydrophobicContact CD1-CB 4.44Å; F31-I157 HydrophobicContact CD1-CD1 3.65Å; F31-I157 HydrophobicContact CD1-CG1 4.48Å; F31-I157 HydrophobicContact CD2-CB 3.61Å; F31-I157 HydrophobicContact CD2-CD1 4.21Å; F31-I157 HydrophobicContact CD2-CG1 4.46Å; F31-I157 HydrophobicContact CE1-CD1 3.31Å; F31-I157 HydrophobicContact CE1-CG1 4.45Å; F31-I157 VanDerWaalsContact CE2-CA 3.48Å; F31-I157 HydrophobicContact CE2-CB 3.73Å; F31-I157 HydrophobicContact CE2-CD1 3.92Å; F31-I157 HydrophobicContact CE2-CG1 4.43Å; F31-I157 HydrophobicContact CG-CB 3.98Å; F31-I157 HydrophobicContact CG-CD1 4.08Å; F31-I157 HydrophobicContact CG-CG1 4.48Å; F31-I157 HydrophobicContact CZ-CB 4.2Å; F31-I157 HydrophobicContact CZ-CD1 3.45Å; F31-I157 VanDerWaalsContact CZ-CD1 3.45Å; F31-I157 HydrophobicContact CZ-CG1 4.42Å; F31-I157 VanDerWaalsContact O-CG1 3.29Å; F31-I157 WeakPolarHBondContact O-CG1 3.37Å; F31-V160 HydrophobicContact CE2-CB 4.29Å; F31-V160 HydrophobicContact CE2-CG2 4.01Å; F31-V160 HydrophobicContact CZ-CB 3.81Å; F31-V160 HydrophobicContact CZ-CG1 3.93Å; F31-V160 HydrophobicContact CZ-CG2 3.84Å; F31-A177 HydrophobicContact CD1-CB 3.81Å; F31-A177 HydrophobicContact CE1-CB 3.49Å; F31-A177 VanDerWaalsContact CE1-CB 3.49Å; F31-M180 HydrophobicContact CE1-SD 4.16Å; F31-M180 HydrophobicContact CZ-SD 4.14Å |
| 32 | T | 85.2 | Confident | 82.6 | Confident | 0 Ų | 0 | 26.1 Ų | 26.1 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -72.5 | -11.8 | 174.9 | 58.1 | 0 | 0 | 0 | 0 | 114.9 | L28 F29 Y30 S35 N96 Q119 A181 | L28-T32 WeakPolarHBondContact O-CG2 3.24Å; L28-T32 PolarHBondContact O-N 3Å; L28-T32 PolarHBondContact O-OG1 3.02Å; F29-T32 PolarHBondContact O-N 2.89Å; F29-T32 PolarHBondContact O-OG1 2.78Å; Y30-T32 VanDerWaalsContact C-N 3.3Å; Y30-T32 PolarHBondContact O-N 3.19Å; T32-S35 PolarHBondContact O-OG 3.46Å; T32-N96 WeakPolarHBondContact CB-ND2 3.26Å; T32-Q119 PolarHBondContact O-NE2 3.15Å; T32-Q119 VanDerWaalsContact O-NE2 3.13Å; T32-A181 HydrophobicContact CG2-CB 3.71Å |
| 33 | R | 83.8 | Confident | 81.8 | Confident | 17 Ų | 17 | 26.1 Ų | 26.1 | 6% | 0.064 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -83.3 | -48.2 | 176.8 | -172.9 | 174.1 | -59.5 | 156.2 | 17 | 112.2 | F29 Y30 F31 S35 F61 Y65 W112 Q119 | F29-R33 PolarHBondContact O-N 3.1Å; F29-R33 VanDerWaalsContact O-N 3.14Å; Y30-R33 VanDerWaalsContact CE1-NH1 3.32Å; Y30-R33 WeakPolarHBondContact O-CA 3.49Å; Y30-R33 VanDerWaalsContact O-CB 3.28Å; Y30-R33 WeakPolarHBondContact O-CB 3.16Å; Y30-R33 PolarHBondContact O-N 3.24Å; Y30-R33 PolarHBondContact OH-NH1 3.44Å; F31-R33 VanDerWaalsContact C-N 3.25Å; F31-R33 PolarHBondContact O-N 3.42Å; R33-S35 VanDerWaalsContact C-N 3.28Å; R33-F61 HydrophobicContact CG-CE1 4Å; R33-F61 HydrophobicContact CG-CE2 4.33Å; R33-F61 HydrophobicContact CG-CZ 3.55Å; R33-Y65 VanDerWaalsContact CZ-CZ 3.44Å; R33-Y65 VanDerWaalsContact CZ-OH 3.32Å; R33-Y65 PolarHBondContact NH1-OH 2.91Å; R33-Y65 PolarHBondContact NH2-OH 2.98Å; R33-W112 WeakPolarHBondContact O-CH2 3.12Å; R33-Q119 VanDerWaalsContact CA-NE2 3.25Å |
| 34 | K | 80.4 | Confident | 81 | Confident | 74 Ų | 74 | 25.8 Ų | 25.8 | 32% | 0.322 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -86.6 | -5 | -175.6 | -69.7 | -73.5 | -168 | 172.7 | 0 | 111.4 | Y30 N37 A38 I157 | Y30-K34 PolarHBondContact O-N 3.03Å; K34-N37 HydrophobicContact CD-CB 4.46Å; K34-N37 PolarHBondContact O-N 3.04Å; K34-A38 WeakPolarHBondContact O-CB 3.17Å; K34-A38 PolarHBondContact O-N 2.89Å; K34-I157 HydrophobicContact CB-CG2 3.51Å |
| 35 | S | 79.5 | Confident | 80.1 | Confident | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -57 | -49 | 174.5 | 58 | 0 | 0 | 0 | 0 | 112.2 | F31 T32 R33 A38 A39 N96 M174 | F31-S35 PolarHBondContact O-N 3.39Å; T32-S35 PolarHBondContact O-OG 3.46Å; R33-S35 VanDerWaalsContact C-N 3.28Å; S35-A38 PolarHBondContact O-N 3.14Å; S35-A39 PolarHBondContact O-N 2.76Å; S35-N96 PolarHBondContact OG-OD1 3.31Å; S35-M174 VanDerWaalsContact C-CE 3.47Å; S35-M174 WeakPolarHBondContact O-CE 3.39Å |
| 36 | F | 77.6 | Confident | 79.4 | Confident | 3 Ų | 3 | 31.3 Ų | 31.3 | 1% | 0.013 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.9 | -48.4 | 175.4 | -173.9 | -99.6 | 0 | 0 | 0 | 112.3 | A38 A39 V40 I43 L49 L57 F99 F108 W112 M174 | F36-A38 PolarHBondContact O-N 2.77Å; F36-A39 CarbonylContact O-C 3.56Å; F36-A39 WeakPolarHBondContact O-CA 3.18Å; F36-A39 PolarHBondContact O-N 3.4Å; F36-V40 HydrophobicContact CD1-CG2 4.14Å; F36-V40 HydrophobicContact CE1-CG2 3.91Å; F36-V40 HydrophobicContact CZ-CG2 4.44Å; F36-V40 WeakPolarHBondContact O-CG2 3.3Å; F36-V40 PolarHBondContact O-N 3.35Å; F36-I43 HydrophobicContact CD2-CD1 4.3Å; F36-I43 HydrophobicContact CE2-CD1 3.93Å; F36-L49 HydrophobicContact CZ-CD1 4.24Å; F36-L57 HydrophobicContact CE1-CD1 4.22Å; F36-L57 HydrophobicContact CZ-CD1 3.68Å; F36-F99 HydrophobicContact CD2-CE1 4.39Å; F36-F99 HydrophobicContact CE2-CE1 4.46Å; F36-F108 HydrophobicContact CE2-CD1 4.1Å; F36-W112 HydrophobicContact CB-CE3 4.05Å; F36-W112 HydrophobicContact CB-CH2 3.25Å; F36-W112 HydrophobicContact CB-CZ2 3.93Å; F36-W112 HydrophobicContact CB-CZ3 3.3Å; F36-W112 HydrophobicContact CD1-CD2 4.43Å; F36-W112 HydrophobicContact CD1-CH2 4.05Å; F36-W112 AromaticContact CD1-CZ2 3.82Å; F36-W112 HydrophobicContact CD1-CZ2 3.82Å; F36-W112 HydrophobicContact CD1-CZ3 4.39Å; F36-W112 HydrophobicContact CD2-CE3 4.49Å; F36-W112 HydrophobicContact CG-CD2 4.42Å; F36-W112 HydrophobicContact CG-CE3 4.12Å; F36-W112 AromaticContact CG-CH2 3.87Å; F36-W112 HydrophobicContact CG-CH2 3.87Å; F36-W112 HydrophobicContact CG-CZ2 4.11Å; F36-W112 AromaticContact CG-CZ3 3.85Å; F36-W112 HydrophobicContact CG-CZ3 3.85Å; F36-M174 HydrophobicContact CB-CE 4.01Å; F36-M174 HydrophobicContact CD2-CE 4.21Å |
| 37 | N | 74.6 | Confident | 78.5 | Confident | 70 Ų | 70 | 34 Ų | 34 | 37% | 0.374 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -60.3 | -34.7 | 177.8 | -66.8 | 12.2 | 0 | 0 | 0 | 112.2 | K34 | K34-N37 HydrophobicContact CD-CB 4.46Å; K34-N37 PolarHBondContact O-N 3.04Å |
| 38 | A | 74.5 | Confident | 77.5 | Confident | 33 Ų | 33 | 35.7 Ų | 35.7 | 27% | 0.273 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -73.5 | -28.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | K34 S35 F36 P158 M161 | K34-A38 WeakPolarHBondContact O-CB 3.17Å; K34-A38 PolarHBondContact O-N 2.89Å; S35-A38 PolarHBondContact O-N 3.14Å; F36-A38 PolarHBondContact O-N 2.77Å; A38-P158 HydrophobicContact CB-CB 4.46Å; A38-M161 HydrophobicContact CB-CB 3.95Å; A38-M161 HydrophobicContact CB-CG 3.9Å |
| 39 | A | 77.4 | Confident | 76.7 | Confident | 1 Ų | 1 | 35.4 Ų | 35.4 | 1% | 0.008 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -81.1 | -21.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | S35 F36 P41 E42 I43 M161 W170 M174 | S35-A39 PolarHBondContact O-N 2.76Å; F36-A39 CarbonylContact O-C 3.56Å; F36-A39 WeakPolarHBondContact O-CA 3.18Å; F36-A39 PolarHBondContact O-N 3.4Å; A39-P41 VanDerWaalsContact C-CD 3.48Å; A39-E42 PolarHBondContact O-N 2.98Å; A39-I43 HydrophobicContact CB-CD1 3.79Å; A39-I43 HydrophobicContact CB-CG1 4.27Å; A39-I43 WeakPolarHBondContact O-CG1 3.36Å; A39-I43 PolarHBondContact O-N 2.94Å; A39-M161 HydrophobicContact CB-CE 3.75Å; A39-W170 HydrophobicContact CB-CB 4.13Å; A39-W170 HydrophobicContact CB-CE3 4.38Å; A39-M174 HydrophobicContact CB-CE 3.59Å |
| 40 | V | 74 | Confident | 76.1 | Confident | 23 Ų | 23 | 37.7 Ų | 37.7 | 14% | 0.139 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -47.4 | -48.2 | -176.6 | 153.5 | 0 | 0 | 0 | 0 | 113.7 | F36 E42 I43 L44 I54 | F36-V40 HydrophobicContact CD1-CG2 4.14Å; F36-V40 HydrophobicContact CE1-CG2 3.91Å; F36-V40 HydrophobicContact CZ-CG2 4.44Å; F36-V40 WeakPolarHBondContact O-CG2 3.3Å; F36-V40 PolarHBondContact O-N 3.35Å; V40-E42 VanDerWaalsContact C-N 3.27Å; V40-E42 PolarHBondContact O-N 3Å; V40-I43 PolarHBondContact O-N 3.07Å; V40-L44 HydrophobicContact CG1-CD1 3.88Å; V40-L44 HydrophobicContact CG1-CG 4.35Å; V40-L44 WeakPolarHBondContact O-CB 3.3Å; V40-L44 WeakPolarHBondContact O-CG 3.38Å; V40-L44 PolarHBondContact O-N 3.27Å; V40-I54 HydrophobicContact CB-CD1 4.4Å; V40-I54 HydrophobicContact CG1-CD1 3.71Å; V40-I54 HydrophobicContact CG1-CG2 4.27Å; V40-I54 HydrophobicContact CG2-CD1 4.11Å; V40-I54 HydrophobicContact CG2-CG2 3.83Å |
| 41 | P | 71.8 | Confident | 75.5 | Confident | 88 Ų | 88 | 46.3 Ų | 46.3 | 57% | 0.571 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -57.8 | -39.4 | 179.9 | -25.9 | 35.7 | 0 | 0 | 0 | 113.1 | A39 A45 | A39-P41 VanDerWaalsContact C-CD 3.48Å; P41-A45 WeakPolarHBondContact O-CB 3.47Å; P41-A45 PolarHBondContact O-N 3.08Å |
| 42 | E | 72.3 | Confident | 75 | Confident | 52 Ų | 52 | 50.4 Ų | 50.4 | 24% | 0.243 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -77.7 | -34.5 | 179.6 | -158.7 | -177.2 | 147.9 | 0 | 0 | 112 | A39 V40 L44 A45 N46 A165 G169 W170 | A39-E42 PolarHBondContact O-N 2.98Å; V40-E42 VanDerWaalsContact C-N 3.27Å; V40-E42 PolarHBondContact O-N 3Å; E42-L44 VanDerWaalsContact C-N 3.33Å; E42-A45 PolarHBondContact O-N 2.9Å; E42-N46 WeakPolarHBondContact O-CB 3.31Å; E42-N46 PolarHBondContact O-N 3.48Å; E42-N46 PolarHBondContact O-ND2 3.47Å; E42-A165 WeakPolarHBondContact OE2-CB 3.46Å; E42-G169 WeakPolarHBondContact OE1-CA 3.26Å; E42-W170 HydrophobicContact CB-CB 4.23Å; E42-W170 HydrophobicContact CB-CG 4.44Å; E42-W170 HydrophobicContact CG-CB 4.32Å; E42-W170 HydrophobicContact CG-CG 4.38Å; E42-W170 VanDerWaalsContact OE1-CD1 3.25Å; E42-W170 PolarHBondContact OE1-N 2.9Å; E42-W170 VanDerWaalsContact OE2-CB 3.25Å; E42-W170 WeakPolarHBondContact OE2-CB 3.47Å; E42-W170 PolarHBondContact OE2-N 3.05Å |
| 43 | I | 74.1 | Confident | 74.6 | Confident | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.3 | -41.6 | 173.3 | -68.2 | 171.1 | 0 | 0 | 0 | 110.4 | F36 A39 V40 G47 V48 L49 W170 | F36-I43 HydrophobicContact CD2-CD1 4.3Å; F36-I43 HydrophobicContact CE2-CD1 3.93Å; A39-I43 HydrophobicContact CB-CD1 3.79Å; A39-I43 HydrophobicContact CB-CG1 4.27Å; A39-I43 WeakPolarHBondContact O-CG1 3.36Å; A39-I43 PolarHBondContact O-N 2.94Å; V40-I43 PolarHBondContact O-N 3.07Å; I43-G47 PolarHBondContact O-N 2.91Å; I43-V48 HydrophobicContact CG2-CB 4.03Å; I43-V48 HydrophobicContact CG2-CG1 4.44Å; I43-V48 PolarHBondContact O-N 3.35Å; I43-V48 VanDerWaalsContact O-N 3.11Å; I43-L49 HydrophobicContact CG2-CB 3.94Å; I43-L49 HydrophobicContact CG2-CD1 3.92Å; I43-L49 HydrophobicContact CG2-CG 3.99Å; I43-W170 HydrophobicContact CD1-CE3 4.32Å; I43-W170 HydrophobicContact CD1-CZ3 4.38Å; I43-W170 HydrophobicContact CG1-CD2 4.02Å; I43-W170 HydrophobicContact CG1-CE3 4.25Å; I43-W170 HydrophobicContact CG1-CG 4.49Å; I43-W170 HydrophobicContact CG1-CZ2 4.26Å |
| 44 | L | 71.8 | Confident | 74.2 | Confident | 57 Ų | 57 | 52.8 Ų | 52.8 | 30% | 0.298 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -66.3 | -45.3 | 173.9 | -74.9 | 174.2 | 0 | 0 | 0 | 111.6 | V40 E42 N46 G47 L49 R51 I54 | V40-L44 HydrophobicContact CG1-CD1 3.88Å; V40-L44 HydrophobicContact CG1-CG 4.35Å; V40-L44 WeakPolarHBondContact O-CB 3.3Å; V40-L44 WeakPolarHBondContact O-CG 3.38Å; V40-L44 PolarHBondContact O-N 3.27Å; E42-L44 VanDerWaalsContact C-N 3.33Å; L44-N46 VanDerWaalsContact C-N 3.28Å; L44-N46 PolarHBondContact O-N 2.81Å; L44-G47 PolarHBondContact O-N 3.45Å; L44-L49 WeakPolarHBondContact CD2-O 3.38Å; L44-R51 HydrophobicContact CD1-CG 4.38Å; L44-R51 HydrophobicContact CD2-CG 3.97Å; L44-I54 HydrophobicContact CD1-CD1 3.9Å; L44-I54 HydrophobicContact CD2-CD1 3.44Å; L44-I54 VanDerWaalsContact CD2-CD1 3.44Å; L44-I54 HydrophobicContact CG-CD1 3.51Å |
| 45 | A | 71.9 | Confident | 73.6 | Confident | 87 Ų | 87 | 51 Ų | 51 | 72% | 0.719 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -62.1 | -35.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | P41 E42 G47 | P41-A45 WeakPolarHBondContact O-CB 3.47Å; P41-A45 PolarHBondContact O-N 3.08Å; E42-A45 PolarHBondContact O-N 2.9Å; A45-G47 PolarHBondContact O-N 2.74Å |
| 46 | N | 74.1 | Confident | 73.5 | Confident | 95 Ų | 95 | 55.9 Ų | 55.9 | 51% | 0.508 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.2 | -1.7 | 174.7 | -72.5 | -52.5 | 0 | 0 | 0 | 113.7 | E42 L44 V48 | E42-N46 WeakPolarHBondContact O-CB 3.31Å; E42-N46 PolarHBondContact O-N 3.48Å; E42-N46 PolarHBondContact O-ND2 3.47Å; L44-N46 VanDerWaalsContact C-N 3.28Å; L44-N46 PolarHBondContact O-N 2.81Å; N46-V48 HydrophobicContact CB-CG2 3.85Å; N46-V48 PolarHBondContact O-N 3.23Å |
| 47 | G | 69.8 | Low | 73.7 | Confident | 63 Ų | 63 | 56 Ų | 56 | 65% | 0.649 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.9 | 18.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | I43 L44 A45 | I43-G47 PolarHBondContact O-N 2.91Å; L44-G47 PolarHBondContact O-N 3.45Å; A45-G47 PolarHBondContact O-N 2.74Å |
| 48 | V | 69.5 | Low | 73.7 | Confident | 40 Ų | 40 | 54.4 Ų | 54.4 | 24% | 0.242 | 34% | 0.335 | C | S | . | . | S | Bend | trans | -74.1 | -35.6 | -175.4 | 179.1 | 0 | 0 | 0 | 0 | 111.7 | I43 N46 F108 | I43-V48 HydrophobicContact CG2-CB 4.03Å; I43-V48 HydrophobicContact CG2-CG1 4.44Å; I43-V48 PolarHBondContact O-N 3.35Å; I43-V48 VanDerWaalsContact O-N 3.11Å; N46-V48 HydrophobicContact CB-CG2 3.85Å; N46-V48 PolarHBondContact O-N 3.23Å; V48-F108 HydrophobicContact CG1-CE2 3.67Å; V48-F108 HydrophobicContact CG1-CZ 4.11Å |
| 49 | L | 71.7 | Confident | 73.9 | Confident | 9 Ų | 9 | 56.6 Ų | 56.6 | 5% | 0.047 | 35% | 0.345 | C | S | . | . | S | Bend | trans | -134.4 | 151.5 | 177.9 | -69.3 | 176.2 | 0 | 0 | 0 | 110.1 | F36 I43 L44 D53 I54 L57 L105 F108 | F36-L49 HydrophobicContact CZ-CD1 4.24Å; I43-L49 HydrophobicContact CG2-CB 3.94Å; I43-L49 HydrophobicContact CG2-CD1 3.92Å; I43-L49 HydrophobicContact CG2-CG 3.99Å; L44-L49 WeakPolarHBondContact CD2-O 3.38Å; L49-D53 HydrophobicContact CB-CB 4.41Å; L49-D53 HydrophobicContact CD2-CB 4.2Å; L49-I54 HydrophobicContact CB-CG1 4.31Å; L49-L57 HydrophobicContact CD1-CD1 3.91Å; L49-L105 HydrophobicContact CD2-CB 3.83Å; L49-L105 HydrophobicContact CD2-CD1 3.93Å; L49-L105 HydrophobicContact CD2-CG 3.87Å; L49-F108 HydrophobicContact CD1-CD2 4.23Å; L49-F108 HydrophobicContact CD1-CG 4.24Å; L49-F108 HydrophobicContact CD2-CD2 4.32Å; L49-F108 HydrophobicContact CG-CD2 4.44Å |
| 50 | S | 76.2 | Confident | 74.1 | Confident | 48 Ų | 48 | 59.5 Ų | 59.5 | 34% | 0.336 | 36% | 0.36 | S | S | . | . | trans | -85.9 | 163.5 | 170.4 | 74.8 | 0 | 0 | 0 | 0 | 111.4 | S52 D53 I54 | S50-S52 VanDerWaalsContact C-N 3.27Å; S50-S52 PolarHBondContact O-N 2.99Å; S50-S52 PolarHBondContact OG-OG 2.97Å; S50-D53 WeakPolarHBondContact CB-OD2 3.49Å; S50-D53 PolarHBondContact N-OD2 3.43Å; S50-D53 PolarHBondContact O-N 3.17Å; S50-D53 VanDerWaalsContact O-N 3.17Å; S50-D53 PolarHBondContact OG-N 3.02Å; S50-D53 PolarHBondContact OG-OD1 2.97Å; S50-D53 PolarHBondContact OG-OD2 2.68Å; S50-I54 WeakPolarHBondContact O-CG1 3.42Å; S50-I54 PolarHBondContact O-N 2.7Å | ||
| 51 | R | 71.7 | Confident | 74.6 | Confident | 212 Ų | 212 | 58.8 Ų | 58.8 | 80% | 0.8 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -60.2 | -36.5 | 176.6 | -65.5 | -179 | -176.7 | 178.4 | 0.5 | 112.4 | L44 D53 I54 G55 | L44-R51 HydrophobicContact CD1-CG 4.38Å; L44-R51 HydrophobicContact CD2-CG 3.97Å; R51-D53 VanDerWaalsContact C-N 3.33Å; R51-I54 PolarHBondContact O-N 3.03Å; R51-G55 PolarHBondContact O-N 3.24Å |
| 52 | S | 73 | Confident | 75.1 | Confident | 86 Ų | 86 | 58 Ų | 58 | 60% | 0.601 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -64.6 | -38 | 176.3 | 40.2 | 0 | 0 | 0 | 0 | 112.2 | S50 I54 G55 L56 | S50-S52 VanDerWaalsContact C-N 3.27Å; S50-S52 PolarHBondContact O-N 2.99Å; S50-S52 PolarHBondContact OG-OG 2.97Å; S52-I54 VanDerWaalsContact C-N 3.31Å; S52-I54 PolarHBondContact O-N 3.49Å; S52-G55 PolarHBondContact O-N 3.34Å; S52-L56 PolarHBondContact O-N 3.16Å |
| 53 | D | 76.1 | Confident | 75.7 | Confident | 42 Ų | 42 | 60.1 Ų | 60.1 | 23% | 0.225 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -65.3 | -39.4 | 179.2 | -54.3 | -34.3 | 0 | 0 | 0 | 110.8 | L49 S50 R51 L56 L57 L105 | L49-D53 HydrophobicContact CB-CB 4.41Å; L49-D53 HydrophobicContact CD2-CB 4.2Å; S50-D53 WeakPolarHBondContact CB-OD2 3.49Å; S50-D53 PolarHBondContact N-OD2 3.43Å; S50-D53 PolarHBondContact O-N 3.17Å; S50-D53 VanDerWaalsContact O-N 3.17Å; S50-D53 PolarHBondContact OG-N 3.02Å; S50-D53 PolarHBondContact OG-OD1 2.97Å; S50-D53 PolarHBondContact OG-OD2 2.68Å; R51-D53 VanDerWaalsContact C-N 3.33Å; D53-L56 PolarHBondContact O-N 2.92Å; D53-L57 VanDerWaalsContact O-CG 3.25Å; D53-L57 WeakPolarHBondContact O-CG 3.39Å; D53-L57 PolarHBondContact O-N 2.75Å; D53-L105 HydrophobicContact CB-CD1 3.79Å; D53-L105 WeakPolarHBondContact OD1-CD1 3.33Å; D53-L105 WeakPolarHBondContact OD2-CD1 3.13Å |
| 54 | I | 75.4 | Confident | 76.5 | Confident | 26 Ų | 26 | 61.5 Ų | 61.5 | 13% | 0.133 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -65.4 | -41 | 178.3 | -62.7 | 174.9 | 0 | 0 | 0 | 111.2 | V40 L44 L49 S50 R51 S52 L56 L57 A58 | V40-I54 HydrophobicContact CB-CD1 4.4Å; V40-I54 HydrophobicContact CG1-CD1 3.71Å; V40-I54 HydrophobicContact CG1-CG2 4.27Å; V40-I54 HydrophobicContact CG2-CD1 4.11Å; V40-I54 HydrophobicContact CG2-CG2 3.83Å; L44-I54 HydrophobicContact CD1-CD1 3.9Å; L44-I54 HydrophobicContact CD2-CD1 3.44Å; L44-I54 VanDerWaalsContact CD2-CD1 3.44Å; L44-I54 HydrophobicContact CG-CD1 3.51Å; L49-I54 HydrophobicContact CB-CG1 4.31Å; S50-I54 WeakPolarHBondContact O-CG1 3.42Å; S50-I54 PolarHBondContact O-N 2.7Å; R51-I54 PolarHBondContact O-N 3.03Å; S52-I54 VanDerWaalsContact C-N 3.31Å; S52-I54 PolarHBondContact O-N 3.49Å; I54-L56 VanDerWaalsContact C-N 3.35Å; I54-L56 PolarHBondContact O-N 2.86Å; I54-L57 PolarHBondContact O-N 2.59Å; I54-A58 WeakPolarHBondContact O-CB 3.26Å; I54-A58 PolarHBondContact O-N 3.26Å |
| 55 | G | 69.3 | Low | 77.2 | Confident | 37 Ų | 37 | 58.8 Ų | 58.8 | 38% | 0.381 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.8 | -40.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | R51 S52 A58 T59 | R51-G55 PolarHBondContact O-N 3.24Å; S52-G55 PolarHBondContact O-N 3.34Å; G55-A58 PolarHBondContact O-N 3.3Å; G55-T59 PolarHBondContact O-N 3.25Å; G55-T59 PolarHBondContact O-OG1 3.03Å |
| 56 | L | 77.2 | Confident | 78 | Confident | 102 Ų | 102 | 54.7 Ų | 54.7 | 53% | 0.534 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -64.6 | -44.1 | 174.9 | -176.7 | 147.9 | 0 | 0 | 0 | 111.2 | S52 D53 I54 A58 T59 L60 | S52-L56 PolarHBondContact O-N 3.16Å; D53-L56 PolarHBondContact O-N 2.92Å; I54-L56 VanDerWaalsContact C-N 3.35Å; I54-L56 PolarHBondContact O-N 2.86Å; L56-A58 PolarHBondContact O-N 2.8Å; L56-T59 PolarHBondContact O-N 2.83Å; L56-L60 HydrophobicContact CD2-CD1 3.52Å; L56-L60 HydrophobicContact CD2-CG 4.19Å; L56-L60 WeakPolarHBondContact O-CG 3.45Å; L56-L60 PolarHBondContact O-N 2.99Å |
| 57 | L | 80.6 | Confident | 78.7 | Confident | 4 Ų | 4 | 53.5 Ų | 53.5 | 2% | 0.021 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -62.2 | -41.9 | 176 | -70.3 | 175 | 0 | 0 | 0 | 112.2 | F36 L49 D53 I54 T59 L60 F61 F108 A109 W112 | F36-L57 HydrophobicContact CE1-CD1 4.22Å; F36-L57 HydrophobicContact CZ-CD1 3.68Å; L49-L57 HydrophobicContact CD1-CD1 3.91Å; D53-L57 VanDerWaalsContact O-CG 3.25Å; D53-L57 WeakPolarHBondContact O-CG 3.39Å; D53-L57 PolarHBondContact O-N 2.75Å; I54-L57 PolarHBondContact O-N 2.59Å; L57-T59 VanDerWaalsContact C-N 3.35Å; L57-T59 PolarHBondContact O-N 2.78Å; L57-L60 PolarHBondContact O-N 3.32Å; L57-F61 WeakPolarHBondContact O-CB 3.13Å; L57-F61 PolarHBondContact O-N 3.15Å; L57-F108 HydrophobicContact CD1-CB 4.4Å; L57-A109 VanDerWaalsContact CD2-CA 3.42Å; L57-A109 HydrophobicContact CD2-CB 3.76Å; L57-W112 HydrophobicContact CD2-CB 4.32Å; L57-W112 PolarHBondContact O-NE1 2.98Å; L57-W112 VanDerWaalsContact O-NE1 3.08Å |
| 58 | A | 75.9 | Confident | 79.7 | Confident | 37 Ų | 37 | 50.5 Ų | 50.5 | 31% | 0.306 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.9 | -42.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I54 G55 L56 F61 Y62 | I54-A58 WeakPolarHBondContact O-CB 3.26Å; I54-A58 PolarHBondContact O-N 3.26Å; G55-A58 PolarHBondContact O-N 3.3Å; L56-A58 PolarHBondContact O-N 2.8Å; A58-F61 WeakPolarHBondContact O-CB 3.16Å; A58-F61 PolarHBondContact O-N 2.92Å; A58-Y62 WeakPolarHBondContact O-CD2 3.3Å; A58-Y62 PolarHBondContact O-N 2.92Å; A58-Y62 VanDerWaalsContact O-N 3.15Å |
| 59 | T | 77.6 | Confident | 80.6 | Confident | 80 Ų | 80 | 49.1 Ų | 49.1 | 49% | 0.491 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -65 | -47.8 | 177.7 | -55 | 0 | 0 | 0 | 0 | 111.7 | G55 L56 L57 F61 Y62 I63 | G55-T59 PolarHBondContact O-N 3.25Å; G55-T59 PolarHBondContact O-OG1 3.03Å; L56-T59 PolarHBondContact O-N 2.83Å; L57-T59 VanDerWaalsContact C-N 3.35Å; L57-T59 PolarHBondContact O-N 2.78Å; T59-F61 VanDerWaalsContact C-N 3.25Å; T59-F61 PolarHBondContact O-N 3.21Å; T59-Y62 PolarHBondContact O-N 3.12Å; T59-I63 HydrophobicContact CG2-CD1 4.06Å; T59-I63 WeakPolarHBondContact O-CG1 3.45Å; T59-I63 PolarHBondContact O-N 3.01Å; T59-I63 VanDerWaalsContact O-N 3.16Å |
| 60 | L | 82.5 | Confident | 81.4 | Confident | 61 Ų | 61 | 50.6 Ų | 50.6 | 32% | 0.319 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -57.1 | -41.8 | 175.7 | -75 | 177.4 | 0 | 0 | 0 | 111.4 | L56 L57 Y62 I63 T64 V113 | L56-L60 HydrophobicContact CD2-CD1 3.52Å; L56-L60 HydrophobicContact CD2-CG 4.19Å; L56-L60 WeakPolarHBondContact O-CG 3.45Å; L56-L60 PolarHBondContact O-N 2.99Å; L57-L60 PolarHBondContact O-N 3.32Å; L60-Y62 PolarHBondContact O-N 2.99Å; L60-I63 PolarHBondContact O-N 3.3Å; L60-T64 WeakPolarHBondContact O-CB 3.48Å; L60-T64 PolarHBondContact O-N 3.45Å; L60-T64 PolarHBondContact O-OG1 2.59Å; L60-T64 VanDerWaalsContact O-OG1 3.05Å; L60-V113 HydrophobicContact CB-CG2 4.34Å; L60-V113 HydrophobicContact CD1-CG2 4.46Å |
| 61 | F | 84.5 | Confident | 82 | Confident | 9 Ų | 9 | 51 Ų | 51 | 4% | 0.039 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -58.2 | -49.9 | 177.2 | -177.2 | -87.1 | 0 | 0 | 0 | 112.2 | R33 L57 A58 T59 I63 T64 Y65 W112 A116 | R33-F61 HydrophobicContact CG-CE1 4Å; R33-F61 HydrophobicContact CG-CE2 4.33Å; R33-F61 HydrophobicContact CG-CZ 3.55Å; L57-F61 WeakPolarHBondContact O-CB 3.13Å; L57-F61 PolarHBondContact O-N 3.15Å; A58-F61 WeakPolarHBondContact O-CB 3.16Å; A58-F61 PolarHBondContact O-N 2.92Å; T59-F61 VanDerWaalsContact C-N 3.25Å; T59-F61 PolarHBondContact O-N 3.21Å; F61-I63 VanDerWaalsContact C-N 3.34Å; F61-I63 PolarHBondContact O-N 3.4Å; F61-T64 PolarHBondContact O-N 3.45Å; F61-Y65 HydrophobicContact CE1-CD2 4.29Å; F61-Y65 HydrophobicContact CE1-CG 4.16Å; F61-Y65 HydrophobicContact CZ-CD2 4.05Å; F61-Y65 HydrophobicContact CZ-CG 4.37Å; F61-Y65 WeakPolarHBondContact O-CA 3.44Å; F61-Y65 WeakPolarHBondContact O-CB 3.41Å; F61-Y65 PolarHBondContact O-N 3.48Å; F61-W112 HydrophobicContact CB-CZ2 4.36Å; F61-W112 VanDerWaalsContact CB-NE1 3.35Å; F61-W112 AromaticContact CD2-CD2 4Å; F61-W112 HydrophobicContact CD2-CD2 4Å; F61-W112 AromaticContact CD2-CE2 3.43Å; F61-W112 VanDerWaalsContact CD2-CE2 3.43Å; F61-W112 HydrophobicContact CD2-CG 4.49Å; F61-W112 HydrophobicContact CD2-CH2 4.02Å; F61-W112 AromaticContact CD2-CZ2 3.45Å; F61-W112 HydrophobicContact CD2-CZ2 3.45Å; F61-W112 VanDerWaalsContact CD2-CZ2 3.45Å; F61-W112 AromaticContact CD2-NE1 3.72Å; F61-W112 HydrophobicContact CE2-CH2 4.09Å; F61-W112 AromaticContact CE2-CZ2 3.96Å; F61-W112 HydrophobicContact CE2-CZ2 3.96Å; F61-W112 AromaticContact CG-CE2 3.94Å; F61-W112 AromaticContact CG-CZ2 3.95Å; F61-W112 HydrophobicContact CG-CZ2 3.95Å; F61-W112 AromaticContact CG-NE1 3.86Å; F61-A116 HydrophobicContact CD2-CB 3.46Å; F61-A116 VanDerWaalsContact CD2-CB 3.46Å; F61-A116 HydrophobicContact CE2-CB 3.63Å; F61-A116 HydrophobicContact CG-CB 4.08Å; F61-A116 HydrophobicContact CZ-CB 4.37Å |
| 62 | Y | 82.9 | Confident | 82.7 | Confident | 72 Ų | 72 | 41 Ų | 41 | 28% | 0.282 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -62.8 | -41.5 | -178.3 | -70.6 | -51.7 | 0 | 0 | 0 | 112.5 | A58 T59 L60 G66 Y377 | A58-Y62 WeakPolarHBondContact O-CD2 3.3Å; A58-Y62 PolarHBondContact O-N 2.92Å; A58-Y62 VanDerWaalsContact O-N 3.15Å; T59-Y62 PolarHBondContact O-N 3.12Å; L60-Y62 PolarHBondContact O-N 2.99Å; Y62-G66 PolarHBondContact O-N 2.84Å; Y62-Y377 AromaticContact CD1-CD1 3.67Å; Y62-Y377 HydrophobicContact CD1-CD1 3.67Å; Y62-Y377 AromaticContact CD1-CE1 3.92Å; Y62-Y377 HydrophobicContact CD1-CE1 3.92Å; Y62-Y377 HydrophobicContact CE1-CD1 4.42Å; Y62-Y377 HydrophobicContact CE1-CE1 4.3Å; Y62-Y377 HydrophobicContact CG-CD1 4.48Å |
| 63 | I | 84.9 | Confident | 83.3 | Confident | 96 Ų | 96 | 36.9 Ų | 36.9 | 49% | 0.492 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -64.7 | -53.6 | 177.7 | -64 | 170.4 | 0 | 0 | 0 | 110.2 | T59 L60 F61 Y65 G66 V67 | T59-I63 HydrophobicContact CG2-CD1 4.06Å; T59-I63 WeakPolarHBondContact O-CG1 3.45Å; T59-I63 PolarHBondContact O-N 3.01Å; T59-I63 VanDerWaalsContact O-N 3.16Å; L60-I63 PolarHBondContact O-N 3.3Å; F61-I63 VanDerWaalsContact C-N 3.34Å; F61-I63 PolarHBondContact O-N 3.4Å; I63-Y65 VanDerWaalsContact C-N 3.29Å; I63-Y65 PolarHBondContact O-N 3.1Å; I63-G66 PolarHBondContact O-N 2.89Å; I63-V67 WeakPolarHBondContact O-CG2 3.42Å; I63-V67 PolarHBondContact O-N 3.34Å |
| 64 | T | 89 | Confident | 83.8 | Confident | 28 Ų | 28 | 36.6 Ų | 36.6 | 17% | 0.172 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -62.8 | -38.2 | -179.5 | -57.5 | 0 | 0 | 0 | 0 | 111.7 | L60 F61 S68 V113 A116 F117 | L60-T64 WeakPolarHBondContact O-CB 3.48Å; L60-T64 PolarHBondContact O-N 3.45Å; L60-T64 PolarHBondContact O-OG1 2.59Å; L60-T64 VanDerWaalsContact O-OG1 3.05Å; F61-T64 PolarHBondContact O-N 3.45Å; T64-S68 WeakPolarHBondContact O-CB 3.11Å; T64-S68 PolarHBondContact O-N 3.29Å; T64-V113 HydrophobicContact CG2-CG1 3.88Å; T64-V113 WeakPolarHBondContact CG2-O 3.33Å; T64-A116 HydrophobicContact CG2-CB 3.93Å; T64-F117 HydrophobicContact CG2-CB 4.11Å |
| 65 | Y | 88.3 | Confident | 84.3 | Confident | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -67.7 | -41.1 | 178.5 | -174.6 | -95.2 | 0 | 0 | 0 | 112 | R33 F61 I63 S68 K69 A116 Q119 Y377 | R33-Y65 VanDerWaalsContact CZ-CZ 3.44Å; R33-Y65 VanDerWaalsContact CZ-OH 3.32Å; R33-Y65 PolarHBondContact NH1-OH 2.91Å; R33-Y65 PolarHBondContact NH2-OH 2.98Å; F61-Y65 HydrophobicContact CE1-CD2 4.29Å; F61-Y65 HydrophobicContact CE1-CG 4.16Å; F61-Y65 HydrophobicContact CZ-CD2 4.05Å; F61-Y65 HydrophobicContact CZ-CG 4.37Å; F61-Y65 WeakPolarHBondContact O-CA 3.44Å; F61-Y65 WeakPolarHBondContact O-CB 3.41Å; F61-Y65 PolarHBondContact O-N 3.48Å; I63-Y65 VanDerWaalsContact C-N 3.29Å; I63-Y65 PolarHBondContact O-N 3.1Å; Y65-S68 PolarHBondContact O-N 3.43Å; Y65-K69 HydrophobicContact CD1-CD 4.05Å; Y65-K69 HydrophobicContact CD1-CG 4.35Å; Y65-K69 HydrophobicContact CE1-CD 3.45Å; Y65-K69 VanDerWaalsContact CE1-CD 3.45Å; Y65-K69 HydrophobicContact CE1-CG 3.91Å; Y65-K69 WeakPolarHBondContact O-CB 3.37Å; Y65-K69 WeakPolarHBondContact O-CG 3.17Å; Y65-K69 PolarHBondContact O-N 3.27Å; Y65-K69 WeakPolarHBondContact OH-CE 3.34Å; Y65-A116 WeakPolarHBondContact CD2-O 3.18Å; Y65-Q119 HydrophobicContact CD2-CB 4.09Å; Y65-Q119 HydrophobicContact CE2-CB 3.82Å; Y65-Y377 HydrophobicContact CD1-CD1 4.06Å; Y65-Y377 AromaticContact CD1-CD2 3.74Å; Y65-Y377 HydrophobicContact CD1-CD2 3.74Å; Y65-Y377 AromaticContact CD1-CE1 3.65Å; Y65-Y377 HydrophobicContact CD1-CE1 3.65Å; Y65-Y377 AromaticContact CD1-CE2 3.39Å; Y65-Y377 HydrophobicContact CD1-CE2 3.39Å; Y65-Y377 HydrophobicContact CD1-CG 4.1Å; Y65-Y377 AromaticContact CD1-CZ 3.31Å; Y65-Y377 HydrophobicContact CE1-CD2 4.06Å; Y65-Y377 AromaticContact CE1-CE1 3.96Å; Y65-Y377 HydrophobicContact CE1-CE1 3.96Å; Y65-Y377 AromaticContact CE1-CE2 3.26Å; Y65-Y377 HydrophobicContact CE1-CE2 3.26Å; Y65-Y377 AromaticContact CE1-CZ 3.16Å; Y65-Y377 WeakPolarHBondContact CE1-OH 3.43Å |
| 66 | G | 87.2 | Confident | 84.8 | Confident | 1 Ų | 1 | 36.6 Ų | 36.6 | 1% | 0.01 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.4 | -50.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y62 I63 S68 K69 F70 L374 | Y62-G66 PolarHBondContact O-N 2.84Å; I63-G66 PolarHBondContact O-N 2.89Å; G66-S68 VanDerWaalsContact C-N 3.33Å; G66-S68 PolarHBondContact O-N 3.27Å; G66-K69 PolarHBondContact O-N 2.9Å; G66-F70 PolarHBondContact O-N 2.97Å; G66-L374 VanDerWaalsContact C-CD1 3.43Å |
| 67 | V | 90.1 | Very high | 84.9 | Confident | 71 Ų | 71 | 32.5 Ų | 32.5 | 43% | 0.43 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -61.7 | -44 | 177.1 | 174.6 | 0 | 0 | 0 | 0 | 110.8 | I63 K69 F70 V71 L374 | I63-V67 WeakPolarHBondContact O-CG2 3.42Å; I63-V67 PolarHBondContact O-N 3.34Å; V67-K69 PolarHBondContact O-N 3.45Å; V67-F70 PolarHBondContact O-N 2.96Å; V67-V71 HydrophobicContact CG1-CG2 4.14Å; V67-V71 WeakPolarHBondContact O-CG2 3.3Å; V67-V71 PolarHBondContact O-N 3.46Å; V67-L374 HydrophobicContact CG2-CD1 4.05Å |
| 68 | S | 90.5 | Very high | 84.7 | Confident | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -63.5 | -41.2 | 178.8 | -178.4 | 0 | 0 | 0 | 0 | 112.3 | T64 Y65 G66 F70 V71 S72 F117 | T64-S68 WeakPolarHBondContact O-CB 3.11Å; T64-S68 PolarHBondContact O-N 3.29Å; Y65-S68 PolarHBondContact O-N 3.43Å; G66-S68 VanDerWaalsContact C-N 3.33Å; G66-S68 PolarHBondContact O-N 3.27Å; S68-F70 PolarHBondContact O-N 3.28Å; S68-V71 PolarHBondContact O-N 2.95Å; S68-S72 WeakPolarHBondContact O-CA 3.2Å; S68-S72 WeakPolarHBondContact O-CB 3Å; S68-S72 PolarHBondContact O-N 3.39Å; S68-S72 PolarHBondContact O-OG 3.1Å; S68-F117 WeakPolarHBondContact CB-O 3.5Å; S68-F117 PolarHBondContact OG-O 3.38Å |
| 69 | K | 88 | Confident | 84.9 | Confident | 10 Ų | 10 | 38.8 Ų | 38.8 | 4% | 0.043 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -53.9 | -42.7 | 174.4 | -89.5 | -175.3 | 151.6 | -179.2 | 0 | 111.9 | Y65 G66 V67 S72 G73 P124 G370 Y377 | Y65-K69 HydrophobicContact CD1-CD 4.05Å; Y65-K69 HydrophobicContact CD1-CG 4.35Å; Y65-K69 HydrophobicContact CE1-CD 3.45Å; Y65-K69 VanDerWaalsContact CE1-CD 3.45Å; Y65-K69 HydrophobicContact CE1-CG 3.91Å; Y65-K69 WeakPolarHBondContact O-CB 3.37Å; Y65-K69 WeakPolarHBondContact O-CG 3.17Å; Y65-K69 PolarHBondContact O-N 3.27Å; Y65-K69 WeakPolarHBondContact OH-CE 3.34Å; G66-K69 PolarHBondContact O-N 2.9Å; V67-K69 PolarHBondContact O-N 3.45Å; K69-S72 PolarHBondContact O-OG 3.42Å; K69-G73 PolarHBondContact O-N 3.3Å; K69-P124 VanDerWaalsContact O-CG 3.31Å; K69-P124 WeakPolarHBondContact O-CG 3.35Å; K69-G370 VanDerWaalsContact O-CA 3.25Å; K69-G370 WeakPolarHBondContact O-CA 3.24Å; K69-Y377 HydrophobicContact CD-CD2 4.1Å; K69-Y377 HydrophobicContact CD-CE2 3.67Å |
| 70 | F | 88 | Confident | 85 | Confident | 40 Ų | 40 | 38 Ų | 38 | 18% | 0.175 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -70.9 | -51 | 178.1 | 179.5 | -128.5 | 0 | 0 | 0 | 112.7 | G66 V67 S68 S72 G73 I74 L234 F371 L374 | G66-F70 PolarHBondContact O-N 2.97Å; V67-F70 PolarHBondContact O-N 2.96Å; S68-F70 PolarHBondContact O-N 3.28Å; F70-S72 VanDerWaalsContact C-N 3.33Å; F70-S72 PolarHBondContact O-N 3.15Å; F70-G73 WeakPolarHBondContact O-CA 3.39Å; F70-G73 PolarHBondContact O-N 2.94Å; F70-G73 VanDerWaalsContact O-N 3.1Å; F70-I74 HydrophobicContact CD1-CD1 4.45Å; F70-I74 HydrophobicContact CD2-CD1 4.37Å; F70-I74 HydrophobicContact CE1-CD1 3.95Å; F70-I74 HydrophobicContact CE2-CD1 3.86Å; F70-I74 HydrophobicContact CE2-CG1 4.2Å; F70-I74 HydrophobicContact CZ-CD1 3.64Å; F70-I74 HydrophobicContact CZ-CG1 4.46Å; F70-I74 PolarHBondContact O-N 3.25Å; F70-I74 VanDerWaalsContact O-N 3.11Å; F70-L234 HydrophobicContact CZ-CD2 4.09Å; F70-F371 HydrophobicContact CD2-CB 3.64Å; F70-F371 AromaticContact CD2-CD2 3.94Å; F70-F371 HydrophobicContact CD2-CD2 3.94Å; F70-F371 HydrophobicContact CD2-CG 4.31Å; F70-F371 HydrophobicContact CE1-CD2 4.45Å; F70-F371 HydrophobicContact CE2-CB 3.73Å; F70-F371 AromaticContact CE2-CD2 3.57Å; F70-F371 HydrophobicContact CE2-CD2 3.57Å; F70-F371 HydrophobicContact CE2-CG 4.12Å; F70-F371 AromaticContact CZ-CD2 3.84Å; F70-F371 HydrophobicContact CZ-CD2 3.84Å; F70-L374 HydrophobicContact CB-CB 4.14Å; F70-L374 HydrophobicContact CB-CD2 4.33Å; F70-L374 HydrophobicContact CD1-CD2 4.34Å; F70-L374 HydrophobicContact CG-CD2 4.48Å |
| 71 | V | 89.2 | Confident | 84.8 | Confident | 57 Ų | 57 | 35.1 Ų | 35.1 | 35% | 0.345 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -58.9 | -47.1 | 179.1 | 172.4 | 0 | 0 | 0 | 0 | 110.8 | V67 S68 G73 I74 V75 | V67-V71 HydrophobicContact CG1-CG2 4.14Å; V67-V71 WeakPolarHBondContact O-CG2 3.3Å; V67-V71 PolarHBondContact O-N 3.46Å; S68-V71 PolarHBondContact O-N 2.95Å; V71-G73 VanDerWaalsContact C-N 3.31Å; V71-G73 PolarHBondContact O-N 3.44Å; V71-I74 PolarHBondContact O-N 3.46Å; V71-V75 HydrophobicContact CG1-CG2 4.29Å; V71-V75 WeakPolarHBondContact O-CG2 3.38Å; V71-V75 PolarHBondContact O-N 3.21Å |
| 72 | S | 87 | Confident | 84.7 | Confident | 1 Ų | 1 | 37.9 Ų | 37.9 | 1% | 0.007 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -67.1 | -30.7 | 177.3 | 70.1 | 0 | 0 | 0 | 0 | 112.4 | S68 K69 F70 V75 S76 G120 | S68-S72 WeakPolarHBondContact O-CA 3.2Å; S68-S72 WeakPolarHBondContact O-CB 3Å; S68-S72 PolarHBondContact O-N 3.39Å; S68-S72 PolarHBondContact O-OG 3.1Å; K69-S72 PolarHBondContact O-OG 3.42Å; F70-S72 VanDerWaalsContact C-N 3.33Å; F70-S72 PolarHBondContact O-N 3.15Å; S72-V75 PolarHBondContact O-N 3.06Å; S72-S76 WeakPolarHBondContact O-CA 3.41Å; S72-S76 WeakPolarHBondContact O-CB 3.35Å; S72-S76 PolarHBondContact O-N 3.49Å; S72-S76 PolarHBondContact O-OG 3.02Å; S72-G120 PolarHBondContact OG-O 3.41Å; S72-G120 VanDerWaalsContact OG-O 3.11Å |
| 73 | G | 85.1 | Confident | 84.8 | Confident | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -54.6 | -54.7 | 167.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | K69 F70 V71 V75 S76 D77 G366 | K69-G73 PolarHBondContact O-N 3.3Å; F70-G73 WeakPolarHBondContact O-CA 3.39Å; F70-G73 PolarHBondContact O-N 2.94Å; F70-G73 VanDerWaalsContact O-N 3.1Å; V71-G73 VanDerWaalsContact C-N 3.31Å; V71-G73 PolarHBondContact O-N 3.44Å; G73-V75 PolarHBondContact O-N 3.06Å; G73-S76 PolarHBondContact O-N 3.24Å; G73-S76 PolarHBondContact O-OG 3.35Å; G73-D77 WeakPolarHBondContact O-CB 3.25Å; G73-D77 VanDerWaalsContact O-CG 3.23Å; G73-D77 PolarHBondContact O-N 3.28Å; G73-G366 VanDerWaalsContact CA-C 3.42Å; G73-G366 WeakPolarHBondContact CA-O 3.48Å |
| 74 | I | 86 | Confident | 84.9 | Confident | 37 Ų | 37 | 35.7 Ų | 35.7 | 19% | 0.19 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -61.9 | -44.4 | 179.6 | -60.3 | 168.5 | 0 | 0 | 0 | 112.4 | F70 V71 L229 A367 | F70-I74 HydrophobicContact CD1-CD1 4.45Å; F70-I74 HydrophobicContact CD2-CD1 4.37Å; F70-I74 HydrophobicContact CE1-CD1 3.95Å; F70-I74 HydrophobicContact CE2-CD1 3.86Å; F70-I74 HydrophobicContact CE2-CG1 4.2Å; F70-I74 HydrophobicContact CZ-CD1 3.64Å; F70-I74 HydrophobicContact CZ-CG1 4.46Å; F70-I74 PolarHBondContact O-N 3.25Å; F70-I74 VanDerWaalsContact O-N 3.11Å; V71-I74 PolarHBondContact O-N 3.46Å; I74-L229 HydrophobicContact CD1-CD2 4.14Å; I74-L229 HydrophobicContact CG1-CD1 4.08Å; I74-L229 HydrophobicContact CG1-CD2 4.07Å; I74-L229 HydrophobicContact CG2-CD2 4.06Å; I74-A367 HydrophobicContact CG1-CB 4.01Å |
| 75 | V | 85.9 | Confident | 84.9 | Confident | 62 Ų | 62 | 34.4 Ų | 34.4 | 38% | 0.376 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -72.9 | -39.7 | -178.3 | -179.6 | 0 | 0 | 0 | 0 | 110.8 | V71 S72 G73 D77 R78 S79 F84 | V71-V75 HydrophobicContact CG1-CG2 4.29Å; V71-V75 WeakPolarHBondContact O-CG2 3.38Å; V71-V75 PolarHBondContact O-N 3.21Å; S72-V75 PolarHBondContact O-N 3.06Å; G73-V75 PolarHBondContact O-N 3.06Å; V75-D77 VanDerWaalsContact C-N 3.31Å; V75-D77 PolarHBondContact O-N 3.29Å; V75-R78 PolarHBondContact O-N 3.06Å; V75-R78 VanDerWaalsContact O-N 3.1Å; V75-S79 VanDerWaalsContact O-CB 3.3Å; V75-S79 WeakPolarHBondContact O-CB 3.48Å; V75-S79 PolarHBondContact O-N 3.07Å; V75-S79 PolarHBondContact O-OG 3.29Å; V75-F84 HydrophobicContact CB-CE2 4Å; V75-F84 HydrophobicContact CB-CZ 4.08Å; V75-F84 HydrophobicContact CG1-CD2 4.25Å; V75-F84 HydrophobicContact CG1-CE2 3.43Å; V75-F84 VanDerWaalsContact CG1-CE2 3.43Å; V75-F84 HydrophobicContact CG1-CZ 4.03Å |
| 76 | S | 80.9 | Confident | 85 | Confident | 1 Ų | 1 | 34.4 Ų | 34.4 | 1% | 0.007 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -62 | -40.7 | 178.3 | 72.1 | 0 | 0 | 0 | 0 | 110.8 | S72 G73 R78 S79 R128 | S72-S76 WeakPolarHBondContact O-CA 3.41Å; S72-S76 WeakPolarHBondContact O-CB 3.35Å; S72-S76 PolarHBondContact O-N 3.49Å; S72-S76 PolarHBondContact O-OG 3.02Å; G73-S76 PolarHBondContact O-N 3.24Å; G73-S76 PolarHBondContact O-OG 3.35Å; S76-R78 PolarHBondContact O-N 3.33Å; S76-S79 PolarHBondContact O-N 3.09Å; S76-R128 PolarHBondContact O-NH1 3.11Å |
| 77 | D | 78.4 | Confident | 85.2 | Confident | 15 Ų | 15 | 38.6 Ų | 38.6 | 8% | 0.08 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -60 | -28.2 | 176.5 | -75.2 | -19.9 | 0 | 0 | 0 | 112.8 | G73 V75 R128 E363 A364 G366 A367 | G73-D77 WeakPolarHBondContact O-CB 3.25Å; G73-D77 VanDerWaalsContact O-CG 3.23Å; G73-D77 PolarHBondContact O-N 3.28Å; V75-D77 VanDerWaalsContact C-N 3.31Å; V75-D77 PolarHBondContact O-N 3.29Å; D77-R128 PolarHBondContact O-NH1 3.4Å; D77-E363 VanDerWaalsContact CB-O 3.26Å; D77-E363 WeakPolarHBondContact CB-O 3.46Å; D77-A364 VanDerWaalsContact OD2-CA 3.28Å; D77-A364 WeakPolarHBondContact OD2-CA 3.38Å; D77-G366 WeakPolarHBondContact OD1-CA 3.44Å; D77-G366 PolarHBondContact OD1-N 2.95Å; D77-G366 VanDerWaalsContact OD1-N 3.13Å; D77-A367 VanDerWaalsContact OD2-CB 3.25Å; D77-A367 WeakPolarHBondContact OD2-CB 3.47Å; D77-A367 PolarHBondContact OD2-N 3.3Å |
| 78 | R | 76.9 | Confident | 85.3 | Confident | 132 Ų | 132 | 35.2 Ų | 35.2 | 50% | 0.498 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -90.8 | -18.3 | 175.2 | -61.9 | -179.5 | -173.8 | 174.8 | 5.4 | 113.8 | V75 S76 | V75-R78 PolarHBondContact O-N 3.06Å; V75-R78 VanDerWaalsContact O-N 3.1Å; S76-R78 PolarHBondContact O-N 3.33Å |
| 79 | S | 79.3 | Confident | 85.4 | Confident | 42 Ų | 42 | 35.2 Ų | 35.2 | 29% | 0.294 | 17% | 0.169 | S | C | . | . | S | Bend | trans | -101.1 | 165.7 | -173 | -56.7 | 0 | 0 | 0 | 0 | 111.3 | V75 S76 A81 R128 | V75-S79 VanDerWaalsContact O-CB 3.3Å; V75-S79 WeakPolarHBondContact O-CB 3.48Å; V75-S79 PolarHBondContact O-N 3.07Å; V75-S79 PolarHBondContact O-OG 3.29Å; S76-S79 PolarHBondContact O-N 3.09Å; S79-A81 PolarHBondContact O-N 3.26Å; S79-R128 PolarHBondContact O-NH1 3.03Å |
| 80 | N | 80.4 | Confident | 85.7 | Confident | 64 Ų | 64 | 36.6 Ų | 36.6 | 34% | 0.342 | 18% | 0.177 | S | C | . | . | trans | -74 | 116.9 | 168.8 | -173.6 | -31.2 | 0 | 0 | 0 | 109 | R82 Y83 F84 | N80-R82 PolarHBondContact O-N 2.96Å; N80-R82 VanDerWaalsContact O-N 3.08Å; N80-R82 WeakPolarHBondContact OD1-CB 3.41Å; N80-R82 PolarHBondContact OD1-N 3.06Å; N80-Y83 HydrophobicContact CB-CD2 3.99Å; N80-Y83 PolarHBondContact O-N 3.36Å; N80-F84 WeakPolarHBondContact O-CB 3.38Å; N80-F84 PolarHBondContact O-N 2.96Å | ||
| 81 | A | 79.2 | Confident | 85.9 | Confident | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -51.5 | -34.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | S79 M85 V125 L129 D194 | S79-A81 PolarHBondContact O-N 3.26Å; A81-M85 WeakPolarHBondContact O-CB 3.36Å; A81-M85 PolarHBondContact O-N 2.85Å; A81-V125 HydrophobicContact CB-CG1 3.63Å; A81-L129 HydrophobicContact CB-CD1 4.25Å; A81-L129 HydrophobicContact CB-CD2 3.9Å; A81-L129 HydrophobicContact CB-CG 4.05Å; A81-D194 HydrophobicContact CB-CB 4.44Å; A81-D194 WeakPolarHBondContact CB-OD1 3.41Å |
