| 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 | 31.1 | Very low | 29.9 | Very low | 152 Ų | 152 | 112.4 Ų | 112.4 | 75% | 0.749 | 70% | 0.695 | S | S | * | * | 0 | 124.4 | 0 | -86.9 | 168.2 | 110 | 0 | 0 | 106.9 | V29 N33 | M1-V29 HydrophobicContact CE-CG1 3.4Å; M1-V29 HydrophobicContact SD-CG1 3.81Å; M1-N33 PolarHBondContact SD-ND2 3.26Å | |||
| 2 | D | 28.3 | Very low | 30.3 | Very low | 149 Ų | 149 | 114.8 Ų | 114.8 | 80% | 0.797 | 70% | 0.701 | S | S | * | * | trans | 70.2 | 65.8 | -173.4 | -58.7 | -18.3 | 0 | 0 | 0 | 117.9 | ||||
| 3 | S | 30 | Very low | 31.2 | Very low | 97 Ų | 97 | 114.5 Ų | 114.5 | 68% | 0.678 | 71% | 0.707 | S | S | * | * | trans | -151.8 | 89.7 | 145.9 | 56.8 | 0 | 0 | 0 | 0 | 107.6 | P5 | S3-P5 WeakPolarHBondContact O-CD 3.33Š| ||
| 4 | Q | 28.5 | Very low | 33 | Very low | 188 Ų | 188 | 117 Ų | 117 | 88% | 0.879 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 125 | 168.1 | -72.3 | -171.1 | -63.9 | 0 | 0 | 108.3 | S6 | Q4-S6 PolarHBondContact O-N 3.3Š|
| 5 | P | 30.3 | Very low | 35.4 | Very low | 109 Ų | 109 | 119.3 Ų | 119.3 | 71% | 0.708 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 127.6 | 163.5 | 28 | -24.8 | 0 | 0 | 0 | 107.3 | S3 | S3-P5 WeakPolarHBondContact O-CD 3.33Š|
| 6 | S | 27.7 | Very low | 38.1 | Very low | 42 Ų | 42 | 112.6 Ų | 112.6 | 29% | 0.294 | 67% | 0.671 | S | S | . | * | P | Polyproline II helix | trans | -75.4 | 133.7 | -177.1 | 56.7 | 0 | 0 | 0 | 0 | 111 | Q4 R186 E207 | Q4-S6 PolarHBondContact O-N 3.3Å; S6-R186 PolarHBondContact O-NH2 3.04Å; S6-R186 WeakPolarHBondContact OG-CD 3.3Å; S6-R186 PolarHBondContact OG-NE 3.35Å; S6-R186 VanDerWaalsContact OG-NE 3.16Å; S6-R186 PolarHBondContact OG-NH1 3.13Å; S6-E207 PolarHBondContact OG-OE2 3.36Å |
| 7 | M | 29.7 | Very low | 41 | Very low | 127 Ų | 127 | 111.8 Ų | 111.8 | 63% | 0.626 | 66% | 0.663 | S | S | * | * | trans | 69.2 | 82.4 | 162.1 | -64.1 | -179.4 | -113.5 | 0 | 0 | 118 | T9 | M7-T9 HydrophobicContact CB-CG2 4.44Å; M7-T9 HydrophobicContact CG-CG2 4.49Å | ||
| 8 | A | 30 | Very low | 43.6 | Very low | 108 Ų | 108 | 114.4 Ų | 114.4 | 89% | 0.893 | 67% | 0.665 | S | S | * | * | trans | -89.7 | 88.6 | 135.9 | 0 | 0 | 0 | 0 | 0 | 107.9 | G10 | A8-G10 PolarHBondContact O-N 3.39Š| ||
| 9 | T | 31.5 | Very low | 46.1 | Very low | 124 Ų | 124 | 114.9 Ų | 114.9 | 76% | 0.761 | 66% | 0.664 | S | S | * | * | trans | -73.9 | 113.5 | 165.6 | 44.8 | 0 | 0 | 0 | 0 | 108.4 | M7 | M7-T9 HydrophobicContact CB-CG2 4.44Å; M7-T9 HydrophobicContact CG-CG2 4.49Å | ||
| 10 | G | 28.6 | Very low | 48.3 | Very low | 54 Ų | 54 | 112.8 Ų | 112.8 | 56% | 0.557 | 65% | 0.648 | S | S | * | * | S | Bend | trans | 115.9 | 50.9 | 161 | 0 | 0 | 0 | 0 | 0 | 117.3 | A8 | A8-G10 PolarHBondContact O-N 3.39Š|
| 11 | A | 33.1 | Very low | 50.2 | Low | 86 Ų | 86 | 111.3 Ų | 111.3 | 71% | 0.711 | 64% | 0.635 | S | S | * | * | S | Bend | trans | -171.5 | 107.2 | 147.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | S13 | A11-S13 PolarHBondContact O-N 2.74Š|
| 12 | D | 35.3 | Very low | 53.1 | Low | 142 Ų | 142 | 107.3 Ų | 107.3 | 76% | 0.759 | 62% | 0.62 | S | S | * | * | trans | 18.5 | 91.9 | 169.5 | -67.3 | -26.5 | 0 | 0 | 0 | 117.5 | Q14 | D12-Q14 PolarHBondContact O-N 3.2Š| ||
| 13 | S | 42.1 | Very low | 56.1 | Low | 111 Ų | 111 | 106.2 Ų | 106.2 | 78% | 0.776 | 60% | 0.604 | S | S | * | * | trans | -69.9 | 74 | 156.7 | 62.4 | 0 | 0 | 0 | 0 | 108.9 | A11 L15 | A11-S13 PolarHBondContact O-N 2.74Å; S13-L15 PolarHBondContact O-N 3.46Å | ||
