| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 35 | Very low | 35.8 | Very low | 46 Ų | 46 | 49.3 Ų | 49.3 | 23% | 0.227 | 24% | 0.235 | C | C | . | . | 0 | -31.6 | 0 | -158.9 | 91.5 | 165.4 | 0 | 0 | 110.5 | T3 F4 R210 I271 E300 | M1-T3 VanDerWaalsContact C-N 3.26Å; M1-T3 PolarHBondContact O-N 3.29Å; M1-F4 WeakPolarHBondContact O-CB 3.4Å; M1-F4 PolarHBondContact O-N 3.21Å; M1-R210 HydrophobicContact CE-CG 3.46Å; M1-R210 VanDerWaalsContact CE-CG 3.46Å; M1-I271 HydrophobicContact CE-CD1 4.25Å; M1-E300 WeakPolarHBondContact CB-OE1 3.4Å; M1-E300 PolarHBondContact N-OE1 3.12Å | |||
| 2 | S | 31.2 | Very low | 35.7 | Very low | 20 Ų | 20 | 57.3 Ų | 57.3 | 14% | 0.14 | 27% | 0.269 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67 | -14.5 | 178.4 | -53 | 0 | 0 | 0 | 0 | 115.9 | E300 | S2-E300 PolarHBondContact OG-OE2 2.91Š|
| 3 | T | 33.9 | Very low | 35.1 | Very low | 12 Ų | 12 | 64.2 Ų | 64.2 | 7% | 0.074 | 31% | 0.309 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | -7.8 | 176.3 | 39.4 | 0 | 0 | 0 | 0 | 114.5 | M1 Y5 E6 | M1-T3 VanDerWaalsContact C-N 3.26Å; M1-T3 PolarHBondContact O-N 3.29Å; T3-Y5 VanDerWaalsContact C-N 3.31Å; T3-Y5 PolarHBondContact O-N 3.03Å; T3-E6 PolarHBondContact O-N 3.1Å |
| 4 | F | 38.8 | Very low | 34.5 | Very low | 32 Ų | 32 | 69.4 Ų | 69.4 | 14% | 0.14 | 34% | 0.338 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | -29.9 | -174.9 | -117 | -92.5 | 0 | 0 | 0 | 113.9 | M1 V7 R195 Y197 M206 | M1-F4 WeakPolarHBondContact O-CB 3.4Å; M1-F4 PolarHBondContact O-N 3.21Å; F4-V7 PolarHBondContact O-N 3.12Å; F4-R195 HydrophobicContact CE2-CB 3.89Å; F4-R195 VanDerWaalsContact CE2-O 3.29Å; F4-R195 WeakPolarHBondContact CE2-O 3.45Å; F4-R195 HydrophobicContact CZ-CB 4Å; F4-R195 WeakPolarHBondContact CZ-O 3.34Å; F4-Y197 HydrophobicContact CE1-CE2 4.4Å; F4-Y197 HydrophobicContact CZ-CD2 4.34Å; F4-Y197 AromaticContact CZ-CE2 3.88Å; F4-Y197 HydrophobicContact CZ-CE2 3.88Å; F4-M206 HydrophobicContact CD1-CE 3.6Å; F4-M206 HydrophobicContact CE1-CE 3.42Å; F4-M206 VanDerWaalsContact CE1-CE 3.42Å; F4-M206 HydrophobicContact CZ-CE 4.36Å |
| 5 | Y | 38.8 | Very low | 34.4 | Very low | 36 Ų | 36 | 70.9 Ų | 70.9 | 14% | 0.141 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -83.6 | -14.8 | -177.5 | -76.9 | -72.1 | 0 | 0 | 0 | 113.9 | T3 V7 E8 D274 Q293 | T3-Y5 VanDerWaalsContact C-N 3.31Å; T3-Y5 PolarHBondContact O-N 3.03Å; Y5-V7 PolarHBondContact O-N 3.33Å; Y5-E8 WeakPolarHBondContact CD1-OE2 3.47Å; Y5-D274 PolarHBondContact OH-OD1 3.37Å; Y5-D274 PolarHBondContact OH-OD2 2.88Å; Y5-Q293 HydrophobicContact CD2-CG 4.28Å; Y5-Q293 HydrophobicContact CE2-CG 4.38Å |
| 6 | E | 36 | Very low | 34.1 | Very low | 25 Ų | 25 | 73.3 Ų | 73.3 | 12% | 0.117 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65.6 | -20.3 | 168.6 | -102.5 | 166 | 125.8 | 0 | 0 | 111.2 | T3 I10 R190 | T3-E6 PolarHBondContact O-N 3.1Å; E6-I10 VanDerWaalsContact O-CD1 3.27Å; E6-I10 WeakPolarHBondContact O-CD1 3.3Å; E6-I10 WeakPolarHBondContact O-CG1 3.41Å; E6-I10 PolarHBondContact O-N 3.37Å; E6-I10 VanDerWaalsContact O-N 3.16Å; E6-R190 VanDerWaalsContact CD-CZ 3.47Å; E6-R190 IonicContact OE1-CZ 2.85Å; E6-R190 IonicContact OE1-NE 3.15Å; E6-R190 PolarHBondContact OE1-NE 3.45Å; E6-R190 IonicContact OE1-NH1 3.32Å; E6-R190 PolarHBondContact OE1-NH1 2.99Å; E6-R190 IonicContact OE1-NH2 3.9Å; E6-R190 PolarHBondContact OE1-NH2 3.43Å; E6-R190 IonicContact OE2-CZ 3.47Å; E6-R190 IonicContact OE2-NH1 2.9Å; E6-R190 IonicContact OE2-NH2 3.13Å; E6-R190 PolarHBondContact OE2-NH2 3.17Å |
| 7 | V | 37.8 | Very low | 33.8 | Very low | 18 Ų | 18 | 81.5 Ų | 81.5 | 11% | 0.109 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -92.2 | -28 | -174.6 | 174 | 0 | 0 | 0 | 0 | 113.3 | F4 Y5 H9 I10 F11 I192 | F4-V7 PolarHBondContact O-N 3.12Å; Y5-V7 PolarHBondContact O-N 3.33Å; V7-H9 PolarHBondContact O-N 2.95Å; V7-I10 PolarHBondContact O-N 3.08Å; V7-F11 HydrophobicContact CG1-CD2 3.56Å; V7-F11 HydrophobicContact CG1-CE2 3.9Å; V7-F11 WeakPolarHBondContact O-CB 3.26Å; V7-F11 PolarHBondContact O-N 3.4Å; V7-I192 HydrophobicContact CG2-CD1 3.19Å |
| 8 | E | 36 | Very low | 33.9 | Very low | 111 Ų | 111 | 87.3 Ų | 87.3 | 52% | 0.519 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -59.2 | -36 | 170.1 | -128.6 | 168 | -168.8 | 0 | 0 | 110.5 | Y5 F12 | Y5-E8 WeakPolarHBondContact CD1-OE2 3.47Å; E8-F12 PolarHBondContact O-N 3.03Å |
| 9 | H | 35 | Very low | 33.8 | Very low | 74 Ų | 74 | 92.6 Ų | 92.6 | 34% | 0.343 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -74.6 | -45 | 171.8 | -95.9 | -92.3 | 0 | 0 | 0 | 113.7 | V7 F11 F12 D13 P32 | V7-H9 PolarHBondContact O-N 2.95Å; H9-F11 VanDerWaalsContact C-N 3.3Å; H9-F11 PolarHBondContact O-N 2.97Å; H9-F12 PolarHBondContact O-N 2.91Å; H9-D13 PolarHBondContact O-N 3.39Å; H9-D13 VanDerWaalsContact O-N 3.12Å; H9-P32 VanDerWaalsContact CE1-CB 3.49Å; H9-P32 WeakPolarHBondContact CE1-CB 3.46Å |
| 10 | I | 37.8 | Very low | 33.9 | Very low | 53 Ų | 53 | 93.8 Ų | 93.8 | 27% | 0.272 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.5 | -33.5 | 179.3 | -67.3 | 160.5 | 0 | 0 | 0 | 112.3 | E6 V7 | E6-I10 VanDerWaalsContact O-CD1 3.27Å; E6-I10 WeakPolarHBondContact O-CD1 3.3Å; E6-I10 WeakPolarHBondContact O-CG1 3.41Å; E6-I10 PolarHBondContact O-N 3.37Å; E6-I10 VanDerWaalsContact O-N 3.16Å; V7-I10 PolarHBondContact O-N 3.08Å |
| 11 | F | 34 | Very low | 33.7 | Very low | 115 Ų | 115 | 92.8 Ų | 92.8 | 50% | 0.504 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -74.8 | -26.6 | 176.5 | -98 | -87.5 | 0 | 0 | 0 | 113.5 | V7 H9 Q199 | V7-F11 HydrophobicContact CG1-CD2 3.56Å; V7-F11 HydrophobicContact CG1-CE2 3.9Å; V7-F11 WeakPolarHBondContact O-CB 3.26Å; V7-F11 PolarHBondContact O-N 3.4Å; H9-F11 VanDerWaalsContact C-N 3.3Å; H9-F11 PolarHBondContact O-N 2.97Å; F11-Q199 VanDerWaalsContact CE1-NE2 3.27Å |
| 12 | F | 33.8 | Very low | 34 | Very low | 146 Ų | 146 | 98.5 Ų | 98.5 | 64% | 0.64 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -75.2 | -34.2 | 174.1 | -111.1 | -88.6 | 0 | 0 | 0 | 112.3 | E8 H9 N14 T15 | E8-F12 PolarHBondContact O-N 3.03Å; H9-F12 PolarHBondContact O-N 2.91Å; F12-N14 VanDerWaalsContact C-N 3.26Å; F12-N14 PolarHBondContact O-N 3Å; F12-T15 PolarHBondContact O-OG1 2.71Å |
| 13 | D | 28.8 | Very low | 34.1 | Very low | 147 Ų | 147 | 105.5 Ų | 105.5 | 79% | 0.786 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -74.2 | -16.3 | -177.9 | -146.9 | 21.2 | 0 | 0 | 0 | 113.2 | H9 | H9-D13 PolarHBondContact O-N 3.39Å; H9-D13 VanDerWaalsContact O-N 3.12Å |
| 14 | N | 26.7 | Very low | 34.1 | Very low | 136 Ų | 136 | 112.7 Ų | 112.7 | 73% | 0.727 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.4 | 7.4 | -176.4 | -137.9 | 19.3 | 0 | 0 | 0 | 114.2 | F12 | F12-N14 VanDerWaalsContact C-N 3.26Å; F12-N14 PolarHBondContact O-N 3Å |
| 15 | T | 32 | Very low | 34 | Very low | 92 Ų | 92 | 116.9 Ų | 116.9 | 56% | 0.564 | 61% | 0.608 | S | S | * | * | trans | -98.4 | 66.2 | 169.7 | 25.6 | 0 | 0 | 0 | 0 | 110.7 | F12 Y17 | F12-T15 PolarHBondContact O-OG1 2.71Å; T15-Y17 HydrophobicContact CG2-CE2 4.34Å; T15-Y17 PolarHBondContact O-N 3.1Å | ||
| 16 | S | 30.8 | Very low | 33.9 | Very low | 109 Ų | 109 | 122.9 Ų | 122.9 | 76% | 0.762 | 64% | 0.642 | S | S | * | * | trans | -80 | 99.1 | 165.1 | 49.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 17 | Y | 29 | Very low | 34 | Very low | 213 Ų | 213 | 127 Ų | 127 | 84% | 0.835 | 67% | 0.665 | S | S | * | * | trans | -92.6 | 110.9 | 162.1 | -80.3 | -84.4 | 0 | 0 | 0 | 108.7 | T15 E19 | T15-Y17 HydrophobicContact CG2-CE2 4.34Å; T15-Y17 PolarHBondContact O-N 3.1Å; Y17-E19 PolarHBondContact O-N 3.46Å | ||
| 18 | E | 34.3 | Very low | 33.9 | Very low | 187 Ų | 187 | 129.6 Ų | 129.6 | 87% | 0.874 | 70% | 0.695 | S | S | * | * | trans | -65.5 | 115.8 | 153.9 | -72 | -177.6 | 152.2 | 0 | 0 | 107.9 | ||||
| 19 | E | 31.8 | Very low | 33.8 | Very low | 187 Ų | 187 | 132.2 Ų | 132.2 | 87% | 0.874 | 71% | 0.705 | S | S | * | * | 180 | 143.8 | 124.9 | -103.9 | -177.3 | 167.5 | 0 | 0 | 112.6 | Y17 | Y17-E19 PolarHBondContact O-N 3.46Š| |||
| 20 | S | 36.7 | Very low | 34.3 | Very low | 116 Ų | 116 | 136.8 Ų | 136.8 | 81% | 0.811 | 73% | 0.726 | S | S | * | * | trans | -51 | 141 | 171.1 | 46.7 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 21 | G | 30.6 | Very low | 34.7 | Very low | 74 Ų | 74 | 142.6 Ų | 142.6 | 76% | 0.763 | 75% | 0.752 | S | S | * | * | trans | 157.8 | 109.9 | 160.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | F23 | G21-F23 PolarHBondContact O-N 3.39Š| ||
| 22 | D | 40.3 | Very low | 36 | Very low | 165 Ų | 165 | 140.5 Ų | 140.5 | 88% | 0.882 | 75% | 0.75 | S | S | * | * | trans | -58.2 | 108.8 | 174.2 | -131 | 5.2 | 0 | 0 | 0 | 110.8 | ||||
| 23 | F | 33.5 | Very low | 37.5 | Very low | 167 Ų | 167 | 135.1 Ų | 135.1 | 73% | 0.732 | 73% | 0.73 | S | S | * | * | trans | -160.2 | 97.3 | 160 | -156.2 | -100.7 | 0 | 0 | 0 | 110.4 | G21 L25 | G21-F23 PolarHBondContact O-N 3.39Å; F23-L25 HydrophobicContact CD1-CB 4.43Å; F23-L25 HydrophobicContact CD1-CD1 3.72Å; F23-L25 HydrophobicContact CD1-CG 3.96Å; F23-L25 HydrophobicContact CE1-CD1 3.6Å; F23-L25 HydrophobicContact CE1-CG 3.81Å; F23-L25 PolarHBondContact O-N 2.9Å | ||
| 24 | D | 34.1 | Very low | 39 | Very low | 164 Ų | 164 | 134.4 Ų | 134.4 | 88% | 0.877 | 73% | 0.726 | S | S | * | * | trans | -66.2 | 91.1 | 171.8 | -80.3 | -33.7 | 0 | 0 | 0 | 110.5 | ||||
| 25 | L | 35.6 | Very low | 40.5 | Very low | 120 Ų | 120 | 130.6 Ų | 130.6 | 63% | 0.628 | 70% | 0.702 | S | S | * | * | trans | -100 | 104.8 | 156.4 | -102.1 | 157.6 | 0 | 0 | 0 | 106.7 | F23 L27 | F23-L25 HydrophobicContact CD1-CB 4.43Å; F23-L25 HydrophobicContact CD1-CD1 3.72Å; F23-L25 HydrophobicContact CD1-CG 3.96Å; F23-L25 HydrophobicContact CE1-CD1 3.6Å; F23-L25 HydrophobicContact CE1-CG 3.81Å; F23-L25 PolarHBondContact O-N 2.9Å; L25-L27 PolarHBondContact O-N 3.35Å | ||
| 26 | D | 36.8 | Very low | 41.2 | Very low | 162 Ų | 162 | 132.2 Ų | 132.2 | 87% | 0.866 | 71% | 0.711 | S | S | * | * | trans | -65 | 70.7 | 168.1 | -171.9 | 32.1 | 0 | 0 | 0 | 109.5 | G28 | D26-G28 PolarHBondContact O-N 2.96Š| ||
| 27 | L | 38.6 | Very low | 42.3 | Very low | 112 Ų | 112 | 129.7 Ų | 129.7 | 59% | 0.586 | 70% | 0.703 | S | S | * | * | trans | -73.6 | 110.6 | 155.8 | -84.1 | 154.3 | 0 | 0 | 0 | 104.5 | L25 F29 | L25-L27 PolarHBondContact O-N 3.35Å; L27-F29 HydrophobicContact CB-CD2 3.98Å; L27-F29 HydrophobicContact CB-CE2 3.61Å; L27-F29 HydrophobicContact CB-CZ 4.31Å; L27-F29 HydrophobicContact CD1-CE2 4.37Å; L27-F29 WeakPolarHBondContact O-CD2 3.34Å; L27-F29 PolarHBondContact O-N 3.39Å | ||
| 28 | G | 35.6 | Very low | 43.8 | Very low | 72 Ų | 72 | 120.9 Ų | 120.9 | 74% | 0.742 | 68% | 0.677 | S | S | * | * | trans | -60.7 | 77.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | D26 E30 | D26-G28 PolarHBondContact O-N 2.96Å; G28-E30 PolarHBondContact O-N 3.24Å; G28-E30 VanDerWaalsContact O-N 3.14Å | ||
| 29 | F | 34.7 | Very low | 45.5 | Very low | 165 Ų | 165 | 114.7 Ų | 114.7 | 72% | 0.724 | 65% | 0.649 | S | S | * | * | trans | -67.5 | 104.7 | 163.4 | -70.6 | -78.9 | 0 | 0 | 0 | 105.4 | L27 E31 | L27-F29 HydrophobicContact CB-CD2 3.98Å; L27-F29 HydrophobicContact CB-CE2 3.61Å; L27-F29 HydrophobicContact CB-CZ 4.31Å; L27-F29 HydrophobicContact CD1-CE2 4.37Å; L27-F29 WeakPolarHBondContact O-CD2 3.34Å; L27-F29 PolarHBondContact O-N 3.39Å; F29-E31 PolarHBondContact O-N 3.4Å | ||
| 30 | E | 44.8 | Very low | 47.7 | Very low | 171 Ų | 171 | 111 Ų | 111 | 80% | 0.799 | 64% | 0.636 | S | S | * | * | trans | -52.7 | 111.2 | 166.5 | -80.3 | -178.5 | 143.4 | 0 | 0 | 107.3 | G28 | G28-E30 PolarHBondContact O-N 3.24Å; G28-E30 VanDerWaalsContact O-N 3.14Å | ||
| 31 | E | 46.6 | Very low | 49.9 | Very low | 174 Ų | 174 | 110.2 Ų | 110.2 | 81% | 0.813 | 62% | 0.618 | S | S | * | * | trans | -55.4 | 130.5 | 172.8 | -77.2 | -174.2 | 153.8 | 0 | 0 | 108.2 | F29 C33 | F29-E31 PolarHBondContact O-N 3.4Å; E31-C33 PolarHBondContact O-N 3.48Å | ||
| 32 | P | 60.5 | Low | 52.4 | Low | 72 Ų | 72 | 107.6 Ų | 107.6 | 47% | 0.468 | 59% | 0.586 | S | S | . | * | trans | -62.1 | 131.6 | -178.6 | 26.5 | -34.5 | 0 | 0 | 0 | 109.4 | H9 N34 | H9-P32 VanDerWaalsContact CE1-CB 3.49Å; H9-P32 WeakPolarHBondContact CE1-CB 3.46Å; P32-N34 PolarHBondContact O-N 3.26Å | ||
| 33 | C | 66.4 | Low | 54.5 | Low | 33 Ų | 33 | 104.7 Ų | 104.7 | 22% | 0.223 | 56% | 0.563 | C | S | . | * | trans | -57.4 | 112.5 | -176.1 | -61.3 | 0 | 0 | 0 | 0 | 110.6 | E31 R35 C286 | E31-C33 PolarHBondContact O-N 3.48Å; C33-R35 PolarHBondContact O-N 3.45Å; C33-C286 HydrophobicContact CB-CB 3.78Å; C33-C286 WeakPolarHBondContact CB-SG 3.2Å; C33-C286 WeakPolarHBondContact SG-CA 3.39Å; C33-C286 WeakPolarHBondContact SG-CB 3.43Å; C33-C286 CovalentContact SG-SG 2.05Å; C33-C286 PolarHBondContact SG-SG 3.3Å | ||
| 34 | N | 59.1 | Low | 57.2 | Low | 131 Ų | 131 | 102.4 Ų | 102.4 | 70% | 0.701 | 56% | 0.557 | S | S | * | * | trans | -71.5 | 117.6 | -178.2 | -91.2 | -32.3 | 0 | 0 | 0 | 111.4 | P32 V36 | P32-N34 PolarHBondContact O-N 3.26Å; N34-V36 PolarHBondContact O-N 2.9Å | ||
| 35 | R | 58.2 | Low | 59.9 | Low | 57 Ų | 57 | 97 Ų | 97 | 22% | 0.215 | 53% | 0.526 | C | S | . | . | trans | -79 | 77.2 | 178.8 | -70.7 | 179.1 | 167.6 | -173.4 | -3.3 | 112 | C33 G37 | C33-R35 PolarHBondContact O-N 3.45Å; R35-G37 PolarHBondContact O-N 3.32Å; R35-G37 VanDerWaalsContact O-N 3.1Å | ||
| 36 | V | 47.9 | Very low | 62.5 | Low | 125 Ų | 125 | 91.5 Ų | 91.5 | 76% | 0.758 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.3 | 109.2 | 175.7 | -174.2 | 0 | 0 | 0 | 0 | 109.7 | N34 | N34-V36 PolarHBondContact O-N 2.9Š|
| 37 | G | 53.6 | Low | 65.1 | Low | 57 Ų | 57 | 85.1 Ų | 85.1 | 59% | 0.588 | 46% | 0.464 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86 | 2.8 | 169.4 | 0 | 0 | 0 | 0 | 0 | 117.5 | R35 | R35-G37 PolarHBondContact O-N 3.32Å; R35-G37 VanDerWaalsContact O-N 3.1Å |
| 38 | G | 60.9 | Low | 67.8 | Low | 28 Ų | 28 | 83.5 Ų | 83.5 | 29% | 0.289 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -76.5 | -35.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | F41 Q42 | G38-F41 PolarHBondContact O-N 3.34Å; G38-Q42 WeakPolarHBondContact O-CB 2.87Å; G38-Q42 PolarHBondContact O-N 3.2Å |
| 39 | D | 68.4 | Low | 70.5 | Confident | 56 Ų | 56 | 81.4 Ų | 81.4 | 30% | 0.299 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -71.9 | -40 | -170.5 | -65.7 | -10.2 | 0 | 0 | 0 | 112.4 | Q42 R43 | D39-Q42 PolarHBondContact O-N 2.93Å; D39-R43 WeakPolarHBondContact O-CB 3.31Å; D39-R43 WeakPolarHBondContact O-CG 3.4Å; D39-R43 PolarHBondContact O-N 3.47Å |
| 40 | D | 79.8 | Confident | 73.3 | Confident | 111 Ų | 111 | 74 Ų | 74 | 59% | 0.594 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -66.8 | -40.4 | 176.2 | -72.2 | -24.9 | 0 | 0 | 0 | 111.8 | R43 I44 | D40-R43 PolarHBondContact O-N 3.28Å; D40-I44 WeakPolarHBondContact O-CG1 3.46Å; D40-I44 PolarHBondContact O-N 2.75Å |
| 41 | F | 82.8 | Confident | 75.8 | Confident | 98 Ų | 98 | 67.2 Ų | 67.2 | 43% | 0.43 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -61.3 | -46.7 | 174.9 | 176.1 | -104.4 | 0 | 0 | 0 | 110.9 | G38 I44 F45 L297 | G38-F41 PolarHBondContact O-N 3.34Å; F41-I44 PolarHBondContact O-N 3.13Å; F41-F45 HydrophobicContact CE1-CB 4.2Å; F41-F45 HydrophobicContact CE1-CD2 4.49Å; F41-F45 HydrophobicContact CE1-CG 4.2Å; F41-F45 HydrophobicContact CE2-CB 4.2Å; F41-F45 HydrophobicContact CE2-CD2 4.2Å; F41-F45 HydrophobicContact CE2-CG 4.43Å; F41-F45 HydrophobicContact CZ-CB 4.04Å; F41-F45 AromaticContact CZ-CD2 3.77Å; F41-F45 HydrophobicContact CZ-CD2 3.77Å; F41-F45 HydrophobicContact CZ-CE2 4.38Å; F41-F45 AromaticContact CZ-CG 3.9Å; F41-F45 HydrophobicContact CZ-CG 3.9Å; F41-F45 WeakPolarHBondContact O-CB 3.34Å; F41-F45 PolarHBondContact O-N 3.44Å; F41-L297 HydrophobicContact CE1-CD2 3.98Å |
| 42 | Q | 81.8 | Confident | 78.1 | Confident | 20 Ų | 20 | 62.8 Ų | 62.8 | 9% | 0.093 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -60.8 | -45.8 | 178.1 | 177.8 | 170.2 | -32.7 | 0 | 0 | 112.3 | G38 D39 I44 F45 L46 L297 | G38-Q42 WeakPolarHBondContact O-CB 2.87Å; G38-Q42 PolarHBondContact O-N 3.2Å; D39-Q42 PolarHBondContact O-N 2.93Å; Q42-I44 PolarHBondContact O-N 2.84Å; Q42-F45 PolarHBondContact O-N 3.17Å; Q42-L46 HydrophobicContact CG-CD1 3.56Å; Q42-L46 HydrophobicContact CG-CG 4.17Å; Q42-L46 WeakPolarHBondContact O-CB 3.3Å; Q42-L46 PolarHBondContact O-N 3.03Å; Q42-L46 VanDerWaalsContact O-N 3.08Å; Q42-L297 HydrophobicContact CB-CD1 3.69Å; Q42-L297 HydrophobicContact CG-CD1 3.62Å |
| 43 | R | 85.9 | Confident | 79.7 | Confident | 103 Ų | 103 | 59.4 Ų | 59.4 | 39% | 0.389 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.9 | -23.9 | -179.4 | -75.2 | 172.1 | -178 | -165.7 | 1.9 | 113.7 | D39 D40 P47 A103 | D39-R43 WeakPolarHBondContact O-CB 3.31Å; D39-R43 WeakPolarHBondContact O-CG 3.4Å; D39-R43 PolarHBondContact O-N 3.47Å; D40-R43 PolarHBondContact O-N 3.28Å; R43-P47 VanDerWaalsContact O-CD 3.26Å; R43-P47 WeakPolarHBondContact O-CD 3.41Å; R43-P47 WeakPolarHBondContact O-CG 3.4Å; R43-A103 WeakPolarHBondContact CG-O 3.5Å |
| 44 | I | 89.4 | Confident | 81.1 | Confident | 119 Ų | 119 | 60.5 Ų | 60.5 | 61% | 0.61 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -96.5 | -45.8 | 176.6 | -62.8 | 169 | 0 | 0 | 0 | 110.8 | D40 F41 Q42 T48 | D40-I44 WeakPolarHBondContact O-CG1 3.46Å; D40-I44 PolarHBondContact O-N 2.75Å; F41-I44 PolarHBondContact O-N 3.13Å; Q42-I44 PolarHBondContact O-N 2.84Å; I44-T48 VanDerWaalsContact O-CB 3.3Å; I44-T48 WeakPolarHBondContact O-CB 3.45Å; I44-T48 PolarHBondContact O-N 2.97Å; I44-T48 PolarHBondContact O-OG1 2.85Å |
| 45 | F | 90 | Very high | 82.9 | Confident | 52 Ų | 52 | 59.7 Ų | 59.7 | 23% | 0.228 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -66 | -50.9 | -173.7 | 178.4 | -93.7 | 0 | 0 | 0 | 112.2 | F41 Q42 T48 V49 L297 I298 A301 | F41-F45 HydrophobicContact CE1-CB 4.2Å; F41-F45 HydrophobicContact CE1-CD2 4.49Å; F41-F45 HydrophobicContact CE1-CG 4.2Å; F41-F45 HydrophobicContact CE2-CB 4.2Å; F41-F45 HydrophobicContact CE2-CD2 4.2Å; F41-F45 HydrophobicContact CE2-CG 4.43Å; F41-F45 HydrophobicContact CZ-CB 4.04Å; F41-F45 AromaticContact CZ-CD2 3.77Å; F41-F45 HydrophobicContact CZ-CD2 3.77Å; F41-F45 HydrophobicContact CZ-CE2 4.38Å; F41-F45 AromaticContact CZ-CG 3.9Å; F41-F45 HydrophobicContact CZ-CG 3.9Å; F41-F45 WeakPolarHBondContact O-CB 3.34Å; F41-F45 PolarHBondContact O-N 3.44Å; Q42-F45 PolarHBondContact O-N 3.17Å; F45-T48 PolarHBondContact O-N 3.16Å; F45-V49 HydrophobicContact CD1-CG2 4.27Å; F45-V49 HydrophobicContact CD2-CG2 4.23Å; F45-V49 HydrophobicContact CE1-CG2 3.95Å; F45-V49 HydrophobicContact CE2-CG2 3.89Å; F45-V49 HydrophobicContact CG-CG2 4.42Å; F45-V49 HydrophobicContact CZ-CG2 3.76Å; F45-V49 WeakPolarHBondContact O-CG2 3.43Å; F45-V49 PolarHBondContact O-N 2.63Å; F45-L297 HydrophobicContact CD1-CD2 3.3Å; F45-L297 HydrophobicContact CE1-CD2 3.52Å; F45-L297 HydrophobicContact CG-CD2 4.21Å; F45-I298 HydrophobicContact CZ-CG1 4.39Å; F45-A301 HydrophobicContact CE1-CB 3.93Å; F45-A301 HydrophobicContact CZ-CB 4.38Å |
| 46 | L | 90.1 | Very high | 84.6 | Confident | 4 Ų | 4 | 60.7 Ų | 60.7 | 2% | 0.021 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -62.5 | -51.6 | -174.7 | -73.1 | 179.3 | 0 | 0 | 0 | 112.3 | Q42 T48 V49 Y50 A103 L297 | Q42-L46 HydrophobicContact CG-CD1 3.56Å; Q42-L46 HydrophobicContact CG-CG 4.17Å; Q42-L46 WeakPolarHBondContact O-CB 3.3Å; Q42-L46 PolarHBondContact O-N 3.03Å; Q42-L46 VanDerWaalsContact O-N 3.08Å; L46-T48 VanDerWaalsContact C-N 3.27Å; L46-T48 PolarHBondContact O-N 3.37Å; L46-V49 PolarHBondContact O-N 3.25Å; L46-Y50 HydrophobicContact CB-CD2 4.46Å; L46-Y50 HydrophobicContact CB-CE2 4.04Å; L46-Y50 HydrophobicContact CD2-CE1 4.33Å; L46-Y50 HydrophobicContact CD2-CE2 4.47Å; L46-Y50 WeakPolarHBondContact O-CB 3.36Å; L46-Y50 WeakPolarHBondContact O-CD2 3.44Å; L46-Y50 PolarHBondContact O-N 3.33Å; L46-A103 HydrophobicContact CB-CB 3.8Å; L46-A103 HydrophobicContact CD1-CB 3.96Å; L46-L297 HydrophobicContact CD2-CD2 4.35Å; L46-L297 HydrophobicContact CD2-CG 4.13Å; L46-L297 HydrophobicContact CG-CG 4.33Å |
| 47 | P | 92.9 | Very high | 86.8 | Confident | 27 Ų | 27 | 54.7 Ų | 54.7 | 18% | 0.175 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -61.6 | -36.8 | 179.1 | -23.6 | 36.3 | 0 | 0 | 0 | 112.5 | R43 G51 A100 A103 A104 | R43-P47 VanDerWaalsContact O-CD 3.26Å; R43-P47 WeakPolarHBondContact O-CD 3.41Å; R43-P47 WeakPolarHBondContact O-CG 3.4Å; P47-G51 PolarHBondContact O-N 2.89Å; P47-A100 HydrophobicContact CB-CB 4.04Å; P47-A100 WeakPolarHBondContact CG-O 3.48Å; P47-A103 HydrophobicContact CG-CB 4.17Å; P47-A104 HydrophobicContact CB-CB 4.43Å; P47-A104 HydrophobicContact CG-CB 3.72Å |
| 48 | T | 94.3 | Very high | 88.8 | Confident | 78 Ų | 78 | 54.6 Ų | 54.6 | 48% | 0.479 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62 | -49.9 | 176.6 | -59.6 | 0 | 0 | 0 | 0 | 111 | I44 F45 L46 G51 I52 | I44-T48 VanDerWaalsContact O-CB 3.3Å; I44-T48 WeakPolarHBondContact O-CB 3.45Å; I44-T48 PolarHBondContact O-N 2.97Å; I44-T48 PolarHBondContact O-OG1 2.85Å; F45-T48 PolarHBondContact O-N 3.16Å; L46-T48 VanDerWaalsContact C-N 3.27Å; L46-T48 PolarHBondContact O-N 3.37Å; T48-G51 PolarHBondContact O-N 3.47Å; T48-I52 HydrophobicContact CG2-CD1 4.19Å; T48-I52 WeakPolarHBondContact O-CG1 3.46Å; T48-I52 PolarHBondContact O-N 2.95Å |
| 49 | V | 92.8 | Very high | 90.3 | Very high | 28 Ų | 28 | 58.3 Ų | 58.3 | 17% | 0.17 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -67.7 | -42.9 | -179.6 | 177.2 | 0 | 0 | 0 | 0 | 111.3 | F45 L46 G51 I52 I53 A301 | F45-V49 HydrophobicContact CD1-CG2 4.27Å; F45-V49 HydrophobicContact CD2-CG2 4.23Å; F45-V49 HydrophobicContact CE1-CG2 3.95Å; F45-V49 HydrophobicContact CE2-CG2 3.89Å; F45-V49 HydrophobicContact CG-CG2 4.42Å; F45-V49 HydrophobicContact CZ-CG2 3.76Å; F45-V49 WeakPolarHBondContact O-CG2 3.43Å; F45-V49 PolarHBondContact O-N 2.63Å; L46-V49 PolarHBondContact O-N 3.25Å; V49-G51 VanDerWaalsContact C-N 3.3Å; V49-G51 PolarHBondContact O-N 3.37Å; V49-I52 PolarHBondContact O-N 3.41Å; V49-I53 HydrophobicContact CG1-CD1 3.65Å; V49-I53 HydrophobicContact CG1-CG1 4.17Å; V49-I53 VanDerWaalsContact O-CG1 3.3Å; V49-I53 WeakPolarHBondContact O-CG1 3.34Å; V49-I53 PolarHBondContact O-N 3.12Å; V49-A301 HydrophobicContact CG1-CB 3.89Å |
| 50 | Y | 94 | Very high | 91.3 | Very high | 9 Ų | 9 | 56.4 Ų | 56.4 | 4% | 0.035 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -60.2 | -39.4 | 175.2 | -65.6 | -19.3 | 0 | 0 | 0 | 112.1 | L46 I53 F54 L96 W99 A100 Y304 | L46-Y50 HydrophobicContact CB-CD2 4.46Å; L46-Y50 HydrophobicContact CB-CE2 4.04Å; L46-Y50 HydrophobicContact CD2-CE1 4.33Å; L46-Y50 HydrophobicContact CD2-CE2 4.47Å; L46-Y50 WeakPolarHBondContact O-CB 3.36Å; L46-Y50 WeakPolarHBondContact O-CD2 3.44Å; L46-Y50 PolarHBondContact O-N 3.33Å; Y50-I53 PolarHBondContact O-N 2.74Å; Y50-F54 WeakPolarHBondContact O-CB 3.13Å; Y50-F54 PolarHBondContact O-N 3.3Å; Y50-L96 HydrophobicContact CD1-CD2 4.25Å; Y50-W99 HydrophobicContact CD2-CB 3.77Å; Y50-W99 HydrophobicContact CE2-CB 3.58Å; Y50-A100 HydrophobicContact CD2-CB 4.21Å; Y50-Y304 HydrophobicContact CD1-CD2 4.43Å; Y50-Y304 AromaticContact CE1-CD2 3.68Å; Y50-Y304 HydrophobicContact CE1-CD2 3.68Å; Y50-Y304 AromaticContact CE1-CE2 3.75Å; Y50-Y304 HydrophobicContact CE1-CE2 3.75Å |
| 51 | G | 95.8 | Very high | 92 | Very high | 29 Ų | 29 | 51.1 Ų | 51.1 | 30% | 0.299 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -62.3 | -43 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | P47 T48 V49 F54 L55 | P47-G51 PolarHBondContact O-N 2.89Å; T48-G51 PolarHBondContact O-N 3.47Å; V49-G51 VanDerWaalsContact C-N 3.3Å; V49-G51 PolarHBondContact O-N 3.37Å; G51-F54 WeakPolarHBondContact O-CB 3.17Å; G51-F54 PolarHBondContact O-N 3.35Å; G51-L55 WeakPolarHBondContact O-CG 3.18Å; G51-L55 PolarHBondContact O-N 3.35Å; G51-L55 VanDerWaalsContact O-N 3.1Å |
| 52 | I | 95.4 | Very high | 92.4 | Very high | 82 Ų | 82 | 47.4 Ų | 47.4 | 42% | 0.421 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -63.2 | -48.8 | 176 | -68 | 165.6 | 0 | 0 | 0 | 110.7 | T48 V49 F54 L55 L56 | T48-I52 HydrophobicContact CG2-CD1 4.19Å; T48-I52 WeakPolarHBondContact O-CG1 3.46Å; T48-I52 PolarHBondContact O-N 2.95Å; V49-I52 PolarHBondContact O-N 3.41Å; I52-F54 VanDerWaalsContact C-N 3.28Å; I52-F54 PolarHBondContact O-N 2.86Å; I52-L55 PolarHBondContact O-N 3.35Å; I52-L56 HydrophobicContact CG2-CD1 3.8Å; I52-L56 HydrophobicContact CG2-CG 4.37Å; I52-L56 WeakPolarHBondContact O-CB 3.48Å; I52-L56 WeakPolarHBondContact O-CG 3.32Å; I52-L56 PolarHBondContact O-N 2.78Å |
| 53 | I | 94.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63 | -38.5 | 179 | -64.5 | 173.4 | 0 | 0 | 0 | 110.2 | V49 Y50 G57 L96 F305 C307 C308 | V49-I53 HydrophobicContact CG1-CD1 3.65Å; V49-I53 HydrophobicContact CG1-CG1 4.17Å; V49-I53 VanDerWaalsContact O-CG1 3.3Å; V49-I53 WeakPolarHBondContact O-CG1 3.34Å; V49-I53 PolarHBondContact O-N 3.12Å; Y50-I53 PolarHBondContact O-N 2.74Å; I53-G57 WeakPolarHBondContact O-CA 3.45Å; I53-G57 PolarHBondContact O-N 3.07Å; I53-L96 HydrophobicContact CB-CD1 3.83Å; I53-L96 HydrophobicContact CG2-CD1 3.36Å; I53-F305 HydrophobicContact CD1-CB 4.47Å; I53-F305 HydrophobicContact CD1-CD2 4.22Å; I53-F305 HydrophobicContact CG1-CD2 3.81Å; I53-F305 HydrophobicContact CG1-CE2 4.46Å; I53-C307 VanDerWaalsContact CG2-SG 3.57Å; I53-C308 PolarHBondContact O-SG 3.39Å; I53-C308 VanDerWaalsContact O-SG 3.35Å |
| 54 | F | 96 | Very high | 92.8 | Very high | 57 Ų | 57 | 44.3 Ų | 44.3 | 25% | 0.25 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -56.5 | -54 | 175.6 | 173.8 | -106.1 | 0 | 0 | 0 | 111.9 | Y50 G51 I52 G57 I58 V93 F94 L96 P97 | Y50-F54 WeakPolarHBondContact O-CB 3.13Å; Y50-F54 PolarHBondContact O-N 3.3Å; G51-F54 WeakPolarHBondContact O-CB 3.17Å; G51-F54 PolarHBondContact O-N 3.35Å; I52-F54 VanDerWaalsContact C-N 3.28Å; I52-F54 PolarHBondContact O-N 2.86Å; F54-G57 PolarHBondContact O-N 3.44Å; F54-I58 HydrophobicContact CD2-CD1 4.1Å; F54-I58 HydrophobicContact CD2-CG1 4.31Å; F54-I58 HydrophobicContact CE1-CD1 4.21Å; F54-I58 HydrophobicContact CE2-CD1 3.35Å; F54-I58 HydrophobicContact CE2-CG1 4.03Å; F54-I58 HydrophobicContact CZ-CD1 3.41Å; F54-I58 VanDerWaalsContact CZ-CD1 3.41Å; F54-I58 HydrophobicContact CZ-CG1 4.37Å; F54-I58 WeakPolarHBondContact O-CG1 3.4Å; F54-I58 PolarHBondContact O-N 3.41Å; F54-V93 HydrophobicContact CD2-CG1 3.94Å; F54-V93 WeakPolarHBondContact CD2-O 3.33Å; F54-V93 WeakPolarHBondContact O-CG1 3.24Å; F54-F94 HydrophobicContact CE2-CD1 4.49Å; F54-L96 HydrophobicContact CB-CB 4.47Å; F54-P97 HydrophobicContact CD2-CG 3.72Å; F54-P97 HydrophobicContact CE2-CG 3.69Å; F54-P97 HydrophobicContact CG-CG 4.22Å; F54-P97 HydrophobicContact CZ-CG 4.19Å |
| 55 | L | 95.6 | Very high | 92.9 | Very high | 114 Ų | 114 | 40.8 Ų | 40.8 | 60% | 0.597 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -64 | -49.2 | -178.1 | -67.5 | 174.6 | 0 | 0 | 0 | 112.1 | G51 I52 G57 V59 | G51-L55 WeakPolarHBondContact O-CG 3.18Å; G51-L55 PolarHBondContact O-N 3.35Å; G51-L55 VanDerWaalsContact O-N 3.1Å; I52-L55 PolarHBondContact O-N 3.35Å; L55-G57 VanDerWaalsContact C-N 3.32Å; L55-G57 PolarHBondContact O-N 2.97Å; L55-V59 WeakPolarHBondContact O-CB 3.18Å; L55-V59 VanDerWaalsContact O-CG2 3.3Å; L55-V59 WeakPolarHBondContact O-CG2 3.36Å; L55-V59 PolarHBondContact O-N 2.97Å; L55-V59 VanDerWaalsContact O-N 3.17Å |
| 56 | L | 94.4 | Very high | 92.7 | Very high | 77 Ų | 77 | 41.4 Ų | 41.4 | 40% | 0.403 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -64 | -40.1 | 179.2 | -67.4 | 178.6 | 0 | 0 | 0 | 111.6 | I52 G60 F305 C308 | I52-L56 HydrophobicContact CG2-CD1 3.8Å; I52-L56 HydrophobicContact CG2-CG 4.37Å; I52-L56 WeakPolarHBondContact O-CB 3.48Å; I52-L56 WeakPolarHBondContact O-CG 3.32Å; I52-L56 PolarHBondContact O-N 2.78Å; L56-G60 PolarHBondContact O-N 3.41Å; L56-F305 HydrophobicContact CD1-CE2 4.12Å; L56-F305 HydrophobicContact CD1-CZ 4.17Å; L56-C308 HydrophobicContact CB-CB 4.17Å |
| 57 | G | 94.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -65.6 | -47.9 | -179 | 0 | 0 | 0 | 0 | 0 | 112.6 | I53 F54 L55 N61 | I53-G57 WeakPolarHBondContact O-CA 3.45Å; I53-G57 PolarHBondContact O-N 3.07Å; F54-G57 PolarHBondContact O-N 3.44Å; L55-G57 VanDerWaalsContact C-N 3.32Å; L55-G57 PolarHBondContact O-N 2.97Å; G57-N61 VanDerWaalsContact O-CB 3.32Å; G57-N61 WeakPolarHBondContact O-CB 3.24Å; G57-N61 PolarHBondContact O-N 3.44Å; G57-N61 PolarHBondContact O-ND2 3.24Å |
| 58 | I | 94.8 | Very high | 91.9 | Very high | 54 Ų | 54 | 40.2 Ų | 40.2 | 28% | 0.277 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -62.3 | -48.6 | 177.3 | -73.9 | -159.7 | 0 | 0 | 0 | 110.6 | F54 G62 V93 F94 | F54-I58 HydrophobicContact CD2-CD1 4.1Å; F54-I58 HydrophobicContact CD2-CG1 4.31Å; F54-I58 HydrophobicContact CE1-CD1 4.21Å; F54-I58 HydrophobicContact CE2-CD1 3.35Å; F54-I58 HydrophobicContact CE2-CG1 4.03Å; F54-I58 HydrophobicContact CZ-CD1 3.41Å; F54-I58 VanDerWaalsContact CZ-CD1 3.41Å; F54-I58 HydrophobicContact CZ-CG1 4.37Å; F54-I58 WeakPolarHBondContact O-CG1 3.4Å; F54-I58 PolarHBondContact O-N 3.41Å; I58-G62 VanDerWaalsContact O-CA 3.24Å; I58-G62 WeakPolarHBondContact O-CA 3.32Å; I58-G62 PolarHBondContact O-N 3.29Å; I58-V93 HydrophobicContact CG1-CG1 3.57Å; I58-F94 HydrophobicContact CD1-CD1 4.01Å; I58-F94 HydrophobicContact CD1-CE1 3.5Å; I58-F94 VanDerWaalsContact CD1-CE1 3.5Å; I58-F94 HydrophobicContact CD1-CZ 4.19Å; I58-F94 HydrophobicContact CG1-CE1 4.34Å |
| 59 | V | 92.8 | Very high | 91.3 | Very high | 107 Ų | 107 | 39.3 Ų | 39.3 | 65% | 0.648 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -64.1 | -49 | -178.3 | 173.4 | 0 | 0 | 0 | 0 | 110.5 | L55 L63 | L55-V59 WeakPolarHBondContact O-CB 3.18Å; L55-V59 VanDerWaalsContact O-CG2 3.3Å; L55-V59 WeakPolarHBondContact O-CG2 3.36Å; L55-V59 PolarHBondContact O-N 2.97Å; L55-V59 VanDerWaalsContact O-N 3.17Å; V59-L63 WeakPolarHBondContact O-CB 3.4Å; V59-L63 PolarHBondContact O-N 2.76Å |