| 82 | R | 82.1 | Confident | 86.1 | Confident | 67 Ų | 67 | 32.8 Ų | 32.8 | 25% | 0.253 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -56.9 | -56.9 | 177.8 | 176 | -174.1 | 176.6 | -176.5 | -9.6 | 112.4 | N80 G86 C189 L192 | N80-R82 PolarHBondContact O-N 2.96Å; N80-R82 VanDerWaalsContact O-N 3.08Å; N80-R82 WeakPolarHBondContact OD1-CB 3.41Å; N80-R82 PolarHBondContact OD1-N 3.06Å; R82-G86 PolarHBondContact O-N 3.14Å; R82-C189 PolarHBondContact NE-O 3.38Å; R82-C189 PolarHBondContact NH2-O 3.26Å; R82-L192 HydrophobicContact CB-CB 4.18Å; R82-L192 WeakPolarHBondContact CD-O 3.45Å; R82-L192 HydrophobicContact CG-CB 4.11Å; R82-L192 WeakPolarHBondContact CG-O 3.3Å |
| 83 | Y | 85.2 | Confident | 86.4 | Confident | 107 Ų | 107 | 32.7 Ų | 32.7 | 42% | 0.42 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -76.9 | -34.4 | -176.8 | -62.4 | -63 | 0 | 0 | 0 | 111 | N80 G86 I87 | N80-Y83 HydrophobicContact CB-CD2 3.99Å; N80-Y83 PolarHBondContact O-N 3.36Å; Y83-G86 PolarHBondContact O-N 3.38Å; Y83-I87 WeakPolarHBondContact O-CB 3.45Å; Y83-I87 WeakPolarHBondContact O-CD1 3.32Å; Y83-I87 WeakPolarHBondContact O-CG1 3.11Å; Y83-I87 PolarHBondContact O-N 3.42Å |
| 84 | F | 87.2 | Confident | 86.8 | Confident | 15 Ų | 15 | 36.7 Ų | 36.7 | 7% | 0.066 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -64.6 | -46.4 | -178.5 | -163.1 | -94 | 0 | 0 | 0 | 112 | V75 N80 G88 W121 V125 | V75-F84 HydrophobicContact CB-CE2 4Å; V75-F84 HydrophobicContact CB-CZ 4.08Å; V75-F84 HydrophobicContact CG1-CD2 4.25Å; V75-F84 HydrophobicContact CG1-CE2 3.43Å; V75-F84 VanDerWaalsContact CG1-CE2 3.43Å; V75-F84 HydrophobicContact CG1-CZ 4.03Å; N80-F84 WeakPolarHBondContact O-CB 3.38Å; N80-F84 PolarHBondContact O-N 2.96Å; F84-G88 PolarHBondContact O-N 3.45Å; F84-W121 HydrophobicContact CD1-CB 4.17Å; F84-W121 HydrophobicContact CD1-CD2 4.33Å; F84-W121 HydrophobicContact CD1-CE3 4.01Å; F84-W121 HydrophobicContact CD1-CG 4.45Å; F84-W121 HydrophobicContact CD2-CE3 4.14Å; F84-W121 HydrophobicContact CD2-CZ3 4.14Å; F84-W121 HydrophobicContact CE1-CB 3.59Å; F84-W121 AromaticContact CE1-CD2 3.59Å; F84-W121 HydrophobicContact CE1-CD2 3.59Å; F84-W121 AromaticContact CE1-CE3 3.71Å; F84-W121 HydrophobicContact CE1-CE3 3.71Å; F84-W121 AromaticContact CE1-CG 3.58Å; F84-W121 HydrophobicContact CE1-CG 3.58Å; F84-W121 HydrophobicContact CE2-CD2 4.06Å; F84-W121 AromaticContact CE2-CE3 3.79Å; F84-W121 HydrophobicContact CE2-CE3 3.79Å; F84-W121 HydrophobicContact CE2-CH2 4.08Å; F84-W121 HydrophobicContact CE2-CZ2 4.33Å; F84-W121 AromaticContact CE2-CZ3 3.81Å; F84-W121 HydrophobicContact CE2-CZ3 3.81Å; F84-W121 HydrophobicContact CG-CE3 4.25Å; F84-W121 HydrophobicContact CZ-CB 4.31Å; F84-W121 AromaticContact CZ-CD2 3.42Å; F84-W121 HydrophobicContact CZ-CD2 3.42Å; F84-W121 VanDerWaalsContact CZ-CD2 3.42Å; F84-W121 AromaticContact CZ-CE2 3.78Å; F84-W121 AromaticContact CZ-CE3 3.58Å; F84-W121 HydrophobicContact CZ-CE3 3.58Å; F84-W121 AromaticContact CZ-CG 3.79Å; F84-W121 HydrophobicContact CZ-CG 3.79Å; F84-W121 HydrophobicContact CZ-CH2 4.35Å; F84-W121 HydrophobicContact CZ-CZ2 4.22Å; F84-W121 HydrophobicContact CZ-CZ3 4.05Å; F84-V125 HydrophobicContact CD1-CG2 3.49Å; F84-V125 VanDerWaalsContact CD1-CG2 3.49Å; F84-V125 HydrophobicContact CE1-CG2 4.13Å; F84-V125 HydrophobicContact CG-CG2 4.47Å |
| 85 | M | 88.9 | Confident | 87 | Confident | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -67.7 | -43.7 | 176.2 | -168.1 | -179.8 | 179.3 | 0 | 0 | 112.1 | F29 A81 G88 L89 V125 L188 L192 | F29-M85 HydrophobicContact CD2-CE 4.35Å; F29-M85 HydrophobicContact CE2-CE 4.12Å; F29-M85 HydrophobicContact CE2-CG 3.91Å; A81-M85 WeakPolarHBondContact O-CB 3.36Å; A81-M85 PolarHBondContact O-N 2.85Å; M85-G88 PolarHBondContact O-N 2.95Å; M85-L89 PolarHBondContact O-N 2.86Å; M85-V125 HydrophobicContact CB-CB 4.46Å; M85-V125 HydrophobicContact CB-CG1 4Å; M85-L188 HydrophobicContact CE-CD1 4.07Å; M85-L188 HydrophobicContact CG-CD1 3.88Å; M85-L188 HydrophobicContact SD-CD1 4.11Å; M85-L192 HydrophobicContact CB-CD2 4.26Å; M85-L192 HydrophobicContact SD-CD2 4.11Å |
| 86 | G | 90.3 | Very high | 87.2 | Confident | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -67.9 | -45.8 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | R82 Y83 G88 L89 I90 C189 | R82-G86 PolarHBondContact O-N 3.14Å; Y83-G86 PolarHBondContact O-N 3.38Å; G86-G88 VanDerWaalsContact C-N 3.33Å; G86-G88 PolarHBondContact O-N 3.14Å; G86-L89 PolarHBondContact O-N 3.33Å; G86-I90 VanDerWaalsContact O-CG1 3.26Å; G86-I90 WeakPolarHBondContact O-CG1 3.48Å; G86-I90 PolarHBondContact O-N 2.89Å; G86-C189 VanDerWaalsContact CA-SG 3.59Å |
| 87 | I | 91.7 | Very high | 87.6 | Confident | 89 Ų | 89 | 34.1 Ų | 34.1 | 46% | 0.456 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -63.1 | -41 | 175.1 | -66.1 | 167.5 | 0 | 0 | 0 | 110.4 | Y83 L89 I90 A91 | Y83-I87 WeakPolarHBondContact O-CB 3.45Å; Y83-I87 WeakPolarHBondContact O-CD1 3.32Å; Y83-I87 WeakPolarHBondContact O-CG1 3.11Å; Y83-I87 PolarHBondContact O-N 3.42Å; I87-L89 VanDerWaalsContact C-N 3.32Å; I87-L89 PolarHBondContact O-N 2.91Å; I87-I90 PolarHBondContact O-N 2.72Å; I87-A91 VanDerWaalsContact O-CB 3.31Å; I87-A91 WeakPolarHBondContact O-CB 3.49Å; I87-A91 PolarHBondContact O-N 3.03Å |
| 88 | G | 91.3 | Very high | 88.2 | Confident | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -56.6 | -46.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | F84 M85 G86 A91 T92 | F84-G88 PolarHBondContact O-N 3.45Å; M85-G88 PolarHBondContact O-N 2.95Å; G86-G88 VanDerWaalsContact C-N 3.33Å; G86-G88 PolarHBondContact O-N 3.14Å; G88-A91 PolarHBondContact O-N 3.39Å; G88-T92 WeakPolarHBondContact O-CG2 3.45Å; G88-T92 PolarHBondContact O-N 3.48Å; G88-T92 PolarHBondContact O-OG1 3.06Å |
| 89 | L | 92.4 | Very high | 88.5 | Confident | 0 Ų | 0 | 31.2 Ų | 31.2 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -71.5 | -35 | -179.9 | -169.2 | 63.9 | 0 | 0 | 0 | 113 | L28 F29 M85 G86 I87 T92 G93 A181 V184 L188 | L28-L89 HydrophobicContact CB-CD1 4.08Å; L28-L89 HydrophobicContact CB-CD2 4.19Å; F29-L89 HydrophobicContact CD1-CD1 3.84Å; F29-L89 HydrophobicContact CD2-CD1 3.96Å; F29-L89 HydrophobicContact CE1-CB 4.13Å; F29-L89 HydrophobicContact CE1-CD1 3.99Å; F29-L89 HydrophobicContact CE2-CB 3.97Å; F29-L89 HydrophobicContact CE2-CD1 4.09Å; F29-L89 HydrophobicContact CE2-CG 4.49Å; F29-L89 HydrophobicContact CG-CD1 3.84Å; F29-L89 HydrophobicContact CZ-CB 3.67Å; F29-L89 HydrophobicContact CZ-CD1 4.12Å; F29-L89 HydrophobicContact CZ-CG 4.47Å; M85-L89 PolarHBondContact O-N 2.86Å; G86-L89 PolarHBondContact O-N 3.33Å; I87-L89 VanDerWaalsContact C-N 3.32Å; I87-L89 PolarHBondContact O-N 2.91Å; L89-T92 WeakPolarHBondContact CA-OG1 3.36Å; L89-T92 PolarHBondContact O-OG1 2.89Å; L89-G93 PolarHBondContact O-N 3.1Å; L89-A181 HydrophobicContact CD1-CB 4.03Å; L89-A181 HydrophobicContact CG-CB 4.15Å; L89-A181 WeakPolarHBondContact CG-O 3.49Å; L89-V184 HydrophobicContact CD2-CB 4.06Å; L89-V184 HydrophobicContact CD2-CG1 3.63Å; L89-L188 HydrophobicContact CB-CD1 4.44Å; L89-L188 HydrophobicContact CD2-CD1 3.73Å |
| 90 | I | 93.5 | Very high | 88.7 | Confident | 39 Ų | 39 | 29.5 Ų | 29.5 | 20% | 0.2 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64.1 | -45.4 | 172.9 | -67.9 | 164.8 | 0 | 0 | 0 | 109.9 | G86 I87 G93 I94 I182 I186 | G86-I90 VanDerWaalsContact O-CG1 3.26Å; G86-I90 WeakPolarHBondContact O-CG1 3.48Å; G86-I90 PolarHBondContact O-N 2.89Å; I87-I90 PolarHBondContact O-N 2.72Å; I90-G93 WeakPolarHBondContact O-CA 3.48Å; I90-G93 PolarHBondContact O-N 3.05Å; I90-G93 VanDerWaalsContact O-N 3.14Å; I90-I94 HydrophobicContact CG2-CD1 3.94Å; I90-I94 HydrophobicContact CG2-CG1 4.46Å; I90-I94 WeakPolarHBondContact O-CG1 3.31Å; I90-I94 PolarHBondContact O-N 3.37Å; I90-I182 HydrophobicContact CG2-CG1 4.45Å; I90-I186 HydrophobicContact CD1-CG1 3.94Å; I90-I186 HydrophobicContact CG1-CG1 4.41Å |
| 91 | A | 93.6 | Very high | 88.9 | Confident | 17 Ų | 17 | 33.5 Ų | 33.5 | 14% | 0.14 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -62.9 | -43.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I87 G88 G93 I94 I95 F118 | I87-A91 VanDerWaalsContact O-CB 3.31Å; I87-A91 WeakPolarHBondContact O-CB 3.49Å; I87-A91 PolarHBondContact O-N 3.03Å; G88-A91 PolarHBondContact O-N 3.39Å; A91-G93 VanDerWaalsContact C-N 3.25Å; A91-G93 PolarHBondContact O-N 3.43Å; A91-I94 PolarHBondContact O-N 2.88Å; A91-I95 WeakPolarHBondContact O-CD1 3.46Å; A91-I95 VanDerWaalsContact O-CG1 3.24Å; A91-I95 WeakPolarHBondContact O-CG1 3.29Å; A91-I95 PolarHBondContact O-N 3.41Å; A91-F118 HydrophobicContact CB-CB 4.18Å; A91-F118 HydrophobicContact CB-CD1 3.69Å; A91-F118 HydrophobicContact CB-CD2 3.87Å; A91-F118 HydrophobicContact CB-CE1 3.96Å; A91-F118 HydrophobicContact CB-CE2 4.14Å; A91-F118 HydrophobicContact CB-CG 3.64Å; A91-F118 HydrophobicContact CB-CZ 4.18Å |
| 92 | T | 92.8 | Very high | 88.9 | Confident | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.5 | -35.5 | 173.6 | 58.5 | 0 | 0 | 0 | 0 | 111.9 | F29 G88 L89 I95 N96 N115 F118 Q119 | F29-T92 HydrophobicContact CD1-CG2 4.19Å; F29-T92 HydrophobicContact CE1-CG2 3.99Å; G88-T92 WeakPolarHBondContact O-CG2 3.45Å; G88-T92 PolarHBondContact O-N 3.48Å; G88-T92 PolarHBondContact O-OG1 3.06Å; L89-T92 WeakPolarHBondContact CA-OG1 3.36Å; L89-T92 PolarHBondContact O-OG1 2.89Å; T92-I95 PolarHBondContact O-N 3.19Å; T92-N96 PolarHBondContact O-N 2.64Å; T92-N96 PolarHBondContact O-ND2 2.92Å; T92-N115 PolarHBondContact O-ND2 3.21Å; T92-F118 HydrophobicContact CG2-CB 3.49Å; T92-F118 VanDerWaalsContact CG2-CB 3.49Å; T92-Q119 HydrophobicContact CG2-CB 4.29Å; T92-Q119 HydrophobicContact CG2-CG 3.54Å |
| 93 | G | 92.5 | Very high | 88.5 | Confident | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64 | -49.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113 | L89 I90 A91 I95 N96 I97 G178 | L89-G93 PolarHBondContact O-N 3.1Å; I90-G93 WeakPolarHBondContact O-CA 3.48Å; I90-G93 PolarHBondContact O-N 3.05Å; I90-G93 VanDerWaalsContact O-N 3.14Å; A91-G93 VanDerWaalsContact C-N 3.25Å; A91-G93 PolarHBondContact O-N 3.43Å; G93-I95 VanDerWaalsContact C-N 3.28Å; G93-I95 PolarHBondContact O-N 2.94Å; G93-N96 PolarHBondContact O-N 3.16Å; G93-N96 VanDerWaalsContact O-N 3.14Å; G93-I97 WeakPolarHBondContact O-CG1 3.42Å; G93-I97 PolarHBondContact O-N 3.44Å; G93-G178 WeakPolarHBondContact CA-O 3.29Å; G93-G178 VanDerWaalsContact O-CA 3.29Å; G93-G178 WeakPolarHBondContact O-CA 3.26Å |
| 94 | I | 93.8 | Very high | 88.1 | Confident | 83 Ų | 83 | 33.3 Ų | 33.3 | 43% | 0.426 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -57.3 | -44.5 | 175.5 | -67.2 | 166.7 | 0 | 0 | 0 | 110.3 | I90 A91 N96 I97 L98 I182 | I90-I94 HydrophobicContact CG2-CD1 3.94Å; I90-I94 HydrophobicContact CG2-CG1 4.46Å; I90-I94 WeakPolarHBondContact O-CG1 3.31Å; I90-I94 PolarHBondContact O-N 3.37Å; A91-I94 PolarHBondContact O-N 2.88Å; I94-N96 VanDerWaalsContact C-N 3.34Å; I94-N96 PolarHBondContact O-N 3.02Å; I94-I97 WeakPolarHBondContact O-CB 3.46Å; I94-I97 PolarHBondContact O-N 3.06Å; I94-I97 VanDerWaalsContact O-N 3.16Å; I94-L98 HydrophobicContact CG2-CD1 4.2Å; I94-L98 HydrophobicContact CG2-CG 4.45Å; I94-L98 WeakPolarHBondContact O-CG 3.38Å; I94-L98 PolarHBondContact O-N 3.42Å; I94-I182 HydrophobicContact CG1-CD1 3.98Å; I94-I182 HydrophobicContact CG1-CG1 4.48Å |
| 95 | I | 91.7 | Very high | 87.5 | Confident | 10 Ų | 10 | 35.5 Ų | 35.5 | 5% | 0.051 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -63.9 | -39.2 | 179.1 | -68.1 | 162.4 | 0 | 0 | 0 | 111.6 | A91 T92 G93 I97 L98 F99 L111 L114 N115 F118 | A91-I95 WeakPolarHBondContact O-CD1 3.46Å; A91-I95 VanDerWaalsContact O-CG1 3.24Å; A91-I95 WeakPolarHBondContact O-CG1 3.29Å; A91-I95 PolarHBondContact O-N 3.41Å; T92-I95 PolarHBondContact O-N 3.19Å; G93-I95 VanDerWaalsContact C-N 3.28Å; G93-I95 PolarHBondContact O-N 2.94Å; I95-I97 VanDerWaalsContact C-N 3.3Å; I95-I97 PolarHBondContact O-N 3.46Å; I95-L98 PolarHBondContact O-N 3.4Å; I95-F99 HydrophobicContact CG2-CD2 3.83Å; I95-F99 HydrophobicContact CG2-CE2 3.68Å; I95-F99 WeakPolarHBondContact O-CD2 2.95Å; I95-F99 PolarHBondContact O-N 2.86Å; I95-L111 HydrophobicContact CG2-CB 4.11Å; I95-L111 HydrophobicContact CG2-CD2 4.2Å; I95-L111 VanDerWaalsContact CG2-O 3.25Å; I95-L111 WeakPolarHBondContact CG2-O 3.36Å; I95-L114 HydrophobicContact CD1-CB 3.72Å; I95-N115 HydrophobicContact CG2-CB 3.72Å; I95-N115 WeakPolarHBondContact CG2-ND2 3.42Å; I95-F118 HydrophobicContact CD1-CD2 3.41Å; I95-F118 VanDerWaalsContact CD1-CD2 3.41Å; I95-F118 HydrophobicContact CD1-CE2 3.8Å |
| 96 | N | 89.6 | Confident | 87.1 | Confident | 1 Ų | 1 | 44.9 Ų | 44.9 | 1% | 0.005 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63 | -36.7 | 174.3 | -88.1 | -96.1 | 0 | 0 | 0 | 112.2 | T32 S35 T92 G93 I94 F99 G100 N115 | T32-N96 WeakPolarHBondContact CB-ND2 3.26Å; S35-N96 PolarHBondContact OG-OD1 3.31Å; T92-N96 PolarHBondContact O-N 2.64Å; T92-N96 PolarHBondContact O-ND2 2.92Å; G93-N96 PolarHBondContact O-N 3.16Å; G93-N96 VanDerWaalsContact O-N 3.14Å; I94-N96 VanDerWaalsContact C-N 3.34Å; I94-N96 PolarHBondContact O-N 3.02Å; N96-F99 WeakPolarHBondContact O-CB 3.49Å; N96-F99 PolarHBondContact O-N 2.65Å; N96-G100 PolarHBondContact O-N 3.37Å; N96-N115 PolarHBondContact ND2-ND2 2.82Å; N96-N115 VanDerWaalsContact ND2-ND2 3.15Å |
| 97 | I | 89.7 | Confident | 86.8 | Confident | 35 Ų | 35 | 46.6 Ų | 46.6 | 18% | 0.179 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -65 | -45.7 | 173.3 | -62.6 | 174.4 | 0 | 0 | 0 | 110.3 | G93 I94 I95 F99 G100 F101 M175 I182 | G93-I97 WeakPolarHBondContact O-CG1 3.42Å; G93-I97 PolarHBondContact O-N 3.44Å; I94-I97 WeakPolarHBondContact O-CB 3.46Å; I94-I97 PolarHBondContact O-N 3.06Å; I94-I97 VanDerWaalsContact O-N 3.16Å; I95-I97 VanDerWaalsContact C-N 3.3Å; I95-I97 PolarHBondContact O-N 3.46Å; I97-F99 PolarHBondContact O-N 3.46Å; I97-G100 PolarHBondContact O-N 3.32Å; I97-F101 HydrophobicContact CG2-CD2 4.11Å; I97-F101 HydrophobicContact CG2-CE2 3.71Å; I97-F101 VanDerWaalsContact O-CD2 3.27Å; I97-F101 WeakPolarHBondContact O-CD2 3.4Å; I97-F101 PolarHBondContact O-N 3.31Å; I97-M175 HydrophobicContact CG1-CG 4.26Å; I97-M175 HydrophobicContact CG2-CG 4.27Å; I97-M175 HydrophobicContact CG2-SD 4.31Å; I97-I182 HydrophobicContact CD1-CD1 3.65Å |
| 98 | L | 89.6 | Confident | 86.4 | Confident | 84 Ų | 84 | 42.3 Ų | 42.3 | 44% | 0.44 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -61.1 | -32.9 | 176.6 | -66.8 | 174.9 | 0 | 0 | 0 | 112.5 | I94 I95 G100 F101 S102 L111 | I94-L98 HydrophobicContact CG2-CD1 4.2Å; I94-L98 HydrophobicContact CG2-CG 4.45Å; I94-L98 WeakPolarHBondContact O-CG 3.38Å; I94-L98 PolarHBondContact O-N 3.42Å; I95-L98 PolarHBondContact O-N 3.4Å; L98-G100 VanDerWaalsContact C-N 3.31Å; L98-G100 PolarHBondContact O-N 3.49Å; L98-F101 PolarHBondContact O-N 3.18Å; L98-S102 PolarHBondContact O-N 2.93Å; L98-L111 HydrophobicContact CB-CD1 4.06Å; L98-L111 HydrophobicContact CB-CD2 3.81Å; L98-L111 HydrophobicContact CD1-CD2 3.95Å |
| 99 | F | 84.6 | Confident | 86 | Confident | 2 Ų | 2 | 42.9 Ų | 42.9 | 1% | 0.009 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -60.1 | -39.7 | 171.7 | -92.8 | -68.9 | 0 | 0 | 0 | 112.7 | F36 I95 N96 I97 F101 S102 F108 L111 W112 N115 | F36-F99 HydrophobicContact CD2-CE1 4.39Å; F36-F99 HydrophobicContact CE2-CE1 4.46Å; I95-F99 HydrophobicContact CG2-CD2 3.83Å; I95-F99 HydrophobicContact CG2-CE2 3.68Å; I95-F99 WeakPolarHBondContact O-CD2 2.95Å; I95-F99 PolarHBondContact O-N 2.86Å; N96-F99 WeakPolarHBondContact O-CB 3.49Å; N96-F99 PolarHBondContact O-N 2.65Å; I97-F99 PolarHBondContact O-N 3.46Å; F99-F101 PolarHBondContact O-N 3.44Å; F99-S102 PolarHBondContact O-N 3.15Å; F99-F108 AromaticContact CD1-CD1 3.43Å; F99-F108 HydrophobicContact CD1-CD1 3.43Å; F99-F108 VanDerWaalsContact CD1-CD1 3.43Å; F99-F108 AromaticContact CD1-CE1 3.8Å; F99-F108 HydrophobicContact CD1-CE1 3.8Å; F99-F108 HydrophobicContact CD1-CG 4.5Å; F99-F108 HydrophobicContact CE1-CB 4.23Å; F99-F108 AromaticContact CE1-CD1 3.5Å; F99-F108 HydrophobicContact CE1-CD1 3.5Å; F99-F108 HydrophobicContact CE1-CE1 4.32Å; F99-F108 HydrophobicContact CE1-CG 4.3Å; F99-L111 HydrophobicContact CD1-CB 4.25Å; F99-L111 HydrophobicContact CD1-CD1 4.26Å; F99-L111 HydrophobicContact CD2-CB 4.02Å; F99-L111 HydrophobicContact CE1-CB 3.8Å; F99-L111 HydrophobicContact CE2-CB 3.54Å; F99-L111 HydrophobicContact CG-CB 4.35Å; F99-L111 HydrophobicContact CG-CD1 4.3Å; F99-L111 VanDerWaalsContact CZ-C 3.44Å; F99-L111 HydrophobicContact CZ-CB 3.43Å; F99-L111 VanDerWaalsContact CZ-CB 3.43Å; F99-W112 HydrophobicContact CE1-CE3 4.49Å; F99-W112 AromaticContact CE2-CE3 3.83Å; F99-W112 HydrophobicContact CE2-CE3 3.83Å; F99-W112 VanDerWaalsContact CZ-CA 3.5Å; F99-W112 HydrophobicContact CZ-CB 3.75Å; F99-W112 HydrophobicContact CZ-CD2 4.23Å; F99-W112 AromaticContact CZ-CE3 3.58Å; F99-W112 HydrophobicContact CZ-CE3 3.58Å; F99-W112 HydrophobicContact CZ-CG 4.35Å; F99-N115 HydrophobicContact CE2-CB 4.21Å |
| 100 | G | 82.9 | Confident | 85.8 | Confident | 6 Ų | 6 | 47 Ų | 47 | 6% | 0.062 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -61.8 | -31.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | N96 I97 L98 R171 | N96-G100 PolarHBondContact O-N 3.37Å; I97-G100 PolarHBondContact O-N 3.32Å; L98-G100 VanDerWaalsContact C-N 3.31Å; L98-G100 PolarHBondContact O-N 3.49Å; G100-R171 WeakPolarHBondContact O-CD 3.38Å; G100-R171 VanDerWaalsContact O-CG 3.24Å; G100-R171 WeakPolarHBondContact O-CG 3.47Å; G100-R171 PolarHBondContact O-NE 3.22Å; G100-R171 VanDerWaalsContact O-NE 3.1Å |
| 101 | F | 84.5 | Confident | 85.6 | Confident | 149 Ų | 149 | 46.1 Ų | 46.1 | 65% | 0.654 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -87 | -15.6 | 177.8 | -69.2 | -70.9 | 0 | 0 | 0 | 114.2 | I97 L98 F99 M175 | I97-F101 HydrophobicContact CG2-CD2 4.11Å; I97-F101 HydrophobicContact CG2-CE2 3.71Å; I97-F101 VanDerWaalsContact O-CD2 3.27Å; I97-F101 WeakPolarHBondContact O-CD2 3.4Å; I97-F101 PolarHBondContact O-N 3.31Å; L98-F101 PolarHBondContact O-N 3.18Å; F99-F101 PolarHBondContact O-N 3.44Å; F101-M175 HydrophobicContact CE2-SD 4.2Å; F101-M175 HydrophobicContact CZ-SD 4.19Å |
| 102 | S | 79.2 | Confident | 85.3 | Confident | 12 Ų | 12 | 45.5 Ų | 45.5 | 8% | 0.084 | 24% | 0.24 | C | C | . | . | trans | -82 | 145.9 | -175.7 | -174.2 | 0 | 0 | 0 | 0 | 112.9 | L98 F99 A107 F108 | L98-S102 PolarHBondContact O-N 2.93Å; F99-S102 PolarHBondContact O-N 3.15Å; S102-A107 WeakPolarHBondContact OG-CB 3.24Å; S102-F108 WeakPolarHBondContact O-CZ 3.36Å | ||
| 103 | T | 73.1 | Confident | 85.1 | Confident | 97 Ų | 97 | 47.8 Ų | 47.8 | 60% | 0.595 | 25% | 0.253 | S | S | * | . | trans | -128.4 | -15.1 | 172.3 | 47.9 | 0 | 0 | 0 | 0 | 113.3 | R171 | T103-R171 VanDerWaalsContact CG2-NH2 3.27Š| ||
| 104 | S | 77.6 | Confident | 85.1 | Confident | 61 Ų | 61 | 51.2 Ų | 51.2 | 43% | 0.427 | 27% | 0.271 | S | S | . | . | trans | -91.6 | 135.8 | -174.8 | 173.3 | 0 | 0 | 0 | 0 | 111.9 | W106 A107 F108 | S104-W106 VanDerWaalsContact C-N 3.29Å; S104-W106 PolarHBondContact O-N 3.34Å; S104-A107 CarbonylContact O-C 3.5Å; S104-A107 WeakPolarHBondContact O-CA 3.33Å; S104-A107 WeakPolarHBondContact O-CB 3.2Å; S104-A107 PolarHBondContact O-N 2.87Å; S104-F108 WeakPolarHBondContact O-CD2 3.42Å; S104-F108 PolarHBondContact O-N 3.37Å | ||
| 105 | L | 74.8 | Confident | 84.9 | Confident | 60 Ų | 60 | 47.2 Ų | 47.2 | 31% | 0.314 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -52.7 | -44.5 | 176.2 | -179.4 | 153 | 0 | 0 | 0 | 112.7 | L49 D53 A107 F108 A109 | L49-L105 HydrophobicContact CD2-CB 3.83Å; L49-L105 HydrophobicContact CD2-CD1 3.93Å; L49-L105 HydrophobicContact CD2-CG 3.87Å; D53-L105 HydrophobicContact CB-CD1 3.79Å; D53-L105 WeakPolarHBondContact OD1-CD1 3.33Å; D53-L105 WeakPolarHBondContact OD2-CD1 3.13Å; L105-A107 VanDerWaalsContact C-N 3.32Å; L105-A107 PolarHBondContact O-N 3.43Å; L105-F108 WeakPolarHBondContact O-CB 3.46Å; L105-F108 PolarHBondContact O-N 3.16Å; L105-A109 PolarHBondContact O-N 3.43Å |
| 106 | W | 81 | Confident | 84.8 | Confident | 197 Ų | 197 | 46.8 Ų | 46.8 | 75% | 0.746 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -66.4 | -37.1 | 178.9 | -73.5 | 109.9 | 0 | 0 | 0 | 112.2 | S104 A109 V110 | S104-W106 VanDerWaalsContact C-N 3.29Å; S104-W106 PolarHBondContact O-N 3.34Å; W106-A109 PolarHBondContact O-N 3.31Å; W106-V110 WeakPolarHBondContact O-CG2 3.41Å; W106-V110 PolarHBondContact O-N 3.38Å |
| 107 | A | 83.5 | Confident | 84.8 | Confident | 36 Ų | 36 | 50 Ų | 50 | 30% | 0.298 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -66.5 | -41.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | S102 S104 L105 A109 V110 L111 | S102-A107 WeakPolarHBondContact OG-CB 3.24Å; S104-A107 CarbonylContact O-C 3.5Å; S104-A107 WeakPolarHBondContact O-CA 3.33Å; S104-A107 WeakPolarHBondContact O-CB 3.2Å; S104-A107 PolarHBondContact O-N 2.87Å; L105-A107 VanDerWaalsContact C-N 3.32Å; L105-A107 PolarHBondContact O-N 3.43Å; A107-A109 PolarHBondContact O-N 3.19Å; A107-V110 PolarHBondContact O-N 2.82Å; A107-L111 WeakPolarHBondContact O-CB 3.46Å; A107-L111 WeakPolarHBondContact O-CD1 3.47Å; A107-L111 WeakPolarHBondContact O-CG 3.09Å; A107-L111 PolarHBondContact O-N 2.63Å |
| 108 | F | 82.8 | Confident | 84.8 | Confident | 0 Ų | 0 | 50.4 Ų | 50.4 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -58 | -47.1 | 171.5 | -75 | -76.7 | 0 | 0 | 0 | 111.3 | F36 V48 L49 L57 F99 S102 S104 L105 L111 W112 W170 | F36-F108 HydrophobicContact CE2-CD1 4.1Å; V48-F108 HydrophobicContact CG1-CE2 3.67Å; V48-F108 HydrophobicContact CG1-CZ 4.11Å; L49-F108 HydrophobicContact CD1-CD2 4.23Å; L49-F108 HydrophobicContact CD1-CG 4.24Å; L49-F108 HydrophobicContact CD2-CD2 4.32Å; L49-F108 HydrophobicContact CG-CD2 4.44Å; L57-F108 HydrophobicContact CD1-CB 4.4Å; F99-F108 AromaticContact CD1-CD1 3.43Å; F99-F108 HydrophobicContact CD1-CD1 3.43Å; F99-F108 VanDerWaalsContact CD1-CD1 3.43Å; F99-F108 AromaticContact CD1-CE1 3.8Å; F99-F108 HydrophobicContact CD1-CE1 3.8Å; F99-F108 HydrophobicContact CD1-CG 4.5Å; F99-F108 HydrophobicContact CE1-CB 4.23Å; F99-F108 AromaticContact CE1-CD1 3.5Å; F99-F108 HydrophobicContact CE1-CD1 3.5Å; F99-F108 HydrophobicContact CE1-CE1 4.32Å; F99-F108 HydrophobicContact CE1-CG 4.3Å; S102-F108 WeakPolarHBondContact O-CZ 3.36Å; S104-F108 WeakPolarHBondContact O-CD2 3.42Å; S104-F108 PolarHBondContact O-N 3.37Å; L105-F108 WeakPolarHBondContact O-CB 3.46Å; L105-F108 PolarHBondContact O-N 3.16Å; F108-L111 PolarHBondContact O-N 3.24Å; F108-W112 WeakPolarHBondContact O-CB 3.44Å; F108-W112 PolarHBondContact O-N 3.09Å; F108-W170 AromaticContact CE1-CH2 4Å; F108-W170 HydrophobicContact CE1-CH2 4Å; F108-W170 HydrophobicContact CE1-CZ3 4.36Å; F108-W170 AromaticContact CZ-CH2 3.78Å; F108-W170 HydrophobicContact CZ-CH2 3.78Å; F108-W170 HydrophobicContact CZ-CZ2 4.48Å |
| 109 | A | 83.7 | Confident | 84.7 | Confident | 12 Ų | 12 | 46.4 Ų | 46.4 | 10% | 0.099 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61 | -49.1 | -180 | 0 | 0 | 0 | 0 | 0 | 112.9 | L57 L105 W106 A107 W112 V113 | L57-A109 VanDerWaalsContact CD2-CA 3.42Å; L57-A109 HydrophobicContact CD2-CB 3.76Å; L105-A109 PolarHBondContact O-N 3.43Å; W106-A109 PolarHBondContact O-N 3.31Å; A107-A109 PolarHBondContact O-N 3.19Å; A109-W112 PolarHBondContact O-N 3.21Å; A109-V113 WeakPolarHBondContact O-CG2 3.3Å; A109-V113 PolarHBondContact O-N 3.48Å |
| 110 | V | 88.2 | Confident | 84.7 | Confident | 86 Ų | 86 | 46.3 Ų | 46.3 | 52% | 0.521 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -63.9 | -47.9 | 178.9 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | W106 A107 W112 V113 L114 | W106-V110 WeakPolarHBondContact O-CG2 3.41Å; W106-V110 PolarHBondContact O-N 3.38Å; A107-V110 PolarHBondContact O-N 2.82Å; V110-W112 PolarHBondContact O-N 3.35Å; V110-V113 PolarHBondContact O-N 2.97Å; V110-L114 HydrophobicContact CG1-CD1 3.96Å; V110-L114 HydrophobicContact CG1-CG 4.44Å; V110-L114 WeakPolarHBondContact O-CB 3.46Å; V110-L114 VanDerWaalsContact O-CG 3.27Å; V110-L114 WeakPolarHBondContact O-CG 3.38Å; V110-L114 PolarHBondContact O-N 2.8Å |
| 111 | L | 89.2 | Confident | 84.9 | Confident | 21 Ų | 21 | 47.8 Ų | 47.8 | 11% | 0.11 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -60.7 | -35.7 | 177.2 | -69.1 | 172.9 | 0 | 0 | 0 | 111 | I95 L98 F99 A107 F108 L114 N115 | I95-L111 HydrophobicContact CG2-CB 4.11Å; I95-L111 HydrophobicContact CG2-CD2 4.2Å; I95-L111 VanDerWaalsContact CG2-O 3.25Å; I95-L111 WeakPolarHBondContact CG2-O 3.36Å; L98-L111 HydrophobicContact CB-CD1 4.06Å; L98-L111 HydrophobicContact CB-CD2 3.81Å; L98-L111 HydrophobicContact CD1-CD2 3.95Å; F99-L111 HydrophobicContact CD1-CB 4.25Å; F99-L111 HydrophobicContact CD1-CD1 4.26Å; F99-L111 HydrophobicContact CD2-CB 4.02Å; F99-L111 HydrophobicContact CE1-CB 3.8Å; F99-L111 HydrophobicContact CE2-CB 3.54Å; F99-L111 HydrophobicContact CG-CB 4.35Å; F99-L111 HydrophobicContact CG-CD1 4.3Å; F99-L111 VanDerWaalsContact CZ-C 3.44Å; F99-L111 HydrophobicContact CZ-CB 3.43Å; F99-L111 VanDerWaalsContact CZ-CB 3.43Å; A107-L111 WeakPolarHBondContact O-CB 3.46Å; A107-L111 WeakPolarHBondContact O-CD1 3.47Å; A107-L111 WeakPolarHBondContact O-CG 3.09Å; A107-L111 PolarHBondContact O-N 2.63Å; F108-L111 PolarHBondContact O-N 3.24Å; L111-L114 PolarHBondContact O-N 2.84Å; L111-N115 WeakPolarHBondContact O-CB 3.38Å; L111-N115 PolarHBondContact O-N 3.35Å |
| 112 | W | 86.5 | Confident | 84.8 | Confident | 4 Ų | 4 | 40.7 Ų | 40.7 | 2% | 0.015 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -72.9 | -41.9 | -177.4 | -161.7 | -130.6 | 0 | 0 | 0 | 112.4 | R33 F36 L57 F61 F99 F108 A109 V110 N115 A116 | R33-W112 WeakPolarHBondContact O-CH2 3.12Å; F36-W112 HydrophobicContact CB-CE3 4.05Å; F36-W112 HydrophobicContact CB-CH2 3.25Å; F36-W112 HydrophobicContact CB-CZ2 3.93Å; F36-W112 HydrophobicContact CB-CZ3 3.3Å; F36-W112 HydrophobicContact CD1-CD2 4.43Å; F36-W112 HydrophobicContact CD1-CH2 4.05Å; F36-W112 AromaticContact CD1-CZ2 3.82Å; F36-W112 HydrophobicContact CD1-CZ2 3.82Å; F36-W112 HydrophobicContact CD1-CZ3 4.39Å; F36-W112 HydrophobicContact CD2-CE3 4.49Å; F36-W112 HydrophobicContact CG-CD2 4.42Å; F36-W112 HydrophobicContact CG-CE3 4.12Å; F36-W112 AromaticContact CG-CH2 3.87Å; F36-W112 HydrophobicContact CG-CH2 3.87Å; F36-W112 HydrophobicContact CG-CZ2 4.11Å; F36-W112 AromaticContact CG-CZ3 3.85Å; F36-W112 HydrophobicContact CG-CZ3 3.85Å; L57-W112 HydrophobicContact CD2-CB 4.32Å; L57-W112 PolarHBondContact O-NE1 2.98Å; L57-W112 VanDerWaalsContact O-NE1 3.08Å; F61-W112 HydrophobicContact CB-CZ2 4.36Å; F61-W112 VanDerWaalsContact CB-NE1 3.35Å; F61-W112 AromaticContact CD2-CD2 4Å; F61-W112 HydrophobicContact CD2-CD2 4Å; F61-W112 AromaticContact CD2-CE2 3.43Å; F61-W112 VanDerWaalsContact CD2-CE2 3.43Å; F61-W112 HydrophobicContact CD2-CG 4.49Å; F61-W112 HydrophobicContact CD2-CH2 4.02Å; F61-W112 AromaticContact CD2-CZ2 3.45Å; F61-W112 HydrophobicContact CD2-CZ2 3.45Å; F61-W112 VanDerWaalsContact CD2-CZ2 3.45Å; F61-W112 AromaticContact CD2-NE1 3.72Å; F61-W112 HydrophobicContact CE2-CH2 4.09Å; F61-W112 AromaticContact CE2-CZ2 3.96Å; F61-W112 HydrophobicContact CE2-CZ2 3.96Å; F61-W112 AromaticContact CG-CE2 3.94Å; F61-W112 AromaticContact CG-CZ2 3.95Å; F61-W112 HydrophobicContact CG-CZ2 3.95Å; F61-W112 AromaticContact CG-NE1 3.86Å; F99-W112 HydrophobicContact CE1-CE3 4.49Å; F99-W112 AromaticContact CE2-CE3 3.83Å; F99-W112 HydrophobicContact CE2-CE3 3.83Å; F99-W112 VanDerWaalsContact CZ-CA 3.5Å; F99-W112 HydrophobicContact CZ-CB 3.75Å; F99-W112 HydrophobicContact CZ-CD2 4.23Å; F99-W112 AromaticContact CZ-CE3 3.58Å; F99-W112 HydrophobicContact CZ-CE3 3.58Å; F99-W112 HydrophobicContact CZ-CG 4.35Å; F108-W112 WeakPolarHBondContact O-CB 3.44Å; F108-W112 PolarHBondContact O-N 3.09Å; A109-W112 PolarHBondContact O-N 3.21Å; V110-W112 PolarHBondContact O-N 3.35Å; W112-N115 HydrophobicContact CE3-CB 4.3Å; W112-N115 WeakPolarHBondContact O-CB 3.31Å; W112-N115 PolarHBondContact O-N 3.12Å; W112-A116 WeakPolarHBondContact O-CB 3.29Å; W112-A116 PolarHBondContact O-N 3.49Å |
| 113 | V | 89.7 | Confident | 85 | Confident | 47 Ų | 47 | 40.9 Ų | 40.9 | 29% | 0.285 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -61.8 | -46.4 | 172.2 | 169.7 | 0 | 0 | 0 | 0 | 110.3 | L60 T64 A109 V110 N115 A116 F117 | L60-V113 HydrophobicContact CB-CG2 4.34Å; L60-V113 HydrophobicContact CD1-CG2 4.46Å; T64-V113 HydrophobicContact CG2-CG1 3.88Å; T64-V113 WeakPolarHBondContact CG2-O 3.33Å; A109-V113 WeakPolarHBondContact O-CG2 3.3Å; A109-V113 PolarHBondContact O-N 3.48Å; V110-V113 PolarHBondContact O-N 2.97Å; V113-N115 VanDerWaalsContact C-N 3.31Å; V113-N115 PolarHBondContact O-N 3.47Å; V113-A116 PolarHBondContact O-N 2.8Å; V113-F117 WeakPolarHBondContact O-CB 3.47Å; V113-F117 PolarHBondContact O-N 3.42Å |
| 114 | L | 91.3 | Very high | 85.5 | Confident | 72 Ų | 72 | 36.3 Ų | 36.3 | 38% | 0.377 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -61.1 | -41.6 | 175.4 | -70.2 | 173.7 | 0 | 0 | 0 | 111.4 | I95 V110 L111 F117 F118 | I95-L114 HydrophobicContact CD1-CB 3.72Å; V110-L114 HydrophobicContact CG1-CD1 3.96Å; V110-L114 HydrophobicContact CG1-CG 4.44Å; V110-L114 WeakPolarHBondContact O-CB 3.46Å; V110-L114 VanDerWaalsContact O-CG 3.27Å; V110-L114 WeakPolarHBondContact O-CG 3.38Å; V110-L114 PolarHBondContact O-N 2.8Å; L111-L114 PolarHBondContact O-N 2.84Å; L114-F117 WeakPolarHBondContact O-CB 3.45Å; L114-F117 PolarHBondContact O-N 3.3Å; L114-F118 WeakPolarHBondContact O-CD2 3.43Å; L114-F118 PolarHBondContact O-N 3.49Å |
| 115 | N | 90.1 | Very high | 85.9 | Confident | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -63.2 | -48.1 | 178.2 | -158.2 | -108.7 | 0 | 0 | 0 | 111.4 | T92 I95 N96 F99 L111 W112 V113 F117 F118 Q119 | T92-N115 PolarHBondContact O-ND2 3.21Å; I95-N115 HydrophobicContact CG2-CB 3.72Å; I95-N115 WeakPolarHBondContact CG2-ND2 3.42Å; N96-N115 PolarHBondContact ND2-ND2 2.82Å; N96-N115 VanDerWaalsContact ND2-ND2 3.15Å; F99-N115 HydrophobicContact CE2-CB 4.21Å; L111-N115 WeakPolarHBondContact O-CB 3.38Å; L111-N115 PolarHBondContact O-N 3.35Å; W112-N115 HydrophobicContact CE3-CB 4.3Å; W112-N115 WeakPolarHBondContact O-CB 3.31Å; W112-N115 PolarHBondContact O-N 3.12Å; V113-N115 VanDerWaalsContact C-N 3.31Å; V113-N115 PolarHBondContact O-N 3.47Å; N115-F117 PolarHBondContact O-N 2.97Å; N115-F118 PolarHBondContact O-N 3.4Å; N115-Q119 VanDerWaalsContact O-CB 3.3Å; N115-Q119 WeakPolarHBondContact O-CB 3.25Å; N115-Q119 WeakPolarHBondContact O-CG 3.46Å; N115-Q119 PolarHBondContact O-N 2.93Å; N115-Q119 PolarHBondContact OD1-NE2 3.33Å |
| 116 | A | 88.7 | Confident | 86.5 | Confident | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -56.2 | -41.2 | 174 | 0 | 0 | 0 | 0 | 0 | 111.5 | F61 T64 Y65 W112 V113 G120 | F61-A116 HydrophobicContact CD2-CB 3.46Å; F61-A116 VanDerWaalsContact CD2-CB 3.46Å; F61-A116 HydrophobicContact CE2-CB 3.63Å; F61-A116 HydrophobicContact CG-CB 4.08Å; F61-A116 HydrophobicContact CZ-CB 4.37Å; T64-A116 HydrophobicContact CG2-CB 3.93Å; Y65-A116 WeakPolarHBondContact CD2-O 3.18Å; W112-A116 WeakPolarHBondContact O-CB 3.29Å; W112-A116 PolarHBondContact O-N 3.49Å; V113-A116 PolarHBondContact O-N 2.8Å; A116-G120 PolarHBondContact O-N 3.44Å; A116-G120 VanDerWaalsContact O-N 3.09Å |
| 117 | F | 90.7 | Very high | 86.6 | Confident | 68 Ų | 68 | 21.2 Ų | 21.2 | 30% | 0.298 | 12% | 0.117 | S | C | . | . | H | α-helix | trans | -62 | -56.7 | 177.1 | -174.8 | -100.3 | 0 | 0 | 0 | 111.4 | T64 S68 V113 L114 N115 Q119 G120 W121 | T64-F117 HydrophobicContact CG2-CB 4.11Å; S68-F117 WeakPolarHBondContact CB-O 3.5Å; S68-F117 PolarHBondContact OG-O 3.38Å; V113-F117 WeakPolarHBondContact O-CB 3.47Å; V113-F117 PolarHBondContact O-N 3.42Å; L114-F117 WeakPolarHBondContact O-CB 3.45Å; L114-F117 PolarHBondContact O-N 3.3Å; N115-F117 PolarHBondContact O-N 2.97Å; F117-Q119 VanDerWaalsContact C-N 3.29Å; F117-Q119 PolarHBondContact O-N 3.29Å; F117-G120 PolarHBondContact O-N 3.13Å; F117-G120 VanDerWaalsContact O-N 3.16Å; F117-W121 HydrophobicContact CD1-CZ2 4.39Å; F117-W121 AromaticContact CD1-NE1 3.9Å; F117-W121 AromaticContact CE1-CE2 3.94Å; F117-W121 AromaticContact CE1-CZ2 3.68Å; F117-W121 HydrophobicContact CE1-CZ2 3.68Å; F117-W121 AromaticContact CE1-NE1 3.62Å; F117-W121 HydrophobicContact CZ-CZ2 4.36Å; F117-W121 AromaticContact CZ-NE1 3.95Å; F117-W121 PolarHBondContact O-NE1 2.91Å |
| 118 | F | 89.9 | Confident | 86.6 | Confident | 45 Ų | 45 | 19.8 Ų | 19.8 | 20% | 0.197 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -68.3 | -27.9 | -179 | -66.8 | -69.6 | 0 | 0 | 0 | 113.4 | A91 T92 I95 L114 N115 G120 W121 | A91-F118 HydrophobicContact CB-CB 4.18Å; A91-F118 HydrophobicContact CB-CD1 3.69Å; A91-F118 HydrophobicContact CB-CD2 3.87Å; A91-F118 HydrophobicContact CB-CE1 3.96Å; A91-F118 HydrophobicContact CB-CE2 4.14Å; A91-F118 HydrophobicContact CB-CG 3.64Å; A91-F118 HydrophobicContact CB-CZ 4.18Å; T92-F118 HydrophobicContact CG2-CB 3.49Å; T92-F118 VanDerWaalsContact CG2-CB 3.49Å; I95-F118 HydrophobicContact CD1-CD2 3.41Å; I95-F118 VanDerWaalsContact CD1-CD2 3.41Å; I95-F118 HydrophobicContact CD1-CE2 3.8Å; L114-F118 WeakPolarHBondContact O-CD2 3.43Å; L114-F118 PolarHBondContact O-N 3.49Å; N115-F118 PolarHBondContact O-N 3.4Å; F118-G120 VanDerWaalsContact C-N 3.31Å; F118-G120 PolarHBondContact O-N 3.48Å; F118-W121 HydrophobicContact CD1-CD2 4.31Å; F118-W121 AromaticContact CD1-CE2 3.99Å; F118-W121 HydrophobicContact CD1-CE3 4.39Å; F118-W121 AromaticContact CD1-CH2 3.93Å; F118-W121 HydrophobicContact CD1-CH2 3.93Å; F118-W121 AromaticContact CD1-CZ2 3.82Å; F118-W121 HydrophobicContact CD1-CZ2 3.82Å; F118-W121 HydrophobicContact CD1-CZ3 4.2Å; F118-W121 AromaticContact CE1-CH2 3.83Å; F118-W121 HydrophobicContact CE1-CH2 3.83Å; F118-W121 AromaticContact CE1-CZ2 3.86Å; F118-W121 HydrophobicContact CE1-CZ2 3.86Å; F118-W121 HydrophobicContact CE1-CZ3 4.44Å; F118-W121 WeakPolarHBondContact O-CB 3.44Å; F118-W121 PolarHBondContact O-N 3.03Å |
| 119 | Q | 86 | Confident | 86.7 | Confident | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -68 | -30.7 | 174 | -76.1 | -170.4 | 26.9 | 0 | 0 | 113.4 | F29 T32 R33 Y65 T92 N115 F117 W121 G122 | F29-Q119 HydrophobicContact CD1-CB 4.38Å; F29-Q119 HydrophobicContact CD1-CG 4.24Å; T32-Q119 PolarHBondContact O-NE2 3.15Å; T32-Q119 VanDerWaalsContact O-NE2 3.13Å; R33-Q119 VanDerWaalsContact CA-NE2 3.25Å; Y65-Q119 HydrophobicContact CD2-CB 4.09Å; Y65-Q119 HydrophobicContact CE2-CB 3.82Å; T92-Q119 HydrophobicContact CG2-CB 4.29Å; T92-Q119 HydrophobicContact CG2-CG 3.54Å; N115-Q119 VanDerWaalsContact O-CB 3.3Å; N115-Q119 WeakPolarHBondContact O-CB 3.25Å; N115-Q119 WeakPolarHBondContact O-CG 3.46Å; N115-Q119 PolarHBondContact O-N 2.93Å; N115-Q119 PolarHBondContact OD1-NE2 3.33Å; F117-Q119 VanDerWaalsContact C-N 3.29Å; F117-Q119 PolarHBondContact O-N 3.29Å; Q119-W121 PolarHBondContact O-N 3.46Å; Q119-W121 VanDerWaalsContact O-N 3.12Å; Q119-G122 PolarHBondContact O-N 3.15Å |
| 120 | G | 85.7 | Confident | 86.7 | Confident | 0 Ų | 0 | 19.3 Ų | 19.3 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -58.2 | -23.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | S72 A116 F117 F118 G122 P124 | S72-G120 PolarHBondContact OG-O 3.41Å; S72-G120 VanDerWaalsContact OG-O 3.11Å; A116-G120 PolarHBondContact O-N 3.44Å; A116-G120 VanDerWaalsContact O-N 3.09Å; F117-G120 PolarHBondContact O-N 3.13Å; F117-G120 VanDerWaalsContact O-N 3.16Å; F118-G120 VanDerWaalsContact C-N 3.31Å; F118-G120 PolarHBondContact O-N 3.48Å; G120-G122 PolarHBondContact O-N 3.07Å; G120-P124 WeakPolarHBondContact O-CD 3.49Å |
| 121 | W | 85.7 | Confident | 86.3 | Confident | 36 Ų | 36 | 15.2 Ų | 15.2 | 14% | 0.136 | 8% | 0.075 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.7 | -27.6 | -175.3 | -63.7 | 19.2 | 0 | 0 | 0 | 113.5 | F84 F117 F118 Q119 V125 | F84-W121 HydrophobicContact CD1-CB 4.17Å; F84-W121 HydrophobicContact CD1-CD2 4.33Å; F84-W121 HydrophobicContact CD1-CE3 4.01Å; F84-W121 HydrophobicContact CD1-CG 4.45Å; F84-W121 HydrophobicContact CD2-CE3 4.14Å; F84-W121 HydrophobicContact CD2-CZ3 4.14Å; F84-W121 HydrophobicContact CE1-CB 3.59Å; F84-W121 AromaticContact CE1-CD2 3.59Å; F84-W121 HydrophobicContact CE1-CD2 3.59Å; F84-W121 AromaticContact CE1-CE3 3.71Å; F84-W121 HydrophobicContact CE1-CE3 3.71Å; F84-W121 AromaticContact CE1-CG 3.58Å; F84-W121 HydrophobicContact CE1-CG 3.58Å; F84-W121 HydrophobicContact CE2-CD2 4.06Å; F84-W121 AromaticContact CE2-CE3 3.79Å; F84-W121 HydrophobicContact CE2-CE3 3.79Å; F84-W121 HydrophobicContact CE2-CH2 4.08Å; F84-W121 HydrophobicContact CE2-CZ2 4.33Å; F84-W121 AromaticContact CE2-CZ3 3.81Å; F84-W121 HydrophobicContact CE2-CZ3 3.81Å; F84-W121 HydrophobicContact CG-CE3 4.25Å; F84-W121 HydrophobicContact CZ-CB 4.31Å; F84-W121 AromaticContact CZ-CD2 3.42Å; F84-W121 HydrophobicContact CZ-CD2 3.42Å; F84-W121 VanDerWaalsContact CZ-CD2 3.42Å; F84-W121 AromaticContact CZ-CE2 3.78Å; F84-W121 AromaticContact CZ-CE3 3.58Å; F84-W121 HydrophobicContact CZ-CE3 3.58Å; F84-W121 AromaticContact CZ-CG 3.79Å; F84-W121 HydrophobicContact CZ-CG 3.79Å; F84-W121 HydrophobicContact CZ-CH2 4.35Å; F84-W121 HydrophobicContact CZ-CZ2 4.22Å; F84-W121 HydrophobicContact CZ-CZ3 4.05Å; F117-W121 HydrophobicContact CD1-CZ2 4.39Å; F117-W121 AromaticContact CD1-NE1 3.9Å; F117-W121 AromaticContact CE1-CE2 3.94Å; F117-W121 AromaticContact CE1-CZ2 3.68Å; F117-W121 HydrophobicContact CE1-CZ2 3.68Å; F117-W121 AromaticContact CE1-NE1 3.62Å; F117-W121 HydrophobicContact CZ-CZ2 4.36Å; F117-W121 AromaticContact CZ-NE1 3.95Å; F117-W121 PolarHBondContact O-NE1 2.91Å; F118-W121 HydrophobicContact CD1-CD2 4.31Å; F118-W121 AromaticContact CD1-CE2 3.99Å; F118-W121 HydrophobicContact CD1-CE3 4.39Å; F118-W121 AromaticContact CD1-CH2 3.93Å; F118-W121 HydrophobicContact CD1-CH2 3.93Å; F118-W121 AromaticContact CD1-CZ2 3.82Å; F118-W121 HydrophobicContact CD1-CZ2 3.82Å; F118-W121 HydrophobicContact CD1-CZ3 4.2Å; F118-W121 AromaticContact CE1-CH2 3.83Å; F118-W121 HydrophobicContact CE1-CH2 3.83Å; F118-W121 AromaticContact CE1-CZ2 3.86Å; F118-W121 HydrophobicContact CE1-CZ2 3.86Å; F118-W121 HydrophobicContact CE1-CZ3 4.44Å; F118-W121 WeakPolarHBondContact O-CB 3.44Å; F118-W121 PolarHBondContact O-N 3.03Å; Q119-W121 PolarHBondContact O-N 3.46Å; Q119-W121 VanDerWaalsContact O-N 3.12Å; W121-V125 WeakPolarHBondContact O-CG2 3.21Å |
| 122 | G | 83 | Confident | 86 | Confident | 0 Ų | 0 | 15.2 Ų | 15.2 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -64.2 | -48.5 | -174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q119 G120 C126 | Q119-G122 PolarHBondContact O-N 3.15Å; G120-G122 PolarHBondContact O-N 3.07Å; G122-C126 PolarHBondContact O-N 3.18Å; G122-C126 VanDerWaalsContact O-N 3.15Å; G122-C126 PolarHBondContact O-SG 2.81Å |
| 123 | S | 83.2 | Confident | 85.8 | Confident | 16 Ų | 16 | 15 Ų | 15 | 11% | 0.112 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -65.7 | -49.1 | -168.9 | -156.1 | 0 | 0 | 0 | 0 | 114.3 | Y26 V125 C126 A127 | Y26-S123 PolarHBondContact OH-OG 2.93Å; Y26-S123 VanDerWaalsContact OH-OG 3.04Å; S123-V125 VanDerWaalsContact C-N 3.32Å; S123-V125 PolarHBondContact O-N 3.26Å; S123-C126 WeakPolarHBondContact O-CB 3.11Å; S123-C126 PolarHBondContact O-N 2.82Å; S123-A127 PolarHBondContact O-N 3.2Å; S123-A127 VanDerWaalsContact O-N 3.12Å |