| 14 | Q | 56.3 | Low | 58.9 | Low | 149 Ų | 149 | 102 Ų | 102 | 70% | 0.696 | 58% | 0.575 | S | S | * | * | trans | -56.8 | 114.4 | 158.1 | -81.4 | -170.3 | -24.4 | 0 | 0 | 106.3 | D12 L16 | D12-Q14 PolarHBondContact O-N 3.2Å; Q14-L16 PolarHBondContact O-N 3.47Å; Q14-L16 VanDerWaalsContact O-N 3.12Å | ||
| 15 | L | 68.6 | Low | 61.9 | Low | 152 Ų | 152 | 96.9 Ų | 96.9 | 80% | 0.796 | 56% | 0.556 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 119 | 170.1 | -121.4 | 97.2 | 0 | 0 | 0 | 106 | S13 D17 | S13-L15 PolarHBondContact O-N 3.46Å; L15-D17 PolarHBondContact O-N 3.35Å |
| 16 | L | 78.8 | Confident | 64.8 | Low | 12 Ų | 12 | 97.3 Ų | 97.3 | 6% | 0.063 | 55% | 0.552 | C | S | . | * | P | Polyproline II helix | trans | -46.8 | 135.1 | 171.1 | -68.7 | 166.7 | 0 | 0 | 0 | 109.2 | Q14 E20 Q21 L24 V301 | Q14-L16 PolarHBondContact O-N 3.47Å; Q14-L16 VanDerWaalsContact O-N 3.12Å; L16-E20 VanDerWaalsContact CA-OE2 3.3Å; L16-E20 WeakPolarHBondContact CA-OE2 3.35Å; L16-E20 HydrophobicContact CB-CB 4.25Å; L16-E20 HydrophobicContact CD2-CB 4.12Å; L16-Q21 HydrophobicContact CB-CG 3.52Å; L16-Q21 HydrophobicContact CD1-CG 3.83Å; L16-Q21 HydrophobicContact CG-CG 4.4Å; L16-Q21 PolarHBondContact O-NE2 3.15Å; L16-L24 HydrophobicContact CD1-CD1 3.65Å; L16-L24 HydrophobicContact CD2-CD1 4.45Å; L16-V301 HydrophobicContact CD2-CB 4Å; L16-V301 HydrophobicContact CD2-CG1 4.36Å; L16-V301 HydrophobicContact CD2-CG2 3.42Å; L16-V301 VanDerWaalsContact CD2-CG2 3.42Å |
| 17 | D | 86.8 | Confident | 67.8 | Low | 99 Ų | 99 | 96.7 Ų | 96.7 | 53% | 0.529 | 55% | 0.552 | S | S | . | * | P | Polyproline II helix | trans | -65.6 | 159.8 | 173 | -170.9 | 27.5 | 0 | 0 | 0 | 110.5 | L15 D19 E20 Q21 | L15-D17 PolarHBondContact O-N 3.35Å; D17-D19 PolarHBondContact O-N 3.11Å; D17-E20 HydrophobicContact CB-CG 4.46Å; D17-E20 PolarHBondContact N-OE2 2.9Å; D17-E20 WeakPolarHBondContact O-CB 3.47Å; D17-E20 PolarHBondContact O-N 3.17Å; D17-E20 VanDerWaalsContact O-N 3.1Å; D17-Q21 WeakPolarHBondContact O-CG 3.44Å; D17-Q21 PolarHBondContact O-N 3.07Å |
| 18 | K | 88.4 | Confident | 70.7 | Confident | 159 Ų | 159 | 91.6 Ų | 91.6 | 69% | 0.691 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -56.2 | -38.2 | -176.8 | -71.1 | -178.1 | 178.7 | 176.4 | 0 | 112.3 | Q21 T22 | K18-Q21 PolarHBondContact O-N 3.42Å; K18-T22 VanDerWaalsContact O-CB 3.27Å; K18-T22 WeakPolarHBondContact O-CB 3.47Å; K18-T22 PolarHBondContact O-N 3.24Å; K18-T22 PolarHBondContact O-OG1 3.33Å |
| 19 | D | 90.9 | Very high | 73.6 | Confident | 124 Ų | 124 | 87.4 Ų | 87.4 | 66% | 0.663 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -66.7 | -40.2 | 179.6 | -72.3 | -9.8 | 0 | 0 | 0 | 111.4 | D17 T22 W23 | D17-D19 PolarHBondContact O-N 3.11Å; D19-T22 PolarHBondContact O-N 3.45Å; D19-W23 WeakPolarHBondContact O-CB 3.5Å; D19-W23 PolarHBondContact O-N 3.04Å |
| 20 | E | 90.4 | Very high | 76.5 | Confident | 72 Ų | 72 | 84.6 Ų | 84.6 | 34% | 0.336 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.8 | -44.2 | 176.8 | -61.5 | 174.1 | 152.6 | 0 | 0 | 111.6 | L16 D17 T22 W23 L24 V301 | L16-E20 VanDerWaalsContact CA-OE2 3.3Å; L16-E20 WeakPolarHBondContact CA-OE2 3.35Å; L16-E20 HydrophobicContact CB-CB 4.25Å; L16-E20 HydrophobicContact CD2-CB 4.12Å; D17-E20 HydrophobicContact CB-CG 4.46Å; D17-E20 PolarHBondContact N-OE2 2.9Å; D17-E20 WeakPolarHBondContact O-CB 3.47Å; D17-E20 PolarHBondContact O-N 3.17Å; D17-E20 VanDerWaalsContact O-N 3.1Å; E20-T22 VanDerWaalsContact C-N 3.29Å; E20-T22 PolarHBondContact O-N 3.28Å; E20-W23 PolarHBondContact O-N 3.2Å; E20-L24 WeakPolarHBondContact O-CG 3.41Å; E20-L24 PolarHBondContact O-N 3.3Å; E20-V301 HydrophobicContact CB-CG1 4.06Å; E20-V301 HydrophobicContact CB-CG2 3.73Å; E20-V301 HydrophobicContact CG-CG1 4.46Å; E20-V301 HydrophobicContact CG-CG2 3.57Å; E20-V301 VanDerWaalsContact OE1-CG2 3.23Å; E20-V301 WeakPolarHBondContact OE1-CG2 3.3Å; E20-V301 WeakPolarHBondContact OE2-CG2 3.04Å |