| 60 | G | 91 | Very high | 90.7 | Very high | 15 Ų | 15 | 45.3 Ų | 45.3 | 16% | 0.155 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66.3 | -58.6 | -176.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | L56 L63 V64 P311 | L56-G60 PolarHBondContact O-N 3.41Å; G60-L63 PolarHBondContact O-N 3.39Å; G60-V64 WeakPolarHBondContact O-CG2 3.4Å; G60-V64 PolarHBondContact O-N 3.4Å; G60-V64 VanDerWaalsContact O-N 3.16Å; G60-P311 VanDerWaalsContact C-CB 3.49Å |
| 61 | N | 92.9 | Very high | 89.9 | Confident | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -72.7 | -34.8 | -175.7 | -69.7 | -66.5 | 0 | 0 | 0 | 111.8 | G57 L63 V64 V65 S86 L90 C307 P311 | G57-N61 VanDerWaalsContact O-CB 3.32Å; G57-N61 WeakPolarHBondContact O-CB 3.24Å; G57-N61 PolarHBondContact O-N 3.44Å; G57-N61 PolarHBondContact O-ND2 3.24Å; N61-L63 VanDerWaalsContact C-N 3.32Å; N61-L63 PolarHBondContact O-N 3.13Å; N61-V64 PolarHBondContact O-N 3.4Å; N61-V64 VanDerWaalsContact O-N 3.17Å; N61-V65 WeakPolarHBondContact O-CG2 3.16Å; N61-V65 PolarHBondContact O-N 2.9Å; N61-S86 PolarHBondContact OD1-OG 3.44Å; N61-S86 VanDerWaalsContact OD1-OG 3.06Å; N61-L90 HydrophobicContact CB-CD1 4.26Å; N61-L90 HydrophobicContact CB-CD2 3.91Å; N61-L90 HydrophobicContact CB-CG 3.65Å; N61-C307 PolarHBondContact ND2-O 3.24Å; N61-P311 HydrophobicContact CB-CG 4.3Å; N61-P311 WeakPolarHBondContact OD1-CG 3.38Å |
| 62 | G | 91.7 | Very high | 88.3 | Confident | 21 Ų | 21 | 56 Ų | 56 | 22% | 0.216 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -60.2 | -40.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | I58 V65 T66 | I58-G62 VanDerWaalsContact O-CA 3.24Å; I58-G62 WeakPolarHBondContact O-CA 3.32Å; I58-G62 PolarHBondContact O-N 3.29Å; G62-V65 PolarHBondContact O-N 3.33Å; G62-T66 VanDerWaalsContact O-CB 3.23Å; G62-T66 WeakPolarHBondContact O-CB 3.49Å; G62-T66 PolarHBondContact O-N 3.35Å; G62-T66 PolarHBondContact O-OG1 3.49Å |
| 63 | L | 88.8 | Confident | 87.4 | Confident | 56 Ų | 56 | 60.7 Ų | 60.7 | 29% | 0.293 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -63 | -42.9 | 173.3 | -179 | 65.6 | 0 | 0 | 0 | 111.9 | V59 G60 N61 T66 V67 F321 | V59-L63 WeakPolarHBondContact O-CB 3.4Å; V59-L63 PolarHBondContact O-N 2.76Å; G60-L63 PolarHBondContact O-N 3.39Å; N61-L63 VanDerWaalsContact C-N 3.32Å; N61-L63 PolarHBondContact O-N 3.13Å; L63-T66 PolarHBondContact O-N 3Å; L63-V67 HydrophobicContact CD1-CG2 3.84Å; L63-V67 HydrophobicContact CG-CG2 4.18Å; L63-V67 WeakPolarHBondContact O-CB 3.32Å; L63-V67 VanDerWaalsContact O-CG2 3.23Å; L63-V67 WeakPolarHBondContact O-CG2 3.47Å; L63-V67 PolarHBondContact O-N 3.46Å; L63-F321 HydrophobicContact CD2-CE1 4.4Å; L63-F321 HydrophobicContact CG-CZ 4.48Å |
| 64 | V | 88.3 | Confident | 86.4 | Confident | 1 Ų | 1 | 67.7 Ų | 67.7 | 1% | 0.006 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -60.1 | -50.2 | 177.3 | 175.3 | 0 | 0 | 0 | 0 | 110.8 | G60 N61 T66 V67 M68 S86 P311 Y314 F321 | G60-V64 WeakPolarHBondContact O-CG2 3.4Å; G60-V64 PolarHBondContact O-N 3.4Å; G60-V64 VanDerWaalsContact O-N 3.16Å; N61-V64 PolarHBondContact O-N 3.4Å; N61-V64 VanDerWaalsContact O-N 3.17Å; V64-T66 VanDerWaalsContact C-N 3.33Å; V64-T66 PolarHBondContact O-N 3.43Å; V64-V67 PolarHBondContact O-N 2.82Å; V64-M68 HydrophobicContact CG1-CE 4.32Å; V64-M68 HydrophobicContact CG1-SD 4.1Å; V64-M68 WeakPolarHBondContact O-CB 3.19Å; V64-M68 VanDerWaalsContact O-CG 3.3Å; V64-M68 WeakPolarHBondContact O-CG 3.33Å; V64-M68 PolarHBondContact O-N 3.06Å; V64-S86 WeakPolarHBondContact CG1-OG 3.33Å; V64-P311 HydrophobicContact CG2-CB 4.02Å; V64-P311 HydrophobicContact CG2-CG 4.22Å; V64-Y314 HydrophobicContact CG2-CD2 4.24Å; V64-F321 HydrophobicContact CG2-CE2 4.19Å; V64-F321 HydrophobicContact CG2-CZ 3.88Å |
| 65 | V | 89.6 | Confident | 85.5 | Confident | 45 Ų | 45 | 67.9 Ų | 67.9 | 27% | 0.273 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -58.9 | -46.1 | 177.8 | 173.3 | 0 | 0 | 0 | 0 | 110.7 | N61 G62 M68 G69 L83 V87 L90 | N61-V65 WeakPolarHBondContact O-CG2 3.16Å; N61-V65 PolarHBondContact O-N 2.9Å; G62-V65 PolarHBondContact O-N 3.33Å; V65-M68 PolarHBondContact O-N 3.45Å; V65-G69 PolarHBondContact O-N 3.01Å; V65-L83 HydrophobicContact CB-CD1 4.31Å; V65-L83 HydrophobicContact CG1-CD1 4.3Å; V65-L83 HydrophobicContact CG2-CD1 4.03Å; V65-V87 HydrophobicContact CG2-CG2 4.4Å; V65-L90 HydrophobicContact CG2-CD1 3.79Å |
| 66 | T | 86.8 | Confident | 84.6 | Confident | 65 Ų | 65 | 66 Ų | 66 | 40% | 0.399 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -61.1 | -53.5 | 179.6 | -61.3 | 0 | 0 | 0 | 0 | 111.4 | G62 L63 V64 M68 G69 Y70 | G62-T66 VanDerWaalsContact O-CB 3.23Å; G62-T66 WeakPolarHBondContact O-CB 3.49Å; G62-T66 PolarHBondContact O-N 3.35Å; G62-T66 PolarHBondContact O-OG1 3.49Å; L63-T66 PolarHBondContact O-N 3Å; V64-T66 VanDerWaalsContact C-N 3.33Å; V64-T66 PolarHBondContact O-N 3.43Å; T66-M68 VanDerWaalsContact C-N 3.29Å; T66-M68 PolarHBondContact O-N 3.26Å; T66-G69 PolarHBondContact O-N 3.45Å; T66-G69 VanDerWaalsContact O-N 3.15Å; T66-Y70 HydrophobicContact CG2-CD2 3.67Å; T66-Y70 HydrophobicContact CG2-CE2 3.69Å; T66-Y70 WeakPolarHBondContact O-CD2 3.29Å; T66-Y70 PolarHBondContact O-N 2.87Å |
| 67 | V | 83.9 | Confident | 83.7 | Confident | 1 Ų | 1 | 63.4 Ų | 63.4 | 1% | 0.006 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -59.5 | -42.3 | -179.7 | 171.1 | 0 | 0 | 0 | 0 | 110.8 | L63 V64 Q71 F321 A325 A328 | L63-V67 HydrophobicContact CD1-CG2 3.84Å; L63-V67 HydrophobicContact CG-CG2 4.18Å; L63-V67 WeakPolarHBondContact O-CB 3.32Å; L63-V67 VanDerWaalsContact O-CG2 3.23Å; L63-V67 WeakPolarHBondContact O-CG2 3.47Å; L63-V67 PolarHBondContact O-N 3.46Å; V64-V67 PolarHBondContact O-N 2.82Å; V67-Q71 VanDerWaalsContact O-CG 3.28Å; V67-Q71 WeakPolarHBondContact O-CG 3.21Å; V67-Q71 PolarHBondContact O-N 2.92Å; V67-Q71 VanDerWaalsContact O-N 3.1Å; V67-F321 HydrophobicContact CB-CE2 4.27Å; V67-F321 HydrophobicContact CG1-CD2 4.44Å; V67-F321 HydrophobicContact CG1-CE2 4.12Å; V67-F321 HydrophobicContact CG2-CZ 4.47Å; V67-A325 HydrophobicContact CG2-CB 4.03Å; V67-A328 HydrophobicContact CG2-CB 4.22Å |
| 68 | M | 82.4 | Confident | 82.9 | Confident | 6 Ų | 6 | 63.8 Ų | 63.8 | 3% | 0.03 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -69.1 | -37.6 | 177.4 | -70.7 | -168 | 166.8 | 0 | 0 | 112.3 | V64 V65 T66 Q71 K75 D79 R82 L83 | V64-M68 HydrophobicContact CG1-CE 4.32Å; V64-M68 HydrophobicContact CG1-SD 4.1Å; V64-M68 WeakPolarHBondContact O-CB 3.19Å; V64-M68 VanDerWaalsContact O-CG 3.3Å; V64-M68 WeakPolarHBondContact O-CG 3.33Å; V64-M68 PolarHBondContact O-N 3.06Å; V65-M68 PolarHBondContact O-N 3.45Å; T66-M68 VanDerWaalsContact C-N 3.29Å; T66-M68 PolarHBondContact O-N 3.26Å; M68-Q71 PolarHBondContact O-N 3.14Å; M68-K75 WeakPolarHBondContact O-CE 3.35Å; M68-K75 PolarHBondContact O-NZ 3.24Å; M68-D79 HydrophobicContact CE-CB 3.68Å; M68-D79 WeakPolarHBondContact CE-O 3.44Å; M68-D79 HydrophobicContact SD-CB 4.37Å; M68-R82 HydrophobicContact CE-CB 3.83Å; M68-R82 HydrophobicContact SD-CB 4.42Å; M68-L83 HydrophobicContact CB-CD1 4.2Å; M68-L83 HydrophobicContact SD-CB 3.94Å; M68-L83 HydrophobicContact SD-CD1 4.4Å |
| 69 | G | 80.9 | Confident | 82.1 | Confident | 59 Ų | 59 | 62.6 Ų | 62.6 | 61% | 0.608 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -59.6 | -46.4 | 174 | 0 | 0 | 0 | 0 | 0 | 112.5 | V65 T66 | V65-G69 PolarHBondContact O-N 3.01Å; T66-G69 PolarHBondContact O-N 3.45Å; T66-G69 VanDerWaalsContact O-N 3.15Å |
| 70 | Y | 80 | Confident | 81.7 | Confident | 154 Ų | 154 | 60.4 Ų | 60.4 | 60% | 0.604 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -79.7 | -13.2 | -178 | -75.9 | -71.1 | 0 | 0 | 0 | 115 | T66 K72 | T66-Y70 HydrophobicContact CG2-CD2 3.67Å; T66-Y70 HydrophobicContact CG2-CE2 3.69Å; T66-Y70 WeakPolarHBondContact O-CD2 3.29Å; T66-Y70 PolarHBondContact O-N 2.87Å; Y70-K72 PolarHBondContact O-N 2.76Å |
| 71 | Q | 77.5 | Confident | 81.4 | Confident | 49 Ų | 49 | 59.9 Ų | 59.9 | 23% | 0.229 | 31% | 0.314 | C | S | . | . | trans | -66.4 | 106.4 | 175.6 | -88 | 177.8 | -4.2 | 0 | 0 | 111.2 | V67 M68 K73 S324 | V67-Q71 VanDerWaalsContact O-CG 3.28Å; V67-Q71 WeakPolarHBondContact O-CG 3.21Å; V67-Q71 PolarHBondContact O-N 2.92Å; V67-Q71 VanDerWaalsContact O-N 3.1Å; M68-Q71 PolarHBondContact O-N 3.14Å; Q71-K73 PolarHBondContact O-N 3.18Å; Q71-S324 VanDerWaalsContact NE2-CB 3.32Å; Q71-S324 PolarHBondContact NE2-OG 3.2Å | ||
| 72 | K | 63.7 | Low | 81 | Confident | 213 Ų | 213 | 62.4 Ų | 62.4 | 93% | 0.926 | 32% | 0.323 | S | S | * | . | trans | -70.3 | -10.9 | 173.1 | -63.1 | -170.4 | 178.1 | -172.2 | 0 | 114.3 | Y70 | Y70-K72 PolarHBondContact O-N 2.76Š| ||
| 73 | K | 75.9 | Confident | 80.8 | Confident | 181 Ų | 181 | 63.9 Ų | 63.9 | 79% | 0.787 | 33% | 0.326 | S | S | * | . | S | Bend | trans | -81.4 | 154.1 | 179.1 | -64.7 | -172.8 | -179.9 | -176.2 | 0 | 110.7 | Q71 K75 | Q71-K73 PolarHBondContact O-N 3.18Å; K73-K75 PolarHBondContact O-N 3.33Å |
| 74 | V | 73.9 | Confident | 80.9 | Confident | 146 Ų | 146 | 62.8 Ų | 62.8 | 89% | 0.885 | 32% | 0.319 | S | S | * | . | P | Polyproline II helix | trans | -57.9 | 120.7 | 172.8 | -177.2 | 0 | 0 | 0 | 0 | 109.3 | ||
| 75 | K | 76.8 | Confident | 81 | Confident | 61 Ų | 61 | 62.8 Ų | 62.8 | 27% | 0.265 | 32% | 0.319 | S | S | . | . | P | Polyproline II helix | trans | -71.5 | 138.2 | 179.8 | -66.6 | 173.9 | 170 | 70 | 0 | 110.3 | M68 K73 D79 K80 | M68-K75 WeakPolarHBondContact O-CE 3.35Å; M68-K75 PolarHBondContact O-NZ 3.24Å; K73-K75 PolarHBondContact O-N 3.33Å; K75-D79 HydrophobicContact CB-CB 4.34Å; K75-K80 HydrophobicContact CB-CG 4.35Å |
| 76 | T | 75.7 | Confident | 81.1 | Confident | 76 Ų | 76 | 60.6 Ų | 60.6 | 47% | 0.466 | 31% | 0.306 | S | S | . | . | P | Polyproline II helix | trans | -75.7 | 161.7 | 171.6 | 73.3 | 0 | 0 | 0 | 0 | 110.4 | T78 D79 K80 | T76-T78 PolarHBondContact O-N 2.89Å; T76-D79 WeakPolarHBondContact CB-OD2 3.43Å; T76-D79 WeakPolarHBondContact CG2-OD2 3.41Å; T76-D79 PolarHBondContact N-OD2 3.18Å; T76-D79 WeakPolarHBondContact O-CB 3.33Å; T76-D79 PolarHBondContact O-N 3.22Å; T76-D79 PolarHBondContact OG1-N 3.21Å; T76-D79 PolarHBondContact OG1-OD2 3.41Å; T76-K80 PolarHBondContact O-N 3.26Å; T76-K80 VanDerWaalsContact O-N 3.09Å |
| 77 | M | 76.3 | Confident | 81.4 | Confident | 22 Ų | 22 | 60.3 Ų | 60.3 | 11% | 0.108 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -56.2 | -42 | 176.5 | -69.6 | -62.7 | 151.6 | 0 | 0 | 112.3 | D79 K80 Y81 K156 E160 | M77-D79 VanDerWaalsContact C-N 3.26Å; M77-D79 PolarHBondContact O-N 2.84Å; M77-K80 WeakPolarHBondContact O-CB 3.5Å; M77-K80 PolarHBondContact O-N 3.24Å; M77-K80 VanDerWaalsContact O-N 3.1Å; M77-Y81 HydrophobicContact CB-CE2 4.13Å; M77-Y81 WeakPolarHBondContact O-CD2 3.43Å; M77-Y81 PolarHBondContact O-N 3.1Å; M77-K156 HydrophobicContact CE-CB 3.46Å; M77-K156 VanDerWaalsContact CE-CB 3.46Å; M77-K156 HydrophobicContact CE-CD 4.14Å; M77-K156 HydrophobicContact CE-CG 3.8Å; M77-K156 HydrophobicContact CG-CD 4.27Å; M77-K156 HydrophobicContact CG-CG 3.91Å; M77-K156 HydrophobicContact SD-CB 4.44Å; M77-K156 HydrophobicContact SD-CG 4.43Å; M77-E160 HydrophobicContact CE-CG 3.91Å; M77-E160 WeakPolarHBondContact CE-OE1 2.85Å; M77-E160 HydrophobicContact SD-CG 3.78Å |
| 78 | T | 76.4 | Confident | 81.9 | Confident | 8 Ų | 8 | 60.3 Ų | 60.3 | 5% | 0.049 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -63.1 | -33.9 | 176.7 | -47.3 | 0 | 0 | 0 | 0 | 112.1 | T76 Y81 R82 R139 | T76-T78 PolarHBondContact O-N 2.89Å; T78-Y81 PolarHBondContact O-N 3.09Å; T78-R82 WeakPolarHBondContact O-CB 3.27Å; T78-R82 WeakPolarHBondContact O-CD 3.32Å; T78-R82 WeakPolarHBondContact O-CG 3.49Å; T78-R82 PolarHBondContact O-N 3.31Å; T78-R139 VanDerWaalsContact OG1-CZ 3.3Å; T78-R139 PolarHBondContact OG1-NH1 2.92Å; T78-R139 PolarHBondContact OG1-NH2 3.47Å |
| 79 | D | 79.4 | Confident | 82.5 | Confident | 29 Ų | 29 | 60 Ų | 60 | 16% | 0.155 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -68.2 | -38.6 | 174.6 | -57.8 | -38.9 | 0 | 0 | 0 | 110.9 | M68 K75 T76 M77 R82 L83 | M68-D79 HydrophobicContact CE-CB 3.68Å; M68-D79 WeakPolarHBondContact CE-O 3.44Å; M68-D79 HydrophobicContact SD-CB 4.37Å; K75-D79 HydrophobicContact CB-CB 4.34Å; T76-D79 WeakPolarHBondContact CB-OD2 3.43Å; T76-D79 WeakPolarHBondContact CG2-OD2 3.41Å; T76-D79 PolarHBondContact N-OD2 3.18Å; T76-D79 WeakPolarHBondContact O-CB 3.33Å; T76-D79 PolarHBondContact O-N 3.22Å; T76-D79 PolarHBondContact OG1-N 3.21Å; T76-D79 PolarHBondContact OG1-OD2 3.41Å; M77-D79 VanDerWaalsContact C-N 3.26Å; M77-D79 PolarHBondContact O-N 2.84Å; D79-R82 PolarHBondContact O-N 3.36Å; D79-R82 IonicContact OD1-NH1 2.76Å; D79-R82 PolarHBondContact OD1-NH1 3.42Å; D79-L83 PolarHBondContact O-N 2.89Å |
| 80 | K | 83.4 | Confident | 83.2 | Confident | 61 Ų | 61 | 58.3 Ų | 58.3 | 27% | 0.265 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -63 | -44.6 | 174 | -63.7 | -177.8 | 175.8 | -173.1 | 0 | 112 | K75 T76 M77 R82 L83 H84 E160 | K75-K80 HydrophobicContact CB-CG 4.35Å; T76-K80 PolarHBondContact O-N 3.26Å; T76-K80 VanDerWaalsContact O-N 3.09Å; M77-K80 WeakPolarHBondContact O-CB 3.5Å; M77-K80 PolarHBondContact O-N 3.24Å; M77-K80 VanDerWaalsContact O-N 3.1Å; K80-R82 VanDerWaalsContact C-N 3.35Å; K80-R82 PolarHBondContact O-N 3.15Å; K80-L83 WeakPolarHBondContact O-CB 3.21Å; K80-L83 PolarHBondContact O-N 3.47Å; K80-L83 VanDerWaalsContact O-N 3.15Å; K80-H84 PolarHBondContact O-CD2 2.97Å; K80-H84 VanDerWaalsContact O-CD2 3.24Å; K80-H84 PolarHBondContact O-N 3.07Å; K80-H84 VanDerWaalsContact O-N 3.07Å; K80-E160 HydrophobicContact CD-CG 4.26Å; K80-E160 IonicContact NZ-OE1 2.6Å; K80-E160 PolarHBondContact NZ-OE1 2.86Å; K80-E160 IonicContact NZ-OE2 2.64Å; K80-E160 PolarHBondContact NZ-OE2 3.16Å |
| 81 | Y | 84.4 | Confident | 83.9 | Confident | 4 Ų | 4 | 54.7 Ų | 54.7 | 2% | 0.016 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64.2 | -39.3 | 177.4 | -58.2 | -34.3 | 0 | 0 | 0 | 112.8 | M77 T78 L83 H84 L85 F134 I135 D138 I163 | M77-Y81 HydrophobicContact CB-CE2 4.13Å; M77-Y81 WeakPolarHBondContact O-CD2 3.43Å; M77-Y81 PolarHBondContact O-N 3.1Å; T78-Y81 PolarHBondContact O-N 3.09Å; Y81-L83 VanDerWaalsContact C-N 3.28Å; Y81-L83 PolarHBondContact O-N 3.01Å; Y81-H84 PolarHBondContact O-N 2.93Å; Y81-L85 PolarHBondContact O-N 3.02Å; Y81-F134 HydrophobicContact CD1-CD1 4.42Å; Y81-F134 AromaticContact CE1-CD1 3.74Å; Y81-F134 HydrophobicContact CE1-CD1 3.74Å; Y81-F134 AromaticContact CE1-CE1 3.76Å; Y81-F134 HydrophobicContact CE1-CE1 3.76Å; Y81-F134 HydrophobicContact CE2-CD1 4.14Å; Y81-F134 HydrophobicContact CE2-CE1 4.46Å; Y81-F134 AromaticContact CZ-CD1 3.58Å; Y81-F134 AromaticContact CZ-CE1 3.56Å; Y81-F134 WeakPolarHBondContact OH-CE1 3.29Å; Y81-I135 HydrophobicContact CD2-CG1 3.67Å; Y81-I135 HydrophobicContact CG-CG1 4.03Å; Y81-D138 HydrophobicContact CE2-CB 4.24Å; Y81-I163 HydrophobicContact CD1-CD1 3.51Å; Y81-I163 HydrophobicContact CE1-CD1 3.88Å |
| 82 | R | 84.6 | Confident | 84.8 | Confident | 52 Ų | 52 | 52.5 Ų | 52.5 | 20% | 0.196 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -61.9 | -37 | 172.7 | -74.3 | 171.3 | 176 | 160.8 | -4.5 | 112.3 | M68 T78 D79 K80 L85 S86 Y314 | M68-R82 HydrophobicContact CE-CB 3.83Å; M68-R82 HydrophobicContact SD-CB 4.42Å; T78-R82 WeakPolarHBondContact O-CB 3.27Å; T78-R82 WeakPolarHBondContact O-CD 3.32Å; T78-R82 WeakPolarHBondContact O-CG 3.49Å; T78-R82 PolarHBondContact O-N 3.31Å; D79-R82 PolarHBondContact O-N 3.36Å; D79-R82 IonicContact OD1-NH1 2.76Å; D79-R82 PolarHBondContact OD1-NH1 3.42Å; K80-R82 VanDerWaalsContact C-N 3.35Å; K80-R82 PolarHBondContact O-N 3.15Å; R82-L85 PolarHBondContact O-N 3.35Å; R82-S86 WeakPolarHBondContact O-CB 3.27Å; R82-S86 PolarHBondContact O-N 2.99Å; R82-S86 PolarHBondContact O-OG 3.41Å; R82-Y314 HydrophobicContact CB-CE2 4.41Å; R82-Y314 HydrophobicContact CG-CE1 3.98Å; R82-Y314 HydrophobicContact CG-CE2 4.02Å |
| 83 | L | 88.3 | Confident | 86.3 | Confident | 52 Ų | 52 | 42.3 Ų | 42.3 | 27% | 0.272 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -62.9 | -47.7 | 174.6 | -174.4 | 67.2 | 0 | 0 | 0 | 111.2 | V65 M68 D79 K80 Y81 L85 S86 V87 | V65-L83 HydrophobicContact CB-CD1 4.31Å; V65-L83 HydrophobicContact CG1-CD1 4.3Å; V65-L83 HydrophobicContact CG2-CD1 4.03Å; M68-L83 HydrophobicContact CB-CD1 4.2Å; M68-L83 HydrophobicContact SD-CB 3.94Å; M68-L83 HydrophobicContact SD-CD1 4.4Å; D79-L83 PolarHBondContact O-N 2.89Å; K80-L83 WeakPolarHBondContact O-CB 3.21Å; K80-L83 PolarHBondContact O-N 3.47Å; K80-L83 VanDerWaalsContact O-N 3.15Å; Y81-L83 VanDerWaalsContact C-N 3.28Å; Y81-L83 PolarHBondContact O-N 3.01Å; L83-L85 VanDerWaalsContact C-N 3.3Å; L83-L85 PolarHBondContact O-N 2.62Å; L83-S86 PolarHBondContact O-N 3.31Å; L83-V87 WeakPolarHBondContact O-CG2 3.48Å; L83-V87 PolarHBondContact O-N 3.03Å |
| 84 | H | 90.8 | Very high | 87.3 | Confident | 34 Ų | 34 | 39 Ų | 39 | 16% | 0.157 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -58.1 | -43.4 | 175.2 | -77.2 | -77.1 | 0 | 0 | 0 | 112 | K80 Y81 V87 A88 I131 I163 Y164 W168 | K80-H84 PolarHBondContact O-CD2 2.97Å; K80-H84 VanDerWaalsContact O-CD2 3.24Å; K80-H84 PolarHBondContact O-N 3.07Å; K80-H84 VanDerWaalsContact O-N 3.07Å; Y81-H84 PolarHBondContact O-N 2.93Å; H84-V87 PolarHBondContact O-N 3.01Å; H84-A88 PolarHBondContact O-N 3.49Å; H84-I131 HydrophobicContact CB-CD1 3.85Å; H84-I163 HydrophobicContact CB-CD1 4.34Å; H84-Y164 AromaticContact CE1-CE1 3.84Å; H84-Y164 AromaticContact CE1-CZ 3.8Å; H84-W168 HydrophobicContact CB-CZ2 4.3Å; H84-W168 AromaticContact CE1-NE1 3.91Å; H84-W168 AromaticContact CG-NE1 3.97Å; H84-W168 AromaticContact ND1-CE2 3.82Å; H84-W168 AromaticContact ND1-CZ2 3.88Å; H84-W168 AromaticContact ND1-NE1 3.26Å; H84-W168 PolarHBondContact ND1-NE1 3.31Å |
| 85 | L | 90.8 | Very high | 88.3 | Confident | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.9 | -48.2 | 177.3 | -172.7 | 63.5 | 0 | 0 | 0 | 111.5 | Y81 R82 L83 V87 A88 D89 S128 I131 L132 N310 | Y81-L85 PolarHBondContact O-N 3.02Å; R82-L85 PolarHBondContact O-N 3.35Å; L83-L85 VanDerWaalsContact C-N 3.3Å; L83-L85 PolarHBondContact O-N 2.62Å; L85-V87 VanDerWaalsContact C-N 3.29Å; L85-V87 PolarHBondContact O-N 3.33Å; L85-A88 PolarHBondContact O-N 2.85Å; L85-D89 WeakPolarHBondContact O-CB 3.43Å; L85-D89 PolarHBondContact O-N 2.96Å; L85-S128 WeakPolarHBondContact CD1-OG 3.11Å; L85-I131 HydrophobicContact CB-CD1 4.5Å; L85-I131 HydrophobicContact CB-CG2 4.3Å; L85-L132 HydrophobicContact CD2-CD2 4.46Å; L85-N310 HydrophobicContact CD2-CB 4.41Å |
| 86 | S | 92.3 | Very high | 89.2 | Confident | 0 Ų | 0 | 29.4 Ų | 29.4 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -65.6 | -29.8 | 177.5 | -71.7 | 0 | 0 | 0 | 0 | 113.5 | N61 V64 R82 L83 L90 | N61-S86 PolarHBondContact OD1-OG 3.44Å; N61-S86 VanDerWaalsContact OD1-OG 3.06Å; V64-S86 WeakPolarHBondContact CG1-OG 3.33Å; R82-S86 WeakPolarHBondContact O-CB 3.27Å; R82-S86 PolarHBondContact O-N 2.99Å; R82-S86 PolarHBondContact O-OG 3.41Å; L83-S86 PolarHBondContact O-N 3.31Å; S86-L90 WeakPolarHBondContact O-CB 3.45Å; S86-L90 VanDerWaalsContact O-CG 3.27Å; S86-L90 WeakPolarHBondContact O-CG 3.33Å; S86-L90 PolarHBondContact O-N 3.43Å |
| 87 | V | 92.9 | Very high | 90.1 | Very high | 59 Ų | 59 | 28.2 Ų | 28.2 | 36% | 0.358 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -68.3 | -46.2 | 171.9 | 169.3 | 0 | 0 | 0 | 0 | 110.6 | V65 L83 H84 L85 D89 L90 L91 | V65-V87 HydrophobicContact CG2-CG2 4.4Å; L83-V87 WeakPolarHBondContact O-CG2 3.48Å; L83-V87 PolarHBondContact O-N 3.03Å; H84-V87 PolarHBondContact O-N 3.01Å; L85-V87 VanDerWaalsContact C-N 3.29Å; L85-V87 PolarHBondContact O-N 3.33Å; V87-D89 VanDerWaalsContact C-N 3.33Å; V87-D89 PolarHBondContact O-N 3.16Å; V87-L90 PolarHBondContact O-N 3.43Å; V87-L91 HydrophobicContact CG1-CD1 4.38Å; V87-L91 WeakPolarHBondContact O-CG 3.34Å; V87-L91 PolarHBondContact O-N 2.85Å |
| 88 | A | 94 | Very high | 91.1 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -59.7 | -44.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | H84 L85 L91 L92 N124 W168 | H84-A88 PolarHBondContact O-N 3.49Å; L85-A88 PolarHBondContact O-N 2.85Å; A88-L91 PolarHBondContact O-N 3.07Å; A88-L92 PolarHBondContact O-N 3.23Å; A88-L92 VanDerWaalsContact O-N 3.16Å; A88-N124 PolarHBondContact O-ND2 3.36Å; A88-W168 HydrophobicContact CB-CH2 4.14Å |
| 89 | D | 94.7 | Very high | 91.9 | Very high | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -63.7 | -41.9 | 178.5 | -72.4 | -18.5 | 0 | 0 | 0 | 111.8 | L85 V87 L91 L92 V93 N124 H306 C307 N310 | L85-D89 WeakPolarHBondContact O-CB 3.43Å; L85-D89 PolarHBondContact O-N 2.96Å; V87-D89 VanDerWaalsContact C-N 3.33Å; V87-D89 PolarHBondContact O-N 3.16Å; D89-L91 PolarHBondContact O-N 2.93Å; D89-L92 PolarHBondContact O-N 3.05Å; D89-V93 WeakPolarHBondContact O-CB 3.43Å; D89-V93 WeakPolarHBondContact O-CG2 3.29Å; D89-V93 PolarHBondContact O-N 2.71Å; D89-N124 VanDerWaalsContact CA-ND2 3.35Å; D89-N124 WeakPolarHBondContact CA-ND2 3.17Å; D89-N124 PolarHBondContact N-ND2 3.14Å; D89-N124 PolarHBondContact OD1-ND2 2.63Å; D89-N124 VanDerWaalsContact OD1-ND2 3.17Å; D89-H306 IonicContact OD1-NE2 3.86Å; D89-C307 HydrophobicContact CB-CB 3.94Å; D89-N310 PolarHBondContact OD2-ND2 3.17Å |
| 90 | L | 95.4 | Very high | 92.5 | Very high | 24 Ų | 24 | 29.7 Ų | 29.7 | 13% | 0.126 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -61.9 | -43.2 | 174.8 | -80 | 168.8 | 0 | 0 | 0 | 112.2 | N61 V65 S86 V87 L92 V93 F94 | N61-L90 HydrophobicContact CB-CD1 4.26Å; N61-L90 HydrophobicContact CB-CD2 3.91Å; N61-L90 HydrophobicContact CB-CG 3.65Å; V65-L90 HydrophobicContact CG2-CD1 3.79Å; S86-L90 WeakPolarHBondContact O-CB 3.45Å; S86-L90 VanDerWaalsContact O-CG 3.27Å; S86-L90 WeakPolarHBondContact O-CG 3.33Å; S86-L90 PolarHBondContact O-N 3.43Å; V87-L90 PolarHBondContact O-N 3.43Å; L90-L92 VanDerWaalsContact C-N 3.33Å; L90-L92 PolarHBondContact O-N 3.48Å; L90-V93 PolarHBondContact O-N 3.46Å; L90-F94 HydrophobicContact CB-CD2 4.48Å; L90-F94 HydrophobicContact CB-CE2 4.21Å; L90-F94 HydrophobicContact CD2-CE2 4.42Å; L90-F94 WeakPolarHBondContact O-CD2 3.47Å; L90-F94 PolarHBondContact O-N 3.35Å |
| 91 | L | 95.3 | Very high | 93.1 | Very high | 78 Ų | 78 | 29.3 Ų | 29.3 | 41% | 0.408 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -56.9 | -48 | 177.5 | -72.5 | 171 | 0 | 0 | 0 | 110.9 | V87 A88 D89 F94 I120 | V87-L91 HydrophobicContact CG1-CD1 4.38Å; V87-L91 WeakPolarHBondContact O-CG 3.34Å; V87-L91 PolarHBondContact O-N 2.85Å; A88-L91 PolarHBondContact O-N 3.07Å; D89-L91 PolarHBondContact O-N 2.93Å; L91-F94 PolarHBondContact O-N 2.7Å; L91-I120 HydrophobicContact CB-CG2 3.99Å; L91-I120 WeakPolarHBondContact O-CG2 3.48Å |
| 92 | L | 95.4 | Very high | 93.4 | Very high | 2 Ų | 2 | 29.3 Ų | 29.3 | 1% | 0.01 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -61 | -49.3 | 175.4 | 173.4 | 65.3 | 0 | 0 | 0 | 111.8 | A88 D89 L90 F94 T95 L96 Y121 N124 Y304 | A88-L92 PolarHBondContact O-N 3.23Å; A88-L92 VanDerWaalsContact O-N 3.16Å; D89-L92 PolarHBondContact O-N 3.05Å; L90-L92 VanDerWaalsContact C-N 3.33Å; L90-L92 PolarHBondContact O-N 3.48Å; L92-F94 PolarHBondContact O-N 2.85Å; L92-T95 WeakPolarHBondContact O-CA 3.45Å; L92-T95 WeakPolarHBondContact O-CB 3.48Å; L92-T95 PolarHBondContact O-N 3.38Å; L92-T95 PolarHBondContact O-OG1 3.25Å; L92-L96 PolarHBondContact O-N 3.04Å; L92-Y121 HydrophobicContact CD1-CD2 4.23Å; L92-N124 HydrophobicContact CB-CB 3.78Å; L92-N124 HydrophobicContact CD2-CB 4.22Å; L92-N124 VanDerWaalsContact CD2-OD1 3.3Å; L92-N124 WeakPolarHBondContact CD2-OD1 3.31Å; L92-N124 HydrophobicContact CG-CB 4.43Å; L92-Y304 HydrophobicContact CD1-CD1 4.48Å; L92-Y304 HydrophobicContact CD1-CE1 4.09Å; L92-Y304 HydrophobicContact CD2-CD1 4.07Å; L92-Y304 HydrophobicContact CD2-CE1 4.4Å |
| 93 | V | 96.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 27.1 Ų | 27.1 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -56 | -40.5 | -178.3 | 164.9 | 0 | 0 | 0 | 0 | 111.2 | F54 I58 D89 L90 T95 L96 | F54-V93 HydrophobicContact CD2-CG1 3.94Å; F54-V93 WeakPolarHBondContact CD2-O 3.33Å; F54-V93 WeakPolarHBondContact O-CG1 3.24Å; I58-V93 HydrophobicContact CG1-CG1 3.57Å; D89-V93 WeakPolarHBondContact O-CB 3.43Å; D89-V93 WeakPolarHBondContact O-CG2 3.29Å; D89-V93 PolarHBondContact O-N 2.71Å; L90-V93 PolarHBondContact O-N 3.46Å; V93-T95 PolarHBondContact O-N 2.95Å; V93-L96 HydrophobicContact CG2-CD1 4.41Å; V93-L96 WeakPolarHBondContact O-CB 3.26Å; V93-L96 PolarHBondContact O-N 3.37Å; V93-L96 VanDerWaalsContact O-N 3.12Å |
| 94 | F | 96.3 | Very high | 93.7 | Very high | 112 Ų | 112 | 26.9 Ų | 26.9 | 49% | 0.491 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -63.9 | -20.1 | 175.7 | -75.3 | -57.8 | 0 | 0 | 0 | 114.3 | F54 I58 L90 L91 L92 P97 | F54-F94 HydrophobicContact CE2-CD1 4.49Å; I58-F94 HydrophobicContact CD1-CD1 4.01Å; I58-F94 HydrophobicContact CD1-CE1 3.5Å; I58-F94 VanDerWaalsContact CD1-CE1 3.5Å; I58-F94 HydrophobicContact CD1-CZ 4.19Å; I58-F94 HydrophobicContact CG1-CE1 4.34Å; L90-F94 HydrophobicContact CB-CD2 4.48Å; L90-F94 HydrophobicContact CB-CE2 4.21Å; L90-F94 HydrophobicContact CD2-CE2 4.42Å; L90-F94 WeakPolarHBondContact O-CD2 3.47Å; L90-F94 PolarHBondContact O-N 3.35Å; L91-F94 PolarHBondContact O-N 2.7Å; L92-F94 PolarHBondContact O-N 2.85Å; F94-P97 WeakPolarHBondContact O-CD 3.48Å |
| 95 | T | 95.9 | Very high | 93.7 | Very high | 5 Ų | 5 | 28 Ų | 28 | 3% | 0.031 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -84 | -20.5 | 175.1 | 70.4 | 0 | 0 | 0 | 0 | 113.5 | L92 V93 P97 F98 W99 V117 I120 | L92-T95 WeakPolarHBondContact O-CA 3.45Å; L92-T95 WeakPolarHBondContact O-CB 3.48Å; L92-T95 PolarHBondContact O-N 3.38Å; L92-T95 PolarHBondContact O-OG1 3.25Å; V93-T95 PolarHBondContact O-N 2.95Å; T95-P97 VanDerWaalsContact C-CD 3.44Å; T95-F98 WeakPolarHBondContact O-CB 3.41Å; T95-F98 WeakPolarHBondContact O-CD2 3.46Å; T95-F98 PolarHBondContact O-N 3.47Å; T95-W99 PolarHBondContact O-N 2.75Å; T95-V117 HydrophobicContact CG2-CB 4.29Å; T95-V117 HydrophobicContact CG2-CG1 4.03Å; T95-I120 HydrophobicContact CG2-CB 3.9Å; T95-I120 HydrophobicContact CG2-CD1 3.69Å; T95-I120 HydrophobicContact CG2-CG1 4.41Å; T95-I120 HydrophobicContact CG2-CG2 3.63Å |
| 96 | L | 94.5 | Very high | 93.7 | Very high | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -58.1 | -35.6 | -175.4 | -64.4 | 178 | 0 | 0 | 0 | 115.1 | Y50 I53 F54 L92 V93 F98 W99 A100 | Y50-L96 HydrophobicContact CD1-CD2 4.25Å; I53-L96 HydrophobicContact CB-CD1 3.83Å; I53-L96 HydrophobicContact CG2-CD1 3.36Å; F54-L96 HydrophobicContact CB-CB 4.47Å; L92-L96 PolarHBondContact O-N 3.04Å; V93-L96 HydrophobicContact CG2-CD1 4.41Å; V93-L96 WeakPolarHBondContact O-CB 3.26Å; V93-L96 PolarHBondContact O-N 3.37Å; V93-L96 VanDerWaalsContact O-N 3.12Å; L96-F98 VanDerWaalsContact C-N 3.25Å; L96-F98 PolarHBondContact O-N 3.31Å; L96-W99 PolarHBondContact O-N 3.42Å; L96-A100 WeakPolarHBondContact O-CB 3.43Å; L96-A100 PolarHBondContact O-N 2.82Å |
| 97 | P | 96 | Very high | 93.8 | Very high | 50 Ų | 50 | 28.6 Ų | 28.6 | 33% | 0.325 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -59.6 | -34.8 | 173.4 | -26.3 | 36.5 | 0 | 0 | 0 | 113.4 | F54 F94 T95 A100 V101 | F54-P97 HydrophobicContact CD2-CG 3.72Å; F54-P97 HydrophobicContact CE2-CG 3.69Å; F54-P97 HydrophobicContact CG-CG 4.22Å; F54-P97 HydrophobicContact CZ-CG 4.19Å; F94-P97 WeakPolarHBondContact O-CD 3.48Å; T95-P97 VanDerWaalsContact C-CD 3.44Å; P97-A100 PolarHBondContact O-N 3.15Å; P97-V101 WeakPolarHBondContact O-CG2 3.35Å; P97-V101 PolarHBondContact O-N 2.89Å; P97-V101 VanDerWaalsContact O-N 3.1Å |
| 98 | F | 95.7 | Very high | 93.9 | Very high | 59 Ų | 59 | 33.1 Ų | 33.1 | 26% | 0.259 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -68.1 | -44 | 177.3 | -58.9 | -89.9 | 0 | 0 | 0 | 110.8 | T95 L96 A100 V101 D102 W107 F109 L113 V117 | T95-F98 WeakPolarHBondContact O-CB 3.41Å; T95-F98 WeakPolarHBondContact O-CD2 3.46Å; T95-F98 PolarHBondContact O-N 3.47Å; L96-F98 VanDerWaalsContact C-N 3.25Å; L96-F98 PolarHBondContact O-N 3.31Å; F98-A100 VanDerWaalsContact C-N 3.28Å; F98-A100 PolarHBondContact O-N 3.29Å; F98-V101 PolarHBondContact O-N 2.87Å; F98-D102 WeakPolarHBondContact O-CB 3.04Å; F98-D102 PolarHBondContact O-N 2.93Å; F98-W107 HydrophobicContact CB-CH2 3.99Å; F98-W107 HydrophobicContact CB-CZ3 4Å; F98-F109 HydrophobicContact CB-CD2 4.4Å; F98-F109 HydrophobicContact CB-CE2 4.17Å; F98-F109 HydrophobicContact CD1-CB 4.46Å; F98-F109 AromaticContact CD1-CD1 3.66Å; F98-F109 HydrophobicContact CD1-CD1 3.66Å; F98-F109 AromaticContact CD1-CD2 3.72Å; F98-F109 HydrophobicContact CD1-CD2 3.72Å; F98-F109 AromaticContact CD1-CE1 3.68Å; F98-F109 HydrophobicContact CD1-CE1 3.68Å; F98-F109 AromaticContact CD1-CE2 3.74Å; F98-F109 HydrophobicContact CD1-CE2 3.74Å; F98-F109 AromaticContact CD1-CG 3.68Å; F98-F109 HydrophobicContact CD1-CG 3.68Å; F98-F109 AromaticContact CD1-CZ 3.72Å; F98-F109 HydrophobicContact CD1-CZ 3.72Å; F98-F109 AromaticContact CE1-CD1 3.77Å; F98-F109 HydrophobicContact CE1-CD1 3.77Å; F98-F109 AromaticContact CE1-CE1 3.87Å; F98-F109 HydrophobicContact CE1-CE1 3.87Å; F98-F109 HydrophobicContact CE1-CG 4.15Å; F98-F109 HydrophobicContact CE1-CZ 4.35Å; F98-F109 HydrophobicContact CG-CE2 4.42Å; F98-L113 HydrophobicContact CE1-CD1 4.2Å; F98-V117 HydrophobicContact CB-CG1 4.26Å; F98-V117 HydrophobicContact CD2-CG1 4.41Å; F98-V117 HydrophobicContact CG-CG1 4.35Å |
| 99 | W | 93.3 | Very high | 94 | Very high | 14 Ų | 14 | 36.3 Ų | 36.3 | 5% | 0.053 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -63 | -33.6 | 173.9 | -64.6 | 107.5 | 0 | 0 | 0 | 112.8 | Y50 T95 L96 A103 V117 H118 | Y50-W99 HydrophobicContact CD2-CB 3.77Å; Y50-W99 HydrophobicContact CE2-CB 3.58Å; T95-W99 PolarHBondContact O-N 2.75Å; L96-W99 PolarHBondContact O-N 3.42Å; W99-A103 VanDerWaalsContact O-CB 3.29Å; W99-A103 WeakPolarHBondContact O-CB 3.17Å; W99-A103 PolarHBondContact O-N 3.41Å; W99-V117 HydrophobicContact CH2-CG2 4.38Å; W99-V117 HydrophobicContact CZ2-CB 4.2Å; W99-V117 HydrophobicContact CZ2-CG2 3.81Å; W99-H118 AromaticContact CH2-CE1 3.49Å; W99-H118 VanDerWaalsContact CH2-CE1 3.49Å; W99-H118 WeakPolarHBondContact CH2-CE1 3.28Å; W99-H118 AromaticContact CH2-ND1 3.9Å; W99-H118 AromaticContact CH2-NE2 3.64Å |