| 124 | P | 84.7 | Confident | 85.4 | Confident | 1 Ų | 1 | 12.8 Ų | 12.8 | 1% | 0.006 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -65.9 | -34.5 | -178.4 | -22.7 | 36.3 | 0 | 0 | 0 | 112.9 | K69 G120 A127 R128 | K69-P124 VanDerWaalsContact O-CG 3.31Å; K69-P124 WeakPolarHBondContact O-CG 3.35Å; G120-P124 WeakPolarHBondContact O-CD 3.49Å; P124-A127 WeakPolarHBondContact O-CB 3.38Å; P124-A127 PolarHBondContact O-N 3.5Å; P124-R128 PolarHBondContact O-N 2.85Å |
| 125 | V | 86.2 | Confident | 84.7 | Confident | 0 Ų | 0 | 9.3 Ų | 9.3 | 0% | 0 | 5% | 0.046 | C | C | . | . | H | α-helix | trans | -67.1 | -41.7 | 177.2 | -177.4 | 0 | 0 | 0 | 0 | 111.1 | A81 F84 M85 W121 S123 A127 R128 L129 | A81-V125 HydrophobicContact CB-CG1 3.63Å; F84-V125 HydrophobicContact CD1-CG2 3.49Å; F84-V125 VanDerWaalsContact CD1-CG2 3.49Å; F84-V125 HydrophobicContact CE1-CG2 4.13Å; F84-V125 HydrophobicContact CG-CG2 4.47Å; M85-V125 HydrophobicContact CB-CB 4.46Å; M85-V125 HydrophobicContact CB-CG1 4Å; W121-V125 WeakPolarHBondContact O-CG2 3.21Å; S123-V125 VanDerWaalsContact C-N 3.32Å; S123-V125 PolarHBondContact O-N 3.26Å; V125-A127 VanDerWaalsContact C-N 3.31Å; V125-A127 PolarHBondContact O-N 3.45Å; V125-R128 PolarHBondContact O-N 3.2Å; V125-L129 HydrophobicContact CG1-CD1 3.89Å; V125-L129 HydrophobicContact CG1-CG 4.38Å; V125-L129 WeakPolarHBondContact O-CG 3.36Å; V125-L129 PolarHBondContact O-N 3.06Å |
| 126 | C | 86.5 | Confident | 83.8 | Confident | 0 Ų | 0 | 11.5 Ų | 11.5 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -59.5 | -45.7 | 175.2 | -62 | 0 | 0 | 0 | 0 | 110.6 | I22 G122 S123 R128 L129 L130 W146 | I22-C126 HydrophobicContact CG2-CB 3.74Å; I22-C126 WeakPolarHBondContact CG2-SG 3.19Å; G122-C126 PolarHBondContact O-N 3.18Å; G122-C126 VanDerWaalsContact O-N 3.15Å; G122-C126 PolarHBondContact O-SG 2.81Å; S123-C126 WeakPolarHBondContact O-CB 3.11Å; S123-C126 PolarHBondContact O-N 2.82Å; C126-R128 PolarHBondContact O-N 3.47Å; C126-L129 PolarHBondContact O-N 2.89Å; C126-L130 WeakPolarHBondContact O-CB 3.23Å; C126-L130 WeakPolarHBondContact O-CG 3.39Å; C126-L130 PolarHBondContact O-N 3.27Å; C126-W146 HydrophobicContact CB-CD2 4.19Å; C126-W146 VanDerWaalsContact CB-CE2 3.41Å; C126-W146 HydrophobicContact CB-CH2 4.14Å; C126-W146 HydrophobicContact CB-CZ2 3.38Å; C126-W146 PolarHBondContact SG-NE1 2.98Å |
| 127 | A | 83 | Confident | 82.8 | Confident | 1 Ų | 1 | 13.9 Ų | 13.9 | 1% | 0.008 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -57.2 | -49 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | S123 P124 V125 L129 L130 T131 W143 T369 | S123-A127 PolarHBondContact O-N 3.2Å; S123-A127 VanDerWaalsContact O-N 3.12Å; P124-A127 WeakPolarHBondContact O-CB 3.38Å; P124-A127 PolarHBondContact O-N 3.5Å; V125-A127 VanDerWaalsContact C-N 3.31Å; V125-A127 PolarHBondContact O-N 3.45Å; A127-L129 PolarHBondContact O-N 3.15Å; A127-L130 PolarHBondContact O-N 3Å; A127-T131 WeakPolarHBondContact O-CG2 3.33Å; A127-T131 PolarHBondContact O-N 3.33Å; A127-T131 PolarHBondContact O-OG1 3.32Å; A127-W143 HydrophobicContact CB-CH2 3.36Å; A127-W143 HydrophobicContact CB-CZ2 4.16Å; A127-W143 HydrophobicContact CB-CZ3 3.93Å; A127-T369 HydrophobicContact CB-CG2 3.77Å |
| 128 | R | 83.2 | Confident | 82.2 | Confident | 7 Ų | 7 | 12 Ų | 12 | 3% | 0.026 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -60.7 | -41.6 | 177 | 177.8 | -176.4 | 153.9 | 177 | -2.6 | 112.7 | S76 D77 S79 P124 V125 C126 T131 A132 D194 | S76-R128 PolarHBondContact O-NH1 3.11Å; D77-R128 PolarHBondContact O-NH1 3.4Å; S79-R128 PolarHBondContact O-NH1 3.03Å; P124-R128 PolarHBondContact O-N 2.85Å; V125-R128 PolarHBondContact O-N 3.2Å; C126-R128 PolarHBondContact O-N 3.47Å; R128-T131 WeakPolarHBondContact CA-OG1 3.31Å; R128-T131 PolarHBondContact O-N 3.12Å; R128-T131 PolarHBondContact O-OG1 3.47Å; R128-A132 VanDerWaalsContact O-CB 3.3Å; R128-A132 WeakPolarHBondContact O-CB 3.46Å; R128-A132 PolarHBondContact O-N 3.35Å; R128-D194 IonicContact CZ-OD1 2.68Å; R128-D194 IonicContact CZ-OD2 3.54Å; R128-D194 IonicContact NE-OD1 3.71Å; R128-D194 IonicContact NH2-OD1 3.99Å; R128-D194 PolarHBondContact NH2-OD1 2.77Å; R128-D194 IonicContact NH2-OD2 3.52Å; R128-D194 PolarHBondContact NH2-OD2 3.04Å |
| 129 | L | 85.1 | Confident | 81.7 | Confident | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -68.5 | -39.4 | 178.3 | -73.6 | 165.7 | 0 | 0 | 0 | 111.3 | I22 A81 V125 C126 A127 A132 W133 L192 D194 | I22-L129 HydrophobicContact CD1-CB 3.43Å; I22-L129 VanDerWaalsContact CD1-CB 3.43Å; I22-L129 HydrophobicContact CD1-CD1 3.62Å; I22-L129 HydrophobicContact CD1-CG 4.13Å; I22-L129 HydrophobicContact CG1-CD1 3.81Å; A81-L129 HydrophobicContact CB-CD1 4.25Å; A81-L129 HydrophobicContact CB-CD2 3.9Å; A81-L129 HydrophobicContact CB-CG 4.05Å; V125-L129 HydrophobicContact CG1-CD1 3.89Å; V125-L129 HydrophobicContact CG1-CG 4.38Å; V125-L129 WeakPolarHBondContact O-CG 3.36Å; V125-L129 PolarHBondContact O-N 3.06Å; C126-L129 PolarHBondContact O-N 2.89Å; A127-L129 PolarHBondContact O-N 3.15Å; L129-A132 PolarHBondContact O-N 2.85Å; L129-W133 WeakPolarHBondContact O-CB 3.36Å; L129-W133 VanDerWaalsContact O-CD1 3.23Å; L129-W133 PolarHBondContact O-N 3.46Å; L129-L192 HydrophobicContact CD1-CD1 4.32Å; L129-L192 HydrophobicContact CD1-CD2 3.47Å; L129-L192 VanDerWaalsContact CD1-CD2 3.47Å; L129-L192 HydrophobicContact CD1-CG 4.01Å; L129-D194 WeakPolarHBondContact CD2-O 3.49Å |
| 130 | L | 84.1 | Confident | 81.2 | Confident | 1 Ų | 1 | 10 Ų | 10 | 1% | 0.005 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -63.2 | -42.8 | 175.3 | -73.1 | 171.2 | 0 | 0 | 0 | 111.2 | L19 C126 A127 A132 Y134 W142 W143 W146 | L19-L130 HydrophobicContact CD1-CD2 4.15Å; C126-L130 WeakPolarHBondContact O-CB 3.23Å; C126-L130 WeakPolarHBondContact O-CG 3.39Å; C126-L130 PolarHBondContact O-N 3.27Å; A127-L130 PolarHBondContact O-N 3Å; L130-A132 VanDerWaalsContact C-N 3.31Å; L130-A132 PolarHBondContact O-N 3.48Å; L130-Y134 HydrophobicContact CD2-CD2 3.82Å; L130-Y134 HydrophobicContact CD2-CE2 3.87Å; L130-Y134 VanDerWaalsContact O-CB 3.3Å; L130-Y134 WeakPolarHBondContact O-CB 3.05Å; L130-Y134 PolarHBondContact O-N 3.11Å; L130-W142 HydrophobicContact CD2-CB 4.29Å; L130-W143 HydrophobicContact CB-CE3 3.99Å; L130-W143 HydrophobicContact CB-CZ3 4.24Å; L130-W143 HydrophobicContact CD1-CB 4.33Å; L130-W143 HydrophobicContact CD1-CD2 3.92Å; L130-W143 HydrophobicContact CD1-CE3 3.57Å; L130-W143 HydrophobicContact CD1-CG 4.27Å; L130-W143 HydrophobicContact CD1-CZ3 4.25Å; L130-W143 HydrophobicContact CG-CE3 4.44Å; L130-W146 HydrophobicContact CD1-CB 4.01Å; L130-W146 HydrophobicContact CD1-CD2 4.03Å; L130-W146 HydrophobicContact CD1-CE3 3.83Å; L130-W146 HydrophobicContact CD1-CG 4.11Å |
| 131 | T | 80.4 | Confident | 80.9 | Confident | 1 Ų | 1 | 11.4 Ų | 11.4 | 1% | 0.006 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -69.1 | -28.6 | 176.1 | 57.7 | 0 | 0 | 0 | 0 | 113.3 | A127 R128 R139 A357 A365 | A127-T131 WeakPolarHBondContact O-CG2 3.33Å; A127-T131 PolarHBondContact O-N 3.33Å; A127-T131 PolarHBondContact O-OG1 3.32Å; R128-T131 WeakPolarHBondContact CA-OG1 3.31Å; R128-T131 PolarHBondContact O-N 3.12Å; R128-T131 PolarHBondContact O-OG1 3.47Å; T131-R139 PolarHBondContact O-NH2 2.87Å; T131-A357 HydrophobicContact CG2-CB 3.78Å; T131-A365 HydrophobicContact CG2-CB 4.32Å |
| 132 | A | 82.3 | Confident | 80.8 | Confident | 20 Ų | 20 | 13 Ų | 13 | 17% | 0.165 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -78.6 | -31 | 178 | 0 | 0 | 0 | 0 | 0 | 114.1 | R128 L129 L130 V204 | R128-A132 VanDerWaalsContact O-CB 3.3Å; R128-A132 WeakPolarHBondContact O-CB 3.46Å; R128-A132 PolarHBondContact O-N 3.35Å; L129-A132 PolarHBondContact O-N 2.85Å; L130-A132 VanDerWaalsContact C-N 3.31Å; L130-A132 PolarHBondContact O-N 3.48Å; A132-V204 WeakPolarHBondContact O-CG2 3.21Å |
| 133 | W | 82.7 | Confident | 80.7 | Confident | 0 Ų | 0 | 13.4 Ų | 13.4 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -107.1 | -13.4 | -172.4 | -73.3 | 91.4 | 0 | 0 | 0 | 114.8 | W14 R15 I18 L129 R193 D194 P196 L199 L201 | W14-W133 HydrophobicContact CB-CE3 4.45Å; W14-W133 HydrophobicContact CB-CH2 3.93Å; W14-W133 HydrophobicContact CB-CZ3 3.61Å; W14-W133 HydrophobicContact CG-CH2 4.38Å; W14-W133 HydrophobicContact CG-CZ3 4.45Å; R15-W133 HydrophobicContact CG-CE3 4.23Å; I18-W133 HydrophobicContact CD1-CD2 3.39Å; I18-W133 HydrophobicContact CD1-CE3 3.73Å; I18-W133 HydrophobicContact CD1-CG 4.02Å; I18-W133 HydrophobicContact CD1-CH2 3.57Å; I18-W133 HydrophobicContact CD1-CZ2 3.23Å; I18-W133 HydrophobicContact CD1-CZ3 3.82Å; I18-W133 HydrophobicContact CG2-CG 4.46Å; L129-W133 WeakPolarHBondContact O-CB 3.36Å; L129-W133 VanDerWaalsContact O-CD1 3.23Å; L129-W133 PolarHBondContact O-N 3.46Å; W133-R193 HydrophobicContact CZ2-CB 4.18Å; W133-R193 PolarHBondContact NE1-O 3.47Å; W133-D194 PolarHBondContact NE1-O 2.85Å; W133-D194 VanDerWaalsContact NE1-O 3.1Å; W133-P196 HydrophobicContact CE3-CB 4.25Å; W133-P196 HydrophobicContact CH2-CB 3.99Å; W133-P196 HydrophobicContact CZ2-CB 4.31Å; W133-P196 HydrophobicContact CZ3-CB 3.94Å; W133-L199 HydrophobicContact CH2-CD1 3.84Å; W133-L201 HydrophobicContact CH2-CD1 4.43Å; W133-L201 HydrophobicContact CZ3-CD1 4.21Å |
| 134 | Y | 81.3 | Confident | 80.7 | Confident | 0 Ų | 0 | 12.7 Ų | 12.7 | 0% | 0 | 7% | 0.069 | C | C | . | . | S | Bend | trans | -130.4 | 133.8 | -176.8 | -61.6 | -89.9 | 0 | 0 | 0 | 111.2 | R15 L19 L130 E138 R139 W142 | R15-Y134 HydrophobicContact CB-CE1 4.23Å; R15-Y134 HydrophobicContact CG-CE1 4.45Å; R15-Y134 VanDerWaalsContact NE-CE1 3.3Å; R15-Y134 PolarHBondContact O-OH 3.32Å; L19-Y134 WeakPolarHBondContact CB-OH 3.25Å; L130-Y134 HydrophobicContact CD2-CD2 3.82Å; L130-Y134 HydrophobicContact CD2-CE2 3.87Å; L130-Y134 VanDerWaalsContact O-CB 3.3Å; L130-Y134 WeakPolarHBondContact O-CB 3.05Å; L130-Y134 PolarHBondContact O-N 3.11Å; Y134-E138 HydrophobicContact CD1-CG 4.49Å; Y134-R139 PolarHBondContact O-NE 2.95Å; Y134-R139 PolarHBondContact O-NH2 3.45Å; Y134-W142 HydrophobicContact CD1-CB 4.11Å; Y134-W142 AromaticContact CD1-CD1 3.03Å; Y134-W142 AromaticContact CD1-CD2 3.98Å; Y134-W142 HydrophobicContact CD1-CD2 3.98Å; Y134-W142 AromaticContact CD1-CE2 3.91Å; Y134-W142 AromaticContact CD1-CG 3.45Å; Y134-W142 HydrophobicContact CD1-CG 3.45Å; Y134-W142 VanDerWaalsContact CD1-CG 3.45Å; Y134-W142 AromaticContact CD1-NE1 3.36Å; Y134-W142 HydrophobicContact CE1-CB 4.17Å; Y134-W142 AromaticContact CE1-CD1 3.35Å; Y134-W142 AromaticContact CE1-CD2 3.43Å; Y134-W142 HydrophobicContact CE1-CD2 3.43Å; Y134-W142 VanDerWaalsContact CE1-CD2 3.43Å; Y134-W142 AromaticContact CE1-CE2 3.41Å; Y134-W142 VanDerWaalsContact CE1-CE2 3.41Å; Y134-W142 HydrophobicContact CE1-CE3 4.21Å; Y134-W142 AromaticContact CE1-CG 3.39Å; Y134-W142 HydrophobicContact CE1-CG 3.39Å; Y134-W142 HydrophobicContact CE1-CZ2 4.11Å; Y134-W142 AromaticContact CE1-NE1 3.38Å; Y134-W142 HydrophobicContact CG-CB 4.33Å; Y134-W142 AromaticContact CG-CD1 3.88Å; Y134-W142 HydrophobicContact CG-CG 4.15Å |
| 135 | S | 76.5 | Confident | 80.8 | Confident | 0 Ų | 0 | 15.9 Ų | 15.9 | 0% | 0 | 9% | 0.086 | C | C | . | . | trans | -75.7 | 159.1 | 179.5 | 122.1 | 0 | 0 | 0 | 0 | 110.7 | T137 E138 R139 R208 D210 | S135-T137 PolarHBondContact O-N 3.1Å; S135-T137 PolarHBondContact OG-OG1 2.64Å; S135-E138 WeakPolarHBondContact O-CG 3.45Å; S135-E138 PolarHBondContact O-N 3.49Å; S135-R139 WeakPolarHBondContact O-CB 3.28Å; S135-R139 PolarHBondContact O-N 3.46Å; S135-R139 VanDerWaalsContact O-N 3.15Å; S135-R208 PolarHBondContact OG-NH1 3.13Å; S135-D210 WeakPolarHBondContact CB-OD2 3.39Å; S135-D210 PolarHBondContact OG-OD2 3.2Å | ||
| 136 | R | 70.7 | Confident | 80.7 | Confident | 46 Ų | 46 | 16.2 Ų | 16.2 | 17% | 0.174 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -53.4 | -39 | -174.3 | -61.2 | -156.8 | -176 | -156.5 | 8.4 | 113.6 | E138 R139 E213 Q216 E358 | R136-E138 VanDerWaalsContact C-N 3.29Å; R136-E138 PolarHBondContact O-N 2.79Å; R136-R139 PolarHBondContact O-N 3.32Å; R136-E213 WeakPolarHBondContact CG-OE2 3.5Å; R136-Q216 VanDerWaalsContact NH2-CB 3.3Å; R136-E358 PolarHBondContact NH2-O 3.18Å |
| 137 | T | 68.9 | Low | 80.5 | Confident | 50 Ų | 50 | 17.1 Ų | 17.1 | 31% | 0.307 | 9% | 0.092 | S | C | . | . | H | α-helix | trans | -74.4 | -11.5 | -173.9 | 54.1 | 0 | 0 | 0 | 0 | 115.1 | S135 R208 | S135-T137 PolarHBondContact O-N 3.1Å; S135-T137 PolarHBondContact OG-OG1 2.64Å; T137-R208 PolarHBondContact OG1-NH1 3.16Å |
| 138 | E | 77.5 | Confident | 80.5 | Confident | 29 Ų | 29 | 17.7 Ų | 17.7 | 14% | 0.136 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -120 | -1.8 | 174.1 | 63.8 | -177.1 | 167 | 0 | 0 | 112.9 | R15 Y134 S135 R136 G140 G141 W142 R208 D298 | R15-E138 IonicContact CZ-OE1 3.59Å; R15-E138 IonicContact CZ-OE2 3.86Å; R15-E138 IonicContact NH1-OE1 2.93Å; R15-E138 PolarHBondContact NH1-OE1 3.41Å; R15-E138 IonicContact NH1-OE2 2.92Å; R15-E138 IonicContact NH2-OE1 3.42Å; R15-E138 PolarHBondContact NH2-OE1 2.96Å; R15-E138 IonicContact NH2-OE2 3.21Å; R15-E138 PolarHBondContact NH2-OE2 3.11Å; Y134-E138 HydrophobicContact CD1-CG 4.49Å; S135-E138 WeakPolarHBondContact O-CG 3.45Å; S135-E138 PolarHBondContact O-N 3.49Å; R136-E138 VanDerWaalsContact C-N 3.29Å; R136-E138 PolarHBondContact O-N 2.79Å; E138-G140 PolarHBondContact O-N 2.84Å; E138-G141 PolarHBondContact O-N 3.46Å; E138-W142 PolarHBondContact O-N 3.36Å; E138-W142 PolarHBondContact OE2-NE1 3.19Å; E138-R208 VanDerWaalsContact CG-NH1 3.31Å; E138-R208 IonicContact OE1-NH1 2.9Å; E138-R208 IonicContact OE2-CZ 3.84Å; E138-R208 IonicContact OE2-NH2 3.96Å; E138-D298 WeakPolarHBondContact CA-OD2 3.25Å |
| 139 | R | 79.3 | Confident | 80.6 | Confident | 1 Ų | 1 | 17.4 Ų | 17.4 | 0% | 0.004 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -65.1 | -32.2 | -171.8 | -166.9 | 172.2 | -67.2 | 157.8 | -3.6 | 111 | T131 Y134 S135 R136 W142 W143 E213 M354 E358 | T131-R139 PolarHBondContact O-NH2 2.87Å; Y134-R139 PolarHBondContact O-NE 2.95Å; Y134-R139 PolarHBondContact O-NH2 3.45Å; S135-R139 WeakPolarHBondContact O-CB 3.28Å; S135-R139 PolarHBondContact O-N 3.46Å; S135-R139 VanDerWaalsContact O-N 3.15Å; R136-R139 PolarHBondContact O-N 3.32Å; R139-W142 PolarHBondContact O-N 3.18Å; R139-W143 HydrophobicContact CG-CE3 4.32Å; R139-W143 WeakPolarHBondContact O-CB 3.06Å; R139-W143 PolarHBondContact O-N 3.08Å; R139-E213 IonicContact CZ-OE2 2.82Å; R139-E213 IonicContact NH2-OE1 2.63Å; R139-E213 PolarHBondContact NH2-OE1 3.33Å; R139-E213 IonicContact NH2-OE2 3.24Å; R139-E213 PolarHBondContact NH2-OE2 2.98Å; R139-M354 HydrophobicContact CB-SD 4.47Å; R139-M354 HydrophobicContact CG-CG 4.39Å; R139-M354 HydrophobicContact CG-SD 4.29Å; R139-E358 IonicContact CZ-OE1 3.37Å; R139-E358 IonicContact NE-OE1 3.59Å; R139-E358 IonicContact NH1-OE1 2.97Å; R139-E358 PolarHBondContact NH1-OE1 3.16Å |
| 140 | G | 75.1 | Confident | 80.5 | Confident | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -56.1 | -53.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | E138 W143 A144 D298 M354 | E138-G140 PolarHBondContact O-N 2.84Å; G140-W143 PolarHBondContact O-N 2.83Å; G140-A144 WeakPolarHBondContact O-CB 3.24Å; G140-A144 PolarHBondContact O-N 3.49Å; G140-D298 VanDerWaalsContact CA-CG 3.46Å; G140-D298 WeakPolarHBondContact CA-OD1 3.49Å; G140-D298 WeakPolarHBondContact CA-OD2 3.22Å; G140-D298 PolarHBondContact N-OD1 2.92Å; G140-D298 PolarHBondContact N-OD2 3.47Å; G140-M354 VanDerWaalsContact CA-SD 3.52Å |
| 141 | G | 78.9 | Confident | 80.2 | Confident | 30 Ų | 30 | 19.2 Ų | 19.2 | 31% | 0.309 | 10% | 0.104 | S | C | . | . | H | α-helix | trans | -63.7 | -43.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | E138 A144 L145 D298 | E138-G141 PolarHBondContact O-N 3.46Å; G141-A144 PolarHBondContact O-N 3.1Å; G141-L145 WeakPolarHBondContact O-CB 3.47Å; G141-L145 PolarHBondContact O-N 3.41Å; G141-D298 PolarHBondContact N-OD2 2.88Å |
| 142 | W | 83.5 | Confident | 80.4 | Confident | 70 Ų | 70 | 22 Ų | 22 | 27% | 0.265 | 12% | 0.121 | S | C | . | . | H | α-helix | trans | -71 | -35.4 | 179.3 | -64.8 | 114.4 | 0 | 0 | 0 | 112.9 | L19 L130 Y134 E138 R139 L145 W146 | L19-W142 HydrophobicContact CD1-CE3 4.22Å; L19-W142 HydrophobicContact CD2-CD2 4.43Å; L19-W142 HydrophobicContact CD2-CE3 3.21Å; L19-W142 HydrophobicContact CD2-CH2 4.45Å; L19-W142 HydrophobicContact CD2-CZ3 3.23Å; L19-W142 HydrophobicContact CG-CE3 4.28Å; L130-W142 HydrophobicContact CD2-CB 4.29Å; Y134-W142 HydrophobicContact CD1-CB 4.11Å; Y134-W142 AromaticContact CD1-CD1 3.03Å; Y134-W142 AromaticContact CD1-CD2 3.98Å; Y134-W142 HydrophobicContact CD1-CD2 3.98Å; Y134-W142 AromaticContact CD1-CE2 3.91Å; Y134-W142 AromaticContact CD1-CG 3.45Å; Y134-W142 HydrophobicContact CD1-CG 3.45Å; Y134-W142 VanDerWaalsContact CD1-CG 3.45Å; Y134-W142 AromaticContact CD1-NE1 3.36Å; Y134-W142 HydrophobicContact CE1-CB 4.17Å; Y134-W142 AromaticContact CE1-CD1 3.35Å; Y134-W142 AromaticContact CE1-CD2 3.43Å; Y134-W142 HydrophobicContact CE1-CD2 3.43Å; Y134-W142 VanDerWaalsContact CE1-CD2 3.43Å; Y134-W142 AromaticContact CE1-CE2 3.41Å; Y134-W142 VanDerWaalsContact CE1-CE2 3.41Å; Y134-W142 HydrophobicContact CE1-CE3 4.21Å; Y134-W142 AromaticContact CE1-CG 3.39Å; Y134-W142 HydrophobicContact CE1-CG 3.39Å; Y134-W142 HydrophobicContact CE1-CZ2 4.11Å; Y134-W142 AromaticContact CE1-NE1 3.38Å; Y134-W142 HydrophobicContact CG-CB 4.33Å; Y134-W142 AromaticContact CG-CD1 3.88Å; Y134-W142 HydrophobicContact CG-CG 4.15Å; E138-W142 PolarHBondContact O-N 3.36Å; E138-W142 PolarHBondContact OE2-NE1 3.19Å; R139-W142 PolarHBondContact O-N 3.18Å; W142-L145 HydrophobicContact CE3-CD2 4.03Å; W142-L145 HydrophobicContact CZ3-CD2 3.94Å; W142-L145 PolarHBondContact O-N 3.31Å; W142-W146 PolarHBondContact O-N 3.22Å |
| 143 | W | 82.2 | Confident | 80.4 | Confident | 8 Ų | 8 | 21.2 Ų | 21.2 | 3% | 0.03 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -69.4 | -37.3 | 174.3 | -164.9 | -75.1 | 0 | 0 | 0 | 111.6 | A127 L130 R139 G140 W146 N147 M350 M354 A357 T369 | A127-W143 HydrophobicContact CB-CH2 3.36Å; A127-W143 HydrophobicContact CB-CZ2 4.16Å; A127-W143 HydrophobicContact CB-CZ3 3.93Å; L130-W143 HydrophobicContact CB-CE3 3.99Å; L130-W143 HydrophobicContact CB-CZ3 4.24Å; L130-W143 HydrophobicContact CD1-CB 4.33Å; L130-W143 HydrophobicContact CD1-CD2 3.92Å; L130-W143 HydrophobicContact CD1-CE3 3.57Å; L130-W143 HydrophobicContact CD1-CG 4.27Å; L130-W143 HydrophobicContact CD1-CZ3 4.25Å; L130-W143 HydrophobicContact CG-CE3 4.44Å; R139-W143 HydrophobicContact CG-CE3 4.32Å; R139-W143 WeakPolarHBondContact O-CB 3.06Å; R139-W143 PolarHBondContact O-N 3.08Å; G140-W143 PolarHBondContact O-N 2.83Å; W143-W146 AromaticContact CD1-CE3 3.91Å; W143-W146 HydrophobicContact CD2-CE3 4.05Å; W143-W146 HydrophobicContact CD2-CZ3 4.11Å; W143-W146 AromaticContact CE2-CE3 3.93Å; W143-W146 AromaticContact CE2-CZ3 3.53Å; W143-W146 HydrophobicContact CG-CE3 4.06Å; W143-W146 HydrophobicContact CG-CZ3 4.44Å; W143-W146 AromaticContact CZ2-CZ3 3.84Å; W143-W146 HydrophobicContact CZ2-CZ3 3.84Å; W143-W146 AromaticContact NE1-CE3 3.82Å; W143-W146 AromaticContact NE1-CZ3 3.52Å; W143-W146 PolarHBondContact O-N 3.45Å; W143-N147 PolarHBondContact NE1-ND2 3.41Å; W143-N147 PolarHBondContact O-N 3.34Å; W143-N147 PolarHBondContact O-ND2 2.74Å; W143-M350 VanDerWaalsContact CD1-CG 3.48Å; W143-M354 HydrophobicContact CB-CE 3.53Å; W143-M354 HydrophobicContact CB-CG 4.32Å; W143-M354 HydrophobicContact CB-SD 4Å; W143-M354 HydrophobicContact CD2-CB 4.23Å; W143-M354 HydrophobicContact CD2-CE 4.3Å; W143-M354 HydrophobicContact CD2-CG 3.65Å; W143-M354 HydrophobicContact CD2-SD 4.47Å; W143-M354 HydrophobicContact CE3-CG 3.72Å; W143-M354 HydrophobicContact CG-CE 3.59Å; W143-M354 HydrophobicContact CG-CG 3.96Å; W143-M354 HydrophobicContact CG-SD 4.2Å; W143-M354 HydrophobicContact CZ2-CB 4.38Å; W143-M354 HydrophobicContact CZ2-CG 4.48Å; W143-M354 HydrophobicContact CZ3-CG 4.15Å; W143-A357 HydrophobicContact CH2-CB 3.85Å; W143-A357 HydrophobicContact CZ3-CB 4.12Å; W143-T369 HydrophobicContact CH2-CG2 4.15Å |
| 144 | A | 83.2 | Confident | 80.2 | Confident | 1 Ų | 1 | 22.1 Ų | 22.1 | 1% | 0.008 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -65.1 | -43.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | G140 G141 W146 N147 T148 A290 L291 M350 | G140-A144 WeakPolarHBondContact O-CB 3.24Å; G140-A144 PolarHBondContact O-N 3.49Å; G141-A144 PolarHBondContact O-N 3.1Å; A144-W146 VanDerWaalsContact C-N 3.34Å; A144-W146 PolarHBondContact O-N 3.01Å; A144-N147 WeakPolarHBondContact O-CA 3.37Å; A144-N147 WeakPolarHBondContact O-CB 3.21Å; A144-N147 PolarHBondContact O-N 3.32Å; A144-T148 PolarHBondContact O-N 3.46Å; A144-T148 VanDerWaalsContact O-N 3.08Å; A144-A290 WeakPolarHBondContact CB-O 3.27Å; A144-L291 HydrophobicContact CB-CD2 3.96Å; A144-M350 WeakPolarHBondContact CA-SD 3.08Å; A144-M350 HydrophobicContact CB-CE 4.43Å; A144-M350 HydrophobicContact CB-SD 3.51Å; A144-M350 VanDerWaalsContact CB-SD 3.51Å |
| 145 | L | 86.1 | Confident | 80.2 | Confident | 69 Ų | 69 | 25.1 Ų | 25.1 | 36% | 0.361 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -62 | -41.4 | 173.3 | -176.4 | 53.9 | 0 | 0 | 0 | 111.4 | L19 W23 G141 W142 N147 T148 | L19-L145 HydrophobicContact CD2-CD2 3.57Å; L19-L145 HydrophobicContact CD2-CG 4.21Å; W23-L145 VanDerWaalsContact CD1-O 3.22Å; W23-L145 PolarHBondContact NE1-O 3.13Å; G141-L145 WeakPolarHBondContact O-CB 3.47Å; G141-L145 PolarHBondContact O-N 3.41Å; W142-L145 HydrophobicContact CE3-CD2 4.03Å; W142-L145 HydrophobicContact CZ3-CD2 3.94Å; W142-L145 PolarHBondContact O-N 3.31Å; L145-N147 VanDerWaalsContact C-N 3.31Å; L145-N147 PolarHBondContact O-N 3.35Å; L145-T148 WeakPolarHBondContact O-CB 3.11Å; L145-T148 PolarHBondContact O-N 2.89Å; L145-T148 PolarHBondContact O-OG1 2.9Å |
| 146 | W | 85 | Confident | 80.6 | Confident | 7 Ų | 7 | 28.7 Ų | 28.7 | 3% | 0.027 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -60.1 | -40.5 | 170.8 | 166.6 | 57.9 | 0 | 0 | 0 | 112.2 | I22 Y26 C126 L130 W142 W143 A144 T148 A149 | I22-W146 HydrophobicContact CG2-CG 4.44Å; Y26-W146 AromaticContact CD1-CE2 3.78Å; Y26-W146 AromaticContact CD1-CZ2 3.99Å; Y26-W146 HydrophobicContact CD1-CZ2 3.99Å; Y26-W146 AromaticContact CD1-NE1 3.31Å; Y26-W146 VanDerWaalsContact CD1-NE1 3.31Å; Y26-W146 HydrophobicContact CD2-CZ2 4.01Å; Y26-W146 AromaticContact CD2-NE1 3.88Å; Y26-W146 AromaticContact CE1-CE2 3.84Å; Y26-W146 AromaticContact CE1-CZ2 3.64Å; Y26-W146 HydrophobicContact CE1-CZ2 3.64Å; Y26-W146 AromaticContact CE1-NE1 3.87Å; Y26-W146 AromaticContact CE2-CZ2 3.69Å; Y26-W146 HydrophobicContact CE2-CZ2 3.69Å; Y26-W146 AromaticContact CG-CE2 3.97Å; Y26-W146 HydrophobicContact CG-CZ2 4.14Å; Y26-W146 AromaticContact CG-NE1 3.28Å; Y26-W146 VanDerWaalsContact CG-NE1 3.28Å; Y26-W146 AromaticContact CZ-CZ2 3.45Å; Y26-W146 VanDerWaalsContact CZ-CZ2 3.45Å; C126-W146 HydrophobicContact CB-CD2 4.19Å; C126-W146 VanDerWaalsContact CB-CE2 3.41Å; C126-W146 HydrophobicContact CB-CH2 4.14Å; C126-W146 HydrophobicContact CB-CZ2 3.38Å; C126-W146 PolarHBondContact SG-NE1 2.98Å; L130-W146 HydrophobicContact CD1-CB 4.01Å; L130-W146 HydrophobicContact CD1-CD2 4.03Å; L130-W146 HydrophobicContact CD1-CE3 3.83Å; L130-W146 HydrophobicContact CD1-CG 4.11Å; W142-W146 PolarHBondContact O-N 3.22Å; W143-W146 AromaticContact CD1-CE3 3.91Å; W143-W146 HydrophobicContact CD2-CE3 4.05Å; W143-W146 HydrophobicContact CD2-CZ3 4.11Å; W143-W146 AromaticContact CE2-CE3 3.93Å; W143-W146 AromaticContact CE2-CZ3 3.53Å; W143-W146 HydrophobicContact CG-CE3 4.06Å; W143-W146 HydrophobicContact CG-CZ3 4.44Å; W143-W146 AromaticContact CZ2-CZ3 3.84Å; W143-W146 HydrophobicContact CZ2-CZ3 3.84Å; W143-W146 AromaticContact NE1-CE3 3.82Å; W143-W146 AromaticContact NE1-CZ3 3.52Å; W143-W146 PolarHBondContact O-N 3.45Å; A144-W146 VanDerWaalsContact C-N 3.34Å; A144-W146 PolarHBondContact O-N 3.01Å; W146-T148 VanDerWaalsContact C-N 3.25Å; W146-T148 PolarHBondContact O-N 2.91Å; W146-A149 WeakPolarHBondContact O-CB 3.43Å; W146-A149 PolarHBondContact O-N 3.05Å |
| 147 | N | 81.8 | Confident | 81.2 | Confident | 19 Ų | 19 | 26.5 Ų | 26.5 | 10% | 0.102 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -59.7 | -36.6 | 176.5 | -87.4 | -85.6 | 0 | 0 | 0 | 111.4 | W143 A144 L145 A149 H150 M350 | W143-N147 PolarHBondContact NE1-ND2 3.41Å; W143-N147 PolarHBondContact O-N 3.34Å; W143-N147 PolarHBondContact O-ND2 2.74Å; A144-N147 WeakPolarHBondContact O-CA 3.37Å; A144-N147 WeakPolarHBondContact O-CB 3.21Å; A144-N147 PolarHBondContact O-N 3.32Å; L145-N147 VanDerWaalsContact C-N 3.31Å; L145-N147 PolarHBondContact O-N 3.35Å; N147-A149 PolarHBondContact O-N 2.96Å; N147-H150 PolarHBondContact O-CE1 2.52Å; N147-H150 PolarHBondContact O-N 3.24Å; N147-H150 PolarHBondContact O-ND1 3.41Å; N147-M350 WeakPolarHBondContact ND2-CG 3.25Å |
| 148 | T | 82.8 | Confident | 81.7 | Confident | 13 Ų | 13 | 27 Ų | 27 | 8% | 0.08 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -53.8 | -25.2 | 176.2 | 69.6 | 0 | 0 | 0 | 0 | 114.4 | W23 A144 L145 W146 H150 N151 V152 F287 L291 | W23-T148 PolarHBondContact NE1-OG1 3.39Å; A144-T148 PolarHBondContact O-N 3.46Å; A144-T148 VanDerWaalsContact O-N 3.08Å; L145-T148 WeakPolarHBondContact O-CB 3.11Å; L145-T148 PolarHBondContact O-N 2.89Å; L145-T148 PolarHBondContact O-OG1 2.9Å; W146-T148 VanDerWaalsContact C-N 3.25Å; W146-T148 PolarHBondContact O-N 2.91Å; T148-H150 VanDerWaalsContact C-N 3.28Å; T148-H150 PolarHBondContact O-N 3.03Å; T148-N151 PolarHBondContact O-N 2.89Å; T148-V152 PolarHBondContact O-N 3.17Å; T148-V152 VanDerWaalsContact O-N 3.09Å; T148-F287 HydrophobicContact CG2-CD2 4.13Å; T148-F287 HydrophobicContact CG2-CE2 3.43Å; T148-F287 VanDerWaalsContact CG2-CE2 3.43Å; T148-F287 HydrophobicContact CG2-CZ 3.75Å; T148-L291 HydrophobicContact CG2-CD1 4.29Å; T148-L291 HydrophobicContact CG2-CD2 3.75Å; T148-L291 HydrophobicContact CG2-CG 4.2Å |
| 149 | A | 85 | Confident | 82 | Confident | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -58.7 | -35.7 | 175 | 0 | 0 | 0 | 0 | 0 | 113.2 | W23 Y26 A27 W146 N147 N151 G153 | W23-A149 HydrophobicContact CB-CB 4.48Å; W23-A149 HydrophobicContact CD2-CB 4.01Å; W23-A149 HydrophobicContact CG-CB 3.8Å; W23-A149 VanDerWaalsContact O-CB 3.29Å; W23-A149 WeakPolarHBondContact O-CB 3.45Å; Y26-A149 HydrophobicContact CD1-CB 4.2Å; A27-A149 WeakPolarHBondContact CA-O 3.47Å; A27-A149 HydrophobicContact CB-CB 4.1Å; W146-A149 WeakPolarHBondContact O-CB 3.43Å; W146-A149 PolarHBondContact O-N 3.05Å; N147-A149 PolarHBondContact O-N 2.96Å; A149-N151 VanDerWaalsContact C-N 3.34Å; A149-G153 PolarHBondContact O-N 2.57Å |
| 150 | H | 82.5 | Confident | 82.3 | Confident | 13 Ų | 13 | 32.4 Ų | 32.4 | 6% | 0.06 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -66.1 | -39.8 | 179.9 | 74.2 | -106.8 | 0 | 0 | 0 | 111.6 | Y26 Y30 N147 T148 G154 F346 | Y26-H150 HydrophobicContact CE1-CB 4.21Å; Y30-H150 HydrophobicContact CD1-CB 3.97Å; Y30-H150 HydrophobicContact CD2-CB 3.79Å; Y30-H150 HydrophobicContact CE1-CB 3.8Å; Y30-H150 HydrophobicContact CE2-CB 3.62Å; Y30-H150 HydrophobicContact CG-CB 3.96Å; N147-H150 PolarHBondContact O-CE1 2.52Å; N147-H150 PolarHBondContact O-N 3.24Å; N147-H150 PolarHBondContact O-ND1 3.41Å; T148-H150 VanDerWaalsContact C-N 3.28Å; T148-H150 PolarHBondContact O-N 3.03Å; H150-G154 PolarHBondContact O-N 3.45Å; H150-F346 AromaticContact NE2-CE1 3.64Å |
| 151 | N | 79.6 | Confident | 82.5 | Confident | 27 Ų | 27 | 32.6 Ų | 32.6 | 14% | 0.144 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -69 | -46.2 | 179.2 | -72.8 | -39.3 | 0 | 0 | 0 | 111.1 | T148 A149 G154 A155 F287 | T148-N151 PolarHBondContact O-N 2.89Å; A149-N151 VanDerWaalsContact C-N 3.34Å; N151-G154 PolarHBondContact O-N 3.33Å; N151-A155 VanDerWaalsContact O-CB 3.26Å; N151-A155 WeakPolarHBondContact O-CB 3.44Å; N151-A155 PolarHBondContact O-N 3.4Å; N151-F287 HydrophobicContact CB-CD2 3.92Å; N151-F287 WeakPolarHBondContact ND2-CD2 3.39Å |
| 152 | V | 83.1 | Confident | 82.6 | Confident | 60 Ų | 60 | 33.7 Ų | 33.7 | 36% | 0.364 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -65 | -45.9 | 178.3 | 177.6 | 0 | 0 | 0 | 0 | 111.2 | W23 T148 G154 A155 L156 | W23-V152 HydrophobicContact CH2-CB 4.11Å; W23-V152 HydrophobicContact CH2-CG1 3.86Å; W23-V152 HydrophobicContact CH2-CG2 4.32Å; W23-V152 HydrophobicContact CZ2-CB 3.95Å; W23-V152 HydrophobicContact CZ2-CG1 4.21Å; W23-V152 HydrophobicContact CZ2-CG2 3.86Å; T148-V152 PolarHBondContact O-N 3.17Å; T148-V152 VanDerWaalsContact O-N 3.09Å; V152-G154 VanDerWaalsContact C-N 3.33Å; V152-G154 PolarHBondContact O-N 3.39Å; V152-A155 PolarHBondContact O-N 3.06Å; V152-L156 VanDerWaalsContact O-CB 3.28Å; V152-L156 WeakPolarHBondContact O-CB 3.45Å; V152-L156 PolarHBondContact O-N 2.91Å |
| 153 | G | 82.1 | Confident | 82.6 | Confident | 2 Ų | 2 | 32.7 Ų | 32.7 | 2% | 0.021 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -60.8 | -41.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.9 | A27 A149 I157 | A27-G153 WeakPolarHBondContact O-CA 3.15Å; A149-G153 PolarHBondContact O-N 2.57Å; G153-I157 WeakPolarHBondContact O-CG2 3.47Å |
| 154 | G | 80.1 | Confident | 82.7 | Confident | 20 Ų | 20 | 32.7 Ų | 32.7 | 21% | 0.206 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -70.7 | -31.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | H150 N151 V152 P158 | H150-G154 PolarHBondContact O-N 3.45Å; N151-G154 PolarHBondContact O-N 3.33Å; V152-G154 VanDerWaalsContact C-N 3.33Å; V152-G154 PolarHBondContact O-N 3.39Å; G154-P158 WeakPolarHBondContact O-CD 3.47Å |
| 155 | A | 81.2 | Confident | 82.4 | Confident | 62 Ų | 62 | 34 Ų | 34 | 51% | 0.512 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -84.1 | -30.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | N151 V152 P158 | N151-A155 VanDerWaalsContact O-CB 3.26Å; N151-A155 WeakPolarHBondContact O-CB 3.44Å; N151-A155 PolarHBondContact O-N 3.4Å; V152-A155 PolarHBondContact O-N 3.06Å; A155-P158 WeakPolarHBondContact O-CD 3.27Å |
| 156 | L | 83.8 | Confident | 82.1 | Confident | 76 Ų | 76 | 37.7 Ų | 37.7 | 40% | 0.398 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -74.6 | -35.4 | -178.7 | -170.1 | 66.9 | 0 | 0 | 0 | 112.1 | F31 V152 I159 V160 | F31-L156 HydrophobicContact CD2-CB 4.22Å; F31-L156 HydrophobicContact CD2-CD2 4.32Å; F31-L156 HydrophobicContact CD2-CG 4.41Å; F31-L156 HydrophobicContact CE2-CB 4.08Å; F31-L156 HydrophobicContact CE2-CD2 3.99Å; F31-L156 HydrophobicContact CE2-CG 3.88Å; V152-L156 VanDerWaalsContact O-CB 3.28Å; V152-L156 WeakPolarHBondContact O-CB 3.45Å; V152-L156 PolarHBondContact O-N 2.91Å; L156-I159 PolarHBondContact O-N 3.46Å; L156-V160 HydrophobicContact CG-CG2 4.28Å; L156-V160 WeakPolarHBondContact O-CG2 3.47Å; L156-V160 PolarHBondContact O-N 2.74Å; L156-V160 VanDerWaalsContact O-N 3.08Å |
| 157 | I | 82.7 | Confident | 82 | Confident | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65.8 | -43 | -174.6 | -179.2 | 70.5 | 0 | 0 | 0 | 114.4 | F31 K34 G153 I159 V160 M161 A177 | F31-I157 HydrophobicContact CD1-CB 4.44Å; F31-I157 HydrophobicContact CD1-CD1 3.65Å; F31-I157 HydrophobicContact CD1-CG1 4.48Å; F31-I157 HydrophobicContact CD2-CB 3.61Å; F31-I157 HydrophobicContact CD2-CD1 4.21Å; F31-I157 HydrophobicContact CD2-CG1 4.46Å; F31-I157 HydrophobicContact CE1-CD1 3.31Å; F31-I157 HydrophobicContact CE1-CG1 4.45Å; F31-I157 VanDerWaalsContact CE2-CA 3.48Å; F31-I157 HydrophobicContact CE2-CB 3.73Å; F31-I157 HydrophobicContact CE2-CD1 3.92Å; F31-I157 HydrophobicContact CE2-CG1 4.43Å; F31-I157 HydrophobicContact CG-CB 3.98Å; F31-I157 HydrophobicContact CG-CD1 4.08Å; F31-I157 HydrophobicContact CG-CG1 4.48Å; F31-I157 HydrophobicContact CZ-CB 4.2Å; F31-I157 HydrophobicContact CZ-CD1 3.45Å; F31-I157 VanDerWaalsContact CZ-CD1 3.45Å; F31-I157 HydrophobicContact CZ-CG1 4.42Å; F31-I157 VanDerWaalsContact O-CG1 3.29Å; F31-I157 WeakPolarHBondContact O-CG1 3.37Å; K34-I157 HydrophobicContact CB-CG2 3.51Å; G153-I157 WeakPolarHBondContact O-CG2 3.47Å; I157-I159 PolarHBondContact O-N 3.08Å; I157-V160 PolarHBondContact O-N 2.89Å; I157-M161 HydrophobicContact CD1-CG 3.56Å; I157-M161 HydrophobicContact CD1-SD 4.13Å; I157-M161 HydrophobicContact CG1-CG 3.75Å; I157-M161 VanDerWaalsContact O-CB 3.29Å; I157-M161 WeakPolarHBondContact O-CB 3.38Å; I157-M161 VanDerWaalsContact O-CG 3.26Å; I157-M161 WeakPolarHBondContact O-CG 3.35Å; I157-M161 PolarHBondContact O-N 3.06Å; I157-A177 HydrophobicContact CD1-CB 4.02Å |
| 158 | P | 79.6 | Confident | 82 | Confident | 59 Ų | 59 | 52.4 Ų | 52.4 | 38% | 0.383 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -61.5 | -33.5 | 177.7 | -22.3 | 36.2 | 0 | 0 | 0 | 111.8 | A38 G154 A155 A162 | A38-P158 HydrophobicContact CB-CB 4.46Å; G154-P158 WeakPolarHBondContact O-CD 3.47Å; A155-P158 WeakPolarHBondContact O-CD 3.27Å; P158-A162 WeakPolarHBondContact O-CB 3.33Å; P158-A162 PolarHBondContact O-N 2.97Å |
| 159 | I | 85.2 | Confident | 81.9 | Confident | 113 Ų | 113 | 52.7 Ų | 52.7 | 58% | 0.579 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -66.5 | -48.8 | 176.1 | -58.1 | 172 | 0 | 0 | 0 | 110.3 | L156 I157 A162 A163 | L156-I159 PolarHBondContact O-N 3.46Å; I157-I159 PolarHBondContact O-N 3.08Å; I159-A162 PolarHBondContact O-N 2.99Å; I159-A163 WeakPolarHBondContact O-CB 3.15Å; I159-A163 PolarHBondContact O-N 3.17Å |
| 160 | V | 84.5 | Confident | 81.7 | Confident | 32 Ų | 32 | 52.8 Ų | 52.8 | 19% | 0.194 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64.9 | -41.1 | 178.6 | 175.5 | 0 | 0 | 0 | 0 | 111.2 | F31 L156 I157 A164 I176 | F31-V160 HydrophobicContact CE2-CB 4.29Å; F31-V160 HydrophobicContact CE2-CG2 4.01Å; F31-V160 HydrophobicContact CZ-CB 3.81Å; F31-V160 HydrophobicContact CZ-CG1 3.93Å; F31-V160 HydrophobicContact CZ-CG2 3.84Å; L156-V160 HydrophobicContact CG-CG2 4.28Å; L156-V160 WeakPolarHBondContact O-CG2 3.47Å; L156-V160 PolarHBondContact O-N 2.74Å; L156-V160 VanDerWaalsContact O-N 3.08Å; I157-V160 PolarHBondContact O-N 2.89Å; V160-A164 VanDerWaalsContact O-CB 3.27Å; V160-A164 WeakPolarHBondContact O-CB 3.38Å; V160-A164 PolarHBondContact O-N 3.43Å; V160-I176 HydrophobicContact CG1-CG2 4.1Å |
| 161 | M | 80.7 | Confident | 81.8 | Confident | 4 Ų | 4 | 56.4 Ų | 56.4 | 2% | 0.02 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -65 | -44.2 | 176.5 | -74.1 | -64.2 | -55 | 0 | 0 | 111.6 | A38 A39 I157 A164 A165 W170 G173 M174 | A38-M161 HydrophobicContact CB-CB 3.95Å; A38-M161 HydrophobicContact CB-CG 3.9Å; A39-M161 HydrophobicContact CB-CE 3.75Å; I157-M161 HydrophobicContact CD1-CG 3.56Å; I157-M161 HydrophobicContact CD1-SD 4.13Å; I157-M161 HydrophobicContact CG1-CG 3.75Å; I157-M161 VanDerWaalsContact O-CB 3.29Å; I157-M161 WeakPolarHBondContact O-CB 3.38Å; I157-M161 VanDerWaalsContact O-CG 3.26Å; I157-M161 WeakPolarHBondContact O-CG 3.35Å; I157-M161 PolarHBondContact O-N 3.06Å; M161-A164 PolarHBondContact O-N 3.09Å; M161-A165 WeakPolarHBondContact O-CB 3.46Å; M161-A165 PolarHBondContact O-N 3.43Å; M161-W170 HydrophobicContact CE-CB 4.33Å; M161-G173 VanDerWaalsContact SD-CA 3.53Å; M161-M174 HydrophobicContact CE-CG 4.39Å |
| 162 | A | 79.2 | Confident | 82.1 | Confident | 52 Ų | 52 | 56 Ų | 56 | 43% | 0.43 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -63.3 | -45.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | P158 I159 A164 A165 L166 | P158-A162 WeakPolarHBondContact O-CB 3.33Å; P158-A162 PolarHBondContact O-N 2.97Å; I159-A162 PolarHBondContact O-N 2.99Å; A162-A164 PolarHBondContact O-N 3.27Å; A162-A165 PolarHBondContact O-N 3.08Å; A162-L166 VanDerWaalsContact O-CG 3.28Å; A162-L166 WeakPolarHBondContact O-CG 3.43Å; A162-L166 PolarHBondContact O-N 2.92Å |
| 163 | A | 84.8 | Confident | 82.2 | Confident | 50 Ų | 50 | 53.1 Ų | 53.1 | 41% | 0.413 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -62.5 | -42.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | I159 H167 | I159-A163 WeakPolarHBondContact O-CB 3.15Å; I159-A163 PolarHBondContact O-N 3.17Å; A163-H167 PolarHBondContact O-CD2 3.4Å; A163-H167 VanDerWaalsContact O-CD2 3.25Å |
| 164 | A | 83.9 | Confident | 82.4 | Confident | 7 Ų | 7 | 53.1 Ų | 53.1 | 6% | 0.058 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -68.5 | -39.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | V160 M161 A162 H167 Y168 G169 G173 I176 | V160-A164 VanDerWaalsContact O-CB 3.27Å; V160-A164 WeakPolarHBondContact O-CB 3.38Å; V160-A164 PolarHBondContact O-N 3.43Å; M161-A164 PolarHBondContact O-N 3.09Å; A162-A164 PolarHBondContact O-N 3.27Å; A164-H167 PolarHBondContact O-N 3.09Å; A164-Y168 WeakPolarHBondContact O-CA 3.2Å; A164-Y168 PolarHBondContact O-N 3.23Å; A164-G169 PolarHBondContact O-N 3.32Å; A164-G173 VanDerWaalsContact CB-CA 3.44Å; A164-I176 HydrophobicContact CB-CD1 4.02Å |
| 165 | A | 77.6 | Confident | 82.9 | Confident | 30 Ų | 30 | 56 Ų | 56 | 25% | 0.248 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -61.3 | -43.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | E42 M161 A162 H167 G169 | E42-A165 WeakPolarHBondContact OE2-CB 3.46Å; M161-A165 WeakPolarHBondContact O-CB 3.46Å; M161-A165 PolarHBondContact O-N 3.43Å; A162-A165 PolarHBondContact O-N 3.08Å; A165-H167 VanDerWaalsContact C-N 3.25Å; A165-H167 PolarHBondContact O-N 2.91Å; A165-G169 WeakPolarHBondContact O-CA 3.28Å; A165-G169 PolarHBondContact O-N 2.94Å |
| 166 | L | 79.9 | Confident | 83.3 | Confident | 145 Ų | 145 | 56.3 Ų | 56.3 | 76% | 0.759 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -60.8 | -31.2 | 179.7 | -73.2 | 170.2 | 0 | 0 | 0 | 113.6 | A162 | A162-L166 VanDerWaalsContact O-CG 3.28Å; A162-L166 WeakPolarHBondContact O-CG 3.43Å; A162-L166 PolarHBondContact O-N 2.92Å |
| 167 | H | 81.1 | Confident | 83.5 | Confident | 147 Ų | 147 | 52.7 Ų | 52.7 | 68% | 0.681 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -107.1 | -34.5 | -174.2 | -65.5 | -63.2 | 0 | 0 | 0 | 114.4 | A163 A164 A165 | A163-H167 PolarHBondContact O-CD2 3.4Å; A163-H167 VanDerWaalsContact O-CD2 3.25Å; A164-H167 PolarHBondContact O-N 3.09Å; A165-H167 VanDerWaalsContact C-N 3.25Å; A165-H167 PolarHBondContact O-N 2.91Å |
| 168 | Y | 81.7 | Confident | 83.9 | Confident | 188 Ų | 188 | 52.7 Ų | 52.7 | 74% | 0.737 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -137.6 | 1.2 | -168.4 | -59.1 | -75.1 | 0 | 0 | 0 | 113.8 | A164 A172 | A164-Y168 WeakPolarHBondContact O-CA 3.2Å; A164-Y168 PolarHBondContact O-N 3.23Å; Y168-A172 HydrophobicContact CG-CB 4.37Å |
| 169 | G | 81.5 | Confident | 84.5 | Confident | 19 Ų | 19 | 52.9 Ų | 52.9 | 20% | 0.196 | 29% | 0.285 | C | S | . | . | trans | 78.6 | 166.6 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | E42 A164 A165 R171 A172 G173 | E42-G169 WeakPolarHBondContact OE1-CA 3.26Å; A164-G169 PolarHBondContact O-N 3.32Å; A165-G169 WeakPolarHBondContact O-CA 3.28Å; A165-G169 PolarHBondContact O-N 2.94Å; G169-R171 PolarHBondContact O-N 3.3Å; G169-R171 VanDerWaalsContact O-N 3.08Å; G169-A172 PolarHBondContact O-N 2.92Å; G169-A172 VanDerWaalsContact O-N 3.11Å; G169-G173 PolarHBondContact O-N 3.49Å | ||