| 21 | Q | 88.6 | Confident | 79.5 | Confident | 81 Ų | 81 | 86.9 Ų | 86.9 | 38% | 0.379 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.4 | -40.1 | 173.7 | -66.5 | -175.8 | 14.5 | 0 | 0 | 111.5 | L16 D17 K18 L24 T25 | L16-Q21 HydrophobicContact CB-CG 3.52Å; L16-Q21 HydrophobicContact CD1-CG 3.83Å; L16-Q21 HydrophobicContact CG-CG 4.4Å; L16-Q21 PolarHBondContact O-NE2 3.15Å; D17-Q21 WeakPolarHBondContact O-CG 3.44Å; D17-Q21 PolarHBondContact O-N 3.07Å; K18-Q21 PolarHBondContact O-N 3.42Å; Q21-L24 PolarHBondContact O-N 3.28Å; Q21-T25 VanDerWaalsContact O-CB 3.28Å; Q21-T25 WeakPolarHBondContact O-CB 3.42Å; Q21-T25 PolarHBondContact O-N 2.98Å; Q21-T25 PolarHBondContact O-OG1 3.37Å |
| 22 | T | 90.6 | Very high | 82.2 | Confident | 69 Ų | 69 | 83.6 Ų | 83.6 | 42% | 0.423 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -66.2 | -43.7 | 178.2 | -59.7 | 0 | 0 | 0 | 0 | 110.8 | K18 D19 E20 T25 N26 | K18-T22 VanDerWaalsContact O-CB 3.27Å; K18-T22 WeakPolarHBondContact O-CB 3.47Å; K18-T22 PolarHBondContact O-N 3.24Å; K18-T22 PolarHBondContact O-OG1 3.33Å; D19-T22 PolarHBondContact O-N 3.45Å; E20-T22 VanDerWaalsContact C-N 3.29Å; E20-T22 PolarHBondContact O-N 3.28Å; T22-T25 PolarHBondContact O-N 2.99Å; T22-N26 VanDerWaalsContact CG2-ND2 3.35Å; T22-N26 WeakPolarHBondContact CG2-ND2 3.38Å; T22-N26 VanDerWaalsContact O-CB 3.28Å; T22-N26 WeakPolarHBondContact O-CB 3.39Å; T22-N26 PolarHBondContact O-N 2.83Å |
| 23 | W | 91.3 | Very high | 84.8 | Confident | 125 Ų | 125 | 80.2 Ų | 80.2 | 47% | 0.473 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -61.5 | -45 | 175.5 | 173.4 | 78.1 | 0 | 0 | 0 | 112.1 | D19 E20 G27 I28 V301 A305 | D19-W23 WeakPolarHBondContact O-CB 3.5Å; D19-W23 PolarHBondContact O-N 3.04Å; E20-W23 PolarHBondContact O-N 3.2Å; W23-G27 VanDerWaalsContact O-CA 3.23Å; W23-G27 WeakPolarHBondContact O-CA 3.38Å; W23-G27 PolarHBondContact O-N 3.33Å; W23-I28 HydrophobicContact CD2-CG1 4.34Å; W23-I28 HydrophobicContact CE3-CG1 4.31Å; W23-I28 HydrophobicContact CH2-CD1 3.94Å; W23-I28 HydrophobicContact CH2-CG1 3.78Å; W23-I28 HydrophobicContact CZ2-CD1 3.64Å; W23-I28 HydrophobicContact CZ2-CG1 3.8Å; W23-I28 HydrophobicContact CZ3-CG1 4.02Å; W23-I28 PolarHBondContact O-N 3.04Å; W23-V301 HydrophobicContact CE3-CG1 3.58Å; W23-V301 HydrophobicContact CZ3-CG1 3.53Å; W23-A305 HydrophobicContact CH2-CB 3.72Å; W23-A305 HydrophobicContact CZ3-CB 3.79Å |
| 24 | L | 90.2 | Very high | 87.1 | Confident | 10 Ų | 10 | 78 Ų | 78 | 5% | 0.052 | 42% | 0.417 | C | S | . | . | I | π-helix | trans | -60.6 | -50.4 | 175.1 | -74.5 | 174.3 | 0 | 0 | 0 | 111.4 | L16 E20 Q21 I28 V29 V301 R304 A305 I308 | L16-L24 HydrophobicContact CD1-CD1 3.65Å; L16-L24 HydrophobicContact CD2-CD1 4.45Å; E20-L24 WeakPolarHBondContact O-CG 3.41Å; E20-L24 PolarHBondContact O-N 3.3Å; Q21-L24 PolarHBondContact O-N 3.28Å; L24-I28 HydrophobicContact CD2-CG1 4.35Å; L24-I28 PolarHBondContact O-N 3.05Å; L24-I28 VanDerWaalsContact O-N 3.12Å; L24-V29 WeakPolarHBondContact O-CG2 3.23Å; L24-V29 PolarHBondContact O-N 3.19Å; L24-V301 HydrophobicContact CD1-CG1 4.33Å; L24-V301 HydrophobicContact CD2-CG1 4.41Å; L24-V301 HydrophobicContact CG-CG1 4.2Å; L24-R304 HydrophobicContact CD1-CB 4.02Å; L24-A305 HydrophobicContact CD2-CB 3.75Å; L24-I308 HydrophobicContact CD2-CD1 4.21Å |