| 100 | A | 93.3 | Very high | 93.9 | Very high | 17 Ų | 17 | 38 Ų | 38 | 14% | 0.14 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -67 | -41.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | P47 Y50 L96 P97 F98 A104 | P47-A100 HydrophobicContact CB-CB 4.04Å; P47-A100 WeakPolarHBondContact CG-O 3.48Å; Y50-A100 HydrophobicContact CD2-CB 4.21Å; L96-A100 WeakPolarHBondContact O-CB 3.43Å; L96-A100 PolarHBondContact O-N 2.82Å; P97-A100 PolarHBondContact O-N 3.15Å; F98-A100 VanDerWaalsContact C-N 3.28Å; F98-A100 PolarHBondContact O-N 3.29Å; A100-A104 VanDerWaalsContact O-CB 3.26Å; A100-A104 WeakPolarHBondContact O-CB 3.07Å; A100-A104 PolarHBondContact O-N 2.83Å |
| 101 | V | 94.4 | Very high | 93.9 | Very high | 54 Ų | 54 | 38.4 Ų | 38.4 | 33% | 0.327 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -68.6 | -42.5 | 176.5 | 173.6 | 0 | 0 | 0 | 0 | 111.3 | P97 F98 A103 A104 S105 S106 Y108 F109 | P97-V101 WeakPolarHBondContact O-CG2 3.35Å; P97-V101 PolarHBondContact O-N 2.89Å; P97-V101 VanDerWaalsContact O-N 3.1Å; F98-V101 PolarHBondContact O-N 2.87Å; V101-A103 VanDerWaalsContact C-N 3.35Å; V101-A103 PolarHBondContact O-N 3.44Å; V101-A104 PolarHBondContact O-N 3.24Å; V101-S105 PolarHBondContact O-N 2.98Å; V101-S106 PolarHBondContact O-N 3.2Å; V101-Y108 HydrophobicContact CG1-CD2 3.74Å; V101-Y108 HydrophobicContact CG1-CE2 3.98Å; V101-F109 HydrophobicContact CB-CE2 3.99Å; V101-F109 HydrophobicContact CB-CZ 4.03Å; V101-F109 HydrophobicContact CG1-CE2 3.94Å; V101-F109 HydrophobicContact CG1-CZ 3.95Å; V101-F109 HydrophobicContact CG2-CZ 4.26Å |
| 102 | D | 91.5 | Very high | 93.9 | Very high | 4 Ų | 4 | 42.5 Ų | 42.5 | 2% | 0.021 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -56.1 | -48.1 | 174.3 | -173.5 | 66.2 | 0 | 0 | 0 | 111.6 | F98 W107 C193 | F98-D102 WeakPolarHBondContact O-CB 3.04Å; F98-D102 PolarHBondContact O-N 2.93Å; D102-W107 HydrophobicContact CB-CE3 3.84Å; D102-W107 HydrophobicContact CB-CZ3 4.33Å; D102-C193 PolarHBondContact OD1-N 2.98Å |
| 103 | A | 88.8 | Confident | 94 | Very high | 6 Ų | 6 | 45.1 Ų | 45.1 | 5% | 0.05 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -70.6 | -34.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | R43 L46 P47 W99 V101 | R43-A103 WeakPolarHBondContact CG-O 3.5Å; L46-A103 HydrophobicContact CB-CB 3.8Å; L46-A103 HydrophobicContact CD1-CB 3.96Å; P47-A103 HydrophobicContact CG-CB 4.17Å; W99-A103 VanDerWaalsContact O-CB 3.29Å; W99-A103 WeakPolarHBondContact O-CB 3.17Å; W99-A103 PolarHBondContact O-N 3.41Å; V101-A103 VanDerWaalsContact C-N 3.35Å; V101-A103 PolarHBondContact O-N 3.44Å |
| 104 | A | 90 | Very high | 94 | Very high | 47 Ų | 47 | 45.1 Ų | 45.1 | 39% | 0.388 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -76.8 | -33.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | P47 A100 V101 | P47-A104 HydrophobicContact CB-CB 4.43Å; P47-A104 HydrophobicContact CG-CB 3.72Å; A100-A104 VanDerWaalsContact O-CB 3.26Å; A100-A104 WeakPolarHBondContact O-CB 3.07Å; A100-A104 PolarHBondContact O-N 2.83Å; V101-A104 PolarHBondContact O-N 3.24Å |
| 105 | S | 90.3 | Very high | 94 | Very high | 56 Ų | 56 | 41.1 Ų | 41.1 | 39% | 0.392 | 23% | 0.231 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -146.8 | -87.8 | -167.5 | -179.3 | 0 | 0 | 0 | 0 | 111.8 | V101 Y108 | V101-S105 PolarHBondContact O-N 2.98Å; S105-Y108 PolarHBondContact OG-OH 3.26Å |
| 106 | S | 92 | Very high | 94.1 | Very high | 10 Ų | 10 | 42.9 Ų | 42.9 | 7% | 0.07 | 24% | 0.242 | C | C | . | . | trans | -156.5 | 160.2 | -174.3 | -172.8 | 0 | 0 | 0 | 0 | 111.1 | V101 Y108 T191 | V101-S106 PolarHBondContact O-N 3.2Å; S106-Y108 WeakPolarHBondContact O-CD2 3.22Å; S106-Y108 WeakPolarHBondContact O-CE2 3.32Å; S106-Y108 PolarHBondContact O-N 3.28Å; S106-T191 PolarHBondContact OG-N 3.18Å; S106-T191 PolarHBondContact OG-O 2.85Å | ||
| 107 | W | 93.8 | Very high | 94.1 | Very high | 4 Ų | 4 | 43 Ų | 43 | 2% | 0.015 | 24% | 0.243 | C | C | . | . | trans | -81.1 | 100.2 | 174.1 | -172.8 | -96.1 | 0 | 0 | 0 | 112.7 | F98 D102 F109 G110 L113 C114 V117 T191 C193 | F98-W107 HydrophobicContact CB-CH2 3.99Å; F98-W107 HydrophobicContact CB-CZ3 4Å; D102-W107 HydrophobicContact CB-CE3 3.84Å; D102-W107 HydrophobicContact CB-CZ3 4.33Å; W107-F109 HydrophobicContact CD2-CB 4.49Å; W107-F109 AromaticContact CD2-CD2 3.9Å; W107-F109 HydrophobicContact CD2-CD2 3.9Å; W107-F109 AromaticContact CE2-CD2 3.91Å; W107-F109 AromaticContact CE3-CD2 3.89Å; W107-F109 HydrophobicContact CE3-CD2 3.89Å; W107-F109 HydrophobicContact CE3-CE2 4.49Å; W107-F109 HydrophobicContact CH2-CB 4.36Å; W107-F109 AromaticContact CH2-CD2 3.9Å; W107-F109 HydrophobicContact CH2-CD2 3.9Å; W107-F109 HydrophobicContact CZ2-CB 3.63Å; W107-F109 AromaticContact CZ2-CD2 3.89Å; W107-F109 HydrophobicContact CZ2-CD2 3.89Å; W107-F109 HydrophobicContact CZ2-CG 4.21Å; W107-F109 AromaticContact CZ3-CD2 3.91Å; W107-F109 HydrophobicContact CZ3-CD2 3.91Å; W107-F109 HydrophobicContact CZ3-CE2 4.46Å; W107-G110 PolarHBondContact NE1-O 3.22Å; W107-L113 HydrophobicContact CZ2-CB 4Å; W107-C114 HydrophobicContact CZ2-CB 3.8Å; W107-C114 VanDerWaalsContact CZ2-N 3.27Å; W107-V117 HydrophobicContact CH2-CG1 4.17Å; W107-V117 HydrophobicContact CH2-CG2 3.71Å; W107-V117 HydrophobicContact CZ2-CG2 4.49Å; W107-V117 HydrophobicContact CZ3-CG2 4.33Å; W107-T191 HydrophobicContact CB-CG2 4.19Å; W107-T191 PolarHBondContact N-O 2.87Å; W107-C193 HydrophobicContact CB-CB 4.27Å; W107-C193 HydrophobicContact CD2-CB 3.33Å; W107-C193 HydrophobicContact CE3-CB 3.4Å; W107-C193 HydrophobicContact CG-CB 3.7Å; W107-C193 HydrophobicContact CH2-CB 4.38Å; W107-C193 HydrophobicContact CZ2-CB 4.33Å; W107-C193 HydrophobicContact CZ3-CB 3.94Å | ||
| 108 | Y | 95.2 | Very high | 94.1 | Very high | 154 Ų | 154 | 40.9 Ų | 40.9 | 60% | 0.604 | 23% | 0.229 | S | C | * | . | trans | -91.2 | -4.2 | -179.7 | -56.9 | -73.1 | 0 | 0 | 0 | 114.8 | V101 S105 S106 | V101-Y108 HydrophobicContact CG1-CD2 3.74Å; V101-Y108 HydrophobicContact CG1-CE2 3.98Å; S105-Y108 PolarHBondContact OG-OH 3.26Å; S106-Y108 WeakPolarHBondContact O-CD2 3.22Å; S106-Y108 WeakPolarHBondContact O-CE2 3.32Å; S106-Y108 PolarHBondContact O-N 3.28Å | ||
| 109 | F | 95.4 | Very high | 94.1 | Very high | 66 Ų | 66 | 39.3 Ų | 39.3 | 29% | 0.289 | 22% | 0.224 | S | C | . | . | S | Bend | trans | -95.9 | 2.9 | -162.5 | -49.6 | -76.4 | 0 | 0 | 0 | 114.5 | F98 V101 W107 L113 | F98-F109 HydrophobicContact CB-CD2 4.4Å; F98-F109 HydrophobicContact CB-CE2 4.17Å; F98-F109 HydrophobicContact CD1-CB 4.46Å; F98-F109 AromaticContact CD1-CD1 3.66Å; F98-F109 HydrophobicContact CD1-CD1 3.66Å; F98-F109 AromaticContact CD1-CD2 3.72Å; F98-F109 HydrophobicContact CD1-CD2 3.72Å; F98-F109 AromaticContact CD1-CE1 3.68Å; F98-F109 HydrophobicContact CD1-CE1 3.68Å; F98-F109 AromaticContact CD1-CE2 3.74Å; F98-F109 HydrophobicContact CD1-CE2 3.74Å; F98-F109 AromaticContact CD1-CG 3.68Å; F98-F109 HydrophobicContact CD1-CG 3.68Å; F98-F109 AromaticContact CD1-CZ 3.72Å; F98-F109 HydrophobicContact CD1-CZ 3.72Å; F98-F109 AromaticContact CE1-CD1 3.77Å; F98-F109 HydrophobicContact CE1-CD1 3.77Å; F98-F109 AromaticContact CE1-CE1 3.87Å; F98-F109 HydrophobicContact CE1-CE1 3.87Å; F98-F109 HydrophobicContact CE1-CG 4.15Å; F98-F109 HydrophobicContact CE1-CZ 4.35Å; F98-F109 HydrophobicContact CG-CE2 4.42Å; V101-F109 HydrophobicContact CB-CE2 3.99Å; V101-F109 HydrophobicContact CB-CZ 4.03Å; V101-F109 HydrophobicContact CG1-CE2 3.94Å; V101-F109 HydrophobicContact CG1-CZ 3.95Å; V101-F109 HydrophobicContact CG2-CZ 4.26Å; W107-F109 HydrophobicContact CD2-CB 4.49Å; W107-F109 AromaticContact CD2-CD2 3.9Å; W107-F109 HydrophobicContact CD2-CD2 3.9Å; W107-F109 AromaticContact CE2-CD2 3.91Å; W107-F109 AromaticContact CE3-CD2 3.89Å; W107-F109 HydrophobicContact CE3-CD2 3.89Å; W107-F109 HydrophobicContact CE3-CE2 4.49Å; W107-F109 HydrophobicContact CH2-CB 4.36Å; W107-F109 AromaticContact CH2-CD2 3.9Å; W107-F109 HydrophobicContact CH2-CD2 3.9Å; W107-F109 HydrophobicContact CZ2-CB 3.63Å; W107-F109 AromaticContact CZ2-CD2 3.89Å; W107-F109 HydrophobicContact CZ2-CD2 3.89Å; W107-F109 HydrophobicContact CZ2-CG 4.21Å; W107-F109 AromaticContact CZ3-CD2 3.91Å; W107-F109 HydrophobicContact CZ3-CD2 3.91Å; W107-F109 HydrophobicContact CZ3-CE2 4.46Å; F109-L113 HydrophobicContact CB-CB 3.85Å; F109-L113 HydrophobicContact CB-CD1 3.72Å; F109-L113 HydrophobicContact CB-CG 4.43Å; F109-L113 HydrophobicContact CG-CD1 4.48Å |
| 110 | G | 94.3 | Very high | 94.3 | Very high | 36 Ų | 36 | 40.5 Ų | 40.5 | 37% | 0.371 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | 72.2 | 175.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | W107 C114 | W107-G110 PolarHBondContact NE1-O 3.22Å; G110-C114 PolarHBondContact O-N 2.97Å |
| 111 | G | 94.3 | Very high | 94.3 | Very high | 32 Ų | 32 | 40.4 Ų | 40.4 | 33% | 0.33 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -64.1 | -42.1 | -173.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | L113 C114 T115 | G111-L113 PolarHBondContact O-N 3.48Å; G111-C114 WeakPolarHBondContact O-CB 3.2Å; G111-C114 PolarHBondContact O-N 3.15Å; G111-T115 PolarHBondContact O-N 3.42Å; G111-T115 PolarHBondContact O-OG1 3.18Å; G111-T115 VanDerWaalsContact O-OG1 3.11Å |
| 112 | F | 96.1 | Very high | 94.2 | Very high | 165 Ų | 165 | 38 Ų | 38 | 72% | 0.724 | 21% | 0.213 | S | C | * | . | H | α-helix | trans | -58.2 | -47.7 | -177.9 | 173.8 | -98.6 | 0 | 0 | 0 | 112.8 | C114 T116 | F112-C114 VanDerWaalsContact C-N 3.31Å; F112-T116 WeakPolarHBondContact O-CB 3.34Å; F112-T116 PolarHBondContact O-N 3.46Å; F112-T116 PolarHBondContact O-OG1 3.04Å |
| 113 | L | 96.5 | Very high | 94.4 | Very high | 56 Ų | 56 | 39.7 Ų | 39.7 | 29% | 0.293 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -69.4 | -32.2 | 177 | -78.7 | 172.3 | 0 | 0 | 0 | 111.3 | F98 W107 F109 G111 T116 V117 | F98-L113 HydrophobicContact CE1-CD1 4.2Å; W107-L113 HydrophobicContact CZ2-CB 4Å; F109-L113 HydrophobicContact CB-CB 3.85Å; F109-L113 HydrophobicContact CB-CD1 3.72Å; F109-L113 HydrophobicContact CB-CG 4.43Å; F109-L113 HydrophobicContact CG-CD1 4.48Å; G111-L113 PolarHBondContact O-N 3.48Å; L113-T116 PolarHBondContact O-N 3.4Å; L113-V117 WeakPolarHBondContact O-CG1 3.49Å; L113-V117 WeakPolarHBondContact O-CG2 3.23Å; L113-V117 PolarHBondContact O-N 2.95Å |
| 114 | C | 96.4 | Very high | 94.6 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.4 | -47.7 | 177.1 | 177.1 | 0 | 0 | 0 | 0 | 111.3 | W107 G110 G111 F112 T116 V117 H118 T183 A184 C193 | W107-C114 HydrophobicContact CZ2-CB 3.8Å; W107-C114 VanDerWaalsContact CZ2-N 3.27Å; G110-C114 PolarHBondContact O-N 2.97Å; G111-C114 WeakPolarHBondContact O-CB 3.2Å; G111-C114 PolarHBondContact O-N 3.15Å; F112-C114 VanDerWaalsContact C-N 3.31Å; C114-T116 VanDerWaalsContact C-N 3.34Å; C114-V117 VanDerWaalsContact O-CG2 3.24Å; C114-V117 WeakPolarHBondContact O-CG2 3.16Å; C114-H118 PolarHBondContact O-N 2.82Å; C114-H118 PolarHBondContact O-ND1 3.46Å; C114-T183 PolarHBondContact SG-O 3.34Å; C114-A184 HydrophobicContact CB-CB 4.35Å; C114-C193 WeakPolarHBondContact CA-SG 3.4Å; C114-C193 HydrophobicContact CB-CB 3.84Å; C114-C193 WeakPolarHBondContact CB-SG 3.26Å; C114-C193 WeakPolarHBondContact SG-CA 3.46Å; C114-C193 WeakPolarHBondContact SG-CB 3.17Å; C114-C193 CovalentContact SG-SG 2.03Å; C114-C193 PolarHBondContact SG-SG 2.97Å |
| 115 | T | 96.9 | Very high | 94.6 | Very high | 29 Ų | 29 | 37.4 Ų | 37.4 | 18% | 0.178 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -62.4 | -43.4 | 173.9 | -48.2 | 0 | 0 | 0 | 0 | 111 | G111 V117 H118 V119 A182 | G111-T115 PolarHBondContact O-N 3.42Å; G111-T115 PolarHBondContact O-OG1 3.18Å; G111-T115 VanDerWaalsContact O-OG1 3.11Å; T115-V117 PolarHBondContact O-N 3.1Å; T115-H118 PolarHBondContact O-N 3.03Å; T115-V119 HydrophobicContact CG2-CG2 4.42Å; T115-V119 WeakPolarHBondContact O-CG2 3.39Å; T115-V119 PolarHBondContact O-N 3.13Å; T115-A182 PolarHBondContact OG1-O 3.45Å |
| 116 | T | 96.9 | Very high | 94.8 | Very high | 42 Ų | 42 | 35.1 Ų | 35.1 | 26% | 0.258 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -61.6 | -45.5 | -178.5 | -59.9 | 0 | 0 | 0 | 0 | 112.6 | F112 L113 C114 H118 V119 I120 | F112-T116 WeakPolarHBondContact O-CB 3.34Å; F112-T116 PolarHBondContact O-N 3.46Å; F112-T116 PolarHBondContact O-OG1 3.04Å; L113-T116 PolarHBondContact O-N 3.4Å; C114-T116 VanDerWaalsContact C-N 3.34Å; T116-H118 VanDerWaalsContact C-N 3.32Å; T116-H118 PolarHBondContact O-N 3.03Å; T116-V119 PolarHBondContact O-N 2.92Å; T116-I120 HydrophobicContact CG2-CD1 3.83Å; T116-I120 HydrophobicContact CG2-CG1 4.45Å; T116-I120 WeakPolarHBondContact O-CG1 3.3Å; T116-I120 PolarHBondContact O-N 3.42Å |
| 117 | V | 96 | Very high | 94.9 | Very high | 3 Ų | 3 | 34.6 Ų | 34.6 | 2% | 0.018 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -66.3 | -35.5 | 179.7 | -62.4 | 0 | 0 | 0 | 0 | 111.9 | T95 F98 W99 W107 L113 C114 T115 I120 Y121 | T95-V117 HydrophobicContact CG2-CB 4.29Å; T95-V117 HydrophobicContact CG2-CG1 4.03Å; F98-V117 HydrophobicContact CB-CG1 4.26Å; F98-V117 HydrophobicContact CD2-CG1 4.41Å; F98-V117 HydrophobicContact CG-CG1 4.35Å; W99-V117 HydrophobicContact CH2-CG2 4.38Å; W99-V117 HydrophobicContact CZ2-CB 4.2Å; W99-V117 HydrophobicContact CZ2-CG2 3.81Å; W107-V117 HydrophobicContact CH2-CG1 4.17Å; W107-V117 HydrophobicContact CH2-CG2 3.71Å; W107-V117 HydrophobicContact CZ2-CG2 4.49Å; W107-V117 HydrophobicContact CZ3-CG2 4.33Å; L113-V117 WeakPolarHBondContact O-CG1 3.49Å; L113-V117 WeakPolarHBondContact O-CG2 3.23Å; L113-V117 PolarHBondContact O-N 2.95Å; C114-V117 VanDerWaalsContact O-CG2 3.24Å; C114-V117 WeakPolarHBondContact O-CG2 3.16Å; T115-V117 PolarHBondContact O-N 3.1Å; V117-I120 PolarHBondContact O-N 3.31Å; V117-Y121 WeakPolarHBondContact O-CB 3.35Å; V117-Y121 PolarHBondContact O-N 3.44Å |
| 118 | H | 95.1 | Very high | 94.7 | Very high | 5 Ų | 5 | 34.5 Ų | 34.5 | 2% | 0.023 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -66.7 | -43 | 173.8 | -80.7 | 87.7 | 0 | 0 | 0 | 112.1 | W99 C114 T115 T116 Y121 T122 D178 A182 C193 | W99-H118 AromaticContact CH2-CE1 3.49Å; W99-H118 VanDerWaalsContact CH2-CE1 3.49Å; W99-H118 WeakPolarHBondContact CH2-CE1 3.28Å; W99-H118 AromaticContact CH2-ND1 3.9Å; W99-H118 AromaticContact CH2-NE2 3.64Å; C114-H118 PolarHBondContact O-N 2.82Å; C114-H118 PolarHBondContact O-ND1 3.46Å; T115-H118 PolarHBondContact O-N 3.03Å; T116-H118 VanDerWaalsContact C-N 3.32Å; T116-H118 PolarHBondContact O-N 3.03Å; H118-Y121 WeakPolarHBondContact O-CB 3.33Å; H118-Y121 PolarHBondContact O-N 3.36Å; H118-T122 PolarHBondContact O-N 3.4Å; H118-T122 PolarHBondContact O-OG1 3.32Å; H118-D178 HydrophobicContact CB-CB 4.14Å; H118-A182 HydrophobicContact CB-CB 3.85Å; H118-C193 PolarHBondContact CE1-SG 3.28Å; H118-C193 PolarHBondContact ND1-SG 2.97Å |
| 119 | V | 96.2 | Very high | 94.5 | Very high | 26 Ų | 26 | 27.1 Ų | 27.1 | 16% | 0.158 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -61.1 | -46.8 | 174.8 | 168.1 | 0 | 0 | 0 | 0 | 110.8 | T115 T116 Y121 T122 I123 T175 D178 I179 | T115-V119 HydrophobicContact CG2-CG2 4.42Å; T115-V119 WeakPolarHBondContact O-CG2 3.39Å; T115-V119 PolarHBondContact O-N 3.13Å; T116-V119 PolarHBondContact O-N 2.92Å; V119-Y121 VanDerWaalsContact C-N 3.33Å; V119-Y121 PolarHBondContact O-N 2.89Å; V119-T122 PolarHBondContact O-N 2.93Å; V119-I123 HydrophobicContact CG1-CD1 3.77Å; V119-I123 HydrophobicContact CG1-CG1 4.35Å; V119-I123 VanDerWaalsContact O-CG1 3.31Å; V119-I123 WeakPolarHBondContact O-CG1 3.21Å; V119-I123 PolarHBondContact O-N 3.4Å; V119-T175 HydrophobicContact CG1-CG2 4.16Å; V119-D178 HydrophobicContact CG2-CB 4.12Å; V119-I179 HydrophobicContact CG2-CD1 4.43Å; V119-I179 HydrophobicContact CG2-CG1 3.58Å |
| 120 | I | 96.3 | Very high | 94.3 | Very high | 38 Ų | 38 | 25.8 Ų | 25.8 | 20% | 0.195 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -62.5 | -41.8 | 178.7 | -69.8 | 168.9 | 0 | 0 | 0 | 111 | L91 T95 T116 V117 I123 N124 | L91-I120 HydrophobicContact CB-CG2 3.99Å; L91-I120 WeakPolarHBondContact O-CG2 3.48Å; T95-I120 HydrophobicContact CG2-CB 3.9Å; T95-I120 HydrophobicContact CG2-CD1 3.69Å; T95-I120 HydrophobicContact CG2-CG1 4.41Å; T95-I120 HydrophobicContact CG2-CG2 3.63Å; T116-I120 HydrophobicContact CG2-CD1 3.83Å; T116-I120 HydrophobicContact CG2-CG1 4.45Å; T116-I120 WeakPolarHBondContact O-CG1 3.3Å; T116-I120 PolarHBondContact O-N 3.42Å; V117-I120 PolarHBondContact O-N 3.31Å; I120-I123 PolarHBondContact O-N 3.18Å; I120-N124 WeakPolarHBondContact O-CB 3.34Å; I120-N124 PolarHBondContact O-N 3.44Å |
| 121 | Y | 93.7 | Very high | 94.1 | Very high | 15 Ų | 15 | 24 Ų | 24 | 6% | 0.059 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -55.2 | -52.3 | 174.2 | 170.2 | -91.6 | 0 | 0 | 0 | 111.4 | L92 V117 H118 V119 I123 N124 L125 Y304 | L92-Y121 HydrophobicContact CD1-CD2 4.23Å; V117-Y121 WeakPolarHBondContact O-CB 3.35Å; V117-Y121 PolarHBondContact O-N 3.44Å; H118-Y121 WeakPolarHBondContact O-CB 3.33Å; H118-Y121 PolarHBondContact O-N 3.36Å; V119-Y121 VanDerWaalsContact C-N 3.33Å; V119-Y121 PolarHBondContact O-N 2.89Å; Y121-I123 PolarHBondContact O-N 3.15Å; Y121-N124 PolarHBondContact O-N 3.02Å; Y121-L125 WeakPolarHBondContact O-CB 3.49Å; Y121-L125 PolarHBondContact O-N 2.86Å; Y121-Y304 AromaticContact CD2-CE1 3.64Å; Y121-Y304 HydrophobicContact CD2-CE1 3.64Å; Y121-Y304 AromaticContact CD2-CZ 3.95Å; Y121-Y304 WeakPolarHBondContact CD2-OH 3.27Å; Y121-Y304 AromaticContact CE2-CE1 3.45Å; Y121-Y304 HydrophobicContact CE2-CE1 3.45Å; Y121-Y304 VanDerWaalsContact CE2-CE1 3.45Å; Y121-Y304 AromaticContact CE2-CZ 3.63Å; Y121-Y304 WeakPolarHBondContact CE2-OH 3.16Å |
| 122 | T | 93.2 | Very high | 93.8 | Very high | 5 Ų | 5 | 22.9 Ų | 22.9 | 3% | 0.031 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -66.2 | -39.2 | -177.8 | -60.4 | 0 | 0 | 0 | 0 | 112 | H118 V119 Y126 T175 D178 | H118-T122 PolarHBondContact O-N 3.4Å; H118-T122 PolarHBondContact O-OG1 3.32Å; V119-T122 PolarHBondContact O-N 2.93Å; T122-Y126 HydrophobicContact CG2-CD2 3.54Å; T122-Y126 HydrophobicContact CG2-CE2 3.32Å; T122-Y126 VanDerWaalsContact O-CD2 3.3Å; T122-Y126 WeakPolarHBondContact O-CD2 3.3Å; T122-Y126 PolarHBondContact O-N 3.05Å; T122-Y126 VanDerWaalsContact O-N 3.15Å; T122-T175 HydrophobicContact CG2-CG2 3.75Å; T122-D178 VanDerWaalsContact CB-OD2 3.23Å; T122-D178 WeakPolarHBondContact CB-OD2 3.48Å; T122-D178 WeakPolarHBondContact CG2-OD2 3.46Å; T122-D178 VanDerWaalsContact OG1-CG 3.29Å; T122-D178 PolarHBondContact OG1-OD2 3.12Å |
| 123 | I | 94.4 | Very high | 93.5 | Very high | 38 Ų | 38 | 15.4 Ų | 15.4 | 20% | 0.195 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -59.7 | -49.3 | 172.6 | -71.4 | 172.8 | 0 | 0 | 0 | 110.2 | V119 I120 Y121 S127 W168 T175 | V119-I123 HydrophobicContact CG1-CD1 3.77Å; V119-I123 HydrophobicContact CG1-CG1 4.35Å; V119-I123 VanDerWaalsContact O-CG1 3.31Å; V119-I123 WeakPolarHBondContact O-CG1 3.21Å; V119-I123 PolarHBondContact O-N 3.4Å; I120-I123 PolarHBondContact O-N 3.18Å; Y121-I123 PolarHBondContact O-N 3.15Å; I123-S127 WeakPolarHBondContact O-CB 3.39Å; I123-S127 PolarHBondContact O-N 3.41Å; I123-S127 PolarHBondContact O-OG 2.89Å; I123-W168 HydrophobicContact CG2-CE3 4.32Å; I123-W168 HydrophobicContact CG2-CZ3 3.76Å; I123-T175 HydrophobicContact CD1-CG2 4.33Å; I123-T175 HydrophobicContact CG1-CG2 3.52Å |
| 124 | N | 93.7 | Very high | 93.1 | Very high | 3 Ų | 3 | 14.9 Ų | 14.9 | 2% | 0.016 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -59.8 | -53.4 | -179.3 | 175.9 | -85.2 | 0 | 0 | 0 | 110.8 | A88 D89 L92 I120 Y121 Y126 S127 S128 | A88-N124 PolarHBondContact O-ND2 3.36Å; D89-N124 VanDerWaalsContact CA-ND2 3.35Å; D89-N124 WeakPolarHBondContact CA-ND2 3.17Å; D89-N124 PolarHBondContact N-ND2 3.14Å; D89-N124 PolarHBondContact OD1-ND2 2.63Å; D89-N124 VanDerWaalsContact OD1-ND2 3.17Å; L92-N124 HydrophobicContact CB-CB 3.78Å; L92-N124 HydrophobicContact CD2-CB 4.22Å; L92-N124 VanDerWaalsContact CD2-OD1 3.3Å; L92-N124 WeakPolarHBondContact CD2-OD1 3.31Å; L92-N124 HydrophobicContact CG-CB 4.43Å; I120-N124 WeakPolarHBondContact O-CB 3.34Å; I120-N124 PolarHBondContact O-N 3.44Å; Y121-N124 PolarHBondContact O-N 3.02Å; N124-Y126 PolarHBondContact O-N 3.47Å; N124-S127 PolarHBondContact O-N 3.13Å; N124-S127 PolarHBondContact O-OG 2.86Å; N124-S128 WeakPolarHBondContact O-CB 3.13Å; N124-S128 PolarHBondContact O-N 2.85Å; N124-S128 PolarHBondContact O-OG 3.36Å |
| 125 | L | 90.8 | Very high | 92.5 | Very high | 3 Ų | 3 | 15.1 Ų | 15.1 | 2% | 0.016 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -47.9 | -59.8 | 179.4 | 169.4 | 78.4 | 0 | 0 | 0 | 111.7 | Y121 V129 H213 W264 | Y121-L125 WeakPolarHBondContact O-CB 3.49Å; Y121-L125 PolarHBondContact O-N 2.86Å; L125-V129 WeakPolarHBondContact O-CG1 3.22Å; L125-V129 PolarHBondContact O-N 3.37Å; L125-H213 WeakPolarHBondContact CD2-CD2 3.29Å; L125-H213 WeakPolarHBondContact CD2-NE2 3.01Å; L125-W264 HydrophobicContact CD1-CE3 3.99Å; L125-W264 HydrophobicContact CD1-CH2 3.11Å; L125-W264 HydrophobicContact CD1-CZ2 3.75Å; L125-W264 HydrophobicContact CD1-CZ3 3.24Å; L125-W264 HydrophobicContact CG-CH2 4.4Å |
| 126 | Y | 93.4 | Very high | 92 | Very high | 7 Ų | 7 | 13.8 Ų | 13.8 | 3% | 0.027 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -73.8 | -41.3 | -173 | -66.4 | -50.5 | 0 | 0 | 0 | 112 | T122 N124 V129 L130 L174 V216 | T122-Y126 HydrophobicContact CG2-CD2 3.54Å; T122-Y126 HydrophobicContact CG2-CE2 3.32Å; T122-Y126 VanDerWaalsContact O-CD2 3.3Å; T122-Y126 WeakPolarHBondContact O-CD2 3.3Å; T122-Y126 PolarHBondContact O-N 3.05Å; T122-Y126 VanDerWaalsContact O-N 3.15Å; N124-Y126 PolarHBondContact O-N 3.47Å; Y126-V129 WeakPolarHBondContact O-CG1 3.3Å; Y126-L130 WeakPolarHBondContact O-CB 3.37Å; Y126-L130 WeakPolarHBondContact O-CD1 3.35Å; Y126-L130 WeakPolarHBondContact O-CG 3.41Å; Y126-L130 PolarHBondContact O-N 2.85Å; Y126-L174 HydrophobicContact CD1-CD1 4.18Å; Y126-L174 HydrophobicContact CD2-CB 3.65Å; Y126-L174 HydrophobicContact CD2-CD1 3.67Å; Y126-L174 HydrophobicContact CD2-CG 4.31Å; Y126-L174 HydrophobicContact CE1-CD1 4.37Å; Y126-L174 HydrophobicContact CE2-CB 3.55Å; Y126-L174 HydrophobicContact CE2-CD1 3.86Å; Y126-L174 HydrophobicContact CE2-CG 4.24Å; Y126-L174 HydrophobicContact CG-CD1 3.85Å; Y126-V216 HydrophobicContact CD1-CB 4.28Å; Y126-V216 HydrophobicContact CD1-CG1 3.8Å; Y126-V216 HydrophobicContact CE1-CB 3.79Å; Y126-V216 HydrophobicContact CE1-CG1 3.8Å |
| 127 | S | 93.7 | Very high | 91.5 | Very high | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -65.3 | -43.1 | 179.5 | 66.3 | 0 | 0 | 0 | 0 | 111.7 | I123 N124 V129 L130 I131 | I123-S127 WeakPolarHBondContact O-CB 3.39Å; I123-S127 PolarHBondContact O-N 3.41Å; I123-S127 PolarHBondContact O-OG 2.89Å; N124-S127 PolarHBondContact O-N 3.13Å; N124-S127 PolarHBondContact O-OG 2.86Å; S127-V129 PolarHBondContact O-N 3.4Å; S127-L130 PolarHBondContact O-N 2.92Å; S127-I131 WeakPolarHBondContact O-CB 3.12Å; S127-I131 WeakPolarHBondContact O-CD1 3.44Å; S127-I131 WeakPolarHBondContact O-CG1 3.44Å; S127-I131 PolarHBondContact O-N 3.36Å |
| 128 | S | 91.2 | Very high | 90.8 | Very high | 1 Ų | 1 | 14.7 Ų | 14.7 | 1% | 0.007 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -60 | -48.6 | -179.5 | -70.5 | 0 | 0 | 0 | 0 | 111.8 | L85 N124 I131 L132 | L85-S128 WeakPolarHBondContact CD1-OG 3.11Å; N124-S128 WeakPolarHBondContact O-CB 3.13Å; N124-S128 PolarHBondContact O-N 2.85Å; N124-S128 PolarHBondContact O-OG 3.36Å; S128-I131 PolarHBondContact O-N 3.31Å; S128-L132 WeakPolarHBondContact O-CG 3.44Å; S128-L132 PolarHBondContact O-N 2.84Å; S128-L132 VanDerWaalsContact O-N 3.14Å |
| 129 | V | 90.1 | Very high | 90.1 | Very high | 0 Ų | 0 | 17.9 Ų | 17.9 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -70.6 | -39.8 | -179.8 | 73.6 | 0 | 0 | 0 | 0 | 112.6 | L125 Y126 S127 I131 L132 A133 P221 F260 | L125-V129 WeakPolarHBondContact O-CG1 3.22Å; L125-V129 PolarHBondContact O-N 3.37Å; Y126-V129 WeakPolarHBondContact O-CG1 3.3Å; S127-V129 PolarHBondContact O-N 3.4Å; V129-I131 VanDerWaalsContact C-N 3.3Å; V129-I131 PolarHBondContact O-N 3.41Å; V129-L132 WeakPolarHBondContact O-CB 3.13Å; V129-L132 PolarHBondContact O-N 3.37Å; V129-L132 VanDerWaalsContact O-N 3.16Å; V129-A133 PolarHBondContact O-N 3.35Å; V129-P221 HydrophobicContact CB-CB 4.39Å; V129-P221 HydrophobicContact CB-CG 4.36Å; V129-P221 HydrophobicContact CG1-CB 4.3Å; V129-P221 HydrophobicContact CG1-CG 3.77Å; V129-P221 HydrophobicContact CG2-CB 3.37Å; V129-P221 HydrophobicContact CG2-CG 3.69Å; V129-F260 HydrophobicContact CB-CE2 3.84Å; V129-F260 HydrophobicContact CB-CZ 3.65Å; V129-F260 HydrophobicContact CG2-CD1 4.48Å; V129-F260 HydrophobicContact CG2-CE1 3.6Å; V129-F260 HydrophobicContact CG2-CE2 3.79Å; V129-F260 HydrophobicContact CG2-CZ 3.21Å |
| 130 | L | 91.9 | Very high | 89.5 | Confident | 37 Ų | 37 | 19.1 Ų | 19.1 | 19% | 0.194 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -65.8 | -34.8 | 176.9 | -70.8 | 173.2 | 0 | 0 | 0 | 111.3 | Y126 S127 A133 F134 V167 P170 P221 | Y126-L130 WeakPolarHBondContact O-CB 3.37Å; Y126-L130 WeakPolarHBondContact O-CD1 3.35Å; Y126-L130 WeakPolarHBondContact O-CG 3.41Å; Y126-L130 PolarHBondContact O-N 2.85Å; S127-L130 PolarHBondContact O-N 2.92Å; L130-A133 PolarHBondContact O-N 2.88Å; L130-F134 WeakPolarHBondContact O-CB 3.47Å; L130-F134 PolarHBondContact O-N 2.95Å; L130-V167 HydrophobicContact CB-CB 4.36Å; L130-V167 HydrophobicContact CB-CG1 3.92Å; L130-V167 HydrophobicContact CB-CG2 4.12Å; L130-P170 HydrophobicContact CD1-CB 4.5Å; L130-P221 HydrophobicContact CD2-CG 4.49Å |
| 131 | I | 90.3 | Very high | 88.8 | Confident | 0 Ų | 0 | 19.3 Ų | 19.3 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -62.4 | -43.6 | 171.8 | -72 | 163.1 | 0 | 0 | 0 | 110.7 | H84 L85 S127 S128 V129 F134 I135 I163 V167 | H84-I131 HydrophobicContact CB-CD1 3.85Å; L85-I131 HydrophobicContact CB-CD1 4.5Å; L85-I131 HydrophobicContact CB-CG2 4.3Å; S127-I131 WeakPolarHBondContact O-CB 3.12Å; S127-I131 WeakPolarHBondContact O-CD1 3.44Å; S127-I131 WeakPolarHBondContact O-CG1 3.44Å; S127-I131 PolarHBondContact O-N 3.36Å; S128-I131 PolarHBondContact O-N 3.31Å; V129-I131 VanDerWaalsContact C-N 3.3Å; V129-I131 PolarHBondContact O-N 3.41Å; I131-F134 PolarHBondContact O-N 3.05Å; I131-I135 HydrophobicContact CG2-CD1 3.77Å; I131-I135 HydrophobicContact CG2-CG1 4.33Å; I131-I135 VanDerWaalsContact O-CG1 3.24Å; I131-I135 WeakPolarHBondContact O-CG1 3.44Å; I131-I135 PolarHBondContact O-N 3.24Å; I131-I163 HydrophobicContact CG1-CD1 4.42Å; I131-V167 HydrophobicContact CD1-CG1 4.31Å; I131-V167 HydrophobicContact CG1-CG1 3.73Å; I131-V167 HydrophobicContact CG1-CG2 4.49Å |
| 132 | L | 87.4 | Confident | 88.1 | Confident | 8 Ų | 8 | 21.2 Ų | 21.2 | 4% | 0.042 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -62.5 | -41.8 | 176.2 | -68.7 | 176.3 | 0 | 0 | 0 | 112 | L85 S128 V129 I135 S136 I225 L256 F260 | L85-L132 HydrophobicContact CD2-CD2 4.46Å; S128-L132 WeakPolarHBondContact O-CG 3.44Å; S128-L132 PolarHBondContact O-N 2.84Å; S128-L132 VanDerWaalsContact O-N 3.14Å; V129-L132 WeakPolarHBondContact O-CB 3.13Å; V129-L132 PolarHBondContact O-N 3.37Å; V129-L132 VanDerWaalsContact O-N 3.16Å; L132-I135 HydrophobicContact CD2-CD1 4.46Å; L132-I135 PolarHBondContact O-N 3.11Å; L132-S136 WeakPolarHBondContact O-CB 3.14Å; L132-S136 PolarHBondContact O-N 3.5Å; L132-S136 PolarHBondContact O-OG 2.83Å; L132-I225 HydrophobicContact CB-CD1 4.13Å; L132-L256 HydrophobicContact CD2-CB 4.47Å; L132-F260 HydrophobicContact CD1-CB 3.91Å; L132-F260 HydrophobicContact CD1-CD2 3.69Å; L132-F260 HydrophobicContact CD1-CE2 4.48Å; L132-F260 HydrophobicContact CD1-CG 3.85Å |
| 133 | A | 90.2 | Very high | 87.3 | Confident | 8 Ų | 8 | 23 Ų | 23 | 7% | 0.066 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -61.5 | -44.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | V129 L130 I135 S136 V137 P221 V224 I225 | V129-A133 PolarHBondContact O-N 3.35Å; L130-A133 PolarHBondContact O-N 2.88Å; A133-I135 PolarHBondContact O-N 2.97Å; A133-S136 WeakPolarHBondContact O-CA 3.21Å; A133-S136 VanDerWaalsContact O-CB 3.29Å; A133-S136 WeakPolarHBondContact O-CB 3.08Å; A133-S136 PolarHBondContact O-N 2.81Å; A133-S136 VanDerWaalsContact O-N 3.07Å; A133-V137 WeakPolarHBondContact O-CG2 3.46Å; A133-V137 PolarHBondContact O-N 3.29Å; A133-P221 HydrophobicContact CB-CB 4.24Å; A133-V224 HydrophobicContact CB-CB 4.47Å; A133-V224 HydrophobicContact CB-CG1 4.17Å; A133-I225 HydrophobicContact CB-CD1 4.47Å; A133-I225 HydrophobicContact CB-CG1 4.16Å |
| 134 | F | 87.7 | Confident | 86.5 | Confident | 45 Ų | 45 | 23.3 Ų | 23.3 | 20% | 0.197 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -65.1 | -40.3 | 179 | -158.3 | -108.4 | 0 | 0 | 0 | 112.7 | Y81 L130 I131 S136 V137 D138 A159 W162 | Y81-F134 HydrophobicContact CD1-CD1 4.42Å; Y81-F134 AromaticContact CE1-CD1 3.74Å; Y81-F134 HydrophobicContact CE1-CD1 3.74Å; Y81-F134 AromaticContact CE1-CE1 3.76Å; Y81-F134 HydrophobicContact CE1-CE1 3.76Å; Y81-F134 HydrophobicContact CE2-CD1 4.14Å; Y81-F134 HydrophobicContact CE2-CE1 4.46Å; Y81-F134 AromaticContact CZ-CD1 3.58Å; Y81-F134 AromaticContact CZ-CE1 3.56Å; Y81-F134 WeakPolarHBondContact OH-CE1 3.29Å; L130-F134 WeakPolarHBondContact O-CB 3.47Å; L130-F134 PolarHBondContact O-N 2.95Å; I131-F134 PolarHBondContact O-N 3.05Å; F134-S136 PolarHBondContact O-N 2.95Å; F134-V137 PolarHBondContact O-N 3.38Å; F134-D138 WeakPolarHBondContact O-CB 3.46Å; F134-D138 PolarHBondContact O-N 2.87Å; F134-A159 HydrophobicContact CE1-CB 4.34Å; F134-A159 HydrophobicContact CZ-CB 4.37Å; F134-W162 HydrophobicContact CZ-CB 4.22Å |