| 170 | W | 80.5 | Confident | 84.8 | Confident | 3 Ų | 3 | 50.9 Ų | 50.9 | 1% | 0.011 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -55.5 | -30.7 | -176.2 | 63.9 | -87.7 | 0 | 0 | 0 | 114.1 | A39 E42 I43 F108 M161 A172 G173 M174 | A39-W170 HydrophobicContact CB-CB 4.13Å; A39-W170 HydrophobicContact CB-CE3 4.38Å; E42-W170 HydrophobicContact CB-CB 4.23Å; E42-W170 HydrophobicContact CB-CG 4.44Å; E42-W170 HydrophobicContact CG-CB 4.32Å; E42-W170 HydrophobicContact CG-CG 4.38Å; E42-W170 VanDerWaalsContact OE1-CD1 3.25Å; E42-W170 PolarHBondContact OE1-N 2.9Å; E42-W170 VanDerWaalsContact OE2-CB 3.25Å; E42-W170 WeakPolarHBondContact OE2-CB 3.47Å; E42-W170 PolarHBondContact OE2-N 3.05Å; I43-W170 HydrophobicContact CD1-CE3 4.32Å; I43-W170 HydrophobicContact CD1-CZ3 4.38Å; I43-W170 HydrophobicContact CG1-CD2 4.02Å; I43-W170 HydrophobicContact CG1-CE3 4.25Å; I43-W170 HydrophobicContact CG1-CG 4.49Å; I43-W170 HydrophobicContact CG1-CZ2 4.26Å; F108-W170 AromaticContact CE1-CH2 4Å; F108-W170 HydrophobicContact CE1-CH2 4Å; F108-W170 HydrophobicContact CE1-CZ3 4.36Å; F108-W170 AromaticContact CZ-CH2 3.78Å; F108-W170 HydrophobicContact CZ-CH2 3.78Å; F108-W170 HydrophobicContact CZ-CZ2 4.48Å; M161-W170 HydrophobicContact CE-CB 4.33Å; W170-A172 VanDerWaalsContact C-N 3.34Å; W170-A172 PolarHBondContact O-N 2.81Å; W170-G173 PolarHBondContact O-N 3.22Å; W170-M174 HydrophobicContact CE3-CG 4.09Å; W170-M174 HydrophobicContact CZ3-CG 4.37Å; W170-M174 PolarHBondContact O-N 3.32Å |
| 171 | R | 84.8 | Confident | 85.2 | Confident | 89 Ų | 89 | 49.3 Ų | 49.3 | 34% | 0.336 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -61.6 | -42.6 | 179.7 | -67.8 | -174.9 | 158.8 | 84.5 | 6.4 | 112 | G100 T103 G169 G173 M174 M175 | G100-R171 WeakPolarHBondContact O-CD 3.38Å; G100-R171 VanDerWaalsContact O-CG 3.24Å; G100-R171 WeakPolarHBondContact O-CG 3.47Å; G100-R171 PolarHBondContact O-NE 3.22Å; G100-R171 VanDerWaalsContact O-NE 3.1Å; T103-R171 VanDerWaalsContact CG2-NH2 3.27Å; G169-R171 PolarHBondContact O-N 3.3Å; G169-R171 VanDerWaalsContact O-N 3.08Å; R171-G173 VanDerWaalsContact C-N 3.33Å; R171-M174 PolarHBondContact O-N 3.2Å; R171-M175 PolarHBondContact O-N 2.58Å |
| 172 | A | 85.9 | Confident | 85.8 | Confident | 18 Ų | 18 | 51 Ų | 51 | 15% | 0.149 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -66.2 | -39.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | Y168 G169 W170 M174 M175 I176 | Y168-A172 HydrophobicContact CG-CB 4.37Å; G169-A172 PolarHBondContact O-N 2.92Å; G169-A172 VanDerWaalsContact O-N 3.11Å; W170-A172 VanDerWaalsContact C-N 3.34Å; W170-A172 PolarHBondContact O-N 2.81Å; A172-M174 PolarHBondContact O-N 3.44Å; A172-M175 PolarHBondContact O-N 2.86Å; A172-I176 VanDerWaalsContact O-CG1 3.25Å; A172-I176 WeakPolarHBondContact O-CG1 3.27Å; A172-I176 PolarHBondContact O-N 3.05Å |
| 173 | G | 85.4 | Confident | 86.4 | Confident | 0 Ų | 0 | 53.3 Ų | 53.3 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -58.5 | -45.1 | 175 | 0 | 0 | 0 | 0 | 0 | 112.8 | M161 A164 G169 W170 R171 M175 I176 A177 | M161-G173 VanDerWaalsContact SD-CA 3.53Å; A164-G173 VanDerWaalsContact CB-CA 3.44Å; G169-G173 PolarHBondContact O-N 3.49Å; W170-G173 PolarHBondContact O-N 3.22Å; R171-G173 VanDerWaalsContact C-N 3.33Å; G173-M175 PolarHBondContact O-N 2.8Å; G173-I176 PolarHBondContact O-N 2.89Å; G173-A177 WeakPolarHBondContact O-CB 3.42Å; G173-A177 PolarHBondContact O-N 3.4Å |
| 174 | M | 86.9 | Confident | 86.7 | Confident | 1 Ų | 1 | 51.9 Ų | 51.9 | 1% | 0.005 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -61.8 | -41.8 | 174.6 | -72.1 | -67 | -167.6 | 0 | 0 | 112.7 | S35 F36 A39 M161 W170 R171 A172 A177 G178 | S35-M174 VanDerWaalsContact C-CE 3.47Å; S35-M174 WeakPolarHBondContact O-CE 3.39Å; F36-M174 HydrophobicContact CB-CE 4.01Å; F36-M174 HydrophobicContact CD2-CE 4.21Å; A39-M174 HydrophobicContact CB-CE 3.59Å; M161-M174 HydrophobicContact CE-CG 4.39Å; W170-M174 HydrophobicContact CE3-CG 4.09Å; W170-M174 HydrophobicContact CZ3-CG 4.37Å; W170-M174 PolarHBondContact O-N 3.32Å; R171-M174 PolarHBondContact O-N 3.2Å; A172-M174 PolarHBondContact O-N 3.44Å; M174-A177 PolarHBondContact O-N 2.91Å; M174-G178 PolarHBondContact O-N 3.25Å |
| 175 | M | 89 | Confident | 87 | Confident | 80 Ų | 80 | 51.6 Ų | 51.6 | 39% | 0.394 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -67.8 | -41.4 | 179 | -169.9 | 156.1 | 65.5 | 0 | 0 | 111.8 | I97 F101 R171 A172 G173 A177 G178 C179 | I97-M175 HydrophobicContact CG1-CG 4.26Å; I97-M175 HydrophobicContact CG2-CG 4.27Å; I97-M175 HydrophobicContact CG2-SD 4.31Å; F101-M175 HydrophobicContact CE2-SD 4.2Å; F101-M175 HydrophobicContact CZ-SD 4.19Å; R171-M175 PolarHBondContact O-N 2.58Å; A172-M175 PolarHBondContact O-N 2.86Å; G173-M175 PolarHBondContact O-N 2.8Å; M175-A177 VanDerWaalsContact C-N 3.34Å; M175-A177 PolarHBondContact O-N 3.2Å; M175-G178 PolarHBondContact O-N 2.95Å; M175-C179 WeakPolarHBondContact O-CB 3.46Å; M175-C179 PolarHBondContact O-N 3.35Å; M175-C179 PolarHBondContact O-SG 3.26Å |
| 176 | I | 89.9 | Confident | 87.7 | Confident | 70 Ų | 70 | 54.9 Ų | 54.9 | 36% | 0.359 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -59.9 | -46.4 | 173.7 | -69.2 | 163.8 | 0 | 0 | 0 | 110.1 | V160 A164 A172 G173 G178 C179 M180 | V160-I176 HydrophobicContact CG1-CG2 4.1Å; A164-I176 HydrophobicContact CB-CD1 4.02Å; A172-I176 VanDerWaalsContact O-CG1 3.25Å; A172-I176 WeakPolarHBondContact O-CG1 3.27Å; A172-I176 PolarHBondContact O-N 3.05Å; G173-I176 PolarHBondContact O-N 2.89Å; I176-G178 VanDerWaalsContact C-N 3.32Å; I176-G178 PolarHBondContact O-N 3.48Å; I176-C179 PolarHBondContact O-N 3.04Å; I176-M180 HydrophobicContact CG2-SD 4.21Å; I176-M180 WeakPolarHBondContact O-CG 3.28Å; I176-M180 PolarHBondContact O-N 2.83Å |
| 177 | A | 88.5 | Confident | 88.2 | Confident | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.9 | -41.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | F31 I157 G173 M174 M175 A181 | F31-A177 HydrophobicContact CD1-CB 3.81Å; F31-A177 HydrophobicContact CE1-CB 3.49Å; F31-A177 VanDerWaalsContact CE1-CB 3.49Å; I157-A177 HydrophobicContact CD1-CB 4.02Å; G173-A177 WeakPolarHBondContact O-CB 3.42Å; G173-A177 PolarHBondContact O-N 3.4Å; M174-A177 PolarHBondContact O-N 2.91Å; M175-A177 VanDerWaalsContact C-N 3.34Å; M175-A177 PolarHBondContact O-N 3.2Å; A177-A181 WeakPolarHBondContact O-CB 3.27Å; A177-A181 PolarHBondContact O-N 2.95Å |
| 178 | G | 91.3 | Very high | 88.5 | Confident | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63.9 | -45.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | G93 M174 M175 I176 M180 A181 I182 | G93-G178 WeakPolarHBondContact CA-O 3.29Å; G93-G178 VanDerWaalsContact O-CA 3.29Å; G93-G178 WeakPolarHBondContact O-CA 3.26Å; M174-G178 PolarHBondContact O-N 3.25Å; M175-G178 PolarHBondContact O-N 2.95Å; I176-G178 VanDerWaalsContact C-N 3.32Å; I176-G178 PolarHBondContact O-N 3.48Å; G178-M180 PolarHBondContact O-N 3.33Å; G178-A181 PolarHBondContact O-N 2.9Å; G178-I182 WeakPolarHBondContact O-CG1 3.12Å; G178-I182 PolarHBondContact O-N 3.46Å |
| 179 | C | 92.8 | Very high | 88.7 | Confident | 62 Ų | 62 | 37.2 Ų | 37.2 | 42% | 0.419 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -60.9 | -45.3 | 176.9 | -72.9 | 0 | 0 | 0 | 0 | 112 | M175 I176 A181 I182 V183 | M175-C179 WeakPolarHBondContact O-CB 3.46Å; M175-C179 PolarHBondContact O-N 3.35Å; M175-C179 PolarHBondContact O-SG 3.26Å; I176-C179 PolarHBondContact O-N 3.04Å; C179-A181 VanDerWaalsContact C-N 3.32Å; C179-A181 PolarHBondContact O-N 3.03Å; C179-I182 PolarHBondContact O-N 3.08Å; C179-V183 WeakPolarHBondContact O-CG2 3.29Å; C179-V183 PolarHBondContact O-N 3.37Å |
| 180 | M | 91.6 | Very high | 88.8 | Confident | 71 Ų | 71 | 45.4 Ų | 45.4 | 35% | 0.35 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -59.2 | -44.6 | 175.6 | -72.7 | -179.9 | 67.9 | 0 | 0 | 111.4 | L28 F31 I176 G178 I182 V183 V184 | L28-M180 VanDerWaalsContact CD1-C 3.48Å; L28-M180 HydrophobicContact CD1-CB 3.86Å; L28-M180 WeakPolarHBondContact CD1-O 3.3Å; F31-M180 HydrophobicContact CE1-SD 4.16Å; F31-M180 HydrophobicContact CZ-SD 4.14Å; I176-M180 HydrophobicContact CG2-SD 4.21Å; I176-M180 WeakPolarHBondContact O-CG 3.28Å; I176-M180 PolarHBondContact O-N 2.83Å; G178-M180 PolarHBondContact O-N 3.33Å; M180-I182 PolarHBondContact O-N 2.78Å; M180-V183 PolarHBondContact O-N 3.2Å; M180-V184 WeakPolarHBondContact O-CB 3.48Å; M180-V184 WeakPolarHBondContact O-CG2 3.47Å; M180-V184 PolarHBondContact O-N 3.23Å |
| 181 | A | 92 | Very high | 88.8 | Confident | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.7 | -40.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | T32 L89 A177 G178 C179 G185 | T32-A181 HydrophobicContact CG2-CB 3.71Å; L89-A181 HydrophobicContact CD1-CB 4.03Å; L89-A181 HydrophobicContact CG-CB 4.15Å; L89-A181 WeakPolarHBondContact CG-O 3.49Å; A177-A181 WeakPolarHBondContact O-CB 3.27Å; A177-A181 PolarHBondContact O-N 2.95Å; G178-A181 PolarHBondContact O-N 2.9Å; C179-A181 VanDerWaalsContact C-N 3.32Å; C179-A181 PolarHBondContact O-N 3.03Å; A181-G185 WeakPolarHBondContact O-CA 3.22Å; A181-G185 PolarHBondContact O-N 2.85Å |
| 182 | I | 92.8 | Very high | 88.5 | Confident | 39 Ų | 39 | 43.3 Ų | 43.3 | 20% | 0.2 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -65.7 | -49.5 | 177.1 | -66.9 | 168.3 | 0 | 0 | 0 | 111.2 | I90 I94 I97 G178 C179 M180 V184 G185 I186 | I90-I182 HydrophobicContact CG2-CG1 4.45Å; I94-I182 HydrophobicContact CG1-CD1 3.98Å; I94-I182 HydrophobicContact CG1-CG1 4.48Å; I97-I182 HydrophobicContact CD1-CD1 3.65Å; G178-I182 WeakPolarHBondContact O-CG1 3.12Å; G178-I182 PolarHBondContact O-N 3.46Å; C179-I182 PolarHBondContact O-N 3.08Å; M180-I182 PolarHBondContact O-N 2.78Å; I182-V184 VanDerWaalsContact C-N 3.32Å; I182-V184 PolarHBondContact O-N 3.35Å; I182-G185 PolarHBondContact O-N 3Å; I182-G185 VanDerWaalsContact O-N 3.14Å; I182-I186 HydrophobicContact CG2-CD1 3.91Å; I182-I186 HydrophobicContact CG2-CG1 4.48Å; I182-I186 WeakPolarHBondContact O-CG1 3.49Å; I182-I186 PolarHBondContact O-N 3.34Å |
| 183 | V | 93.4 | Very high | 88.1 | Confident | 100 Ų | 100 | 46.8 Ų | 46.8 | 61% | 0.606 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -58.7 | -46.9 | -179.7 | 171.7 | 0 | 0 | 0 | 0 | 110.5 | C179 M180 I186 F187 | C179-V183 WeakPolarHBondContact O-CG2 3.29Å; C179-V183 PolarHBondContact O-N 3.37Å; M180-V183 PolarHBondContact O-N 3.2Å; V183-I186 PolarHBondContact O-N 2.93Å; V183-F187 PolarHBondContact O-N 3.26Å |
| 184 | V | 91.1 | Very high | 87.5 | Confident | 21 Ų | 21 | 48 Ų | 48 | 13% | 0.127 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -66.2 | -41.1 | 176.5 | 170.9 | 0 | 0 | 0 | 0 | 111.2 | L24 L28 L89 M180 I182 I186 F187 L188 | L24-V184 HydrophobicContact CD2-CB 4.13Å; L24-V184 HydrophobicContact CD2-CG1 3.25Å; L24-V184 HydrophobicContact CD2-CG2 3.76Å; L24-V184 HydrophobicContact CG-CG1 4.37Å; L28-V184 HydrophobicContact CD1-CB 3.79Å; L28-V184 HydrophobicContact CD1-CG1 4.33Å; L28-V184 HydrophobicContact CD1-CG2 3.47Å; L28-V184 VanDerWaalsContact CD1-CG2 3.47Å; L28-V184 HydrophobicContact CG-CB 4.36Å; L28-V184 HydrophobicContact CG-CG1 4.38Å; L28-V184 HydrophobicContact CG-CG2 4.13Å; L89-V184 HydrophobicContact CD2-CB 4.06Å; L89-V184 HydrophobicContact CD2-CG1 3.63Å; M180-V184 WeakPolarHBondContact O-CB 3.48Å; M180-V184 WeakPolarHBondContact O-CG2 3.47Å; M180-V184 PolarHBondContact O-N 3.23Å; I182-V184 VanDerWaalsContact C-N 3.32Å; I182-V184 PolarHBondContact O-N 3.35Å; V184-I186 VanDerWaalsContact C-N 3.32Å; V184-I186 PolarHBondContact O-N 3.39Å; V184-F187 CarbonylContact O-C 3.56Å; V184-F187 WeakPolarHBondContact O-CA 3.41Å; V184-F187 VanDerWaalsContact O-CB 3.3Å; V184-F187 WeakPolarHBondContact O-CB 3.46Å; V184-F187 PolarHBondContact O-N 3.35Å; V184-L188 HydrophobicContact CG1-CD2 4.36Å; V184-L188 HydrophobicContact CG1-CG 4.18Å; V184-L188 VanDerWaalsContact O-CG 3.31Å; V184-L188 WeakPolarHBondContact O-CG 3.28Å; V184-L188 PolarHBondContact O-N 3.31Å |
| 185 | G | 90.5 | Very high | 87 | Confident | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -60.9 | -39.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | A181 I182 L188 C189 | A181-G185 WeakPolarHBondContact O-CA 3.22Å; A181-G185 PolarHBondContact O-N 2.85Å; I182-G185 PolarHBondContact O-N 3Å; I182-G185 VanDerWaalsContact O-N 3.14Å; G185-L188 WeakPolarHBondContact O-CB 3.33Å; G185-L188 PolarHBondContact O-N 3.18Å; G185-C189 WeakPolarHBondContact O-CB 3.17Å; G185-C189 PolarHBondContact O-N 2.78Å |
| 186 | I | 91.9 | Very high | 85.9 | Confident | 99 Ų | 99 | 47.6 Ų | 47.6 | 51% | 0.508 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -63.6 | -43.9 | 171.1 | -65.5 | 167.1 | 0 | 0 | 0 | 110.2 | I90 I182 V183 V184 L188 C189 W190 | I90-I186 HydrophobicContact CD1-CG1 3.94Å; I90-I186 HydrophobicContact CG1-CG1 4.41Å; I182-I186 HydrophobicContact CG2-CD1 3.91Å; I182-I186 HydrophobicContact CG2-CG1 4.48Å; I182-I186 WeakPolarHBondContact O-CG1 3.49Å; I182-I186 PolarHBondContact O-N 3.34Å; V183-I186 PolarHBondContact O-N 2.93Å; V184-I186 VanDerWaalsContact C-N 3.32Å; V184-I186 PolarHBondContact O-N 3.39Å; I186-L188 PolarHBondContact O-N 3.4Å; I186-C189 CarbonylContact O-C 3.58Å; I186-C189 WeakPolarHBondContact O-CB 3.4Å; I186-C189 PolarHBondContact O-N 2.83Å; I186-W190 PolarHBondContact O-N 3.31Å |
| 187 | F | 90 | Very high | 84.7 | Confident | 85 Ų | 85 | 48.5 Ų | 48.5 | 37% | 0.373 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -61 | -40.8 | 175.3 | 177.3 | -97.3 | 0 | 0 | 0 | 112.5 | T21 V183 V184 W190 R191 | T21-F187 HydrophobicContact CG2-CD1 4.44Å; T21-F187 HydrophobicContact CG2-CE1 4.14Å; V183-F187 PolarHBondContact O-N 3.26Å; V184-F187 CarbonylContact O-C 3.56Å; V184-F187 WeakPolarHBondContact O-CA 3.41Å; V184-F187 VanDerWaalsContact O-CB 3.3Å; V184-F187 WeakPolarHBondContact O-CB 3.46Å; V184-F187 PolarHBondContact O-N 3.35Å; F187-W190 PolarHBondContact O-N 3.17Å; F187-R191 HydrophobicContact CD1-CB 4.49Å; F187-R191 HydrophobicContact CE1-CB 4.09Å; F187-R191 HydrophobicContact CE1-CG 4.24Å; F187-R191 HydrophobicContact CE2-CB 4.35Å; F187-R191 HydrophobicContact CZ-CB 4.02Å; F187-R191 HydrophobicContact CZ-CG 3.96Å; F187-R191 WeakPolarHBondContact O-CB 3.44Å; F187-R191 PolarHBondContact O-N 2.97Å |
| 188 | L | 86.9 | Confident | 83.7 | Confident | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.4 | -47.3 | 172.7 | -60.9 | -175.4 | 0 | 0 | 0 | 110.4 | T21 M85 L89 V184 G185 I186 W190 R191 L192 | T21-L188 HydrophobicContact CG2-CD2 3.33Å; T21-L188 WeakPolarHBondContact O-CD2 2.96Å; M85-L188 HydrophobicContact CE-CD1 4.07Å; M85-L188 HydrophobicContact CG-CD1 3.88Å; M85-L188 HydrophobicContact SD-CD1 4.11Å; L89-L188 HydrophobicContact CB-CD1 4.44Å; L89-L188 HydrophobicContact CD2-CD1 3.73Å; V184-L188 HydrophobicContact CG1-CD2 4.36Å; V184-L188 HydrophobicContact CG1-CG 4.18Å; V184-L188 VanDerWaalsContact O-CG 3.31Å; V184-L188 WeakPolarHBondContact O-CG 3.28Å; V184-L188 PolarHBondContact O-N 3.31Å; G185-L188 WeakPolarHBondContact O-CB 3.33Å; G185-L188 PolarHBondContact O-N 3.18Å; I186-L188 PolarHBondContact O-N 3.4Å; L188-W190 PolarHBondContact O-N 3.03Å; L188-W190 VanDerWaalsContact O-N 3.08Å; L188-R191 PolarHBondContact O-N 3.14Å; L188-L192 WeakPolarHBondContact O-CB 3.21Å; L188-L192 PolarHBondContact O-N 3.42Å |
| 189 | C | 85.7 | Confident | 82.6 | Confident | 24 Ų | 24 | 53.8 Ų | 53.8 | 16% | 0.162 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -60 | -16.6 | 175.1 | -81.2 | 0 | 0 | 0 | 0 | 113.3 | R82 G86 G185 I186 | R82-C189 PolarHBondContact NE-O 3.38Å; R82-C189 PolarHBondContact NH2-O 3.26Å; G86-C189 VanDerWaalsContact CA-SG 3.59Å; G185-C189 WeakPolarHBondContact O-CB 3.17Å; G185-C189 PolarHBondContact O-N 2.78Å; I186-C189 CarbonylContact O-C 3.58Å; I186-C189 WeakPolarHBondContact O-CB 3.4Å; I186-C189 PolarHBondContact O-N 2.83Å |
| 190 | W | 84.1 | Confident | 81.6 | Confident | 191 Ų | 191 | 53.2 Ų | 53.2 | 72% | 0.723 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -99.4 | -41.6 | 174.7 | -174 | 52.7 | 0 | 0 | 0 | 113 | I186 F187 L188 | I186-W190 PolarHBondContact O-N 3.31Å; F187-W190 PolarHBondContact O-N 3.17Å; L188-W190 PolarHBondContact O-N 3.03Å; L188-W190 VanDerWaalsContact O-N 3.08Å |
| 191 | R | 80.4 | Confident | 80.6 | Confident | 49 Ų | 49 | 50.1 Ų | 50.1 | 19% | 0.185 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -92.7 | -32.3 | -168.3 | -168.3 | 62.5 | 174.2 | 178.9 | 2.4 | 114.2 | Y13 H17 T21 F187 L188 | Y13-R191 VanDerWaalsContact CZ-NH2 3.31Å; Y13-R191 PolarHBondContact OH-NH2 3.11Å; H17-R191 PolarHBondContact CD2-NH2 3.07Å; H17-R191 PolarHBondContact NE2-NH2 3.26Å; H17-R191 VanDerWaalsContact NE2-NH2 3.11Å; T21-R191 HydrophobicContact CG2-CB 4.09Å; T21-R191 HydrophobicContact CG2-CG 4.26Å; T21-R191 WeakPolarHBondContact OG1-CG 3.3Å; F187-R191 HydrophobicContact CD1-CB 4.49Å; F187-R191 HydrophobicContact CE1-CB 4.09Å; F187-R191 HydrophobicContact CE1-CG 4.24Å; F187-R191 HydrophobicContact CE2-CB 4.35Å; F187-R191 HydrophobicContact CZ-CB 4.02Å; F187-R191 HydrophobicContact CZ-CG 3.96Å; F187-R191 WeakPolarHBondContact O-CB 3.44Å; F187-R191 PolarHBondContact O-N 2.97Å; L188-R191 PolarHBondContact O-N 3.14Å |
| 192 | L | 79.4 | Confident | 79.6 | Confident | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 27% | 0.27 | C | S | . | . | trans | -69.5 | 138.5 | -174.8 | -143.1 | 80.6 | 0 | 0 | 0 | 110.1 | T21 I22 R82 M85 L129 L188 | T21-L192 HydrophobicContact CG2-CD1 3.45Å; T21-L192 VanDerWaalsContact CG2-CD1 3.45Å; I22-L192 HydrophobicContact CG1-CD1 3.91Å; R82-L192 HydrophobicContact CB-CB 4.18Å; R82-L192 WeakPolarHBondContact CD-O 3.45Å; R82-L192 HydrophobicContact CG-CB 4.11Å; R82-L192 WeakPolarHBondContact CG-O 3.3Å; M85-L192 HydrophobicContact CB-CD2 4.26Å; M85-L192 HydrophobicContact SD-CD2 4.11Å; L129-L192 HydrophobicContact CD1-CD1 4.32Å; L129-L192 HydrophobicContact CD1-CD2 3.47Å; L129-L192 VanDerWaalsContact CD1-CD2 3.47Å; L129-L192 HydrophobicContact CD1-CG 4.01Å; L188-L192 WeakPolarHBondContact O-CB 3.21Å; L188-L192 PolarHBondContact O-N 3.42Å | ||
| 193 | R | 76.6 | Confident | 78.7 | Confident | 90 Ų | 90 | 50.3 Ų | 50.3 | 34% | 0.34 | 26% | 0.262 | S | S | . | . | trans | -126.7 | 128.4 | 176.2 | -68.8 | -176.1 | 166.1 | -170.8 | 1.5 | 108.5 | W14 I18 W133 L199 | W14-R193 HydrophobicContact CE3-CG 4.38Å; W14-R193 VanDerWaalsContact CZ3-CD 3.44Å; W14-R193 HydrophobicContact CZ3-CG 4.06Å; I18-R193 HydrophobicContact CD1-CB 4.5Å; W133-R193 HydrophobicContact CZ2-CB 4.18Å; W133-R193 PolarHBondContact NE1-O 3.47Å; R193-L199 VanDerWaalsContact CZ-CD2 3.43Å | ||
| 194 | D | 73.7 | Confident | 77.5 | Confident | 26 Ų | 26 | 45.7 Ų | 45.7 | 14% | 0.139 | 23% | 0.234 | C | C | . | . | S | Bend | trans | -63.8 | -59.3 | -169.5 | -168.9 | -2.3 | 0 | 0 | 0 | 111.6 | A81 R128 L129 W133 | A81-D194 HydrophobicContact CB-CB 4.44Å; A81-D194 WeakPolarHBondContact CB-OD1 3.41Å; R128-D194 IonicContact CZ-OD1 2.68Å; R128-D194 IonicContact CZ-OD2 3.54Å; R128-D194 IonicContact NE-OD1 3.71Å; R128-D194 IonicContact NH2-OD1 3.99Å; R128-D194 PolarHBondContact NH2-OD1 2.77Å; R128-D194 IonicContact NH2-OD2 3.52Å; R128-D194 PolarHBondContact NH2-OD2 3.04Å; L129-D194 WeakPolarHBondContact CD2-O 3.49Å; W133-D194 PolarHBondContact NE1-O 2.85Å; W133-D194 VanDerWaalsContact NE1-O 3.1Å |
| 195 | R | 75.3 | Confident | 76 | Confident | 73 Ų | 73 | 44.7 Ų | 44.7 | 28% | 0.275 | 23% | 0.228 | S | C | . | . | trans | -131.2 | 143.8 | -171.4 | -74.8 | -178.9 | 179.8 | 168.9 | -5.9 | 110.9 | Q197 A198 E363 | R195-Q197 PolarHBondContact O-N 3.31Å; R195-A198 VanDerWaalsContact O-CB 3.3Å; R195-A198 WeakPolarHBondContact O-CB 3.47Å; R195-A198 PolarHBondContact O-N 2.83Å; R195-E363 IonicContact NH1-OE1 3.09Å; R195-E363 IonicContact NH2-OE1 2.86Å; R195-E363 PolarHBondContact NH2-OE1 3.07Å | ||
| 196 | P | 66.7 | Low | 74.5 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 25% | 0.252 | C | S | . | . | G | 310 helix | trans | -57.5 | -33.9 | 172.9 | 21.8 | -30.4 | 0 | 0 | 0 | 111.5 | Y11 W133 A198 L199 L201 V204 | Y11-P196 HydrophobicContact CE1-CB 4.07Å; W133-P196 HydrophobicContact CE3-CB 4.25Å; W133-P196 HydrophobicContact CH2-CB 3.99Å; W133-P196 HydrophobicContact CZ2-CB 4.31Å; W133-P196 HydrophobicContact CZ3-CB 3.94Å; P196-A198 PolarHBondContact O-N 3.06Å; P196-L199 WeakPolarHBondContact O-CA 3.25Å; P196-L199 WeakPolarHBondContact O-CB 3.27Å; P196-L199 PolarHBondContact O-N 3.5Å; P196-L201 HydrophobicContact CB-CB 3.91Å; P196-L201 HydrophobicContact CB-CD1 4.35Å; P196-L201 WeakPolarHBondContact O-CB 3.16Å; P196-L201 PolarHBondContact O-N 3.47Å; P196-L201 VanDerWaalsContact O-N 3.13Å; P196-V204 HydrophobicContact CG-CG2 4.37Å |
| 197 | Q | 63.6 | Low | 73 | Confident | 89 Ų | 89 | 47.9 Ų | 47.9 | 42% | 0.416 | 24% | 0.239 | S | C | . | . | G | 310 helix | trans | -61.4 | -30.4 | 176.2 | -61.1 | 85.5 | -5.4 | 0 | 0 | 113.1 | R195 L199 G200 L201 | R195-Q197 PolarHBondContact O-N 3.31Å; Q197-L199 PolarHBondContact O-N 2.98Å; Q197-L199 VanDerWaalsContact O-N 3.12Å; Q197-G200 PolarHBondContact O-N 3.3Å; Q197-L201 WeakPolarHBondContact CA-O 3.34Å |
| 198 | A | 67.7 | Low | 71.8 | Confident | 77 Ų | 77 | 48.6 Ų | 48.6 | 64% | 0.636 | 24% | 0.239 | S | C | * | . | G | 310 helix | trans | -65.5 | -13.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | R195 P196 | R195-A198 VanDerWaalsContact O-CB 3.3Å; R195-A198 WeakPolarHBondContact O-CB 3.47Å; R195-A198 PolarHBondContact O-N 2.83Å; P196-A198 PolarHBondContact O-N 3.06Å |
| 199 | L | 69.6 | Low | 70.6 | Confident | 33 Ų | 33 | 56 Ų | 56 | 17% | 0.173 | 27% | 0.273 | C | S | . | . | G | 310 helix | trans | -103.9 | 6 | 175.4 | -58.2 | -173.9 | 0 | 0 | 0 | 114.1 | M1 W14 W133 R193 P196 Q197 L201 | M1-L199 WeakPolarHBondContact CE-O 3.46Å; W14-L199 HydrophobicContact CD2-CD1 3.96Å; W14-L199 HydrophobicContact CG-CD1 3.89Å; W133-L199 HydrophobicContact CH2-CD1 3.84Å; R193-L199 VanDerWaalsContact CZ-CD2 3.43Å; P196-L199 WeakPolarHBondContact O-CA 3.25Å; P196-L199 WeakPolarHBondContact O-CB 3.27Å; P196-L199 PolarHBondContact O-N 3.5Å; Q197-L199 PolarHBondContact O-N 2.98Å; Q197-L199 VanDerWaalsContact O-N 3.12Å; L199-L201 HydrophobicContact CB-CD1 4.27Å; L199-L201 HydrophobicContact CB-CG 4.17Å; L199-L201 HydrophobicContact CD1-CD1 4.26Å; L199-L201 PolarHBondContact O-N 3.22Å |
| 200 | G | 70 | Confident | 69.5 | Low | 51 Ų | 51 | 55.7 Ų | 55.7 | 53% | 0.526 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 67.2 | 17.6 | -170.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q197 | Q197-G200 PolarHBondContact O-N 3.3Š|
| 201 | L | 72 | Confident | 68.3 | Low | 6 Ų | 6 | 50.2 Ų | 50.2 | 3% | 0.031 | 27% | 0.265 | C | S | . | . | trans | -81.7 | 148.5 | 168.7 | -63 | 170.9 | 0 | 0 | 0 | 109.1 | I7 R10 Y11 W133 P196 Q197 L199 | I7-L201 HydrophobicContact CG2-CD2 4.2Å; R10-L201 HydrophobicContact CB-CD2 4.05Å; Y11-L201 HydrophobicContact CD1-CD1 4.44Å; Y11-L201 HydrophobicContact CD2-CD1 4.29Å; Y11-L201 HydrophobicContact CD2-CD2 4.1Å; Y11-L201 HydrophobicContact CE1-CD1 4.4Å; Y11-L201 HydrophobicContact CE2-CB 3.85Å; Y11-L201 HydrophobicContact CE2-CD1 4.26Å; Y11-L201 HydrophobicContact CE2-CD2 4.07Å; Y11-L201 HydrophobicContact CE2-CG 4.29Å; Y11-L201 HydrophobicContact CG-CD1 4.4Å; W133-L201 HydrophobicContact CH2-CD1 4.43Å; W133-L201 HydrophobicContact CZ3-CD1 4.21Å; P196-L201 HydrophobicContact CB-CB 3.91Å; P196-L201 HydrophobicContact CB-CD1 4.35Å; P196-L201 WeakPolarHBondContact O-CB 3.16Å; P196-L201 PolarHBondContact O-N 3.47Å; P196-L201 VanDerWaalsContact O-N 3.13Å; Q197-L201 WeakPolarHBondContact CA-O 3.34Å; L199-L201 HydrophobicContact CB-CD1 4.27Å; L199-L201 HydrophobicContact CB-CG 4.17Å; L199-L201 HydrophobicContact CD1-CD1 4.26Å; L199-L201 PolarHBondContact O-N 3.22Å | ||
| 202 | P | 70.8 | Confident | 67.3 | Low | 37 Ų | 37 | 51.6 Ų | 51.6 | 24% | 0.24 | 28% | 0.276 | C | S | . | . | trans | -60.2 | -179.4 | 174.2 | 24.7 | -33.7 | 0 | 0 | 0 | 112 | I7 Y11 E206 W207 | I7-P202 HydrophobicContact CG2-CG 4.18Å; Y11-P202 HydrophobicContact CE2-CG 3.98Å; Y11-P202 VanDerWaalsContact OH-C 3.32Å; Y11-P202 PolarHBondContact OH-O 2.89Å; P202-E206 HydrophobicContact CB-CB 4.26Å; P202-E206 WeakPolarHBondContact CB-OE2 3.5Å; P202-W207 HydrophobicContact CG-CB 4.23Å | ||
| 203 | A | 72.6 | Confident | 66.5 | Low | 6 Ų | 6 | 51.6 Ų | 51.6 | 5% | 0.05 | 28% | 0.276 | C | S | . | . | trans | -76.6 | 152 | 169.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | G205 E206 W207 | A203-G205 PolarHBondContact O-N 3.08Å; A203-E206 HydrophobicContact CB-CG 4.29Å; A203-E206 PolarHBondContact N-OE2 3.12Å; A203-E206 VanDerWaalsContact N-OE2 3.13Å; A203-E206 WeakPolarHBondContact O-CB 3.36Å; A203-E206 PolarHBondContact O-N 3.2Å; A203-W207 PolarHBondContact O-N 2.88Å | ||
| 204 | V | 69.5 | Low | 65.6 | Low | 2 Ų | 2 | 49.7 Ų | 49.7 | 1% | 0.012 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -59.2 | -32.9 | 179.8 | 178.5 | 0 | 0 | 0 | 0 | 112.2 | Y11 A132 P196 R208 | Y11-V204 HydrophobicContact CE1-CG2 4.08Å; A132-V204 WeakPolarHBondContact O-CG2 3.21Å; P196-V204 HydrophobicContact CG-CG2 4.37Å; V204-R208 WeakPolarHBondContact O-CB 3.42Å; V204-R208 PolarHBondContact O-N 2.97Å |
| 205 | G | 60 | Low | 64.9 | Low | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63 | -41.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | A203 H209 D210 | A203-G205 PolarHBondContact O-N 3.08Å; G205-H209 CarbonylContact O-C 3.53Å; G205-H209 VanDerWaalsContact O-CA 3.24Å; G205-H209 WeakPolarHBondContact O-CA 3.37Å; G205-H209 PolarHBondContact O-N 3.09Å; G205-D210 PolarHBondContact O-N 3.04Å |
| 206 | E | 58.1 | Low | 64.3 | Low | 108 Ų | 108 | 47.1 Ų | 47.1 | 51% | 0.505 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -71.9 | -39.8 | 177.2 | -64 | 174.6 | 158.6 | 0 | 0 | 112.1 | P202 A203 H209 | P202-E206 HydrophobicContact CB-CB 4.26Å; P202-E206 WeakPolarHBondContact CB-OE2 3.5Å; A203-E206 HydrophobicContact CB-CG 4.29Å; A203-E206 PolarHBondContact N-OE2 3.12Å; A203-E206 VanDerWaalsContact N-OE2 3.13Å; A203-E206 WeakPolarHBondContact O-CB 3.36Å; A203-E206 PolarHBondContact O-N 3.2Å; E206-H209 PolarHBondContact O-CE1 3.47Å; E206-H209 VanDerWaalsContact O-CE1 3.28Å; E206-H209 PolarHBondContact O-ND1 3.33Å; E206-H209 VanDerWaalsContact O-ND1 3.13Å |
| 207 | W | 59.8 | Low | 64 | Low | 59 Ų | 59 | 49.7 Ų | 49.7 | 22% | 0.223 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -65.6 | -40.6 | 179.7 | 177.5 | 68.6 | 0 | 0 | 0 | 112.6 | D8 Y11 P202 A203 | D8-W207 PolarHBondContact OD1-NE1 2.93Å; Y11-W207 AromaticContact CD2-CD1 3.66Å; Y11-W207 HydrophobicContact CD2-CD2 4.02Å; Y11-W207 AromaticContact CD2-CE2 3.95Å; Y11-W207 AromaticContact CD2-CG 3.83Å; Y11-W207 HydrophobicContact CD2-CG 3.83Å; Y11-W207 AromaticContact CD2-NE1 3.71Å; Y11-W207 HydrophobicContact CE2-CB 3.93Å; Y11-W207 AromaticContact CE2-CD1 3.66Å; Y11-W207 HydrophobicContact CE2-CD2 4.18Å; Y11-W207 AromaticContact CE2-CG 3.61Å; Y11-W207 HydrophobicContact CE2-CG 3.61Å; Y11-W207 HydrophobicContact CG-CD2 4.18Å; Y11-W207 HydrophobicContact CG-CG 4.44Å; P202-W207 HydrophobicContact CG-CB 4.23Å; A203-W207 PolarHBondContact O-N 2.88Å |
| 208 | R | 65.6 | Low | 63.7 | Low | 99 Ų | 99 | 51.9 Ų | 51.9 | 37% | 0.374 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -96.1 | -4.5 | -178.9 | -147.7 | -171.8 | -172.6 | -171.8 | -1.7 | 113.8 | S135 T137 E138 V204 D210 | S135-R208 PolarHBondContact OG-NH1 3.13Å; T137-R208 PolarHBondContact OG1-NH1 3.16Å; E138-R208 VanDerWaalsContact CG-NH1 3.31Å; E138-R208 IonicContact OE1-NH1 2.9Å; E138-R208 IonicContact OE2-CZ 3.84Å; E138-R208 IonicContact OE2-NH2 3.96Å; V204-R208 WeakPolarHBondContact O-CB 3.42Å; V204-R208 PolarHBondContact O-N 2.97Å; R208-D210 VanDerWaalsContact C-N 3.29Å; R208-D210 PolarHBondContact O-N 2.63Å |
| 209 | H | 62.3 | Low | 63.3 | Low | 156 Ų | 156 | 53.1 Ų | 53.1 | 72% | 0.722 | 29% | 0.285 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.1 | 41.5 | -171.8 | -54.8 | -53 | 0 | 0 | 0 | 113.5 | G205 E206 A211 | G205-H209 CarbonylContact O-C 3.53Å; G205-H209 VanDerWaalsContact O-CA 3.24Å; G205-H209 WeakPolarHBondContact O-CA 3.37Å; G205-H209 PolarHBondContact O-N 3.09Å; E206-H209 PolarHBondContact O-CE1 3.47Å; E206-H209 VanDerWaalsContact O-CE1 3.28Å; E206-H209 PolarHBondContact O-ND1 3.33Å; E206-H209 VanDerWaalsContact O-ND1 3.13Å; H209-A211 PolarHBondContact O-N 2.87Å |
| 210 | D | 60.9 | Low | 62.7 | Low | 18 Ų | 18 | 52 Ų | 52 | 10% | 0.096 | 28% | 0.28 | C | S | . | . | trans | -89.2 | 106.5 | -179.2 | -174.5 | -9.7 | 0 | 0 | 0 | 110.6 | S135 G205 R208 L212 E213 I214 | S135-D210 WeakPolarHBondContact CB-OD2 3.39Å; S135-D210 PolarHBondContact OG-OD2 3.2Å; G205-D210 PolarHBondContact O-N 3.04Å; R208-D210 VanDerWaalsContact C-N 3.29Å; R208-D210 PolarHBondContact O-N 2.63Å; D210-L212 VanDerWaalsContact C-N 3.3Å; D210-L212 PolarHBondContact O-N 3.44Å; D210-L212 PolarHBondContact OD1-N 3.26Å; D210-E213 HydrophobicContact CB-CB 3.84Å; D210-E213 PolarHBondContact O-N 2.85Å; D210-E213 VanDerWaalsContact O-N 3.16Å; D210-I214 WeakPolarHBondContact O-CG1 3.13Å; D210-I214 PolarHBondContact O-N 3.34Å | ||
| 211 | A | 59.7 | Low | 62.1 | Low | 75 Ų | 75 | 53.5 Ų | 53.5 | 62% | 0.62 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -59.4 | -37.1 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | H209 E213 I214 A215 | H209-A211 PolarHBondContact O-N 2.87Å; A211-E213 VanDerWaalsContact C-N 3.31Å; A211-E213 PolarHBondContact O-N 3.41Å; A211-I214 PolarHBondContact O-N 2.77Å; A211-A215 WeakPolarHBondContact O-CB 3.33Å; A211-A215 PolarHBondContact O-N 3.41Å |
| 212 | L | 59.9 | Low | 61.5 | Low | 78 Ų | 78 | 57.2 Ų | 57.2 | 41% | 0.408 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -68.5 | -34.7 | 179.1 | -67 | 173.5 | 0 | 0 | 0 | 111.7 | D210 Q216 | D210-L212 VanDerWaalsContact C-N 3.3Å; D210-L212 PolarHBondContact O-N 3.44Å; D210-L212 PolarHBondContact OD1-N 3.26Å; L212-Q216 PolarHBondContact O-N 2.81Å; L212-Q216 VanDerWaalsContact O-N 3.16Å |
| 213 | E | 61.3 | Low | 61.3 | Low | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -76.3 | -31.5 | 179.5 | -170.8 | 67.5 | -169.1 | 0 | 0 | 111.9 | R136 R139 D210 A211 Q217 K362 | R136-E213 WeakPolarHBondContact CG-OE2 3.5Å; R139-E213 IonicContact CZ-OE2 2.82Å; R139-E213 IonicContact NH2-OE1 2.63Å; R139-E213 PolarHBondContact NH2-OE1 3.33Å; R139-E213 IonicContact NH2-OE2 3.24Å; R139-E213 PolarHBondContact NH2-OE2 2.98Å; D210-E213 HydrophobicContact CB-CB 3.84Å; D210-E213 PolarHBondContact O-N 2.85Å; D210-E213 VanDerWaalsContact O-N 3.16Å; A211-E213 VanDerWaalsContact C-N 3.31Å; A211-E213 PolarHBondContact O-N 3.41Å; E213-Q217 WeakPolarHBondContact O-CG 3.25Å; E213-Q217 PolarHBondContact O-N 3.09Å; E213-K362 VanDerWaalsContact CG-NZ 3.28Å; E213-K362 WeakPolarHBondContact O-CE 3.14Å; E213-K362 PolarHBondContact O-NZ 3.17Å; E213-K362 VanDerWaalsContact O-NZ 3.15Å; E213-K362 WeakPolarHBondContact OE1-CE 3.34Å; E213-K362 IonicContact OE1-NZ 2.74Å; E213-K362 PolarHBondContact OE1-NZ 3.35Å |
| 214 | I | 58.5 | Low | 61.3 | Low | 51 Ų | 51 | 61.4 Ų | 61.4 | 26% | 0.262 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -71.4 | -45.7 | 172.3 | -66 | 166.7 | 0 | 0 | 0 | 110.2 | D210 A211 Q216 Q217 Q218 | D210-I214 WeakPolarHBondContact O-CG1 3.13Å; D210-I214 PolarHBondContact O-N 3.34Å; A211-I214 PolarHBondContact O-N 2.77Å; I214-Q216 VanDerWaalsContact C-N 3.29Å; I214-Q216 PolarHBondContact O-N 3.25Å; I214-Q217 WeakPolarHBondContact O-CB 3.13Å; I214-Q217 PolarHBondContact O-N 3.27Å; I214-Q218 PolarHBondContact O-N 2.8Å; I214-Q218 VanDerWaalsContact O-N 3.12Å |
| 215 | A | 59 | Low | 61.2 | Low | 45 Ų | 45 | 67.7 Ų | 67.7 | 37% | 0.372 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -56.2 | -44.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | A211 Q217 Q218 E219 | A211-A215 WeakPolarHBondContact O-CB 3.33Å; A211-A215 PolarHBondContact O-N 3.41Å; A215-Q217 PolarHBondContact O-N 3.33Å; A215-Q218 PolarHBondContact O-N 2.9Å; A215-Q218 VanDerWaalsContact O-N 3.1Å; A215-E219 PolarHBondContact O-N 3.37Å |
| 216 | Q | 61.7 | Low | 61.8 | Low | 0 Ų | 0 | 74.9 Ų | 74.9 | 0% | 0 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -60.2 | -30.2 | 176 | -159 | -179.7 | 2.4 | 0 | 0 | 113.7 | R136 L212 I214 S360 H361 K362 | R136-Q216 VanDerWaalsContact NH2-CB 3.3Å; L212-Q216 PolarHBondContact O-N 2.81Å; L212-Q216 VanDerWaalsContact O-N 3.16Å; I214-Q216 VanDerWaalsContact C-N 3.29Å; I214-Q216 PolarHBondContact O-N 3.25Å; Q216-S360 PolarHBondContact NE2-O 3.37Å; Q216-H361 PolarHBondContact O-CD2 2.83Å; Q216-H361 PolarHBondContact O-NE2 3.46Å; Q216-K362 HydrophobicContact CG-CG 4.18Å |
| 217 | Q | 60.5 | Low | 62.6 | Low | 54 Ų | 54 | 74.3 Ų | 74.3 | 25% | 0.252 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -76 | -34 | 177.5 | -72.6 | 176.2 | -46.2 | 0 | 0 | 112.2 | E213 I214 A215 K362 | E213-Q217 WeakPolarHBondContact O-CG 3.25Å; E213-Q217 PolarHBondContact O-N 3.09Å; I214-Q217 WeakPolarHBondContact O-CB 3.13Å; I214-Q217 PolarHBondContact O-N 3.27Å; A215-Q217 PolarHBondContact O-N 3.33Å; Q217-K362 HydrophobicContact CG-CD 3.77Å |
| 218 | Q | 58.8 | Low | 63.5 | Low | 135 Ų | 135 | 71.6 Ų | 71.6 | 63% | 0.631 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -77.6 | -30.5 | -178.2 | -68.7 | 178.2 | -4.6 | 0 | 0 | 111.9 | I214 A215 G220 A221 | I214-Q218 PolarHBondContact O-N 2.8Å; I214-Q218 VanDerWaalsContact O-N 3.12Å; A215-Q218 PolarHBondContact O-N 2.9Å; A215-Q218 VanDerWaalsContact O-N 3.1Å; Q218-G220 PolarHBondContact O-N 3.46Å; Q218-G220 VanDerWaalsContact O-N 3.09Å; Q218-A221 WeakPolarHBondContact O-CB 3.22Å; Q218-A221 PolarHBondContact O-N 3.22Å |
| 219 | E | 59.3 | Low | 64 | Low | 103 Ų | 103 | 68 Ų | 68 | 48% | 0.481 | 38% | 0.38 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.9 | -29.6 | -179.4 | -81.7 | -174.8 | 177.7 | 0 | 0 | 114.6 | A215 Y232 | A215-E219 PolarHBondContact O-N 3.37Å; E219-Y232 PolarHBondContact O-OH 2.79Å |
| 220 | G | 55.8 | Low | 64.7 | Low | 8 Ų | 8 | 63.5 Ų | 63.5 | 8% | 0.082 | 36% | 0.364 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -102 | 5.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | Q218 G222 L223 H361 | Q218-G220 PolarHBondContact O-N 3.46Å; Q218-G220 VanDerWaalsContact O-N 3.09Å; G220-G222 PolarHBondContact O-N 3.33Å; G220-G222 VanDerWaalsContact O-N 3.07Å; G220-L223 PolarHBondContact O-N 2.94Å; G220-H361 VanDerWaalsContact CA-CD2 3.49Å; G220-H361 WeakPolarHBondContact CA-CD2 3.46Å; G220-H361 VanDerWaalsContact CA-NE2 3.32Å; G220-H361 WeakPolarHBondContact CA-NE2 3.39Å; G220-H361 PolarHBondContact N-CD2 3.47Å; G220-H361 VanDerWaalsContact N-CD2 3.29Å; G220-H361 PolarHBondContact N-NE2 2.63Å |
| 221 | A | 57.9 | Low | 65.3 | Low | 84 Ų | 84 | 68.4 Ų | 68.4 | 69% | 0.694 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | 112.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | Q218 | Q218-A221 WeakPolarHBondContact O-CB 3.22Å; Q218-A221 PolarHBondContact O-N 3.22Å |
| 222 | G | 59.5 | Low | 66.1 | Low | 83 Ų | 83 | 66.5 Ų | 66.5 | 86% | 0.856 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 97.9 | -8.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | G220 | G220-G222 PolarHBondContact O-N 3.33Å; G220-G222 VanDerWaalsContact O-N 3.07Å |
| 223 | L | 67.4 | Low | 66.9 | Low | 54 Ų | 54 | 62.8 Ų | 62.8 | 28% | 0.283 | 34% | 0.342 | S | S | . | . | trans | -83 | 140.5 | 175.8 | -67.4 | 173.8 | 0 | 0 | 0 | 111.3 | G220 E227 I228 K231 Y232 | G220-L223 PolarHBondContact O-N 2.94Å; L223-E227 HydrophobicContact CD2-CB 4.49Å; L223-I228 HydrophobicContact CB-CD1 4.23Å; L223-I228 HydrophobicContact CB-CG1 3.62Å; L223-I228 HydrophobicContact CD1-CG1 4.4Å; L223-K231 HydrophobicContact CD1-CD 4.39Å; L223-Y232 HydrophobicContact CD1-CE2 3.74Å | ||
| 224 | T | 73 | Confident | 67.9 | Low | 78 Ų | 78 | 65.9 Ų | 65.9 | 48% | 0.479 | 36% | 0.358 | S | S | . | . | trans | -68.5 | 148.9 | 171.1 | 67.7 | 0 | 0 | 0 | 0 | 110 | K226 E227 I228 | T224-K226 PolarHBondContact O-N 3.5Å; T224-E227 VanDerWaalsContact CB-OE2 3.3Å; T224-E227 WeakPolarHBondContact CB-OE2 3.42Å; T224-E227 WeakPolarHBondContact CG2-OE2 3.41Å; T224-E227 PolarHBondContact N-OE2 3.42Å; T224-E227 CarbonylContact O-C 3.47Å; T224-E227 WeakPolarHBondContact O-CA 3.49Å; T224-E227 WeakPolarHBondContact O-CB 3.37Å; T224-E227 PolarHBondContact O-N 2.86Å; T224-E227 WeakPolarHBondContact OG1-CG 3.45Å; T224-E227 PolarHBondContact OG1-N 3.47Å; T224-E227 PolarHBondContact OG1-OE2 2.92Å; T224-I228 WeakPolarHBondContact O-CG1 3.42Å; T224-I228 PolarHBondContact O-N 2.98Å | ||
| 225 | R | 66.5 | Low | 69 | Low | 134 Ų | 134 | 69.4 Ų | 69.4 | 51% | 0.506 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -57 | -29.2 | -178.7 | -64.7 | -177.6 | -175.1 | 164.6 | 5.3 | 114 | L229 E363 | R225-L229 PolarHBondContact O-N 2.83Å; R225-L229 VanDerWaalsContact O-N 3.08Å; R225-E363 IonicContact NE-OE2 2.59Å |
| 226 | K | 72.6 | Confident | 69.9 | Low | 150 Ų | 150 | 68.1 Ų | 68.1 | 65% | 0.652 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -69 | -44.4 | 173.9 | -70.8 | -173.3 | -178.8 | 178.7 | 0 | 110.9 | T224 I228 L229 T230 | T224-K226 PolarHBondContact O-N 3.5Å; K226-I228 VanDerWaalsContact C-N 3.33Å; K226-L229 PolarHBondContact O-N 3.48Å; K226-T230 PolarHBondContact O-N 2.95Å; K226-T230 PolarHBondContact O-OG1 3.47Å |
| 227 | E | 75.5 | Confident | 70.8 | Confident | 96 Ų | 96 | 72.4 Ų | 72.4 | 45% | 0.449 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -64.7 | -38.5 | 175.4 | -68.6 | 161.5 | 150.7 | 0 | 0 | 111.5 | L223 T224 T230 K231 | L223-E227 HydrophobicContact CD2-CB 4.49Å; T224-E227 VanDerWaalsContact CB-OE2 3.3Å; T224-E227 WeakPolarHBondContact CB-OE2 3.42Å; T224-E227 WeakPolarHBondContact CG2-OE2 3.41Å; T224-E227 PolarHBondContact N-OE2 3.42Å; T224-E227 CarbonylContact O-C 3.47Å; T224-E227 WeakPolarHBondContact O-CA 3.49Å; T224-E227 WeakPolarHBondContact O-CB 3.37Å; T224-E227 PolarHBondContact O-N 2.86Å; T224-E227 WeakPolarHBondContact OG1-CG 3.45Å; T224-E227 PolarHBondContact OG1-N 3.47Å; T224-E227 PolarHBondContact OG1-OE2 2.92Å; E227-T230 PolarHBondContact O-N 2.96Å; E227-K231 WeakPolarHBondContact O-CB 3.15Å; E227-K231 PolarHBondContact O-N 3.06Å |
| 228 | I | 77.5 | Confident | 71.8 | Confident | 2 Ų | 2 | 75 Ų | 75 | 1% | 0.01 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -60.2 | -49.2 | 174.6 | -62 | 173.6 | 0 | 0 | 0 | 109.9 | L223 T224 K226 T230 Y232 H361 A364 | L223-I228 HydrophobicContact CB-CD1 4.23Å; L223-I228 HydrophobicContact CB-CG1 3.62Å; L223-I228 HydrophobicContact CD1-CG1 4.4Å; T224-I228 WeakPolarHBondContact O-CG1 3.42Å; T224-I228 PolarHBondContact O-N 2.98Å; K226-I228 VanDerWaalsContact C-N 3.33Å; I228-T230 PolarHBondContact O-N 3.31Å; I228-Y232 HydrophobicContact CG2-CD2 4.09Å; I228-Y232 WeakPolarHBondContact O-CA 3.18Å; I228-Y232 VanDerWaalsContact O-CB 3.25Å; I228-Y232 WeakPolarHBondContact O-CB 3.36Å; I228-Y232 PolarHBondContact O-N 3.25Å; I228-H361 HydrophobicContact CG2-CB 3.7Å; I228-A364 HydrophobicContact CG2-CB 3.77Å |