| 25 | T | 89.9 | Confident | 88.7 | Confident | 79 Ų | 79 | 72.5 Ų | 72.5 | 49% | 0.485 | 39% | 0.39 | S | S | . | . | I | π-helix | trans | -72.6 | -38.3 | -171.7 | -52.7 | 0 | 0 | 0 | 0 | 112.7 | Q21 T22 P30 | Q21-T25 VanDerWaalsContact O-CB 3.28Å; Q21-T25 WeakPolarHBondContact O-CB 3.42Å; Q21-T25 PolarHBondContact O-N 2.98Å; Q21-T25 PolarHBondContact O-OG1 3.37Å; T22-T25 PolarHBondContact O-N 2.99Å; T25-P30 WeakPolarHBondContact O-CD 3.48Å |
| 26 | N | 91.9 | Very high | 89.5 | Confident | 118 Ų | 118 | 66.8 Ų | 66.8 | 63% | 0.631 | 37% | 0.367 | S | S | * | . | I | π-helix | trans | -97.4 | -24.5 | -176.2 | -65 | -21.1 | 0 | 0 | 0 | 113.3 | T22 P30 | T22-N26 VanDerWaalsContact CG2-ND2 3.35Å; T22-N26 WeakPolarHBondContact CG2-ND2 3.38Å; T22-N26 VanDerWaalsContact O-CB 3.28Å; T22-N26 WeakPolarHBondContact O-CB 3.39Å; T22-N26 PolarHBondContact O-N 2.83Å; N26-P30 WeakPolarHBondContact O-CG 3.37Å |
| 27 | G | 91.1 | Very high | 89.8 | Confident | 29 Ų | 29 | 75.3 Ų | 75.3 | 30% | 0.299 | 40% | 0.4 | S | S | . | . | I | π-helix | trans | -96.8 | -57.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | W23 I31 | W23-G27 VanDerWaalsContact O-CA 3.23Å; W23-G27 WeakPolarHBondContact O-CA 3.38Å; W23-G27 PolarHBondContact O-N 3.33Å; G27-I31 VanDerWaalsContact O-CD1 3.31Å; G27-I31 WeakPolarHBondContact O-CD1 3.47Å; G27-I31 WeakPolarHBondContact O-CG1 3.43Å |
| 28 | I | 91.5 | Very high | 90 | Very high | 20 Ų | 20 | 74.3 Ų | 74.3 | 10% | 0.103 | 40% | 0.398 | C | S | . | . | I | π-helix | trans | -87.8 | -48.4 | -166.9 | -56.6 | -58 | 0 | 0 | 0 | 112.6 | W23 L24 I31 A32 A305 I308 L309 | W23-I28 HydrophobicContact CD2-CG1 4.34Å; W23-I28 HydrophobicContact CE3-CG1 4.31Å; W23-I28 HydrophobicContact CH2-CD1 3.94Å; W23-I28 HydrophobicContact CH2-CG1 3.78Å; W23-I28 HydrophobicContact CZ2-CD1 3.64Å; W23-I28 HydrophobicContact CZ2-CG1 3.8Å; W23-I28 HydrophobicContact CZ3-CG1 4.02Å; W23-I28 PolarHBondContact O-N 3.04Å; L24-I28 HydrophobicContact CD2-CG1 4.35Å; L24-I28 PolarHBondContact O-N 3.05Å; L24-I28 VanDerWaalsContact O-N 3.12Å; I28-I31 WeakPolarHBondContact O-CB 3.48Å; I28-I31 PolarHBondContact O-N 3.01Å; I28-I31 VanDerWaalsContact O-N 3.17Å; I28-A32 PolarHBondContact O-N 3.37Å; I28-A305 HydrophobicContact CG1-CB 4.4Å; I28-A305 HydrophobicContact CG2-CB 4.41Å; I28-I308 HydrophobicContact CG2-CB 4.17Å; I28-I308 HydrophobicContact CG2-CG2 3.77Å; I28-L309 HydrophobicContact CG2-CD1 4.14Å; I28-L309 HydrophobicContact CG2-CD2 4.06Å; I28-L309 HydrophobicContact CG2-CG 3.81Å |
| 29 | V | 90.7 | Very high | 90 | Very high | 21 Ų | 21 | 67.4 Ų | 67.4 | 13% | 0.127 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -56.9 | -42.2 | -177.9 | 166.6 | 0 | 0 | 0 | 0 | 113.2 | M1 L24 I31 A32 N33 I308 | M1-V29 HydrophobicContact CE-CG1 3.4Å; M1-V29 HydrophobicContact SD-CG1 3.81Å; L24-V29 WeakPolarHBondContact O-CG2 3.23Å; L24-V29 PolarHBondContact O-N 3.19Å; V29-I31 VanDerWaalsContact C-N 3.3Å; V29-I31 PolarHBondContact O-N 3.4Å; V29-A32 PolarHBondContact O-N 3.33Å; V29-N33 WeakPolarHBondContact CG1-ND2 3.29Å; V29-N33 WeakPolarHBondContact O-CB 3.19Å; V29-N33 VanDerWaalsContact O-CG 3.29Å; V29-N33 PolarHBondContact O-N 3.01Å; V29-N33 PolarHBondContact O-ND2 2.7Å; V29-I308 HydrophobicContact CG2-CD1 4.1Å; V29-I308 HydrophobicContact CG2-CG2 4.3Å |