| 135 | I | 84.6 | Confident | 85.6 | Confident | 4 Ų | 4 | 27.5 Ų | 27.5 | 2% | 0.021 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -58 | -40.9 | 171.5 | -70.8 | 163.7 | 0 | 0 | 0 | 110.4 | Y81 I131 L132 A133 D138 R139 T253 | Y81-I135 HydrophobicContact CD2-CG1 3.67Å; Y81-I135 HydrophobicContact CG-CG1 4.03Å; I131-I135 HydrophobicContact CG2-CD1 3.77Å; I131-I135 HydrophobicContact CG2-CG1 4.33Å; I131-I135 VanDerWaalsContact O-CG1 3.24Å; I131-I135 WeakPolarHBondContact O-CG1 3.44Å; I131-I135 PolarHBondContact O-N 3.24Å; L132-I135 HydrophobicContact CD2-CD1 4.46Å; L132-I135 PolarHBondContact O-N 3.11Å; A133-I135 PolarHBondContact O-N 2.97Å; I135-D138 PolarHBondContact O-N 3.47Å; I135-R139 WeakPolarHBondContact O-CB 3.23Å; I135-R139 VanDerWaalsContact O-CG 3.26Å; I135-R139 WeakPolarHBondContact O-CG 3.28Å; I135-R139 PolarHBondContact O-N 3.34Å; I135-T253 HydrophobicContact CG2-CG2 3.66Å |
| 136 | S | 85.5 | Confident | 84.3 | Confident | 1 Ų | 1 | 31.6 Ų | 31.6 | 1% | 0.007 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -67.5 | -42.9 | -179.1 | -54.8 | 0 | 0 | 0 | 0 | 111.8 | L132 A133 F134 R139 Y140 Y229 | L132-S136 WeakPolarHBondContact O-CB 3.14Å; L132-S136 PolarHBondContact O-N 3.5Å; L132-S136 PolarHBondContact O-OG 2.83Å; A133-S136 WeakPolarHBondContact O-CA 3.21Å; A133-S136 VanDerWaalsContact O-CB 3.29Å; A133-S136 WeakPolarHBondContact O-CB 3.08Å; A133-S136 PolarHBondContact O-N 2.81Å; A133-S136 VanDerWaalsContact O-N 3.07Å; F134-S136 PolarHBondContact O-N 2.95Å; S136-R139 PolarHBondContact O-N 3.44Å; S136-Y140 WeakPolarHBondContact O-CB 3.23Å; S136-Y140 PolarHBondContact O-N 3.4Å; S136-Y229 WeakPolarHBondContact OG-CE2 3.19Å |
| 137 | V | 86.4 | Confident | 82.6 | Confident | 46 Ų | 46 | 34.6 Ų | 34.6 | 28% | 0.279 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -64.7 | -43.8 | 174.1 | 173.8 | 0 | 0 | 0 | 0 | 111.5 | A133 F134 R139 Y140 L141 V224 | A133-V137 WeakPolarHBondContact O-CG2 3.46Å; A133-V137 PolarHBondContact O-N 3.29Å; F134-V137 PolarHBondContact O-N 3.38Å; V137-R139 VanDerWaalsContact C-N 3.28Å; V137-R139 PolarHBondContact O-N 3.19Å; V137-Y140 PolarHBondContact O-N 3.21Å; V137-L141 HydrophobicContact CG1-CD1 3.74Å; V137-L141 HydrophobicContact CG1-CG 4.24Å; V137-L141 WeakPolarHBondContact O-CB 3.24Å; V137-L141 VanDerWaalsContact O-CG 3.31Å; V137-L141 WeakPolarHBondContact O-CG 3.37Å; V137-L141 PolarHBondContact O-N 3.31Å; V137-V224 HydrophobicContact CG2-CG1 3.7Å |
| 138 | D | 81.4 | Confident | 81 | Confident | 19 Ų | 19 | 40.3 Ų | 40.3 | 10% | 0.102 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -55.4 | -46.1 | 175.1 | 176.1 | 71.5 | 0 | 0 | 0 | 111.1 | Y81 F134 I135 A142 | Y81-D138 HydrophobicContact CE2-CB 4.24Å; F134-D138 WeakPolarHBondContact O-CB 3.46Å; F134-D138 PolarHBondContact O-N 2.87Å; I135-D138 PolarHBondContact O-N 3.47Å; D138-A142 VanDerWaalsContact O-CB 3.32Å; D138-A142 WeakPolarHBondContact O-CB 3.39Å; D138-A142 PolarHBondContact O-N 3.31Å |
| 139 | R | 80.4 | Confident | 79.5 | Confident | 71 Ų | 71 | 44.9 Ų | 44.9 | 27% | 0.268 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -65.8 | -46.6 | 177.9 | -73 | -68.8 | -179.1 | -116.5 | 4 | 112.8 | T78 I135 S136 V137 L141 A142 V143 I232 | T78-R139 VanDerWaalsContact OG1-CZ 3.3Å; T78-R139 PolarHBondContact OG1-NH1 2.92Å; T78-R139 PolarHBondContact OG1-NH2 3.47Å; I135-R139 WeakPolarHBondContact O-CB 3.23Å; I135-R139 VanDerWaalsContact O-CG 3.26Å; I135-R139 WeakPolarHBondContact O-CG 3.28Å; I135-R139 PolarHBondContact O-N 3.34Å; S136-R139 PolarHBondContact O-N 3.44Å; V137-R139 VanDerWaalsContact C-N 3.28Å; V137-R139 PolarHBondContact O-N 3.19Å; R139-L141 VanDerWaalsContact C-N 3.33Å; R139-L141 PolarHBondContact O-N 2.9Å; R139-A142 PolarHBondContact O-N 3.44Å; R139-V143 WeakPolarHBondContact O-CG2 3.22Å; R139-V143 PolarHBondContact O-N 3.45Å; R139-I232 HydrophobicContact CB-CD1 4.19Å |
| 140 | Y | 84.1 | Confident | 78.1 | Confident | 52 Ų | 52 | 51.2 Ų | 51.2 | 20% | 0.204 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -53.7 | -53.7 | 176.2 | 157.3 | -104.7 | 0 | 0 | 0 | 110.3 | S136 V137 A142 V143 V144 H145 I231 | S136-Y140 WeakPolarHBondContact O-CB 3.23Å; S136-Y140 PolarHBondContact O-N 3.4Å; V137-Y140 PolarHBondContact O-N 3.21Å; Y140-A142 VanDerWaalsContact C-N 3.31Å; Y140-A142 PolarHBondContact O-N 3.37Å; Y140-V143 PolarHBondContact O-N 3.45Å; Y140-V143 VanDerWaalsContact O-N 3.17Å; Y140-V144 HydrophobicContact CD2-CB 4.23Å; Y140-V144 HydrophobicContact CD2-CG2 3.6Å; Y140-V144 HydrophobicContact CE2-CB 3.89Å; Y140-V144 HydrophobicContact CE2-CG1 4.09Å; Y140-V144 HydrophobicContact CE2-CG2 3.52Å; Y140-V144 WeakPolarHBondContact O-CB 3.07Å; Y140-V144 WeakPolarHBondContact O-CG2 3.15Å; Y140-V144 PolarHBondContact O-N 2.92Å; Y140-H145 PolarHBondContact OH-CE1 2.89Å; Y140-I231 HydrophobicContact CD2-CB 4.21Å; Y140-I231 HydrophobicContact CD2-CD1 4.36Å; Y140-I231 HydrophobicContact CD2-CG2 4.18Å; Y140-I231 HydrophobicContact CE2-CB 4.1Å; Y140-I231 HydrophobicContact CE2-CD1 3.82Å; Y140-I231 HydrophobicContact CE2-CG2 3.76Å |
| 141 | L | 81.8 | Confident | 76.8 | Confident | 43 Ų | 43 | 53.3 Ų | 53.3 | 23% | 0.225 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -68 | -29.7 | -177.9 | -68.5 | 171.3 | 0 | 0 | 0 | 112.6 | V137 R139 H145 R155 | V137-L141 HydrophobicContact CG1-CD1 3.74Å; V137-L141 HydrophobicContact CG1-CG 4.24Å; V137-L141 WeakPolarHBondContact O-CB 3.24Å; V137-L141 VanDerWaalsContact O-CG 3.31Å; V137-L141 WeakPolarHBondContact O-CG 3.37Å; V137-L141 PolarHBondContact O-N 3.31Å; R139-L141 VanDerWaalsContact C-N 3.33Å; R139-L141 PolarHBondContact O-N 2.9Å; L141-H145 CarbonylContact O-C 3.49Å; L141-H145 WeakPolarHBondContact O-CA 3.35Å; L141-H145 WeakPolarHBondContact O-CB 3.26Å; L141-H145 PolarHBondContact O-N 2.85Å; L141-H145 VanDerWaalsContact O-N 3.1Å; L141-R155 VanDerWaalsContact CB-NH1 3.25Å |
| 142 | A | 77.4 | Confident | 75.6 | Confident | 54 Ų | 54 | 55.4 Ų | 55.4 | 45% | 0.446 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -70.3 | -30.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | D138 R139 Y140 | D138-A142 VanDerWaalsContact O-CB 3.32Å; D138-A142 WeakPolarHBondContact O-CB 3.39Å; D138-A142 PolarHBondContact O-N 3.31Å; R139-A142 PolarHBondContact O-N 3.44Å; Y140-A142 VanDerWaalsContact C-N 3.31Å; Y140-A142 PolarHBondContact O-N 3.37Å |
| 143 | V | 76.5 | Confident | 74.6 | Confident | 44 Ų | 44 | 63.9 Ų | 63.9 | 27% | 0.267 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -86.9 | -45.7 | 179.7 | 171.7 | 0 | 0 | 0 | 0 | 111.6 | R139 Y140 L236 | R139-V143 WeakPolarHBondContact O-CG2 3.22Å; R139-V143 PolarHBondContact O-N 3.45Å; Y140-V143 PolarHBondContact O-N 3.45Å; Y140-V143 VanDerWaalsContact O-N 3.17Å; V143-L236 HydrophobicContact CG1-CD1 4.27Å; V143-L236 HydrophobicContact CG1-CD2 3.82Å; V143-L236 HydrophobicContact CG1-CG 3.9Å |
| 144 | V | 78.3 | Confident | 73.4 | Confident | 44 Ų | 44 | 70.1 Ų | 70.1 | 27% | 0.267 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -85.1 | -37.8 | -172.1 | 179.6 | 0 | 0 | 0 | 0 | 112 | Y140 I231 K235 | Y140-V144 HydrophobicContact CD2-CB 4.23Å; Y140-V144 HydrophobicContact CD2-CG2 3.6Å; Y140-V144 HydrophobicContact CE2-CB 3.89Å; Y140-V144 HydrophobicContact CE2-CG1 4.09Å; Y140-V144 HydrophobicContact CE2-CG2 3.52Å; Y140-V144 WeakPolarHBondContact O-CB 3.07Å; Y140-V144 WeakPolarHBondContact O-CG2 3.15Å; Y140-V144 PolarHBondContact O-N 2.92Å; V144-I231 HydrophobicContact CG2-CG2 3.97Å; V144-K235 HydrophobicContact CG2-CG 4.28Å |
| 145 | H | 73.7 | Confident | 72.7 | Confident | 90 Ų | 90 | 71.4 Ų | 71.4 | 42% | 0.417 | 38% | 0.379 | S | S | . | . | trans | -111.7 | 46.4 | -176.8 | -62.7 | 92.2 | 0 | 0 | 0 | 111.3 | Y140 L141 T147 | Y140-H145 PolarHBondContact OH-CE1 2.89Å; L141-H145 CarbonylContact O-C 3.49Å; L141-H145 WeakPolarHBondContact O-CA 3.35Å; L141-H145 WeakPolarHBondContact O-CB 3.26Å; L141-H145 PolarHBondContact O-N 2.85Å; L141-H145 VanDerWaalsContact O-N 3.1Å; H145-T147 VanDerWaalsContact C-N 3.26Å; H145-T147 WeakPolarHBondContact O-CB 3.2Å; H145-T147 WeakPolarHBondContact O-CG2 3.25Å; H145-T147 PolarHBondContact O-N 3.36Å; H145-T147 PolarHBondContact O-OG1 2.94Å | ||
| 146 | A | 64.9 | Low | 72 | Confident | 89 Ų | 89 | 75.8 Ų | 75.8 | 74% | 0.736 | 40% | 0.398 | S | S | * | . | trans | -58 | 89.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 147 | T | 57.3 | Low | 71.2 | Confident | 70 Ų | 70 | 81 Ų | 81 | 43% | 0.429 | 43% | 0.425 | S | S | . | . | trans | -113.5 | 162.8 | -170.6 | 41.6 | 0 | 0 | 0 | 0 | 110.3 | H145 T152 | H145-T147 VanDerWaalsContact C-N 3.26Å; H145-T147 WeakPolarHBondContact O-CB 3.2Å; H145-T147 WeakPolarHBondContact O-CG2 3.25Å; H145-T147 PolarHBondContact O-N 3.36Å; H145-T147 PolarHBondContact O-OG1 2.94Å; T147-T152 PolarHBondContact O-OG1 3.45Å | ||
| 148 | N | 60.5 | Low | 70.6 | Confident | 121 Ų | 121 | 83.7 Ų | 83.7 | 65% | 0.647 | 44% | 0.437 | S | S | * | . | trans | -43.2 | 145.8 | -174.2 | -159.5 | -10.7 | 0 | 0 | 0 | 113.9 | Q150 T151 T152 | N148-Q150 PolarHBondContact O-N 2.86Å; N148-Q150 VanDerWaalsContact O-N 3.1Å; N148-T151 PolarHBondContact O-N 3.46Å; N148-T151 VanDerWaalsContact O-N 3.12Å; N148-T152 PolarHBondContact O-N 3.48Å; N148-T152 PolarHBondContact O-OG1 3.34Å | ||
| 149 | S | 59.6 | Low | 70.2 | Confident | 96 Ų | 96 | 83.4 Ų | 83.4 | 67% | 0.671 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -58.4 | -32.4 | -167.8 | 80.3 | 0 | 0 | 0 | 0 | 113.4 | R153 | S149-R153 WeakPolarHBondContact O-CB 3.36Å; S149-R153 PolarHBondContact O-N 2.95Å |
| 150 | Q | 59.6 | Low | 70 | Confident | 134 Ų | 134 | 83 Ų | 83 | 63% | 0.626 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -73.6 | -40.4 | -179.4 | -160.7 | 170.6 | 0.9 | 0 | 0 | 112.4 | N148 R153 K154 | N148-Q150 PolarHBondContact O-N 2.86Å; N148-Q150 VanDerWaalsContact O-N 3.1Å; Q150-R153 PolarHBondContact O-N 3.36Å; Q150-K154 PolarHBondContact O-N 3.26Å |
| 151 | T | 64.5 | Low | 69.9 | Low | 81 Ų | 81 | 90.2 Ų | 90.2 | 50% | 0.497 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -66 | -40.8 | 172.4 | -54.3 | 0 | 0 | 0 | 0 | 110.9 | N148 R153 K154 R155 | N148-T151 PolarHBondContact O-N 3.46Å; N148-T151 VanDerWaalsContact O-N 3.12Å; T151-R153 VanDerWaalsContact C-N 3.3Å; T151-R153 PolarHBondContact O-N 2.89Å; T151-K154 PolarHBondContact O-N 3.14Å; T151-R155 VanDerWaalsContact O-CB 3.3Å; T151-R155 WeakPolarHBondContact O-CB 3.43Å; T151-R155 PolarHBondContact O-N 3.32Å |
| 152 | T | 66.3 | Low | 70.1 | Confident | 44 Ų | 44 | 94.9 Ų | 94.9 | 27% | 0.27 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.2 | -38 | 174 | -66.4 | 0 | 0 | 0 | 0 | 111.8 | T147 N148 K156 | T147-T152 PolarHBondContact O-OG1 3.45Å; N148-T152 PolarHBondContact O-N 3.48Å; N148-T152 PolarHBondContact O-OG1 3.34Å; T152-K156 HydrophobicContact CG2-CD 4.37Å; T152-K156 WeakPolarHBondContact O-CB 3.32Å; T152-K156 VanDerWaalsContact O-CG 3.26Å; T152-K156 WeakPolarHBondContact O-CG 3.34Å; T152-K156 PolarHBondContact O-N 3.42Å; T152-K156 VanDerWaalsContact O-N 3.08Å |
| 153 | R | 65.2 | Low | 70.5 | Confident | 186 Ų | 186 | 92.5 Ų | 92.5 | 70% | 0.702 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -69.5 | -45.2 | 176.8 | -169.4 | -180 | -168.8 | 165.8 | 1.8 | 112.5 | S149 Q150 T151 K156 L157 | S149-R153 WeakPolarHBondContact O-CB 3.36Å; S149-R153 PolarHBondContact O-N 2.95Å; Q150-R153 PolarHBondContact O-N 3.36Å; T151-R153 VanDerWaalsContact C-N 3.3Å; T151-R153 PolarHBondContact O-N 2.89Å; R153-K156 WeakPolarHBondContact O-CB 3.38Å; R153-K156 PolarHBondContact O-N 3.5Å; R153-L157 PolarHBondContact O-N 3.28Å; R153-L157 VanDerWaalsContact O-N 3.12Å |
| 154 | K | 66.6 | Low | 71.1 | Confident | 138 Ų | 138 | 96.5 Ų | 96.5 | 60% | 0.6 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -60.7 | -45.7 | 175.7 | -73.9 | -175.8 | 177.7 | -176.9 | 0 | 111.4 | Q150 T151 K156 L157 L158 | Q150-K154 PolarHBondContact O-N 3.26Å; T151-K154 PolarHBondContact O-N 3.14Å; K154-K156 VanDerWaalsContact C-N 3.3Å; K154-K156 PolarHBondContact O-N 3Å; K154-L157 PolarHBondContact O-N 2.91Å; K154-L158 WeakPolarHBondContact O-CG 3.23Å; K154-L158 PolarHBondContact O-N 3.23Å |
| 155 | R | 71.3 | Confident | 71.7 | Confident | 72 Ų | 72 | 98 Ų | 98 | 27% | 0.272 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.5 | -37.5 | 177.9 | -177.7 | 166.8 | 158.5 | -114.7 | -33.9 | 113 | L141 T151 L158 A159 | L141-R155 VanDerWaalsContact CB-NH1 3.25Å; T151-R155 VanDerWaalsContact O-CB 3.3Å; T151-R155 WeakPolarHBondContact O-CB 3.43Å; T151-R155 PolarHBondContact O-N 3.32Å; R155-L158 PolarHBondContact O-N 3.5Å; R155-A159 WeakPolarHBondContact O-CB 3.33Å; R155-A159 PolarHBondContact O-N 3.36Å |
| 156 | K | 70.9 | Confident | 72.4 | Confident | 97 Ų | 97 | 95.6 Ų | 95.6 | 42% | 0.422 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.2 | -46.3 | 173.4 | -87.1 | 179.7 | -177.9 | 179.1 | 0 | 112.8 | M77 T152 R153 K154 L158 A159 E160 | M77-K156 HydrophobicContact CE-CB 3.46Å; M77-K156 VanDerWaalsContact CE-CB 3.46Å; M77-K156 HydrophobicContact CE-CD 4.14Å; M77-K156 HydrophobicContact CE-CG 3.8Å; M77-K156 HydrophobicContact CG-CD 4.27Å; M77-K156 HydrophobicContact CG-CG 3.91Å; M77-K156 HydrophobicContact SD-CB 4.44Å; M77-K156 HydrophobicContact SD-CG 4.43Å; T152-K156 HydrophobicContact CG2-CD 4.37Å; T152-K156 WeakPolarHBondContact O-CB 3.32Å; T152-K156 VanDerWaalsContact O-CG 3.26Å; T152-K156 WeakPolarHBondContact O-CG 3.34Å; T152-K156 PolarHBondContact O-N 3.42Å; T152-K156 VanDerWaalsContact O-N 3.08Å; R153-K156 WeakPolarHBondContact O-CB 3.38Å; R153-K156 PolarHBondContact O-N 3.5Å; K154-K156 VanDerWaalsContact C-N 3.3Å; K154-K156 PolarHBondContact O-N 3Å; K156-L158 VanDerWaalsContact C-N 3.34Å; K156-A159 PolarHBondContact O-N 3.04Å; K156-E160 PolarHBondContact O-N 2.97Å |
| 157 | L | 69.6 | Low | 73.7 | Confident | 110 Ų | 110 | 91.5 Ų | 91.5 | 58% | 0.576 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -63.6 | -40.5 | 176.5 | -72 | 167.1 | 0 | 0 | 0 | 112 | R153 K154 E160 | R153-L157 PolarHBondContact O-N 3.28Å; R153-L157 VanDerWaalsContact O-N 3.12Å; K154-L157 PolarHBondContact O-N 2.91Å; L157-E160 PolarHBondContact O-N 3.47Å |
| 158 | L | 73.6 | Confident | 75.5 | Confident | 102 Ų | 102 | 90.8 Ų | 90.8 | 53% | 0.534 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -64.2 | -44.8 | 175.3 | -68.8 | 172.3 | 0 | 0 | 0 | 111 | K154 R155 K156 E160 R161 W162 | K154-L158 WeakPolarHBondContact O-CG 3.23Å; K154-L158 PolarHBondContact O-N 3.23Å; R155-L158 PolarHBondContact O-N 3.5Å; K156-L158 VanDerWaalsContact C-N 3.34Å; L158-E160 PolarHBondContact O-N 3.3Å; L158-R161 PolarHBondContact O-N 2.84Å; L158-W162 VanDerWaalsContact C-CD1 3.49Å; L158-W162 PolarHBondContact O-N 2.97Å |
| 159 | A | 73.3 | Confident | 77.1 | Confident | 14 Ų | 14 | 89.8 Ų | 89.8 | 12% | 0.116 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -58.4 | -34.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | F134 R155 K156 R161 W162 I163 | F134-A159 HydrophobicContact CE1-CB 4.34Å; F134-A159 HydrophobicContact CZ-CB 4.37Å; R155-A159 WeakPolarHBondContact O-CB 3.33Å; R155-A159 PolarHBondContact O-N 3.36Å; K156-A159 PolarHBondContact O-N 3.04Å; A159-R161 VanDerWaalsContact C-N 3.28Å; A159-R161 PolarHBondContact O-N 3.19Å; A159-W162 PolarHBondContact O-N 3.17Å; A159-I163 PolarHBondContact O-N 3.16Å; A159-I163 VanDerWaalsContact O-N 3.16Å |
| 160 | E | 75.3 | Confident | 78.7 | Confident | 63 Ų | 63 | 87.3 Ų | 87.3 | 29% | 0.294 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -64.5 | -29.1 | 174.3 | -69.2 | -178.4 | -155.2 | 0 | 0 | 113.6 | M77 K80 K156 L157 L158 I163 Y164 | M77-E160 HydrophobicContact CE-CG 3.91Å; M77-E160 WeakPolarHBondContact CE-OE1 2.85Å; M77-E160 HydrophobicContact SD-CG 3.78Å; K80-E160 HydrophobicContact CD-CG 4.26Å; K80-E160 IonicContact NZ-OE1 2.6Å; K80-E160 PolarHBondContact NZ-OE1 2.86Å; K80-E160 IonicContact NZ-OE2 2.64Å; K80-E160 PolarHBondContact NZ-OE2 3.16Å; K156-E160 PolarHBondContact O-N 2.97Å; L157-E160 PolarHBondContact O-N 3.47Å; L158-E160 PolarHBondContact O-N 3.3Å; E160-I163 WeakPolarHBondContact O-CG2 3.06Å; E160-Y164 WeakPolarHBondContact O-CD2 3.19Å; E160-Y164 VanDerWaalsContact O-CE2 3.3Å; E160-Y164 WeakPolarHBondContact O-CE2 3.43Å |
| 161 | R | 82.6 | Confident | 80.4 | Confident | 202 Ų | 202 | 81 Ų | 81 | 76% | 0.762 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -87.5 | -36.1 | 175.6 | -163.4 | 165.7 | -176 | 155.7 | -0.7 | 111.4 | L158 A159 I163 Y164 | L158-R161 PolarHBondContact O-N 2.84Å; A159-R161 VanDerWaalsContact C-N 3.28Å; A159-R161 PolarHBondContact O-N 3.19Å; R161-I163 VanDerWaalsContact C-N 3.31Å; R161-I163 PolarHBondContact O-N 3.35Å; R161-Y164 PolarHBondContact O-N 3.06Å |
| 162 | W | 84.9 | Confident | 81.9 | Confident | 142 Ų | 142 | 79.4 Ų | 79.4 | 54% | 0.538 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -64.4 | -30.9 | 179.9 | -80.3 | 112.5 | 0 | 0 | 0 | 113.3 | F134 L158 A159 Y164 V165 A166 | F134-W162 HydrophobicContact CZ-CB 4.22Å; L158-W162 VanDerWaalsContact C-CD1 3.49Å; L158-W162 PolarHBondContact O-N 2.97Å; A159-W162 PolarHBondContact O-N 3.17Å; W162-Y164 PolarHBondContact O-N 3.45Å; W162-V165 HydrophobicContact CE3-CB 4.46Å; W162-V165 HydrophobicContact CZ3-CG1 4.46Å; W162-V165 PolarHBondContact O-N 3.47Å; W162-V165 VanDerWaalsContact O-N 3.13Å; W162-A166 WeakPolarHBondContact O-CB 3.46Å; W162-A166 PolarHBondContact O-N 3.26Å |
| 163 | I | 86.5 | Confident | 83.3 | Confident | 3 Ų | 3 | 81.5 Ų | 81.5 | 2% | 0.015 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -57.4 | -37.7 | 177.7 | -171.1 | 162.7 | 0 | 0 | 0 | 112.5 | Y81 H84 I131 A159 E160 R161 V167 W168 | Y81-I163 HydrophobicContact CD1-CD1 3.51Å; Y81-I163 HydrophobicContact CE1-CD1 3.88Å; H84-I163 HydrophobicContact CB-CD1 4.34Å; I131-I163 HydrophobicContact CG1-CD1 4.42Å; A159-I163 PolarHBondContact O-N 3.16Å; A159-I163 VanDerWaalsContact O-N 3.16Å; E160-I163 WeakPolarHBondContact O-CG2 3.06Å; R161-I163 VanDerWaalsContact C-N 3.31Å; R161-I163 PolarHBondContact O-N 3.35Å; I163-V167 HydrophobicContact CG1-CB 4.16Å; I163-V167 HydrophobicContact CG1-CG2 3.93Å; I163-V167 WeakPolarHBondContact O-CA 3.21Å; I163-V167 WeakPolarHBondContact O-CB 3.39Å; I163-V167 PolarHBondContact O-N 3.43Å; I163-W168 PolarHBondContact O-N 2.78Å |
| 164 | Y | 88.9 | Confident | 84.7 | Confident | 128 Ų | 128 | 74.2 Ų | 74.2 | 50% | 0.502 | 36% | 0.36 | S | S | . | . | I | π-helix | trans | -67.9 | -39.3 | 178.8 | -62.2 | -78.1 | 0 | 0 | 0 | 111.9 | H84 E160 R161 W162 W168 L169 | H84-Y164 AromaticContact CE1-CE1 3.84Å; H84-Y164 AromaticContact CE1-CZ 3.8Å; E160-Y164 WeakPolarHBondContact O-CD2 3.19Å; E160-Y164 VanDerWaalsContact O-CE2 3.3Å; E160-Y164 WeakPolarHBondContact O-CE2 3.43Å; R161-Y164 PolarHBondContact O-N 3.06Å; W162-Y164 PolarHBondContact O-N 3.45Å; Y164-W168 PolarHBondContact O-N 3.42Å; Y164-L169 WeakPolarHBondContact O-CB 3.35Å; Y164-L169 PolarHBondContact O-N 2.96Å |
| 165 | V | 90.2 | Very high | 86 | Confident | 75 Ų | 75 | 68 Ų | 68 | 46% | 0.455 | 33% | 0.334 | S | S | . | . | I | π-helix | trans | -82.3 | -33.1 | -177.8 | -178.6 | 0 | 0 | 0 | 0 | 112.3 | W162 L169 P170 | W162-V165 HydrophobicContact CE3-CB 4.46Å; W162-V165 HydrophobicContact CZ3-CG1 4.46Å; W162-V165 PolarHBondContact O-N 3.47Å; W162-V165 VanDerWaalsContact O-N 3.13Å; V165-L169 HydrophobicContact CG1-CD2 4.38Å; V165-P170 WeakPolarHBondContact O-CD 3.45Å |
| 166 | A | 88.6 | Confident | 87.2 | Confident | 41 Ų | 41 | 68.4 Ų | 68.4 | 34% | 0.339 | 34% | 0.344 | S | S | . | . | I | π-helix | trans | -95.7 | -17.7 | -174.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | W162 | W162-A166 WeakPolarHBondContact O-CB 3.46Å; W162-A166 PolarHBondContact O-N 3.26Å |
| 167 | V | 92.3 | Very high | 88.1 | Confident | 2 Ų | 2 | 65.1 Ų | 65.1 | 1% | 0.012 | 33% | 0.333 | C | S | . | . | I | π-helix | trans | -119.1 | -63.4 | -179.8 | 178.8 | 0 | 0 | 0 | 0 | 110.2 | L130 I131 I163 A171 | L130-V167 HydrophobicContact CB-CB 4.36Å; L130-V167 HydrophobicContact CB-CG1 3.92Å; L130-V167 HydrophobicContact CB-CG2 4.12Å; I131-V167 HydrophobicContact CD1-CG1 4.31Å; I131-V167 HydrophobicContact CG1-CG1 3.73Å; I131-V167 HydrophobicContact CG1-CG2 4.49Å; I163-V167 HydrophobicContact CG1-CB 4.16Å; I163-V167 HydrophobicContact CG1-CG2 3.93Å; I163-V167 WeakPolarHBondContact O-CA 3.21Å; I163-V167 WeakPolarHBondContact O-CB 3.39Å; I163-V167 PolarHBondContact O-N 3.43Å; V167-A171 VanDerWaalsContact O-CB 3.27Å; V167-A171 WeakPolarHBondContact O-CB 3.35Å; V167-A171 PolarHBondContact O-N 2.88Å |
| 168 | W | 94.7 | Very high | 89.2 | Confident | 55 Ų | 55 | 60.3 Ų | 60.3 | 21% | 0.208 | 31% | 0.308 | C | S | . | . | I | π-helix | trans | -70.3 | -42 | -169.5 | -71.7 | 97.1 | 0 | 0 | 0 | 113 | H84 A88 I123 I163 Y164 A171 A172 | H84-W168 HydrophobicContact CB-CZ2 4.3Å; H84-W168 AromaticContact CE1-NE1 3.91Å; H84-W168 AromaticContact CG-NE1 3.97Å; H84-W168 AromaticContact ND1-CE2 3.82Å; H84-W168 AromaticContact ND1-CZ2 3.88Å; H84-W168 AromaticContact ND1-NE1 3.26Å; H84-W168 PolarHBondContact ND1-NE1 3.31Å; A88-W168 HydrophobicContact CB-CH2 4.14Å; I123-W168 HydrophobicContact CG2-CE3 4.32Å; I123-W168 HydrophobicContact CG2-CZ3 3.76Å; I163-W168 PolarHBondContact O-N 2.78Å; Y164-W168 PolarHBondContact O-N 3.42Å; W168-A171 PolarHBondContact O-N 3.04Å; W168-A172 WeakPolarHBondContact O-CB 3.48Å; W168-A172 PolarHBondContact O-N 3.41Å |
| 169 | L | 94.7 | Very high | 90.2 | Very high | 100 Ų | 100 | 60.1 Ų | 60.1 | 52% | 0.524 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -62.9 | -51.3 | 177.8 | 175.6 | 74.8 | 0 | 0 | 0 | 111.5 | Y164 V165 A171 A172 V173 | Y164-L169 WeakPolarHBondContact O-CB 3.35Å; Y164-L169 PolarHBondContact O-N 2.96Å; V165-L169 HydrophobicContact CG1-CD2 4.38Å; L169-A171 VanDerWaalsContact C-N 3.35Å; L169-A171 PolarHBondContact O-N 3.09Å; L169-A172 PolarHBondContact O-N 2.98Å; L169-V173 HydrophobicContact CD1-CG2 4.41Å; L169-V173 WeakPolarHBondContact O-CG2 3.23Å; L169-V173 PolarHBondContact O-N 2.95Å |
| 170 | P | 93.9 | Very high | 91.2 | Very high | 45 Ų | 45 | 64.1 Ų | 64.1 | 29% | 0.292 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -57.8 | -44.1 | 173.5 | -27.9 | 34.2 | 0 | 0 | 0 | 113.1 | L130 V165 A172 V173 L174 | L130-P170 HydrophobicContact CD1-CB 4.5Å; V165-P170 WeakPolarHBondContact O-CD 3.45Å; P170-A172 VanDerWaalsContact C-N 3.28Å; P170-A172 PolarHBondContact O-N 3.21Å; P170-V173 PolarHBondContact O-N 2.99Å; P170-L174 WeakPolarHBondContact O-CB 3.27Å; P170-L174 WeakPolarHBondContact O-CD1 3.43Å; P170-L174 WeakPolarHBondContact O-CG 3.37Å; P170-L174 PolarHBondContact O-N 3.07Å |
| 171 | A | 94.9 | Very high | 92 | Very high | 0 Ų | 0 | 62.7 Ų | 62.7 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.1 | -39.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | V167 W168 L169 T175 | V167-A171 VanDerWaalsContact O-CB 3.27Å; V167-A171 WeakPolarHBondContact O-CB 3.35Å; V167-A171 PolarHBondContact O-N 2.88Å; W168-A171 PolarHBondContact O-N 3.04Å; L169-A171 VanDerWaalsContact C-N 3.35Å; L169-A171 PolarHBondContact O-N 3.09Å; A171-T175 WeakPolarHBondContact O-CG2 3.23Å |
| 172 | A | 95.3 | Very high | 92.5 | Very high | 48 Ų | 48 | 53.3 Ų | 53.3 | 40% | 0.397 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -71.3 | -38.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | W168 L169 P170 L174 T175 | W168-A172 WeakPolarHBondContact O-CB 3.48Å; W168-A172 PolarHBondContact O-N 3.41Å; L169-A172 PolarHBondContact O-N 2.98Å; P170-A172 VanDerWaalsContact C-N 3.28Å; P170-A172 PolarHBondContact O-N 3.21Å; A172-L174 VanDerWaalsContact C-N 3.3Å; A172-L174 PolarHBondContact O-N 2.71Å; A172-T175 PolarHBondContact O-N 2.7Å; A172-T175 PolarHBondContact O-OG1 2.59Å |
| 173 | V | 96.3 | Very high | 92.9 | Very high | 89 Ų | 89 | 49.3 Ų | 49.3 | 54% | 0.539 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -64.8 | -38.4 | 175.7 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | L169 P170 T175 V176 | L169-V173 HydrophobicContact CD1-CG2 4.41Å; L169-V173 WeakPolarHBondContact O-CG2 3.23Å; L169-V173 PolarHBondContact O-N 2.95Å; P170-V173 PolarHBondContact O-N 2.99Å; V173-T175 PolarHBondContact O-N 3.17Å; V173-V176 WeakPolarHBondContact O-CB 3.48Å; V173-V176 VanDerWaalsContact O-CG2 3.27Å; V173-V176 WeakPolarHBondContact O-CG2 3.3Å; V173-V176 PolarHBondContact O-N 2.84Å |
| 174 | L | 94.1 | Very high | 93.2 | Very high | 33 Ų | 33 | 50.5 Ų | 50.5 | 17% | 0.173 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.8 | -7.2 | -179.6 | -69.2 | 167 | 0 | 0 | 0 | 114 | Y126 P170 A172 P177 V216 | Y126-L174 HydrophobicContact CD1-CD1 4.18Å; Y126-L174 HydrophobicContact CD2-CB 3.65Å; Y126-L174 HydrophobicContact CD2-CD1 3.67Å; Y126-L174 HydrophobicContact CD2-CG 4.31Å; Y126-L174 HydrophobicContact CE1-CD1 4.37Å; Y126-L174 HydrophobicContact CE2-CB 3.55Å; Y126-L174 HydrophobicContact CE2-CD1 3.86Å; Y126-L174 HydrophobicContact CE2-CG 4.24Å; Y126-L174 HydrophobicContact CG-CD1 3.85Å; P170-L174 WeakPolarHBondContact O-CB 3.27Å; P170-L174 WeakPolarHBondContact O-CD1 3.43Å; P170-L174 WeakPolarHBondContact O-CG 3.37Å; P170-L174 PolarHBondContact O-N 3.07Å; A172-L174 VanDerWaalsContact C-N 3.3Å; A172-L174 PolarHBondContact O-N 2.71Å; L174-P177 WeakPolarHBondContact O-CD 3.29Å; L174-V216 HydrophobicContact CD1-CG1 3.76Å |
| 175 | T | 94.8 | Very high | 93.2 | Very high | 7 Ų | 7 | 47 Ų | 47 | 4% | 0.043 | 28% | 0.278 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.2 | -7.8 | 175 | 70.5 | 0 | 0 | 0 | 0 | 113.4 | V119 T122 I123 A171 A172 V173 P177 D178 I179 | V119-T175 HydrophobicContact CG1-CG2 4.16Å; T122-T175 HydrophobicContact CG2-CG2 3.75Å; I123-T175 HydrophobicContact CD1-CG2 4.33Å; I123-T175 HydrophobicContact CG1-CG2 3.52Å; A171-T175 WeakPolarHBondContact O-CG2 3.23Å; A172-T175 PolarHBondContact O-N 2.7Å; A172-T175 PolarHBondContact O-OG1 2.59Å; V173-T175 PolarHBondContact O-N 3.17Å; T175-P177 VanDerWaalsContact C-CD 3.43Å; T175-P177 VanDerWaalsContact C-N 3.28Å; T175-D178 WeakPolarHBondContact O-CA 3.39Å; T175-D178 WeakPolarHBondContact O-CB 3.44Å; T175-D178 PolarHBondContact O-N 3.33Å; T175-I179 PolarHBondContact O-N 2.93Å |
| 176 | V | 95.1 | Very high | 93.1 | Very high | 80 Ų | 80 | 48.7 Ų | 48.7 | 49% | 0.485 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -51.5 | -42.9 | 177.5 | 172.1 | 0 | 0 | 0 | 0 | 112.2 | V173 D178 I179 V180 | V173-V176 WeakPolarHBondContact O-CB 3.48Å; V173-V176 VanDerWaalsContact O-CG2 3.27Å; V173-V176 WeakPolarHBondContact O-CG2 3.3Å; V173-V176 PolarHBondContact O-N 2.84Å; V176-D178 VanDerWaalsContact C-N 3.33Å; V176-D178 PolarHBondContact O-N 3.48Å; V176-I179 WeakPolarHBondContact O-CB 3.3Å; V176-I179 PolarHBondContact O-N 3.33Å; V176-V180 HydrophobicContact CG1-CG2 4.5Å; V176-V180 WeakPolarHBondContact O-CG2 3.09Å; V176-V180 PolarHBondContact O-N 3.22Å; V176-V180 VanDerWaalsContact O-N 3.13Å |
| 177 | P | 91.7 | Very high | 92.5 | Very high | 29 Ų | 29 | 47.9 Ų | 47.9 | 19% | 0.188 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -59.2 | -40.3 | 173.8 | -25.6 | 36.6 | 0 | 0 | 0 | 113.7 | L174 T175 I179 V180 F181 F209 | L174-P177 WeakPolarHBondContact O-CD 3.29Å; T175-P177 VanDerWaalsContact C-CD 3.43Å; T175-P177 VanDerWaalsContact C-N 3.28Å; P177-I179 VanDerWaalsContact C-N 3.31Å; P177-I179 PolarHBondContact O-N 3.12Å; P177-V180 PolarHBondContact O-N 3.28Å; P177-F181 HydrophobicContact CB-CD2 4.16Å; P177-F181 HydrophobicContact CB-CE2 4.47Å; P177-F181 WeakPolarHBondContact O-CB 3.2Å; P177-F181 WeakPolarHBondContact O-CD2 3.19Å; P177-F181 PolarHBondContact O-N 2.87Å; P177-F209 HydrophobicContact CB-CD1 4.16Å; P177-F209 HydrophobicContact CB-CE1 3.52Å; P177-F209 HydrophobicContact CB-CE2 4.34Å; P177-F209 HydrophobicContact CB-CZ 3.62Å; P177-F209 HydrophobicContact CG-CD1 4.21Å; P177-F209 HydrophobicContact CG-CE1 3.46Å; P177-F209 VanDerWaalsContact CG-CE1 3.46Å; P177-F209 HydrophobicContact CG-CZ 3.96Å |
| 178 | D | 90.8 | Very high | 92.1 | Very high | 8 Ų | 8 | 51.1 Ų | 51.1 | 4% | 0.043 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -63.2 | -39.8 | 176.2 | -65.5 | -73.4 | 0 | 0 | 0 | 111.5 | H118 V119 T122 T175 V176 V180 A182 R195 | H118-D178 HydrophobicContact CB-CB 4.14Å; V119-D178 HydrophobicContact CG2-CB 4.12Å; T122-D178 VanDerWaalsContact CB-OD2 3.23Å; T122-D178 WeakPolarHBondContact CB-OD2 3.48Å; T122-D178 WeakPolarHBondContact CG2-OD2 3.46Å; T122-D178 VanDerWaalsContact OG1-CG 3.29Å; T122-D178 PolarHBondContact OG1-OD2 3.12Å; T175-D178 WeakPolarHBondContact O-CA 3.39Å; T175-D178 WeakPolarHBondContact O-CB 3.44Å; T175-D178 PolarHBondContact O-N 3.33Å; V176-D178 VanDerWaalsContact C-N 3.33Å; V176-D178 PolarHBondContact O-N 3.48Å; D178-V180 VanDerWaalsContact C-N 3.25Å; D178-V180 PolarHBondContact O-N 3.06Å; D178-A182 WeakPolarHBondContact O-CB 3.05Å; D178-A182 PolarHBondContact O-N 3.34Å; D178-R195 IonicContact OD1-CZ 3.48Å; D178-R195 IonicContact OD1-NE 2.63Å; D178-R195 PolarHBondContact OD1-NE 3.37Å; D178-R195 IonicContact OD1-NH2 2.75Å; D178-R195 PolarHBondContact OD1-NH2 2.66Å |
| 179 | I | 94.6 | Very high | 91.5 | Very high | 98 Ų | 98 | 53.8 Ų | 53.8 | 50% | 0.503 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -61.5 | -38 | 177.6 | -63.4 | 170.8 | 0 | 0 | 0 | 111.3 | V119 T175 V176 P177 | V119-I179 HydrophobicContact CG2-CD1 4.43Å; V119-I179 HydrophobicContact CG2-CG1 3.58Å; T175-I179 PolarHBondContact O-N 2.93Å; V176-I179 WeakPolarHBondContact O-CB 3.3Å; V176-I179 PolarHBondContact O-N 3.33Å; P177-I179 VanDerWaalsContact C-N 3.31Å; P177-I179 PolarHBondContact O-N 3.12Å |
| 180 | V | 94.2 | Very high | 91.1 | Very high | 99 Ų | 99 | 50.3 Ų | 50.3 | 60% | 0.6 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -82.4 | -41.9 | -176.1 | 175.8 | 0 | 0 | 0 | 0 | 111.9 | V176 P177 D178 | V176-V180 HydrophobicContact CG1-CG2 4.5Å; V176-V180 WeakPolarHBondContact O-CG2 3.09Å; V176-V180 PolarHBondContact O-N 3.22Å; V176-V180 VanDerWaalsContact O-N 3.13Å; P177-V180 PolarHBondContact O-N 3.28Å; D178-V180 VanDerWaalsContact C-N 3.25Å; D178-V180 PolarHBondContact O-N 3.06Å |