| 229 | L | 77.2 | Confident | 73 | Confident | 24 Ų | 24 | 68.6 Ų | 68.6 | 13% | 0.126 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -59.8 | -49.2 | 177.7 | -178.8 | 69.5 | 0 | 0 | 0 | 111.4 | I74 R225 K226 V233 L234 A367 | I74-L229 HydrophobicContact CD1-CD2 4.14Å; I74-L229 HydrophobicContact CG1-CD1 4.08Å; I74-L229 HydrophobicContact CG1-CD2 4.07Å; I74-L229 HydrophobicContact CG2-CD2 4.06Å; R225-L229 PolarHBondContact O-N 2.83Å; R225-L229 VanDerWaalsContact O-N 3.08Å; K226-L229 PolarHBondContact O-N 3.48Å; L229-V233 HydrophobicContact CD1-CB 3.99Å; L229-V233 HydrophobicContact CD1-CG1 4.41Å; L229-V233 HydrophobicContact CD1-CG2 3.92Å; L229-V233 WeakPolarHBondContact O-CA 3.43Å; L229-V233 WeakPolarHBondContact O-CB 3.4Å; L229-V233 PolarHBondContact O-N 2.92Å; L229-L234 PolarHBondContact O-N 3.43Å; L229-L234 VanDerWaalsContact O-N 3.09Å; L229-A367 HydrophobicContact CD1-CB 3.37Å |
| 230 | T | 76 | Confident | 74.3 | Confident | 62 Ų | 62 | 68.4 Ų | 68.4 | 38% | 0.38 | 36% | 0.364 | S | S | . | . | I | π-helix | trans | -66.4 | -46.4 | -177.4 | -55.7 | 0 | 0 | 0 | 0 | 111.3 | K226 E227 I228 L234 L235 | K226-T230 PolarHBondContact O-N 2.95Å; K226-T230 PolarHBondContact O-OG1 3.47Å; E227-T230 PolarHBondContact O-N 2.96Å; I228-T230 PolarHBondContact O-N 3.31Å; T230-L234 PolarHBondContact O-N 2.77Å; T230-L235 HydrophobicContact CG2-CD1 3.75Å; T230-L235 HydrophobicContact CG2-CG 4.07Å; T230-L235 VanDerWaalsContact O-CB 3.25Å; T230-L235 WeakPolarHBondContact O-CB 3.21Å; T230-L235 WeakPolarHBondContact O-CG 3.39Å; T230-L235 PolarHBondContact O-N 3.43Å |
| 231 | K | 74.7 | Confident | 75.7 | Confident | 120 Ų | 120 | 69.9 Ų | 69.9 | 52% | 0.522 | 37% | 0.37 | S | S | . | . | I | π-helix | trans | -74.9 | -46.9 | -175.5 | -172.1 | 177.9 | -179.9 | -177.1 | 0 | 112.7 | L223 E227 | L223-K231 HydrophobicContact CD1-CD 4.39Å; E227-K231 WeakPolarHBondContact O-CB 3.15Å; E227-K231 PolarHBondContact O-N 3.06Å |
| 232 | Y | 74.9 | Confident | 77 | Confident | 35 Ų | 35 | 65.9 Ų | 65.9 | 14% | 0.137 | 34% | 0.337 | C | S | . | . | I | π-helix | trans | -91.7 | -18.4 | -173.6 | -72.3 | -92.4 | 0 | 0 | 0 | 114 | E219 L223 I228 N236 I239 H361 | E219-Y232 PolarHBondContact O-OH 2.79Å; L223-Y232 HydrophobicContact CD1-CE2 3.74Å; I228-Y232 HydrophobicContact CG2-CD2 4.09Å; I228-Y232 WeakPolarHBondContact O-CA 3.18Å; I228-Y232 VanDerWaalsContact O-CB 3.25Å; I228-Y232 WeakPolarHBondContact O-CB 3.36Å; I228-Y232 PolarHBondContact O-N 3.25Å; Y232-N236 WeakPolarHBondContact O-CB 3.18Å; Y232-N236 PolarHBondContact O-ND2 2.87Å; Y232-N236 VanDerWaalsContact O-ND2 3.12Å; Y232-I239 WeakPolarHBondContact O-CD1 3.4Å; Y232-H361 HydrophobicContact CG-CB 4.43Å |
| 233 | V | 78.3 | Confident | 78.4 | Confident | 0 Ų | 0 | 61.9 Ų | 61.9 | 0% | 0 | 30% | 0.296 | C | S | . | . | I | π-helix | trans | -109.4 | -62.3 | 178.1 | -172.2 | 0 | 0 | 0 | 0 | 111.7 | L229 I239 A364 A367 A368 F371 | L229-V233 HydrophobicContact CD1-CB 3.99Å; L229-V233 HydrophobicContact CD1-CG1 4.41Å; L229-V233 HydrophobicContact CD1-CG2 3.92Å; L229-V233 WeakPolarHBondContact O-CA 3.43Å; L229-V233 WeakPolarHBondContact O-CB 3.4Å; L229-V233 PolarHBondContact O-N 2.92Å; V233-I239 HydrophobicContact CB-CD1 4.44Å; V233-I239 HydrophobicContact CG1-CD1 4.44Å; V233-I239 HydrophobicContact CG2-CD1 4.5Å; V233-A364 HydrophobicContact CG2-CB 3.94Å; V233-A367 HydrophobicContact CG2-CB 4.27Å; V233-A368 HydrophobicContact CG1-CB 4.5Å; V233-A368 HydrophobicContact CG2-CB 4.16Å; V233-F371 HydrophobicContact CG1-CB 4.04Å; V233-F371 HydrophobicContact CG1-CG 4.3Å |
| 234 | L | 80.8 | Confident | 79.4 | Confident | 65 Ų | 65 | 64.2 Ų | 64.2 | 34% | 0.34 | 30% | 0.304 | S | S | . | . | I | π-helix | trans | -77.5 | -36.8 | -170.1 | -63.5 | 177.2 | 0 | 0 | 0 | 114.2 | F70 L229 T230 W240 F371 | F70-L234 HydrophobicContact CZ-CD2 4.09Å; L229-L234 PolarHBondContact O-N 3.43Å; L229-L234 VanDerWaalsContact O-N 3.09Å; T230-L234 PolarHBondContact O-N 2.77Å; L234-W240 PolarHBondContact O-NE1 3.49Å; L234-F371 HydrophobicContact CD2-CD2 4.35Å; L234-F371 HydrophobicContact CD2-CE2 4.06Å |
| 235 | L | 81.6 | Confident | 80 | Confident | 126 Ų | 126 | 60.5 Ų | 60.5 | 66% | 0.66 | 28% | 0.282 | S | S | * | . | S | Bend | trans | -97 | -2.5 | -179.6 | -66.3 | 174.1 | 0 | 0 | 0 | 112.8 | T230 P237 | T230-L235 HydrophobicContact CG2-CD1 3.75Å; T230-L235 HydrophobicContact CG2-CG 4.07Å; T230-L235 VanDerWaalsContact O-CB 3.25Å; T230-L235 WeakPolarHBondContact O-CB 3.21Å; T230-L235 WeakPolarHBondContact O-CG 3.39Å; T230-L235 PolarHBondContact O-N 3.43Å; L235-P237 WeakPolarHBondContact O-CD 3.12Å |
| 236 | N | 78.6 | Confident | 81 | Confident | 17 Ų | 17 | 55 Ų | 55 | 9% | 0.091 | 26% | 0.261 | C | S | . | . | trans | -79.1 | 111.1 | -177.2 | -173.4 | -15.7 | 0 | 0 | 0 | 110.2 | Y232 Y238 I239 W240 C359 | Y232-N236 WeakPolarHBondContact O-CB 3.18Å; Y232-N236 PolarHBondContact O-ND2 2.87Å; Y232-N236 VanDerWaalsContact O-ND2 3.12Å; N236-Y238 PolarHBondContact O-N 2.95Å; N236-Y238 WeakPolarHBondContact OD1-CB 3.09Å; N236-Y238 WeakPolarHBondContact OD1-CD2 3.31Å; N236-Y238 PolarHBondContact OD1-N 2.9Å; N236-I239 HydrophobicContact CB-CB 4.37Å; N236-I239 HydrophobicContact CB-CD1 4.25Å; N236-I239 HydrophobicContact CB-CG1 4.4Å; N236-I239 PolarHBondContact O-N 3.13Å; N236-I239 VanDerWaalsContact O-N 3.11Å; N236-W240 PolarHBondContact O-N 3.22Å; N236-C359 PolarHBondContact ND2-O 3.14Å | ||
| 237 | P | 81.1 | Confident | 81.7 | Confident | 90 Ų | 90 | 48.6 Ų | 48.6 | 58% | 0.584 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -61.4 | -28.6 | -178 | 25.9 | -34.8 | 0 | 0 | 0 | 112.3 | L235 W240 L241 | L235-P237 WeakPolarHBondContact O-CD 3.12Å; P237-W240 PolarHBondContact O-N 3.32Å; P237-L241 WeakPolarHBondContact O-CB 3.37Å; P237-L241 PolarHBondContact O-N 3.47Å |
| 238 | Y | 81.1 | Confident | 82.3 | Confident | 110 Ų | 110 | 45.6 Ų | 45.6 | 43% | 0.431 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -66.5 | -38.6 | 177.5 | -64.7 | -74.7 | 0 | 0 | 0 | 112.2 | N236 W240 L241 L242 F417 A420 | N236-Y238 PolarHBondContact O-N 2.95Å; N236-Y238 WeakPolarHBondContact OD1-CB 3.09Å; N236-Y238 WeakPolarHBondContact OD1-CD2 3.31Å; N236-Y238 PolarHBondContact OD1-N 2.9Å; Y238-W240 VanDerWaalsContact C-N 3.35Å; Y238-L241 PolarHBondContact O-N 3.08Å; Y238-L242 WeakPolarHBondContact O-CG 3.35Å; Y238-L242 PolarHBondContact O-N 3.25Å; Y238-F417 HydrophobicContact CD1-CE1 4.26Å; Y238-F417 HydrophobicContact CD1-CZ 4.28Å; Y238-A420 HydrophobicContact CD1-CB 4.21Å; Y238-A420 HydrophobicContact CE1-CB 3.55Å |
| 239 | I | 84.3 | Confident | 82.7 | Confident | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -70.7 | -35.2 | 178.1 | -74.2 | 174.5 | 0 | 0 | 0 | 111.1 | Y232 V233 N236 L242 S243 A368 F371 V372 | Y232-I239 WeakPolarHBondContact O-CD1 3.4Å; V233-I239 HydrophobicContact CB-CD1 4.44Å; V233-I239 HydrophobicContact CG1-CD1 4.44Å; V233-I239 HydrophobicContact CG2-CD1 4.5Å; N236-I239 HydrophobicContact CB-CB 4.37Å; N236-I239 HydrophobicContact CB-CD1 4.25Å; N236-I239 HydrophobicContact CB-CG1 4.4Å; N236-I239 PolarHBondContact O-N 3.13Å; N236-I239 VanDerWaalsContact O-N 3.11Å; I239-L242 PolarHBondContact O-N 3.44Å; I239-S243 VanDerWaalsContact O-CB 3.3Å; I239-S243 WeakPolarHBondContact O-CB 3.19Å; I239-S243 PolarHBondContact O-N 3.28Å; I239-S243 PolarHBondContact O-OG 2.85Å; I239-A368 HydrophobicContact CD1-CB 3.85Å; I239-F371 HydrophobicContact CG2-CD1 3.5Å; I239-F371 HydrophobicContact CG2-CE1 3.93Å; I239-V372 HydrophobicContact CG2-CG2 4.12Å |
| 240 | W | 86.2 | Confident | 83.1 | Confident | 98 Ų | 98 | 45 Ų | 45 | 37% | 0.371 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -62.9 | -46.2 | 170.9 | -81.9 | 94.4 | 0 | 0 | 0 | 111.6 | L234 N236 P237 Y238 L242 S243 F244 F371 F375 | L234-W240 PolarHBondContact O-NE1 3.49Å; N236-W240 PolarHBondContact O-N 3.22Å; P237-W240 PolarHBondContact O-N 3.32Å; Y238-W240 VanDerWaalsContact C-N 3.35Å; W240-L242 PolarHBondContact O-N 2.91Å; W240-S243 WeakPolarHBondContact O-CB 3.4Å; W240-S243 PolarHBondContact O-N 3.45Å; W240-S243 VanDerWaalsContact O-N 3.12Å; W240-F244 HydrophobicContact CB-CE2 4.46Å; W240-F244 AromaticContact CE3-CE2 3.71Å; W240-F244 HydrophobicContact CE3-CE2 3.71Å; W240-F244 AromaticContact CE3-CZ 3.91Å; W240-F244 HydrophobicContact CE3-CZ 3.91Å; W240-F244 HydrophobicContact CZ3-CE2 4.42Å; W240-F244 HydrophobicContact CZ3-CZ 4.16Å; W240-F244 WeakPolarHBondContact O-CD2 3.48Å; W240-F244 PolarHBondContact O-N 3.47Å; W240-F371 HydrophobicContact CD2-CE1 4.44Å; W240-F371 HydrophobicContact CD2-CZ 4.37Å; W240-F371 AromaticContact CE2-CZ 3.93Å; W240-F371 HydrophobicContact CH2-CZ 4.2Å; W240-F371 AromaticContact CZ2-CZ 3.86Å; W240-F371 HydrophobicContact CZ2-CZ 3.86Å; W240-F375 HydrophobicContact CE3-CZ 4.43Å; W240-F375 HydrophobicContact CH2-CZ 4.16Å; W240-F375 HydrophobicContact CZ3-CE1 4.37Å; W240-F375 HydrophobicContact CZ3-CE2 4.46Å; W240-F375 AromaticContact CZ3-CZ 3.73Å; W240-F375 HydrophobicContact CZ3-CZ 3.73Å |
| 241 | L | 85.3 | Confident | 83.6 | Confident | 39 Ų | 39 | 42.8 Ų | 42.8 | 20% | 0.204 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.5 | -45.3 | 176.2 | -171.5 | 66.2 | 0 | 0 | 0 | 111.8 | P237 Y238 S243 F244 C245 L413 P416 F417 | P237-L241 WeakPolarHBondContact O-CB 3.37Å; P237-L241 PolarHBondContact O-N 3.47Å; Y238-L241 PolarHBondContact O-N 3.08Å; L241-S243 VanDerWaalsContact C-N 3.33Å; L241-S243 PolarHBondContact O-N 2.97Å; L241-F244 PolarHBondContact O-N 2.8Å; L241-C245 WeakPolarHBondContact O-CB 3.15Å; L241-C245 PolarHBondContact O-N 3.39Å; L241-L413 HydrophobicContact CD1-CB 4.09Å; L241-L413 HydrophobicContact CD1-CD2 3.7Å; L241-L413 HydrophobicContact CD1-CG 4.39Å; L241-P416 HydrophobicContact CD2-CB 4.17Å; L241-P416 HydrophobicContact CD2-CG 4.35Å; L241-F417 HydrophobicContact CB-CE2 4.1Å; L241-F417 HydrophobicContact CB-CZ 4.45Å; L241-F417 HydrophobicContact CD2-CD2 4Å; L241-F417 HydrophobicContact CD2-CE2 3.47Å; L241-F417 VanDerWaalsContact CD2-CE2 3.47Å; L241-F417 HydrophobicContact CD2-CZ 4.19Å; L241-F417 HydrophobicContact CG-CE2 3.74Å |
| 242 | L | 85.2 | Confident | 84 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -60.5 | -42.8 | 173.2 | -72.1 | 175.4 | 0 | 0 | 0 | 111.6 | Y238 I239 W240 C245 Y246 I352 A355 A356 V372 F417 | Y238-L242 WeakPolarHBondContact O-CG 3.35Å; Y238-L242 PolarHBondContact O-N 3.25Å; I239-L242 PolarHBondContact O-N 3.44Å; W240-L242 PolarHBondContact O-N 2.91Å; L242-C245 PolarHBondContact O-N 2.97Å; L242-Y246 VanDerWaalsContact O-CB 3.25Å; L242-Y246 WeakPolarHBondContact O-CB 3.14Å; L242-Y246 PolarHBondContact O-N 3.32Å; L242-I352 HydrophobicContact CB-CG2 4.21Å; L242-I352 HydrophobicContact CD2-CG2 4.18Å; L242-A355 HydrophobicContact CD1-CB 4.01Å; L242-A355 HydrophobicContact CD2-CB 4.19Å; L242-A356 HydrophobicContact CD1-CB 4.1Å; L242-V372 HydrophobicContact CB-CG2 4.28Å; L242-F417 HydrophobicContact CD1-CE1 4.25Å; L242-F417 HydrophobicContact CD1-CZ 4.1Å; L242-F417 HydrophobicContact CD2-CD1 4.32Å; L242-F417 HydrophobicContact CD2-CD2 4.15Å; L242-F417 HydrophobicContact CD2-CE1 3.73Å; L242-F417 HydrophobicContact CD2-CE2 3.5Å; L242-F417 VanDerWaalsContact CD2-CE2 3.5Å; L242-F417 HydrophobicContact CD2-CZ 3.33Å; L242-F417 HydrophobicContact CG-CE1 3.92Å; L242-F417 HydrophobicContact CG-CE2 3.86Å; L242-F417 HydrophobicContact CG-CZ 3.33Å |
| 243 | S | 87.5 | Confident | 84.5 | Confident | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.6 | -46.8 | -179.9 | -60.5 | 0 | 0 | 0 | 0 | 111.2 | I239 W240 L241 Y246 V247 F371 V372 | I239-S243 VanDerWaalsContact O-CB 3.3Å; I239-S243 WeakPolarHBondContact O-CB 3.19Å; I239-S243 PolarHBondContact O-N 3.28Å; I239-S243 PolarHBondContact O-OG 2.85Å; W240-S243 WeakPolarHBondContact O-CB 3.4Å; W240-S243 PolarHBondContact O-N 3.45Å; W240-S243 VanDerWaalsContact O-N 3.12Å; L241-S243 VanDerWaalsContact C-N 3.33Å; L241-S243 PolarHBondContact O-N 2.97Å; S243-Y246 WeakPolarHBondContact O-CB 3.23Å; S243-Y246 PolarHBondContact O-N 3.41Å; S243-Y246 VanDerWaalsContact O-N 3.17Å; S243-V247 WeakPolarHBondContact O-CG2 3.41Å; S243-V247 PolarHBondContact O-N 3.33Å; S243-F371 WeakPolarHBondContact OG-CD1 3.31Å; S243-F371 WeakPolarHBondContact OG-CE1 2.94Å; S243-V372 WeakPolarHBondContact OG-CG2 3.3Å |
| 244 | F | 88.6 | Confident | 84.8 | Confident | 103 Ų | 103 | 37.6 Ų | 37.6 | 45% | 0.452 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -63.4 | -42.9 | 176.1 | -73.5 | -61.4 | 0 | 0 | 0 | 112.5 | W240 L241 Y246 V247 L248 L413 | W240-F244 HydrophobicContact CB-CE2 4.46Å; W240-F244 AromaticContact CE3-CE2 3.71Å; W240-F244 HydrophobicContact CE3-CE2 3.71Å; W240-F244 AromaticContact CE3-CZ 3.91Å; W240-F244 HydrophobicContact CE3-CZ 3.91Å; W240-F244 HydrophobicContact CZ3-CE2 4.42Å; W240-F244 HydrophobicContact CZ3-CZ 4.16Å; W240-F244 WeakPolarHBondContact O-CD2 3.48Å; W240-F244 PolarHBondContact O-N 3.47Å; L241-F244 PolarHBondContact O-N 2.8Å; F244-Y246 VanDerWaalsContact C-N 3.26Å; F244-Y246 PolarHBondContact O-N 3.05Å; F244-V247 WeakPolarHBondContact O-CB 3.49Å; F244-V247 PolarHBondContact O-N 2.77Å; F244-L248 WeakPolarHBondContact O-CG 3.38Å; F244-L248 PolarHBondContact O-N 3.29Å; F244-L413 HydrophobicContact CB-CD1 4.24Å |
| 245 | C | 85.9 | Confident | 84.9 | Confident | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -59.5 | -41.3 | 173.2 | -176.4 | 0 | 0 | 0 | 0 | 111.3 | L241 L242 V247 L248 V249 I352 L414 | L241-C245 WeakPolarHBondContact O-CB 3.15Å; L241-C245 PolarHBondContact O-N 3.39Å; L242-C245 PolarHBondContact O-N 2.97Å; C245-V247 PolarHBondContact O-N 2.86Å; C245-L248 PolarHBondContact O-N 2.9Å; C245-V249 WeakPolarHBondContact O-CG2 3.14Å; C245-V249 PolarHBondContact O-N 3.25Å; C245-I352 HydrophobicContact CB-CD1 4.43Å; C245-L414 WeakPolarHBondContact SG-CG 3Å |
| 246 | Y | 87.3 | Confident | 84.9 | Confident | 18 Ų | 18 | 29 Ų | 29 | 7% | 0.071 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -68.1 | -35.8 | -178.2 | -151.5 | -134.8 | 0 | 0 | 0 | 113.2 | L242 S243 F244 L248 V249 Y250 Q349 I352 V372 A376 | L242-Y246 VanDerWaalsContact O-CB 3.25Å; L242-Y246 WeakPolarHBondContact O-CB 3.14Å; L242-Y246 PolarHBondContact O-N 3.32Å; S243-Y246 WeakPolarHBondContact O-CB 3.23Å; S243-Y246 PolarHBondContact O-N 3.41Å; S243-Y246 VanDerWaalsContact O-N 3.17Å; F244-Y246 VanDerWaalsContact C-N 3.26Å; F244-Y246 PolarHBondContact O-N 3.05Å; Y246-L248 VanDerWaalsContact C-N 3.3Å; Y246-L248 PolarHBondContact O-N 3.1Å; Y246-V249 PolarHBondContact O-N 2.91Å; Y246-Y250 HydrophobicContact CD1-CD2 4.22Å; Y246-Y250 HydrophobicContact CD1-CE2 4.11Å; Y246-Y250 HydrophobicContact CD2-CD2 4.17Å; Y246-Y250 HydrophobicContact CD2-CE2 4.16Å; Y246-Y250 HydrophobicContact CE1-CD2 4.16Å; Y246-Y250 AromaticContact CE1-CE2 3.59Å; Y246-Y250 HydrophobicContact CE1-CE2 3.59Å; Y246-Y250 HydrophobicContact CE2-CD2 4.08Å; Y246-Y250 AromaticContact CE2-CE2 3.61Å; Y246-Y250 HydrophobicContact CE2-CE2 3.61Å; Y246-Y250 HydrophobicContact CG-CD2 4.25Å; Y246-Y250 HydrophobicContact CG-CE2 4.39Å; Y246-Y250 AromaticContact CZ-CE2 3.3Å; Y246-Y250 WeakPolarHBondContact O-CB 3.33Å; Y246-Y250 WeakPolarHBondContact O-CD2 3.45Å; Y246-Y250 PolarHBondContact O-N 2.95Å; Y246-Y250 WeakPolarHBondContact OH-CE2 3.44Å; Y246-Y250 PolarHBondContact OH-OH 3.36Å; Y246-Q349 HydrophobicContact CE2-CB 4.47Å; Y246-Q349 HydrophobicContact CE2-CG 4.06Å; Y246-Q349 VanDerWaalsContact CE2-O 3.23Å; Y246-Q349 WeakPolarHBondContact CE2-O 3.02Å; Y246-Q349 PolarHBondContact OH-O 2.92Å; Y246-I352 HydrophobicContact CD2-CB 3.68Å; Y246-I352 HydrophobicContact CD2-CD1 3.93Å; Y246-I352 HydrophobicContact CD2-CG1 4.42Å; Y246-I352 HydrophobicContact CD2-CG2 3.37Å; Y246-I352 HydrophobicContact CE2-CB 3.98Å; Y246-I352 HydrophobicContact CE2-CG2 3.99Å; Y246-I352 HydrophobicContact CG-CG2 3.8Å; Y246-V372 HydrophobicContact CD1-CB 4.44Å; Y246-V372 HydrophobicContact CD1-CG1 3.27Å; Y246-V372 WeakPolarHBondContact CD1-O 3.41Å; Y246-V372 HydrophobicContact CD2-CG1 4.36Å; Y246-V372 HydrophobicContact CE1-CG1 3.76Å; Y246-V372 HydrophobicContact CG-CG1 3.61Å; Y246-A376 HydrophobicContact CD1-CB 3.1Å; Y246-A376 HydrophobicContact CE1-CB 3.11Å; Y246-A376 HydrophobicContact CG-CB 4.12Å |
| 247 | V | 88.9 | Confident | 85 | Confident | 16 Ų | 16 | 29.8 Ų | 29.8 | 10% | 0.097 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -52.8 | -52.3 | 169.3 | 173.3 | 0 | 0 | 0 | 0 | 109.3 | S243 F244 C245 Y250 V251 F375 L382 | S243-V247 WeakPolarHBondContact O-CG2 3.41Å; S243-V247 PolarHBondContact O-N 3.33Å; F244-V247 WeakPolarHBondContact O-CB 3.49Å; F244-V247 PolarHBondContact O-N 2.77Å; C245-V247 PolarHBondContact O-N 2.86Å; V247-Y250 PolarHBondContact O-N 3.45Å; V247-V251 HydrophobicContact CG1-CG2 4.36Å; V247-V251 VanDerWaalsContact O-CG2 3.31Å; V247-V251 WeakPolarHBondContact O-CG2 3.3Å; V247-V251 PolarHBondContact O-N 3.44Å; V247-F375 HydrophobicContact CG2-CB 3.8Å; V247-F375 HydrophobicContact CG2-CD1 3.88Å; V247-F375 HydrophobicContact CG2-CG 4.34Å; V247-F375 VanDerWaalsContact CG2-O 3.29Å; V247-F375 WeakPolarHBondContact CG2-O 3.45Å; V247-L382 HydrophobicContact CG1-CD1 4.17Å |
| 248 | L | 86.9 | Confident | 84.8 | Confident | 32 Ų | 32 | 28.7 Ų | 28.7 | 17% | 0.168 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -65.1 | -45.1 | -175.6 | -61.4 | 173.3 | 0 | 0 | 0 | 112 | F244 C245 Y246 Y250 V251 V252 A406 I409 L413 | F244-L248 WeakPolarHBondContact O-CG 3.38Å; F244-L248 PolarHBondContact O-N 3.29Å; C245-L248 PolarHBondContact O-N 2.9Å; Y246-L248 VanDerWaalsContact C-N 3.3Å; Y246-L248 PolarHBondContact O-N 3.1Å; L248-Y250 VanDerWaalsContact C-N 3.28Å; L248-Y250 PolarHBondContact O-N 3.41Å; L248-V251 WeakPolarHBondContact O-CB 3.21Å; L248-V251 PolarHBondContact O-N 2.85Å; L248-V252 WeakPolarHBondContact O-CG2 3.21Å; L248-V252 PolarHBondContact O-N 3.25Å; L248-A406 HydrophobicContact CB-CB 4.39Å; L248-A406 HydrophobicContact CD2-CB 4.03Å; L248-I409 HydrophobicContact CD1-CB 3.81Å; L248-I409 HydrophobicContact CD1-CG2 3.51Å; L248-L413 HydrophobicContact CD1-CD1 4.02Å |
| 249 | V | 85.3 | Confident | 84.7 | Confident | 2 Ų | 2 | 25.7 Ų | 25.7 | 1% | 0.012 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -60.2 | -40.3 | 175.9 | 173.3 | 0 | 0 | 0 | 0 | 111 | C245 Y246 V252 R253 P348 Q349 I352 | C245-V249 WeakPolarHBondContact O-CG2 3.14Å; C245-V249 PolarHBondContact O-N 3.25Å; Y246-V249 PolarHBondContact O-N 2.91Å; V249-V252 PolarHBondContact O-N 3.24Å; V249-R253 WeakPolarHBondContact O-CB 3.25Å; V249-R253 PolarHBondContact O-N 3.2Å; V249-P348 HydrophobicContact CG1-CB 4.35Å; V249-P348 HydrophobicContact CG2-CB 4.19Å; V249-Q349 HydrophobicContact CG1-CB 4.19Å; V249-I352 HydrophobicContact CG2-CD1 3.92Å |
| 250 | Y | 86.7 | Confident | 84.3 | Confident | 13 Ų | 13 | 25.9 Ų | 25.9 | 5% | 0.051 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -71.9 | -32.3 | 176.2 | -96.3 | -104.9 | 0 | 0 | 0 | 113.6 | Y246 V247 L248 R253 A254 Q349 A376 A380 | Y246-Y250 HydrophobicContact CD1-CD2 4.22Å; Y246-Y250 HydrophobicContact CD1-CE2 4.11Å; Y246-Y250 HydrophobicContact CD2-CD2 4.17Å; Y246-Y250 HydrophobicContact CD2-CE2 4.16Å; Y246-Y250 HydrophobicContact CE1-CD2 4.16Å; Y246-Y250 AromaticContact CE1-CE2 3.59Å; Y246-Y250 HydrophobicContact CE1-CE2 3.59Å; Y246-Y250 HydrophobicContact CE2-CD2 4.08Å; Y246-Y250 AromaticContact CE2-CE2 3.61Å; Y246-Y250 HydrophobicContact CE2-CE2 3.61Å; Y246-Y250 HydrophobicContact CG-CD2 4.25Å; Y246-Y250 HydrophobicContact CG-CE2 4.39Å; Y246-Y250 AromaticContact CZ-CE2 3.3Å; Y246-Y250 WeakPolarHBondContact O-CB 3.33Å; Y246-Y250 WeakPolarHBondContact O-CD2 3.45Å; Y246-Y250 PolarHBondContact O-N 2.95Å; Y246-Y250 WeakPolarHBondContact OH-CE2 3.44Å; Y246-Y250 PolarHBondContact OH-OH 3.36Å; V247-Y250 PolarHBondContact O-N 3.45Å; L248-Y250 VanDerWaalsContact C-N 3.28Å; L248-Y250 PolarHBondContact O-N 3.41Å; Y250-R253 PolarHBondContact O-N 3.31Å; Y250-A254 WeakPolarHBondContact O-CB 3.36Å; Y250-A254 PolarHBondContact O-N 3.17Å; Y250-Q349 HydrophobicContact CE2-CG 3.69Å; Y250-Q349 VanDerWaalsContact CZ-NE2 3.29Å; Y250-Q349 PolarHBondContact OH-NE2 3.01Å; Y250-A376 WeakPolarHBondContact CB-O 3.48Å; Y250-A376 HydrophobicContact CD1-CB 3.88Å; Y250-A376 WeakPolarHBondContact CD1-O 3.1Å; Y250-A376 HydrophobicContact CD2-CB 3.44Å; Y250-A376 VanDerWaalsContact CD2-CB 3.44Å; Y250-A376 HydrophobicContact CE1-CB 3.85Å; Y250-A376 HydrophobicContact CE2-CB 3.41Å; Y250-A376 VanDerWaalsContact CE2-CB 3.41Å; Y250-A376 HydrophobicContact CG-CB 3.65Å; Y250-A380 HydrophobicContact CD1-CB 4.2Å |
| 251 | V | 86.5 | Confident | 83.7 | Confident | 14 Ų | 14 | 23.1 Ų | 23.1 | 9% | 0.085 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -59.6 | -50.1 | 171 | 168.6 | 0 | 0 | 0 | 0 | 109.2 | V247 L248 R253 A254 A255 G379 L382 A383 | V247-V251 HydrophobicContact CG1-CG2 4.36Å; V247-V251 VanDerWaalsContact O-CG2 3.31Å; V247-V251 WeakPolarHBondContact O-CG2 3.3Å; V247-V251 PolarHBondContact O-N 3.44Å; L248-V251 WeakPolarHBondContact O-CB 3.21Å; L248-V251 PolarHBondContact O-N 2.85Å; V251-R253 PolarHBondContact O-N 3.31Å; V251-A254 PolarHBondContact O-N 3.38Å; V251-A255 WeakPolarHBondContact O-CB 3.44Å; V251-A255 PolarHBondContact O-N 3.39Å; V251-G379 WeakPolarHBondContact CG2-O 3.33Å; V251-L382 HydrophobicContact CG2-CB 4.17Å; V251-A383 HydrophobicContact CG1-CB 4.49Å |
| 252 | V | 83.9 | Confident | 83.1 | Confident | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -59.6 | -47.4 | 177.2 | 175.3 | 0 | 0 | 0 | 0 | 111.1 | L248 V249 I256 I316 V345 I403 A406 A407 | L248-V252 WeakPolarHBondContact O-CG2 3.21Å; L248-V252 PolarHBondContact O-N 3.25Å; V249-V252 PolarHBondContact O-N 3.24Å; V252-I256 HydrophobicContact CG1-CD1 3.83Å; V252-I256 VanDerWaalsContact O-CG1 3.26Å; V252-I256 WeakPolarHBondContact O-CG1 3.36Å; V252-I256 PolarHBondContact O-N 3.32Å; V252-I256 VanDerWaalsContact O-N 3.1Å; V252-I316 HydrophobicContact CG1-CG2 4.08Å; V252-V345 HydrophobicContact CG1-CG2 3.82Å; V252-I403 HydrophobicContact CB-CG2 4.36Å; V252-I403 HydrophobicContact CG1-CG2 3.9Å; V252-I403 HydrophobicContact CG2-CG2 3.98Å; V252-A406 HydrophobicContact CG2-CB 4.09Å; V252-A407 HydrophobicContact CG2-CB 4.44Å |
| 253 | R | 85.2 | Confident | 82.6 | Confident | 37 Ų | 37 | 24.6 Ų | 24.6 | 14% | 0.14 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -59.6 | -54.7 | 179.4 | -173.7 | -163.5 | 160.4 | 113.6 | 12.9 | 111.7 | V249 Y250 V251 A255 I256 N257 F282 E283 V345 | V249-R253 WeakPolarHBondContact O-CB 3.25Å; V249-R253 PolarHBondContact O-N 3.2Å; Y250-R253 PolarHBondContact O-N 3.31Å; V251-R253 PolarHBondContact O-N 3.31Å; R253-A255 VanDerWaalsContact C-N 3.34Å; R253-I256 PolarHBondContact O-N 2.95Å; R253-N257 WeakPolarHBondContact O-CB 3.41Å; R253-N257 PolarHBondContact O-N 3.47Å; R253-F282 HydrophobicContact CG-CE1 4.43Å; R253-F282 HydrophobicContact CG-CZ 4.17Å; R253-E283 IonicContact NH2-OE1 3.38Å; R253-E283 PolarHBondContact NH2-OE1 3.07Å; R253-E283 IonicContact NH2-OE2 3.41Å; R253-E283 PolarHBondContact NH2-OE2 3.45Å; R253-V345 HydrophobicContact CB-CG1 3.58Å; R253-V345 HydrophobicContact CG-CG1 3.96Å |
| 254 | A | 83.5 | Confident | 81.9 | Confident | 10 Ų | 10 | 24.7 Ų | 24.7 | 8% | 0.083 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -66.7 | -39.2 | -176.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | Y250 V251 I256 N257 D258 A380 A383 | Y250-A254 WeakPolarHBondContact O-CB 3.36Å; Y250-A254 PolarHBondContact O-N 3.17Å; V251-A254 PolarHBondContact O-N 3.38Å; A254-I256 VanDerWaalsContact C-N 3.32Å; A254-I256 PolarHBondContact O-N 2.83Å; A254-N257 PolarHBondContact O-N 2.67Å; A254-D258 VanDerWaalsContact O-CB 3.26Å; A254-D258 WeakPolarHBondContact O-CB 3.46Å; A254-D258 PolarHBondContact O-N 2.88Å; A254-A380 HydrophobicContact CB-CB 4.09Å; A254-A383 HydrophobicContact CB-CB 3.56Å |
| 255 | A | 83.5 | Confident | 81 | Confident | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -55.5 | -48 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | V251 R253 W259 A383 L387 F399 I403 | V251-A255 WeakPolarHBondContact O-CB 3.44Å; V251-A255 PolarHBondContact O-N 3.39Å; R253-A255 VanDerWaalsContact C-N 3.34Å; A255-W259 VanDerWaalsContact O-CB 3.24Å; A255-W259 WeakPolarHBondContact O-CB 3.5Å; A255-W259 VanDerWaalsContact O-CD1 3.29Å; A255-W259 PolarHBondContact O-N 3.33Å; A255-A383 HydrophobicContact CB-CB 4.36Å; A255-L387 HydrophobicContact CB-CD2 3.35Å; A255-F399 HydrophobicContact CB-CE2 3.96Å; A255-F399 HydrophobicContact CB-CZ 4.04Å; A255-I403 HydrophobicContact CB-CD1 3.65Å; A255-I403 HydrophobicContact CB-CG1 4Å |
| 256 | I | 81.3 | Confident | 80.3 | Confident | 9 Ų | 9 | 27.3 Ų | 27.3 | 5% | 0.046 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -75.1 | -34.4 | -177.3 | -63 | 174.2 | 0 | 0 | 0 | 111.4 | V252 R253 A254 G260 F282 F338 I341 I403 | V252-I256 HydrophobicContact CG1-CD1 3.83Å; V252-I256 VanDerWaalsContact O-CG1 3.26Å; V252-I256 WeakPolarHBondContact O-CG1 3.36Å; V252-I256 PolarHBondContact O-N 3.32Å; V252-I256 VanDerWaalsContact O-N 3.1Å; R253-I256 PolarHBondContact O-N 2.95Å; A254-I256 VanDerWaalsContact C-N 3.32Å; A254-I256 PolarHBondContact O-N 2.83Å; I256-G260 WeakPolarHBondContact O-CA 3.22Å; I256-G260 PolarHBondContact O-N 3.03Å; I256-F282 HydrophobicContact CB-CE2 4.19Å; I256-F282 HydrophobicContact CB-CZ 4.38Å; I256-F282 HydrophobicContact CG2-CD2 3.76Å; I256-F282 HydrophobicContact CG2-CE2 3.7Å; I256-F282 HydrophobicContact CG2-CG 4.36Å; I256-F282 HydrophobicContact CG2-CZ 4.23Å; I256-F338 HydrophobicContact CG2-CD1 3.92Å; I256-F338 HydrophobicContact CG2-CE1 3.68Å; I256-I341 HydrophobicContact CD1-CD1 4.39Å; I256-I341 HydrophobicContact CD1-CG2 3.22Å; I256-I341 HydrophobicContact CG2-CG2 4.37Å; I256-I403 HydrophobicContact CG1-CD1 4.27Å |
| 257 | N | 81.6 | Confident | 79.6 | Confident | 34 Ų | 34 | 29.6 Ų | 29.6 | 18% | 0.182 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -69.6 | -45.4 | 177.2 | -160.9 | -114.3 | 0 | 0 | 0 | 112.3 | R253 A254 F282 E283 | R253-N257 WeakPolarHBondContact O-CB 3.41Å; R253-N257 PolarHBondContact O-N 3.47Å; A254-N257 PolarHBondContact O-N 2.67Å; N257-F282 HydrophobicContact CB-CE1 4.41Å; N257-E283 PolarHBondContact ND2-OE1 3.41Å |
| 258 | D | 76 | Confident | 78.6 | Confident | 68 Ų | 68 | 31.4 Ų | 31.4 | 36% | 0.364 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -84.8 | -32 | -172.1 | -65.3 | -23.8 | 0 | 0 | 0 | 112.4 | A254 N261 | A254-D258 VanDerWaalsContact O-CB 3.26Å; A254-D258 WeakPolarHBondContact O-CB 3.46Å; A254-D258 PolarHBondContact O-N 2.88Å; D258-N261 PolarHBondContact O-OD1 2.99Å |
| 259 | W | 80.1 | Confident | 77.7 | Confident | 47 Ų | 47 | 33 Ų | 33 | 18% | 0.178 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -111.7 | -10.2 | -176.5 | -54.6 | 88.9 | 0 | 0 | 0 | 114 | A255 N261 L262 Y263 A383 A388 L391 W396 F399 | A255-W259 VanDerWaalsContact O-CB 3.24Å; A255-W259 WeakPolarHBondContact O-CB 3.5Å; A255-W259 VanDerWaalsContact O-CD1 3.29Å; A255-W259 PolarHBondContact O-N 3.33Å; W259-N261 VanDerWaalsContact C-N 3.32Å; W259-N261 PolarHBondContact O-N 2.93Å; W259-L262 HydrophobicContact CE3-CD2 3.82Å; W259-L262 HydrophobicContact CZ3-CD2 4.01Å; W259-L262 PolarHBondContact O-N 2.93Å; W259-Y263 PolarHBondContact O-N 3.34Å; W259-A383 PolarHBondContact NE1-O 3.11Å; W259-A388 HydrophobicContact CH2-CB 3.45Å; W259-A388 VanDerWaalsContact CH2-CB 3.45Å; W259-A388 HydrophobicContact CZ2-CB 3.61Å; W259-L391 HydrophobicContact CE3-CD2 3.73Å; W259-L391 HydrophobicContact CZ3-CD2 3.7Å; W259-W396 HydrophobicContact CB-CZ3 4.37Å; W259-F399 HydrophobicContact CB-CE2 3.59Å; W259-F399 HydrophobicContact CB-CZ 3.84Å; W259-F399 AromaticContact CD1-CE2 3.91Å; W259-F399 AromaticContact CG-CE2 3.8Å; W259-F399 HydrophobicContact CG-CE2 3.8Å; W259-F399 HydrophobicContact CG-CZ 4.48Å |
| 260 | G | 74.4 | Confident | 77 | Confident | 3 Ų | 3 | 34.4 Ų | 34.4 | 3% | 0.031 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -64.1 | -34.8 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | I256 M264 | I256-G260 WeakPolarHBondContact O-CA 3.22Å; I256-G260 PolarHBondContact O-N 3.03Å; G260-M264 WeakPolarHBondContact O-CG 3.39Å; G260-M264 PolarHBondContact O-N 3.18Å |
| 261 | N | 74.2 | Confident | 76.5 | Confident | 41 Ų | 41 | 38.7 Ų | 38.7 | 22% | 0.219 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -68.7 | -40.9 | 174.1 | 57.6 | 3.7 | 0 | 0 | 0 | 112 | D258 W259 M264 S265 A275 V279 | D258-N261 PolarHBondContact O-OD1 2.99Å; W259-N261 VanDerWaalsContact C-N 3.32Å; W259-N261 PolarHBondContact O-N 2.93Å; N261-M264 PolarHBondContact O-N 2.93Å; N261-S265 WeakPolarHBondContact O-CB 2.99Å; N261-S265 PolarHBondContact O-N 3.03Å; N261-A275 HydrophobicContact CB-CB 4.09Å; N261-V279 HydrophobicContact CB-CG2 3.95Å |
| 262 | L | 72.3 | Confident | 75.6 | Confident | 56 Ų | 56 | 42.8 Ų | 42.8 | 29% | 0.293 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -65 | -43.5 | 177.6 | -174.3 | 69 | 0 | 0 | 0 | 110.6 | W259 M264 S265 E266 L391 W396 | W259-L262 HydrophobicContact CE3-CD2 3.82Å; W259-L262 HydrophobicContact CZ3-CD2 4.01Å; W259-L262 PolarHBondContact O-N 2.93Å; L262-M264 VanDerWaalsContact C-N 3.29Å; L262-M264 PolarHBondContact O-N 3.1Å; L262-S265 PolarHBondContact O-N 2.8Å; L262-S265 VanDerWaalsContact O-N 3.14Å; L262-E266 HydrophobicContact CD1-CG 4.04Å; L262-E266 WeakPolarHBondContact CD1-OE1 3.44Å; L262-E266 HydrophobicContact CG-CG 4.2Å; L262-E266 WeakPolarHBondContact O-CB 3.35Å; L262-E266 PolarHBondContact O-N 2.78Å; L262-L391 HydrophobicContact CD2-CD2 4.22Å; L262-W396 HydrophobicContact CB-CH2 4.06Å; L262-W396 HydrophobicContact CB-CZ2 4.4Å; L262-W396 HydrophobicContact CD2-CH2 4.07Å; L262-W396 HydrophobicContact CD2-CZ2 4.12Å; L262-W396 HydrophobicContact CG-CH2 4.04Å; L262-W396 HydrophobicContact CG-CZ2 3.95Å |
| 263 | Y | 75.9 | Confident | 75 | Confident | 14 Ų | 14 | 47.3 Ų | 47.3 | 6% | 0.055 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -54.4 | -46.7 | 174.7 | 174.1 | -107.4 | 0 | 0 | 0 | 111.8 | W259 T267 W396 F400 | W259-Y263 PolarHBondContact O-N 3.34Å; Y263-T267 WeakPolarHBondContact CD2-OG1 3.44Å; Y263-T267 HydrophobicContact CE2-CG2 4.2Å; Y263-T267 VanDerWaalsContact CE2-OG1 3.26Å; Y263-T267 WeakPolarHBondContact CE2-OG1 3.38Å; Y263-T267 WeakPolarHBondContact O-CB 3.12Å; Y263-T267 PolarHBondContact O-N 3.47Å; Y263-T267 PolarHBondContact O-OG1 3.31Å; Y263-W396 VanDerWaalsContact CA-CZ2 3.48Å; Y263-W396 HydrophobicContact CD2-CB 4.45Å; Y263-W396 AromaticContact CD2-CD2 3.6Å; Y263-W396 HydrophobicContact CD2-CD2 3.6Å; Y263-W396 AromaticContact CD2-CE3 3.58Å; Y263-W396 HydrophobicContact CD2-CE3 3.58Å; Y263-W396 AromaticContact CD2-CG 3.99Å; Y263-W396 HydrophobicContact CD2-CG 3.99Å; Y263-W396 HydrophobicContact CD2-CZ3 4.09Å; Y263-W396 HydrophobicContact CE2-CB 4.45Å; Y263-W396 HydrophobicContact CE2-CD2 4.41Å; Y263-W396 HydrophobicContact CE2-CG 4.36Å; Y263-W396 HydrophobicContact CG-CE3 4.21Å; Y263-W396 HydrophobicContact CG-CZ3 4.28Å; Y263-F400 HydrophobicContact CD1-CZ 4.49Å; Y263-F400 HydrophobicContact CD2-CE2 4.15Å; Y263-F400 AromaticContact CD2-CZ 3.94Å; Y263-F400 HydrophobicContact CD2-CZ 3.94Å; Y263-F400 HydrophobicContact CE1-CZ 4.16Å; Y263-F400 AromaticContact CE2-CE2 3.59Å; Y263-F400 HydrophobicContact CE2-CE2 3.59Å; Y263-F400 AromaticContact CE2-CZ 3.57Å; Y263-F400 HydrophobicContact CE2-CZ 3.57Å; Y263-F400 HydrophobicContact CG-CZ 4.38Å; Y263-F400 AromaticContact CZ-CZ 3.68Å |
| 264 | M | 72 | Confident | 74.5 | Confident | 1 Ų | 1 | 47.9 Ų | 47.9 | 1% | 0.005 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -64.3 | -46.2 | 176.7 | -72.6 | -159.6 | 175 | 0 | 0 | 111.8 | G260 N261 L262 E266 L268 V270 A275 A278 Q334 F338 | G260-M264 WeakPolarHBondContact O-CG 3.39Å; G260-M264 PolarHBondContact O-N 3.18Å; N261-M264 PolarHBondContact O-N 2.93Å; L262-M264 VanDerWaalsContact C-N 3.29Å; L262-M264 PolarHBondContact O-N 3.1Å; M264-E266 PolarHBondContact O-N 3.17Å; M264-L268 HydrophobicContact CB-CD1 4.44Å; M264-L268 HydrophobicContact CG-CD1 4.44Å; M264-L268 VanDerWaalsContact O-CB 3.28Å; M264-L268 WeakPolarHBondContact O-CB 3.41Å; M264-L268 PolarHBondContact O-N 3.21Å; M264-V270 HydrophobicContact CB-CG2 3.89Å; M264-V270 WeakPolarHBondContact O-CG2 3.41Å; M264-A275 HydrophobicContact CB-CB 3.98Å; M264-A278 HydrophobicContact CE-CB 3.15Å; M264-A278 HydrophobicContact SD-CB 3.3Å; M264-A278 WeakPolarHBondContact SD-CB 3.47Å; M264-Q334 HydrophobicContact CE-CB 3.94Å; M264-F338 HydrophobicContact CE-CD2 3.19Å; M264-F338 HydrophobicContact CE-CE2 3.12Å; M264-F338 HydrophobicContact CE-CG 3.99Å; M264-F338 HydrophobicContact CE-CZ 3.87Å; M264-F338 HydrophobicContact CG-CE2 4.3Å; M264-F338 HydrophobicContact CG-CZ 4.47Å; M264-F338 HydrophobicContact SD-CE2 4.5Å |
| 265 | S | 69 | Low | 73.9 | Confident | 44 Ų | 44 | 47.4 Ų | 47.4 | 31% | 0.308 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.6 | -42.8 | -178.9 | -170.1 | 0 | 0 | 0 | 0 | 112.3 | N261 L262 G269 | N261-S265 WeakPolarHBondContact O-CB 2.99Å; N261-S265 PolarHBondContact O-N 3.03Å; L262-S265 PolarHBondContact O-N 2.8Å; L262-S265 VanDerWaalsContact O-N 3.14Å; S265-G269 VanDerWaalsContact O-CA 3.28Å; S265-G269 WeakPolarHBondContact O-CA 3.48Å; S265-G269 PolarHBondContact O-N 2.86Å |
| 266 | E | 73 | Confident | 73.2 | Confident | 115 Ų | 115 | 50.6 Ų | 50.6 | 54% | 0.537 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -80.1 | -42.5 | -176.8 | -70.9 | -174.2 | 178.9 | 0 | 0 | 113 | L262 M264 W396 | L262-E266 HydrophobicContact CD1-CG 4.04Å; L262-E266 WeakPolarHBondContact CD1-OE1 3.44Å; L262-E266 HydrophobicContact CG-CG 4.2Å; L262-E266 WeakPolarHBondContact O-CB 3.35Å; L262-E266 PolarHBondContact O-N 2.78Å; M264-E266 PolarHBondContact O-N 3.17Å; E266-W396 HydrophobicContact CB-CZ2 4.5Å; E266-W396 VanDerWaalsContact OE2-CZ2 3.26Å; E266-W396 WeakPolarHBondContact OE2-CZ2 3.34Å; E266-W396 PolarHBondContact OE2-NE1 3.22Å |
| 267 | T | 70.5 | Confident | 73.1 | Confident | 66 Ų | 66 | 53 Ų | 53 | 41% | 0.405 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -82.4 | -32.5 | -173.2 | -45.7 | 0 | 0 | 0 | 0 | 112.1 | Y263 | Y263-T267 WeakPolarHBondContact CD2-OG1 3.44Å; Y263-T267 HydrophobicContact CE2-CG2 4.2Å; Y263-T267 VanDerWaalsContact CE2-OG1 3.26Å; Y263-T267 WeakPolarHBondContact CE2-OG1 3.38Å; Y263-T267 WeakPolarHBondContact O-CB 3.12Å; Y263-T267 PolarHBondContact O-N 3.47Å; Y263-T267 PolarHBondContact O-OG1 3.31Å |
| 268 | L | 69.1 | Low | 72.8 | Confident | 53 Ų | 53 | 51.4 Ų | 51.4 | 28% | 0.277 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -107.2 | -13.6 | -177.2 | -61 | 165.7 | 0 | 0 | 0 | 114.1 | M264 V270 Q334 | M264-L268 HydrophobicContact CB-CD1 4.44Å; M264-L268 HydrophobicContact CG-CD1 4.44Å; M264-L268 VanDerWaalsContact O-CB 3.28Å; M264-L268 WeakPolarHBondContact O-CB 3.41Å; M264-L268 PolarHBondContact O-N 3.21Å; L268-V270 HydrophobicContact CB-CG1 3.9Å; L268-V270 HydrophobicContact CB-CG2 4.29Å; L268-V270 HydrophobicContact CD1-CG1 4.35Å; L268-V270 HydrophobicContact CD1-CG2 4.46Å; L268-V270 PolarHBondContact O-N 3.08Å; L268-Q334 VanDerWaalsContact CD2-NE2 3.3Å |
| 269 | G | 67.9 | Low | 72.8 | Confident | 65 Ų | 65 | 49.1 Ų | 49.1 | 67% | 0.67 | 29% | 0.285 | S | S | * | . | trans | 62.3 | 21.1 | -172 | 0 | 0 | 0 | 0 | 0 | 113.5 | S265 | S265-G269 VanDerWaalsContact O-CA 3.28Å; S265-G269 WeakPolarHBondContact O-CA 3.48Å; S265-G269 PolarHBondContact O-N 2.86Å | ||
| 270 | V | 71.2 | Confident | 72.9 | Confident | 33 Ų | 33 | 50.9 Ų | 50.9 | 20% | 0.2 | 30% | 0.301 | C | S | . | . | trans | -71.9 | 146.9 | 175 | -67.5 | 0 | 0 | 0 | 0 | 110.3 | M264 L268 T274 A275 | M264-V270 HydrophobicContact CB-CG2 3.89Å; M264-V270 WeakPolarHBondContact O-CG2 3.41Å; L268-V270 HydrophobicContact CB-CG1 3.9Å; L268-V270 HydrophobicContact CB-CG2 4.29Å; L268-V270 HydrophobicContact CD1-CG1 4.35Å; L268-V270 HydrophobicContact CD1-CG2 4.46Å; L268-V270 PolarHBondContact O-N 3.08Å; V270-T274 HydrophobicContact CB-CG2 4.27Å; V270-T274 HydrophobicContact CG1-CG2 4.48Å; V270-A275 HydrophobicContact CG2-CB 4.41Å | ||
| 271 | D | 75.9 | Confident | 73.3 | Confident | 103 Ų | 103 | 53.9 Ų | 53.9 | 55% | 0.551 | 32% | 0.315 | S | S | * | . | trans | -59.2 | 149.9 | 174.7 | -178 | 43.7 | 0 | 0 | 0 | 111.8 | V273 T274 A275 | D271-V273 PolarHBondContact O-N 3.48Å; D271-V273 VanDerWaalsContact O-N 3.16Å; D271-V273 WeakPolarHBondContact OD2-CB 3.41Å; D271-V273 WeakPolarHBondContact OD2-CG2 3.41Å; D271-V273 PolarHBondContact OD2-N 3.15Å; D271-T274 WeakPolarHBondContact O-CB 3.06Å; D271-T274 PolarHBondContact O-N 3.46Å; D271-A275 PolarHBondContact O-N 3.23Å | ||
| 272 | L | 67.7 | Low | 73.7 | Confident | 99 Ų | 99 | 52 Ų | 52 | 52% | 0.518 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -58 | -32.1 | -177 | -175.7 | 63 | 0 | 0 | 0 | 112.1 | A275 N276 | L272-A275 PolarHBondContact O-N 3.34Å; L272-N276 VanDerWaalsContact O-CG 3.31Å; L272-N276 PolarHBondContact O-N 3.35Å; L272-N276 PolarHBondContact O-ND2 3.4Å |
| 273 | V | 71.5 | Confident | 74.3 | Confident | 96 Ų | 96 | 51.5 Ų | 51.5 | 58% | 0.582 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -62.7 | -45.3 | 175.9 | -179.9 | 0 | 0 | 0 | 0 | 110.9 | D271 N276 T277 | D271-V273 PolarHBondContact O-N 3.48Å; D271-V273 VanDerWaalsContact O-N 3.16Å; D271-V273 WeakPolarHBondContact OD2-CB 3.41Å; D271-V273 WeakPolarHBondContact OD2-CG2 3.41Å; D271-V273 PolarHBondContact OD2-N 3.15Å; V273-N276 PolarHBondContact O-N 3.43Å; V273-T277 PolarHBondContact O-N 2.79Å; V273-T277 VanDerWaalsContact O-N 3.09Å; V273-T277 PolarHBondContact O-OG1 3.01Å |
| 274 | T | 74 | Confident | 74.7 | Confident | 48 Ų | 48 | 54.6 Ų | 54.6 | 29% | 0.294 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -68.2 | -36.5 | 179.2 | -55.8 | 0 | 0 | 0 | 0 | 111.7 | V270 D271 T277 A278 Y331 | V270-T274 HydrophobicContact CB-CG2 4.27Å; V270-T274 HydrophobicContact CG1-CG2 4.48Å; D271-T274 WeakPolarHBondContact O-CB 3.06Å; D271-T274 PolarHBondContact O-N 3.46Å; T274-T277 WeakPolarHBondContact CA-OG1 3.18Å; T274-T277 PolarHBondContact O-N 2.89Å; T274-T277 PolarHBondContact O-OG1 3.35Å; T274-A278 PolarHBondContact O-N 3.3Å; T274-Y331 HydrophobicContact CG2-CD2 3.49Å; T274-Y331 VanDerWaalsContact CG2-CD2 3.49Å; T274-Y331 HydrophobicContact CG2-CE1 4.35Å; T274-Y331 HydrophobicContact CG2-CE2 3.19Å; T274-Y331 HydrophobicContact CG2-CG 4.21Å; T274-Y331 WeakPolarHBondContact O-CE2 3.25Å; T274-Y331 PolarHBondContact O-OH 2.88Å |
| 275 | A | 70.1 | Confident | 75.4 | Confident | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.1 | -41.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | N261 M264 V270 D271 L272 T277 A278 V279 | N261-A275 HydrophobicContact CB-CB 4.09Å; M264-A275 HydrophobicContact CB-CB 3.98Å; V270-A275 HydrophobicContact CG2-CB 4.41Å; D271-A275 PolarHBondContact O-N 3.23Å; L272-A275 PolarHBondContact O-N 3.34Å; A275-T277 PolarHBondContact O-N 3.28Å; A275-A278 PolarHBondContact O-N 2.91Å; A275-V279 PolarHBondContact O-N 3.49Å |
| 276 | N | 70.8 | Confident | 76.1 | Confident | 68 Ų | 68 | 52.4 Ų | 52.4 | 36% | 0.364 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -68.1 | -32.6 | 177.9 | -74.1 | -40.4 | 0 | 0 | 0 | 113.1 | L272 V273 A278 V279 T280 | L272-N276 VanDerWaalsContact O-CG 3.31Å; L272-N276 PolarHBondContact O-N 3.35Å; L272-N276 PolarHBondContact O-ND2 3.4Å; V273-N276 PolarHBondContact O-N 3.43Å; N276-A278 VanDerWaalsContact C-N 3.28Å; N276-A278 PolarHBondContact O-N 3.38Å; N276-V279 PolarHBondContact O-N 2.95Å; N276-T280 PolarHBondContact O-N 3.05Å; N276-T280 PolarHBondContact O-OG1 3.46Å |