| 30 | P | 92.3 | Very high | 89.9 | Confident | 64 Ų | 64 | 62.3 Ų | 62.3 | 42% | 0.416 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.9 | -36.6 | 178.9 | -24.9 | 37.7 | 0 | 0 | 0 | 112.6 | T25 N26 A34 | T25-P30 WeakPolarHBondContact O-CD 3.48Å; N26-P30 WeakPolarHBondContact O-CG 3.37Å; P30-A34 VanDerWaalsContact O-CB 3.28Å; P30-A34 WeakPolarHBondContact O-CB 3.47Å; P30-A34 PolarHBondContact O-N 3.11Å |
| 31 | I | 91.1 | Very high | 90 | Very high | 103 Ų | 103 | 67 Ų | 67 | 53% | 0.528 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -66.2 | -47.9 | 176.3 | -61.9 | 171.4 | 0 | 0 | 0 | 109.9 | G27 I28 V29 N33 A34 Y35 | G27-I31 VanDerWaalsContact O-CD1 3.31Å; G27-I31 WeakPolarHBondContact O-CD1 3.47Å; G27-I31 WeakPolarHBondContact O-CG1 3.43Å; I28-I31 WeakPolarHBondContact O-CB 3.48Å; I28-I31 PolarHBondContact O-N 3.01Å; I28-I31 VanDerWaalsContact O-N 3.17Å; V29-I31 VanDerWaalsContact C-N 3.3Å; V29-I31 PolarHBondContact O-N 3.4Å; I31-N33 PolarHBondContact O-N 2.87Å; I31-A34 PolarHBondContact O-N 3.39Å; I31-Y35 PolarHBondContact O-N 2.82Å |
| 32 | A | 90.4 | Very high | 90.3 | Very high | 17 Ų | 17 | 66.3 Ų | 66.3 | 14% | 0.14 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60.8 | -45.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | I28 V29 Y35 G36 I308 | I28-A32 PolarHBondContact O-N 3.37Å; V29-A32 PolarHBondContact O-N 3.33Å; A32-Y35 PolarHBondContact O-N 2.75Å; A32-G36 PolarHBondContact O-N 2.82Å; A32-I308 HydrophobicContact CB-CG2 3.48Å; A32-I308 VanDerWaalsContact CB-CG2 3.48Å; A32-I308 WeakPolarHBondContact CB-O 3.2Å |
| 33 | N | 89.3 | Confident | 90.4 | Very high | 70 Ų | 70 | 63 Ų | 63 | 37% | 0.374 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -63.4 | -44.9 | 177 | -73.6 | -17.9 | 0 | 0 | 0 | 112.1 | M1 V29 I31 Y35 G36 Y37 | M1-N33 PolarHBondContact SD-ND2 3.26Å; V29-N33 WeakPolarHBondContact CG1-ND2 3.29Å; V29-N33 WeakPolarHBondContact O-CB 3.19Å; V29-N33 VanDerWaalsContact O-CG 3.29Å; V29-N33 PolarHBondContact O-N 3.01Å; V29-N33 PolarHBondContact O-ND2 2.7Å; I31-N33 PolarHBondContact O-N 2.87Å; N33-Y35 VanDerWaalsContact C-N 3.27Å; N33-Y35 PolarHBondContact O-N 3.24Å; N33-G36 PolarHBondContact O-N 3.27Å; N33-Y37 WeakPolarHBondContact O-CD2 3.38Å; N33-Y37 PolarHBondContact O-N 3.19Å |
| 34 | A | 90.7 | Very high | 90.6 | Very high | 66 Ų | 66 | 58.1 Ų | 58.1 | 55% | 0.545 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59 | -41.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | P30 I31 | P30-A34 VanDerWaalsContact O-CB 3.28Å; P30-A34 WeakPolarHBondContact O-CB 3.47Å; P30-A34 PolarHBondContact O-N 3.11Å; I31-A34 PolarHBondContact O-N 3.39Å |
| 35 | Y | 89.5 | Confident | 90.8 | Very high | 32 Ų | 32 | 62.6 Ų | 62.6 | 13% | 0.125 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -75 | -39.3 | 176.7 | -178.5 | -115.9 | 0 | 0 | 0 | 112.9 | I31 A32 N33 Y37 V38 H39 L42 D311 L315 | I31-Y35 PolarHBondContact O-N 2.82Å; A32-Y35 PolarHBondContact O-N 2.75Å; N33-Y35 VanDerWaalsContact C-N 3.27Å; N33-Y35 PolarHBondContact O-N 3.24Å; Y35-Y37 PolarHBondContact O-N 3.2Å; Y35-Y37 VanDerWaalsContact O-N 3.15Å; Y35-V38 HydrophobicContact CD2-CG2 3.94Å; Y35-V38 HydrophobicContact CE2-CG2 4.25Å; Y35-V38 WeakPolarHBondContact O-CG2 3.4Å; Y35-V38 PolarHBondContact O-N 2.98Å; Y35-H39 HydrophobicContact CD1-CB 4.13Å; Y35-H39 HydrophobicContact CE1-CB 3.75Å; Y35-H39 AromaticContact CE1-CG 3.71Å; Y35-H39 AromaticContact CE1-ND1 3.26Å; Y35-H39 VanDerWaalsContact CE1-ND1 3.26Å; Y35-H39 WeakPolarHBondContact CE1-ND1 3.35Å; Y35-H39 HydrophobicContact CE2-CB 4.44Å; Y35-H39 AromaticContact CZ-CG 3.99Å; Y35-H39 AromaticContact CZ-ND1 3.37Å; Y35-H39 WeakPolarHBondContact O-CB 3.41Å; Y35-H39 PolarHBondContact O-N 3.09Å; Y35-H39 PolarHBondContact OH-ND1 2.97Å; Y35-L42 HydrophobicContact CE2-CD2 4.18Å; Y35-D311 HydrophobicContact CD1-CB 3.78Å; Y35-D311 VanDerWaalsContact CE1-C 3.5Å; Y35-D311 HydrophobicContact CE1-CB 3.66Å; Y35-D311 VanDerWaalsContact CE1-O 3.3Å; Y35-D311 WeakPolarHBondContact CE1-O 3.23Å; Y35-L315 HydrophobicContact CE1-CB 4.41Å; Y35-L315 HydrophobicContact CE2-CD2 3.81Å; Y35-L315 VanDerWaalsContact OH-CB 3.28Å; Y35-L315 WeakPolarHBondContact OH-CB 3.16Å; Y35-L315 WeakPolarHBondContact OH-CD1 3.47Å; Y35-L315 WeakPolarHBondContact OH-CD2 3.36Å |