| 181 | F | 92.4 | Very high | 90.9 | Very high | 33 Ų | 33 | 50 Ų | 50 | 15% | 0.145 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -103.5 | -20.4 | -167.8 | -61.5 | -61.1 | 0 | 0 | 0 | 114.2 | P177 T183 R195 I196 Y197 W205 F209 | P177-F181 HydrophobicContact CB-CD2 4.16Å; P177-F181 HydrophobicContact CB-CE2 4.47Å; P177-F181 WeakPolarHBondContact O-CB 3.2Å; P177-F181 WeakPolarHBondContact O-CD2 3.19Å; P177-F181 PolarHBondContact O-N 2.87Å; F181-T183 PolarHBondContact O-N 2.92Å; F181-R195 HydrophobicContact CB-CB 4.42Å; F181-R195 CarbonylContact O-C 3.39Å; F181-R195 WeakPolarHBondContact O-CA 3.34Å; F181-I196 WeakPolarHBondContact CD1-O 3.26Å; F181-I196 PolarHBondContact O-N 3.48Å; F181-Y197 HydrophobicContact CB-CD1 4.18Å; F181-Y197 HydrophobicContact CB-CE1 4.01Å; F181-Y197 AromaticContact CD1-CD1 3.97Å; F181-Y197 HydrophobicContact CD1-CD1 3.97Å; F181-Y197 AromaticContact CD2-CD1 3.99Å; F181-Y197 HydrophobicContact CD2-CD1 3.99Å; F181-Y197 AromaticContact CD2-CE1 3.83Å; F181-Y197 HydrophobicContact CD2-CE1 3.83Å; F181-Y197 HydrophobicContact CE1-CD1 4.34Å; F181-Y197 HydrophobicContact CE2-CD1 4.37Å; F181-Y197 HydrophobicContact CE2-CE1 4.46Å; F181-Y197 AromaticContact CG-CD1 3.78Å; F181-Y197 HydrophobicContact CG-CD1 3.78Å; F181-Y197 AromaticContact CG-CE1 3.88Å; F181-Y197 HydrophobicContact CG-CE1 3.88Å; F181-W205 HydrophobicContact CE2-CE3 4.5Å; F181-W205 HydrophobicContact CZ-CE3 4.43Å; F181-W205 HydrophobicContact CZ-CZ3 4.42Å; F181-F209 AromaticContact CD2-CE2 3.95Å; F181-F209 HydrophobicContact CD2-CE2 3.95Å; F181-F209 HydrophobicContact CD2-CZ 4.18Å; F181-F209 AromaticContact CE2-CE2 3.75Å; F181-F209 HydrophobicContact CE2-CE2 3.75Å; F181-F209 AromaticContact CE2-CZ 3.74Å; F181-F209 HydrophobicContact CE2-CZ 3.74Å |
| 182 | A | 93.1 | Very high | 90.6 | Very high | 5 Ų | 5 | 50.1 Ų | 50.1 | 4% | 0.041 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.8 | 122.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | T115 H118 D178 Q194 R195 | T115-A182 PolarHBondContact OG1-O 3.45Å; H118-A182 HydrophobicContact CB-CB 3.85Å; D178-A182 WeakPolarHBondContact O-CB 3.05Å; D178-A182 PolarHBondContact O-N 3.34Å; A182-Q194 WeakPolarHBondContact CA-O 3.3Å; A182-R195 HydrophobicContact CB-CG 4.38Å |
| 183 | T | 93.6 | Very high | 90.4 | Very high | 58 Ų | 58 | 47.8 Ų | 47.8 | 36% | 0.356 | 30% | 0.3 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.5 | 160.3 | 178.7 | -169.7 | 0 | 0 | 0 | 0 | 111.8 | C114 F181 Q194 I196 | C114-T183 PolarHBondContact SG-O 3.34Å; F181-T183 PolarHBondContact O-N 2.92Å; T183-Q194 PolarHBondContact N-O 2.88Å; T183-Q194 PolarHBondContact O-N 3.36Å; T183-Q194 VanDerWaalsContact O-N 3.09Å; T183-I196 HydrophobicContact CG2-CD1 3.46Å; T183-I196 VanDerWaalsContact CG2-CD1 3.46Å; T183-I196 HydrophobicContact CG2-CG1 3.97Å |
| 184 | A | 93.3 | Very high | 90.1 | Very high | 27 Ų | 27 | 43.9 Ų | 43.9 | 22% | 0.223 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.6 | 123.8 | 169.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | C114 T191 I192 | C114-A184 HydrophobicContact CB-CB 4.35Å; A184-T191 HydrophobicContact CB-CG2 4.1Å; A184-I192 WeakPolarHBondContact CA-O 3.41Å |
| 185 | L | 89.4 | Confident | 89.9 | Confident | 54 Ų | 54 | 43.7 Ų | 43.7 | 28% | 0.283 | 27% | 0.273 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.1 | 131.7 | 179.4 | -175.2 | 69.6 | 0 | 0 | 0 | 109.8 | T191 I192 I196 | L185-T191 CarbonylContact O-C 3.55Å; L185-T191 VanDerWaalsContact O-CA 3.26Å; L185-T191 WeakPolarHBondContact O-CA 3.13Å; L185-T191 WeakPolarHBondContact O-CG2 3.37Å; L185-I192 HydrophobicContact CB-CG1 4.37Å; L185-I192 PolarHBondContact N-O 3.42Å; L185-I192 PolarHBondContact O-N 3.16Å; L185-I196 HydrophobicContact CB-CD1 4.07Å; L185-I196 HydrophobicContact CD1-CD1 4.14Å; L185-I196 HydrophobicContact CD2-CD1 4.01Å; L185-I196 HydrophobicContact CG-CD1 4.3Å |
| 186 | D | 87.3 | Confident | 89.5 | Confident | 112 Ų | 112 | 46.4 Ų | 46.4 | 60% | 0.599 | 29% | 0.287 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -84.6 | 113 | 172 | -167.8 | 1 | 0 | 0 | 0 | 109.9 | G188 | D186-G188 VanDerWaalsContact C-N 3.3Å; D186-G188 PolarHBondContact OD1-N 3.43Å |
| 187 | G | 76.6 | Confident | 89.2 | Confident | 23 Ų | 23 | 43.5 Ų | 43.5 | 24% | 0.237 | 27% | 0.267 | C | S | . | . | trans | -91.8 | 15.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | S189 R190 | G187-S189 VanDerWaalsContact C-N 3.25Å; G187-S189 PolarHBondContact O-N 3.41Å; G187-R190 WeakPolarHBondContact CA-O 3.15Å; G187-R190 PolarHBondContact N-O 3.35Å | ||
| 188 | G | 82.6 | Confident | 89 | Confident | 70 Ų | 70 | 45.1 Ų | 45.1 | 72% | 0.722 | 28% | 0.278 | S | S | * | . | S | Bend | trans | 82.2 | -56.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | D186 | D186-G188 VanDerWaalsContact C-N 3.3Å; D186-G188 PolarHBondContact OD1-N 3.43Å |
| 189 | S | 82.8 | Confident | 88.4 | Confident | 112 Ų | 112 | 51.6 Ų | 51.6 | 78% | 0.783 | 31% | 0.308 | S | S | * | . | S | Bend | trans | -81.8 | -28.8 | 177.2 | 62.9 | 0 | 0 | 0 | 0 | 113.1 | G187 | G187-S189 VanDerWaalsContact C-N 3.25Å; G187-S189 PolarHBondContact O-N 3.41Å |
| 190 | R | 86.1 | Confident | 87.6 | Confident | 26 Ų | 26 | 56.5 Ų | 56.5 | 10% | 0.098 | 33% | 0.325 | C | S | . | . | trans | -158.6 | 149.1 | 176.4 | 64.8 | -175.6 | -163.4 | 141.1 | 23.5 | 111.1 | E6 G187 I192 | E6-R190 VanDerWaalsContact CD-CZ 3.47Å; E6-R190 IonicContact OE1-CZ 2.85Å; E6-R190 IonicContact OE1-NE 3.15Å; E6-R190 PolarHBondContact OE1-NE 3.45Å; E6-R190 IonicContact OE1-NH1 3.32Å; E6-R190 PolarHBondContact OE1-NH1 2.99Å; E6-R190 IonicContact OE1-NH2 3.9Å; E6-R190 PolarHBondContact OE1-NH2 3.43Å; E6-R190 IonicContact OE2-CZ 3.47Å; E6-R190 IonicContact OE2-NH1 2.9Å; E6-R190 IonicContact OE2-NH2 3.13Å; E6-R190 PolarHBondContact OE2-NH2 3.17Å; G187-R190 WeakPolarHBondContact CA-O 3.15Å; G187-R190 PolarHBondContact N-O 3.35Å; R190-I192 HydrophobicContact CG-CG2 4.26Å; R190-I192 VanDerWaalsContact NH2-CG2 3.31Å | ||
| 191 | T | 89.3 | Confident | 87.2 | Confident | 38 Ų | 38 | 54.3 Ų | 54.3 | 23% | 0.233 | 31% | 0.312 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.5 | 140.2 | 166.7 | -49.1 | 0 | 0 | 0 | 0 | 110 | S106 W107 A184 L185 | S106-T191 PolarHBondContact OG-N 3.18Å; S106-T191 PolarHBondContact OG-O 2.85Å; W107-T191 HydrophobicContact CB-CG2 4.19Å; W107-T191 PolarHBondContact N-O 2.87Å; A184-T191 HydrophobicContact CB-CG2 4.1Å; L185-T191 CarbonylContact O-C 3.55Å; L185-T191 VanDerWaalsContact O-CA 3.26Å; L185-T191 WeakPolarHBondContact O-CA 3.13Å; L185-T191 WeakPolarHBondContact O-CG2 3.37Å |
| 192 | I | 88.9 | Confident | 86.7 | Confident | 3 Ų | 3 | 54.3 Ų | 54.3 | 2% | 0.015 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 147.5 | 177.1 | 57 | 172.6 | 0 | 0 | 0 | 110.6 | V7 A184 L185 R190 Q194 | V7-I192 HydrophobicContact CG2-CD1 3.19Å; A184-I192 WeakPolarHBondContact CA-O 3.41Å; L185-I192 HydrophobicContact CB-CG1 4.37Å; L185-I192 PolarHBondContact N-O 3.42Å; L185-I192 PolarHBondContact O-N 3.16Å; R190-I192 HydrophobicContact CG-CG2 4.26Å; R190-I192 VanDerWaalsContact NH2-CG2 3.31Å; I192-Q194 HydrophobicContact CD1-CG 4.28Å; I192-Q194 HydrophobicContact CG1-CG 4.48Å |
| 193 | C | 92.6 | Very high | 86.1 | Confident | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 116.5 | 173.8 | 172.2 | 0 | 0 | 0 | 0 | 111.4 | D102 W107 C114 H118 | D102-C193 PolarHBondContact OD1-N 2.98Å; W107-C193 HydrophobicContact CB-CB 4.27Å; W107-C193 HydrophobicContact CD2-CB 3.33Å; W107-C193 HydrophobicContact CE3-CB 3.4Å; W107-C193 HydrophobicContact CG-CB 3.7Å; W107-C193 HydrophobicContact CH2-CB 4.38Å; W107-C193 HydrophobicContact CZ2-CB 4.33Å; W107-C193 HydrophobicContact CZ3-CB 3.94Å; C114-C193 WeakPolarHBondContact CA-SG 3.4Å; C114-C193 HydrophobicContact CB-CB 3.84Å; C114-C193 WeakPolarHBondContact CB-SG 3.26Å; C114-C193 WeakPolarHBondContact SG-CA 3.46Å; C114-C193 WeakPolarHBondContact SG-CB 3.17Å; C114-C193 CovalentContact SG-SG 2.03Å; C114-C193 PolarHBondContact SG-SG 2.97Å; H118-C193 PolarHBondContact CE1-SG 3.28Å; H118-C193 PolarHBondContact ND1-SG 2.97Å |
| 194 | Q | 88.8 | Confident | 85.8 | Confident | 6 Ų | 6 | 62.3 Ų | 62.3 | 3% | 0.028 | 34% | 0.342 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -153.5 | 169.4 | -176.7 | 63.4 | 173.6 | -5.1 | 0 | 0 | 113.6 | A182 T183 I192 I196 | A182-Q194 WeakPolarHBondContact CA-O 3.3Å; T183-Q194 PolarHBondContact N-O 2.88Å; T183-Q194 PolarHBondContact O-N 3.36Å; T183-Q194 VanDerWaalsContact O-N 3.09Å; I192-Q194 HydrophobicContact CD1-CG 4.28Å; I192-Q194 HydrophobicContact CG1-CG 4.48Å; Q194-I196 HydrophobicContact CG-CG1 4.12Å |
| 195 | R | 89 | Confident | 85.5 | Confident | 29 Ų | 29 | 66.2 Ų | 66.2 | 11% | 0.109 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.8 | 135 | 170.7 | -57.1 | 168.8 | 178.3 | 121.6 | -1.3 | 108.5 | F4 D178 F181 A182 Y197 | F4-R195 HydrophobicContact CE2-CB 3.89Å; F4-R195 VanDerWaalsContact CE2-O 3.29Å; F4-R195 WeakPolarHBondContact CE2-O 3.45Å; F4-R195 HydrophobicContact CZ-CB 4Å; F4-R195 WeakPolarHBondContact CZ-O 3.34Å; D178-R195 IonicContact OD1-CZ 3.48Å; D178-R195 IonicContact OD1-NE 2.63Å; D178-R195 PolarHBondContact OD1-NE 3.37Å; D178-R195 IonicContact OD1-NH2 2.75Å; D178-R195 PolarHBondContact OD1-NH2 2.66Å; F181-R195 HydrophobicContact CB-CB 4.42Å; F181-R195 CarbonylContact O-C 3.39Å; F181-R195 WeakPolarHBondContact O-CA 3.34Å; A182-R195 HydrophobicContact CB-CG 4.38Å; R195-Y197 HydrophobicContact CB-CE1 4.43Å |
| 196 | I | 88.1 | Confident | 85.3 | Confident | 65 Ų | 65 | 64.8 Ų | 64.8 | 33% | 0.333 | 34% | 0.343 | S | S | . | . | trans | -122.2 | 123.3 | 177.6 | -56.2 | -178 | 0 | 0 | 0 | 108.5 | F181 T183 L185 Q194 | F181-I196 WeakPolarHBondContact CD1-O 3.26Å; F181-I196 PolarHBondContact O-N 3.48Å; T183-I196 HydrophobicContact CG2-CD1 3.46Å; T183-I196 VanDerWaalsContact CG2-CD1 3.46Å; T183-I196 HydrophobicContact CG2-CG1 3.97Å; L185-I196 HydrophobicContact CB-CD1 4.07Å; L185-I196 HydrophobicContact CD1-CD1 4.14Å; L185-I196 HydrophobicContact CD2-CD1 4.01Å; L185-I196 HydrophobicContact CG-CD1 4.3Å; Q194-I196 HydrophobicContact CG-CG1 4.12Å | ||
| 197 | Y | 88.3 | Confident | 85.3 | Confident | 19 Ų | 19 | 60 Ų | 60 | 8% | 0.075 | 32% | 0.32 | C | S | . | . | trans | -103.1 | 158.9 | 178.2 | -54.4 | -58 | 0 | 0 | 0 | 111.3 | F4 F181 R195 Q199 W205 M206 F209 | F4-Y197 HydrophobicContact CE1-CE2 4.4Å; F4-Y197 HydrophobicContact CZ-CD2 4.34Å; F4-Y197 AromaticContact CZ-CE2 3.88Å; F4-Y197 HydrophobicContact CZ-CE2 3.88Å; F181-Y197 HydrophobicContact CB-CD1 4.18Å; F181-Y197 HydrophobicContact CB-CE1 4.01Å; F181-Y197 AromaticContact CD1-CD1 3.97Å; F181-Y197 HydrophobicContact CD1-CD1 3.97Å; F181-Y197 AromaticContact CD2-CD1 3.99Å; F181-Y197 HydrophobicContact CD2-CD1 3.99Å; F181-Y197 AromaticContact CD2-CE1 3.83Å; F181-Y197 HydrophobicContact CD2-CE1 3.83Å; F181-Y197 HydrophobicContact CE1-CD1 4.34Å; F181-Y197 HydrophobicContact CE2-CD1 4.37Å; F181-Y197 HydrophobicContact CE2-CE1 4.46Å; F181-Y197 AromaticContact CG-CD1 3.78Å; F181-Y197 HydrophobicContact CG-CD1 3.78Å; F181-Y197 AromaticContact CG-CE1 3.88Å; F181-Y197 HydrophobicContact CG-CE1 3.88Å; R195-Y197 HydrophobicContact CB-CE1 4.43Å; Y197-Q199 PolarHBondContact O-N 2.95Å; Y197-W205 HydrophobicContact CD1-CB 3.86Å; Y197-W205 HydrophobicContact CD2-CB 4.21Å; Y197-W205 HydrophobicContact CE1-CB 4.5Å; Y197-W205 HydrophobicContact CG-CB 3.7Å; Y197-M206 HydrophobicContact CD2-CB 4.14Å; Y197-M206 HydrophobicContact CE2-CB 4Å; Y197-M206 HydrophobicContact CE2-CG 4.39Å; Y197-F209 HydrophobicContact CD1-CD2 4.23Å; Y197-F209 AromaticContact CD1-CE2 3.99Å; Y197-F209 HydrophobicContact CD1-CE2 3.99Å; Y197-F209 AromaticContact CE1-CD2 3.37Å; Y197-F209 HydrophobicContact CE1-CD2 3.37Å; Y197-F209 AromaticContact CE1-CE2 3.4Å; Y197-F209 HydrophobicContact CE1-CE2 3.4Å; Y197-F209 VanDerWaalsContact CE1-CE2 3.4Å; Y197-F209 AromaticContact CZ-CD2 3.55Å; Y197-F209 WeakPolarHBondContact OH-CD2 3.22Å | ||
| 198 | P | 86.6 | Confident | 85.9 | Confident | 62 Ų | 62 | 60.8 Ų | 60.8 | 40% | 0.403 | 33% | 0.328 | S | S | . | . | trans | -59.6 | 123.3 | 177.7 | -22.3 | 32.7 | 0 | 0 | 0 | 111.8 | K200 T201 S202 | P198-K200 PolarHBondContact O-N 2.84Å; P198-T201 CarbonylContact O-C 3.48Å; P198-T201 PolarHBondContact O-N 3.19Å; P198-T201 PolarHBondContact O-OG1 3.37Å; P198-S202 WeakPolarHBondContact O-CA 3.16Å; P198-S202 PolarHBondContact O-N 2.94Å | ||
| 199 | Q | 78.4 | Confident | 86.3 | Confident | 145 Ų | 145 | 59.1 Ų | 59.1 | 68% | 0.678 | 30% | 0.301 | S | S | * | . | G | 310 helix | trans | -47.8 | -52.2 | -168.7 | -75.3 | -169.4 | -14.8 | 0 | 0 | 114.2 | F11 Y197 T201 S202 | F11-Q199 VanDerWaalsContact CE1-NE2 3.27Å; Y197-Q199 PolarHBondContact O-N 2.95Å; Q199-T201 PolarHBondContact O-N 3.24Å; Q199-S202 WeakPolarHBondContact O-CB 3.27Å; Q199-S202 PolarHBondContact O-N 3.48Å |
| 200 | K | 79.4 | Confident | 86.7 | Confident | 201 Ų | 201 | 54.3 Ų | 54.3 | 87% | 0.874 | 27% | 0.265 | S | S | * | . | G | 310 helix | trans | -60.2 | -22.8 | -177 | -65.9 | -173.5 | 177.9 | -176.5 | 0 | 114.4 | P198 | P198-K200 PolarHBondContact O-N 2.84Š|
| 201 | T | 83.8 | Confident | 86.9 | Confident | 53 Ų | 53 | 59 Ų | 59 | 33% | 0.325 | 29% | 0.287 | S | S | . | . | G | 310 helix | trans | -125.9 | 14 | -176 | 52.4 | 0 | 0 | 0 | 0 | 112.3 | P198 Q199 F203 Y204 W205 | P198-T201 CarbonylContact O-C 3.48Å; P198-T201 PolarHBondContact O-N 3.19Å; P198-T201 PolarHBondContact O-OG1 3.37Å; Q199-T201 PolarHBondContact O-N 3.24Å; T201-F203 VanDerWaalsContact C-N 3.3Å; T201-F203 PolarHBondContact O-N 3.43Å; T201-Y204 PolarHBondContact O-N 3.18Å; T201-Y204 VanDerWaalsContact O-N 3.12Å; T201-W205 PolarHBondContact O-N 2.92Å; T201-W205 VanDerWaalsContact O-N 3.12Å; T201-W205 VanDerWaalsContact OG1-CD1 3.28Å; T201-W205 PolarHBondContact OG1-NE1 2.82Å |
| 202 | S | 81.9 | Confident | 87 | Confident | 33 Ų | 33 | 59.9 Ų | 59.9 | 23% | 0.231 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -58.4 | -43.1 | -168.4 | -177.4 | 0 | 0 | 0 | 0 | 111.9 | P198 Q199 Y204 W205 M206 | P198-S202 WeakPolarHBondContact O-CA 3.16Å; P198-S202 PolarHBondContact O-N 2.94Å; Q199-S202 WeakPolarHBondContact O-CB 3.27Å; Q199-S202 PolarHBondContact O-N 3.48Å; S202-Y204 PolarHBondContact O-N 3.42Å; S202-W205 PolarHBondContact O-N 3.44Å; S202-M206 VanDerWaalsContact O-CB 3.3Å; S202-M206 WeakPolarHBondContact O-CB 3.2Å; S202-M206 PolarHBondContact O-N 2.87Å |
| 203 | F | 82.5 | Confident | 87 | Confident | 79 Ų | 79 | 60.8 Ų | 60.8 | 35% | 0.346 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -63.4 | -39.5 | 178.9 | 67.4 | -85.8 | 0 | 0 | 0 | 112.9 | T201 M206 A207 L278 | T201-F203 VanDerWaalsContact C-N 3.3Å; T201-F203 PolarHBondContact O-N 3.43Å; F203-M206 PolarHBondContact O-N 2.96Å; F203-A207 VanDerWaalsContact O-CB 3.27Å; F203-A207 WeakPolarHBondContact O-CB 3.49Å; F203-A207 PolarHBondContact O-N 2.91Å; F203-L278 HydrophobicContact CB-CD2 4.45Å; F203-L278 HydrophobicContact CB-CG 4.45Å |
| 204 | Y | 85.5 | Confident | 87 | Confident | 151 Ų | 151 | 61.8 Ų | 61.8 | 59% | 0.592 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -66.6 | -44 | 175.8 | -68.6 | -61.6 | 0 | 0 | 0 | 112.2 | T201 S202 G208 | T201-Y204 PolarHBondContact O-N 3.18Å; T201-Y204 VanDerWaalsContact O-N 3.12Å; S202-Y204 PolarHBondContact O-N 3.42Å; Y204-G208 PolarHBondContact O-N 3.17Å |
| 205 | W | 87.7 | Confident | 87.2 | Confident | 109 Ų | 109 | 64.3 Ų | 64.3 | 41% | 0.413 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62.3 | -45.5 | 175.9 | -75.6 | 107 | 0 | 0 | 0 | 111.2 | F181 Y197 T201 S202 G208 F209 | F181-W205 HydrophobicContact CE2-CE3 4.5Å; F181-W205 HydrophobicContact CZ-CE3 4.43Å; F181-W205 HydrophobicContact CZ-CZ3 4.42Å; Y197-W205 HydrophobicContact CD1-CB 3.86Å; Y197-W205 HydrophobicContact CD2-CB 4.21Å; Y197-W205 HydrophobicContact CE1-CB 4.5Å; Y197-W205 HydrophobicContact CG-CB 3.7Å; T201-W205 PolarHBondContact O-N 2.92Å; T201-W205 VanDerWaalsContact O-N 3.12Å; T201-W205 VanDerWaalsContact OG1-CD1 3.28Å; T201-W205 PolarHBondContact OG1-NE1 2.82Å; S202-W205 PolarHBondContact O-N 3.44Å; W205-G208 PolarHBondContact O-N 2.98Å; W205-F209 HydrophobicContact CB-CD2 4.49Å; W205-F209 HydrophobicContact CB-CE2 4.31Å; W205-F209 HydrophobicContact CD2-CE2 4.38Å; W205-F209 HydrophobicContact CE3-CD2 4.47Å; W205-F209 AromaticContact CE3-CE2 3.5Å; W205-F209 HydrophobicContact CE3-CE2 3.5Å; W205-F209 AromaticContact CE3-CZ 3.6Å; W205-F209 HydrophobicContact CE3-CZ 3.6Å; W205-F209 HydrophobicContact CZ3-CE2 4.2Å; W205-F209 AromaticContact CZ3-CZ 3.83Å; W205-F209 HydrophobicContact CZ3-CZ 3.83Å; W205-F209 WeakPolarHBondContact O-CD2 3.17Å; W205-F209 PolarHBondContact O-N 3.47Å |
| 206 | M | 85.5 | Confident | 87.3 | Confident | 24 Ų | 24 | 64.5 Ų | 64.5 | 12% | 0.118 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -60.7 | -51.3 | 178.1 | -173.6 | -178.5 | -56.6 | 0 | 0 | 111.6 | F4 Y197 S202 F203 G208 F209 R210 L278 | F4-M206 HydrophobicContact CD1-CE 3.6Å; F4-M206 HydrophobicContact CE1-CE 3.42Å; F4-M206 VanDerWaalsContact CE1-CE 3.42Å; F4-M206 HydrophobicContact CZ-CE 4.36Å; Y197-M206 HydrophobicContact CD2-CB 4.14Å; Y197-M206 HydrophobicContact CE2-CB 4Å; Y197-M206 HydrophobicContact CE2-CG 4.39Å; S202-M206 VanDerWaalsContact O-CB 3.3Å; S202-M206 WeakPolarHBondContact O-CB 3.2Å; S202-M206 PolarHBondContact O-N 2.87Å; F203-M206 PolarHBondContact O-N 2.96Å; M206-G208 VanDerWaalsContact C-N 3.32Å; M206-G208 PolarHBondContact O-N 3.22Å; M206-F209 PolarHBondContact O-N 2.93Å; M206-R210 HydrophobicContact CG-CG 4.45Å; M206-R210 WeakPolarHBondContact O-CB 3.37Å; M206-R210 WeakPolarHBondContact O-CG 3.42Å; M206-R210 PolarHBondContact O-N 3.38Å; M206-R210 VanDerWaalsContact SD-CZ 3.54Å; M206-R210 PolarHBondContact SD-NH2 3.41Å; M206-R210 VanDerWaalsContact SD-NH2 3.43Å; M206-L278 HydrophobicContact CB-CD2 4.39Å; M206-L278 HydrophobicContact CG-CD2 4.25Å; M206-L278 HydrophobicContact SD-CD2 3.76Å |
| 207 | A | 86.8 | Confident | 87.4 | Confident | 12 Ų | 12 | 61.6 Ų | 61.6 | 10% | 0.099 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -60 | -43.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | F203 R210 F211 T275 L279 | F203-A207 VanDerWaalsContact O-CB 3.27Å; F203-A207 WeakPolarHBondContact O-CB 3.49Å; F203-A207 PolarHBondContact O-N 2.91Å; A207-R210 PolarHBondContact O-N 2.96Å; A207-F211 VanDerWaalsContact O-CB 3.29Å; A207-F211 WeakPolarHBondContact O-CB 3.29Å; A207-F211 PolarHBondContact O-N 3.27Å; A207-T275 HydrophobicContact CB-CG2 3.81Å; A207-L279 HydrophobicContact CB-CD1 4.44Å; A207-L279 HydrophobicContact CB-CD2 4.3Å |
| 208 | G | 90.3 | Very high | 87.5 | Confident | 40 Ų | 40 | 62 Ų | 62 | 41% | 0.412 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.2 | -48.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y204 W205 M206 F211 Q212 | Y204-G208 PolarHBondContact O-N 3.17Å; W205-G208 PolarHBondContact O-N 2.98Å; M206-G208 VanDerWaalsContact C-N 3.32Å; M206-G208 PolarHBondContact O-N 3.22Å; G208-F211 PolarHBondContact O-N 2.98Å; G208-Q212 WeakPolarHBondContact O-CB 3.46Å; G208-Q212 PolarHBondContact O-N 3.41Å |
| 209 | F | 90.4 | Very high | 87.8 | Confident | 35 Ų | 35 | 61.6 Ų | 61.6 | 15% | 0.154 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -70.5 | -35.1 | 178.6 | -68.9 | -51.6 | 0 | 0 | 0 | 113 | P177 F181 Y197 W205 M206 Q212 H213 | P177-F209 HydrophobicContact CB-CD1 4.16Å; P177-F209 HydrophobicContact CB-CE1 3.52Å; P177-F209 HydrophobicContact CB-CE2 4.34Å; P177-F209 HydrophobicContact CB-CZ 3.62Å; P177-F209 HydrophobicContact CG-CD1 4.21Å; P177-F209 HydrophobicContact CG-CE1 3.46Å; P177-F209 VanDerWaalsContact CG-CE1 3.46Å; P177-F209 HydrophobicContact CG-CZ 3.96Å; F181-F209 AromaticContact CD2-CE2 3.95Å; F181-F209 HydrophobicContact CD2-CE2 3.95Å; F181-F209 HydrophobicContact CD2-CZ 4.18Å; F181-F209 AromaticContact CE2-CE2 3.75Å; F181-F209 HydrophobicContact CE2-CE2 3.75Å; F181-F209 AromaticContact CE2-CZ 3.74Å; F181-F209 HydrophobicContact CE2-CZ 3.74Å; Y197-F209 HydrophobicContact CD1-CD2 4.23Å; Y197-F209 AromaticContact CD1-CE2 3.99Å; Y197-F209 HydrophobicContact CD1-CE2 3.99Å; Y197-F209 AromaticContact CE1-CD2 3.37Å; Y197-F209 HydrophobicContact CE1-CD2 3.37Å; Y197-F209 AromaticContact CE1-CE2 3.4Å; Y197-F209 HydrophobicContact CE1-CE2 3.4Å; Y197-F209 VanDerWaalsContact CE1-CE2 3.4Å; Y197-F209 AromaticContact CZ-CD2 3.55Å; Y197-F209 WeakPolarHBondContact OH-CD2 3.22Å; W205-F209 HydrophobicContact CB-CD2 4.49Å; W205-F209 HydrophobicContact CB-CE2 4.31Å; W205-F209 HydrophobicContact CD2-CE2 4.38Å; W205-F209 HydrophobicContact CE3-CD2 4.47Å; W205-F209 AromaticContact CE3-CE2 3.5Å; W205-F209 HydrophobicContact CE3-CE2 3.5Å; W205-F209 AromaticContact CE3-CZ 3.6Å; W205-F209 HydrophobicContact CE3-CZ 3.6Å; W205-F209 HydrophobicContact CZ3-CE2 4.2Å; W205-F209 AromaticContact CZ3-CZ 3.83Å; W205-F209 HydrophobicContact CZ3-CZ 3.83Å; W205-F209 WeakPolarHBondContact O-CD2 3.17Å; W205-F209 PolarHBondContact O-N 3.47Å; M206-F209 PolarHBondContact O-N 2.93Å; F209-Q212 PolarHBondContact O-N 3.24Å; F209-H213 VanDerWaalsContact O-CB 3.26Å; F209-H213 WeakPolarHBondContact O-CB 3.48Å; F209-H213 PolarHBondContact O-N 2.99Å |
| 210 | R | 89.9 | Confident | 88.4 | Confident | 10 Ų | 10 | 59 Ų | 59 | 4% | 0.038 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -63.7 | -42.2 | 171.9 | -73.5 | 173.3 | 177.6 | -156.1 | -4.9 | 111.4 | M1 M206 A207 H213 I214 I271 D274 T275 | M1-R210 HydrophobicContact CE-CG 3.46Å; M1-R210 VanDerWaalsContact CE-CG 3.46Å; M206-R210 HydrophobicContact CG-CG 4.45Å; M206-R210 WeakPolarHBondContact O-CB 3.37Å; M206-R210 WeakPolarHBondContact O-CG 3.42Å; M206-R210 PolarHBondContact O-N 3.38Å; M206-R210 VanDerWaalsContact SD-CZ 3.54Å; M206-R210 PolarHBondContact SD-NH2 3.41Å; M206-R210 VanDerWaalsContact SD-NH2 3.43Å; A207-R210 PolarHBondContact O-N 2.96Å; R210-H213 WeakPolarHBondContact O-CB 3.36Å; R210-H213 PolarHBondContact O-N 3.49Å; R210-I214 WeakPolarHBondContact O-CG1 3.2Å; R210-I214 PolarHBondContact O-N 3.26Å; R210-I271 HydrophobicContact CB-CG2 3.8Å; R210-I271 HydrophobicContact CG-CG2 3.82Å; R210-D274 IonicContact CZ-OD2 3.44Å; R210-D274 IonicContact NH1-OD2 2.7Å; R210-D274 PolarHBondContact NH1-OD2 2.75Å; R210-D274 IonicContact NH2-OD2 2.71Å; R210-D274 PolarHBondContact NH2-OD2 2.93Å; R210-T275 WeakPolarHBondContact CD-OG1 3.3Å; R210-T275 PolarHBondContact NH1-OG1 3.09Å |
| 211 | F | 90.6 | Very high | 89 | Confident | 124 Ų | 124 | 49.7 Ų | 49.7 | 54% | 0.544 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -65 | -44.4 | 175.1 | -173.8 | -99.5 | 0 | 0 | 0 | 111.7 | A207 G208 H213 I214 L215 | A207-F211 VanDerWaalsContact O-CB 3.29Å; A207-F211 WeakPolarHBondContact O-CB 3.29Å; A207-F211 PolarHBondContact O-N 3.27Å; G208-F211 PolarHBondContact O-N 2.98Å; F211-H213 VanDerWaalsContact C-N 3.3Å; F211-H213 PolarHBondContact O-N 3.01Å; F211-I214 PolarHBondContact O-N 2.91Å; F211-L215 HydrophobicContact CE1-CB 4.43Å; F211-L215 HydrophobicContact CE1-CD2 3.9Å; F211-L215 VanDerWaalsContact O-CB 3.23Å; F211-L215 WeakPolarHBondContact O-CB 3.47Å; F211-L215 PolarHBondContact O-N 3.34Å |
| 212 | Q | 91.9 | Very high | 89.3 | Confident | 58 Ų | 58 | 47.3 Ų | 47.3 | 27% | 0.271 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -56.5 | -45.9 | 172.8 | -178.5 | -176.8 | -83.4 | 0 | 0 | 111.1 | G208 F209 I214 L215 V216 | G208-Q212 WeakPolarHBondContact O-CB 3.46Å; G208-Q212 PolarHBondContact O-N 3.41Å; F209-Q212 PolarHBondContact O-N 3.24Å; Q212-I214 PolarHBondContact O-N 3.28Å; Q212-L215 PolarHBondContact O-N 3.06Å; Q212-V216 HydrophobicContact CG-CG2 4.14Å; Q212-V216 WeakPolarHBondContact O-CB 3.49Å; Q212-V216 WeakPolarHBondContact O-CG2 3.24Å; Q212-V216 PolarHBondContact O-N 3.46Å |
| 213 | H | 89.8 | Confident | 89.8 | Confident | 22 Ų | 22 | 50.2 Ų | 50.2 | 10% | 0.102 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -58.9 | -47.7 | 178.2 | -179.5 | -92.5 | 0 | 0 | 0 | 111.7 | L125 F209 R210 F211 G217 Y267 | L125-H213 WeakPolarHBondContact CD2-CD2 3.29Å; L125-H213 WeakPolarHBondContact CD2-NE2 3.01Å; F209-H213 VanDerWaalsContact O-CB 3.26Å; F209-H213 WeakPolarHBondContact O-CB 3.48Å; F209-H213 PolarHBondContact O-N 2.99Å; R210-H213 WeakPolarHBondContact O-CB 3.36Å; R210-H213 PolarHBondContact O-N 3.49Å; F211-H213 VanDerWaalsContact C-N 3.3Å; F211-H213 PolarHBondContact O-N 3.01Å; H213-G217 WeakPolarHBondContact O-CA 3.26Å; H213-G217 PolarHBondContact O-N 2.9Å; H213-Y267 AromaticContact CE1-CE1 3.94Å |
| 214 | I | 91.4 | Very high | 90.3 | Very high | 20 Ų | 20 | 49.2 Ų | 49.2 | 10% | 0.103 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -65.5 | -47.2 | 176.9 | -67.7 | 164.1 | 0 | 0 | 0 | 110.9 | R210 F211 Q212 F218 V219 I271 F272 | R210-I214 WeakPolarHBondContact O-CG1 3.2Å; R210-I214 PolarHBondContact O-N 3.26Å; F211-I214 PolarHBondContact O-N 2.91Å; Q212-I214 PolarHBondContact O-N 3.28Å; I214-F218 WeakPolarHBondContact O-CA 3.28Å; I214-F218 VanDerWaalsContact O-CB 3.28Å; I214-F218 WeakPolarHBondContact O-CB 3.45Å; I214-F218 PolarHBondContact O-N 2.92Å; I214-V219 HydrophobicContact CG2-CG2 3.98Å; I214-V219 PolarHBondContact O-N 3.2Å; I214-I271 HydrophobicContact CD1-CG2 3.98Å; I214-F272 HydrophobicContact CD1-CB 3.97Å; I214-F272 HydrophobicContact CD1-CD2 4.42Å |
| 215 | L | 92.8 | Very high | 90.5 | Very high | 60 Ų | 60 | 42.1 Ų | 42.1 | 31% | 0.314 | 22% | 0.221 | S | C | . | . | I | π-helix | trans | -66.1 | -51.8 | -174.5 | -177.7 | 63.9 | 0 | 0 | 0 | 111.5 | F211 Q212 V219 L220 | F211-L215 HydrophobicContact CE1-CB 4.43Å; F211-L215 HydrophobicContact CE1-CD2 3.9Å; F211-L215 VanDerWaalsContact O-CB 3.23Å; F211-L215 WeakPolarHBondContact O-CB 3.47Å; F211-L215 PolarHBondContact O-N 3.34Å; Q212-L215 PolarHBondContact O-N 3.06Å; L215-V219 HydrophobicContact CD1-CB 4.21Å; L215-V219 HydrophobicContact CD1-CG1 4.26Å; L215-V219 PolarHBondContact O-N 3.11Å; L215-L220 HydrophobicContact CD1-CD1 4.41Å; L215-L220 HydrophobicContact CD1-CD2 4.28Å; L215-L220 HydrophobicContact CD1-CG 3.95Å; L215-L220 HydrophobicContact CG-CD1 4.03Å; L215-L220 HydrophobicContact CG-CG 4.07Å; L215-L220 WeakPolarHBondContact O-CB 3.46Å; L215-L220 WeakPolarHBondContact O-CG 3.45Å; L215-L220 PolarHBondContact O-N 2.96Å |
| 216 | V | 92 | Very high | 90.6 | Very high | 33 Ų | 33 | 41.4 Ų | 41.4 | 20% | 0.2 | 23% | 0.225 | C | C | . | . | I | π-helix | trans | -83.9 | -36 | -174.8 | -175.5 | 0 | 0 | 0 | 0 | 111.7 | Y126 L174 Q212 P221 | Y126-V216 HydrophobicContact CD1-CB 4.28Å; Y126-V216 HydrophobicContact CD1-CG1 3.8Å; Y126-V216 HydrophobicContact CE1-CB 3.79Å; Y126-V216 HydrophobicContact CE1-CG1 3.8Å; L174-V216 HydrophobicContact CD1-CG1 3.76Å; Q212-V216 HydrophobicContact CG-CG2 4.14Å; Q212-V216 WeakPolarHBondContact O-CB 3.49Å; Q212-V216 WeakPolarHBondContact O-CG2 3.24Å; Q212-V216 PolarHBondContact O-N 3.46Å; V216-P221 WeakPolarHBondContact O-CD 3.38Å; V216-P221 WeakPolarHBondContact O-CG 3.38Å |
| 217 | G | 89.6 | Confident | 90.8 | Very high | 3 Ų | 3 | 44 Ų | 44 | 3% | 0.031 | 24% | 0.242 | C | C | . | . | I | π-helix | trans | -80.6 | -21.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114 | H213 | H213-G217 WeakPolarHBondContact O-CA 3.26Å; H213-G217 PolarHBondContact O-N 2.9Å |
| 218 | F | 90.3 | Very high | 90.9 | Very high | 27 Ų | 27 | 43.9 Ų | 43.9 | 12% | 0.118 | 24% | 0.24 | C | C | . | . | I | π-helix | trans | -134.9 | -58.4 | -173.2 | -174.2 | -97.3 | 0 | 0 | 0 | 113.8 | I214 G222 F260 F261 W264 L265 C268 | I214-F218 WeakPolarHBondContact O-CA 3.28Å; I214-F218 VanDerWaalsContact O-CB 3.28Å; I214-F218 WeakPolarHBondContact O-CB 3.45Å; I214-F218 PolarHBondContact O-N 2.92Å; F218-G222 WeakPolarHBondContact O-CA 3.33Å; F218-G222 PolarHBondContact O-N 2.89Å; F218-F260 HydrophobicContact CD2-CE1 4.27Å; F218-F261 HydrophobicContact CD2-CD1 4.39Å; F218-F261 HydrophobicContact CE1-CE1 4.49Å; F218-F261 AromaticContact CE2-CD1 3.45Å; F218-F261 HydrophobicContact CE2-CD1 3.45Å; F218-F261 VanDerWaalsContact CE2-CD1 3.45Å; F218-F261 AromaticContact CE2-CE1 3.92Å; F218-F261 HydrophobicContact CE2-CE1 3.92Å; F218-F261 AromaticContact CZ-CD1 3.52Å; F218-F261 HydrophobicContact CZ-CD1 3.52Å; F218-F261 AromaticContact CZ-CE1 3.86Å; F218-F261 HydrophobicContact CZ-CE1 3.86Å; F218-W264 HydrophobicContact CD2-CB 4.07Å; F218-W264 HydrophobicContact CE2-CB 4.26Å; F218-L265 HydrophobicContact CE1-CD1 3.86Å; F218-L265 HydrophobicContact CE2-CB 3.96Å; F218-L265 HydrophobicContact CE2-CD1 4.43Å; F218-L265 HydrophobicContact CZ-CB 3.79Å; F218-L265 HydrophobicContact CZ-CD1 3.5Å; F218-L265 HydrophobicContact CZ-CG 4.2Å; F218-C268 HydrophobicContact CG-CB 4.47Å |
| 219 | V | 92.6 | Very high | 90.7 | Very high | 55 Ų | 55 | 42.8 Ų | 42.8 | 33% | 0.333 | 22% | 0.224 | S | C | . | . | I | π-helix | trans | -68 | -55.9 | -169.4 | 176.8 | 0 | 0 | 0 | 0 | 112.3 | I214 L215 G222 L223 | I214-V219 HydrophobicContact CG2-CG2 3.98Å; I214-V219 PolarHBondContact O-N 3.2Å; L215-V219 HydrophobicContact CD1-CB 4.21Å; L215-V219 HydrophobicContact CD1-CG1 4.26Å; L215-V219 PolarHBondContact O-N 3.11Å; V219-G222 PolarHBondContact O-N 2.87Å; V219-L223 HydrophobicContact CG1-CD1 4.01Å; V219-L223 HydrophobicContact CG1-CG 4.42Å; V219-L223 VanDerWaalsContact O-CG 3.32Å; V219-L223 WeakPolarHBondContact O-CG 3Å; V219-L223 PolarHBondContact O-N 3.45Å |
| 220 | L | 92.7 | Very high | 90.5 | Very high | 90 Ų | 90 | 45 Ų | 45 | 47% | 0.471 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.1 | -50.9 | -176.6 | -67 | 174.2 | 0 | 0 | 0 | 112.5 | L215 G222 L223 V224 | L215-L220 HydrophobicContact CD1-CD1 4.41Å; L215-L220 HydrophobicContact CD1-CD2 4.28Å; L215-L220 HydrophobicContact CD1-CG 3.95Å; L215-L220 HydrophobicContact CG-CD1 4.03Å; L215-L220 HydrophobicContact CG-CG 4.07Å; L215-L220 WeakPolarHBondContact O-CB 3.46Å; L215-L220 WeakPolarHBondContact O-CG 3.45Å; L215-L220 PolarHBondContact O-N 2.96Å; L220-G222 VanDerWaalsContact C-N 3.26Å; L220-G222 PolarHBondContact O-N 3.2Å; L220-L223 PolarHBondContact O-N 3.33Å; L220-V224 WeakPolarHBondContact O-CG2 3.23Å; L220-V224 PolarHBondContact O-N 3.05Å; L220-V224 VanDerWaalsContact O-N 3.15Å |