| 277 | T | 77.8 | Confident | 76.7 | Confident | 59 Ų | 59 | 50 Ų | 50 | 36% | 0.362 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -65.5 | -32.8 | 174.5 | 44.6 | 0 | 0 | 0 | 0 | 112 | V273 T274 A275 T280 M281 Y331 | V273-T277 PolarHBondContact O-N 2.79Å; V273-T277 VanDerWaalsContact O-N 3.09Å; V273-T277 PolarHBondContact O-OG1 3.01Å; T274-T277 WeakPolarHBondContact CA-OG1 3.18Å; T274-T277 PolarHBondContact O-N 2.89Å; T274-T277 PolarHBondContact O-OG1 3.35Å; A275-T277 PolarHBondContact O-N 3.28Å; T277-T280 WeakPolarHBondContact O-CB 3.34Å; T277-T280 PolarHBondContact O-N 2.94Å; T277-M281 WeakPolarHBondContact O-CG 3.46Å; T277-M281 PolarHBondContact O-N 3.37Å; T277-Y331 WeakPolarHBondContact CB-OH 3.46Å; T277-Y331 PolarHBondContact OG1-OH 2.86Å |
| 278 | A | 76 | Confident | 77.5 | Confident | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -71.6 | -37.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | M264 T274 A275 N276 T280 M281 F282 Y331 | M264-A278 HydrophobicContact CE-CB 3.15Å; M264-A278 HydrophobicContact SD-CB 3.3Å; M264-A278 WeakPolarHBondContact SD-CB 3.47Å; T274-A278 PolarHBondContact O-N 3.3Å; A275-A278 PolarHBondContact O-N 2.91Å; N276-A278 VanDerWaalsContact C-N 3.28Å; N276-A278 PolarHBondContact O-N 3.38Å; A278-T280 PolarHBondContact O-N 3.46Å; A278-M281 WeakPolarHBondContact O-CA 3.21Å; A278-M281 WeakPolarHBondContact O-CB 3.41Å; A278-M281 PolarHBondContact O-N 2.77Å; A278-F282 PolarHBondContact O-N 3.4Å; A278-Y331 HydrophobicContact CB-CE2 4.38Å |
| 279 | V | 76.3 | Confident | 78.3 | Confident | 21 Ų | 21 | 47.3 Ų | 47.3 | 13% | 0.127 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.3 | -34.9 | 170.7 | 177.8 | 0 | 0 | 0 | 0 | 110.9 | N261 A275 N276 M281 F282 E283 | N261-V279 HydrophobicContact CB-CG2 3.95Å; A275-V279 PolarHBondContact O-N 3.49Å; N276-V279 PolarHBondContact O-N 2.95Å; V279-M281 VanDerWaalsContact C-N 3.32Å; V279-M281 PolarHBondContact O-N 2.81Å; V279-F282 WeakPolarHBondContact O-CB 3.4Å; V279-F282 PolarHBondContact O-N 3.48Å; V279-F282 VanDerWaalsContact O-N 3.16Å; V279-E283 PolarHBondContact O-N 3.27Å; V279-E283 VanDerWaalsContact O-N 3.08Å |
| 280 | T | 81.2 | Confident | 79.2 | Confident | 84 Ų | 84 | 44.4 Ų | 44.4 | 52% | 0.515 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -64.5 | -37.4 | 172.3 | -53.2 | 0 | 0 | 0 | 0 | 111.6 | N276 T277 A278 F282 E283 L284 | N276-T280 PolarHBondContact O-N 3.05Å; N276-T280 PolarHBondContact O-OG1 3.46Å; T277-T280 WeakPolarHBondContact O-CB 3.34Å; T277-T280 PolarHBondContact O-N 2.94Å; A278-T280 PolarHBondContact O-N 3.46Å; T280-F282 VanDerWaalsContact C-N 3.31Å; T280-F282 PolarHBondContact O-N 3.26Å; T280-E283 PolarHBondContact O-N 2.87Å; T280-L284 WeakPolarHBondContact O-CB 3.26Å; T280-L284 PolarHBondContact O-N 3.24Å |
| 281 | M | 82.7 | Confident | 79.9 | Confident | 66 Ų | 66 | 45.7 Ų | 45.7 | 33% | 0.325 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -64.7 | -34 | 172.1 | -68 | -63.9 | 102.4 | 0 | 0 | 112.5 | T277 A278 V279 L284 G285 A335 F339 | T277-M281 WeakPolarHBondContact O-CG 3.46Å; T277-M281 PolarHBondContact O-N 3.37Å; A278-M281 WeakPolarHBondContact O-CA 3.21Å; A278-M281 WeakPolarHBondContact O-CB 3.41Å; A278-M281 PolarHBondContact O-N 2.77Å; V279-M281 VanDerWaalsContact C-N 3.32Å; V279-M281 PolarHBondContact O-N 2.81Å; M281-L284 HydrophobicContact CE-CD2 3.84Å; M281-L284 PolarHBondContact O-N 3.02Å; M281-L284 HydrophobicContact SD-CD2 4.15Å; M281-G285 PolarHBondContact O-N 3.01Å; M281-A335 HydrophobicContact CG-CB 4.47Å; M281-F339 HydrophobicContact CB-CB 4.5Å; M281-F339 WeakPolarHBondContact O-CD2 3.4Å |
| 282 | F | 83.7 | Confident | 80.4 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.7 | -45.7 | 171.7 | 168.8 | -94.2 | 0 | 0 | 0 | 112.1 | R253 I256 N257 A278 V279 T280 L284 G285 G286 F338 I341 G342 F346 | R253-F282 HydrophobicContact CG-CE1 4.43Å; R253-F282 HydrophobicContact CG-CZ 4.17Å; I256-F282 HydrophobicContact CB-CE2 4.19Å; I256-F282 HydrophobicContact CB-CZ 4.38Å; I256-F282 HydrophobicContact CG2-CD2 3.76Å; I256-F282 HydrophobicContact CG2-CE2 3.7Å; I256-F282 HydrophobicContact CG2-CG 4.36Å; I256-F282 HydrophobicContact CG2-CZ 4.23Å; N257-F282 HydrophobicContact CB-CE1 4.41Å; A278-F282 PolarHBondContact O-N 3.4Å; V279-F282 WeakPolarHBondContact O-CB 3.4Å; V279-F282 PolarHBondContact O-N 3.48Å; V279-F282 VanDerWaalsContact O-N 3.16Å; T280-F282 VanDerWaalsContact C-N 3.31Å; T280-F282 PolarHBondContact O-N 3.26Å; F282-L284 VanDerWaalsContact C-N 3.34Å; F282-L284 PolarHBondContact O-N 3.43Å; F282-G285 PolarHBondContact O-N 2.93Å; F282-G286 PolarHBondContact O-N 3.41Å; F282-F338 WeakPolarHBondContact CA-O 3.41Å; F282-F338 HydrophobicContact CB-CB 4.25Å; F282-F338 HydrophobicContact CB-CD1 4.14Å; F282-F338 WeakPolarHBondContact CD2-O 3.44Å; F282-I341 HydrophobicContact CD2-CB 4.49Å; F282-I341 HydrophobicContact CD2-CG2 4.17Å; F282-I341 HydrophobicContact CE2-CG2 3.79Å; F282-G342 VanDerWaalsContact CE2-CA 3.44Å; F282-G342 WeakPolarHBondContact O-CA 3.38Å; F282-F346 HydrophobicContact CD1-CE2 4.36Å; F282-F346 AromaticContact CE1-CE2 3.71Å; F282-F346 HydrophobicContact CE1-CE2 3.71Å; F282-F346 HydrophobicContact CE1-CZ 4.38Å; F282-F346 AromaticContact CZ-CE2 3.89Å; F282-F346 HydrophobicContact CZ-CE2 3.89Å |
| 283 | E | 83.9 | Confident | 81.2 | Confident | 46 Ų | 46 | 38.8 Ų | 38.8 | 22% | 0.215 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -64.8 | -38 | 175.2 | -66.7 | -74.6 | 165.3 | 0 | 0 | 111.6 | R253 N257 V279 T280 G286 F287 F346 | R253-E283 IonicContact NH2-OE1 3.38Å; R253-E283 PolarHBondContact NH2-OE1 3.07Å; R253-E283 IonicContact NH2-OE2 3.41Å; R253-E283 PolarHBondContact NH2-OE2 3.45Å; N257-E283 PolarHBondContact ND2-OE1 3.41Å; V279-E283 PolarHBondContact O-N 3.27Å; V279-E283 VanDerWaalsContact O-N 3.08Å; T280-E283 PolarHBondContact O-N 2.87Å; E283-G286 PolarHBondContact O-N 3.08Å; E283-F287 PolarHBondContact O-N 3.31Å; E283-F346 VanDerWaalsContact OE2-CZ 3.24Å; E283-F346 WeakPolarHBondContact OE2-CZ 3.45Å |
| 284 | L | 85.1 | Confident | 81.6 | Confident | 79 Ų | 79 | 34.2 Ų | 34.2 | 41% | 0.414 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -66.2 | -43.2 | 175.7 | -173 | 67.4 | 0 | 0 | 0 | 112.2 | T280 M281 F282 G286 F287 I288 F339 | T280-L284 WeakPolarHBondContact O-CB 3.26Å; T280-L284 PolarHBondContact O-N 3.24Å; M281-L284 HydrophobicContact CE-CD2 3.84Å; M281-L284 PolarHBondContact O-N 3.02Å; M281-L284 HydrophobicContact SD-CD2 4.15Å; F282-L284 VanDerWaalsContact C-N 3.34Å; F282-L284 PolarHBondContact O-N 3.43Å; L284-G286 VanDerWaalsContact C-N 3.27Å; L284-G286 PolarHBondContact O-N 3.12Å; L284-F287 WeakPolarHBondContact O-CB 3.22Å; L284-F287 PolarHBondContact O-N 2.81Å; L284-I288 PolarHBondContact O-N 3.04Å; L284-I288 VanDerWaalsContact O-N 3.13Å; L284-F339 HydrophobicContact CD2-CE2 4.47Å; L284-F339 HydrophobicContact CG-CE2 4.27Å |
| 285 | G | 85.5 | Confident | 82.1 | Confident | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -57.9 | -45 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | M281 F282 F287 I288 G289 F339 F343 | M281-G285 PolarHBondContact O-N 3.01Å; F282-G285 PolarHBondContact O-N 2.93Å; G285-F287 PolarHBondContact O-N 3.43Å; G285-I288 PolarHBondContact O-N 3.44Å; G285-G289 PolarHBondContact O-N 3.49Å; G285-F339 WeakPolarHBondContact CA-O 3.47Å; G285-F343 VanDerWaalsContact C-N 3.32Å; G285-F343 WeakPolarHBondContact O-CA 3.45Å; G285-F343 PolarHBondContact O-N 3.31Å |
| 286 | G | 85.2 | Confident | 82.5 | Confident | 0 Ų | 0 | 39.3 Ų | 39.3 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60.6 | -40.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | F282 E283 L284 G289 A290 G342 F346 | F282-G286 PolarHBondContact O-N 3.41Å; E283-G286 PolarHBondContact O-N 3.08Å; L284-G286 VanDerWaalsContact C-N 3.27Å; L284-G286 PolarHBondContact O-N 3.12Å; G286-G289 PolarHBondContact O-N 3.3Å; G286-A290 WeakPolarHBondContact O-CB 3.36Å; G286-A290 PolarHBondContact O-N 3.3Å; G286-G342 VanDerWaalsContact CA-O 3.22Å; G286-G342 WeakPolarHBondContact CA-O 3.46Å; G286-G342 VanDerWaalsContact N-C 3.35Å; G286-F346 VanDerWaalsContact CA-CD2 3.41Å; G286-F346 WeakPolarHBondContact O-CB 3.24Å |
| 287 | F | 84.7 | Confident | 82.9 | Confident | 63 Ų | 63 | 36 Ų | 36 | 28% | 0.276 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -57.8 | -51.2 | 173.1 | 174.9 | -84.8 | 0 | 0 | 0 | 111.5 | T148 N151 E283 L284 G285 L291 | T148-F287 HydrophobicContact CG2-CD2 4.13Å; T148-F287 HydrophobicContact CG2-CE2 3.43Å; T148-F287 VanDerWaalsContact CG2-CE2 3.43Å; T148-F287 HydrophobicContact CG2-CZ 3.75Å; N151-F287 HydrophobicContact CB-CD2 3.92Å; N151-F287 WeakPolarHBondContact ND2-CD2 3.39Å; E283-F287 PolarHBondContact O-N 3.31Å; L284-F287 WeakPolarHBondContact O-CB 3.22Å; L284-F287 PolarHBondContact O-N 2.81Å; G285-F287 PolarHBondContact O-N 3.43Å; F287-L291 HydrophobicContact CD1-CD1 4.04Å; F287-L291 HydrophobicContact CE1-CD1 3.51Å; F287-L291 HydrophobicContact CZ-CD1 3.92Å; F287-L291 WeakPolarHBondContact O-CG 3.31Å; F287-L291 PolarHBondContact O-N 3.11Å |
| 288 | I | 87.8 | Confident | 82.6 | Confident | 64 Ų | 64 | 34.2 Ų | 34.2 | 33% | 0.328 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -68.9 | -40.5 | -178.9 | -62.1 | 175.8 | 0 | 0 | 0 | 110.2 | L284 G285 A290 L291 V292 F339 F343 | L284-I288 PolarHBondContact O-N 3.04Å; L284-I288 VanDerWaalsContact O-N 3.13Å; G285-I288 PolarHBondContact O-N 3.44Å; I288-A290 PolarHBondContact O-N 3.4Å; I288-L291 PolarHBondContact O-N 3.14Å; I288-V292 HydrophobicContact CG2-CG2 4.29Å; I288-V292 WeakPolarHBondContact O-CG2 3.41Å; I288-V292 PolarHBondContact O-N 3.12Å; I288-F339 HydrophobicContact CD1-CE2 3.99Å; I288-F339 HydrophobicContact CD1-CZ 3.81Å; I288-F343 HydrophobicContact CB-CD2 4.39Å; I288-F343 HydrophobicContact CG2-CD2 4.15Å; I288-F343 HydrophobicContact CG2-CE2 4.02Å |
| 289 | G | 86 | Confident | 82.5 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60.6 | -42.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | G285 G286 L291 V292 A293 F343 | G285-G289 PolarHBondContact O-N 3.49Å; G286-G289 PolarHBondContact O-N 3.3Å; G289-L291 PolarHBondContact O-N 3.38Å; G289-V292 PolarHBondContact O-N 2.85Å; G289-A293 WeakPolarHBondContact O-CB 3.36Å; G289-A293 PolarHBondContact O-N 3.46Å; G289-F343 WeakPolarHBondContact CA-O 3.33Å |
| 290 | A | 85.8 | Confident | 82.3 | Confident | 4 Ų | 4 | 45.7 Ų | 45.7 | 3% | 0.033 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -62.8 | -41.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112.1 | A144 G286 I288 A293 G294 F346 M350 | A144-A290 WeakPolarHBondContact CB-O 3.27Å; G286-A290 WeakPolarHBondContact O-CB 3.36Å; G286-A290 PolarHBondContact O-N 3.3Å; I288-A290 PolarHBondContact O-N 3.4Å; A290-A293 PolarHBondContact O-N 2.96Å; A290-G294 PolarHBondContact O-N 3.39Å; A290-F346 HydrophobicContact CB-CB 4.37Å; A290-M350 HydrophobicContact CB-SD 4.24Å; A290-M350 VanDerWaalsContact O-SD 3.32Å |
| 291 | L | 86.7 | Confident | 81.6 | Confident | 59 Ų | 59 | 44 Ų | 44 | 31% | 0.309 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -62.9 | -47.8 | 176.1 | -70 | 175.7 | 0 | 0 | 0 | 112.1 | A144 T148 F287 I288 G289 G294 W295 | A144-L291 HydrophobicContact CB-CD2 3.96Å; T148-L291 HydrophobicContact CG2-CD1 4.29Å; T148-L291 HydrophobicContact CG2-CD2 3.75Å; T148-L291 HydrophobicContact CG2-CG 4.2Å; F287-L291 HydrophobicContact CD1-CD1 4.04Å; F287-L291 HydrophobicContact CE1-CD1 3.51Å; F287-L291 HydrophobicContact CZ-CD1 3.92Å; F287-L291 WeakPolarHBondContact O-CG 3.31Å; F287-L291 PolarHBondContact O-N 3.11Å; I288-L291 PolarHBondContact O-N 3.14Å; G289-L291 PolarHBondContact O-N 3.38Å; L291-G294 PolarHBondContact O-N 2.85Å; L291-W295 WeakPolarHBondContact O-CB 3.12Å; L291-W295 PolarHBondContact O-N 3.17Å |
| 292 | V | 86.2 | Confident | 80.8 | Confident | 57 Ų | 57 | 47.1 Ų | 47.1 | 35% | 0.345 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -66.5 | -39.4 | 178.1 | 176.1 | 0 | 0 | 0 | 0 | 111.1 | I288 G289 G296 M308 F343 | I288-V292 HydrophobicContact CG2-CG2 4.29Å; I288-V292 WeakPolarHBondContact O-CG2 3.41Å; I288-V292 PolarHBondContact O-N 3.12Å; G289-V292 PolarHBondContact O-N 2.85Å; V292-G296 WeakPolarHBondContact O-CA 3.43Å; V292-G296 PolarHBondContact O-N 2.94Å; V292-M308 HydrophobicContact CG1-CE 4.25Å; V292-M308 WeakPolarHBondContact O-CE 2.9Å; V292-F343 HydrophobicContact CB-CE2 3.99Å; V292-F343 HydrophobicContact CB-CZ 3.86Å; V292-F343 HydrophobicContact CG1-CE2 4.45Å; V292-F343 HydrophobicContact CG1-CZ 3.86Å; V292-F343 HydrophobicContact CG2-CE2 3.88Å; V292-F343 HydrophobicContact CG2-CZ 4.12Å |
| 293 | A | 84.4 | Confident | 79.6 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.5 | -47.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | G289 A290 S297 F312 G347 M350 L351 | G289-A293 WeakPolarHBondContact O-CB 3.36Å; G289-A293 PolarHBondContact O-N 3.46Å; A290-A293 PolarHBondContact O-N 2.96Å; A293-S297 WeakPolarHBondContact O-CB 3.22Å; A293-S297 PolarHBondContact O-N 2.82Å; A293-F312 HydrophobicContact CB-CE1 3.93Å; A293-F312 HydrophobicContact CB-CE2 4.35Å; A293-F312 HydrophobicContact CB-CZ 3.81Å; A293-G347 VanDerWaalsContact CB-CA 3.4Å; A293-M350 HydrophobicContact CB-CE 4.04Å; A293-L351 HydrophobicContact CB-CD1 3.95Å; A293-L351 HydrophobicContact CB-CG 4.2Å |
| 294 | G | 80.9 | Confident | 78.8 | Confident | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.6 | -48.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | A290 L291 D298 M350 | A290-G294 PolarHBondContact O-N 3.39Å; L291-G294 PolarHBondContact O-N 2.85Å; G294-D298 PolarHBondContact O-N 3.34Å; G294-D298 VanDerWaalsContact O-N 3.17Å; G294-M350 VanDerWaalsContact N-CE 3.27Å |
| 295 | W | 82.7 | Confident | 78 | Confident | 151 Ų | 151 | 43.9 Ų | 43.9 | 57% | 0.572 | 22% | 0.216 | S | C | * | . | H | α-helix | trans | -65.6 | -43 | 179.2 | 178.1 | 82.8 | 0 | 0 | 0 | 112.8 | L291 D298 K299 | L291-W295 WeakPolarHBondContact O-CB 3.12Å; L291-W295 PolarHBondContact O-N 3.17Å; W295-D298 PolarHBondContact O-N 3Å; W295-K299 HydrophobicContact CH2-CD 4.01Å; W295-K299 HydrophobicContact CZ2-CD 3.33Å; W295-K299 WeakPolarHBondContact O-CB 3.45Å; W295-K299 PolarHBondContact O-N 3.12Å |
| 296 | G | 79.1 | Confident | 77.1 | Confident | 4 Ų | 4 | 43.9 Ų | 43.9 | 4% | 0.041 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -69.1 | -37.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | V292 D298 L300 | V292-G296 WeakPolarHBondContact O-CA 3.43Å; V292-G296 PolarHBondContact O-N 2.94Å; G296-D298 VanDerWaalsContact C-N 3.29Å; G296-D298 PolarHBondContact O-N 3.44Å; G296-L300 WeakPolarHBondContact O-CA 3.3Å; G296-L300 WeakPolarHBondContact O-CB 3.47Å; G296-L300 PolarHBondContact O-N 3.45Å |
| 297 | S | 78.4 | Confident | 76.5 | Confident | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -61.5 | -38.3 | 172.6 | -177.2 | 0 | 0 | 0 | 0 | 112.4 | A293 G303 R305 | A293-S297 WeakPolarHBondContact O-CB 3.22Å; A293-S297 PolarHBondContact O-N 2.82Å; S297-G303 PolarHBondContact O-N 3.39Å; S297-R305 VanDerWaalsContact OG-CG 3.31Å; S297-R305 WeakPolarHBondContact OG-CG 3.49Å |
| 298 | D | 73.4 | Confident | 76.2 | Confident | 20 Ų | 20 | 42.8 Ų | 42.8 | 11% | 0.107 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -75 | -46.5 | 179.8 | -74.6 | -7 | 0 | 0 | 0 | 111.7 | E138 G140 G141 G294 W295 G296 N302 | E138-D298 WeakPolarHBondContact CA-OD2 3.25Å; G140-D298 VanDerWaalsContact CA-CG 3.46Å; G140-D298 WeakPolarHBondContact CA-OD1 3.49Å; G140-D298 WeakPolarHBondContact CA-OD2 3.22Å; G140-D298 PolarHBondContact N-OD1 2.92Å; G140-D298 PolarHBondContact N-OD2 3.47Å; G141-D298 PolarHBondContact N-OD2 2.88Å; G294-D298 PolarHBondContact O-N 3.34Å; G294-D298 VanDerWaalsContact O-N 3.17Å; W295-D298 PolarHBondContact O-N 3Å; G296-D298 VanDerWaalsContact C-N 3.29Å; G296-D298 PolarHBondContact O-N 3.44Å; D298-N302 WeakPolarHBondContact O-CA 3.42Å; D298-N302 PolarHBondContact O-N 3.29Å |
| 299 | K | 73.9 | Confident | 75.5 | Confident | 142 Ų | 142 | 39.9 Ų | 39.9 | 62% | 0.617 | 20% | 0.2 | S | C | * | . | H | α-helix | trans | -91.7 | -39.3 | -169.9 | -164.6 | -178.9 | -177 | -176.8 | 0 | 114.5 | W295 | W295-K299 HydrophobicContact CH2-CD 4.01Å; W295-K299 HydrophobicContact CZ2-CD 3.33Å; W295-K299 WeakPolarHBondContact O-CB 3.45Å; W295-K299 PolarHBondContact O-N 3.12Å |
| 300 | L | 70.5 | Confident | 75 | Confident | 120 Ų | 120 | 42.1 Ų | 42.1 | 63% | 0.628 | 21% | 0.212 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -83.2 | -32.5 | -176.1 | -170 | 62.5 | 0 | 0 | 0 | 111.6 | G296 | G296-L300 WeakPolarHBondContact O-CA 3.3Å; G296-L300 WeakPolarHBondContact O-CB 3.47Å; G296-L300 PolarHBondContact O-N 3.45Å |
| 301 | F | 67.3 | Low | 74.7 | Confident | 49 Ų | 49 | 45.9 Ų | 45.9 | 22% | 0.215 | 23% | 0.23 | C | C | . | . | S | Bend | trans | -118.7 | 13.5 | -174.2 | -61.7 | -66.7 | 0 | 0 | 0 | 114 | G303 N304 P307 M308 I311 | F301-G303 PolarHBondContact O-N 2.94Å; F301-G303 VanDerWaalsContact O-N 3.08Å; F301-N304 HydrophobicContact CB-CB 4.11Å; F301-N304 WeakPolarHBondContact CB-O 3.34Å; F301-N304 WeakPolarHBondContact O-CB 3.19Å; F301-N304 PolarHBondContact O-N 3.22Å; F301-P307 HydrophobicContact CD1-CB 3.51Å; F301-P307 HydrophobicContact CD1-CG 3.81Å; F301-P307 HydrophobicContact CD2-CB 4.05Å; F301-P307 HydrophobicContact CE1-CB 3.36Å; F301-P307 HydrophobicContact CE1-CG 4.1Å; F301-P307 HydrophobicContact CE2-CB 3.9Å; F301-P307 HydrophobicContact CG-CB 3.86Å; F301-P307 HydrophobicContact CG-CG 4.18Å; F301-P307 HydrophobicContact CZ-CB 3.57Å; F301-M308 HydrophobicContact CD2-CB 4.03Å; F301-M308 HydrophobicContact CE2-CB 4.13Å; F301-M308 HydrophobicContact CE2-SD 4.08Å; F301-I311 HydrophobicContact CE2-CD1 3.92Å; F301-I311 HydrophobicContact CZ-CD1 3.66Å |
| 302 | N | 64.7 | Low | 74.3 | Confident | 131 Ų | 131 | 43.3 Ų | 43.3 | 70% | 0.701 | 22% | 0.217 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 50.2 | 34.7 | 177.5 | -68.1 | -37.7 | 0 | 0 | 0 | 114.1 | D298 | D298-N302 WeakPolarHBondContact O-CA 3.42Å; D298-N302 PolarHBondContact O-N 3.29Å |
| 303 | G | 59.7 | Low | 73.8 | Confident | 12 Ų | 12 | 40.6 Ų | 40.6 | 12% | 0.124 | 20% | 0.2 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 95.6 | -7.5 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | S297 F301 R305 | S297-G303 PolarHBondContact O-N 3.39Å; F301-G303 PolarHBondContact O-N 2.94Å; F301-G303 VanDerWaalsContact O-N 3.08Å; G303-R305 PolarHBondContact O-N 2.96Å |
| 304 | N | 67.2 | Low | 73.5 | Confident | 44 Ų | 44 | 42.6 Ų | 42.6 | 24% | 0.235 | 22% | 0.217 | C | C | . | . | trans | -72.3 | 114.2 | 171.5 | -77.1 | -23.2 | 0 | 0 | 0 | 110.3 | F301 P307 Q421 | F301-N304 HydrophobicContact CB-CB 4.11Å; F301-N304 WeakPolarHBondContact CB-O 3.34Å; F301-N304 WeakPolarHBondContact O-CB 3.19Å; F301-N304 PolarHBondContact O-N 3.22Å; N304-P307 HydrophobicContact CB-CG 4.41Å; N304-Q421 PolarHBondContact OD1-O 2.79Å; N304-Q421 VanDerWaalsContact OD1-O 3.08Å | ||
| 305 | R | 68.2 | Low | 73.5 | Confident | 1 Ų | 1 | 42.9 Ų | 42.9 | 0% | 0.004 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -87.8 | -25.5 | -175.5 | -66.1 | 173.8 | -178.5 | 160.7 | 8.1 | 112.8 | S297 G303 M308 N309 L351 M354 E358 | S297-R305 VanDerWaalsContact OG-CG 3.31Å; S297-R305 WeakPolarHBondContact OG-CG 3.49Å; G303-R305 PolarHBondContact O-N 2.96Å; R305-M308 PolarHBondContact O-N 2.88Å; R305-N309 WeakPolarHBondContact O-CB 3.22Å; R305-N309 PolarHBondContact O-N 2.89Å; R305-L351 HydrophobicContact CG-CD2 4.22Å; R305-M354 PolarHBondContact NE-SD 2.88Å; R305-M354 VanDerWaalsContact NH1-CB 3.33Å; R305-M354 PolarHBondContact NH1-O 3.39Å; R305-M354 VanDerWaalsContact NH2-CG 3.35Å; R305-M354 PolarHBondContact NH2-SD 2.82Å; R305-E358 IonicContact CZ-OE1 3.22Å; R305-E358 VanDerWaalsContact CZ-OE1 3.24Å; R305-E358 IonicContact CZ-OE2 3.48Å; R305-E358 IonicContact NE-OE2 3.92Å; R305-E358 VanDerWaalsContact NH1-CG 3.32Å; R305-E358 IonicContact NH1-OE1 3.6Å; R305-E358 PolarHBondContact NH1-OE1 3.45Å; R305-E358 IonicContact NH1-OE2 3.98Å; R305-E358 PolarHBondContact NH1-OE2 3.3Å; R305-E358 IonicContact NH2-OE1 2.89Å; R305-E358 PolarHBondContact NH2-OE1 3.16Å; R305-E358 IonicContact NH2-OE2 3.84Å; R305-E358 PolarHBondContact NH2-OE2 3Å |
| 306 | G | 66.7 | Low | 73.3 | Confident | 1 Ų | 1 | 35.7 Ų | 35.7 | 1% | 0.01 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -50.5 | -54.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | M308 N309 L310 | G306-M308 PolarHBondContact O-N 3.24Å; G306-N309 WeakPolarHBondContact O-CB 3.5Å; G306-N309 PolarHBondContact O-N 2.99Å; G306-L310 PolarHBondContact O-N 3.38Å |
| 307 | P | 73.1 | Confident | 73.2 | Confident | 29 Ų | 29 | 38.5 Ų | 38.5 | 19% | 0.188 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -62.2 | -42.5 | -177.8 | -25.3 | 34.7 | 0 | 0 | 0 | 113.3 | F301 N304 N309 L310 I311 L418 | F301-P307 HydrophobicContact CD1-CB 3.51Å; F301-P307 HydrophobicContact CD1-CG 3.81Å; F301-P307 HydrophobicContact CD2-CB 4.05Å; F301-P307 HydrophobicContact CE1-CB 3.36Å; F301-P307 HydrophobicContact CE1-CG 4.1Å; F301-P307 HydrophobicContact CE2-CB 3.9Å; F301-P307 HydrophobicContact CG-CB 3.86Å; F301-P307 HydrophobicContact CG-CG 4.18Å; F301-P307 HydrophobicContact CZ-CB 3.57Å; N304-P307 HydrophobicContact CB-CG 4.41Å; P307-N309 VanDerWaalsContact C-N 3.34Å; P307-N309 PolarHBondContact O-N 3.39Å; P307-L310 PolarHBondContact O-N 2.96Å; P307-I311 WeakPolarHBondContact O-CG1 3.46Å; P307-I311 PolarHBondContact O-N 3.48Å; P307-L418 HydrophobicContact CB-CD2 4.15Å; P307-L418 HydrophobicContact CG-CD2 3.81Å |
| 308 | M | 76.4 | Confident | 73.2 | Confident | 11 Ų | 11 | 44.4 Ų | 44.4 | 5% | 0.054 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -65.6 | -40 | 178.6 | -165.3 | 61 | 159.8 | 0 | 0 | 111.5 | V292 F301 R305 G306 L310 I311 F312 L351 | V292-M308 HydrophobicContact CG1-CE 4.25Å; V292-M308 WeakPolarHBondContact O-CE 2.9Å; F301-M308 HydrophobicContact CD2-CB 4.03Å; F301-M308 HydrophobicContact CE2-CB 4.13Å; F301-M308 HydrophobicContact CE2-SD 4.08Å; R305-M308 PolarHBondContact O-N 2.88Å; G306-M308 PolarHBondContact O-N 3.24Å; M308-L310 VanDerWaalsContact C-N 3.33Å; M308-L310 PolarHBondContact O-N 3.44Å; M308-I311 PolarHBondContact O-N 2.85Å; M308-F312 HydrophobicContact CE-CD2 4.32Å; M308-F312 HydrophobicContact CE-CE2 3.42Å; M308-F312 VanDerWaalsContact CE-CE2 3.42Å; M308-F312 HydrophobicContact CE-CZ 4.04Å; M308-F312 HydrophobicContact CG-CD2 4.25Å; M308-F312 HydrophobicContact CG-CE2 4.21Å; M308-F312 VanDerWaalsContact O-CD2 3.26Å; M308-F312 WeakPolarHBondContact O-CD2 3.42Å; M308-F312 PolarHBondContact O-N 3.39Å; M308-F312 HydrophobicContact SD-CD2 4.13Å; M308-F312 HydrophobicContact SD-CE2 3.78Å; M308-L351 HydrophobicContact CB-CD1 3.85Å; M308-L351 HydrophobicContact CG-CD1 3.67Å |
| 309 | N | 75.1 | Confident | 73.3 | Confident | 2 Ų | 2 | 44 Ų | 44 | 1% | 0.011 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -60.4 | -41.1 | 173.5 | -90 | -6.3 | 0 | 0 | 0 | 112.6 | R305 G306 P307 F312 A313 P348 L351 L414 | R305-N309 WeakPolarHBondContact O-CB 3.22Å; R305-N309 PolarHBondContact O-N 2.89Å; G306-N309 WeakPolarHBondContact O-CB 3.5Å; G306-N309 PolarHBondContact O-N 2.99Å; P307-N309 VanDerWaalsContact C-N 3.34Å; P307-N309 PolarHBondContact O-N 3.39Å; N309-F312 PolarHBondContact O-N 3.11Å; N309-A313 WeakPolarHBondContact O-CB 3.47Å; N309-A313 PolarHBondContact O-N 3.42Å; N309-P348 WeakPolarHBondContact OD1-CA 3.3Å; N309-L351 WeakPolarHBondContact OD1-CB 3.47Å; N309-L351 WeakPolarHBondContact OD1-CD1 3.49Å; N309-L414 HydrophobicContact CB-CD1 4.04Å; N309-L414 HydrophobicContact CB-CD2 4.14Å |
| 310 | L | 75.4 | Confident | 73.2 | Confident | 48 Ų | 48 | 37.3 Ų | 37.3 | 25% | 0.251 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -68.3 | -42.4 | 178.8 | -171.4 | 73.1 | 0 | 0 | 0 | 112 | G306 P307 M308 F312 A313 A314 L415 L418 | G306-L310 PolarHBondContact O-N 3.38Å; P307-L310 PolarHBondContact O-N 2.96Å; M308-L310 VanDerWaalsContact C-N 3.33Å; M308-L310 PolarHBondContact O-N 3.44Å; L310-F312 PolarHBondContact O-N 3.39Å; L310-A313 PolarHBondContact O-N 3.49Å; L310-A314 WeakPolarHBondContact O-CB 3.39Å; L310-A314 PolarHBondContact O-N 3.47Å; L310-L415 HydrophobicContact CD1-CD2 3.72Å; L310-L415 HydrophobicContact CD1-CG 4.22Å; L310-L415 HydrophobicContact CD2-CD2 3.9Å; L310-L415 HydrophobicContact CG-CD2 4.48Å; L310-L418 HydrophobicContact CD2-CD1 4.1Å |
| 311 | I | 79.7 | Confident | 73.3 | Confident | 83 Ų | 83 | 32.5 Ų | 32.5 | 43% | 0.426 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -57.7 | -43.7 | 175.6 | -69.8 | 167.8 | 0 | 0 | 0 | 110 | F301 P307 M308 G315 | F301-I311 HydrophobicContact CE2-CD1 3.92Å; F301-I311 HydrophobicContact CZ-CD1 3.66Å; P307-I311 WeakPolarHBondContact O-CG1 3.46Å; P307-I311 PolarHBondContact O-N 3.48Å; M308-I311 PolarHBondContact O-N 2.85Å; I311-G315 PolarHBondContact O-N 3.38Å |
| 312 | F | 77 | Confident | 73.5 | Confident | 4 Ų | 4 | 32.9 Ų | 32.9 | 2% | 0.018 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -70.6 | -39.8 | 178.5 | -83.7 | -117.4 | 0 | 0 | 0 | 111.8 | A293 M308 N309 L310 A314 G315 I316 F343 F344 P348 | A293-F312 HydrophobicContact CB-CE1 3.93Å; A293-F312 HydrophobicContact CB-CE2 4.35Å; A293-F312 HydrophobicContact CB-CZ 3.81Å; M308-F312 HydrophobicContact CE-CD2 4.32Å; M308-F312 HydrophobicContact CE-CE2 3.42Å; M308-F312 VanDerWaalsContact CE-CE2 3.42Å; M308-F312 HydrophobicContact CE-CZ 4.04Å; M308-F312 HydrophobicContact CG-CD2 4.25Å; M308-F312 HydrophobicContact CG-CE2 4.21Å; M308-F312 VanDerWaalsContact O-CD2 3.26Å; M308-F312 WeakPolarHBondContact O-CD2 3.42Å; M308-F312 PolarHBondContact O-N 3.39Å; M308-F312 HydrophobicContact SD-CD2 4.13Å; M308-F312 HydrophobicContact SD-CE2 3.78Å; N309-F312 PolarHBondContact O-N 3.11Å; L310-F312 PolarHBondContact O-N 3.39Å; F312-A314 VanDerWaalsContact C-N 3.33Å; F312-A314 PolarHBondContact O-N 3.44Å; F312-G315 CarbonylContact O-C 3.54Å; F312-G315 WeakPolarHBondContact O-CA 3.25Å; F312-G315 PolarHBondContact O-N 3.27Å; F312-G315 VanDerWaalsContact O-N 3.08Å; F312-I316 WeakPolarHBondContact O-CG1 3.39Å; F312-I316 PolarHBondContact O-N 2.9Å; F312-F343 HydrophobicContact CE1-CD1 4.12Å; F312-F343 AromaticContact CE1-CE1 3.91Å; F312-F343 HydrophobicContact CE1-CE1 3.91Å; F312-F343 WeakPolarHBondContact CE1-O 3.22Å; F312-F343 HydrophobicContact CZ-CD1 4.39Å; F312-F343 AromaticContact CZ-CE1 3.72Å; F312-F343 HydrophobicContact CZ-CE1 3.72Å; F312-F343 HydrophobicContact CZ-CZ 4.11Å; F312-F344 HydrophobicContact CB-CD1 4.35Å; F312-F344 AromaticContact CD1-CD1 3.96Å; F312-F344 HydrophobicContact CD1-CD1 3.96Å; F312-F344 WeakPolarHBondContact CD1-O 3.1Å; F312-F344 HydrophobicContact CE1-CD1 4.39Å; F312-F344 HydrophobicContact CG-CD1 4.06Å; F312-P348 HydrophobicContact CB-CG 3.44Å; F312-P348 VanDerWaalsContact CB-CG 3.44Å; F312-P348 HydrophobicContact CG-CG 4.36Å |
| 313 | A | 75.8 | Confident | 73.7 | Confident | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.6 | -40.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | N309 L310 G315 I316 L317 A411 L414 | N309-A313 WeakPolarHBondContact O-CB 3.47Å; N309-A313 PolarHBondContact O-N 3.42Å; L310-A313 PolarHBondContact O-N 3.49Å; A313-G315 VanDerWaalsContact C-N 3.34Å; A313-I316 PolarHBondContact O-N 3.5Å; A313-L317 PolarHBondContact O-N 3.33Å; A313-A411 HydrophobicContact CB-CB 3.68Å; A313-L414 HydrophobicContact CB-CD1 4.23Å |
| 314 | A | 78.9 | Confident | 74.1 | Confident | 42 Ų | 42 | 33.3 Ų | 33.3 | 35% | 0.347 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -62.9 | -40.9 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | L310 F312 L317 L318 | L310-A314 WeakPolarHBondContact O-CB 3.39Å; L310-A314 PolarHBondContact O-N 3.47Å; F312-A314 VanDerWaalsContact C-N 3.33Å; F312-A314 PolarHBondContact O-N 3.44Å; A314-L317 PolarHBondContact O-N 3.49Å; A314-L318 WeakPolarHBondContact O-CB 3.37Å; A314-L318 VanDerWaalsContact O-CG 3.31Å; A314-L318 WeakPolarHBondContact O-CG 3.43Å; A314-L318 PolarHBondContact O-N 3.16Å |
| 315 | G | 79.9 | Confident | 74.1 | Confident | 6 Ų | 6 | 37.3 Ų | 37.3 | 6% | 0.062 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.7 | -39 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | I311 F312 A313 S319 | I311-G315 PolarHBondContact O-N 3.38Å; F312-G315 CarbonylContact O-C 3.54Å; F312-G315 WeakPolarHBondContact O-CA 3.25Å; F312-G315 PolarHBondContact O-N 3.27Å; F312-G315 VanDerWaalsContact O-N 3.08Å; A313-G315 VanDerWaalsContact C-N 3.34Å; G315-S319 VanDerWaalsContact O-CB 3.24Å; G315-S319 WeakPolarHBondContact O-CB 3.19Å; G315-S319 PolarHBondContact O-N 3.31Å; G315-S319 PolarHBondContact O-OG 2.6Å |
| 316 | I | 78 | Confident | 73.7 | Confident | 1 Ų | 1 | 42.4 Ų | 42.4 | 1% | 0.005 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.4 | -51.5 | 173.3 | -63.4 | 171.5 | 0 | 0 | 0 | 109.4 | V252 F312 A313 L318 S319 V320 F344 V345 P348 A407 | V252-I316 HydrophobicContact CG1-CG2 4.08Å; F312-I316 WeakPolarHBondContact O-CG1 3.39Å; F312-I316 PolarHBondContact O-N 2.9Å; A313-I316 PolarHBondContact O-N 3.5Å; I316-L318 VanDerWaalsContact C-N 3.32Å; I316-L318 PolarHBondContact O-N 3.07Å; I316-S319 PolarHBondContact O-N 3.27Å; I316-S319 VanDerWaalsContact O-N 3.17Å; I316-V320 HydrophobicContact CG2-CG2 4.04Å; I316-V320 WeakPolarHBondContact O-CB 3.35Å; I316-V320 VanDerWaalsContact O-CG2 3.28Å; I316-V320 WeakPolarHBondContact O-CG2 3.43Å; I316-V320 PolarHBondContact O-N 2.93Å; I316-F344 WeakPolarHBondContact CD1-O 3.41Å; I316-F344 HydrophobicContact CG1-CB 3.72Å; I316-F344 WeakPolarHBondContact CG1-O 3.36Å; I316-V345 HydrophobicContact CD1-CG2 3.96Å; I316-V345 HydrophobicContact CG1-CG2 3.93Å; I316-V345 HydrophobicContact CG2-CG2 4.4Å; I316-P348 HydrophobicContact CD1-CG 4.23Å; I316-A407 HydrophobicContact CB-CB 4.46Å; I316-A407 HydrophobicContact CG2-CB 3.65Å |
| 317 | L | 78.8 | Confident | 73.4 | Confident | 63 Ų | 63 | 47.3 Ų | 47.3 | 33% | 0.33 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -55.8 | -46.5 | 179 | -82.1 | 171.2 | 0 | 0 | 0 | 112.1 | A313 A314 G321 A407 A411 | A313-L317 PolarHBondContact O-N 3.33Å; A314-L317 PolarHBondContact O-N 3.49Å; L317-G321 PolarHBondContact O-N 2.95Å; L317-A407 HydrophobicContact CD2-CB 3.8Å; L317-A407 HydrophobicContact CG-CB 4.07Å; L317-A411 HydrophobicContact CD1-CB 4.16Å |
| 318 | L | 78.3 | Confident | 72.7 | Confident | 124 Ų | 124 | 47.8 Ų | 47.8 | 65% | 0.649 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -65.6 | -40.4 | 177.8 | -72.3 | 172.5 | 0 | 0 | 0 | 112 | A314 I316 S322 | A314-L318 WeakPolarHBondContact O-CB 3.37Å; A314-L318 VanDerWaalsContact O-CG 3.31Å; A314-L318 WeakPolarHBondContact O-CG 3.43Å; A314-L318 PolarHBondContact O-N 3.16Å; I316-L318 VanDerWaalsContact C-N 3.32Å; I316-L318 PolarHBondContact O-N 3.07Å; L318-S322 WeakPolarHBondContact O-CB 3.48Å; L318-S322 PolarHBondContact O-N 2.72Å; L318-S322 PolarHBondContact O-OG 3.48Å |
| 319 | S | 74.8 | Confident | 71.9 | Confident | 10 Ų | 10 | 52 Ų | 52 | 7% | 0.07 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -72.2 | -39.9 | -178 | -55.9 | 0 | 0 | 0 | 0 | 112.1 | G315 I316 S322 L323 I341 F344 | G315-S319 VanDerWaalsContact O-CB 3.24Å; G315-S319 WeakPolarHBondContact O-CB 3.19Å; G315-S319 PolarHBondContact O-N 3.31Å; G315-S319 PolarHBondContact O-OG 2.6Å; I316-S319 PolarHBondContact O-N 3.27Å; I316-S319 VanDerWaalsContact O-N 3.17Å; S319-S322 PolarHBondContact O-N 3.46Å; S319-L323 PolarHBondContact O-N 3.05Å; S319-L323 VanDerWaalsContact O-N 3.13Å; S319-I341 VanDerWaalsContact CB-CG1 3.44Å; S319-F344 WeakPolarHBondContact OG-CD2 3.35Å |
| 320 | V | 72.8 | Confident | 71.8 | Confident | 2 Ų | 2 | 54.4 Ų | 54.4 | 1% | 0.012 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -67.6 | -43.1 | 173.4 | 176.6 | 0 | 0 | 0 | 0 | 110.3 | I316 S322 L323 W324 I403 S404 | I316-V320 HydrophobicContact CG2-CG2 4.04Å; I316-V320 WeakPolarHBondContact O-CB 3.35Å; I316-V320 VanDerWaalsContact O-CG2 3.28Å; I316-V320 WeakPolarHBondContact O-CG2 3.43Å; I316-V320 PolarHBondContact O-N 2.93Å; V320-S322 VanDerWaalsContact C-N 3.25Å; V320-S322 PolarHBondContact O-N 3.31Å; V320-L323 PolarHBondContact O-N 3.31Å; V320-W324 PolarHBondContact O-N 2.91Å; V320-I403 HydrophobicContact CB-CG2 4.5Å; V320-I403 HydrophobicContact CG1-CB 4.45Å; V320-I403 HydrophobicContact CG1-CG2 3.86Å; V320-I403 HydrophobicContact CG2-CG2 3.78Å; V320-S404 VanDerWaalsContact CG1-OG 3.25Å; V320-S404 WeakPolarHBondContact CG1-OG 3.47Å |
| 321 | G | 72.7 | Confident | 71.5 | Confident | 20 Ų | 20 | 55.9 Ų | 55.9 | 21% | 0.206 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -59.6 | -36.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L317 W324 L325 | L317-G321 PolarHBondContact O-N 2.95Å; G321-W324 PolarHBondContact O-N 2.74Å; G321-L325 WeakPolarHBondContact O-CB 3.46Å; G321-L325 VanDerWaalsContact O-CG 3.3Å; G321-L325 WeakPolarHBondContact O-CG 3.29Å; G321-L325 PolarHBondContact O-N 2.84Å |
| 322 | S | 70.9 | Confident | 71.4 | Confident | 57 Ų | 57 | 57 Ų | 57 | 40% | 0.399 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -67.3 | -39.1 | 176.2 | -59.5 | 0 | 0 | 0 | 0 | 112.6 | L318 S319 V320 W324 M326 | L318-S322 WeakPolarHBondContact O-CB 3.48Å; L318-S322 PolarHBondContact O-N 2.72Å; L318-S322 PolarHBondContact O-OG 3.48Å; S319-S322 PolarHBondContact O-N 3.46Å; V320-S322 VanDerWaalsContact C-N 3.25Å; V320-S322 PolarHBondContact O-N 3.31Å; S322-W324 VanDerWaalsContact C-N 3.32Å; S322-M326 PolarHBondContact O-N 3.02Å |
| 323 | L | 69 | Low | 71.3 | Confident | 11 Ų | 11 | 60.4 Ų | 60.4 | 6% | 0.058 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -64.3 | -37.5 | 172.5 | -79.5 | -174.2 | 0 | 0 | 0 | 112.3 | S319 V320 C337 I341 F400 | S319-L323 PolarHBondContact O-N 3.05Å; S319-L323 VanDerWaalsContact O-N 3.13Å; V320-L323 PolarHBondContact O-N 3.31Å; L323-C337 HydrophobicContact CD2-CB 3.51Å; L323-C337 HydrophobicContact CG-CB 4.14Å; L323-I341 HydrophobicContact CD1-CD1 3.19Å; L323-I341 HydrophobicContact CG-CD1 3.84Å; L323-F400 HydrophobicContact CB-CE1 4.23Å; L323-F400 HydrophobicContact CD1-CE1 4.24Å |
| 324 | W | 67.7 | Low | 71.1 | Confident | 141 Ų | 141 | 60.6 Ų | 60.6 | 53% | 0.534 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -75.7 | -41 | -177.8 | -174.3 | 58.1 | 0 | 0 | 0 | 113 | V320 G321 S322 F400 | V320-W324 PolarHBondContact O-N 2.91Å; G321-W324 PolarHBondContact O-N 2.74Å; S322-W324 VanDerWaalsContact C-N 3.32Å; W324-F400 HydrophobicContact CB-CB 4.46Å; W324-F400 HydrophobicContact CG-CB 4.3Å |
| 325 | L | 66.7 | Low | 70.9 | Confident | 128 Ų | 128 | 59.2 Ų | 59.2 | 67% | 0.67 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -77.7 | -20.8 | -177.7 | -70.2 | 170.5 | 0 | 0 | 0 | 113.5 | G321 | G321-L325 WeakPolarHBondContact O-CB 3.46Å; G321-L325 VanDerWaalsContact O-CG 3.3Å; G321-L325 WeakPolarHBondContact O-CG 3.29Å; G321-L325 PolarHBondContact O-N 2.84Å |
| 326 | M | 60.3 | Low | 71 | Confident | 108 Ų | 108 | 62.6 Ų | 62.6 | 53% | 0.532 | 35% | 0.353 | S | S | . | . | trans | -134 | 96.4 | -178.3 | -69.1 | -168.1 | 170.9 | 0 | 0 | 110.9 | S322 F328 | S322-M326 PolarHBondContact O-N 3.02Å; M326-F328 HydrophobicContact CB-CD1 3.88Å; M326-F328 HydrophobicContact CB-CD2 3.8Å; M326-F328 HydrophobicContact CB-CE1 3.57Å; M326-F328 HydrophobicContact CB-CE2 3.43Å; M326-F328 VanDerWaalsContact CB-CE2 3.43Å; M326-F328 HydrophobicContact CB-CG 4.04Å; M326-F328 HydrophobicContact CB-CZ 3.35Å; M326-F328 HydrophobicContact CG-CE1 3.98Å; M326-F328 HydrophobicContact CG-CE2 4.35Å; M326-F328 HydrophobicContact CG-CZ 3.82Å; M326-F328 VanDerWaalsContact O-CD2 3.24Å; M326-F328 WeakPolarHBondContact O-CD2 3.46Å; M326-F328 PolarHBondContact O-N 3.29Å; M326-F328 HydrophobicContact SD-CD1 4.31Å; M326-F328 HydrophobicContact SD-CE1 3.23Å; M326-F328 WeakPolarHBondContact SD-CE1 3.33Å; M326-F328 HydrophobicContact SD-CE2 4.2Å; M326-F328 HydrophobicContact SD-CZ 3.17Å; M326-F328 WeakPolarHBondContact SD-CZ 3.36Å | ||
| 327 | P | 59.5 | Low | 71.1 | Confident | 103 Ų | 103 | 63.1 Ų | 63.1 | 67% | 0.669 | 36% | 0.357 | S | S | * | . | trans | -67.2 | 81.6 | 162.8 | 27.5 | -31.3 | 0 | 0 | 0 | 108.3 | A329 | P327-A329 PolarHBondContact O-N 2.86Š| ||
| 328 | F | 59.4 | Low | 71.2 | Confident | 40 Ų | 40 | 60.3 Ų | 60.3 | 18% | 0.175 | 34% | 0.342 | C | S | . | . | trans | -68.2 | 128.4 | -179.2 | -67.3 | -66.1 | 0 | 0 | 0 | 110.5 | M326 S330 M333 Q334 | M326-F328 HydrophobicContact CB-CD1 3.88Å; M326-F328 HydrophobicContact CB-CD2 3.8Å; M326-F328 HydrophobicContact CB-CE1 3.57Å; M326-F328 HydrophobicContact CB-CE2 3.43Å; M326-F328 VanDerWaalsContact CB-CE2 3.43Å; M326-F328 HydrophobicContact CB-CG 4.04Å; M326-F328 HydrophobicContact CB-CZ 3.35Å; M326-F328 HydrophobicContact CG-CE1 3.98Å; M326-F328 HydrophobicContact CG-CE2 4.35Å; M326-F328 HydrophobicContact CG-CZ 3.82Å; M326-F328 VanDerWaalsContact O-CD2 3.24Å; M326-F328 WeakPolarHBondContact O-CD2 3.46Å; M326-F328 PolarHBondContact O-N 3.29Å; M326-F328 HydrophobicContact SD-CD1 4.31Å; M326-F328 HydrophobicContact SD-CE1 3.23Å; M326-F328 WeakPolarHBondContact SD-CE1 3.33Å; M326-F328 HydrophobicContact SD-CE2 4.2Å; M326-F328 HydrophobicContact SD-CZ 3.17Å; M326-F328 WeakPolarHBondContact SD-CZ 3.36Å; F328-S330 VanDerWaalsContact C-N 3.31Å; F328-S330 PolarHBondContact O-N 3.46Å; F328-M333 HydrophobicContact CB-CB 4.34Å; F328-M333 HydrophobicContact CB-CE 3.96Å; F328-M333 HydrophobicContact CB-CG 4.21Å; F328-M333 HydrophobicContact CD1-CE 3.08Å; F328-M333 HydrophobicContact CD1-CG 3.99Å; F328-M333 HydrophobicContact CD1-SD 3.61Å; F328-M333 HydrophobicContact CD2-CG 3.85Å; F328-M333 HydrophobicContact CD2-SD 4.44Å; F328-M333 HydrophobicContact CE1-CE 3.53Å; F328-M333 HydrophobicContact CE1-CG 4.16Å; F328-M333 HydrophobicContact CE1-SD 3.48Å; F328-M333 WeakPolarHBondContact CE1-SD 3.34Å; F328-M333 HydrophobicContact CE2-CG 4.06Å; F328-M333 HydrophobicContact CE2-SD 4.37Å; F328-M333 HydrophobicContact CG-CB 4.43Å; F328-M333 HydrophobicContact CG-CE 3.67Å; F328-M333 HydrophobicContact CG-CG 3.77Å; F328-M333 HydrophobicContact CG-SD 4.05Å; F328-M333 HydrophobicContact CZ-CE 4.44Å; F328-M333 HydrophobicContact CZ-CG 4.18Å; F328-M333 HydrophobicContact CZ-SD 3.88Å; F328-Q334 HydrophobicContact CB-CG 4.39Å; F328-Q334 PolarHBondContact O-NE2 3.45Å | ||
| 329 | A | 60.1 | Low | 71.4 | Confident | 98 Ų | 98 | 57.1 Ų | 57.1 | 81% | 0.81 | 32% | 0.323 | S | S | * | . | trans | -75.8 | -14.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114 | P327 | P327-A329 PolarHBondContact O-N 2.86Š| ||
| 330 | S | 71.5 | Confident | 71.9 | Confident | 54 Ų | 54 | 58.8 Ų | 58.8 | 38% | 0.378 | 33% | 0.333 | S | S | . | . | trans | -96 | 129.2 | -175.7 | 71.5 | 0 | 0 | 0 | 0 | 112.8 | F328 V332 M333 Q334 | F328-S330 VanDerWaalsContact C-N 3.31Å; F328-S330 PolarHBondContact O-N 3.46Å; S330-V332 VanDerWaalsContact C-N 3.3Å; S330-V332 PolarHBondContact O-N 2.96Å; S330-M333 PolarHBondContact O-N 3.4Å; S330-M333 WeakPolarHBondContact OG-CB 3.39Å; S330-Q334 PolarHBondContact O-N 3.27Å | ||
| 331 | Y | 70.7 | Confident | 72.3 | Confident | 79 Ų | 79 | 58.7 Ų | 58.7 | 31% | 0.31 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -54.5 | -42.2 | 177.4 | 172.7 | -105.8 | 0 | 0 | 0 | 113.1 | T274 T277 A278 M333 Q334 A335 | T274-Y331 HydrophobicContact CG2-CD2 3.49Å; T274-Y331 VanDerWaalsContact CG2-CD2 3.49Å; T274-Y331 HydrophobicContact CG2-CE1 4.35Å; T274-Y331 HydrophobicContact CG2-CE2 3.19Å; T274-Y331 HydrophobicContact CG2-CG 4.21Å; T274-Y331 WeakPolarHBondContact O-CE2 3.25Å; T274-Y331 PolarHBondContact O-OH 2.88Å; T277-Y331 WeakPolarHBondContact CB-OH 3.46Å; T277-Y331 PolarHBondContact OG1-OH 2.86Å; A278-Y331 HydrophobicContact CB-CE2 4.38Å; Y331-M333 VanDerWaalsContact C-N 3.34Å; Y331-M333 PolarHBondContact O-N 3.35Å; Y331-Q334 PolarHBondContact O-N 2.93Å; Y331-A335 WeakPolarHBondContact O-CB 3.34Å; Y331-A335 PolarHBondContact O-N 2.83Å |