| 36 | G | 85.8 | Confident | 91.1 | Very high | 32 Ų | 32 | 60.2 Ų | 60.2 | 33% | 0.33 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -55 | -34.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | A32 N33 V38 | A32-G36 PolarHBondContact O-N 2.82Å; N33-G36 PolarHBondContact O-N 3.27Å; G36-V38 VanDerWaalsContact C-N 3.31Å; G36-V38 PolarHBondContact O-N 3.3Å |
| 37 | Y | 84.5 | Confident | 91.3 | Very high | 192 Ų | 192 | 54.6 Ų | 54.6 | 75% | 0.753 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -61.3 | -34.6 | 175.6 | -78.3 | -69.4 | 0 | 0 | 0 | 114.2 | N33 Y35 | N33-Y37 WeakPolarHBondContact O-CD2 3.38Å; N33-Y37 PolarHBondContact O-N 3.19Å; Y35-Y37 PolarHBondContact O-N 3.2Å; Y35-Y37 VanDerWaalsContact O-N 3.15Å |
| 38 | V | 90 | Very high | 91.5 | Very high | 78 Ų | 78 | 55.8 Ų | 55.8 | 47% | 0.473 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -101.9 | -19.2 | -178.3 | -63.6 | 0 | 0 | 0 | 0 | 112.6 | Y35 G36 G40 Y41 L42 | Y35-V38 HydrophobicContact CD2-CG2 3.94Å; Y35-V38 HydrophobicContact CE2-CG2 4.25Å; Y35-V38 WeakPolarHBondContact O-CG2 3.4Å; Y35-V38 PolarHBondContact O-N 2.98Å; G36-V38 VanDerWaalsContact C-N 3.31Å; G36-V38 PolarHBondContact O-N 3.3Å; V38-G40 PolarHBondContact O-N 3.47Å; V38-Y41 PolarHBondContact O-N 3.22Å; V38-L42 VanDerWaalsContact O-CB 3.29Å; V38-L42 WeakPolarHBondContact O-CB 3.27Å; V38-L42 PolarHBondContact O-N 3Å |
| 39 | H | 90.2 | Very high | 91.7 | Very high | 13 Ų | 13 | 59.8 Ų | 59.8 | 6% | 0.06 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -53.1 | -52.2 | -174 | 175.4 | 60.9 | 0 | 0 | 0 | 112.3 | Y35 Y41 L42 S43 Y88 D311 | Y35-H39 HydrophobicContact CD1-CB 4.13Å; Y35-H39 HydrophobicContact CE1-CB 3.75Å; Y35-H39 AromaticContact CE1-CG 3.71Å; Y35-H39 AromaticContact CE1-ND1 3.26Å; Y35-H39 VanDerWaalsContact CE1-ND1 3.26Å; Y35-H39 WeakPolarHBondContact CE1-ND1 3.35Å; Y35-H39 HydrophobicContact CE2-CB 4.44Å; Y35-H39 AromaticContact CZ-CG 3.99Å; Y35-H39 AromaticContact CZ-ND1 3.37Å; Y35-H39 WeakPolarHBondContact O-CB 3.41Å; Y35-H39 PolarHBondContact O-N 3.09Å; Y35-H39 PolarHBondContact OH-ND1 2.97Å; H39-Y41 PolarHBondContact O-N 2.95Å; H39-L42 PolarHBondContact O-N 2.95Å; H39-S43 PolarHBondContact CE1-OG 3.32Å; H39-S43 PolarHBondContact ND1-OG 3.27Å; H39-S43 VanDerWaalsContact ND1-OG 3.07Å; H39-S43 WeakPolarHBondContact O-CB 3.48Å; H39-S43 PolarHBondContact O-N 2.93Å; H39-S43 PolarHBondContact O-OG 3.48Å; H39-Y88 PolarHBondContact CE1-OH 3.17Å; H39-Y88 PolarHBondContact NE2-OH 3.46Å; H39-D311 HydrophobicContact CB-CB 4.45Å; H39-D311 IonicContact CD2-OD1 3.66Å; H39-D311 IonicContact CD2-OD2 3.83Å; H39-D311 PolarHBondContact CD2-OD2 3.07Å; H39-D311 PolarHBondContact CE1-O 2.88Å; H39-D311 IonicContact CG-OD2 3.13Å; H39-D311 IonicContact NE2-OD1 3.36Å |
| 40 | G | 89.1 | Confident | 92 | Very high | 17 Ų | 17 | 58.8 Ų | 58.8 | 18% | 0.175 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -57 | -45.5 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | V38 T44 | V38-G40 PolarHBondContact O-N 3.47Å; G40-T44 VanDerWaalsContact O-CB 3.29Å; G40-T44 WeakPolarHBondContact O-CB 3.4Å; G40-T44 PolarHBondContact O-N 2.88Å; G40-T44 VanDerWaalsContact O-N 3.17Å; G40-T44 PolarHBondContact O-OG1 3.12Å |