| 221 | P | 90.6 | Very high | 90.3 | Very high | 5 Ų | 5 | 47.9 Ų | 47.9 | 3% | 0.032 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.1 | -37.2 | 176 | -19.1 | 32.5 | 0 | 0 | 0 | 111.5 | V129 L130 A133 V216 V224 I225 | V129-P221 HydrophobicContact CB-CB 4.39Å; V129-P221 HydrophobicContact CB-CG 4.36Å; V129-P221 HydrophobicContact CG1-CB 4.3Å; V129-P221 HydrophobicContact CG1-CG 3.77Å; V129-P221 HydrophobicContact CG2-CB 3.37Å; V129-P221 HydrophobicContact CG2-CG 3.69Å; L130-P221 HydrophobicContact CD2-CG 4.49Å; A133-P221 HydrophobicContact CB-CB 4.24Å; V216-P221 WeakPolarHBondContact O-CD 3.38Å; V216-P221 WeakPolarHBondContact O-CG 3.38Å; P221-V224 PolarHBondContact O-N 3.24Å; P221-I225 WeakPolarHBondContact O-CB 3.34Å; P221-I225 WeakPolarHBondContact O-CD1 3.43Å; P221-I225 WeakPolarHBondContact O-CG1 3.25Å; P221-I225 PolarHBondContact O-N 3.25Å |
| 222 | G | 90.5 | Very high | 90 | Very high | 3 Ų | 3 | 42.1 Ų | 42.1 | 3% | 0.031 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.1 | -45.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | F218 V219 L220 I225 L226 | F218-G222 WeakPolarHBondContact O-CA 3.33Å; F218-G222 PolarHBondContact O-N 2.89Å; V219-G222 PolarHBondContact O-N 2.87Å; L220-G222 VanDerWaalsContact C-N 3.26Å; L220-G222 PolarHBondContact O-N 3.2Å; G222-I225 PolarHBondContact O-N 3.25Å; G222-L226 WeakPolarHBondContact O-CB 3.42Å; G222-L226 WeakPolarHBondContact O-CG 3.49Å; G222-L226 PolarHBondContact O-N 3.47Å |
| 223 | L | 92.3 | Very high | 89.5 | Confident | 94 Ų | 94 | 42.9 Ų | 42.9 | 49% | 0.492 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -61.4 | -44.3 | 174.8 | -71.1 | 173.1 | 0 | 0 | 0 | 112 | V219 L220 I225 L226 T227 | V219-L223 HydrophobicContact CG1-CD1 4.01Å; V219-L223 HydrophobicContact CG1-CG 4.42Å; V219-L223 VanDerWaalsContact O-CG 3.32Å; V219-L223 WeakPolarHBondContact O-CG 3Å; V219-L223 PolarHBondContact O-N 3.45Å; L220-L223 PolarHBondContact O-N 3.33Å; L223-I225 VanDerWaalsContact C-N 3.34Å; L223-I225 PolarHBondContact O-N 3.44Å; L223-L226 PolarHBondContact O-N 2.71Å; L223-T227 WeakPolarHBondContact O-CB 3.04Å; L223-T227 VanDerWaalsContact O-CG2 3.24Å; L223-T227 WeakPolarHBondContact O-CG2 3.37Å; L223-T227 PolarHBondContact O-N 2.95Å; L223-T227 PolarHBondContact O-OG1 3.46Å |
| 224 | V | 92.5 | Very high | 89.2 | Confident | 59 Ų | 59 | 44.2 Ų | 44.2 | 36% | 0.358 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -60.4 | -45.8 | 176.3 | 172.1 | 0 | 0 | 0 | 0 | 110.8 | A133 V137 L220 P221 T227 C228 | A133-V224 HydrophobicContact CB-CB 4.47Å; A133-V224 HydrophobicContact CB-CG1 4.17Å; V137-V224 HydrophobicContact CG2-CG1 3.7Å; L220-V224 WeakPolarHBondContact O-CG2 3.23Å; L220-V224 PolarHBondContact O-N 3.05Å; L220-V224 VanDerWaalsContact O-N 3.15Å; P221-V224 PolarHBondContact O-N 3.24Å; V224-T227 PolarHBondContact O-OG1 2.03Å; V224-C228 VanDerWaalsContact O-CB 3.32Å; V224-C228 WeakPolarHBondContact O-CB 3.24Å; V224-C228 PolarHBondContact O-N 2.95Å; V224-C228 PolarHBondContact O-SG 3.37Å |
| 225 | I | 89.9 | Confident | 88.6 | Confident | 2 Ų | 2 | 48.5 Ų | 48.5 | 1% | 0.01 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.4 | -53.9 | 178.6 | -69.1 | 167 | 0 | 0 | 0 | 109.7 | L132 A133 P221 G222 L223 T227 C228 Y229 I257 | L132-I225 HydrophobicContact CB-CD1 4.13Å; A133-I225 HydrophobicContact CB-CD1 4.47Å; A133-I225 HydrophobicContact CB-CG1 4.16Å; P221-I225 WeakPolarHBondContact O-CB 3.34Å; P221-I225 WeakPolarHBondContact O-CD1 3.43Å; P221-I225 WeakPolarHBondContact O-CG1 3.25Å; P221-I225 PolarHBondContact O-N 3.25Å; G222-I225 PolarHBondContact O-N 3.25Å; L223-I225 VanDerWaalsContact C-N 3.34Å; L223-I225 PolarHBondContact O-N 3.44Å; I225-T227 PolarHBondContact O-N 2.91Å; I225-C228 WeakPolarHBondContact O-CB 3.44Å; I225-C228 PolarHBondContact O-N 3.24Å; I225-Y229 HydrophobicContact CG2-CD2 3.87Å; I225-Y229 HydrophobicContact CG2-CE2 4.06Å; I225-Y229 VanDerWaalsContact O-CD2 3.23Å; I225-Y229 WeakPolarHBondContact O-CD2 3.32Å; I225-Y229 PolarHBondContact O-N 3.29Å; I225-I257 HydrophobicContact CG2-CB 4.3Å; I225-I257 HydrophobicContact CG2-CD1 3.47Å; I225-I257 VanDerWaalsContact CG2-CD1 3.47Å; I225-I257 HydrophobicContact CG2-CG1 3.7Å; I225-I257 HydrophobicContact CG2-CG2 3.6Å |
| 226 | L | 89.2 | Confident | 87.7 | Confident | 93 Ų | 93 | 46.5 Ų | 46.5 | 49% | 0.487 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -57.4 | -49.5 | -177.3 | -72.7 | 170.1 | 0 | 0 | 0 | 111.5 | G222 L223 C228 Y229 C230 F261 | G222-L226 WeakPolarHBondContact O-CB 3.42Å; G222-L226 WeakPolarHBondContact O-CG 3.49Å; G222-L226 PolarHBondContact O-N 3.47Å; L223-L226 PolarHBondContact O-N 2.71Å; L226-C228 PolarHBondContact O-N 2.65Å; L226-Y229 PolarHBondContact O-N 2.91Å; L226-C230 WeakPolarHBondContact O-CB 3.32Å; L226-C230 PolarHBondContact O-N 2.89Å; L226-C230 PolarHBondContact O-SG 3.49Å; L226-F261 HydrophobicContact CG-CZ 4.42Å |
| 227 | T | 90.5 | Very high | 86.8 | Confident | 79 Ų | 79 | 47.8 Ų | 47.8 | 49% | 0.485 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -59.8 | -45.9 | 178.3 | 52.9 | 0 | 0 | 0 | 0 | 112 | L223 V224 I225 Y229 C230 I231 | L223-T227 WeakPolarHBondContact O-CB 3.04Å; L223-T227 VanDerWaalsContact O-CG2 3.24Å; L223-T227 WeakPolarHBondContact O-CG2 3.37Å; L223-T227 PolarHBondContact O-N 2.95Å; L223-T227 PolarHBondContact O-OG1 3.46Å; V224-T227 PolarHBondContact O-OG1 2.03Å; I225-T227 PolarHBondContact O-N 2.91Å; T227-Y229 PolarHBondContact O-N 3.48Å; T227-C230 PolarHBondContact O-N 2.81Å; T227-I231 VanDerWaalsContact O-CG1 3.32Å; T227-I231 WeakPolarHBondContact O-CG1 3.41Å; T227-I231 PolarHBondContact O-N 3.32Å; T227-I231 VanDerWaalsContact O-N 3.13Å |
| 228 | C | 89.3 | Confident | 86 | Confident | 9 Ų | 9 | 54.7 Ų | 54.7 | 6% | 0.061 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -56.5 | -48 | 175.9 | -74 | 0 | 0 | 0 | 0 | 111.6 | V224 I225 L226 I231 I232 | V224-C228 VanDerWaalsContact O-CB 3.32Å; V224-C228 WeakPolarHBondContact O-CB 3.24Å; V224-C228 PolarHBondContact O-N 2.95Å; V224-C228 PolarHBondContact O-SG 3.37Å; I225-C228 WeakPolarHBondContact O-CB 3.44Å; I225-C228 PolarHBondContact O-N 3.24Å; L226-C228 PolarHBondContact O-N 2.65Å; C228-I231 PolarHBondContact O-N 3.44Å; C228-I232 WeakPolarHBondContact O-CD1 3.32Å; C228-I232 WeakPolarHBondContact O-CG1 3.12Å; C228-I232 PolarHBondContact O-N 2.9Å |
| 229 | Y | 85.3 | Confident | 84.8 | Confident | 17 Ų | 17 | 55 Ų | 55 | 7% | 0.067 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -73.1 | -35.4 | -178.4 | -79.7 | -80.4 | 0 | 0 | 0 | 113.7 | S136 I225 L226 T227 I231 I232 I233 L250 T253 V254 I257 | S136-Y229 WeakPolarHBondContact OG-CE2 3.19Å; I225-Y229 HydrophobicContact CG2-CD2 3.87Å; I225-Y229 HydrophobicContact CG2-CE2 4.06Å; I225-Y229 VanDerWaalsContact O-CD2 3.23Å; I225-Y229 WeakPolarHBondContact O-CD2 3.32Å; I225-Y229 PolarHBondContact O-N 3.29Å; L226-Y229 PolarHBondContact O-N 2.91Å; T227-Y229 PolarHBondContact O-N 3.48Å; Y229-I231 VanDerWaalsContact C-N 3.28Å; Y229-I231 PolarHBondContact O-N 3.34Å; Y229-I232 HydrophobicContact CD1-CD1 4.17Å; Y229-I232 HydrophobicContact CE1-CD1 4.22Å; Y229-I232 PolarHBondContact O-N 3.07Å; Y229-I233 VanDerWaalsContact O-CB 3.3Å; Y229-I233 WeakPolarHBondContact O-CB 3.29Å; Y229-I233 WeakPolarHBondContact O-CD1 3.35Å; Y229-I233 WeakPolarHBondContact O-CG1 3.17Å; Y229-I233 PolarHBondContact O-N 2.86Å; Y229-L250 HydrophobicContact CD1-CD2 3.61Å; Y229-L250 HydrophobicContact CE1-CD2 3.76Å; Y229-T253 WeakPolarHBondContact OH-CB 3.24Å; Y229-T253 WeakPolarHBondContact OH-CG2 3.19Å; Y229-V254 HydrophobicContact CD1-CG2 3.95Å; Y229-V254 HydrophobicContact CE1-CG2 4Å; Y229-I257 HydrophobicContact CD2-CD1 3.53Å; Y229-I257 HydrophobicContact CE1-CD1 4.29Å; Y229-I257 HydrophobicContact CE2-CD1 2.98Å; Y229-I257 HydrophobicContact CE2-CG1 4.42Å; Y229-I257 HydrophobicContact CG-CD1 4.41Å; Y229-I257 VanDerWaalsContact CZ-CD1 3.42Å |
| 230 | C | 86.6 | Confident | 83.3 | Confident | 82 Ų | 82 | 56.7 Ų | 56.7 | 55% | 0.554 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -55.4 | -47.3 | 172.2 | -73.3 | 0 | 0 | 0 | 0 | 110.4 | L226 T227 I233 A234 | L226-C230 WeakPolarHBondContact O-CB 3.32Å; L226-C230 PolarHBondContact O-N 2.89Å; L226-C230 PolarHBondContact O-SG 3.49Å; T227-C230 PolarHBondContact O-N 2.81Å; C230-I233 PolarHBondContact O-N 3.24Å; C230-A234 WeakPolarHBondContact O-CB 3.47Å; C230-A234 PolarHBondContact O-N 3.07Å |
| 231 | I | 86.9 | Confident | 81.9 | Confident | 70 Ų | 70 | 61.2 Ų | 61.2 | 36% | 0.359 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -68.4 | -43.5 | 178.9 | -57 | 162.8 | 0 | 0 | 0 | 111.5 | Y140 V144 T227 C228 Y229 I233 A234 K235 | Y140-I231 HydrophobicContact CD2-CB 4.21Å; Y140-I231 HydrophobicContact CD2-CD1 4.36Å; Y140-I231 HydrophobicContact CD2-CG2 4.18Å; Y140-I231 HydrophobicContact CE2-CB 4.1Å; Y140-I231 HydrophobicContact CE2-CD1 3.82Å; Y140-I231 HydrophobicContact CE2-CG2 3.76Å; V144-I231 HydrophobicContact CG2-CG2 3.97Å; T227-I231 VanDerWaalsContact O-CG1 3.32Å; T227-I231 WeakPolarHBondContact O-CG1 3.41Å; T227-I231 PolarHBondContact O-N 3.32Å; T227-I231 VanDerWaalsContact O-N 3.13Å; C228-I231 PolarHBondContact O-N 3.44Å; Y229-I231 VanDerWaalsContact C-N 3.28Å; Y229-I231 PolarHBondContact O-N 3.34Å; I231-I233 VanDerWaalsContact C-N 3.33Å; I231-I233 PolarHBondContact O-N 3.07Å; I231-A234 PolarHBondContact O-N 2.85Å; I231-K235 HydrophobicContact CG2-CG 4.31Å; I231-K235 WeakPolarHBondContact O-CB 3.43Å; I231-K235 WeakPolarHBondContact O-CG 3.44Å; I231-K235 PolarHBondContact O-N 3.48Å |
| 232 | I | 83.4 | Confident | 80.5 | Confident | 4 Ų | 4 | 61.8 Ų | 61.8 | 2% | 0.021 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -57.9 | -47.2 | 176.8 | -70.3 | 163.2 | 0 | 0 | 0 | 110.4 | R139 C228 Y229 K235 L236 L250 | R139-I232 HydrophobicContact CB-CD1 4.19Å; C228-I232 WeakPolarHBondContact O-CD1 3.32Å; C228-I232 WeakPolarHBondContact O-CG1 3.12Å; C228-I232 PolarHBondContact O-N 2.9Å; Y229-I232 HydrophobicContact CD1-CD1 4.17Å; Y229-I232 HydrophobicContact CE1-CD1 4.22Å; Y229-I232 PolarHBondContact O-N 3.07Å; I232-K235 PolarHBondContact O-N 2.86Å; I232-L236 HydrophobicContact CG2-CD1 3.51Å; I232-L236 HydrophobicContact CG2-CG 4.26Å; I232-L236 VanDerWaalsContact O-CB 3.29Å; I232-L236 WeakPolarHBondContact O-CB 2.81Å; I232-L236 WeakPolarHBondContact O-CG 3.35Å; I232-L236 PolarHBondContact O-N 2.91Å; I232-L250 HydrophobicContact CG2-CD2 4Å |
| 233 | I | 80.9 | Confident | 79.2 | Confident | 73 Ų | 73 | 66.6 Ų | 66.6 | 37% | 0.374 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -63.9 | -44.3 | -178.7 | -70.6 | 166 | 0 | 0 | 0 | 110.5 | Y229 C230 I231 L236 S237 L250 | Y229-I233 VanDerWaalsContact O-CB 3.3Å; Y229-I233 WeakPolarHBondContact O-CB 3.29Å; Y229-I233 WeakPolarHBondContact O-CD1 3.35Å; Y229-I233 WeakPolarHBondContact O-CG1 3.17Å; Y229-I233 PolarHBondContact O-N 2.86Å; C230-I233 PolarHBondContact O-N 3.24Å; I231-I233 VanDerWaalsContact C-N 3.33Å; I231-I233 PolarHBondContact O-N 3.07Å; I233-L236 PolarHBondContact O-N 3.43Å; I233-S237 PolarHBondContact O-N 3.43Å; I233-S237 PolarHBondContact O-OG 3.26Å; I233-L250 HydrophobicContact CG1-CD1 3.93Å; I233-L250 HydrophobicContact CG1-CD2 4.44Å |
| 234 | A | 83.3 | Confident | 77.9 | Confident | 50 Ų | 50 | 67.2 Ų | 67.2 | 41% | 0.413 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.3 | -37 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | C230 I231 S237 Q238 | C230-A234 WeakPolarHBondContact O-CB 3.47Å; C230-A234 PolarHBondContact O-N 3.07Å; I231-A234 PolarHBondContact O-N 2.85Å; A234-S237 PolarHBondContact O-OG 3.23Å; A234-Q238 WeakPolarHBondContact O-CG 3.49Å |
| 235 | K | 78.6 | Confident | 76.3 | Confident | 110 Ų | 110 | 70 Ų | 70 | 48% | 0.478 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -75.4 | -37.1 | 176.5 | -75.6 | -68.1 | -177.3 | -177.7 | 0 | 112.7 | V144 I231 I232 S237 Q238 | V144-K235 HydrophobicContact CG2-CG 4.28Å; I231-K235 HydrophobicContact CG2-CG 4.31Å; I231-K235 WeakPolarHBondContact O-CB 3.43Å; I231-K235 WeakPolarHBondContact O-CG 3.44Å; I231-K235 PolarHBondContact O-N 3.48Å; I232-K235 PolarHBondContact O-N 2.86Å; K235-S237 VanDerWaalsContact C-N 3.33Å; K235-Q238 PolarHBondContact O-N 3.14Å |
| 236 | L | 75.3 | Confident | 75.1 | Confident | 18 Ų | 18 | 72 Ų | 72 | 9% | 0.094 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -79.8 | -12.7 | -179.1 | -67.1 | 176.8 | 0 | 0 | 0 | 113.9 | V143 I232 I233 Q238 G242 K246 | V143-L236 HydrophobicContact CG1-CD1 4.27Å; V143-L236 HydrophobicContact CG1-CD2 3.82Å; V143-L236 HydrophobicContact CG1-CG 3.9Å; I232-L236 HydrophobicContact CG2-CD1 3.51Å; I232-L236 HydrophobicContact CG2-CG 4.26Å; I232-L236 VanDerWaalsContact O-CB 3.29Å; I232-L236 WeakPolarHBondContact O-CB 2.81Å; I232-L236 WeakPolarHBondContact O-CG 3.35Å; I232-L236 PolarHBondContact O-N 2.91Å; I233-L236 PolarHBondContact O-N 3.43Å; L236-Q238 VanDerWaalsContact C-N 3.34Å; L236-G242 CarbonylContact O-C 3.43Å; L236-K246 HydrophobicContact CB-CB 3.86Å; L236-K246 HydrophobicContact CB-CD 3.94Å; L236-K246 HydrophobicContact CB-CG 3.9Å; L236-K246 HydrophobicContact CD1-CB 3.92Å; L236-K246 HydrophobicContact CD1-CG 4.09Å; L236-K246 HydrophobicContact CG-CB 4.44Å |
| 237 | S | 71.9 | Confident | 73.9 | Confident | 61 Ų | 61 | 77.7 Ų | 77.7 | 43% | 0.427 | 42% | 0.421 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.9 | -15.5 | 171.6 | 54.9 | 0 | 0 | 0 | 0 | 113.7 | I233 A234 K235 G239 | I233-S237 PolarHBondContact O-N 3.43Å; I233-S237 PolarHBondContact O-OG 3.26Å; A234-S237 PolarHBondContact O-OG 3.23Å; K235-S237 VanDerWaalsContact C-N 3.33Å; S237-G239 VanDerWaalsContact C-N 3.31Å; S237-G239 PolarHBondContact O-N 3.31Å |
| 238 | Q | 73.1 | Confident | 72.5 | Confident | 148 Ų | 148 | 82.5 Ų | 82.5 | 69% | 0.692 | 44% | 0.435 | S | S | * | . | S | Bend | trans | -82.4 | 9.8 | -173.3 | -67.3 | 176.2 | -8.5 | 0 | 0 | 114.8 | A234 K235 L236 | A234-Q238 WeakPolarHBondContact O-CG 3.49Å; K235-Q238 PolarHBondContact O-N 3.14Å; L236-Q238 VanDerWaalsContact C-N 3.34Å |
| 239 | G | 65.8 | Low | 71 | Confident | 34 Ų | 34 | 83.5 Ų | 83.5 | 35% | 0.351 | 44% | 0.444 | S | S | . | . | trans | -171.6 | 155.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 116.9 | S237 K241 G242 Q243 | S237-G239 VanDerWaalsContact C-N 3.31Å; S237-G239 PolarHBondContact O-N 3.31Å; G239-K241 PolarHBondContact O-N 2.97Å; G239-G242 WeakPolarHBondContact O-CA 3.45Å; G239-G242 PolarHBondContact O-N 3.35Å; G239-Q243 PolarHBondContact O-N 2.75Å; G239-Q243 VanDerWaalsContact O-N 3.14Å | ||
| 240 | A | 61.3 | Low | 70 | Confident | 90 Ų | 90 | 83.8 Ų | 83.8 | 74% | 0.744 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -63.7 | -37.7 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | G242 | A240-G242 VanDerWaalsContact C-N 3.32Å |
| 241 | K | 62.2 | Low | 69.3 | Low | 184 Ų | 184 | 85.8 Ų | 85.8 | 80% | 0.8 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -69.6 | -29.9 | 170.8 | -73.9 | 179.6 | 178.9 | 173.8 | 0 | 112.2 | G239 L245 | G239-K241 PolarHBondContact O-N 2.97Å; K241-L245 WeakPolarHBondContact O-CD1 3.45Å; K241-L245 PolarHBondContact O-N 2.98Å |
| 242 | G | 61.6 | Low | 68.3 | Low | 17 Ų | 17 | 83.7 Ų | 83.7 | 18% | 0.175 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -63.4 | -39.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | L236 G239 A240 V244 L245 K246 | L236-G242 CarbonylContact O-C 3.43Å; G239-G242 WeakPolarHBondContact O-CA 3.45Å; G239-G242 PolarHBondContact O-N 3.35Å; A240-G242 VanDerWaalsContact C-N 3.32Å; G242-V244 PolarHBondContact O-N 3.19Å; G242-L245 PolarHBondContact O-N 3.24Å; G242-K246 WeakPolarHBondContact O-CB 3.4Å; G242-K246 PolarHBondContact O-N 3.2Å |
| 243 | Q | 63.1 | Low | 67.6 | Low | 104 Ų | 104 | 84.1 Ų | 84.1 | 49% | 0.486 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -59 | -39.9 | 178.2 | -75.9 | -85.3 | -10 | 0 | 0 | 113.9 | G239 K246 R247 | G239-Q243 PolarHBondContact O-N 2.75Å; G239-Q243 VanDerWaalsContact O-N 3.14Å; Q243-K246 WeakPolarHBondContact O-CB 3.42Å; Q243-K246 PolarHBondContact O-N 3.32Å; Q243-R247 PolarHBondContact O-N 3.23Å |
| 244 | V | 64.6 | Low | 67.3 | Low | 108 Ų | 108 | 82.7 Ų | 82.7 | 66% | 0.655 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -72.1 | -42.5 | 179 | 179 | 0 | 0 | 0 | 0 | 111.3 | G242 R247 K248 | G242-V244 PolarHBondContact O-N 3.19Å; V244-R247 PolarHBondContact O-N 3.34Å; V244-K248 PolarHBondContact O-N 2.9Å |
| 245 | L | 60.2 | Low | 66.9 | Low | 118 Ų | 118 | 83.2 Ų | 83.2 | 62% | 0.618 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -66.4 | -36.2 | 173.4 | -86.8 | 118.2 | 0 | 0 | 0 | 112 | K241 G242 K248 A249 | K241-L245 WeakPolarHBondContact O-CD1 3.45Å; K241-L245 PolarHBondContact O-N 2.98Å; G242-L245 PolarHBondContact O-N 3.24Å; L245-K248 PolarHBondContact O-N 2.95Å; L245-A249 VanDerWaalsContact O-CB 3.22Å; L245-A249 WeakPolarHBondContact O-CB 3.36Å; L245-A249 PolarHBondContact O-N 2.85Å |
| 246 | K | 63.4 | Low | 66.7 | Low | 43 Ų | 43 | 78.1 Ų | 78.1 | 19% | 0.187 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -54.9 | -53.4 | 171.7 | -168.1 | 176.3 | 175.3 | 177.7 | 0 | 111.3 | L236 G242 Q243 K248 A249 L250 | L236-K246 HydrophobicContact CB-CB 3.86Å; L236-K246 HydrophobicContact CB-CD 3.94Å; L236-K246 HydrophobicContact CB-CG 3.9Å; L236-K246 HydrophobicContact CD1-CB 3.92Å; L236-K246 HydrophobicContact CD1-CG 4.09Å; L236-K246 HydrophobicContact CG-CB 4.44Å; G242-K246 WeakPolarHBondContact O-CB 3.4Å; G242-K246 PolarHBondContact O-N 3.2Å; Q243-K246 WeakPolarHBondContact O-CB 3.42Å; Q243-K246 PolarHBondContact O-N 3.32Å; K246-K248 VanDerWaalsContact C-N 3.25Å; K246-K248 PolarHBondContact O-N 3.48Å; K246-A249 PolarHBondContact O-N 2.64Å; K246-L250 HydrophobicContact CD-CD1 4.25Å; K246-L250 HydrophobicContact CG-CD1 3.38Å; K246-L250 HydrophobicContact CG-CG 4.1Å; K246-L250 WeakPolarHBondContact O-CB 3.39Å; K246-L250 VanDerWaalsContact O-CG 3.26Å; K246-L250 WeakPolarHBondContact O-CG 3.18Å; K246-L250 PolarHBondContact O-N 3.2Å |
| 247 | R | 63.8 | Low | 66.7 | Low | 213 Ų | 213 | 78 Ų | 78 | 80% | 0.804 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -63.1 | -33.4 | -179.1 | -147.2 | 176.5 | -171.2 | -146.3 | 3 | 112.1 | Q243 V244 K251 | Q243-R247 PolarHBondContact O-N 3.23Å; V244-R247 PolarHBondContact O-N 3.34Å; R247-K251 VanDerWaalsContact O-CB 3.24Å; R247-K251 WeakPolarHBondContact O-CB 3.26Å |
| 248 | K | 62.9 | Low | 67.2 | Low | 179 Ų | 179 | 80 Ų | 80 | 78% | 0.778 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -82.2 | -35.5 | -178.9 | -160.5 | 172.8 | -174.8 | 174.2 | 0 | 113.7 | V244 L245 K246 | V244-K248 PolarHBondContact O-N 2.9Å; L245-K248 PolarHBondContact O-N 2.95Å; K246-K248 VanDerWaalsContact C-N 3.25Å; K246-K248 PolarHBondContact O-N 3.48Å |
| 249 | A | 56 | Low | 67.7 | Low | 31 Ų | 31 | 73.7 Ų | 73.7 | 26% | 0.256 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -86.3 | -31.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L245 K246 T253 | L245-A249 VanDerWaalsContact O-CB 3.22Å; L245-A249 WeakPolarHBondContact O-CB 3.36Å; L245-A249 PolarHBondContact O-N 2.85Å; K246-A249 PolarHBondContact O-N 2.64Å; A249-T253 PolarHBondContact O-OG1 2.87Å |
| 250 | L | 65.1 | Low | 68.3 | Low | 23 Ų | 23 | 72.3 Ų | 72.3 | 12% | 0.12 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -82.8 | -31.8 | 179.7 | -65.3 | -176.8 | 0 | 0 | 0 | 113.1 | Y229 I232 I233 K246 T252 T253 V254 | Y229-L250 HydrophobicContact CD1-CD2 3.61Å; Y229-L250 HydrophobicContact CE1-CD2 3.76Å; I232-L250 HydrophobicContact CG2-CD2 4Å; I233-L250 HydrophobicContact CG1-CD1 3.93Å; I233-L250 HydrophobicContact CG1-CD2 4.44Å; K246-L250 HydrophobicContact CD-CD1 4.25Å; K246-L250 HydrophobicContact CG-CD1 3.38Å; K246-L250 HydrophobicContact CG-CG 4.1Å; K246-L250 WeakPolarHBondContact O-CB 3.39Å; K246-L250 VanDerWaalsContact O-CG 3.26Å; K246-L250 WeakPolarHBondContact O-CG 3.18Å; K246-L250 PolarHBondContact O-N 3.2Å; L250-T252 PolarHBondContact O-N 2.98Å; L250-T253 PolarHBondContact O-N 3.41Å; L250-V254 HydrophobicContact CB-CG2 3.86Å; L250-V254 HydrophobicContact CD2-CG2 3.79Å; L250-V254 HydrophobicContact CG-CG2 4.34Å; L250-V254 VanDerWaalsContact O-CB 3.26Å; L250-V254 WeakPolarHBondContact O-CB 3.42Å; L250-V254 WeakPolarHBondContact O-CG2 3.3Å; L250-V254 PolarHBondContact O-N 3.31Å |
| 251 | K | 71 | Confident | 69.4 | Low | 124 Ų | 124 | 69.7 Ų | 69.7 | 54% | 0.539 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -56.3 | -42.6 | -169.4 | -174.4 | 178.9 | -174.6 | -175.3 | 0 | 114 | R247 I255 L317 | R247-K251 VanDerWaalsContact O-CB 3.24Å; R247-K251 WeakPolarHBondContact O-CB 3.26Å; K251-I255 WeakPolarHBondContact O-CD1 3.4Å; K251-I255 WeakPolarHBondContact O-CG1 2.84Å; K251-L317 HydrophobicContact CG-CD2 4.41Å |
| 252 | T | 66.1 | Low | 70.7 | Confident | 25 Ų | 25 | 64.7 Ų | 64.7 | 15% | 0.153 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -87.1 | -41.1 | -177.9 | -51.9 | 0 | 0 | 0 | 0 | 111.9 | L250 L256 Y314 L317 | L250-T252 PolarHBondContact O-N 2.98Å; T252-L256 HydrophobicContact CG2-CD1 4.25Å; T252-L256 VanDerWaalsContact O-CG 3.3Å; T252-L256 WeakPolarHBondContact O-CG 3.44Å; T252-L256 PolarHBondContact O-N 3.17Å; T252-Y314 HydrophobicContact CG2-CD1 4.27Å; T252-Y314 HydrophobicContact CG2-CE1 4.5Å; T252-L317 HydrophobicContact CG2-CD1 4.48Å |
| 253 | T | 69.1 | Low | 72 | Confident | 13 Ų | 13 | 64.1 Ų | 64.1 | 8% | 0.08 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -77.5 | -40.1 | -170.3 | -7.3 | 0 | 0 | 0 | 0 | 112.5 | I135 Y229 A249 L250 I255 L256 I257 | I135-T253 HydrophobicContact CG2-CG2 3.66Å; Y229-T253 WeakPolarHBondContact OH-CB 3.24Å; Y229-T253 WeakPolarHBondContact OH-CG2 3.19Å; A249-T253 PolarHBondContact O-OG1 2.87Å; L250-T253 PolarHBondContact O-N 3.41Å; T253-I255 VanDerWaalsContact C-N 3.3Å; T253-I255 PolarHBondContact O-N 2.92Å; T253-L256 PolarHBondContact O-N 3.49Å; T253-I257 WeakPolarHBondContact O-CD1 3.49Å; T253-I257 VanDerWaalsContact O-CG1 3.23Å; T253-I257 WeakPolarHBondContact O-CG1 3.31Å; T253-I257 PolarHBondContact O-N 3.39Å; T253-I257 VanDerWaalsContact O-N 3.11Å |
| 254 | V | 74 | Confident | 73.2 | Confident | 43 Ų | 43 | 59.5 Ų | 59.5 | 26% | 0.261 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -63.8 | -38.5 | 174.4 | 174.1 | 0 | 0 | 0 | 0 | 110.9 | Y229 L250 I257 L258 | Y229-V254 HydrophobicContact CD1-CG2 3.95Å; Y229-V254 HydrophobicContact CE1-CG2 4Å; L250-V254 HydrophobicContact CB-CG2 3.86Å; L250-V254 HydrophobicContact CD2-CG2 3.79Å; L250-V254 HydrophobicContact CG-CG2 4.34Å; L250-V254 VanDerWaalsContact O-CB 3.26Å; L250-V254 WeakPolarHBondContact O-CB 3.42Å; L250-V254 WeakPolarHBondContact O-CG2 3.3Å; L250-V254 PolarHBondContact O-N 3.31Å; V254-I257 PolarHBondContact O-N 2.96Å; V254-L258 HydrophobicContact CG1-CD1 3.95Å; V254-L258 HydrophobicContact CG1-CG 4.21Å; V254-L258 WeakPolarHBondContact O-CG 3.4Å; V254-L258 PolarHBondContact O-N 3.43Å |
| 255 | I | 75.8 | Confident | 74.5 | Confident | 61 Ų | 61 | 58.3 Ų | 58.3 | 31% | 0.313 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -66.5 | -41 | 178.6 | -63.1 | 179.1 | 0 | 0 | 0 | 111.2 | K251 T253 I257 L258 C259 L313 L317 | K251-I255 WeakPolarHBondContact O-CD1 3.4Å; K251-I255 WeakPolarHBondContact O-CG1 2.84Å; T253-I255 VanDerWaalsContact C-N 3.3Å; T253-I255 PolarHBondContact O-N 2.92Å; I255-I257 VanDerWaalsContact C-N 3.26Å; I255-I257 PolarHBondContact O-N 3.4Å; I255-L258 PolarHBondContact O-N 3.35Å; I255-C259 WeakPolarHBondContact O-CB 3.47Å; I255-C259 PolarHBondContact O-N 3.47Å; I255-L313 HydrophobicContact CG2-CD1 4.03Å; I255-L313 HydrophobicContact CG2-CD2 3.38Å; I255-L313 HydrophobicContact CG2-CG 4.29Å; I255-L317 HydrophobicContact CB-CD1 4.24Å; I255-L317 HydrophobicContact CD1-CD1 3.73Å; I255-L317 HydrophobicContact CD1-CD2 4.04Å; I255-L317 HydrophobicContact CG2-CD1 4.26Å |
| 256 | L | 73.5 | Confident | 76.1 | Confident | 4 Ų | 4 | 54.2 Ų | 54.2 | 2% | 0.021 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -60 | -38.9 | 173.9 | -68 | 161.8 | 0 | 0 | 0 | 111.8 | L132 T252 T253 F260 L313 Y314 | L132-L256 HydrophobicContact CD2-CB 4.47Å; T252-L256 HydrophobicContact CG2-CD1 4.25Å; T252-L256 VanDerWaalsContact O-CG 3.3Å; T252-L256 WeakPolarHBondContact O-CG 3.44Å; T252-L256 PolarHBondContact O-N 3.17Å; T253-L256 PolarHBondContact O-N 3.49Å; L256-F260 WeakPolarHBondContact O-CB 3.41Å; L256-F260 PolarHBondContact O-N 3.03Å; L256-L313 HydrophobicContact CD2-CB 3.97Å; L256-L313 HydrophobicContact CD2-CD1 3.7Å; L256-L313 HydrophobicContact CD2-CG 4.49Å; L256-L313 HydrophobicContact CG-CD1 4.34Å; L256-Y314 HydrophobicContact CD1-CE1 3.66Å; L256-Y314 HydrophobicContact CD2-CE1 3.92Å; L256-Y314 HydrophobicContact CG-CE1 4.37Å |
| 257 | I | 77.1 | Confident | 77.4 | Confident | 14 Ų | 14 | 52.4 Ų | 52.4 | 7% | 0.072 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -69.5 | -48.1 | 179.7 | -69.2 | 158.8 | 0 | 0 | 0 | 111.3 | I225 Y229 T253 V254 I255 C259 F260 F261 | I225-I257 HydrophobicContact CG2-CB 4.3Å; I225-I257 HydrophobicContact CG2-CD1 3.47Å; I225-I257 VanDerWaalsContact CG2-CD1 3.47Å; I225-I257 HydrophobicContact CG2-CG1 3.7Å; I225-I257 HydrophobicContact CG2-CG2 3.6Å; Y229-I257 HydrophobicContact CD2-CD1 3.53Å; Y229-I257 HydrophobicContact CE1-CD1 4.29Å; Y229-I257 HydrophobicContact CE2-CD1 2.98Å; Y229-I257 HydrophobicContact CE2-CG1 4.42Å; Y229-I257 HydrophobicContact CG-CD1 4.41Å; Y229-I257 VanDerWaalsContact CZ-CD1 3.42Å; T253-I257 WeakPolarHBondContact O-CD1 3.49Å; T253-I257 VanDerWaalsContact O-CG1 3.23Å; T253-I257 WeakPolarHBondContact O-CG1 3.31Å; T253-I257 PolarHBondContact O-N 3.39Å; T253-I257 VanDerWaalsContact O-N 3.11Å; V254-I257 PolarHBondContact O-N 2.96Å; I255-I257 VanDerWaalsContact C-N 3.26Å; I255-I257 PolarHBondContact O-N 3.4Å; I257-C259 VanDerWaalsContact C-N 3.28Å; I257-C259 PolarHBondContact O-N 2.98Å; I257-F260 WeakPolarHBondContact O-CB 2.98Å; I257-F260 PolarHBondContact O-N 3.43Å; I257-F261 HydrophobicContact CG2-CD2 3.55Å; I257-F261 HydrophobicContact CG2-CE2 3.45Å; I257-F261 VanDerWaalsContact CG2-CE2 3.45Å; I257-F261 WeakPolarHBondContact O-CD2 3.36Å; I257-F261 PolarHBondContact O-N 2.97Å |
| 258 | L | 81.8 | Confident | 78.7 | Confident | 103 Ų | 103 | 42.6 Ų | 42.6 | 54% | 0.539 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -58.6 | -44.7 | 176 | -71.9 | 174.1 | 0 | 0 | 0 | 110.6 | V254 I255 F260 F261 S262 | V254-L258 HydrophobicContact CG1-CD1 3.95Å; V254-L258 HydrophobicContact CG1-CG 4.21Å; V254-L258 WeakPolarHBondContact O-CG 3.4Å; V254-L258 PolarHBondContact O-N 3.43Å; I255-L258 PolarHBondContact O-N 3.35Å; L258-F260 PolarHBondContact O-N 2.96Å; L258-F261 PolarHBondContact O-N 3.33Å; L258-S262 VanDerWaalsContact O-CB 3.28Å; L258-S262 WeakPolarHBondContact O-CB 3.36Å; L258-S262 PolarHBondContact O-N 2.91Å; L258-S262 PolarHBondContact O-OG 2.76Å |
| 259 | C | 82.4 | Confident | 80.2 | Confident | 16 Ų | 16 | 37.1 Ų | 37.1 | 11% | 0.108 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -57.5 | -47.5 | 174.2 | 166.7 | 0 | 0 | 0 | 0 | 112.3 | I255 I257 S262 C263 L309 L313 | I255-C259 WeakPolarHBondContact O-CB 3.47Å; I255-C259 PolarHBondContact O-N 3.47Å; I257-C259 VanDerWaalsContact C-N 3.28Å; I257-C259 PolarHBondContact O-N 2.98Å; C259-S262 PolarHBondContact O-N 3.47Å; C259-C263 WeakPolarHBondContact O-CB 3.37Å; C259-C263 PolarHBondContact O-N 3.49Å; C259-C263 PolarHBondContact O-SG 2.91Å; C259-C263 VanDerWaalsContact O-SG 3.35Å; C259-L309 WeakPolarHBondContact SG-CB 3.48Å; C259-L309 WeakPolarHBondContact SG-CD1 3.39Å; C259-L313 HydrophobicContact CB-CD1 3.87Å |
| 260 | F | 79.9 | Confident | 81.8 | Confident | 6 Ų | 6 | 35.6 Ų | 35.6 | 3% | 0.026 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -58.1 | -52.7 | 176.8 | 178.2 | -91.3 | 0 | 0 | 0 | 111.4 | V129 L132 F218 L256 I257 L258 S262 C263 W264 | V129-F260 HydrophobicContact CB-CE2 3.84Å; V129-F260 HydrophobicContact CB-CZ 3.65Å; V129-F260 HydrophobicContact CG2-CD1 4.48Å; V129-F260 HydrophobicContact CG2-CE1 3.6Å; V129-F260 HydrophobicContact CG2-CE2 3.79Å; V129-F260 HydrophobicContact CG2-CZ 3.21Å; L132-F260 HydrophobicContact CD1-CB 3.91Å; L132-F260 HydrophobicContact CD1-CD2 3.69Å; L132-F260 HydrophobicContact CD1-CE2 4.48Å; L132-F260 HydrophobicContact CD1-CG 3.85Å; F218-F260 HydrophobicContact CD2-CE1 4.27Å; L256-F260 WeakPolarHBondContact O-CB 3.41Å; L256-F260 PolarHBondContact O-N 3.03Å; I257-F260 WeakPolarHBondContact O-CB 2.98Å; I257-F260 PolarHBondContact O-N 3.43Å; L258-F260 PolarHBondContact O-N 2.96Å; F260-S262 PolarHBondContact O-N 2.82Å; F260-C263 PolarHBondContact O-N 2.96Å; F260-W264 AromaticContact CD2-CD1 3.44Å; F260-W264 VanDerWaalsContact CD2-CD1 3.44Å; F260-W264 HydrophobicContact CD2-CG 4.4Å; F260-W264 AromaticContact CD2-NE1 3.73Å; F260-W264 HydrophobicContact CE1-CB 4.41Å; F260-W264 HydrophobicContact CE1-CG 4.4Å; F260-W264 AromaticContact CE2-CD1 3.28Å; F260-W264 HydrophobicContact CE2-CD2 4.43Å; F260-W264 AromaticContact CE2-CG 3.94Å; F260-W264 HydrophobicContact CE2-CG 3.94Å; F260-W264 AromaticContact CE2-NE1 3.4Å; F260-W264 AromaticContact CG-CD1 4Å; F260-W264 HydrophobicContact CZ-CB 4.35Å; F260-W264 AromaticContact CZ-CD1 3.7Å; F260-W264 HydrophobicContact CZ-CD2 4.47Å; F260-W264 AromaticContact CZ-CG 3.91Å; F260-W264 HydrophobicContact CZ-CG 3.91Å; F260-W264 WeakPolarHBondContact O-CB 3.45Å; F260-W264 VanDerWaalsContact O-CD1 3.28Å; F260-W264 PolarHBondContact O-N 3.11Å |
| 261 | F | 84.8 | Confident | 83.1 | Confident | 35 Ų | 35 | 34.7 Ų | 34.7 | 15% | 0.154 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.3 | -42.4 | 179.5 | -76.8 | -67.6 | 0 | 0 | 0 | 112.4 | F218 L226 I257 L258 C263 W264 L265 | F218-F261 HydrophobicContact CD2-CD1 4.39Å; F218-F261 HydrophobicContact CE1-CE1 4.49Å; F218-F261 AromaticContact CE2-CD1 3.45Å; F218-F261 HydrophobicContact CE2-CD1 3.45Å; F218-F261 VanDerWaalsContact CE2-CD1 3.45Å; F218-F261 AromaticContact CE2-CE1 3.92Å; F218-F261 HydrophobicContact CE2-CE1 3.92Å; F218-F261 AromaticContact CZ-CD1 3.52Å; F218-F261 HydrophobicContact CZ-CD1 3.52Å; F218-F261 AromaticContact CZ-CE1 3.86Å; F218-F261 HydrophobicContact CZ-CE1 3.86Å; L226-F261 HydrophobicContact CG-CZ 4.42Å; I257-F261 HydrophobicContact CG2-CD2 3.55Å; I257-F261 HydrophobicContact CG2-CE2 3.45Å; I257-F261 VanDerWaalsContact CG2-CE2 3.45Å; I257-F261 WeakPolarHBondContact O-CD2 3.36Å; I257-F261 PolarHBondContact O-N 2.97Å; L258-F261 PolarHBondContact O-N 3.33Å; F261-C263 VanDerWaalsContact C-N 3.29Å; F261-C263 PolarHBondContact O-N 3.47Å; F261-W264 PolarHBondContact O-N 3.28Å; F261-L265 WeakPolarHBondContact O-CB 3.47Å; F261-L265 PolarHBondContact O-N 3.22Å |