| 332 | V | 77.2 | Confident | 72.8 | Confident | 106 Ų | 106 | 57.8 Ų | 57.8 | 64% | 0.642 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -62.8 | -40.3 | -178.6 | 179 | 0 | 0 | 0 | 0 | 111.8 | S330 A335 T336 | S330-V332 VanDerWaalsContact C-N 3.3Å; S330-V332 PolarHBondContact O-N 2.96Å; V332-A335 PolarHBondContact O-N 3.13Å; V332-T336 WeakPolarHBondContact O-CB 3.42Å; V332-T336 PolarHBondContact O-N 2.85Å; V332-T336 PolarHBondContact O-OG1 3.26Å |
| 333 | M | 74.4 | Confident | 73.5 | Confident | 76 Ų | 76 | 57 Ų | 57 | 37% | 0.374 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -70.8 | -38.7 | -178.7 | -169.4 | 142.9 | 48 | 0 | 0 | 110.9 | F328 S330 Y331 T336 C337 | F328-M333 HydrophobicContact CB-CB 4.34Å; F328-M333 HydrophobicContact CB-CE 3.96Å; F328-M333 HydrophobicContact CB-CG 4.21Å; F328-M333 HydrophobicContact CD1-CE 3.08Å; F328-M333 HydrophobicContact CD1-CG 3.99Å; F328-M333 HydrophobicContact CD1-SD 3.61Å; F328-M333 HydrophobicContact CD2-CG 3.85Å; F328-M333 HydrophobicContact CD2-SD 4.44Å; F328-M333 HydrophobicContact CE1-CE 3.53Å; F328-M333 HydrophobicContact CE1-CG 4.16Å; F328-M333 HydrophobicContact CE1-SD 3.48Å; F328-M333 WeakPolarHBondContact CE1-SD 3.34Å; F328-M333 HydrophobicContact CE2-CG 4.06Å; F328-M333 HydrophobicContact CE2-SD 4.37Å; F328-M333 HydrophobicContact CG-CB 4.43Å; F328-M333 HydrophobicContact CG-CE 3.67Å; F328-M333 HydrophobicContact CG-CG 3.77Å; F328-M333 HydrophobicContact CG-SD 4.05Å; F328-M333 HydrophobicContact CZ-CE 4.44Å; F328-M333 HydrophobicContact CZ-CG 4.18Å; F328-M333 HydrophobicContact CZ-SD 3.88Å; S330-M333 PolarHBondContact O-N 3.4Å; S330-M333 WeakPolarHBondContact OG-CB 3.39Å; Y331-M333 VanDerWaalsContact C-N 3.34Å; Y331-M333 PolarHBondContact O-N 3.35Å; M333-T336 WeakPolarHBondContact O-CB 3.46Å; M333-T336 PolarHBondContact O-N 3.37Å; M333-C337 PolarHBondContact O-N 3.35Å; M333-C337 PolarHBondContact O-SG 2.89Å |
| 334 | Q | 71.8 | Confident | 74.2 | Confident | 3 Ų | 3 | 58.8 Ų | 58.8 | 1% | 0.014 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -67.3 | -44 | 172.5 | -65.8 | -162.8 | 13.5 | 0 | 0 | 113 | M264 L268 F328 S330 Y331 T336 C337 F338 | M264-Q334 HydrophobicContact CE-CB 3.94Å; L268-Q334 VanDerWaalsContact CD2-NE2 3.3Å; F328-Q334 HydrophobicContact CB-CG 4.39Å; F328-Q334 PolarHBondContact O-NE2 3.45Å; S330-Q334 PolarHBondContact O-N 3.27Å; Y331-Q334 PolarHBondContact O-N 2.93Å; Q334-T336 PolarHBondContact O-N 3.41Å; Q334-C337 CarbonylContact O-C 3.59Å; Q334-C337 WeakPolarHBondContact O-CA 3.37Å; Q334-C337 WeakPolarHBondContact O-CB 3.49Å; Q334-C337 PolarHBondContact O-N 2.8Å; Q334-F338 WeakPolarHBondContact O-CD2 3.47Å; Q334-F338 PolarHBondContact O-N 3.08Å |
| 335 | A | 75.3 | Confident | 74.9 | Confident | 14 Ų | 14 | 52 Ų | 52 | 12% | 0.116 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -56.6 | -37.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | M281 Y331 V332 F338 F339 | M281-A335 HydrophobicContact CG-CB 4.47Å; Y331-A335 WeakPolarHBondContact O-CB 3.34Å; Y331-A335 PolarHBondContact O-N 2.83Å; V332-A335 PolarHBondContact O-N 3.13Å; A335-F338 PolarHBondContact O-N 3.22Å; A335-F339 WeakPolarHBondContact O-CB 3.08Å; A335-F339 PolarHBondContact O-N 3.26Å |
| 336 | T | 81.3 | Confident | 75.7 | Confident | 76 Ų | 76 | 46.1 Ų | 46.1 | 47% | 0.466 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -66.6 | -43.3 | 173.2 | -53.4 | 0 | 0 | 0 | 0 | 111.7 | V332 M333 Q334 F339 T340 | V332-T336 WeakPolarHBondContact O-CB 3.42Å; V332-T336 PolarHBondContact O-N 2.85Å; V332-T336 PolarHBondContact O-OG1 3.26Å; M333-T336 WeakPolarHBondContact O-CB 3.46Å; M333-T336 PolarHBondContact O-N 3.37Å; Q334-T336 PolarHBondContact O-N 3.41Å; T336-F339 WeakPolarHBondContact O-CB 3.42Å; T336-F339 PolarHBondContact O-N 3.37Å; T336-T340 WeakPolarHBondContact O-CG2 3.39Å; T336-T340 PolarHBondContact O-N 3.33Å; T336-T340 PolarHBondContact O-OG1 2.9Å |
| 337 | C | 80.7 | Confident | 76.6 | Confident | 13 Ų | 13 | 41 Ų | 41 | 9% | 0.088 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.3 | -42.7 | 174.1 | -67.9 | 0 | 0 | 0 | 0 | 112.5 | L323 M333 Q334 F339 T340 I341 | L323-C337 HydrophobicContact CD2-CB 3.51Å; L323-C337 HydrophobicContact CG-CB 4.14Å; M333-C337 PolarHBondContact O-N 3.35Å; M333-C337 PolarHBondContact O-SG 2.89Å; Q334-C337 CarbonylContact O-C 3.59Å; Q334-C337 WeakPolarHBondContact O-CA 3.37Å; Q334-C337 WeakPolarHBondContact O-CB 3.49Å; Q334-C337 PolarHBondContact O-N 2.8Å; C337-F339 VanDerWaalsContact C-N 3.31Å; C337-F339 PolarHBondContact O-N 3.48Å; C337-T340 WeakPolarHBondContact CA-OG1 3.47Å; C337-T340 PolarHBondContact O-N 3.16Å; C337-T340 PolarHBondContact O-OG1 3.09Å; C337-I341 WeakPolarHBondContact O-CB 3.43Å; C337-I341 WeakPolarHBondContact O-CG1 3.35Å; C337-I341 PolarHBondContact O-N 2.98Å |
| 338 | F | 80.7 | Confident | 77.6 | Confident | 4 Ų | 4 | 36.1 Ų | 36.1 | 2% | 0.018 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63 | -40.2 | 174.8 | -90.1 | -95 | 0 | 0 | 0 | 111.2 | I256 M264 F282 Q334 A335 G342 | I256-F338 HydrophobicContact CG2-CD1 3.92Å; I256-F338 HydrophobicContact CG2-CE1 3.68Å; M264-F338 HydrophobicContact CE-CD2 3.19Å; M264-F338 HydrophobicContact CE-CE2 3.12Å; M264-F338 HydrophobicContact CE-CG 3.99Å; M264-F338 HydrophobicContact CE-CZ 3.87Å; M264-F338 HydrophobicContact CG-CE2 4.3Å; M264-F338 HydrophobicContact CG-CZ 4.47Å; M264-F338 HydrophobicContact SD-CE2 4.5Å; F282-F338 WeakPolarHBondContact CA-O 3.41Å; F282-F338 HydrophobicContact CB-CB 4.25Å; F282-F338 HydrophobicContact CB-CD1 4.14Å; F282-F338 WeakPolarHBondContact CD2-O 3.44Å; Q334-F338 WeakPolarHBondContact O-CD2 3.47Å; Q334-F338 PolarHBondContact O-N 3.08Å; A335-F338 PolarHBondContact O-N 3.22Å; F338-G342 PolarHBondContact O-N 3.44Å |
| 339 | F | 82.7 | Confident | 78.7 | Confident | 57 Ų | 57 | 35 Ų | 35 | 25% | 0.25 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -62.2 | -46.7 | 173.2 | 179.3 | -85.9 | 0 | 0 | 0 | 112.3 | M281 L284 G285 I288 A335 T336 C337 G342 F343 | M281-F339 HydrophobicContact CB-CB 4.5Å; M281-F339 WeakPolarHBondContact O-CD2 3.4Å; L284-F339 HydrophobicContact CD2-CE2 4.47Å; L284-F339 HydrophobicContact CG-CE2 4.27Å; G285-F339 WeakPolarHBondContact CA-O 3.47Å; I288-F339 HydrophobicContact CD1-CE2 3.99Å; I288-F339 HydrophobicContact CD1-CZ 3.81Å; A335-F339 WeakPolarHBondContact O-CB 3.08Å; A335-F339 PolarHBondContact O-N 3.26Å; T336-F339 WeakPolarHBondContact O-CB 3.42Å; T336-F339 PolarHBondContact O-N 3.37Å; C337-F339 VanDerWaalsContact C-N 3.31Å; C337-F339 PolarHBondContact O-N 3.48Å; F339-G342 PolarHBondContact O-N 3.41Å; F339-F343 WeakPolarHBondContact O-CB 3.35Å; F339-F343 PolarHBondContact O-N 2.97Å |
| 340 | T | 84.1 | Confident | 79.8 | Confident | 45 Ų | 45 | 30.5 Ų | 30.5 | 28% | 0.276 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -66.2 | -40.4 | 179.7 | 55 | 0 | 0 | 0 | 0 | 111.9 | T336 C337 F343 F344 | T336-T340 WeakPolarHBondContact O-CG2 3.39Å; T336-T340 PolarHBondContact O-N 3.33Å; T336-T340 PolarHBondContact O-OG1 2.9Å; C337-T340 WeakPolarHBondContact CA-OG1 3.47Å; C337-T340 PolarHBondContact O-N 3.16Å; C337-T340 PolarHBondContact O-OG1 3.09Å; T340-F343 WeakPolarHBondContact O-CB 3.43Å; T340-F343 PolarHBondContact O-N 3.24Å; T340-F344 WeakPolarHBondContact O-CD2 3.36Å; T340-F344 PolarHBondContact O-N 3.18Å |
| 341 | I | 82.1 | Confident | 80.3 | Confident | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -61.2 | -48.8 | 172.7 | -67.8 | 169.7 | 0 | 0 | 0 | 110.1 | I256 F282 S319 L323 C337 F343 F344 V345 | I256-I341 HydrophobicContact CD1-CD1 4.39Å; I256-I341 HydrophobicContact CD1-CG2 3.22Å; I256-I341 HydrophobicContact CG2-CG2 4.37Å; F282-I341 HydrophobicContact CD2-CB 4.49Å; F282-I341 HydrophobicContact CD2-CG2 4.17Å; F282-I341 HydrophobicContact CE2-CG2 3.79Å; S319-I341 VanDerWaalsContact CB-CG1 3.44Å; L323-I341 HydrophobicContact CD1-CD1 3.19Å; L323-I341 HydrophobicContact CG-CD1 3.84Å; C337-I341 WeakPolarHBondContact O-CB 3.43Å; C337-I341 WeakPolarHBondContact O-CG1 3.35Å; C337-I341 PolarHBondContact O-N 2.98Å; I341-F343 VanDerWaalsContact C-N 3.27Å; I341-F343 PolarHBondContact O-N 2.83Å; I341-F344 PolarHBondContact O-N 3.24Å; I341-F344 VanDerWaalsContact O-N 3.13Å; I341-V345 HydrophobicContact CG2-CG2 3.91Å; I341-V345 WeakPolarHBondContact O-CB 3.39Å; I341-V345 VanDerWaalsContact O-CG2 3.22Å; I341-V345 WeakPolarHBondContact O-CG2 3.44Å; I341-V345 PolarHBondContact O-N 3Å |
| 342 | G | 83.4 | Confident | 80.8 | Confident | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -54 | -48.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | F282 G286 F338 F339 F344 V345 F346 | F282-G342 VanDerWaalsContact CE2-CA 3.44Å; F282-G342 WeakPolarHBondContact O-CA 3.38Å; G286-G342 VanDerWaalsContact CA-O 3.22Å; G286-G342 WeakPolarHBondContact CA-O 3.46Å; G286-G342 VanDerWaalsContact N-C 3.35Å; F338-G342 PolarHBondContact O-N 3.44Å; F339-G342 PolarHBondContact O-N 3.41Å; G342-F344 VanDerWaalsContact C-N 3.35Å; G342-F344 PolarHBondContact O-N 3.2Å; G342-V345 PolarHBondContact O-N 3.38Å; G342-F346 VanDerWaalsContact O-CD2 3.31Å; G342-F346 WeakPolarHBondContact O-CD2 3.34Å; G342-F346 PolarHBondContact O-N 2.95Å; G342-F346 VanDerWaalsContact O-N 3.12Å |
| 343 | F | 85.6 | Confident | 81 | Confident | 41 Ų | 41 | 19.6 Ų | 19.6 | 18% | 0.18 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -54.1 | -49.7 | 175.8 | -179 | -85.1 | 0 | 0 | 0 | 111.8 | G285 I288 G289 V292 F312 F339 T340 I341 | G285-F343 VanDerWaalsContact C-N 3.32Å; G285-F343 WeakPolarHBondContact O-CA 3.45Å; G285-F343 PolarHBondContact O-N 3.31Å; I288-F343 HydrophobicContact CB-CD2 4.39Å; I288-F343 HydrophobicContact CG2-CD2 4.15Å; I288-F343 HydrophobicContact CG2-CE2 4.02Å; G289-F343 WeakPolarHBondContact CA-O 3.33Å; V292-F343 HydrophobicContact CB-CE2 3.99Å; V292-F343 HydrophobicContact CB-CZ 3.86Å; V292-F343 HydrophobicContact CG1-CE2 4.45Å; V292-F343 HydrophobicContact CG1-CZ 3.86Å; V292-F343 HydrophobicContact CG2-CE2 3.88Å; V292-F343 HydrophobicContact CG2-CZ 4.12Å; F312-F343 HydrophobicContact CE1-CD1 4.12Å; F312-F343 AromaticContact CE1-CE1 3.91Å; F312-F343 HydrophobicContact CE1-CE1 3.91Å; F312-F343 WeakPolarHBondContact CE1-O 3.22Å; F312-F343 HydrophobicContact CZ-CD1 4.39Å; F312-F343 AromaticContact CZ-CE1 3.72Å; F312-F343 HydrophobicContact CZ-CE1 3.72Å; F312-F343 HydrophobicContact CZ-CZ 4.11Å; F339-F343 WeakPolarHBondContact O-CB 3.35Å; F339-F343 PolarHBondContact O-N 2.97Å; T340-F343 WeakPolarHBondContact O-CB 3.43Å; T340-F343 PolarHBondContact O-N 3.24Å; I341-F343 VanDerWaalsContact C-N 3.27Å; I341-F343 PolarHBondContact O-N 2.83Å |
| 344 | F | 83.9 | Confident | 81.3 | Confident | 48 Ų | 48 | 16 Ų | 16 | 21% | 0.211 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -77.9 | -22.3 | -177.4 | -70.8 | -60.4 | 0 | 0 | 0 | 114.8 | F312 I316 S319 T340 I341 G342 P348 | F312-F344 HydrophobicContact CB-CD1 4.35Å; F312-F344 AromaticContact CD1-CD1 3.96Å; F312-F344 HydrophobicContact CD1-CD1 3.96Å; F312-F344 WeakPolarHBondContact CD1-O 3.1Å; F312-F344 HydrophobicContact CE1-CD1 4.39Å; F312-F344 HydrophobicContact CG-CD1 4.06Å; I316-F344 WeakPolarHBondContact CD1-O 3.41Å; I316-F344 HydrophobicContact CG1-CB 3.72Å; I316-F344 WeakPolarHBondContact CG1-O 3.36Å; S319-F344 WeakPolarHBondContact OG-CD2 3.35Å; T340-F344 WeakPolarHBondContact O-CD2 3.36Å; T340-F344 PolarHBondContact O-N 3.18Å; I341-F344 PolarHBondContact O-N 3.24Å; I341-F344 VanDerWaalsContact O-N 3.13Å; G342-F344 VanDerWaalsContact C-N 3.35Å; G342-F344 PolarHBondContact O-N 3.2Å; F344-P348 WeakPolarHBondContact O-CD 3.48Å; F344-P348 WeakPolarHBondContact O-CG 3.26Å |
| 345 | V | 82.6 | Confident | 81.7 | Confident | 0 Ų | 0 | 15.9 Ų | 15.9 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -82.4 | -41.7 | -179.9 | 169.4 | 0 | 0 | 0 | 0 | 112.4 | V252 R253 I316 I341 G342 G347 P348 Q349 | V252-V345 HydrophobicContact CG1-CG2 3.82Å; R253-V345 HydrophobicContact CB-CG1 3.58Å; R253-V345 HydrophobicContact CG-CG1 3.96Å; I316-V345 HydrophobicContact CD1-CG2 3.96Å; I316-V345 HydrophobicContact CG1-CG2 3.93Å; I316-V345 HydrophobicContact CG2-CG2 4.4Å; I341-V345 HydrophobicContact CG2-CG2 3.91Å; I341-V345 WeakPolarHBondContact O-CB 3.39Å; I341-V345 VanDerWaalsContact O-CG2 3.22Å; I341-V345 WeakPolarHBondContact O-CG2 3.44Å; I341-V345 PolarHBondContact O-N 3Å; G342-V345 PolarHBondContact O-N 3.38Å; V345-G347 VanDerWaalsContact C-N 3.31Å; V345-G347 PolarHBondContact O-N 3.29Å; V345-P348 WeakPolarHBondContact O-CD 3.18Å; V345-Q349 WeakPolarHBondContact O-CB 3.32Å; V345-Q349 PolarHBondContact O-N 3.41Å |
| 346 | F | 81.4 | Confident | 82 | Confident | 3 Ų | 3 | 15.2 Ų | 15.2 | 1% | 0.013 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -73.6 | -24.5 | -176.1 | -81.4 | -124.9 | 0 | 0 | 0 | 112.8 | H150 F282 E283 G286 A290 G342 M350 | H150-F346 AromaticContact NE2-CE1 3.64Å; F282-F346 HydrophobicContact CD1-CE2 4.36Å; F282-F346 AromaticContact CE1-CE2 3.71Å; F282-F346 HydrophobicContact CE1-CE2 3.71Å; F282-F346 HydrophobicContact CE1-CZ 4.38Å; F282-F346 AromaticContact CZ-CE2 3.89Å; F282-F346 HydrophobicContact CZ-CE2 3.89Å; E283-F346 VanDerWaalsContact OE2-CZ 3.24Å; E283-F346 WeakPolarHBondContact OE2-CZ 3.45Å; G286-F346 VanDerWaalsContact CA-CD2 3.41Å; G286-F346 WeakPolarHBondContact O-CB 3.24Å; A290-F346 HydrophobicContact CB-CB 4.37Å; G342-F346 VanDerWaalsContact O-CD2 3.31Å; G342-F346 WeakPolarHBondContact O-CD2 3.34Å; G342-F346 PolarHBondContact O-N 2.95Å; G342-F346 VanDerWaalsContact O-N 3.12Å; F346-M350 WeakPolarHBondContact O-CB 3.31Å; F346-M350 PolarHBondContact O-N 3.43Å |
| 347 | G | 81.3 | Confident | 81.8 | Confident | 0 Ų | 0 | 11.6 Ų | 11.6 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -60.4 | -60.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | A293 V345 Q349 M350 L351 | A293-G347 VanDerWaalsContact CB-CA 3.4Å; V345-G347 VanDerWaalsContact C-N 3.31Å; V345-G347 PolarHBondContact O-N 3.29Å; G347-Q349 PolarHBondContact O-N 3.38Å; G347-M350 WeakPolarHBondContact O-CB 3.21Å; G347-M350 PolarHBondContact O-N 3.48Å; G347-M350 VanDerWaalsContact O-N 3.1Å; G347-L351 WeakPolarHBondContact O-CB 3.26Å; G347-L351 WeakPolarHBondContact O-CG 3.47Å; G347-L351 PolarHBondContact O-N 3.25Å |
| 348 | P | 80 | Confident | 81.7 | Confident | 1 Ų | 1 | 11.4 Ų | 11.4 | 1% | 0.006 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -58.3 | -39.1 | 175.6 | -27.1 | 36.3 | 0 | 0 | 0 | 111.8 | V249 N309 F312 I316 F344 V345 M350 L351 I352 | V249-P348 HydrophobicContact CG1-CB 4.35Å; V249-P348 HydrophobicContact CG2-CB 4.19Å; N309-P348 WeakPolarHBondContact OD1-CA 3.3Å; F312-P348 HydrophobicContact CB-CG 3.44Å; F312-P348 VanDerWaalsContact CB-CG 3.44Å; F312-P348 HydrophobicContact CG-CG 4.36Å; I316-P348 HydrophobicContact CD1-CG 4.23Å; F344-P348 WeakPolarHBondContact O-CD 3.48Å; F344-P348 WeakPolarHBondContact O-CG 3.26Å; V345-P348 WeakPolarHBondContact O-CD 3.18Å; P348-M350 VanDerWaalsContact C-N 3.3Å; P348-M350 PolarHBondContact O-N 3.01Å; P348-L351 PolarHBondContact O-N 2.68Å; P348-I352 HydrophobicContact CB-CD1 4.22Å; P348-I352 VanDerWaalsContact O-CB 3.22Å; P348-I352 WeakPolarHBondContact O-CB 3.47Å; P348-I352 WeakPolarHBondContact O-CD1 3.35Å; P348-I352 WeakPolarHBondContact O-CG1 3.49Å; P348-I352 PolarHBondContact O-N 3.46Å |
| 349 | Q | 81.7 | Confident | 81.4 | Confident | 16 Ų | 16 | 12.7 Ų | 12.7 | 8% | 0.075 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -55.2 | -49.4 | 175.6 | 179.4 | -177.1 | 4.4 | 0 | 0 | 111.3 | Y246 V249 Y250 V345 G347 G353 | Y246-Q349 HydrophobicContact CE2-CB 4.47Å; Y246-Q349 HydrophobicContact CE2-CG 4.06Å; Y246-Q349 VanDerWaalsContact CE2-O 3.23Å; Y246-Q349 WeakPolarHBondContact CE2-O 3.02Å; Y246-Q349 PolarHBondContact OH-O 2.92Å; V249-Q349 HydrophobicContact CG1-CB 4.19Å; Y250-Q349 HydrophobicContact CE2-CG 3.69Å; Y250-Q349 VanDerWaalsContact CZ-NE2 3.29Å; Y250-Q349 PolarHBondContact OH-NE2 3.01Å; V345-Q349 WeakPolarHBondContact O-CB 3.32Å; V345-Q349 PolarHBondContact O-N 3.41Å; G347-Q349 PolarHBondContact O-N 3.38Å; Q349-G353 PolarHBondContact O-N 3.1Å |
| 350 | M | 82.5 | Confident | 80.9 | Confident | 5 Ų | 5 | 10 Ų | 10 | 3% | 0.025 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -66.3 | -48.1 | 179.4 | -172.9 | -157.4 | 66.8 | 0 | 0 | 111.7 | W143 A144 N147 A290 A293 G294 F346 G347 P348 G353 M354 | W143-M350 VanDerWaalsContact CD1-CG 3.48Å; A144-M350 WeakPolarHBondContact CA-SD 3.08Å; A144-M350 HydrophobicContact CB-CE 4.43Å; A144-M350 HydrophobicContact CB-SD 3.51Å; A144-M350 VanDerWaalsContact CB-SD 3.51Å; N147-M350 WeakPolarHBondContact ND2-CG 3.25Å; A290-M350 HydrophobicContact CB-SD 4.24Å; A290-M350 VanDerWaalsContact O-SD 3.32Å; A293-M350 HydrophobicContact CB-CE 4.04Å; G294-M350 VanDerWaalsContact N-CE 3.27Å; F346-M350 WeakPolarHBondContact O-CB 3.31Å; F346-M350 PolarHBondContact O-N 3.43Å; G347-M350 WeakPolarHBondContact O-CB 3.21Å; G347-M350 PolarHBondContact O-N 3.48Å; G347-M350 VanDerWaalsContact O-N 3.1Å; P348-M350 VanDerWaalsContact C-N 3.3Å; P348-M350 PolarHBondContact O-N 3.01Å; M350-G353 PolarHBondContact O-N 2.99Å; M350-M354 HydrophobicContact CE-CE 3.49Å; M350-M354 VanDerWaalsContact CE-CE 3.49Å; M350-M354 HydrophobicContact CG-CE 4.22Å; M350-M354 PolarHBondContact O-N 3.39Å; M350-M354 HydrophobicContact SD-CE 4.13Å |
| 351 | L | 82.3 | Confident | 80.4 | Confident | 0 Ų | 0 | 8.4 Ų | 8.4 | 0% | 0 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -69.3 | -36.4 | -173.8 | -73.7 | 173.4 | 0 | 0 | 0 | 112.9 | A293 R305 M308 N309 G347 P348 M354 A355 | A293-L351 HydrophobicContact CB-CD1 3.95Å; A293-L351 HydrophobicContact CB-CG 4.2Å; R305-L351 HydrophobicContact CG-CD2 4.22Å; M308-L351 HydrophobicContact CB-CD1 3.85Å; M308-L351 HydrophobicContact CG-CD1 3.67Å; N309-L351 WeakPolarHBondContact OD1-CB 3.47Å; N309-L351 WeakPolarHBondContact OD1-CD1 3.49Å; G347-L351 WeakPolarHBondContact O-CB 3.26Å; G347-L351 WeakPolarHBondContact O-CG 3.47Å; G347-L351 PolarHBondContact O-N 3.25Å; P348-L351 PolarHBondContact O-N 2.68Å; L351-M354 HydrophobicContact CD2-CE 4.18Å; L351-M354 WeakPolarHBondContact O-CB 3.46Å; L351-M354 PolarHBondContact O-N 3.49Å; L351-A355 VanDerWaalsContact O-CB 3.31Å; L351-A355 WeakPolarHBondContact O-CB 3.49Å; L351-A355 PolarHBondContact O-N 3.18Å |
| 352 | I | 81.8 | Confident | 79.9 | Confident | 0 Ų | 0 | 9.8 Ų | 9.8 | 0% | 0 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -64.4 | -46.1 | 174.6 | -69.2 | 164.1 | 0 | 0 | 0 | 110.2 | L242 C245 Y246 V249 P348 M354 A355 A356 V372 | L242-I352 HydrophobicContact CB-CG2 4.21Å; L242-I352 HydrophobicContact CD2-CG2 4.18Å; C245-I352 HydrophobicContact CB-CD1 4.43Å; Y246-I352 HydrophobicContact CD2-CB 3.68Å; Y246-I352 HydrophobicContact CD2-CD1 3.93Å; Y246-I352 HydrophobicContact CD2-CG1 4.42Å; Y246-I352 HydrophobicContact CD2-CG2 3.37Å; Y246-I352 HydrophobicContact CE2-CB 3.98Å; Y246-I352 HydrophobicContact CE2-CG2 3.99Å; Y246-I352 HydrophobicContact CG-CG2 3.8Å; V249-I352 HydrophobicContact CG2-CD1 3.92Å; P348-I352 HydrophobicContact CB-CD1 4.22Å; P348-I352 VanDerWaalsContact O-CB 3.22Å; P348-I352 WeakPolarHBondContact O-CB 3.47Å; P348-I352 WeakPolarHBondContact O-CD1 3.35Å; P348-I352 WeakPolarHBondContact O-CG1 3.49Å; P348-I352 PolarHBondContact O-N 3.46Å; I352-M354 PolarHBondContact O-N 3.12Å; I352-A355 PolarHBondContact O-N 2.82Å; I352-A356 WeakPolarHBondContact O-CB 3.4Å; I352-A356 PolarHBondContact O-N 2.82Å; I352-V372 HydrophobicContact CG2-CG1 3.94Å |
| 353 | G | 81.2 | Confident | 79.3 | Confident | 9 Ų | 9 | 12.4 Ų | 12.4 | 9% | 0.093 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -58.8 | -37.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | Q349 M350 A357 T369 | Q349-G353 PolarHBondContact O-N 3.1Å; M350-G353 PolarHBondContact O-N 2.99Å; G353-A357 PolarHBondContact O-N 3.17Å; G353-T369 VanDerWaalsContact O-CG2 3.27Å; G353-T369 WeakPolarHBondContact O-CG2 3.37Å |
| 354 | M | 80.9 | Confident | 79 | Confident | 0 Ų | 0 | 10.6 Ų | 10.6 | 0% | 0 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -69 | -47.4 | 174.9 | -145.9 | -174.2 | -51 | 0 | 0 | 112 | R139 G140 W143 R305 M350 L351 I352 A356 A357 E358 | R139-M354 HydrophobicContact CB-SD 4.47Å; R139-M354 HydrophobicContact CG-CG 4.39Å; R139-M354 HydrophobicContact CG-SD 4.29Å; G140-M354 VanDerWaalsContact CA-SD 3.52Å; W143-M354 HydrophobicContact CB-CE 3.53Å; W143-M354 HydrophobicContact CB-CG 4.32Å; W143-M354 HydrophobicContact CB-SD 4Å; W143-M354 HydrophobicContact CD2-CB 4.23Å; W143-M354 HydrophobicContact CD2-CE 4.3Å; W143-M354 HydrophobicContact CD2-CG 3.65Å; W143-M354 HydrophobicContact CD2-SD 4.47Å; W143-M354 HydrophobicContact CE3-CG 3.72Å; W143-M354 HydrophobicContact CG-CE 3.59Å; W143-M354 HydrophobicContact CG-CG 3.96Å; W143-M354 HydrophobicContact CG-SD 4.2Å; W143-M354 HydrophobicContact CZ2-CB 4.38Å; W143-M354 HydrophobicContact CZ2-CG 4.48Å; W143-M354 HydrophobicContact CZ3-CG 4.15Å; R305-M354 PolarHBondContact NE-SD 2.88Å; R305-M354 VanDerWaalsContact NH1-CB 3.33Å; R305-M354 PolarHBondContact NH1-O 3.39Å; R305-M354 VanDerWaalsContact NH2-CG 3.35Å; R305-M354 PolarHBondContact NH2-SD 2.82Å; M350-M354 HydrophobicContact CE-CE 3.49Å; M350-M354 VanDerWaalsContact CE-CE 3.49Å; M350-M354 HydrophobicContact CG-CE 4.22Å; M350-M354 PolarHBondContact O-N 3.39Å; M350-M354 HydrophobicContact SD-CE 4.13Å; L351-M354 HydrophobicContact CD2-CE 4.18Å; L351-M354 WeakPolarHBondContact O-CB 3.46Å; L351-M354 PolarHBondContact O-N 3.49Å; I352-M354 PolarHBondContact O-N 3.12Å; M354-A356 VanDerWaalsContact C-N 3.26Å; M354-A356 PolarHBondContact O-N 3.32Å; M354-A357 WeakPolarHBondContact O-CA 3.44Å; M354-A357 VanDerWaalsContact O-CB 3.3Å; M354-A357 WeakPolarHBondContact O-CB 3.4Å; M354-A357 PolarHBondContact O-N 2.82Å; M354-E358 PolarHBondContact O-N 3.44Å |
| 355 | A | 80.8 | Confident | 78.8 | Confident | 1 Ų | 1 | 8.3 Ų | 8.3 | 1% | 0.008 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -58.9 | -38.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | L242 L351 I352 A357 E358 C359 | L242-A355 HydrophobicContact CD1-CB 4.01Å; L242-A355 HydrophobicContact CD2-CB 4.19Å; L351-A355 VanDerWaalsContact O-CB 3.31Å; L351-A355 WeakPolarHBondContact O-CB 3.49Å; L351-A355 PolarHBondContact O-N 3.18Å; I352-A355 PolarHBondContact O-N 2.82Å; A355-A357 VanDerWaalsContact C-N 3.29Å; A355-A357 PolarHBondContact O-N 3.38Å; A355-E358 PolarHBondContact O-N 3.37Å; A355-C359 PolarHBondContact O-N 2.99Å; A355-C359 PolarHBondContact O-SG 3.5Å; A355-C359 VanDerWaalsContact O-SG 3.39Å |
| 356 | A | 80.1 | Confident | 78.7 | Confident | 0 Ų | 0 | 8.3 Ų | 8.3 | 0% | 0 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -59.7 | -39.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L242 I352 M354 E358 S360 A368 T369 V372 | L242-A356 HydrophobicContact CD1-CB 4.1Å; I352-A356 WeakPolarHBondContact O-CB 3.4Å; I352-A356 PolarHBondContact O-N 2.82Å; M354-A356 VanDerWaalsContact C-N 3.26Å; M354-A356 PolarHBondContact O-N 3.32Å; A356-E358 PolarHBondContact O-N 3.45Å; A356-S360 PolarHBondContact O-OG 3.15Å; A356-A368 WeakPolarHBondContact O-CB 3.16Å; A356-T369 HydrophobicContact CB-CG2 4.41Å; A356-V372 HydrophobicContact CB-CB 4.16Å; A356-V372 HydrophobicContact CB-CG2 3.65Å |
| 357 | A | 78.9 | Confident | 78.9 | Confident | 0 Ų | 0 | 8.2 Ų | 8.2 | 0% | 0 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -68.9 | -19.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | T131 W143 G353 M354 A355 S360 A365 T369 | T131-A357 HydrophobicContact CG2-CB 3.78Å; W143-A357 HydrophobicContact CH2-CB 3.85Å; W143-A357 HydrophobicContact CZ3-CB 4.12Å; G353-A357 PolarHBondContact O-N 3.17Å; M354-A357 WeakPolarHBondContact O-CA 3.44Å; M354-A357 VanDerWaalsContact O-CB 3.3Å; M354-A357 WeakPolarHBondContact O-CB 3.4Å; M354-A357 PolarHBondContact O-N 2.82Å; A355-A357 VanDerWaalsContact C-N 3.29Å; A355-A357 PolarHBondContact O-N 3.38Å; A357-S360 PolarHBondContact O-OG 3.25Å; A357-A365 HydrophobicContact CB-CB 4.36Å; A357-T369 HydrophobicContact CB-CG2 3.61Å |
| 358 | E | 77.1 | Confident | 79 | Confident | 10 Ų | 10 | 8.2 Ų | 8.2 | 5% | 0.047 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -101.3 | -30.4 | -177.9 | -82.1 | -168.5 | 177.2 | 0 | 0 | 115.3 | R136 R139 R305 M354 A355 A356 S360 | R136-E358 PolarHBondContact NH2-O 3.18Å; R139-E358 IonicContact CZ-OE1 3.37Å; R139-E358 IonicContact NE-OE1 3.59Å; R139-E358 IonicContact NH1-OE1 2.97Å; R139-E358 PolarHBondContact NH1-OE1 3.16Å; R305-E358 IonicContact CZ-OE1 3.22Å; R305-E358 VanDerWaalsContact CZ-OE1 3.24Å; R305-E358 IonicContact CZ-OE2 3.48Å; R305-E358 IonicContact NE-OE2 3.92Å; R305-E358 VanDerWaalsContact NH1-CG 3.32Å; R305-E358 IonicContact NH1-OE1 3.6Å; R305-E358 PolarHBondContact NH1-OE1 3.45Å; R305-E358 IonicContact NH1-OE2 3.98Å; R305-E358 PolarHBondContact NH1-OE2 3.3Å; R305-E358 IonicContact NH2-OE1 2.89Å; R305-E358 PolarHBondContact NH2-OE1 3.16Å; R305-E358 IonicContact NH2-OE2 3.84Å; R305-E358 PolarHBondContact NH2-OE2 3Å; M354-E358 PolarHBondContact O-N 3.44Å; A355-E358 PolarHBondContact O-N 3.37Å; A356-E358 PolarHBondContact O-N 3.45Å; E358-S360 PolarHBondContact O-N 3.22Å |
| 359 | C | 74.2 | Confident | 79.3 | Confident | 30 Ų | 30 | 9 Ų | 9 | 20% | 0.203 | 5% | 0.049 | C | C | . | . | S | Bend | trans | -74.1 | -8 | 171.1 | -67 | 0 | 0 | 0 | 0 | 112.2 | N236 A355 | N236-C359 PolarHBondContact ND2-O 3.14Å; A355-C359 PolarHBondContact O-N 2.99Å; A355-C359 PolarHBondContact O-SG 3.5Å; A355-C359 VanDerWaalsContact O-SG 3.39Å |
| 360 | S | 73.6 | Confident | 79.5 | Confident | 0 Ų | 0 | 8.2 Ų | 8.2 | 0% | 0 | 5% | 0.046 | C | C | . | . | S | Bend | trans | -106.7 | 157.8 | 175.2 | 53.6 | 0 | 0 | 0 | 0 | 111.4 | Q216 A356 A357 E358 A368 | Q216-S360 PolarHBondContact NE2-O 3.37Å; A356-S360 PolarHBondContact O-OG 3.15Å; A357-S360 PolarHBondContact O-OG 3.25Å; E358-S360 PolarHBondContact O-N 3.22Å; S360-A368 VanDerWaalsContact OG-CB 3.23Å; S360-A368 WeakPolarHBondContact OG-CB 3.41Å |
| 361 | H | 73.5 | Confident | 79.8 | Confident | 13 Ų | 13 | 8.6 Ų | 8.6 | 6% | 0.06 | 5% | 0.047 | C | C | . | . | trans | -63.3 | 149.9 | 172 | -171 | -104.7 | 0 | 0 | 0 | 110.6 | Q216 G220 I228 Y232 E363 A364 A365 | Q216-H361 PolarHBondContact O-CD2 2.83Å; Q216-H361 PolarHBondContact O-NE2 3.46Å; G220-H361 VanDerWaalsContact CA-CD2 3.49Å; G220-H361 WeakPolarHBondContact CA-CD2 3.46Å; G220-H361 VanDerWaalsContact CA-NE2 3.32Å; G220-H361 WeakPolarHBondContact CA-NE2 3.39Å; G220-H361 PolarHBondContact N-CD2 3.47Å; G220-H361 VanDerWaalsContact N-CD2 3.29Å; G220-H361 PolarHBondContact N-NE2 2.63Å; I228-H361 HydrophobicContact CG2-CB 3.7Å; Y232-H361 HydrophobicContact CG-CB 4.43Å; H361-E363 PolarHBondContact ND1-N 3.31Å; H361-E363 PolarHBondContact O-N 3.21Å; H361-A364 CarbonylContact O-C 3.56Å; H361-A364 PolarHBondContact O-N 3.29Å; H361-A365 PolarHBondContact O-N 3.37Å | ||
| 362 | K | 71.5 | Confident | 80.1 | Confident | 28 Ų | 28 | 8.6 Ų | 8.6 | 12% | 0.122 | 5% | 0.047 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.9 | -28.2 | -178.1 | -65.7 | -169.5 | -169.7 | -177 | 0 | 113.9 | E213 Q216 Q217 A364 | E213-K362 VanDerWaalsContact CG-NZ 3.28Å; E213-K362 WeakPolarHBondContact O-CE 3.14Å; E213-K362 PolarHBondContact O-NZ 3.17Å; E213-K362 VanDerWaalsContact O-NZ 3.15Å; E213-K362 WeakPolarHBondContact OE1-CE 3.34Å; E213-K362 IonicContact OE1-NZ 2.74Å; E213-K362 PolarHBondContact OE1-NZ 3.35Å; Q216-K362 HydrophobicContact CG-CG 4.18Å; Q217-K362 HydrophobicContact CG-CD 3.77Å; K362-A364 VanDerWaalsContact C-N 3.34Å |
| 363 | E | 71 | Confident | 80.3 | Confident | 55 Ų | 55 | 8.7 Ų | 8.7 | 26% | 0.257 | 5% | 0.048 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -80.2 | -10.7 | 176.8 | -62 | -152.7 | 138.7 | 0 | 0 | 114.6 | D77 R195 R225 H361 | D77-E363 VanDerWaalsContact CB-O 3.26Å; D77-E363 WeakPolarHBondContact CB-O 3.46Å; R195-E363 IonicContact NH1-OE1 3.09Å; R195-E363 IonicContact NH2-OE1 2.86Å; R195-E363 PolarHBondContact NH2-OE1 3.07Å; R225-E363 IonicContact NE-OE2 2.59Å; H361-E363 PolarHBondContact ND1-N 3.31Å; H361-E363 PolarHBondContact O-N 3.21Å |
| 364 | A | 79.4 | Confident | 80.7 | Confident | 4 Ų | 4 | 10.3 Ų | 10.3 | 3% | 0.033 | 5% | 0.054 | C | C | . | . | S | Bend | trans | -122 | 12.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113 | D77 I228 V233 H361 K362 G366 A367 A368 | D77-A364 VanDerWaalsContact OD2-CA 3.28Å; D77-A364 WeakPolarHBondContact OD2-CA 3.38Å; I228-A364 HydrophobicContact CG2-CB 3.77Å; V233-A364 HydrophobicContact CG2-CB 3.94Å; H361-A364 CarbonylContact O-C 3.56Å; H361-A364 PolarHBondContact O-N 3.29Å; K362-A364 VanDerWaalsContact C-N 3.34Å; A364-G366 VanDerWaalsContact C-N 3.3Å; A364-G366 PolarHBondContact O-N 3.24Å; A364-A367 PolarHBondContact O-N 2.95Å; A364-A368 PolarHBondContact O-N 3.29Å |
| 365 | A | 79 | Confident | 81 | Confident | 0 Ų | 0 | 11.9 Ų | 11.9 | 0% | 0 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -63.2 | -36 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112 | T131 A357 H361 T369 | T131-A365 HydrophobicContact CG2-CB 4.32Å; A357-A365 HydrophobicContact CB-CB 4.36Å; H361-A365 PolarHBondContact O-N 3.37Å; A365-T369 WeakPolarHBondContact O-CG2 3.36Å; A365-T369 PolarHBondContact O-N 2.88Å; A365-T369 PolarHBondContact O-OG1 2.74Å |
| 366 | G | 80.7 | Confident | 81.4 | Confident | 0 Ų | 0 | 11.9 Ų | 11.9 | 0% | 0 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -63 | -49.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | G73 D77 A364 A368 T369 G370 | G73-G366 VanDerWaalsContact CA-C 3.42Å; G73-G366 WeakPolarHBondContact CA-O 3.48Å; D77-G366 WeakPolarHBondContact OD1-CA 3.44Å; D77-G366 PolarHBondContact OD1-N 2.95Å; D77-G366 VanDerWaalsContact OD1-N 3.13Å; A364-G366 VanDerWaalsContact C-N 3.3Å; A364-G366 PolarHBondContact O-N 3.24Å; G366-A368 PolarHBondContact O-N 3.3Å; G366-T369 PolarHBondContact O-N 2.86Å; G366-T369 PolarHBondContact O-OG1 3.01Å; G366-T369 VanDerWaalsContact O-OG1 3.06Å; G366-G370 PolarHBondContact O-N 3.47Å |
| 367 | A | 85.5 | Confident | 81.7 | Confident | 0 Ų | 0 | 12.8 Ų | 12.8 | 0% | 0 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -62.4 | -40.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | I74 D77 L229 V233 A364 G370 F371 | I74-A367 HydrophobicContact CG1-CB 4.01Å; D77-A367 VanDerWaalsContact OD2-CB 3.25Å; D77-A367 WeakPolarHBondContact OD2-CB 3.47Å; D77-A367 PolarHBondContact OD2-N 3.3Å; L229-A367 HydrophobicContact CD1-CB 3.37Å; V233-A367 HydrophobicContact CG2-CB 4.27Å; A364-A367 PolarHBondContact O-N 2.95Å; A367-G370 PolarHBondContact O-N 3.34Å; A367-F371 VanDerWaalsContact O-CB 3.27Å; A367-F371 WeakPolarHBondContact O-CB 3.31Å; A367-F371 PolarHBondContact O-N 3.31Å |
| 368 | A | 84.2 | Confident | 82 | Confident | 0 Ų | 0 | 16.5 Ų | 16.5 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -65.4 | -47.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | V233 I239 A356 S360 A364 G366 G370 F371 V372 | V233-A368 HydrophobicContact CG1-CB 4.5Å; V233-A368 HydrophobicContact CG2-CB 4.16Å; I239-A368 HydrophobicContact CD1-CB 3.85Å; A356-A368 WeakPolarHBondContact O-CB 3.16Å; S360-A368 VanDerWaalsContact OG-CB 3.23Å; S360-A368 WeakPolarHBondContact OG-CB 3.41Å; A364-A368 PolarHBondContact O-N 3.29Å; G366-A368 PolarHBondContact O-N 3.3Å; A368-G370 VanDerWaalsContact C-N 3.3Å; A368-G370 PolarHBondContact O-N 2.89Å; A368-F371 PolarHBondContact O-N 3.48Å; A368-V372 WeakPolarHBondContact O-CG2 3.4Å; A368-V372 PolarHBondContact O-N 3.49Å |
| 369 | T | 85.4 | Confident | 82.3 | Confident | 18 Ų | 18 | 16 Ų | 16 | 11% | 0.11 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -66.7 | -33.7 | 175.7 | 56.2 | 0 | 0 | 0 | 0 | 112.5 | A127 W143 G353 A356 A357 A365 G366 G373 | A127-T369 HydrophobicContact CB-CG2 3.77Å; W143-T369 HydrophobicContact CH2-CG2 4.15Å; G353-T369 VanDerWaalsContact O-CG2 3.27Å; G353-T369 WeakPolarHBondContact O-CG2 3.37Å; A356-T369 HydrophobicContact CB-CG2 4.41Å; A357-T369 HydrophobicContact CB-CG2 3.61Å; A365-T369 WeakPolarHBondContact O-CG2 3.36Å; A365-T369 PolarHBondContact O-N 2.88Å; A365-T369 PolarHBondContact O-OG1 2.74Å; G366-T369 PolarHBondContact O-N 2.86Å; G366-T369 PolarHBondContact O-OG1 3.01Å; G366-T369 VanDerWaalsContact O-OG1 3.06Å; T369-G373 WeakPolarHBondContact O-CA 3.39Å; T369-G373 PolarHBondContact O-N 2.8Å |
| 370 | G | 86.4 | Confident | 82.7 | Confident | 0 Ų | 0 | 15.2 Ų | 15.2 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -65.1 | -42.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | K69 G366 A367 A368 G373 L374 | K69-G370 VanDerWaalsContact O-CA 3.25Å; K69-G370 WeakPolarHBondContact O-CA 3.24Å; G366-G370 PolarHBondContact O-N 3.47Å; A367-G370 PolarHBondContact O-N 3.34Å; A368-G370 VanDerWaalsContact C-N 3.3Å; A368-G370 PolarHBondContact O-N 2.89Å; G370-G373 CarbonylContact O-C 3.6Å; G370-G373 WeakPolarHBondContact O-CA 3.28Å; G370-G373 PolarHBondContact O-N 3.38Å; G370-L374 PolarHBondContact O-N 2.92Å |
| 371 | F | 88.3 | Confident | 83 | Confident | 12 Ų | 12 | 17.5 Ų | 17.5 | 5% | 0.053 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -66.5 | -51.6 | 178.6 | -176.5 | -100 | 0 | 0 | 0 | 111.3 | F70 V233 L234 I239 W240 S243 A367 A368 G373 L374 F375 | F70-F371 HydrophobicContact CD2-CB 3.64Å; F70-F371 AromaticContact CD2-CD2 3.94Å; F70-F371 HydrophobicContact CD2-CD2 3.94Å; F70-F371 HydrophobicContact CD2-CG 4.31Å; F70-F371 HydrophobicContact CE1-CD2 4.45Å; F70-F371 HydrophobicContact CE2-CB 3.73Å; F70-F371 AromaticContact CE2-CD2 3.57Å; F70-F371 HydrophobicContact CE2-CD2 3.57Å; F70-F371 HydrophobicContact CE2-CG 4.12Å; F70-F371 AromaticContact CZ-CD2 3.84Å; F70-F371 HydrophobicContact CZ-CD2 3.84Å; V233-F371 HydrophobicContact CG1-CB 4.04Å; V233-F371 HydrophobicContact CG1-CG 4.3Å; L234-F371 HydrophobicContact CD2-CD2 4.35Å; L234-F371 HydrophobicContact CD2-CE2 4.06Å; I239-F371 HydrophobicContact CG2-CD1 3.5Å; I239-F371 HydrophobicContact CG2-CE1 3.93Å; W240-F371 HydrophobicContact CD2-CE1 4.44Å; W240-F371 HydrophobicContact CD2-CZ 4.37Å; W240-F371 AromaticContact CE2-CZ 3.93Å; W240-F371 HydrophobicContact CH2-CZ 4.2Å; W240-F371 AromaticContact CZ2-CZ 3.86Å; W240-F371 HydrophobicContact CZ2-CZ 3.86Å; S243-F371 WeakPolarHBondContact OG-CD1 3.31Å; S243-F371 WeakPolarHBondContact OG-CE1 2.94Å; A367-F371 VanDerWaalsContact O-CB 3.27Å; A367-F371 WeakPolarHBondContact O-CB 3.31Å; A367-F371 PolarHBondContact O-N 3.31Å; A368-F371 PolarHBondContact O-N 3.48Å; F371-G373 PolarHBondContact O-N 2.91Å; F371-L374 WeakPolarHBondContact O-CB 3.33Å; F371-L374 PolarHBondContact O-N 3.44Å; F371-L374 VanDerWaalsContact O-N 3.1Å; F371-F375 HydrophobicContact CD1-CD2 4.33Å; F371-F375 HydrophobicContact CD1-CE2 4.33Å; F371-F375 HydrophobicContact CD2-CE2 4.42Å; F371-F375 HydrophobicContact CE1-CD2 4.07Å; F371-F375 AromaticContact CE1-CE2 3.7Å; F371-F375 HydrophobicContact CE1-CE2 3.7Å; F371-F375 AromaticContact CE2-CE2 3.81Å; F371-F375 HydrophobicContact CE2-CE2 3.81Å; F371-F375 HydrophobicContact CZ-CD2 4.22Å; F371-F375 AromaticContact CZ-CE2 3.43Å; F371-F375 HydrophobicContact CZ-CE2 3.43Å; F371-F375 VanDerWaalsContact CZ-CE2 3.43Å; F371-F375 HydrophobicContact CZ-CZ 4.26Å; F371-F375 WeakPolarHBondContact O-CD2 3.45Å; F371-F375 PolarHBondContact O-N 2.98Å |
| 372 | V | 88.3 | Confident | 83.4 | Confident | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -58.5 | -41.3 | 173.1 | 172.9 | 0 | 0 | 0 | 0 | 109.5 | I239 L242 S243 Y246 I352 A356 A368 L374 F375 A376 | I239-V372 HydrophobicContact CG2-CG2 4.12Å; L242-V372 HydrophobicContact CB-CG2 4.28Å; S243-V372 WeakPolarHBondContact OG-CG2 3.3Å; Y246-V372 HydrophobicContact CD1-CB 4.44Å; Y246-V372 HydrophobicContact CD1-CG1 3.27Å; Y246-V372 WeakPolarHBondContact CD1-O 3.41Å; Y246-V372 HydrophobicContact CD2-CG1 4.36Å; Y246-V372 HydrophobicContact CE1-CG1 3.76Å; Y246-V372 HydrophobicContact CG-CG1 3.61Å; I352-V372 HydrophobicContact CG2-CG1 3.94Å; A356-V372 HydrophobicContact CB-CB 4.16Å; A356-V372 HydrophobicContact CB-CG2 3.65Å; A368-V372 WeakPolarHBondContact O-CG2 3.4Å; A368-V372 PolarHBondContact O-N 3.49Å; V372-L374 PolarHBondContact O-N 2.69Å; V372-F375 PolarHBondContact O-N 2.89Å; V372-F375 VanDerWaalsContact O-N 3.17Å; V372-A376 PolarHBondContact O-N 3.17Å |
| 373 | G | 87.1 | Confident | 83.8 | Confident | 2 Ų | 2 | 19 Ų | 19 | 2% | 0.021 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -53.9 | -44.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | T369 G370 F371 F375 A376 Y377 | T369-G373 WeakPolarHBondContact O-CA 3.39Å; T369-G373 PolarHBondContact O-N 2.8Å; G370-G373 CarbonylContact O-C 3.6Å; G370-G373 WeakPolarHBondContact O-CA 3.28Å; G370-G373 PolarHBondContact O-N 3.38Å; F371-G373 PolarHBondContact O-N 2.91Å; G373-F375 VanDerWaalsContact C-N 3.33Å; G373-F375 PolarHBondContact O-N 3.16Å; G373-A376 WeakPolarHBondContact O-CB 3.49Å; G373-A376 PolarHBondContact O-N 3.32Å; G373-Y377 VanDerWaalsContact O-CD2 3.22Å; G373-Y377 WeakPolarHBondContact O-CD2 3.38Å; G373-Y377 PolarHBondContact O-N 3.33Å |
| 374 | L | 88.2 | Confident | 84 | Confident | 43 Ų | 43 | 17.6 Ų | 17.6 | 23% | 0.225 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -56.8 | -48.4 | 175.8 | 168.1 | 66.8 | 0 | 0 | 0 | 110.9 | G66 V67 F70 G370 F371 V372 A376 Y377 L378 | G66-L374 VanDerWaalsContact C-CD1 3.43Å; V67-L374 HydrophobicContact CG2-CD1 4.05Å; F70-L374 HydrophobicContact CB-CB 4.14Å; F70-L374 HydrophobicContact CB-CD2 4.33Å; F70-L374 HydrophobicContact CD1-CD2 4.34Å; F70-L374 HydrophobicContact CG-CD2 4.48Å; G370-L374 PolarHBondContact O-N 2.92Å; F371-L374 WeakPolarHBondContact O-CB 3.33Å; F371-L374 PolarHBondContact O-N 3.44Å; F371-L374 VanDerWaalsContact O-N 3.1Å; V372-L374 PolarHBondContact O-N 2.69Å; L374-A376 VanDerWaalsContact C-N 3.32Å; L374-A376 PolarHBondContact O-N 3.02Å; L374-Y377 PolarHBondContact O-N 3.03Å; L374-L378 PolarHBondContact O-N 3.33Å |
| 375 | F | 88.2 | Confident | 83.7 | Confident | 34 Ų | 34 | 26.5 Ų | 26.5 | 15% | 0.149 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -65.1 | -33.8 | 177.8 | -82.7 | -85.1 | 0 | 0 | 0 | 112.7 | W240 V247 F371 V372 G373 Y377 L378 G379 | W240-F375 HydrophobicContact CE3-CZ 4.43Å; W240-F375 HydrophobicContact CH2-CZ 4.16Å; W240-F375 HydrophobicContact CZ3-CE1 4.37Å; W240-F375 HydrophobicContact CZ3-CE2 4.46Å; W240-F375 AromaticContact CZ3-CZ 3.73Å; W240-F375 HydrophobicContact CZ3-CZ 3.73Å; V247-F375 HydrophobicContact CG2-CB 3.8Å; V247-F375 HydrophobicContact CG2-CD1 3.88Å; V247-F375 HydrophobicContact CG2-CG 4.34Å; V247-F375 VanDerWaalsContact CG2-O 3.29Å; V247-F375 WeakPolarHBondContact CG2-O 3.45Å; F371-F375 HydrophobicContact CD1-CD2 4.33Å; F371-F375 HydrophobicContact CD1-CE2 4.33Å; F371-F375 HydrophobicContact CD2-CE2 4.42Å; F371-F375 HydrophobicContact CE1-CD2 4.07Å; F371-F375 AromaticContact CE1-CE2 3.7Å; F371-F375 HydrophobicContact CE1-CE2 3.7Å; F371-F375 AromaticContact CE2-CE2 3.81Å; F371-F375 HydrophobicContact CE2-CE2 3.81Å; F371-F375 HydrophobicContact CZ-CD2 4.22Å; F371-F375 AromaticContact CZ-CE2 3.43Å; F371-F375 HydrophobicContact CZ-CE2 3.43Å; F371-F375 VanDerWaalsContact CZ-CE2 3.43Å; F371-F375 HydrophobicContact CZ-CZ 4.26Å; F371-F375 WeakPolarHBondContact O-CD2 3.45Å; F371-F375 PolarHBondContact O-N 2.98Å; V372-F375 PolarHBondContact O-N 2.89Å; V372-F375 VanDerWaalsContact O-N 3.17Å; G373-F375 VanDerWaalsContact C-N 3.33Å; G373-F375 PolarHBondContact O-N 3.16Å; F375-Y377 PolarHBondContact O-N 3.22Å; F375-L378 WeakPolarHBondContact O-CB 3.49Å; F375-L378 PolarHBondContact O-N 3.23Å; F375-G379 PolarHBondContact O-N 3.04Å |