| 41 | Y | 92 | Very high | 92.3 | Very high | 171 Ų | 171 | 56.8 Ų | 56.8 | 67% | 0.671 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -70.9 | -46.6 | 179.1 | -60 | -74.2 | 0 | 0 | 0 | 112.2 | V38 H39 T44 L45 M96 | V38-Y41 PolarHBondContact O-N 3.22Å; H39-Y41 PolarHBondContact O-N 2.95Å; Y41-T44 PolarHBondContact O-N 3.3Å; Y41-L45 PolarHBondContact O-N 2.79Å; Y41-L45 VanDerWaalsContact O-N 3.09Å; Y41-M96 HydrophobicContact CD1-SD 4.01Å; Y41-M96 HydrophobicContact CE1-SD 4.09Å |
| 42 | L | 93.5 | Very high | 92.5 | Very high | 66 Ų | 66 | 57.7 Ų | 57.7 | 35% | 0.346 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -63.7 | -48.5 | -178.5 | -179.6 | 61.6 | 0 | 0 | 0 | 111 | Y35 V38 H39 T44 L45 I46 L315 | Y35-L42 HydrophobicContact CE2-CD2 4.18Å; V38-L42 VanDerWaalsContact O-CB 3.29Å; V38-L42 WeakPolarHBondContact O-CB 3.27Å; V38-L42 PolarHBondContact O-N 3Å; H39-L42 PolarHBondContact O-N 2.95Å; L42-T44 VanDerWaalsContact C-N 3.35Å; L42-T44 PolarHBondContact O-N 3.48Å; L42-L45 PolarHBondContact O-N 3.39Å; L42-I46 HydrophobicContact CD1-CD1 3.94Å; L42-I46 HydrophobicContact CD1-CG1 4.3Å; L42-I46 HydrophobicContact CD2-CD1 4.48Å; L42-I46 HydrophobicContact CG-CD1 3.8Å; L42-I46 HydrophobicContact CG-CG1 4.49Å; L42-I46 VanDerWaalsContact O-CG1 3.28Å; L42-I46 WeakPolarHBondContact O-CG1 3.19Å; L42-I46 PolarHBondContact O-N 3.02Å; L42-L315 HydrophobicContact CD2-CD1 4.12Å |
| 43 | S | 94.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 57.6 Ų | 57.6 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.6 | -40.3 | 178.8 | -66.1 | 0 | 0 | 0 | 0 | 112.3 | H39 L45 I46 C47 | H39-S43 PolarHBondContact CE1-OG 3.32Å; H39-S43 PolarHBondContact ND1-OG 3.27Å; H39-S43 VanDerWaalsContact ND1-OG 3.07Å; H39-S43 WeakPolarHBondContact O-CB 3.48Å; H39-S43 PolarHBondContact O-N 2.93Å; H39-S43 PolarHBondContact O-OG 3.48Å; S43-L45 PolarHBondContact O-N 3.23Å; S43-I46 PolarHBondContact O-N 3.16Å; S43-C47 WeakPolarHBondContact O-CB 3.07Å; S43-C47 PolarHBondContact O-N 3.47Å; S43-C47 PolarHBondContact O-SG 2.84Å |
| 44 | T | 94.2 | Very high | 93.2 | Very high | 22 Ų | 22 | 54.3 Ų | 54.3 | 14% | 0.135 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.5 | -46 | 175.5 | -62.1 | 0 | 0 | 0 | 0 | 111.1 | G40 Y41 L42 C47 C48 L89 T92 L93 M96 | G40-T44 VanDerWaalsContact O-CB 3.29Å; G40-T44 WeakPolarHBondContact O-CB 3.4Å; G40-T44 PolarHBondContact O-N 2.88Å; G40-T44 VanDerWaalsContact O-N 3.17Å; G40-T44 PolarHBondContact O-OG1 3.12Å; Y41-T44 PolarHBondContact O-N 3.3Å; L42-T44 VanDerWaalsContact C-N 3.35Å; L42-T44 PolarHBondContact O-N 3.48Å; T44-C47 PolarHBondContact O-N 2.92Å; T44-C48 PolarHBondContact O-N 2.93Å; T44-C48 PolarHBondContact O-SG 3.34Å; T44-C48 VanDerWaalsContact O-SG 3.34Å; T44-L89 HydrophobicContact CG2-CD1 3.78Å; T44-T92 PolarHBondContact OG1-OG1 3.38Å; T44-L93 HydrophobicContact CG2-CD2 3.98Å; T44-M96 HydrophobicContact CG2-CE 4.2Å; T44-M96 WeakPolarHBondContact OG1-CE 3.21Å |
| 45 | L | 94.7 | Very high | 93.4 | Very high | 104 Ų | 104 | 57.1 Ų | 57.1 | 55% | 0.545 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -61.7 | -47.1 | 176.3 | 178.7 | 64.4 | 0 | 0 | 0 | 111.8 | Y41 L42 S43 C47 C48 L49 | Y41-L45 PolarHBondContact O-N 2.79Å; Y41-L45 VanDerWaalsContact O-N 3.09Å; L42-L45 PolarHBondContact O-N 3.39Å; S43-L45 PolarHBondContact O-N 3.23Å; L45-C47 VanDerWaalsContact C-N 3.34Å; L45-C47 PolarHBondContact O-N 3.49Å; L45-C48 PolarHBondContact O-N 3.31Å; L45-L49 HydrophobicContact CD1-CD1 4.17Å; L45-L49 HydrophobicContact CD1-CG 4.36Å; L45-L49 HydrophobicContact CG-CD1 4.23Å; L45-L49 WeakPolarHBondContact O-CG 3.23Å; L45-L49 PolarHBondContact O-N 3.06Å; L45-L49 VanDerWaalsContact O-N 3.08Å |