| 262 | S | 87.8 | Confident | 84.1 | Confident | 79 Ų | 79 | 33.5 Ų | 33.5 | 55% | 0.552 | 19% | 0.185 | S | C | * | . | H | α-helix | trans | -63.7 | -33.7 | 177.8 | -65.1 | 0 | 0 | 0 | 0 | 112.9 | L258 C259 F260 P266 | L258-S262 VanDerWaalsContact O-CB 3.28Å; L258-S262 WeakPolarHBondContact O-CB 3.36Å; L258-S262 PolarHBondContact O-N 2.91Å; L258-S262 PolarHBondContact O-OG 2.76Å; C259-S262 PolarHBondContact O-N 3.47Å; F260-S262 PolarHBondContact O-N 2.82Å; S262-P266 VanDerWaalsContact O-CD 3.31Å; S262-P266 WeakPolarHBondContact O-CD 3.39Å; S262-P266 WeakPolarHBondContact O-CG 3.49Å |
| 263 | C | 88.6 | Confident | 85.2 | Confident | 4 Ų | 4 | 35.8 Ų | 35.8 | 3% | 0.027 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -77.4 | -40.6 | 177 | -73.4 | 0 | 0 | 0 | 0 | 112.8 | C259 F260 F261 A303 H306 L309 | C259-C263 WeakPolarHBondContact O-CB 3.37Å; C259-C263 PolarHBondContact O-N 3.49Å; C259-C263 PolarHBondContact O-SG 2.91Å; C259-C263 VanDerWaalsContact O-SG 3.35Å; F260-C263 PolarHBondContact O-N 2.96Å; F261-C263 VanDerWaalsContact C-N 3.29Å; F261-C263 PolarHBondContact O-N 3.47Å; C263-A303 WeakPolarHBondContact O-CA 3.29Å; C263-A303 PolarHBondContact O-N 2.92Å; C263-H306 HydrophobicContact CB-CB 3.98Å; C263-L309 VanDerWaalsContact SG-CD1 3.59Å |
| 264 | W | 88.9 | Confident | 86.1 | Confident | 7 Ų | 7 | 35.3 Ų | 35.3 | 3% | 0.027 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -95.2 | -31.8 | -169.8 | -76.7 | 93.5 | 0 | 0 | 0 | 114.8 | L125 F218 F260 F261 Y267 C268 A303 H306 | L125-W264 HydrophobicContact CD1-CE3 3.99Å; L125-W264 HydrophobicContact CD1-CH2 3.11Å; L125-W264 HydrophobicContact CD1-CZ2 3.75Å; L125-W264 HydrophobicContact CD1-CZ3 3.24Å; L125-W264 HydrophobicContact CG-CH2 4.4Å; F218-W264 HydrophobicContact CD2-CB 4.07Å; F218-W264 HydrophobicContact CE2-CB 4.26Å; F260-W264 AromaticContact CD2-CD1 3.44Å; F260-W264 VanDerWaalsContact CD2-CD1 3.44Å; F260-W264 HydrophobicContact CD2-CG 4.4Å; F260-W264 AromaticContact CD2-NE1 3.73Å; F260-W264 HydrophobicContact CE1-CB 4.41Å; F260-W264 HydrophobicContact CE1-CG 4.4Å; F260-W264 AromaticContact CE2-CD1 3.28Å; F260-W264 HydrophobicContact CE2-CD2 4.43Å; F260-W264 AromaticContact CE2-CG 3.94Å; F260-W264 HydrophobicContact CE2-CG 3.94Å; F260-W264 AromaticContact CE2-NE1 3.4Å; F260-W264 AromaticContact CG-CD1 4Å; F260-W264 HydrophobicContact CZ-CB 4.35Å; F260-W264 AromaticContact CZ-CD1 3.7Å; F260-W264 HydrophobicContact CZ-CD2 4.47Å; F260-W264 AromaticContact CZ-CG 3.91Å; F260-W264 HydrophobicContact CZ-CG 3.91Å; F260-W264 WeakPolarHBondContact O-CB 3.45Å; F260-W264 VanDerWaalsContact O-CD1 3.28Å; F260-W264 PolarHBondContact O-N 3.11Å; F261-W264 PolarHBondContact O-N 3.28Å; W264-Y267 HydrophobicContact CE3-CD1 4.4Å; W264-Y267 HydrophobicContact CZ3-CD1 4.32Å; W264-Y267 PolarHBondContact O-N 2.96Å; W264-C268 PolarHBondContact O-N 2.96Å; W264-C268 PolarHBondContact O-SG 3.23Å; W264-A303 HydrophobicContact CD2-CB 4.06Å; W264-A303 HydrophobicContact CE3-CB 3.98Å; W264-A303 HydrophobicContact CH2-CB 4.31Å; W264-A303 HydrophobicContact CZ2-CB 4.44Å; W264-A303 HydrophobicContact CZ3-CB 4.1Å; W264-H306 AromaticContact CE2-ND1 3.82Å; W264-H306 AromaticContact CZ2-CE1 3.64Å; W264-H306 AromaticContact CZ2-ND1 3.65Å; W264-H306 AromaticContact NE1-CD2 3.86Å; W264-H306 AromaticContact NE1-CE1 3.93Å; W264-H306 AromaticContact NE1-CG 3.4Å; W264-H306 AromaticContact NE1-ND1 3.45Å; W264-H306 PolarHBondContact NE1-ND1 3.35Å |
| 265 | L | 91.8 | Very high | 86.7 | Confident | 83 Ų | 83 | 33.9 Ų | 33.9 | 44% | 0.435 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -58.5 | -46.6 | -177.2 | 176.1 | 66.5 | 0 | 0 | 0 | 112.6 | F218 F261 Y267 C268 V269 | F218-L265 HydrophobicContact CE1-CD1 3.86Å; F218-L265 HydrophobicContact CE2-CB 3.96Å; F218-L265 HydrophobicContact CE2-CD1 4.43Å; F218-L265 HydrophobicContact CZ-CB 3.79Å; F218-L265 HydrophobicContact CZ-CD1 3.5Å; F218-L265 HydrophobicContact CZ-CG 4.2Å; F261-L265 WeakPolarHBondContact O-CB 3.47Å; F261-L265 PolarHBondContact O-N 3.22Å; L265-Y267 PolarHBondContact O-N 3.11Å; L265-C268 PolarHBondContact O-N 3.29Å; L265-V269 HydrophobicContact CD1-CG2 3.88Å; L265-V269 HydrophobicContact CG-CG2 4.31Å; L265-V269 WeakPolarHBondContact O-CG2 3.47Å; L265-V269 PolarHBondContact O-N 3.09Å |
| 266 | P | 93.4 | Very high | 87.3 | Confident | 33 Ų | 33 | 32.8 Ų | 32.8 | 21% | 0.214 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -59.4 | -37.7 | -178.4 | -24.9 | 36.8 | 0 | 0 | 0 | 112.7 | S262 G270 W295 T299 L302 | S262-P266 VanDerWaalsContact O-CD 3.31Å; S262-P266 WeakPolarHBondContact O-CD 3.39Å; S262-P266 WeakPolarHBondContact O-CG 3.49Å; P266-G270 PolarHBondContact O-N 3.45Å; P266-G270 VanDerWaalsContact O-N 3.11Å; P266-W295 HydrophobicContact CB-CZ2 4.28Å; P266-W295 PolarHBondContact O-NE1 3.27Å; P266-W295 VanDerWaalsContact O-NE1 3.11Å; P266-T299 HydrophobicContact CB-CG2 3.43Å; P266-T299 VanDerWaalsContact CB-CG2 3.43Å; P266-L302 HydrophobicContact CG-CD2 4.24Å |
| 267 | Y | 91.4 | Very high | 87.9 | Confident | 4 Ų | 4 | 32.9 Ų | 32.9 | 2% | 0.016 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -71.3 | -44.1 | 177.2 | -177.9 | -116 | 0 | 0 | 0 | 112.1 | H213 W264 L265 V269 G270 I271 L296 E300 A303 | H213-Y267 AromaticContact CE1-CE1 3.94Å; W264-Y267 HydrophobicContact CE3-CD1 4.4Å; W264-Y267 HydrophobicContact CZ3-CD1 4.32Å; W264-Y267 PolarHBondContact O-N 2.96Å; L265-Y267 PolarHBondContact O-N 3.11Å; Y267-V269 VanDerWaalsContact C-N 3.31Å; Y267-V269 PolarHBondContact O-N 2.94Å; Y267-G270 PolarHBondContact O-N 3.11Å; Y267-I271 HydrophobicContact CD1-CD1 4.1Å; Y267-I271 HydrophobicContact CE1-CD1 3.41Å; Y267-I271 VanDerWaalsContact CE1-CD1 3.41Å; Y267-I271 HydrophobicContact CE1-CG1 4.35Å; Y267-I271 HydrophobicContact CE2-CD1 3.94Å; Y267-I271 HydrophobicContact CE2-CG1 4.19Å; Y267-I271 PolarHBondContact O-N 3.27Å; Y267-L296 HydrophobicContact CD2-CD2 4.23Å; Y267-L296 HydrophobicContact CE2-CD2 4.23Å; Y267-E300 HydrophobicContact CD2-CB 3.84Å; Y267-E300 HydrophobicContact CD2-CG 4.49Å; Y267-E300 HydrophobicContact CE2-CB 3.51Å; Y267-E300 HydrophobicContact CE2-CG 3.82Å; Y267-E300 PolarHBondContact OH-OE1 3.46Å; Y267-A303 HydrophobicContact CG-CB 4.49Å |
| 268 | C | 91.8 | Very high | 88.2 | Confident | 8 Ų | 8 | 34.1 Ų | 34.1 | 5% | 0.054 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.6 | -40.1 | 177.5 | -66 | 0 | 0 | 0 | 0 | 111.8 | F218 W264 L265 F272 | F218-C268 HydrophobicContact CG-CB 4.47Å; W264-C268 PolarHBondContact O-N 2.96Å; W264-C268 PolarHBondContact O-SG 3.23Å; L265-C268 PolarHBondContact O-N 3.29Å; C268-F272 VanDerWaalsContact O-CB 3.29Å; C268-F272 WeakPolarHBondContact O-CB 3.36Å; C268-F272 PolarHBondContact O-N 3.3Å |
| 269 | V | 93.1 | Very high | 88.4 | Confident | 63 Ų | 63 | 32.8 Ų | 32.8 | 38% | 0.382 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -63.4 | -45.6 | 174.3 | 171.5 | 0 | 0 | 0 | 0 | 110.5 | L265 Y267 F272 L273 | L265-V269 HydrophobicContact CD1-CG2 3.88Å; L265-V269 HydrophobicContact CG-CG2 4.31Å; L265-V269 WeakPolarHBondContact O-CG2 3.47Å; L265-V269 PolarHBondContact O-N 3.09Å; Y267-V269 VanDerWaalsContact C-N 3.31Å; Y267-V269 PolarHBondContact O-N 2.94Å; V269-F272 PolarHBondContact O-N 3.2Å; V269-L273 HydrophobicContact CG1-CD1 4.02Å; V269-L273 HydrophobicContact CG1-CG 4.41Å; V269-L273 WeakPolarHBondContact O-CG 3.47Å; V269-L273 PolarHBondContact O-N 3.2Å |
| 270 | G | 91.6 | Very high | 88.4 | Confident | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -56.7 | -51.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | P266 Y267 F272 L273 D274 | P266-G270 PolarHBondContact O-N 3.45Å; P266-G270 VanDerWaalsContact O-N 3.11Å; Y267-G270 PolarHBondContact O-N 3.11Å; G270-F272 VanDerWaalsContact C-N 3.28Å; G270-F272 PolarHBondContact O-N 3.44Å; G270-L273 PolarHBondContact O-N 3.05Å; G270-D274 VanDerWaalsContact O-CB 3.3Å; G270-D274 WeakPolarHBondContact O-CB 3.19Å; G270-D274 PolarHBondContact O-N 3.3Å |
| 271 | I | 90.6 | Very high | 88.8 | Confident | 4 Ų | 4 | 42.9 Ų | 42.9 | 2% | 0.021 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62 | -38.3 | 179.1 | -74.1 | -174.5 | 0 | 0 | 0 | 111.3 | M1 R210 I214 Y267 D274 T275 L296 | M1-I271 HydrophobicContact CE-CD1 4.25Å; R210-I271 HydrophobicContact CB-CG2 3.8Å; R210-I271 HydrophobicContact CG-CG2 3.82Å; I214-I271 HydrophobicContact CD1-CG2 3.98Å; Y267-I271 HydrophobicContact CD1-CD1 4.1Å; Y267-I271 HydrophobicContact CE1-CD1 3.41Å; Y267-I271 VanDerWaalsContact CE1-CD1 3.41Å; Y267-I271 HydrophobicContact CE1-CG1 4.35Å; Y267-I271 HydrophobicContact CE2-CD1 3.94Å; Y267-I271 HydrophobicContact CE2-CG1 4.19Å; Y267-I271 PolarHBondContact O-N 3.27Å; I271-D274 PolarHBondContact O-N 3.49Å; I271-T275 WeakPolarHBondContact O-CB 3.35Å; I271-T275 PolarHBondContact O-N 2.84Å; I271-T275 PolarHBondContact O-OG1 3.38Å; I271-L296 HydrophobicContact CG1-CD2 3.81Å |
| 272 | F | 91.8 | Very high | 88.8 | Confident | 99 Ų | 99 | 44 Ų | 44 | 43% | 0.434 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -63 | -48.4 | 178.3 | -179.4 | -108.3 | 0 | 0 | 0 | 111.2 | I214 C268 V269 G270 D274 T275 L276 | I214-F272 HydrophobicContact CD1-CB 3.97Å; I214-F272 HydrophobicContact CD1-CD2 4.42Å; C268-F272 VanDerWaalsContact O-CB 3.29Å; C268-F272 WeakPolarHBondContact O-CB 3.36Å; C268-F272 PolarHBondContact O-N 3.3Å; V269-F272 PolarHBondContact O-N 3.2Å; G270-F272 VanDerWaalsContact C-N 3.28Å; G270-F272 PolarHBondContact O-N 3.44Å; F272-D274 PolarHBondContact O-N 3.05Å; F272-T275 PolarHBondContact O-N 3.34Å; F272-L276 HydrophobicContact CD1-CD1 4.05Å; F272-L276 HydrophobicContact CE1-CD1 3.51Å; F272-L276 HydrophobicContact CE1-CG 4.19Å; F272-L276 HydrophobicContact CE2-CD2 4.49Å; F272-L276 HydrophobicContact CE2-CG 4.49Å; F272-L276 HydrophobicContact CZ-CD1 3.82Å; F272-L276 HydrophobicContact CZ-CD2 4.23Å; F272-L276 HydrophobicContact CZ-CG 4.16Å; F272-L276 WeakPolarHBondContact O-CG 3.46Å; F272-L276 PolarHBondContact O-N 3.27Å |
| 273 | L | 90.9 | Very high | 88.5 | Confident | 72 Ų | 72 | 44.9 Ų | 44.9 | 38% | 0.377 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -60.9 | -44.4 | 176.3 | -68.5 | 174.4 | 0 | 0 | 0 | 111.7 | V269 G270 T275 L276 M277 I282 L292 | V269-L273 HydrophobicContact CG1-CD1 4.02Å; V269-L273 HydrophobicContact CG1-CG 4.41Å; V269-L273 WeakPolarHBondContact O-CG 3.47Å; V269-L273 PolarHBondContact O-N 3.2Å; G270-L273 PolarHBondContact O-N 3.05Å; L273-T275 PolarHBondContact O-N 3.01Å; L273-L276 PolarHBondContact O-N 3.38Å; L273-L276 VanDerWaalsContact O-N 3.11Å; L273-M277 PolarHBondContact O-N 3.12Å; L273-I282 HydrophobicContact CD2-CD1 4.38Å; L273-L292 HydrophobicContact CB-CD1 4.36Å; L273-L292 HydrophobicContact CB-CD2 4.38Å |
| 274 | D | 87.4 | Confident | 88 | Confident | 3 Ų | 3 | 48.5 Ų | 48.5 | 2% | 0.016 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -60 | -37.2 | 177.3 | -166.3 | 65.8 | 0 | 0 | 0 | 111.7 | Y5 R210 G270 I271 F272 L278 L292 L296 | Y5-D274 PolarHBondContact OH-OD1 3.37Å; Y5-D274 PolarHBondContact OH-OD2 2.88Å; R210-D274 IonicContact CZ-OD2 3.44Å; R210-D274 IonicContact NH1-OD2 2.7Å; R210-D274 PolarHBondContact NH1-OD2 2.75Å; R210-D274 IonicContact NH2-OD2 2.71Å; R210-D274 PolarHBondContact NH2-OD2 2.93Å; G270-D274 VanDerWaalsContact O-CB 3.3Å; G270-D274 WeakPolarHBondContact O-CB 3.19Å; G270-D274 PolarHBondContact O-N 3.3Å; I271-D274 PolarHBondContact O-N 3.49Å; F272-D274 PolarHBondContact O-N 3.05Å; D274-L278 WeakPolarHBondContact O-CB 3.26Å; D274-L278 PolarHBondContact O-N 2.81Å; D274-L292 HydrophobicContact CB-CD2 3.82Å; D274-L296 HydrophobicContact CB-CD1 4.15Å |
| 275 | T | 87.1 | Confident | 87.8 | Confident | 14 Ų | 14 | 50.9 Ų | 50.9 | 9% | 0.086 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -73 | -34.8 | 176.1 | -52.3 | 0 | 0 | 0 | 0 | 112.3 | A207 R210 I271 F272 L273 L278 L279 | A207-T275 HydrophobicContact CB-CG2 3.81Å; R210-T275 WeakPolarHBondContact CD-OG1 3.3Å; R210-T275 PolarHBondContact NH1-OG1 3.09Å; I271-T275 WeakPolarHBondContact O-CB 3.35Å; I271-T275 PolarHBondContact O-N 2.84Å; I271-T275 PolarHBondContact O-OG1 3.38Å; F272-T275 PolarHBondContact O-N 3.34Å; L273-T275 PolarHBondContact O-N 3.01Å; T275-L278 PolarHBondContact O-N 3.42Å; T275-L279 HydrophobicContact CG2-CD1 4.2Å; T275-L279 WeakPolarHBondContact O-CB 3.3Å; T275-L279 VanDerWaalsContact O-CG 3.29Å; T275-L279 WeakPolarHBondContact O-CG 3.36Å; T275-L279 PolarHBondContact O-N 2.97Å |
| 276 | L | 88.9 | Confident | 87.4 | Confident | 38 Ų | 38 | 50 Ų | 50 | 20% | 0.199 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -67.8 | -37.2 | 174.6 | -70.4 | -179.4 | 0 | 0 | 0 | 112 | F272 L273 L279 N280 V281 I282 | F272-L276 HydrophobicContact CD1-CD1 4.05Å; F272-L276 HydrophobicContact CE1-CD1 3.51Å; F272-L276 HydrophobicContact CE1-CG 4.19Å; F272-L276 HydrophobicContact CE2-CD2 4.49Å; F272-L276 HydrophobicContact CE2-CG 4.49Å; F272-L276 HydrophobicContact CZ-CD1 3.82Å; F272-L276 HydrophobicContact CZ-CD2 4.23Å; F272-L276 HydrophobicContact CZ-CG 4.16Å; F272-L276 WeakPolarHBondContact O-CG 3.46Å; F272-L276 PolarHBondContact O-N 3.27Å; L273-L276 PolarHBondContact O-N 3.38Å; L273-L276 VanDerWaalsContact O-N 3.11Å; L276-L279 PolarHBondContact O-N 3.46Å; L276-N280 PolarHBondContact O-N 3.01Å; L276-V281 HydrophobicContact CB-CB 4.39Å; L276-V281 HydrophobicContact CD2-CB 4.28Å; L276-V281 HydrophobicContact CD2-CG1 4.32Å; L276-V281 HydrophobicContact CD2-CG2 4.34Å; L276-V281 WeakPolarHBondContact O-CB 3.48Å; L276-V281 PolarHBondContact O-N 3.41Å; L276-I282 HydrophobicContact CB-CD1 3.79Å; L276-I282 HydrophobicContact CB-CG1 4.15Å; L276-I282 HydrophobicContact CD1-CD1 3.84Å |
| 277 | M | 85.6 | Confident | 86.9 | Confident | 6 Ų | 6 | 52.1 Ų | 52.1 | 3% | 0.03 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -61.2 | -55.3 | 169.7 | -70 | 179.2 | 66.1 | 0 | 0 | 109.6 | L273 L279 N280 I282 H284 L288 E289 L292 | L273-M277 PolarHBondContact O-N 3.12Å; M277-L279 PolarHBondContact O-N 3.43Å; M277-N280 WeakPolarHBondContact O-CA 3.5Å; M277-N280 PolarHBondContact O-N 3.17Å; M277-I282 HydrophobicContact CG-CB 4.3Å; M277-I282 HydrophobicContact CG-CG2 4.47Å; M277-H284 PolarHBondContact O-NE2 3.39Å; M277-L288 HydrophobicContact CE-CD2 4.05Å; M277-L288 HydrophobicContact CE-CG 4.17Å; M277-L288 HydrophobicContact SD-CD2 3.81Å; M277-L288 HydrophobicContact SD-CG 3.99Å; M277-E289 HydrophobicContact CE-CB 4.37Å; M277-L292 HydrophobicContact SD-CD2 3.7Å |
| 278 | L | 83.4 | Confident | 86.6 | Confident | 39 Ų | 39 | 55.3 Ų | 55.3 | 20% | 0.204 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -51.1 | -32.1 | 177.4 | -174.5 | 70.8 | 0 | 0 | 0 | 114.3 | F203 M206 D274 T275 N280 | F203-L278 HydrophobicContact CB-CD2 4.45Å; F203-L278 HydrophobicContact CB-CG 4.45Å; M206-L278 HydrophobicContact CB-CD2 4.39Å; M206-L278 HydrophobicContact CG-CD2 4.25Å; M206-L278 HydrophobicContact SD-CD2 3.76Å; D274-L278 WeakPolarHBondContact O-CB 3.26Å; D274-L278 PolarHBondContact O-N 2.81Å; T275-L278 PolarHBondContact O-N 3.42Å; L278-N280 VanDerWaalsContact C-N 3.32Å |
| 279 | L | 84.4 | Confident | 86.2 | Confident | 76 Ų | 76 | 56.8 Ų | 56.8 | 40% | 0.398 | 33% | 0.326 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.8 | 9.3 | 177.8 | -66.5 | 175.5 | 0 | 0 | 0 | 113.9 | A207 T275 L276 M277 V281 | A207-L279 HydrophobicContact CB-CD1 4.44Å; A207-L279 HydrophobicContact CB-CD2 4.3Å; T275-L279 HydrophobicContact CG2-CD1 4.2Å; T275-L279 WeakPolarHBondContact O-CB 3.3Å; T275-L279 VanDerWaalsContact O-CG 3.29Å; T275-L279 WeakPolarHBondContact O-CG 3.36Å; T275-L279 PolarHBondContact O-N 2.97Å; L276-L279 PolarHBondContact O-N 3.46Å; M277-L279 PolarHBondContact O-N 3.43Å; L279-V281 HydrophobicContact CB-CG2 4.03Å; L279-V281 PolarHBondContact O-N 2.79Å |
| 280 | N | 84.4 | Confident | 85.7 | Confident | 131 Ų | 131 | 57.9 Ų | 57.9 | 70% | 0.701 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.9 | 31 | -176.2 | -73.1 | -58.4 | 0 | 0 | 0 | 114 | L276 M277 L278 | L276-N280 PolarHBondContact O-N 3.01Å; M277-N280 WeakPolarHBondContact O-CA 3.5Å; M277-N280 PolarHBondContact O-N 3.17Å; L278-N280 VanDerWaalsContact C-N 3.32Å |
| 281 | V | 87.4 | Confident | 85.5 | Confident | 102 Ų | 102 | 61.5 Ų | 61.5 | 62% | 0.618 | 35% | 0.352 | S | S | * | . | S | Bend | trans | -82.6 | -31.3 | 175.3 | -179.3 | 0 | 0 | 0 | 0 | 111 | L276 L279 | L276-V281 HydrophobicContact CB-CB 4.39Å; L276-V281 HydrophobicContact CD2-CB 4.28Å; L276-V281 HydrophobicContact CD2-CG1 4.32Å; L276-V281 HydrophobicContact CD2-CG2 4.34Å; L276-V281 WeakPolarHBondContact O-CB 3.48Å; L276-V281 PolarHBondContact O-N 3.41Å; L279-V281 HydrophobicContact CB-CG2 4.03Å; L279-V281 PolarHBondContact O-N 2.79Å |
| 282 | I | 85.2 | Confident | 85.3 | Confident | 60 Ų | 60 | 61.9 Ų | 61.9 | 31% | 0.308 | 35% | 0.354 | S | S | . | . | S | Bend | trans | -118.2 | 142.6 | 177.8 | -60.8 | 175.2 | 0 | 0 | 0 | 107.9 | L273 L276 M277 H284 | L273-I282 HydrophobicContact CD2-CD1 4.38Å; L276-I282 HydrophobicContact CB-CD1 3.79Å; L276-I282 HydrophobicContact CB-CG1 4.15Å; L276-I282 HydrophobicContact CD1-CD1 3.84Å; M277-I282 HydrophobicContact CG-CB 4.3Å; M277-I282 HydrophobicContact CG-CG2 4.47Å; I282-H284 PolarHBondContact O-N 3.35Å |
| 283 | S | 80.6 | Confident | 84.9 | Confident | 97 Ų | 97 | 58.4 Ų | 58.4 | 68% | 0.678 | 34% | 0.339 | S | S | * | . | trans | -61.1 | 131.3 | 178.4 | 54.9 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 284 | H | 79.4 | Confident | 84.6 | Confident | 80 Ų | 80 | 58 Ų | 58 | 37% | 0.37 | 34% | 0.34 | S | S | . | . | trans | -73.3 | 131.1 | 170.9 | -80.1 | -95.6 | 0 | 0 | 0 | 110.7 | M277 I282 | M277-H284 PolarHBondContact O-NE2 3.39Å; I282-H284 PolarHBondContact O-N 3.35Å | ||
| 285 | S | 84.8 | Confident | 84.7 | Confident | 56 Ų | 56 | 64.1 Ų | 64.1 | 39% | 0.392 | 36% | 0.363 | S | S | . | . | trans | -141.6 | 138.4 | 166.5 | 63.1 | 0 | 0 | 0 | 0 | 108.4 | A287 L288 E289 | S285-A287 PolarHBondContact O-N 3.35Å; S285-L288 PolarHBondContact O-N 2.6Å; S285-L288 WeakPolarHBondContact OG-CB 3.3Å; S285-L288 PolarHBondContact OG-N 3.31Å; S285-E289 PolarHBondContact O-N 3.41Å | ||
| 286 | C | 81.6 | Confident | 84.8 | Confident | 65 Ų | 65 | 64.2 Ų | 64.2 | 44% | 0.439 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -57.6 | -36.2 | -176.9 | -71.3 | 0 | 0 | 0 | 0 | 113 | C33 E289 Q290 | C33-C286 HydrophobicContact CB-CB 3.78Å; C33-C286 WeakPolarHBondContact CB-SG 3.2Å; C33-C286 WeakPolarHBondContact SG-CA 3.39Å; C33-C286 WeakPolarHBondContact SG-CB 3.43Å; C33-C286 CovalentContact SG-SG 2.05Å; C33-C286 PolarHBondContact SG-SG 3.3Å; C286-E289 PolarHBondContact O-N 3.45Å; C286-Q290 WeakPolarHBondContact O-CB 3.5Å; C286-Q290 PolarHBondContact O-N 3.16Å |
| 287 | A | 84.1 | Confident | 84.7 | Confident | 77 Ų | 77 | 62.8 Ų | 62.8 | 64% | 0.636 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -64.9 | -40.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | S285 S291 | S285-A287 PolarHBondContact O-N 3.35Å; A287-S291 VanDerWaalsContact O-CB 3.28Å; A287-S291 WeakPolarHBondContact O-CB 3.49Å; A287-S291 PolarHBondContact O-N 3.19Å; A287-S291 VanDerWaalsContact O-N 3.16Å |
| 288 | L | 84.4 | Confident | 84.8 | Confident | 71 Ų | 71 | 66.3 Ų | 66.3 | 37% | 0.372 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -68.6 | -43.9 | 176.7 | 179.5 | 60.9 | 0 | 0 | 0 | 111 | M277 S285 S291 L292 | M277-L288 HydrophobicContact CE-CD2 4.05Å; M277-L288 HydrophobicContact CE-CG 4.17Å; M277-L288 HydrophobicContact SD-CD2 3.81Å; M277-L288 HydrophobicContact SD-CG 3.99Å; S285-L288 PolarHBondContact O-N 2.6Å; S285-L288 WeakPolarHBondContact OG-CB 3.3Å; S285-L288 PolarHBondContact OG-N 3.31Å; L288-S291 PolarHBondContact O-N 2.86Å; L288-L292 VanDerWaalsContact O-CB 3.23Å; L288-L292 WeakPolarHBondContact O-CB 3.48Å; L288-L292 PolarHBondContact O-N 2.7Å |
| 289 | E | 83.3 | Confident | 85.2 | Confident | 39 Ų | 39 | 64.8 Ų | 64.8 | 18% | 0.182 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -61.7 | -48.5 | 179.7 | -168.1 | -172.5 | 144.2 | 0 | 0 | 111.6 | M277 S285 C286 S291 L292 Q293 | M277-E289 HydrophobicContact CE-CB 4.37Å; S285-E289 PolarHBondContact O-N 3.41Å; C286-E289 PolarHBondContact O-N 3.45Å; E289-S291 VanDerWaalsContact C-N 3.34Å; E289-S291 PolarHBondContact O-N 2.59Å; E289-L292 PolarHBondContact O-N 2.81Å; E289-Q293 WeakPolarHBondContact O-CB 3.29Å; E289-Q293 VanDerWaalsContact O-CG 3.27Å; E289-Q293 WeakPolarHBondContact O-CG 3.43Å; E289-Q293 PolarHBondContact O-N 3.33Å; E289-Q293 PolarHBondContact OE1-NE2 3.42Å |
| 290 | Q | 83.3 | Confident | 85.4 | Confident | 86 Ų | 86 | 61.4 Ų | 61.4 | 40% | 0.402 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.6 | -41.1 | 178.8 | -171.7 | 179.4 | 9.5 | 0 | 0 | 112.2 | C286 T294 | C286-Q290 WeakPolarHBondContact O-CB 3.5Å; C286-Q290 PolarHBondContact O-N 3.16Å; Q290-T294 PolarHBondContact O-N 2.85Å; Q290-T294 VanDerWaalsContact O-N 3.13Å; Q290-T294 PolarHBondContact O-OG1 3.16Å |
| 291 | S | 86.3 | Confident | 85.6 | Confident | 76 Ų | 76 | 55.4 Ų | 55.4 | 53% | 0.531 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -63.9 | -44.2 | 175.5 | -175.1 | 0 | 0 | 0 | 0 | 111.5 | A287 L288 E289 T294 W295 | A287-S291 VanDerWaalsContact O-CB 3.28Å; A287-S291 WeakPolarHBondContact O-CB 3.49Å; A287-S291 PolarHBondContact O-N 3.19Å; A287-S291 VanDerWaalsContact O-N 3.16Å; L288-S291 PolarHBondContact O-N 2.86Å; E289-S291 VanDerWaalsContact C-N 3.34Å; E289-S291 PolarHBondContact O-N 2.59Å; S291-T294 PolarHBondContact O-N 3.34Å; S291-W295 WeakPolarHBondContact O-CB 3.3Å; S291-W295 PolarHBondContact O-N 3.33Å |
| 292 | L | 87.4 | Confident | 85.7 | Confident | 12 Ų | 12 | 54 Ų | 54 | 6% | 0.063 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -66.6 | -38.9 | 179.5 | -175.1 | 59.3 | 0 | 0 | 0 | 112.1 | L273 D274 M277 L288 E289 W295 L296 | L273-L292 HydrophobicContact CB-CD1 4.36Å; L273-L292 HydrophobicContact CB-CD2 4.38Å; D274-L292 HydrophobicContact CB-CD2 3.82Å; M277-L292 HydrophobicContact SD-CD2 3.7Å; L288-L292 VanDerWaalsContact O-CB 3.23Å; L288-L292 WeakPolarHBondContact O-CB 3.48Å; L288-L292 PolarHBondContact O-N 2.7Å; E289-L292 PolarHBondContact O-N 2.81Å; L292-W295 WeakPolarHBondContact O-CB 3.4Å; L292-W295 PolarHBondContact O-N 3.43Å; L292-L296 HydrophobicContact CD1-CG 4.49Å; L292-L296 HydrophobicContact CG-CD1 4.28Å; L292-L296 WeakPolarHBondContact O-CB 3.2Å; L292-L296 VanDerWaalsContact O-CG 3.3Å; L292-L296 WeakPolarHBondContact O-CG 3.14Å; L292-L296 PolarHBondContact O-N 2.81Å |
| 293 | Q | 83.1 | Confident | 85.9 | Confident | 27 Ų | 27 | 51.3 Ų | 51.3 | 13% | 0.126 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -61.5 | -46.2 | 174.6 | -74.3 | 171.6 | -0.4 | 0 | 0 | 111.3 | Y5 E289 W295 L296 L297 | Y5-Q293 HydrophobicContact CD2-CG 4.28Å; Y5-Q293 HydrophobicContact CE2-CG 4.38Å; E289-Q293 WeakPolarHBondContact O-CB 3.29Å; E289-Q293 VanDerWaalsContact O-CG 3.27Å; E289-Q293 WeakPolarHBondContact O-CG 3.43Å; E289-Q293 PolarHBondContact O-N 3.33Å; E289-Q293 PolarHBondContact OE1-NE2 3.42Å; Q293-W295 VanDerWaalsContact C-N 3.32Å; Q293-W295 PolarHBondContact O-N 2.82Å; Q293-L296 PolarHBondContact O-N 3.36Å; Q293-L297 WeakPolarHBondContact O-CB 3.33Å; Q293-L297 PolarHBondContact O-N 3.33Å |
| 294 | T | 84.9 | Confident | 86.3 | Confident | 63 Ų | 63 | 47 Ų | 47 | 39% | 0.387 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -62.6 | -41.6 | 176 | -55.5 | 0 | 0 | 0 | 0 | 111.2 | Q290 S291 L297 I298 | Q290-T294 PolarHBondContact O-N 2.85Å; Q290-T294 VanDerWaalsContact O-N 3.13Å; Q290-T294 PolarHBondContact O-OG1 3.16Å; S291-T294 PolarHBondContact O-N 3.34Å; T294-L297 PolarHBondContact O-N 2.89Å; T294-I298 HydrophobicContact CG2-CD1 4.03Å; T294-I298 WeakPolarHBondContact O-CG1 3.23Å; T294-I298 PolarHBondContact O-N 2.97Å; T294-I298 VanDerWaalsContact O-N 3.09Å |
| 295 | W | 89.6 | Confident | 86.8 | Confident | 131 Ų | 131 | 46.2 Ų | 46.2 | 50% | 0.496 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61 | -48.2 | 175.4 | -179.4 | -84.6 | 0 | 0 | 0 | 112.1 | P266 S291 L292 Q293 L297 I298 T299 | P266-W295 HydrophobicContact CB-CZ2 4.28Å; P266-W295 PolarHBondContact O-NE1 3.27Å; P266-W295 VanDerWaalsContact O-NE1 3.11Å; S291-W295 WeakPolarHBondContact O-CB 3.3Å; S291-W295 PolarHBondContact O-N 3.33Å; L292-W295 WeakPolarHBondContact O-CB 3.4Å; L292-W295 PolarHBondContact O-N 3.43Å; Q293-W295 VanDerWaalsContact C-N 3.32Å; Q293-W295 PolarHBondContact O-N 2.82Å; W295-L297 VanDerWaalsContact C-N 3.31Å; W295-L297 PolarHBondContact O-N 3.06Å; W295-I298 PolarHBondContact O-N 3.29Å; W295-T299 HydrophobicContact CD2-CG2 4.2Å; W295-T299 HydrophobicContact CG-CG2 4.28Å; W295-T299 HydrophobicContact CZ2-CG2 4.23Å; W295-T299 WeakPolarHBondContact O-CB 3.36Å; W295-T299 VanDerWaalsContact O-CG2 3.29Å; W295-T299 WeakPolarHBondContact O-CG2 3.26Å; W295-T299 PolarHBondContact O-N 3.36Å; W295-T299 PolarHBondContact O-OG1 3.47Å |
| 296 | L | 88.9 | Confident | 87 | Confident | 16 Ų | 16 | 43.8 Ų | 43.8 | 8% | 0.084 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -58.9 | -43.4 | 178.4 | -79.1 | 171.2 | 0 | 0 | 0 | 111.4 | Y267 I271 D274 L292 Q293 T299 E300 | Y267-L296 HydrophobicContact CD2-CD2 4.23Å; Y267-L296 HydrophobicContact CE2-CD2 4.23Å; I271-L296 HydrophobicContact CG1-CD2 3.81Å; D274-L296 HydrophobicContact CB-CD1 4.15Å; L292-L296 HydrophobicContact CD1-CG 4.49Å; L292-L296 HydrophobicContact CG-CD1 4.28Å; L292-L296 WeakPolarHBondContact O-CB 3.2Å; L292-L296 VanDerWaalsContact O-CG 3.3Å; L292-L296 WeakPolarHBondContact O-CG 3.14Å; L292-L296 PolarHBondContact O-N 2.81Å; Q293-L296 PolarHBondContact O-N 3.36Å; L296-T299 WeakPolarHBondContact CA-OG1 3.43Å; L296-T299 PolarHBondContact O-N 3.1Å; L296-T299 PolarHBondContact O-OG1 2.96Å; L296-E300 WeakPolarHBondContact O-CB 3.5Å; L296-E300 PolarHBondContact O-N 2.99Å |
| 297 | L | 86.3 | Confident | 87.4 | Confident | 9 Ų | 9 | 40.7 Ų | 40.7 | 5% | 0.047 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.1 | -48.6 | 177.9 | -178.5 | 157.2 | 0 | 0 | 0 | 111.8 | F41 Q42 F45 L46 Q293 T294 W295 A301 | F41-L297 HydrophobicContact CE1-CD2 3.98Å; Q42-L297 HydrophobicContact CB-CD1 3.69Å; Q42-L297 HydrophobicContact CG-CD1 3.62Å; F45-L297 HydrophobicContact CD1-CD2 3.3Å; F45-L297 HydrophobicContact CE1-CD2 3.52Å; F45-L297 HydrophobicContact CG-CD2 4.21Å; L46-L297 HydrophobicContact CD2-CD2 4.35Å; L46-L297 HydrophobicContact CD2-CG 4.13Å; L46-L297 HydrophobicContact CG-CG 4.33Å; Q293-L297 WeakPolarHBondContact O-CB 3.33Å; Q293-L297 PolarHBondContact O-N 3.33Å; T294-L297 PolarHBondContact O-N 2.89Å; W295-L297 VanDerWaalsContact C-N 3.31Å; W295-L297 PolarHBondContact O-N 3.06Å; L297-A301 PolarHBondContact O-N 3.1Å |
| 298 | I | 88.9 | Confident | 87.5 | Confident | 80 Ų | 80 | 37.1 Ų | 37.1 | 41% | 0.41 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -66.8 | -42.4 | 179.3 | -66.4 | 169.7 | 0 | 0 | 0 | 110.9 | F45 T294 W295 A301 L302 | F45-I298 HydrophobicContact CZ-CG1 4.39Å; T294-I298 HydrophobicContact CG2-CD1 4.03Å; T294-I298 WeakPolarHBondContact O-CG1 3.23Å; T294-I298 PolarHBondContact O-N 2.97Å; T294-I298 VanDerWaalsContact O-N 3.09Å; W295-I298 PolarHBondContact O-N 3.29Å; I298-A301 WeakPolarHBondContact O-CB 3.46Å; I298-A301 PolarHBondContact O-N 3.45Å; I298-L302 PolarHBondContact O-N 3.35Å |
| 299 | T | 91.4 | Very high | 87.3 | Confident | 7 Ų | 7 | 35.6 Ų | 35.6 | 4% | 0.043 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -76.6 | -29.1 | -176.3 | 56.1 | 0 | 0 | 0 | 0 | 113.4 | P266 W295 L296 A301 L302 A303 | P266-T299 HydrophobicContact CB-CG2 3.43Å; P266-T299 VanDerWaalsContact CB-CG2 3.43Å; W295-T299 HydrophobicContact CD2-CG2 4.2Å; W295-T299 HydrophobicContact CG-CG2 4.28Å; W295-T299 HydrophobicContact CZ2-CG2 4.23Å; W295-T299 WeakPolarHBondContact O-CB 3.36Å; W295-T299 VanDerWaalsContact O-CG2 3.29Å; W295-T299 WeakPolarHBondContact O-CG2 3.26Å; W295-T299 PolarHBondContact O-N 3.36Å; W295-T299 PolarHBondContact O-OG1 3.47Å; L296-T299 WeakPolarHBondContact CA-OG1 3.43Å; L296-T299 PolarHBondContact O-N 3.1Å; L296-T299 PolarHBondContact O-OG1 2.96Å; T299-A301 VanDerWaalsContact C-N 3.34Å; T299-L302 PolarHBondContact O-N 3.34Å; T299-A303 WeakPolarHBondContact O-CB 3.49Å; T299-A303 PolarHBondContact O-N 3.29Å |
| 300 | E | 88.2 | Confident | 87.1 | Confident | 5 Ų | 5 | 34 Ų | 34 | 2% | 0.023 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61.9 | -44.8 | 169.3 | -170.2 | 178.8 | -134.2 | 0 | 0 | 110.2 | M1 S2 Y267 L296 L302 A303 Y304 | M1-E300 WeakPolarHBondContact CB-OE1 3.4Å; M1-E300 PolarHBondContact N-OE1 3.12Å; S2-E300 PolarHBondContact OG-OE2 2.91Å; Y267-E300 HydrophobicContact CD2-CB 3.84Å; Y267-E300 HydrophobicContact CD2-CG 4.49Å; Y267-E300 HydrophobicContact CE2-CB 3.51Å; Y267-E300 HydrophobicContact CE2-CG 3.82Å; Y267-E300 PolarHBondContact OH-OE1 3.46Å; L296-E300 WeakPolarHBondContact O-CB 3.5Å; L296-E300 PolarHBondContact O-N 2.99Å; E300-L302 VanDerWaalsContact C-N 3.34Å; E300-L302 PolarHBondContact O-N 3.28Å; E300-A303 WeakPolarHBondContact O-CB 3.38Å; E300-A303 PolarHBondContact O-N 3.41Å; E300-A303 VanDerWaalsContact O-N 3.16Å; E300-Y304 HydrophobicContact CG-CD2 4.24Å; E300-Y304 HydrophobicContact CG-CE2 3.74Å; E300-Y304 VanDerWaalsContact O-CD2 3.26Å; E300-Y304 WeakPolarHBondContact O-CD2 3.49Å; E300-Y304 PolarHBondContact O-N 3.34Å |
| 301 | A | 88.1 | Confident | 86.9 | Confident | 5 Ų | 5 | 30.2 Ų | 30.2 | 4% | 0.041 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -61.9 | -41 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | F45 V49 L297 I298 T299 A303 Y304 F305 | F45-A301 HydrophobicContact CE1-CB 3.93Å; F45-A301 HydrophobicContact CZ-CB 4.38Å; V49-A301 HydrophobicContact CG1-CB 3.89Å; L297-A301 PolarHBondContact O-N 3.1Å; I298-A301 WeakPolarHBondContact O-CB 3.46Å; I298-A301 PolarHBondContact O-N 3.45Å; T299-A301 VanDerWaalsContact C-N 3.34Å; A301-A303 VanDerWaalsContact C-N 3.35Å; A301-Y304 PolarHBondContact O-N 3.29Å; A301-F305 PolarHBondContact O-N 3.39Å; A301-F305 VanDerWaalsContact O-N 3.16Å |