| 376 | A | 87.7 | Confident | 83.8 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -56.9 | -48.8 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113 | Y246 Y250 V372 G373 L374 L378 G379 A380 | Y246-A376 HydrophobicContact CD1-CB 3.1Å; Y246-A376 HydrophobicContact CE1-CB 3.11Å; Y246-A376 HydrophobicContact CG-CB 4.12Å; Y250-A376 WeakPolarHBondContact CB-O 3.48Å; Y250-A376 HydrophobicContact CD1-CB 3.88Å; Y250-A376 WeakPolarHBondContact CD1-O 3.1Å; Y250-A376 HydrophobicContact CD2-CB 3.44Å; Y250-A376 VanDerWaalsContact CD2-CB 3.44Å; Y250-A376 HydrophobicContact CE1-CB 3.85Å; Y250-A376 HydrophobicContact CE2-CB 3.41Å; Y250-A376 VanDerWaalsContact CE2-CB 3.41Å; Y250-A376 HydrophobicContact CG-CB 3.65Å; V372-A376 PolarHBondContact O-N 3.17Å; G373-A376 WeakPolarHBondContact O-CB 3.49Å; G373-A376 PolarHBondContact O-N 3.32Å; L374-A376 VanDerWaalsContact C-N 3.32Å; L374-A376 PolarHBondContact O-N 3.02Å; A376-L378 VanDerWaalsContact C-N 3.3Å; A376-G379 CarbonylContact O-C 3.53Å; A376-G379 WeakPolarHBondContact O-CA 3.18Å; A376-G379 PolarHBondContact O-N 3.43Å; A376-G379 VanDerWaalsContact O-N 3.12Å; A376-A380 PolarHBondContact O-N 2.84Å |
| 377 | Y | 86.7 | Confident | 83.8 | Confident | 19 Ų | 19 | 29 Ų | 29 | 8% | 0.075 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -72.5 | -27.9 | 180 | -76.3 | -78 | 0 | 0 | 0 | 112.4 | Y62 Y65 K69 G373 L374 F375 G379 A380 S381 | Y62-Y377 AromaticContact CD1-CD1 3.67Å; Y62-Y377 HydrophobicContact CD1-CD1 3.67Å; Y62-Y377 AromaticContact CD1-CE1 3.92Å; Y62-Y377 HydrophobicContact CD1-CE1 3.92Å; Y62-Y377 HydrophobicContact CE1-CD1 4.42Å; Y62-Y377 HydrophobicContact CE1-CE1 4.3Å; Y62-Y377 HydrophobicContact CG-CD1 4.48Å; Y65-Y377 HydrophobicContact CD1-CD1 4.06Å; Y65-Y377 AromaticContact CD1-CD2 3.74Å; Y65-Y377 HydrophobicContact CD1-CD2 3.74Å; Y65-Y377 AromaticContact CD1-CE1 3.65Å; Y65-Y377 HydrophobicContact CD1-CE1 3.65Å; Y65-Y377 AromaticContact CD1-CE2 3.39Å; Y65-Y377 HydrophobicContact CD1-CE2 3.39Å; Y65-Y377 HydrophobicContact CD1-CG 4.1Å; Y65-Y377 AromaticContact CD1-CZ 3.31Å; Y65-Y377 HydrophobicContact CE1-CD2 4.06Å; Y65-Y377 AromaticContact CE1-CE1 3.96Å; Y65-Y377 HydrophobicContact CE1-CE1 3.96Å; Y65-Y377 AromaticContact CE1-CE2 3.26Å; Y65-Y377 HydrophobicContact CE1-CE2 3.26Å; Y65-Y377 AromaticContact CE1-CZ 3.16Å; Y65-Y377 WeakPolarHBondContact CE1-OH 3.43Å; K69-Y377 HydrophobicContact CD-CD2 4.1Å; K69-Y377 HydrophobicContact CD-CE2 3.67Å; G373-Y377 VanDerWaalsContact O-CD2 3.22Å; G373-Y377 WeakPolarHBondContact O-CD2 3.38Å; G373-Y377 PolarHBondContact O-N 3.33Å; L374-Y377 PolarHBondContact O-N 3.03Å; F375-Y377 PolarHBondContact O-N 3.22Å; Y377-G379 VanDerWaalsContact C-N 3.34Å; Y377-A380 PolarHBondContact O-N 3.04Å; Y377-S381 WeakPolarHBondContact O-CB 3.24Å; Y377-S381 PolarHBondContact O-N 2.92Å |
| 378 | L | 85.9 | Confident | 83.3 | Confident | 79 Ų | 79 | 30 Ų | 30 | 41% | 0.414 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -61.4 | -45.6 | 166 | -168.6 | 150.2 | 0 | 0 | 0 | 110.2 | L374 F375 A376 A380 S381 L382 | L374-L378 PolarHBondContact O-N 3.33Å; F375-L378 WeakPolarHBondContact O-CB 3.49Å; F375-L378 PolarHBondContact O-N 3.23Å; A376-L378 VanDerWaalsContact C-N 3.3Å; L378-A380 PolarHBondContact O-N 3.39Å; L378-S381 PolarHBondContact O-N 3.24Å; L378-S381 VanDerWaalsContact O-N 3.15Å; L378-S381 PolarHBondContact O-OG 3.35Å; L378-L382 HydrophobicContact CD2-CD1 3.71Å; L378-L382 HydrophobicContact CD2-CG 4.17Å; L378-L382 WeakPolarHBondContact O-CG 3.3Å; L378-L382 PolarHBondContact O-N 3.35Å |
| 379 | G | 84 | Confident | 83 | Confident | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -58 | -45.2 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | V251 F375 A376 Y377 S381 L382 A383 | V251-G379 WeakPolarHBondContact CG2-O 3.33Å; F375-G379 PolarHBondContact O-N 3.04Å; A376-G379 CarbonylContact O-C 3.53Å; A376-G379 WeakPolarHBondContact O-CA 3.18Å; A376-G379 PolarHBondContact O-N 3.43Å; A376-G379 VanDerWaalsContact O-N 3.12Å; Y377-G379 VanDerWaalsContact C-N 3.34Å; G379-S381 VanDerWaalsContact C-N 3.29Å; G379-S381 PolarHBondContact O-N 3.01Å; G379-L382 PolarHBondContact O-N 2.99Å; G379-L382 VanDerWaalsContact O-N 3.16Å; G379-A383 PolarHBondContact O-N 3.44Å; G379-A383 VanDerWaalsContact O-N 3.16Å |
| 380 | A | 83 | Confident | 82.8 | Confident | 12 Ų | 12 | 36 Ų | 36 | 10% | 0.099 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -58.8 | -41.4 | 174 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y250 A254 A376 Y377 L378 L382 A383 | Y250-A380 HydrophobicContact CD1-CB 4.2Å; A254-A380 HydrophobicContact CB-CB 4.09Å; A376-A380 PolarHBondContact O-N 2.84Å; Y377-A380 PolarHBondContact O-N 3.04Å; L378-A380 PolarHBondContact O-N 3.39Å; A380-L382 VanDerWaalsContact C-N 3.33Å; A380-L382 PolarHBondContact O-N 2.86Å; A380-A383 WeakPolarHBondContact O-CB 3.31Å; A380-A383 PolarHBondContact O-N 3.46Å |
| 381 | S | 78.9 | Confident | 82.3 | Confident | 48 Ų | 48 | 37 Ų | 37 | 34% | 0.336 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -65.9 | -34.2 | 177.4 | 75.4 | 0 | 0 | 0 | 0 | 112.9 | Y377 L378 G379 A383 G384 | Y377-S381 WeakPolarHBondContact O-CB 3.24Å; Y377-S381 PolarHBondContact O-N 2.92Å; L378-S381 PolarHBondContact O-N 3.24Å; L378-S381 VanDerWaalsContact O-N 3.15Å; L378-S381 PolarHBondContact O-OG 3.35Å; G379-S381 VanDerWaalsContact C-N 3.29Å; G379-S381 PolarHBondContact O-N 3.01Å; S381-A383 VanDerWaalsContact C-N 3.28Å; S381-A383 PolarHBondContact O-N 3.35Å; S381-G384 PolarHBondContact O-N 2.92Å; S381-G384 VanDerWaalsContact O-N 3.14Å |
| 382 | L | 81.9 | Confident | 81.8 | Confident | 72 Ų | 72 | 43 Ų | 43 | 38% | 0.377 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -69.9 | -25 | 175.9 | -68.8 | 174.7 | 0 | 0 | 0 | 112.7 | V247 V251 L378 G379 A380 G384 P386 | V247-L382 HydrophobicContact CG1-CD1 4.17Å; V251-L382 HydrophobicContact CG2-CB 4.17Å; L378-L382 HydrophobicContact CD2-CD1 3.71Å; L378-L382 HydrophobicContact CD2-CG 4.17Å; L378-L382 WeakPolarHBondContact O-CG 3.3Å; L378-L382 PolarHBondContact O-N 3.35Å; G379-L382 PolarHBondContact O-N 2.99Å; G379-L382 VanDerWaalsContact O-N 3.16Å; A380-L382 VanDerWaalsContact C-N 3.33Å; A380-L382 PolarHBondContact O-N 2.86Å; L382-G384 PolarHBondContact O-N 3.27Å; L382-P386 HydrophobicContact CD2-CG 3.94Å; L382-P386 WeakPolarHBondContact O-CB 3.44Å; L382-P386 VanDerWaalsContact O-CD 3.26Å; L382-P386 WeakPolarHBondContact O-CD 3.38Å; L382-P386 WeakPolarHBondContact O-CG 3.29Å |
| 383 | A | 79.6 | Confident | 81.4 | Confident | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 25% | 0.25 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.8 | -9.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | V251 A254 A255 W259 G379 A380 S381 L387 | V251-A383 HydrophobicContact CG1-CB 4.49Å; A254-A383 HydrophobicContact CB-CB 3.56Å; A255-A383 HydrophobicContact CB-CB 4.36Å; W259-A383 PolarHBondContact NE1-O 3.11Å; G379-A383 PolarHBondContact O-N 3.44Å; G379-A383 VanDerWaalsContact O-N 3.16Å; A380-A383 WeakPolarHBondContact O-CB 3.31Å; A380-A383 PolarHBondContact O-N 3.46Å; S381-A383 VanDerWaalsContact C-N 3.28Å; S381-A383 PolarHBondContact O-N 3.35Å; A383-L387 HydrophobicContact CB-CD2 4.38Å; A383-L387 VanDerWaalsContact O-CB 3.31Å; A383-L387 WeakPolarHBondContact O-CB 3.43Å |
| 384 | G | 75.7 | Confident | 81.1 | Confident | 26 Ų | 26 | 54.7 Ų | 54.7 | 27% | 0.268 | 28% | 0.278 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.4 | -96.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | S381 L382 L387 A388 | S381-G384 PolarHBondContact O-N 2.92Å; S381-G384 VanDerWaalsContact O-N 3.14Å; L382-G384 PolarHBondContact O-N 3.27Å; G384-L387 PolarHBondContact O-N 2.91Å; G384-A388 WeakPolarHBondContact O-CB 3.31Å; G384-A388 PolarHBondContact O-N 3.43Å |
| 385 | W | 73.8 | Confident | 80.8 | Confident | 192 Ų | 192 | 58.1 Ų | 58.1 | 73% | 0.727 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -65 | -47.4 | -170.8 | 179.9 | 83.8 | 0 | 0 | 0 | 114.9 | L387 A388 K389 | W385-L387 VanDerWaalsContact C-N 3.3Å; W385-L387 PolarHBondContact O-N 2.86Å; W385-A388 WeakPolarHBondContact O-CB 3.4Å; W385-A388 PolarHBondContact O-N 2.89Å; W385-K389 HydrophobicContact CH2-CD 4.43Å; W385-K389 HydrophobicContact CZ2-CD 4.49Å; W385-K389 PolarHBondContact O-N 3.37Å; W385-K389 VanDerWaalsContact O-N 3.09Å |
| 386 | P | 81.3 | Confident | 80.3 | Confident | 47 Ų | 47 | 58.2 Ų | 58.2 | 31% | 0.305 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.1 | -39.9 | 178.1 | -23.9 | 33.1 | 0 | 0 | 0 | 113.2 | L382 K389 V390 | L382-P386 HydrophobicContact CD2-CG 3.94Å; L382-P386 WeakPolarHBondContact O-CB 3.44Å; L382-P386 VanDerWaalsContact O-CD 3.26Å; L382-P386 WeakPolarHBondContact O-CD 3.38Å; L382-P386 WeakPolarHBondContact O-CG 3.29Å; P386-K389 PolarHBondContact O-N 3.46Å; P386-V390 WeakPolarHBondContact O-CG2 3.24Å; P386-V390 PolarHBondContact O-N 3.23Å |
| 387 | L | 79.1 | Confident | 79.9 | Confident | 5 Ų | 5 | 60.8 Ų | 60.8 | 3% | 0.026 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -72.9 | -36.3 | 179.9 | -164.4 | 65.2 | 0 | 0 | 0 | 112.1 | A255 A383 G384 W385 K389 V390 L391 F399 V402 | A255-L387 HydrophobicContact CB-CD2 3.35Å; A383-L387 HydrophobicContact CB-CD2 4.38Å; A383-L387 VanDerWaalsContact O-CB 3.31Å; A383-L387 WeakPolarHBondContact O-CB 3.43Å; G384-L387 PolarHBondContact O-N 2.91Å; W385-L387 VanDerWaalsContact C-N 3.3Å; W385-L387 PolarHBondContact O-N 2.86Å; L387-K389 VanDerWaalsContact C-N 3.31Å; L387-K389 PolarHBondContact O-N 3.31Å; L387-V390 WeakPolarHBondContact O-CB 3.26Å; L387-V390 PolarHBondContact O-N 3.21Å; L387-L391 PolarHBondContact O-N 2.85Å; L387-F399 HydrophobicContact CD1-CD2 3.94Å; L387-F399 HydrophobicContact CD2-CD2 3.65Å; L387-F399 HydrophobicContact CD2-CE2 3.43Å; L387-F399 VanDerWaalsContact CD2-CE2 3.43Å; L387-F399 HydrophobicContact CG-CD2 3.73Å; L387-F399 HydrophobicContact CG-CE2 4.04Å; L387-V402 HydrophobicContact CD1-CB 4.17Å; L387-V402 HydrophobicContact CD1-CG1 3.91Å |
| 388 | A | 75 | Confident | 79.6 | Confident | 21 Ų | 21 | 60.1 Ų | 60.1 | 17% | 0.174 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -56.3 | -46 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | W259 G384 W385 V390 L391 D392 | W259-A388 HydrophobicContact CH2-CB 3.45Å; W259-A388 VanDerWaalsContact CH2-CB 3.45Å; W259-A388 HydrophobicContact CZ2-CB 3.61Å; G384-A388 WeakPolarHBondContact O-CB 3.31Å; G384-A388 PolarHBondContact O-N 3.43Å; W385-A388 WeakPolarHBondContact O-CB 3.4Å; W385-A388 PolarHBondContact O-N 2.89Å; A388-V390 VanDerWaalsContact C-N 3.29Å; A388-V390 PolarHBondContact O-N 2.89Å; A388-L391 WeakPolarHBondContact O-CA 3.21Å; A388-L391 VanDerWaalsContact O-CB 3.3Å; A388-L391 WeakPolarHBondContact O-CB 3.36Å; A388-L391 PolarHBondContact O-N 2.98Å; A388-D392 PolarHBondContact O-N 3.48Å |
| 389 | K | 77.8 | Confident | 79.4 | Confident | 119 Ų | 119 | 56.6 Ų | 56.6 | 52% | 0.517 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.1 | -35.8 | 178.1 | -170.7 | 173.5 | -176.7 | 176.5 | 0 | 112.5 | W385 P386 L387 L391 D392 T393 | W385-K389 HydrophobicContact CH2-CD 4.43Å; W385-K389 HydrophobicContact CZ2-CD 4.49Å; W385-K389 PolarHBondContact O-N 3.37Å; W385-K389 VanDerWaalsContact O-N 3.09Å; P386-K389 PolarHBondContact O-N 3.46Å; L387-K389 VanDerWaalsContact C-N 3.31Å; L387-K389 PolarHBondContact O-N 3.31Å; K389-L391 VanDerWaalsContact C-N 3.35Å; K389-D392 PolarHBondContact O-N 3.41Å; K389-T393 WeakPolarHBondContact O-CG2 3.48Å; K389-T393 PolarHBondContact O-N 3.26Å; K389-T393 VanDerWaalsContact O-N 3.16Å; K389-T393 PolarHBondContact O-OG1 3.2Å; K389-T393 VanDerWaalsContact O-OG1 3.1Å |
| 390 | V | 82.1 | Confident | 79.3 | Confident | 25 Ų | 25 | 57.2 Ų | 57.2 | 15% | 0.152 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.8 | -39.8 | 172.9 | 167.3 | 0 | 0 | 0 | 0 | 111 | P386 L387 A388 T393 W394 V402 | P386-V390 WeakPolarHBondContact O-CG2 3.24Å; P386-V390 PolarHBondContact O-N 3.23Å; L387-V390 WeakPolarHBondContact O-CB 3.26Å; L387-V390 PolarHBondContact O-N 3.21Å; A388-V390 VanDerWaalsContact C-N 3.29Å; A388-V390 PolarHBondContact O-N 2.89Å; V390-T393 PolarHBondContact O-N 2.84Å; V390-T393 PolarHBondContact O-OG1 2.7Å; V390-W394 HydrophobicContact CG1-CE3 3.92Å; V390-W394 HydrophobicContact CG2-CE3 4.48Å; V390-W394 WeakPolarHBondContact O-CA 3.47Å; V390-W394 WeakPolarHBondContact O-CB 3.28Å; V390-W394 PolarHBondContact O-N 3.25Å; V390-V402 HydrophobicContact CG1-CG2 4.07Å; V390-V402 HydrophobicContact CG2-CG2 4.41Å |
| 391 | L | 75.6 | Confident | 79.3 | Confident | 22 Ų | 22 | 59.9 Ų | 59.9 | 12% | 0.115 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63.2 | -42 | 175.1 | -167.2 | 72 | 0 | 0 | 0 | 111.2 | W259 L262 L387 A388 K389 T393 H395 W396 F399 | W259-L391 HydrophobicContact CE3-CD2 3.73Å; W259-L391 HydrophobicContact CZ3-CD2 3.7Å; L262-L391 HydrophobicContact CD2-CD2 4.22Å; L387-L391 PolarHBondContact O-N 2.85Å; A388-L391 WeakPolarHBondContact O-CA 3.21Å; A388-L391 VanDerWaalsContact O-CB 3.3Å; A388-L391 WeakPolarHBondContact O-CB 3.36Å; A388-L391 PolarHBondContact O-N 2.98Å; K389-L391 VanDerWaalsContact C-N 3.35Å; L391-T393 PolarHBondContact O-N 3.13Å; L391-H395 WeakPolarHBondContact O-CA 3.45Å; L391-H395 PolarHBondContact O-N 3.35Å; L391-W396 HydrophobicContact CD1-CD2 3.64Å; L391-W396 HydrophobicContact CD1-CE3 3.58Å; L391-W396 HydrophobicContact CD1-CG 4.23Å; L391-W396 HydrophobicContact CD1-CH2 4.11Å; L391-W396 HydrophobicContact CD1-CZ2 4.17Å; L391-W396 HydrophobicContact CD1-CZ3 3.81Å; L391-W396 HydrophobicContact CD2-CH2 4.15Å; L391-W396 HydrophobicContact CD2-CZ2 4.3Å; L391-F399 HydrophobicContact CD1-CB 4.26Å |
| 392 | D | 77.3 | Confident | 79.6 | Confident | 138 Ų | 138 | 59.9 Ų | 59.9 | 74% | 0.738 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -62.8 | -39.4 | 177.6 | -67.6 | -23.7 | 0 | 0 | 0 | 112.5 | A388 K389 | A388-D392 PolarHBondContact O-N 3.48Å; K389-D392 PolarHBondContact O-N 3.41Å |
| 393 | T | 81.3 | Confident | 79.7 | Confident | 87 Ų | 87 | 56.5 Ų | 56.5 | 53% | 0.534 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -89.7 | -39.7 | -175.5 | 56.8 | 0 | 0 | 0 | 0 | 114.1 | K389 V390 L391 | K389-T393 WeakPolarHBondContact O-CG2 3.48Å; K389-T393 PolarHBondContact O-N 3.26Å; K389-T393 VanDerWaalsContact O-N 3.16Å; K389-T393 PolarHBondContact O-OG1 3.2Å; K389-T393 VanDerWaalsContact O-OG1 3.1Å; V390-T393 PolarHBondContact O-N 2.84Å; V390-T393 PolarHBondContact O-OG1 2.7Å; L391-T393 PolarHBondContact O-N 3.13Å |
| 394 | W | 79 | Confident | 79.8 | Confident | 160 Ų | 160 | 58.1 Ų | 58.1 | 61% | 0.606 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -124.8 | 14.2 | -169.6 | -64.6 | -29.1 | 0 | 0 | 0 | 112.9 | V390 G398 | V390-W394 HydrophobicContact CG1-CE3 3.92Å; V390-W394 HydrophobicContact CG2-CE3 4.48Å; V390-W394 WeakPolarHBondContact O-CA 3.47Å; V390-W394 WeakPolarHBondContact O-CB 3.28Å; V390-W394 PolarHBondContact O-N 3.25Å; W394-G398 PolarHBondContact O-N 3.14Å |
| 395 | H | 82.3 | Confident | 80.3 | Confident | 114 Ų | 114 | 61.4 Ų | 61.4 | 53% | 0.528 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | 50.3 | -161 | 173.4 | 51.4 | -77.3 | 0 | 0 | 0 | 111.8 | L391 S397 G398 F399 | L391-H395 WeakPolarHBondContact O-CA 3.45Å; L391-H395 PolarHBondContact O-N 3.35Å; H395-S397 PolarHBondContact CD2-OG 2.72Å; H395-S397 VanDerWaalsContact CD2-OG 3.24Å; H395-S397 WeakPolarHBondContact NE2-CB 3.46Å; H395-S397 PolarHBondContact NE2-OG 2.84Å; H395-S397 VanDerWaalsContact NE2-OG 3.07Å; H395-S397 PolarHBondContact O-N 3.06Å; H395-G398 PolarHBondContact O-N 3.35Å; H395-F399 PolarHBondContact O-N 2.87Å |
| 396 | W | 78.1 | Confident | 80.8 | Confident | 36 Ų | 36 | 52.6 Ų | 52.6 | 14% | 0.136 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.2 | -27.7 | -178.7 | -65.6 | 108.8 | 0 | 0 | 0 | 113.3 | W259 L262 Y263 E266 L391 F399 F400 | W259-W396 HydrophobicContact CB-CZ3 4.37Å; L262-W396 HydrophobicContact CB-CH2 4.06Å; L262-W396 HydrophobicContact CB-CZ2 4.4Å; L262-W396 HydrophobicContact CD2-CH2 4.07Å; L262-W396 HydrophobicContact CD2-CZ2 4.12Å; L262-W396 HydrophobicContact CG-CH2 4.04Å; L262-W396 HydrophobicContact CG-CZ2 3.95Å; Y263-W396 VanDerWaalsContact CA-CZ2 3.48Å; Y263-W396 HydrophobicContact CD2-CB 4.45Å; Y263-W396 AromaticContact CD2-CD2 3.6Å; Y263-W396 HydrophobicContact CD2-CD2 3.6Å; Y263-W396 AromaticContact CD2-CE3 3.58Å; Y263-W396 HydrophobicContact CD2-CE3 3.58Å; Y263-W396 AromaticContact CD2-CG 3.99Å; Y263-W396 HydrophobicContact CD2-CG 3.99Å; Y263-W396 HydrophobicContact CD2-CZ3 4.09Å; Y263-W396 HydrophobicContact CE2-CB 4.45Å; Y263-W396 HydrophobicContact CE2-CD2 4.41Å; Y263-W396 HydrophobicContact CE2-CG 4.36Å; Y263-W396 HydrophobicContact CG-CE3 4.21Å; Y263-W396 HydrophobicContact CG-CZ3 4.28Å; E266-W396 HydrophobicContact CB-CZ2 4.5Å; E266-W396 VanDerWaalsContact OE2-CZ2 3.26Å; E266-W396 WeakPolarHBondContact OE2-CZ2 3.34Å; E266-W396 PolarHBondContact OE2-NE1 3.22Å; L391-W396 HydrophobicContact CD1-CD2 3.64Å; L391-W396 HydrophobicContact CD1-CE3 3.58Å; L391-W396 HydrophobicContact CD1-CG 4.23Å; L391-W396 HydrophobicContact CD1-CH2 4.11Å; L391-W396 HydrophobicContact CD1-CZ2 4.17Å; L391-W396 HydrophobicContact CD1-CZ3 3.81Å; L391-W396 HydrophobicContact CD2-CH2 4.15Å; L391-W396 HydrophobicContact CD2-CZ2 4.3Å; W396-F399 HydrophobicContact CE3-CB 4.37Å; W396-F399 HydrophobicContact CE3-CD1 4.15Å; W396-F399 HydrophobicContact CE3-CG 4.22Å; W396-F399 HydrophobicContact CZ3-CD1 4.39Å; W396-F399 HydrophobicContact CZ3-CE1 4.49Å; W396-F399 HydrophobicContact CZ3-CG 4.4Å; W396-F399 WeakPolarHBondContact O-CB 3.25Å; W396-F399 PolarHBondContact O-N 2.87Å; W396-F400 HydrophobicContact CB-CE2 4.2Å; W396-F400 WeakPolarHBondContact O-CD2 3.25Å; W396-F400 PolarHBondContact O-N 3.39Å |
| 397 | S | 79.9 | Confident | 80.7 | Confident | 54 Ų | 54 | 50.3 Ų | 50.3 | 38% | 0.378 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -61.1 | -47.3 | 175.8 | -54.7 | 0 | 0 | 0 | 0 | 111.8 | H395 F399 F400 V401 | H395-S397 PolarHBondContact CD2-OG 2.72Å; H395-S397 VanDerWaalsContact CD2-OG 3.24Å; H395-S397 WeakPolarHBondContact NE2-CB 3.46Å; H395-S397 PolarHBondContact NE2-OG 2.84Å; H395-S397 VanDerWaalsContact NE2-OG 3.07Å; H395-S397 PolarHBondContact O-N 3.06Å; S397-F399 VanDerWaalsContact C-N 3.33Å; S397-F399 PolarHBondContact O-N 3.47Å; S397-F400 PolarHBondContact O-N 3.05Å; S397-V401 VanDerWaalsContact O-CG2 3.27Å; S397-V401 WeakPolarHBondContact O-CG2 3.26Å; S397-V401 PolarHBondContact O-N 3.05Å |
| 398 | G | 80.1 | Confident | 80.9 | Confident | 5 Ų | 5 | 51 Ų | 51 | 5% | 0.052 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.7 | -39.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | W394 H395 V401 V402 | W394-G398 PolarHBondContact O-N 3.14Å; H395-G398 PolarHBondContact O-N 3.35Å; G398-V401 PolarHBondContact O-N 3.44Å; G398-V402 WeakPolarHBondContact O-CG2 3.26Å; G398-V402 PolarHBondContact O-N 3.33Å |
| 399 | F | 80.7 | Confident | 81.3 | Confident | 5 Ų | 5 | 53.6 Ų | 53.6 | 2% | 0.022 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -57.7 | -51.1 | 175.5 | 174.7 | -91.1 | 0 | 0 | 0 | 112 | A255 W259 L387 L391 H395 W396 S397 V401 V402 I403 | A255-F399 HydrophobicContact CB-CE2 3.96Å; A255-F399 HydrophobicContact CB-CZ 4.04Å; W259-F399 HydrophobicContact CB-CE2 3.59Å; W259-F399 HydrophobicContact CB-CZ 3.84Å; W259-F399 AromaticContact CD1-CE2 3.91Å; W259-F399 AromaticContact CG-CE2 3.8Å; W259-F399 HydrophobicContact CG-CE2 3.8Å; W259-F399 HydrophobicContact CG-CZ 4.48Å; L387-F399 HydrophobicContact CD1-CD2 3.94Å; L387-F399 HydrophobicContact CD2-CD2 3.65Å; L387-F399 HydrophobicContact CD2-CE2 3.43Å; L387-F399 VanDerWaalsContact CD2-CE2 3.43Å; L387-F399 HydrophobicContact CG-CD2 3.73Å; L387-F399 HydrophobicContact CG-CE2 4.04Å; L391-F399 HydrophobicContact CD1-CB 4.26Å; H395-F399 PolarHBondContact O-N 2.87Å; W396-F399 HydrophobicContact CE3-CB 4.37Å; W396-F399 HydrophobicContact CE3-CD1 4.15Å; W396-F399 HydrophobicContact CE3-CG 4.22Å; W396-F399 HydrophobicContact CZ3-CD1 4.39Å; W396-F399 HydrophobicContact CZ3-CE1 4.49Å; W396-F399 HydrophobicContact CZ3-CG 4.4Å; W396-F399 WeakPolarHBondContact O-CB 3.25Å; W396-F399 PolarHBondContact O-N 2.87Å; S397-F399 VanDerWaalsContact C-N 3.33Å; S397-F399 PolarHBondContact O-N 3.47Å; F399-V401 VanDerWaalsContact C-N 3.35Å; F399-V401 PolarHBondContact O-N 3.34Å; F399-V402 PolarHBondContact O-N 2.85Å; F399-I403 HydrophobicContact CD1-CD1 3.67Å; F399-I403 HydrophobicContact CD2-CD1 4.3Å; F399-I403 HydrophobicContact CE1-CD1 3.19Å; F399-I403 HydrophobicContact CE2-CD1 3.9Å; F399-I403 HydrophobicContact CG-CD1 4.2Å; F399-I403 HydrophobicContact CZ-CD1 3.33Å; F399-I403 WeakPolarHBondContact O-CG1 3.35Å; F399-I403 PolarHBondContact O-N 2.94Å; F399-I403 VanDerWaalsContact O-N 3.09Å |
| 400 | F | 82.2 | Confident | 81.4 | Confident | 14 Ų | 14 | 48 Ų | 48 | 6% | 0.061 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -66 | -35.9 | 179.3 | -70.2 | -61.3 | 0 | 0 | 0 | 112.9 | Y263 L323 W324 W396 S397 I403 S404 | Y263-F400 HydrophobicContact CD1-CZ 4.49Å; Y263-F400 HydrophobicContact CD2-CE2 4.15Å; Y263-F400 AromaticContact CD2-CZ 3.94Å; Y263-F400 HydrophobicContact CD2-CZ 3.94Å; Y263-F400 HydrophobicContact CE1-CZ 4.16Å; Y263-F400 AromaticContact CE2-CE2 3.59Å; Y263-F400 HydrophobicContact CE2-CE2 3.59Å; Y263-F400 AromaticContact CE2-CZ 3.57Å; Y263-F400 HydrophobicContact CE2-CZ 3.57Å; Y263-F400 HydrophobicContact CG-CZ 4.38Å; Y263-F400 AromaticContact CZ-CZ 3.68Å; L323-F400 HydrophobicContact CB-CE1 4.23Å; L323-F400 HydrophobicContact CD1-CE1 4.24Å; W324-F400 HydrophobicContact CB-CB 4.46Å; W324-F400 HydrophobicContact CG-CB 4.3Å; W396-F400 HydrophobicContact CB-CE2 4.2Å; W396-F400 WeakPolarHBondContact O-CD2 3.25Å; W396-F400 PolarHBondContact O-N 3.39Å; S397-F400 PolarHBondContact O-N 3.05Å; F400-I403 PolarHBondContact O-N 3.09Å; F400-S404 VanDerWaalsContact O-CB 3.26Å; F400-S404 WeakPolarHBondContact O-CB 3.3Å; F400-S404 PolarHBondContact O-N 3.3Å; F400-S404 PolarHBondContact O-OG 3.45Å |
| 401 | V | 84.3 | Confident | 81.1 | Confident | 67 Ų | 67 | 47.3 Ų | 47.3 | 41% | 0.406 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62.6 | -47.2 | 175.3 | 169.6 | 0 | 0 | 0 | 0 | 110.7 | S397 G398 F399 I403 S404 I405 | S397-V401 VanDerWaalsContact O-CG2 3.27Å; S397-V401 WeakPolarHBondContact O-CG2 3.26Å; S397-V401 PolarHBondContact O-N 3.05Å; G398-V401 PolarHBondContact O-N 3.44Å; F399-V401 VanDerWaalsContact C-N 3.35Å; F399-V401 PolarHBondContact O-N 3.34Å; V401-I403 PolarHBondContact O-N 2.89Å; V401-S404 PolarHBondContact O-N 2.89Å; V401-I405 HydrophobicContact CG1-CD1 3.62Å; V401-I405 HydrophobicContact CG1-CG1 4.35Å; V401-I405 WeakPolarHBondContact O-CB 3.42Å; V401-I405 VanDerWaalsContact O-CG1 3.25Å; V401-I405 WeakPolarHBondContact O-CG1 3.46Å; V401-I405 PolarHBondContact O-N 3.48Å |
| 402 | V | 84.4 | Confident | 81.3 | Confident | 48 Ų | 48 | 51.6 Ų | 51.6 | 29% | 0.291 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -61.1 | -44.7 | 178.7 | 171.3 | 0 | 0 | 0 | 0 | 111.4 | L387 V390 G398 F399 I405 A406 | L387-V402 HydrophobicContact CD1-CB 4.17Å; L387-V402 HydrophobicContact CD1-CG1 3.91Å; V390-V402 HydrophobicContact CG1-CG2 4.07Å; V390-V402 HydrophobicContact CG2-CG2 4.41Å; G398-V402 WeakPolarHBondContact O-CG2 3.26Å; G398-V402 PolarHBondContact O-N 3.33Å; F399-V402 PolarHBondContact O-N 2.85Å; V402-I405 PolarHBondContact O-N 2.99Å; V402-A406 VanDerWaalsContact O-CB 3.31Å; V402-A406 WeakPolarHBondContact O-CB 3.47Å; V402-A406 PolarHBondContact O-N 3.44Å |
| 403 | I | 83.2 | Confident | 81.3 | Confident | 2 Ų | 2 | 47.3 Ų | 47.3 | 1% | 0.01 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -65.3 | -41.9 | 178.5 | -67.9 | 174.9 | 0 | 0 | 0 | 111.3 | V252 A255 I256 V320 F399 F400 V401 A406 A407 | V252-I403 HydrophobicContact CB-CG2 4.36Å; V252-I403 HydrophobicContact CG1-CG2 3.9Å; V252-I403 HydrophobicContact CG2-CG2 3.98Å; A255-I403 HydrophobicContact CB-CD1 3.65Å; A255-I403 HydrophobicContact CB-CG1 4Å; I256-I403 HydrophobicContact CG1-CD1 4.27Å; V320-I403 HydrophobicContact CB-CG2 4.5Å; V320-I403 HydrophobicContact CG1-CB 4.45Å; V320-I403 HydrophobicContact CG1-CG2 3.86Å; V320-I403 HydrophobicContact CG2-CG2 3.78Å; F399-I403 HydrophobicContact CD1-CD1 3.67Å; F399-I403 HydrophobicContact CD2-CD1 4.3Å; F399-I403 HydrophobicContact CE1-CD1 3.19Å; F399-I403 HydrophobicContact CE2-CD1 3.9Å; F399-I403 HydrophobicContact CG-CD1 4.2Å; F399-I403 HydrophobicContact CZ-CD1 3.33Å; F399-I403 WeakPolarHBondContact O-CG1 3.35Å; F399-I403 PolarHBondContact O-N 2.94Å; F399-I403 VanDerWaalsContact O-N 3.09Å; F400-I403 PolarHBondContact O-N 3.09Å; V401-I403 PolarHBondContact O-N 2.89Å; I403-A406 PolarHBondContact O-N 3.46Å; I403-A407 WeakPolarHBondContact O-CB 3.44Å; I403-A407 PolarHBondContact O-N 3.09Å |
| 404 | S | 82.1 | Confident | 80.9 | Confident | 33 Ų | 33 | 43.2 Ų | 43.2 | 23% | 0.231 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -65.5 | -42.5 | 179 | -59.6 | 0 | 0 | 0 | 0 | 111.5 | V320 F400 V401 A407 G408 | V320-S404 VanDerWaalsContact CG1-OG 3.25Å; V320-S404 WeakPolarHBondContact CG1-OG 3.47Å; F400-S404 VanDerWaalsContact O-CB 3.26Å; F400-S404 WeakPolarHBondContact O-CB 3.3Å; F400-S404 PolarHBondContact O-N 3.3Å; F400-S404 PolarHBondContact O-OG 3.45Å; V401-S404 PolarHBondContact O-N 2.89Å; S404-A407 PolarHBondContact O-N 3.43Å; S404-G408 PolarHBondContact O-N 3.05Å |
| 405 | I | 86.2 | Confident | 80.5 | Confident | 96 Ų | 96 | 39 Ų | 39 | 49% | 0.492 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.7 | -45.7 | 174.8 | -69.6 | 170 | 0 | 0 | 0 | 110.1 | V401 V402 A407 G408 I409 | V401-I405 HydrophobicContact CG1-CD1 3.62Å; V401-I405 HydrophobicContact CG1-CG1 4.35Å; V401-I405 WeakPolarHBondContact O-CB 3.42Å; V401-I405 VanDerWaalsContact O-CG1 3.25Å; V401-I405 WeakPolarHBondContact O-CG1 3.46Å; V401-I405 PolarHBondContact O-N 3.48Å; V402-I405 PolarHBondContact O-N 2.99Å; I405-A407 PolarHBondContact O-N 2.89Å; I405-G408 PolarHBondContact O-N 3.35Å; I405-I409 HydrophobicContact CG2-CD1 3.57Å; I405-I409 HydrophobicContact CG2-CG1 4.22Å; I405-I409 WeakPolarHBondContact O-CB 3.49Å; I405-I409 VanDerWaalsContact O-CG1 3.29Å; I405-I409 WeakPolarHBondContact O-CG1 3.45Å; I405-I409 PolarHBondContact O-N 3.32Å |
| 406 | A | 84.3 | Confident | 79.8 | Confident | 6 Ų | 6 | 36.7 Ų | 36.7 | 5% | 0.05 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -60.6 | -44.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | L248 V252 V402 I403 S410 | L248-A406 HydrophobicContact CB-CB 4.39Å; L248-A406 HydrophobicContact CD2-CB 4.03Å; V252-A406 HydrophobicContact CG2-CB 4.09Å; V402-A406 VanDerWaalsContact O-CB 3.31Å; V402-A406 WeakPolarHBondContact O-CB 3.47Å; V402-A406 PolarHBondContact O-N 3.44Å; I403-A406 PolarHBondContact O-N 3.46Å; A406-S410 VanDerWaalsContact O-CB 3.3Å; A406-S410 WeakPolarHBondContact O-CB 3.23Å; A406-S410 PolarHBondContact O-N 2.92Å |
| 407 | A | 79.9 | Confident | 79.1 | Confident | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -62.2 | -43.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | V252 I316 L317 I403 S404 I405 S410 A411 | V252-A407 HydrophobicContact CG2-CB 4.44Å; I316-A407 HydrophobicContact CB-CB 4.46Å; I316-A407 HydrophobicContact CG2-CB 3.65Å; L317-A407 HydrophobicContact CD2-CB 3.8Å; L317-A407 HydrophobicContact CG-CB 4.07Å; I403-A407 WeakPolarHBondContact O-CB 3.44Å; I403-A407 PolarHBondContact O-N 3.09Å; S404-A407 PolarHBondContact O-N 3.43Å; I405-A407 PolarHBondContact O-N 2.89Å; A407-S410 PolarHBondContact O-N 3.18Å; A407-S410 PolarHBondContact O-OG 3.46Å; A407-A411 PolarHBondContact O-N 3.44Å |
| 408 | G | 82.3 | Confident | 78 | Confident | 18 Ų | 18 | 35 Ų | 35 | 19% | 0.186 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.8 | -50.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | S404 I405 S410 A411 L412 | S404-G408 PolarHBondContact O-N 3.05Å; I405-G408 PolarHBondContact O-N 3.35Å; G408-S410 VanDerWaalsContact C-N 3.3Å; G408-S410 PolarHBondContact O-N 3.19Å; G408-A411 WeakPolarHBondContact O-CB 3.35Å; G408-A411 PolarHBondContact O-N 2.78Å; G408-L412 WeakPolarHBondContact O-CG 3.3Å; G408-L412 PolarHBondContact O-N 2.88Å |
| 409 | I | 84.8 | Confident | 76.9 | Confident | 76 Ų | 76 | 40.9 Ų | 40.9 | 39% | 0.39 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -63.3 | -39.8 | 176.4 | -62.9 | 170.6 | 0 | 0 | 0 | 110 | L248 I405 A411 L412 L413 | L248-I409 HydrophobicContact CD1-CB 3.81Å; L248-I409 HydrophobicContact CD1-CG2 3.51Å; I405-I409 HydrophobicContact CG2-CD1 3.57Å; I405-I409 HydrophobicContact CG2-CG1 4.22Å; I405-I409 WeakPolarHBondContact O-CB 3.49Å; I405-I409 VanDerWaalsContact O-CG1 3.29Å; I405-I409 WeakPolarHBondContact O-CG1 3.45Å; I405-I409 PolarHBondContact O-N 3.32Å; I409-A411 VanDerWaalsContact C-N 3.31Å; I409-A411 PolarHBondContact O-N 2.9Å; I409-L412 PolarHBondContact O-N 3.22Å; I409-L413 HydrophobicContact CG2-CD1 3.85Å; I409-L413 HydrophobicContact CG2-CG 4.08Å; I409-L413 WeakPolarHBondContact O-CB 3.28Å; I409-L413 VanDerWaalsContact O-CG 3.3Å; I409-L413 WeakPolarHBondContact O-CG 3.17Å; I409-L413 PolarHBondContact O-N 3.46Å |
| 410 | S | 79.7 | Confident | 75.6 | Confident | 1 Ų | 1 | 42.6 Ų | 42.6 | 1% | 0.007 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -60.5 | -41.3 | 177.3 | 80 | 0 | 0 | 0 | 0 | 112.1 | A406 A407 G408 L413 L414 | A406-S410 VanDerWaalsContact O-CB 3.3Å; A406-S410 WeakPolarHBondContact O-CB 3.23Å; A406-S410 PolarHBondContact O-N 2.92Å; A407-S410 PolarHBondContact O-N 3.18Å; A407-S410 PolarHBondContact O-OG 3.46Å; G408-S410 VanDerWaalsContact C-N 3.3Å; G408-S410 PolarHBondContact O-N 3.19Å; S410-L413 PolarHBondContact O-N 3.06Å; S410-L414 WeakPolarHBondContact O-CD1 3.4Å; S410-L414 VanDerWaalsContact O-CG 3.22Å; S410-L414 WeakPolarHBondContact O-CG 3.27Å; S410-L414 PolarHBondContact O-N 3.3Å; S410-L414 VanDerWaalsContact O-N 3.12Å |
| 411 | A | 75.3 | Confident | 74.1 | Confident | 11 Ų | 11 | 43.6 Ų | 43.6 | 9% | 0.091 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -63.7 | -44.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | A313 L317 A407 G408 I409 L414 L415 | A313-A411 HydrophobicContact CB-CB 3.68Å; L317-A411 HydrophobicContact CD1-CB 4.16Å; A407-A411 PolarHBondContact O-N 3.44Å; G408-A411 WeakPolarHBondContact O-CB 3.35Å; G408-A411 PolarHBondContact O-N 2.78Å; I409-A411 VanDerWaalsContact C-N 3.31Å; I409-A411 PolarHBondContact O-N 2.9Å; A411-L414 PolarHBondContact O-N 3.31Å; A411-L415 PolarHBondContact O-N 3.18Å |
| 412 | L | 79.1 | Confident | 72.1 | Confident | 112 Ų | 112 | 44 Ų | 44 | 59% | 0.586 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -64 | -41.8 | 178 | -68.9 | 173.1 | 0 | 0 | 0 | 112.3 | G408 I409 L414 L415 P416 | G408-L412 WeakPolarHBondContact O-CG 3.3Å; G408-L412 PolarHBondContact O-N 2.88Å; I409-L412 PolarHBondContact O-N 3.22Å; L412-L414 PolarHBondContact O-N 3.36Å; L412-L415 HydrophobicContact CD2-CD1 3.83Å; L412-L415 WeakPolarHBondContact O-CB 3.11Å; L412-L415 PolarHBondContact O-N 3.23Å; L412-P416 WeakPolarHBondContact O-CD 3.46Å |
| 413 | L | 77.8 | Confident | 69.8 | Low | 49 Ų | 49 | 45.7 Ų | 45.7 | 26% | 0.257 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -68.9 | -19.5 | 176.7 | -66.9 | 176.5 | 0 | 0 | 0 | 112.8 | L241 F244 L248 I409 S410 P416 | L241-L413 HydrophobicContact CD1-CB 4.09Å; L241-L413 HydrophobicContact CD1-CD2 3.7Å; L241-L413 HydrophobicContact CD1-CG 4.39Å; F244-L413 HydrophobicContact CB-CD1 4.24Å; L248-L413 HydrophobicContact CD1-CD1 4.02Å; I409-L413 HydrophobicContact CG2-CD1 3.85Å; I409-L413 HydrophobicContact CG2-CG 4.08Å; I409-L413 WeakPolarHBondContact O-CB 3.28Å; I409-L413 VanDerWaalsContact O-CG 3.3Å; I409-L413 WeakPolarHBondContact O-CG 3.17Å; I409-L413 PolarHBondContact O-N 3.46Å; S410-L413 PolarHBondContact O-N 3.06Å; L413-P416 WeakPolarHBondContact O-CD 3.18Å |
| 414 | L | 73.5 | Confident | 67.5 | Low | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -86.1 | -16.7 | 174.4 | -72.3 | 165.5 | 0 | 0 | 0 | 113.2 | C245 N309 A313 S410 A411 L412 F417 | C245-L414 WeakPolarHBondContact SG-CG 3Å; N309-L414 HydrophobicContact CB-CD1 4.04Å; N309-L414 HydrophobicContact CB-CD2 4.14Å; A313-L414 HydrophobicContact CB-CD1 4.23Å; S410-L414 WeakPolarHBondContact O-CD1 3.4Å; S410-L414 VanDerWaalsContact O-CG 3.22Å; S410-L414 WeakPolarHBondContact O-CG 3.27Å; S410-L414 PolarHBondContact O-N 3.3Å; S410-L414 VanDerWaalsContact O-N 3.12Å; A411-L414 PolarHBondContact O-N 3.31Å; L412-L414 PolarHBondContact O-N 3.36Å; L414-F417 HydrophobicContact CD2-CD2 4.23Å; L414-F417 VanDerWaalsContact O-CB 3.3Å; L414-F417 WeakPolarHBondContact O-CB 3.26Å; L414-F417 PolarHBondContact O-N 3.34Å |
| 415 | L | 69.9 | Low | 65 | Low | 72 Ų | 72 | 64.6 Ų | 64.6 | 38% | 0.377 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -58.5 | -44.2 | 177.6 | -72.6 | 170 | 0 | 0 | 0 | 113.3 | L310 A411 L412 F417 L418 | L310-L415 HydrophobicContact CD1-CD2 3.72Å; L310-L415 HydrophobicContact CD1-CG 4.22Å; L310-L415 HydrophobicContact CD2-CD2 3.9Å; L310-L415 HydrophobicContact CG-CD2 4.48Å; A411-L415 PolarHBondContact O-N 3.18Å; L412-L415 HydrophobicContact CD2-CD1 3.83Å; L412-L415 WeakPolarHBondContact O-CB 3.11Å; L412-L415 PolarHBondContact O-N 3.23Å; L415-F417 PolarHBondContact O-N 2.89Å; L415-F417 VanDerWaalsContact O-N 3.14Å; L415-L418 HydrophobicContact CD2-CD1 3.97Å; L415-L418 WeakPolarHBondContact O-CB 3.45Å; L415-L418 WeakPolarHBondContact O-CG 3.49Å; L415-L418 PolarHBondContact O-N 2.9Å; L415-L418 VanDerWaalsContact O-N 3.11Å |
| 416 | P | 67.3 | Low | 62.5 | Low | 66 Ų | 66 | 68.2 Ų | 68.2 | 43% | 0.429 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -59.5 | -24.7 | 174.9 | -24.2 | 34.2 | 0 | 0 | 0 | 113.8 | L241 L412 L413 L418 N419 A420 | L241-P416 HydrophobicContact CD2-CB 4.17Å; L241-P416 HydrophobicContact CD2-CG 4.35Å; L412-P416 WeakPolarHBondContact O-CD 3.46Å; L413-P416 WeakPolarHBondContact O-CD 3.18Å; P416-L418 VanDerWaalsContact C-N 3.27Å; P416-L418 PolarHBondContact O-N 3.43Å; P416-N419 PolarHBondContact O-N 3.41Å; P416-A420 PolarHBondContact O-N 3.44Å |
| 417 | F | 63.3 | Low | 61.4 | Low | 4 Ų | 4 | 71.4 Ų | 71.4 | 2% | 0.018 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -70.1 | -21.7 | 178.1 | -85.9 | -78.6 | 0 | 0 | 0 | 113.8 | Y238 L241 L242 L414 L415 N419 | Y238-F417 HydrophobicContact CD1-CE1 4.26Å; Y238-F417 HydrophobicContact CD1-CZ 4.28Å; L241-F417 HydrophobicContact CB-CE2 4.1Å; L241-F417 HydrophobicContact CB-CZ 4.45Å; L241-F417 HydrophobicContact CD2-CD2 4Å; L241-F417 HydrophobicContact CD2-CE2 3.47Å; L241-F417 VanDerWaalsContact CD2-CE2 3.47Å; L241-F417 HydrophobicContact CD2-CZ 4.19Å; L241-F417 HydrophobicContact CG-CE2 3.74Å; L242-F417 HydrophobicContact CD1-CE1 4.25Å; L242-F417 HydrophobicContact CD1-CZ 4.1Å; L242-F417 HydrophobicContact CD2-CD1 4.32Å; L242-F417 HydrophobicContact CD2-CD2 4.15Å; L242-F417 HydrophobicContact CD2-CE1 3.73Å; L242-F417 HydrophobicContact CD2-CE2 3.5Å; L242-F417 VanDerWaalsContact CD2-CE2 3.5Å; L242-F417 HydrophobicContact CD2-CZ 3.33Å; L242-F417 HydrophobicContact CG-CE1 3.92Å; L242-F417 HydrophobicContact CG-CE2 3.86Å; L242-F417 HydrophobicContact CG-CZ 3.33Å; L414-F417 HydrophobicContact CD2-CD2 4.23Å; L414-F417 VanDerWaalsContact O-CB 3.3Å; L414-F417 WeakPolarHBondContact O-CB 3.26Å; L414-F417 PolarHBondContact O-N 3.34Å; L415-F417 PolarHBondContact O-N 2.89Å; L415-F417 VanDerWaalsContact O-N 3.14Å; F417-N419 VanDerWaalsContact C-N 3.25Å; F417-N419 PolarHBondContact O-N 3.16Å |
| 418 | L | 58.3 | Low | 60.4 | Low | 49 Ų | 49 | 75.1 Ų | 75.1 | 26% | 0.257 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -59.5 | -41.3 | 172.7 | -63.1 | 170.3 | 0 | 0 | 0 | 111.1 | P307 L310 L415 P416 | P307-L418 HydrophobicContact CB-CD2 4.15Å; P307-L418 HydrophobicContact CG-CD2 3.81Å; L310-L418 HydrophobicContact CD2-CD1 4.1Å; L415-L418 HydrophobicContact CD2-CD1 3.97Å; L415-L418 WeakPolarHBondContact O-CB 3.45Å; L415-L418 WeakPolarHBondContact O-CG 3.49Å; L415-L418 PolarHBondContact O-N 2.9Å; L415-L418 VanDerWaalsContact O-N 3.11Å; P416-L418 VanDerWaalsContact C-N 3.27Å; P416-L418 PolarHBondContact O-N 3.43Å |
| 419 | N | 56.2 | Low | 59.2 | Low | 129 Ų | 129 | 78.3 Ų | 78.3 | 69% | 0.69 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -88 | -22.7 | -174.8 | -63.6 | -15 | 0 | 0 | 0 | 112.9 | P416 F417 T422 | P416-N419 PolarHBondContact O-N 3.41Å; F417-N419 VanDerWaalsContact C-N 3.25Å; F417-N419 PolarHBondContact O-N 3.16Å; N419-T422 PolarHBondContact O-OG1 3.32Å |
| 420 | A | 53.6 | Low | 57.7 | Low | 42 Ų | 42 | 78.4 Ų | 78.4 | 35% | 0.347 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -79.5 | -23.7 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y238 P416 | Y238-A420 HydrophobicContact CD1-CB 4.21Å; Y238-A420 HydrophobicContact CE1-CB 3.55Å; P416-A420 PolarHBondContact O-N 3.44Å |
| 421 | Q | 49.9 | Very low | 56.3 | Low | 35 Ų | 35 | 83.3 Ų | 83.3 | 16% | 0.164 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -102.7 | -13 | -177.6 | -66.8 | -170.4 | -27.5 | 0 | 0 | 114 | N304 P423 | N304-Q421 PolarHBondContact OD1-O 2.79Å; N304-Q421 VanDerWaalsContact OD1-O 3.08Å; Q421-P423 WeakPolarHBondContact O-CD 3.4Å |
| 422 | T | 42.5 | Very low | 55 | Low | 75 Ų | 75 | 88.1 Ų | 88.1 | 46% | 0.46 | 49% | 0.49 | S | S | . | . | S | Bend | trans | -54.6 | 123.7 | 167.6 | 23.8 | 0 | 0 | 0 | 0 | 108.7 | N419 R424 | N419-T422 PolarHBondContact O-OG1 3.32Å; T422-R424 PolarHBondContact O-N 3.07Å; T422-R424 VanDerWaalsContact O-N 3.09Å |
| 423 | P | 36.9 | Very low | 53.3 | Low | 83 Ų | 83 | 86.4 Ų | 86.4 | 54% | 0.539 | 48% | 0.483 | S | S | . | . | trans | -50.6 | 125.1 | 170.2 | -20.6 | 30.1 | 0 | 0 | 0 | 106.9 | Q421 E425 | Q421-P423 WeakPolarHBondContact O-CD 3.4Å; P423-E425 PolarHBondContact O-N 3.1Å | ||
| 424 | R | 33.8 | Very low | 51.4 | Low | 241 Ų | 241 | 89.2 Ų | 89.2 | 91% | 0.909 | 50% | 0.501 | S | S | * | . | trans | -56.9 | 110.6 | 164.4 | -76.9 | 178.9 | 165.5 | 172.2 | -5.6 | 105 | T422 A426 | T422-R424 PolarHBondContact O-N 3.07Å; T422-R424 VanDerWaalsContact O-N 3.09Å; R424-A426 PolarHBondContact O-N 3.24Å; R424-A426 VanDerWaalsContact O-N 3.17Å | ||
| 425 | E | 31.2 | Very low | 49.6 | Very low | 191 Ų | 191 | 96.7 Ų | 96.7 | 89% | 0.893 | 54% | 0.543 | S | S | * | . | trans | -53 | 123.5 | 161.8 | -71 | -177.9 | 161.9 | 0 | 0 | 105.8 | P423 | P423-E425 PolarHBondContact O-N 3.1Š| ||
| 426 | A | 32.5 | Very low | 47.8 | Very low | 173 Ų | 173 | 98.9 Ų | 98.9 | 100% | 1.43 | 56% | 0.558 | S | S | * | * | trans | -65.9 | 0 | -178.1 | 0 | 0 | 0 | 0 | 0 | 111 | R424 | R424-A426 PolarHBondContact O-N 3.24Å; R424-A426 VanDerWaalsContact O-N 3.17Å |
Retrieved 426 of 426 residues in 506.8 ms
(Link to these results)