| 302 | L | 89.8 | Confident | 86.3 | Confident | 72 Ų | 72 | 29.7 Ų | 29.7 | 38% | 0.377 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -64.2 | -38.3 | 173.3 | -178.9 | 63.4 | 0 | 0 | 0 | 112.3 | P266 I298 T299 E300 F305 | P266-L302 HydrophobicContact CG-CD2 4.24Å; I298-L302 PolarHBondContact O-N 3.35Å; T299-L302 PolarHBondContact O-N 3.34Å; E300-L302 VanDerWaalsContact C-N 3.34Å; E300-L302 PolarHBondContact O-N 3.28Å; L302-F305 VanDerWaalsContact O-CB 3.3Å; L302-F305 WeakPolarHBondContact O-CB 3.45Å; L302-F305 PolarHBondContact O-N 2.6Å |
| 303 | A | 89.8 | Confident | 85.4 | Confident | 3 Ų | 3 | 30.4 Ų | 30.4 | 3% | 0.025 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -62.8 | -43.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111 | C263 W264 Y267 T299 E300 A301 F305 H306 | C263-A303 WeakPolarHBondContact O-CA 3.29Å; C263-A303 PolarHBondContact O-N 2.92Å; W264-A303 HydrophobicContact CD2-CB 4.06Å; W264-A303 HydrophobicContact CE3-CB 3.98Å; W264-A303 HydrophobicContact CH2-CB 4.31Å; W264-A303 HydrophobicContact CZ2-CB 4.44Å; W264-A303 HydrophobicContact CZ3-CB 4.1Å; Y267-A303 HydrophobicContact CG-CB 4.49Å; T299-A303 WeakPolarHBondContact O-CB 3.49Å; T299-A303 PolarHBondContact O-N 3.29Å; E300-A303 WeakPolarHBondContact O-CB 3.38Å; E300-A303 PolarHBondContact O-N 3.41Å; E300-A303 VanDerWaalsContact O-N 3.16Å; A301-A303 VanDerWaalsContact C-N 3.35Å; A303-F305 VanDerWaalsContact C-N 3.26Å; A303-F305 PolarHBondContact O-N 3.16Å; A303-H306 WeakPolarHBondContact O-CB 3.39Å; A303-H306 PolarHBondContact O-N 2.76Å; A303-H306 PolarHBondContact O-ND1 3.36Å |
| 304 | Y | 89.7 | Confident | 84.7 | Confident | 7 Ų | 7 | 29.4 Ų | 29.4 | 3% | 0.027 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -60.7 | -34.4 | 173.5 | -74.1 | -54.3 | 0 | 0 | 0 | 113.1 | Y50 L92 Y121 E300 A301 H306 C307 | Y50-Y304 HydrophobicContact CD1-CD2 4.43Å; Y50-Y304 AromaticContact CE1-CD2 3.68Å; Y50-Y304 HydrophobicContact CE1-CD2 3.68Å; Y50-Y304 AromaticContact CE1-CE2 3.75Å; Y50-Y304 HydrophobicContact CE1-CE2 3.75Å; L92-Y304 HydrophobicContact CD1-CD1 4.48Å; L92-Y304 HydrophobicContact CD1-CE1 4.09Å; L92-Y304 HydrophobicContact CD2-CD1 4.07Å; L92-Y304 HydrophobicContact CD2-CE1 4.4Å; Y121-Y304 AromaticContact CD2-CE1 3.64Å; Y121-Y304 HydrophobicContact CD2-CE1 3.64Å; Y121-Y304 AromaticContact CD2-CZ 3.95Å; Y121-Y304 WeakPolarHBondContact CD2-OH 3.27Å; Y121-Y304 AromaticContact CE2-CE1 3.45Å; Y121-Y304 HydrophobicContact CE2-CE1 3.45Å; Y121-Y304 VanDerWaalsContact CE2-CE1 3.45Å; Y121-Y304 AromaticContact CE2-CZ 3.63Å; Y121-Y304 WeakPolarHBondContact CE2-OH 3.16Å; E300-Y304 HydrophobicContact CG-CD2 4.24Å; E300-Y304 HydrophobicContact CG-CE2 3.74Å; E300-Y304 VanDerWaalsContact O-CD2 3.26Å; E300-Y304 WeakPolarHBondContact O-CD2 3.49Å; E300-Y304 PolarHBondContact O-N 3.34Å; A301-Y304 PolarHBondContact O-N 3.29Å; Y304-H306 PolarHBondContact O-N 3.4Å; Y304-C307 PolarHBondContact O-N 3.3Å; Y304-C307 PolarHBondContact O-SG 2.91Å |
| 305 | F | 89.9 | Confident | 83.7 | Confident | 63 Ų | 63 | 28 Ų | 28 | 28% | 0.276 | 14% | 0.14 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -59.5 | -18.6 | -179.7 | -153.4 | -99.6 | 0 | 0 | 0 | 113.7 | I53 L56 A301 L302 A303 C307 C308 L309 | I53-F305 HydrophobicContact CD1-CB 4.47Å; I53-F305 HydrophobicContact CD1-CD2 4.22Å; I53-F305 HydrophobicContact CG1-CD2 3.81Å; I53-F305 HydrophobicContact CG1-CE2 4.46Å; L56-F305 HydrophobicContact CD1-CE2 4.12Å; L56-F305 HydrophobicContact CD1-CZ 4.17Å; A301-F305 PolarHBondContact O-N 3.39Å; A301-F305 VanDerWaalsContact O-N 3.16Å; L302-F305 VanDerWaalsContact O-CB 3.3Å; L302-F305 WeakPolarHBondContact O-CB 3.45Å; L302-F305 PolarHBondContact O-N 2.6Å; A303-F305 VanDerWaalsContact C-N 3.26Å; A303-F305 PolarHBondContact O-N 3.16Å; F305-C307 PolarHBondContact O-N 2.87Å; F305-C308 PolarHBondContact O-N 3.18Å; F305-L309 HydrophobicContact CD1-CD1 3.88Å; F305-L309 HydrophobicContact CD1-CD2 3.99Å; F305-L309 HydrophobicContact CD1-CG 3.74Å; F305-L309 HydrophobicContact CE1-CD1 4.45Å; F305-L309 HydrophobicContact CE1-CD2 3.73Å; F305-L309 HydrophobicContact CE1-CG 4.01Å; F305-L309 PolarHBondContact O-N 3.35Å |
| 306 | H | 88.9 | Confident | 82.2 | Confident | 5 Ų | 5 | 28.8 Ų | 28.8 | 2% | 0.023 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -55 | -35.1 | 176.1 | 91.1 | -82.1 | 0 | 0 | 0 | 112.9 | D89 C263 W264 A303 Y304 C308 L309 N310 | D89-H306 IonicContact OD1-NE2 3.86Å; C263-H306 HydrophobicContact CB-CB 3.98Å; W264-H306 AromaticContact CE2-ND1 3.82Å; W264-H306 AromaticContact CZ2-CE1 3.64Å; W264-H306 AromaticContact CZ2-ND1 3.65Å; W264-H306 AromaticContact NE1-CD2 3.86Å; W264-H306 AromaticContact NE1-CE1 3.93Å; W264-H306 AromaticContact NE1-CG 3.4Å; W264-H306 AromaticContact NE1-ND1 3.45Å; W264-H306 PolarHBondContact NE1-ND1 3.35Å; A303-H306 WeakPolarHBondContact O-CB 3.39Å; A303-H306 PolarHBondContact O-N 2.76Å; A303-H306 PolarHBondContact O-ND1 3.36Å; Y304-H306 PolarHBondContact O-N 3.4Å; H306-C308 PolarHBondContact O-N 3.05Å; H306-L309 PolarHBondContact O-N 2.89Å; H306-N310 PolarHBondContact O-N 2.95Å |
| 307 | C | 88.6 | Confident | 80.5 | Confident | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -67.1 | -24.3 | -178.3 | 70.3 | 0 | 0 | 0 | 0 | 112.4 | I53 N61 D89 Y304 F305 | I53-C307 VanDerWaalsContact CG2-SG 3.57Å; N61-C307 PolarHBondContact ND2-O 3.24Å; D89-C307 HydrophobicContact CB-CB 3.94Å; Y304-C307 PolarHBondContact O-N 3.3Å; Y304-C307 PolarHBondContact O-SG 2.91Å; F305-C307 PolarHBondContact O-N 2.87Å |
| 308 | C | 86.8 | Confident | 79 | Confident | 2 Ų | 2 | 30.4 Ų | 30.4 | 1% | 0.014 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -86.8 | -28.7 | 177.8 | -64 | 0 | 0 | 0 | 0 | 112.6 | I53 L56 F305 H306 I312 | I53-C308 PolarHBondContact O-SG 3.39Å; I53-C308 VanDerWaalsContact O-SG 3.35Å; L56-C308 HydrophobicContact CB-CB 4.17Å; F305-C308 PolarHBondContact O-N 3.18Å; H306-C308 PolarHBondContact O-N 3.05Å; C308-I312 WeakPolarHBondContact O-CD1 3.36Å; C308-I312 WeakPolarHBondContact O-CG1 3.39Å |
| 309 | L | 80.3 | Confident | 77.3 | Confident | 39 Ų | 39 | 32.7 Ų | 32.7 | 20% | 0.204 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -72.7 | -31.5 | -176.8 | -68.3 | 175 | 0 | 0 | 0 | 112 | C259 C263 F305 H306 I312 L313 | C259-L309 WeakPolarHBondContact SG-CB 3.48Å; C259-L309 WeakPolarHBondContact SG-CD1 3.39Å; C263-L309 VanDerWaalsContact SG-CD1 3.59Å; F305-L309 HydrophobicContact CD1-CD1 3.88Å; F305-L309 HydrophobicContact CD1-CD2 3.99Å; F305-L309 HydrophobicContact CD1-CG 3.74Å; F305-L309 HydrophobicContact CE1-CD1 4.45Å; F305-L309 HydrophobicContact CE1-CD2 3.73Å; F305-L309 HydrophobicContact CE1-CG 4.01Å; F305-L309 PolarHBondContact O-N 3.35Å; H306-L309 PolarHBondContact O-N 2.89Å; L309-I312 PolarHBondContact O-N 3.45Å; L309-L313 HydrophobicContact CB-CD1 4.49Å; L309-L313 WeakPolarHBondContact O-CB 3.27Å; L309-L313 WeakPolarHBondContact O-CG 3.39Å; L309-L313 PolarHBondContact O-N 3.09Å |
| 310 | N | 79.8 | Confident | 75.5 | Confident | 6 Ų | 6 | 41.2 Ų | 41.2 | 3% | 0.032 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -51.7 | -58.3 | 178.9 | -72.8 | -27.3 | 0 | 0 | 0 | 112.6 | L85 D89 H306 I312 L313 Y314 | L85-N310 HydrophobicContact CD2-CB 4.41Å; D89-N310 PolarHBondContact OD2-ND2 3.17Å; H306-N310 PolarHBondContact O-N 2.95Å; N310-I312 PolarHBondContact O-N 3.02Å; N310-L313 PolarHBondContact O-N 2.98Å; N310-Y314 HydrophobicContact CB-CE2 4.24Å; N310-Y314 WeakPolarHBondContact O-CD2 3.28Å; N310-Y314 VanDerWaalsContact O-CE2 3.29Å; N310-Y314 WeakPolarHBondContact O-CE2 3.26Å; N310-Y314 VanDerWaalsContact O-CG 3.3Å; N310-Y314 PolarHBondContact O-N 3.5Å |
| 311 | P | 78.5 | Confident | 74 | Confident | 7 Ų | 7 | 42.3 Ų | 42.3 | 5% | 0.045 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.1 | -42.5 | 174.3 | -26.9 | 33.4 | 0 | 0 | 0 | 115.5 | G60 N61 V64 L313 Y314 A315 | G60-P311 VanDerWaalsContact C-CB 3.49Å; N61-P311 HydrophobicContact CB-CG 4.3Å; N61-P311 WeakPolarHBondContact OD1-CG 3.38Å; V64-P311 HydrophobicContact CG2-CB 4.02Å; V64-P311 HydrophobicContact CG2-CG 4.22Å; P311-L313 VanDerWaalsContact C-N 3.3Å; P311-L313 PolarHBondContact O-N 2.98Å; P311-Y314 PolarHBondContact O-N 3.35Å; P311-Y314 VanDerWaalsContact O-N 3.14Å; P311-A315 WeakPolarHBondContact O-CB 3.41Å; P311-A315 PolarHBondContact O-N 3.13Å |
| 312 | I | 72.5 | Confident | 72.7 | Confident | 65 Ų | 65 | 47.4 Ų | 47.4 | 33% | 0.333 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -58.9 | -47.6 | -179.5 | -69.2 | 172.8 | 0 | 0 | 0 | 109.2 | C308 L309 N310 Y314 A315 F316 | C308-I312 WeakPolarHBondContact O-CD1 3.36Å; C308-I312 WeakPolarHBondContact O-CG1 3.39Å; L309-I312 PolarHBondContact O-N 3.45Å; N310-I312 PolarHBondContact O-N 3.02Å; I312-Y314 VanDerWaalsContact C-N 3.3Å; I312-Y314 PolarHBondContact O-N 3.43Å; I312-A315 PolarHBondContact O-N 2.98Å; I312-A315 VanDerWaalsContact O-N 3.16Å; I312-F316 HydrophobicContact CG2-CD2 3.67Å; I312-F316 HydrophobicContact CG2-CE2 3.85Å; I312-F316 VanDerWaalsContact O-CD2 3.26Å; I312-F316 WeakPolarHBondContact O-CD2 3.19Å; I312-F316 PolarHBondContact O-N 3.44Å |
| 313 | L | 69.3 | Low | 71.3 | Confident | 27 Ų | 27 | 50.9 Ų | 50.9 | 14% | 0.141 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.2 | -37.3 | 178 | -68.2 | 175.8 | 0 | 0 | 0 | 111.8 | I255 L256 C259 L309 N310 P311 L317 | I255-L313 HydrophobicContact CG2-CD1 4.03Å; I255-L313 HydrophobicContact CG2-CD2 3.38Å; I255-L313 HydrophobicContact CG2-CG 4.29Å; L256-L313 HydrophobicContact CD2-CB 3.97Å; L256-L313 HydrophobicContact CD2-CD1 3.7Å; L256-L313 HydrophobicContact CD2-CG 4.49Å; L256-L313 HydrophobicContact CG-CD1 4.34Å; C259-L313 HydrophobicContact CB-CD1 3.87Å; L309-L313 HydrophobicContact CB-CD1 4.49Å; L309-L313 WeakPolarHBondContact O-CB 3.27Å; L309-L313 WeakPolarHBondContact O-CG 3.39Å; L309-L313 PolarHBondContact O-N 3.09Å; N310-L313 PolarHBondContact O-N 2.98Å; P311-L313 VanDerWaalsContact C-N 3.3Å; P311-L313 PolarHBondContact O-N 2.98Å; L313-L317 HydrophobicContact CB-CD1 4.33Å; L313-L317 HydrophobicContact CD2-CD1 4.2Å; L313-L317 WeakPolarHBondContact O-CB 3.44Å; L313-L317 WeakPolarHBondContact O-CD1 3.37Å; L313-L317 VanDerWaalsContact O-CG 3.22Å; L313-L317 WeakPolarHBondContact O-CG 3.46Å; L313-L317 PolarHBondContact O-N 2.97Å |
| 314 | Y | 68.1 | Low | 69.9 | Low | 6 Ų | 6 | 52.1 Ų | 52.1 | 2% | 0.024 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -67.4 | -42.1 | 173.2 | -57.2 | -38.6 | 0 | 0 | 0 | 113.1 | V64 R82 T252 L256 N310 P311 I312 G318 | V64-Y314 HydrophobicContact CG2-CD2 4.24Å; R82-Y314 HydrophobicContact CB-CE2 4.41Å; R82-Y314 HydrophobicContact CG-CE1 3.98Å; R82-Y314 HydrophobicContact CG-CE2 4.02Å; T252-Y314 HydrophobicContact CG2-CD1 4.27Å; T252-Y314 HydrophobicContact CG2-CE1 4.5Å; L256-Y314 HydrophobicContact CD1-CE1 3.66Å; L256-Y314 HydrophobicContact CD2-CE1 3.92Å; L256-Y314 HydrophobicContact CG-CE1 4.37Å; N310-Y314 HydrophobicContact CB-CE2 4.24Å; N310-Y314 WeakPolarHBondContact O-CD2 3.28Å; N310-Y314 VanDerWaalsContact O-CE2 3.29Å; N310-Y314 WeakPolarHBondContact O-CE2 3.26Å; N310-Y314 VanDerWaalsContact O-CG 3.3Å; N310-Y314 PolarHBondContact O-N 3.5Å; P311-Y314 PolarHBondContact O-N 3.35Å; P311-Y314 VanDerWaalsContact O-N 3.14Å; I312-Y314 VanDerWaalsContact C-N 3.3Å; I312-Y314 PolarHBondContact O-N 3.43Å; Y314-G318 WeakPolarHBondContact O-CA 3.15Å; Y314-G318 PolarHBondContact O-N 3.14Å |
| 315 | A | 63.9 | Low | 68.6 | Low | 32 Ų | 32 | 52.4 Ų | 52.4 | 26% | 0.264 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -67.4 | -44 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | P311 I312 F321 K322 | P311-A315 WeakPolarHBondContact O-CB 3.41Å; P311-A315 PolarHBondContact O-N 3.13Å; I312-A315 PolarHBondContact O-N 2.98Å; I312-A315 VanDerWaalsContact O-N 3.16Å; A315-F321 HydrophobicContact CB-CD1 4.3Å; A315-F321 HydrophobicContact CB-CE1 4.31Å; A315-K322 WeakPolarHBondContact O-CE 3.3Å; A315-K322 WeakPolarHBondContact O-CG 3.21Å |
| 316 | F | 57.4 | Low | 67.6 | Low | 149 Ų | 149 | 58.5 Ų | 58.5 | 65% | 0.654 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -78.8 | -31.1 | -178.6 | -75 | -77.5 | 0 | 0 | 0 | 113.3 | I312 | I312-F316 HydrophobicContact CG2-CD2 3.67Å; I312-F316 HydrophobicContact CG2-CE2 3.85Å; I312-F316 VanDerWaalsContact O-CD2 3.26Å; I312-F316 WeakPolarHBondContact O-CD2 3.19Å; I312-F316 PolarHBondContact O-N 3.44Å |
| 317 | L | 53.8 | Low | 66.7 | Low | 38 Ų | 38 | 62.3 Ų | 62.3 | 20% | 0.199 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -98 | -17.7 | -173.8 | -55.8 | 168.4 | 0 | 0 | 0 | 113.8 | K251 T252 I255 L313 | K251-L317 HydrophobicContact CG-CD2 4.41Å; T252-L317 HydrophobicContact CG2-CD1 4.48Å; I255-L317 HydrophobicContact CB-CD1 4.24Å; I255-L317 HydrophobicContact CD1-CD1 3.73Å; I255-L317 HydrophobicContact CD1-CD2 4.04Å; I255-L317 HydrophobicContact CG2-CD1 4.26Å; L313-L317 HydrophobicContact CB-CD1 4.33Å; L313-L317 HydrophobicContact CD2-CD1 4.2Å; L313-L317 WeakPolarHBondContact O-CB 3.44Å; L313-L317 WeakPolarHBondContact O-CD1 3.37Å; L313-L317 VanDerWaalsContact O-CG 3.22Å; L313-L317 WeakPolarHBondContact O-CG 3.46Å; L313-L317 PolarHBondContact O-N 2.97Å |
| 318 | G | 54.8 | Low | 65.7 | Low | 21 Ų | 21 | 63 Ų | 63 | 22% | 0.216 | 31% | 0.312 | C | S | . | . | trans | -101.3 | 95.1 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | Y314 K320 F321 K322 | Y314-G318 WeakPolarHBondContact O-CA 3.15Å; Y314-G318 PolarHBondContact O-N 3.14Å; G318-K320 PolarHBondContact O-N 2.86Å; G318-K320 VanDerWaalsContact O-N 3.13Å; G318-F321 WeakPolarHBondContact O-CB 3.43Å; G318-F321 PolarHBondContact O-N 2.86Å; G318-K322 PolarHBondContact O-N 3.41Å | ||
| 319 | V | 53 | Low | 64.9 | Low | 128 Ų | 128 | 67.7 Ų | 67.7 | 78% | 0.776 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -55.7 | -32.4 | 171.8 | -163.6 | 0 | 0 | 0 | 0 | 111.6 | K323 | V319-K323 PolarHBondContact O-N 3.16Å |
| 320 | K | 55.2 | Low | 64.4 | Low | 185 Ų | 185 | 68 Ų | 68 | 80% | 0.804 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -69.6 | -36.8 | 173.9 | -68.6 | -174 | 177 | -175.4 | 0 | 113.3 | G318 K323 S324 | G318-K320 PolarHBondContact O-N 2.86Å; G318-K320 VanDerWaalsContact O-N 3.13Å; K320-K323 PolarHBondContact O-N 3.22Å; K320-S324 PolarHBondContact O-N 3.47Å; K320-S324 PolarHBondContact O-OG 3.02Å |
| 321 | F | 55.3 | Low | 63.4 | Low | 28 Ų | 28 | 71.7 Ų | 71.7 | 12% | 0.123 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -69.4 | -43 | 178.4 | -171.5 | -94.5 | 0 | 0 | 0 | 110.6 | L63 V64 V67 A315 G318 K323 S324 A325 | L63-F321 HydrophobicContact CD2-CE1 4.4Å; L63-F321 HydrophobicContact CG-CZ 4.48Å; V64-F321 HydrophobicContact CG2-CE2 4.19Å; V64-F321 HydrophobicContact CG2-CZ 3.88Å; V67-F321 HydrophobicContact CB-CE2 4.27Å; V67-F321 HydrophobicContact CG1-CD2 4.44Å; V67-F321 HydrophobicContact CG1-CE2 4.12Å; V67-F321 HydrophobicContact CG2-CZ 4.47Å; A315-F321 HydrophobicContact CB-CD1 4.3Å; A315-F321 HydrophobicContact CB-CE1 4.31Å; G318-F321 WeakPolarHBondContact O-CB 3.43Å; G318-F321 PolarHBondContact O-N 2.86Å; F321-K323 VanDerWaalsContact C-N 3.31Å; F321-K323 PolarHBondContact O-N 2.89Å; F321-S324 PolarHBondContact O-N 3.46Å; F321-A325 HydrophobicContact CE1-CB 4.47Å; F321-A325 VanDerWaalsContact O-CB 3.24Å; F321-A325 WeakPolarHBondContact O-CB 3.45Å; F321-A325 PolarHBondContact O-N 2.88Å |
| 322 | K | 60.4 | Low | 62.3 | Low | 112 Ų | 112 | 74.1 Ų | 74.1 | 49% | 0.487 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -56.1 | -42.9 | 174 | -65.6 | -173 | -178.9 | -173.3 | 0 | 112.7 | A315 G318 R326 | A315-K322 WeakPolarHBondContact O-CE 3.3Å; A315-K322 WeakPolarHBondContact O-CG 3.21Å; G318-K322 PolarHBondContact O-N 3.41Å; K322-R326 WeakPolarHBondContact O-CB 3.26Å; K322-R326 PolarHBondContact O-N 3.4Å; K322-R326 VanDerWaalsContact O-N 3.09Å |
| 323 | K | 62.1 | Low | 61.4 | Low | 145 Ų | 145 | 74 Ų | 74 | 63% | 0.63 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -66.7 | -49.3 | 177 | -171.9 | 171.3 | -179.1 | 170.1 | 0 | 111.7 | V319 K320 F321 A325 R326 D327 | V319-K323 PolarHBondContact O-N 3.16Å; K320-K323 PolarHBondContact O-N 3.22Å; F321-K323 VanDerWaalsContact C-N 3.31Å; F321-K323 PolarHBondContact O-N 2.89Å; K323-A325 PolarHBondContact O-N 2.82Å; K323-R326 PolarHBondContact O-N 2.98Å; K323-D327 PolarHBondContact O-N 2.82Å |
| 324 | S | 59.8 | Low | 60.5 | Low | 30 Ų | 30 | 81.7 Ų | 81.7 | 21% | 0.21 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -65.4 | -34.6 | 178 | -69.2 | 0 | 0 | 0 | 0 | 114 | Q71 K320 F321 D327 A328 | Q71-S324 VanDerWaalsContact NE2-CB 3.32Å; Q71-S324 PolarHBondContact NE2-OG 3.2Å; K320-S324 PolarHBondContact O-N 3.47Å; K320-S324 PolarHBondContact O-OG 3.02Å; F321-S324 PolarHBondContact O-N 3.46Å; S324-D327 PolarHBondContact O-N 3.03Å; S324-A328 WeakPolarHBondContact O-CB 3.1Å; S324-A328 PolarHBondContact O-N 3.47Å |
| 325 | A | 61.5 | Low | 59.6 | Low | 12 Ų | 12 | 84.9 Ų | 84.9 | 10% | 0.099 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -65.7 | -44.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | V67 F321 K323 D327 A328 L329 | V67-A325 HydrophobicContact CG2-CB 4.03Å; F321-A325 HydrophobicContact CE1-CB 4.47Å; F321-A325 VanDerWaalsContact O-CB 3.24Å; F321-A325 WeakPolarHBondContact O-CB 3.45Å; F321-A325 PolarHBondContact O-N 2.88Å; K323-A325 PolarHBondContact O-N 2.82Å; A325-D327 VanDerWaalsContact C-N 3.34Å; A325-D327 PolarHBondContact O-N 2.99Å; A325-A328 PolarHBondContact O-N 3.44Å; A325-L329 WeakPolarHBondContact O-CB 3.49Å; A325-L329 VanDerWaalsContact O-CG 3.23Å; A325-L329 WeakPolarHBondContact O-CG 3.12Å; A325-L329 PolarHBondContact O-N 3.36Å |
| 326 | R | 70.3 | Confident | 58.9 | Low | 192 Ų | 192 | 87.3 Ų | 87.3 | 73% | 0.725 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -59.5 | -45.3 | 173.2 | -172.2 | -175.7 | -64.8 | -146.8 | -1.8 | 111.6 | K322 K323 A330 | K322-R326 WeakPolarHBondContact O-CB 3.26Å; K322-R326 PolarHBondContact O-N 3.4Å; K322-R326 VanDerWaalsContact O-N 3.09Å; K323-R326 PolarHBondContact O-N 2.98Å; R326-A330 VanDerWaalsContact O-CB 3.25Å; R326-A330 WeakPolarHBondContact O-CB 3.13Å; R326-A330 PolarHBondContact O-N 2.99Å |
| 327 | D | 69.6 | Low | 58.4 | Low | 84 Ų | 84 | 86 Ų | 86 | 45% | 0.449 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -64.5 | -41.9 | 179.3 | -64 | -19.6 | 0 | 0 | 0 | 111.4 | K323 S324 A325 V331 | K323-D327 PolarHBondContact O-N 2.82Å; S324-D327 PolarHBondContact O-N 3.03Å; A325-D327 VanDerWaalsContact C-N 3.34Å; A325-D327 PolarHBondContact O-N 2.99Å; D327-V331 VanDerWaalsContact O-CG2 3.25Å; D327-V331 WeakPolarHBondContact O-CG2 3.36Å; D327-V331 PolarHBondContact O-N 3.3Å |
| 328 | A | 66.3 | Low | 58 | Low | 16 Ų | 16 | 91.9 Ų | 91.9 | 13% | 0.132 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -68 | -43.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | V67 S324 A325 A330 V331 S332 | V67-A328 HydrophobicContact CG2-CB 4.22Å; S324-A328 WeakPolarHBondContact O-CB 3.1Å; S324-A328 PolarHBondContact O-N 3.47Å; A325-A328 PolarHBondContact O-N 3.44Å; A328-A330 VanDerWaalsContact C-N 3.34Å; A328-A330 PolarHBondContact O-N 3Å; A328-V331 PolarHBondContact O-N 3.37Å; A328-S332 PolarHBondContact O-N 3.44Å |
| 329 | L | 71.3 | Confident | 57.7 | Low | 99 Ų | 99 | 96 Ų | 96 | 52% | 0.518 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.7 | -41.4 | 175.9 | -71.5 | 168.7 | 0 | 0 | 0 | 111.2 | A325 V331 S332 S333 | A325-L329 WeakPolarHBondContact O-CB 3.49Å; A325-L329 VanDerWaalsContact O-CG 3.23Å; A325-L329 WeakPolarHBondContact O-CG 3.12Å; A325-L329 PolarHBondContact O-N 3.36Å; L329-V331 PolarHBondContact O-N 3.32Å; L329-S332 PolarHBondContact O-N 2.95Å; L329-S332 PolarHBondContact O-OG 3.27Å; L329-S333 WeakPolarHBondContact O-CB 3.37Å; L329-S333 PolarHBondContact O-N 3.08Å |
| 330 | A | 68.4 | Low | 57.3 | Low | 46 Ų | 46 | 96.1 Ų | 96.1 | 38% | 0.38 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.3 | -36 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | R326 A328 R334 | R326-A330 VanDerWaalsContact O-CB 3.25Å; R326-A330 WeakPolarHBondContact O-CB 3.13Å; R326-A330 PolarHBondContact O-N 2.99Å; A328-A330 VanDerWaalsContact C-N 3.34Å; A328-A330 PolarHBondContact O-N 3Å; A330-R334 WeakPolarHBondContact O-CG 3.05Å; A330-R334 PolarHBondContact O-N 3.33Å |
| 331 | V | 60.1 | Low | 56.9 | Low | 84 Ų | 84 | 91.8 Ų | 91.8 | 51% | 0.509 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -70.8 | -40.1 | 174.7 | 170.6 | 0 | 0 | 0 | 0 | 111.4 | D327 A328 L329 S333 R334 S335 | D327-V331 VanDerWaalsContact O-CG2 3.25Å; D327-V331 WeakPolarHBondContact O-CG2 3.36Å; D327-V331 PolarHBondContact O-N 3.3Å; A328-V331 PolarHBondContact O-N 3.37Å; L329-V331 PolarHBondContact O-N 3.32Å; V331-S333 VanDerWaalsContact C-N 3.32Å; V331-S333 PolarHBondContact O-N 3.49Å; V331-R334 PolarHBondContact O-N 3.34Å; V331-S335 PolarHBondContact O-N 2.68Å |
| 332 | S | 54.1 | Low | 56.3 | Low | 57 Ų | 57 | 99.2 Ų | 99.2 | 40% | 0.399 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62 | -40.4 | 174.8 | 86 | 0 | 0 | 0 | 0 | 111.6 | A328 L329 S335 S336 | A328-S332 PolarHBondContact O-N 3.44Å; L329-S332 PolarHBondContact O-N 2.95Å; L329-S332 PolarHBondContact O-OG 3.27Å; S332-S335 WeakPolarHBondContact O-CB 3.38Å; S332-S335 PolarHBondContact O-N 3.12Å; S332-S336 PolarHBondContact O-N 3Å; S332-S336 PolarHBondContact O-OG 2.83Å |
| 333 | S | 53.7 | Low | 55.4 | Low | 62 Ų | 62 | 103.3 Ų | 103.3 | 43% | 0.434 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64 | -41.2 | 175.4 | 174.5 | 0 | 0 | 0 | 0 | 112.4 | L329 V331 S336 H337 | L329-S333 WeakPolarHBondContact O-CB 3.37Å; L329-S333 PolarHBondContact O-N 3.08Å; V331-S333 VanDerWaalsContact C-N 3.32Å; V331-S333 PolarHBondContact O-N 3.49Å; S333-S336 PolarHBondContact O-N 3.39Å; S333-H337 PolarHBondContact O-CD2 2.74Å; S333-H337 PolarHBondContact O-N 3.31Å |
| 334 | R | 51.8 | Low | 54.4 | Low | 190 Ų | 190 | 107.6 Ų | 107.6 | 72% | 0.717 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -68.3 | -31.9 | 174.3 | -73.9 | 177.8 | -177.2 | -171.6 | 0.5 | 113.1 | A330 V331 K338 | A330-R334 WeakPolarHBondContact O-CG 3.05Å; A330-R334 PolarHBondContact O-N 3.33Å; V331-R334 PolarHBondContact O-N 3.34Å; R334-K338 PolarHBondContact O-N 2.92Å; R334-K338 VanDerWaalsContact O-N 3.17Å |
| 335 | S | 49.4 | Very low | 53.6 | Low | 72 Ų | 72 | 109.2 Ų | 109.2 | 50% | 0.503 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.8 | -42.8 | 174.4 | -164.5 | 0 | 0 | 0 | 0 | 111.2 | V331 S332 H337 K338 V339 | V331-S335 PolarHBondContact O-N 2.68Å; S332-S335 WeakPolarHBondContact O-CB 3.38Å; S332-S335 PolarHBondContact O-N 3.12Å; S335-H337 PolarHBondContact O-N 3.43Å; S335-K338 PolarHBondContact O-N 2.67Å; S335-V339 PolarHBondContact O-N 3.29Å |
| 336 | S | 47.7 | Very low | 52.7 | Low | 83 Ų | 83 | 113.1 Ų | 113.1 | 58% | 0.58 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -63.6 | -37.2 | 174.3 | -64 | 0 | 0 | 0 | 0 | 112.8 | S332 S333 V339 L340 | S332-S336 PolarHBondContact O-N 3Å; S332-S336 PolarHBondContact O-OG 2.83Å; S333-S336 PolarHBondContact O-N 3.39Å; S336-V339 PolarHBondContact O-N 2.05Å; S336-L340 PolarHBondContact O-N 3.44Å |
| 337 | H | 47.9 | Very low | 51.6 | Low | 123 Ų | 123 | 112.2 Ų | 112.2 | 57% | 0.569 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -67.6 | -33.9 | 174.3 | -94.1 | -78.8 | 0 | 0 | 0 | 113.8 | S333 S335 L340 T341 | S333-H337 PolarHBondContact O-CD2 2.74Å; S333-H337 PolarHBondContact O-N 3.31Å; S335-H337 PolarHBondContact O-N 3.43Å; H337-L340 PolarHBondContact O-N 3.21Å; H337-T341 PolarHBondContact O-N 3.34Å; H337-T341 VanDerWaalsContact O-N 3.09Å; H337-T341 PolarHBondContact O-OG1 2.98Å; H337-T341 VanDerWaalsContact O-OG1 3.05Å |
| 338 | K | 45.4 | Very low | 50.1 | Low | 161 Ų | 161 | 113.6 Ų | 113.6 | 70% | 0.7 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -71.5 | -30.6 | 176 | -81.8 | -174.6 | 173.8 | -172.8 | 0 | 113.3 | R334 S335 T341 K342 | R334-K338 PolarHBondContact O-N 2.92Å; R334-K338 VanDerWaalsContact O-N 3.17Å; S335-K338 PolarHBondContact O-N 2.67Å; K338-T341 PolarHBondContact O-OG1 2.95Å; K338-K342 WeakPolarHBondContact O-CB 3.41Å; K338-K342 PolarHBondContact O-N 3.02Å |
| 339 | V | 48.1 | Very low | 48.8 | Very low | 107 Ų | 107 | 118 Ų | 118 | 65% | 0.648 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -72.6 | -35.2 | 174.6 | 174.7 | 0 | 0 | 0 | 0 | 110.8 | S335 S336 | S335-V339 PolarHBondContact O-N 3.29Å; S336-V339 PolarHBondContact O-N 2.05Å |
| 340 | L | 45.5 | Very low | 47.1 | Very low | 131 Ų | 131 | 119.6 Ų | 119.6 | 69% | 0.686 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -76 | -33.3 | 179 | -151.6 | 75.6 | 0 | 0 | 0 | 113.3 | S336 H337 | S336-L340 PolarHBondContact O-N 3.44Å; H337-L340 PolarHBondContact O-N 3.21Å |
| 341 | T | 47 | Very low | 45.5 | Very low | 94 Ų | 94 | 122.8 Ų | 122.8 | 58% | 0.577 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -76.8 | -29.9 | 176.5 | 50.1 | 0 | 0 | 0 | 0 | 113.3 | H337 K338 K343 R344 | H337-T341 PolarHBondContact O-N 3.34Å; H337-T341 VanDerWaalsContact O-N 3.09Å; H337-T341 PolarHBondContact O-OG1 2.98Å; H337-T341 VanDerWaalsContact O-OG1 3.05Å; K338-T341 PolarHBondContact O-OG1 2.95Å; T341-K343 PolarHBondContact O-N 3.1Å; T341-R344 PolarHBondContact O-N 3.2Å |
| 342 | K | 41.3 | Very low | 44.2 | Very low | 184 Ų | 184 | 124.8 Ų | 124.8 | 80% | 0.8 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -67.5 | -20.9 | 176.1 | -158.9 | 175.9 | -176.6 | -176.4 | 0 | 113.1 | K338 R344 | K338-K342 WeakPolarHBondContact O-CB 3.41Å; K338-K342 PolarHBondContact O-N 3.02Å; K342-R344 VanDerWaalsContact C-N 3.35Å |
| 343 | K | 42.3 | Very low | 43.3 | Very low | 198 Ų | 198 | 131.2 Ų | 131.2 | 86% | 0.861 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -6.3 | 176.8 | -131 | -178.7 | -175.9 | -175.1 | 0 | 114.1 | T341 | T341-K343 PolarHBondContact O-N 3.1Š|
| 344 | R | 40.6 | Very low | 42.4 | Very low | 234 Ų | 234 | 133.6 Ų | 133.6 | 88% | 0.883 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -115.2 | 0.2 | -174.2 | -130.9 | 174.2 | -175 | 167.2 | 0.5 | 115 | T341 K342 | T341-R344 PolarHBondContact O-N 3.2Å; K342-R344 VanDerWaalsContact C-N 3.35Å |
| 345 | G | 43.3 | Very low | 41.6 | Very low | 65 Ų | 65 | 133.4 Ų | 133.4 | 67% | 0.67 | 74% | 0.743 | S | S | * | * | trans | -123.4 | 70.8 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 346 | A | 42.2 | Very low | 40.8 | Very low | 93 Ų | 93 | 135.6 Ų | 135.6 | 77% | 0.769 | 76% | 0.758 | S | S | * | * | trans | -149 | 51.1 | 167.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 347 | I | 48.6 | Very low | 40.2 | Very low | 174 Ų | 174 | 137.3 Ų | 137.3 | 89% | 0.892 | 77% | 0.77 | S | S | * | * | trans | -142 | 92.4 | 154.4 | -53.6 | 178.5 | 0 | 0 | 0 | 105.7 | ||||
| 348 | S | 37.9 | Very low | 39.5 | Very low | 113 Ų | 113 | 137.1 Ų | 137.1 | 79% | 0.79 | 78% | 0.782 | S | S | * | * | trans | -131.2 | 115.9 | 161.4 | 63.9 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 349 | S | 38.7 | Very low | 39.2 | Very low | 107 Ų | 107 | 135.4 Ų | 135.4 | 75% | 0.748 | 79% | 0.785 | S | S | * | * | trans | -35.3 | 132.2 | 170.2 | 45.3 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 350 | V | 36.1 | Very low | 38.6 | Very low | 134 Ų | 134 | 137.6 Ų | 137.6 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | trans | -69.5 | 120.1 | 166.4 | 174.2 | 0 | 0 | 0 | 0 | 108.7 | T352 | V350-T352 HydrophobicContact CG1-CG2 4.31Š| ||
| 351 | S | 33.7 | Very low | 38 | Very low | 112 Ų | 112 | 136.5 Ų | 136.5 | 78% | 0.783 | 80% | 0.795 | S | S | * | * | trans | -108.9 | 115.4 | 158.5 | 14.6 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 352 | T | 33.6 | Very low | 37.4 | Very low | 126 Ų | 126 | 141.1 Ų | 141.1 | 77% | 0.773 | 83% | 0.831 | S | S | * | * | trans | -73.5 | 121 | 173.7 | 37.5 | 0 | 0 | 0 | 0 | 110.3 | V350 | V350-T352 HydrophobicContact CG1-CG2 4.31Š| ||
| 353 | E | 35.7 | Very low | 37.2 | Very low | 192 Ų | 192 | 139 Ų | 139 | 90% | 0.897 | 83% | 0.832 | S | S | * | * | trans | -75.5 | 138.9 | 157.3 | -76.1 | 176.8 | 152.6 | 0 | 0 | 109.2 | ||||
| 354 | S | 33.4 | Very low | 37 | Very low | 112 Ų | 112 | 135.9 Ų | 135.9 | 78% | 0.783 | 83% | 0.831 | S | S | * | * | trans | -142 | 102.4 | 160.3 | 45 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 355 | E | 35.2 | Very low | 36.8 | Very low | 187 Ų | 187 | 130.4 Ų | 130.4 | 87% | 0.874 | 83% | 0.828 | S | S | * | * | trans | -62.4 | 137.9 | 159.4 | -76.7 | 176.5 | 121.7 | 0 | 0 | 109.4 | ||||
| 356 | S | 33.1 | Very low | 36.4 | Very low | 117 Ų | 117 | 134.3 Ų | 134.3 | 82% | 0.818 | 84% | 0.837 | S | S | * | * | trans | -134.6 | 110.7 | 160.2 | -87.6 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 357 | S | 35.1 | Very low | 36 | Very low | 120 Ų | 120 | 136.9 Ų | 136.9 | 84% | 0.839 | 84% | 0.842 | S | S | * | * | trans | -83.6 | 122.8 | 162.3 | -48.1 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 358 | S | 33.6 | Very low | 35.2 | Very low | 118 Ų | 118 | 134.4 Ų | 134.4 | 83% | 0.825 | 84% | 0.838 | S | S | * | * | trans | -128 | 133.3 | 162.2 | 55.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 359 | V | 38.1 | Very low | 35 | Very low | 126 Ų | 126 | 135.9 Ų | 135.9 | 76% | 0.764 | 84% | 0.842 | S | S | * | * | trans | -94.1 | 150.5 | -171 | 162 | 0 | 0 | 0 | 0 | 110 | ||||
| 360 | L | 35.6 | Very low | 34.7 | Very low | 153 Ų | 153 | 138.2 Ų | 138.2 | 80% | 0.801 | 85% | 0.849 | S | S | * | * | trans | 91.8 | 127.4 | 152.5 | -84.1 | 160 | 0 | 0 | 0 | 123.1 | ||||
| 361 | C | 33.5 | Very low | 34.6 | Very low | 108 Ų | 108 | 138.5 Ų | 138.5 | 73% | 0.73 | 85% | 0.852 | S | S | * | * | trans | 83 | 98.3 | 135.7 | -99.9 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 362 | S | 34.4 | Very low | 34.7 | Very low | 191 Ų | 191 | 140.9 Ų | 140.9 | 100% | 1.336 | 86% | 0.858 | S | S | * | * | 162.1 | 0 | 101.7 | -66.8 | 0 | 0 | 0 | 0 | 110.9 |
Retrieved 362 of 362 residues in 921.3 ms
(Link to these results)