| 46 | I | 95.7 | Very high | 93.7 | Very high | 29 Ų | 29 | 56.1 Ų | 56.1 | 15% | 0.149 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -61.7 | -42.9 | 179.4 | -67.9 | 171.6 | 0 | 0 | 0 | 110.6 | L42 S43 L49 G50 M85 L315 L318 C322 | L42-I46 HydrophobicContact CD1-CD1 3.94Å; L42-I46 HydrophobicContact CD1-CG1 4.3Å; L42-I46 HydrophobicContact CD2-CD1 4.48Å; L42-I46 HydrophobicContact CG-CD1 3.8Å; L42-I46 HydrophobicContact CG-CG1 4.49Å; L42-I46 VanDerWaalsContact O-CG1 3.28Å; L42-I46 WeakPolarHBondContact O-CG1 3.19Å; L42-I46 PolarHBondContact O-N 3.02Å; S43-I46 PolarHBondContact O-N 3.16Å; I46-L49 PolarHBondContact O-N 3.28Å; I46-G50 WeakPolarHBondContact O-CA 3.35Å; I46-G50 PolarHBondContact O-N 3.41Å; I46-M85 HydrophobicContact CG2-CE 4.27Å; I46-L315 HydrophobicContact CD1-CD1 3.76Å; I46-L318 HydrophobicContact CG2-CB 3.85Å; I46-C322 VanDerWaalsContact CG2-SG 3.52Å |
| 47 | C | 96.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.4 | -47.5 | 177.1 | -69.5 | 0 | 0 | 0 | 0 | 111.8 | S43 T44 L45 L49 G50 I51 L89 | S43-C47 WeakPolarHBondContact O-CB 3.07Å; S43-C47 PolarHBondContact O-N 3.47Å; S43-C47 PolarHBondContact O-SG 2.84Å; T44-C47 PolarHBondContact O-N 2.92Å; L45-C47 VanDerWaalsContact C-N 3.34Å; L45-C47 PolarHBondContact O-N 3.49Å; C47-L49 PolarHBondContact O-N 3.49Å; C47-G50 PolarHBondContact O-N 2.92Å; C47-I51 WeakPolarHBondContact O-CB 3.4Å; C47-I51 WeakPolarHBondContact O-CD1 3.38Å; C47-I51 WeakPolarHBondContact O-CG1 3.29Å; C47-I51 PolarHBondContact O-N 3.43Å; C47-L89 HydrophobicContact CB-CB 3.97Å; C47-L89 HydrophobicContact CB-CD1 4.13Å |
| 48 | C | 95.8 | Very high | 94.8 | Very high | 54 Ų | 54 | 47.4 Ų | 47.4 | 37% | 0.365 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -57.5 | -48.7 | 178.4 | -72.7 | 0 | 0 | 0 | 0 | 112.1 | T44 L45 L52 | T44-C48 PolarHBondContact O-N 2.93Å; T44-C48 PolarHBondContact O-SG 3.34Å; T44-C48 VanDerWaalsContact O-SG 3.34Å; L45-C48 PolarHBondContact O-N 3.31Å; C48-L52 WeakPolarHBondContact O-CG 3.24Å; C48-L52 PolarHBondContact O-N 3.44Å |
| 49 | L | 96.2 | Very high | 95.1 | Very high | 105 Ų | 105 | 45.4 Ų | 45.4 | 55% | 0.55 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -66.6 | -41.9 | 177.8 | -66 | 177.9 | 0 | 0 | 0 | 111.9 | L45 I46 C47 L52 A53 | L45-L49 HydrophobicContact CD1-CD1 4.17Å; L45-L49 HydrophobicContact CD1-CG 4.36Å; L45-L49 HydrophobicContact CG-CD1 4.23Å; L45-L49 WeakPolarHBondContact O-CG 3.23Å; L45-L49 PolarHBondContact O-N 3.06Å; L45-L49 VanDerWaalsContact O-N 3.08Å; I46-L49 PolarHBondContact O-N 3.28Å; C47-L49 PolarHBondContact O-N 3.49Å; L49-L52 PolarHBondContact O-N 3.09Å; L49-A53 WeakPolarHBondContact O-CB 3.38Å; L49-A53 PolarHBondContact O-N 2.99Å |
| 50 | G | 96.8 | Very high | 95.4 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66 | -40.5 | -179 | 0 | 0 | 0 | 0 | 0 | 113.3 | I46 C47 A53 N54 M85 C322 | I46-G50 WeakPolarHBondContact O-CA 3.35Å; I46-G50 PolarHBondContact O-N 3.41Å; C47-G50 PolarHBondContact O-N 2.92Å; G50-A53 PolarHBondContact O-N 3.17Å; G50-N54 WeakPolarHBondContact O-CB 3.43Å; G50-N54 PolarHBondContact O-N 2.82Å; G50-N54 PolarHBondContact O-ND2 3.15Å; G50-M85 VanDerWaalsContact CA-SD 3.58Å; G50-C322 WeakPolarHBondContact CA-SG 3.23Å |
| 51 | I | 97.2 | Very high | 95.6 | Very high | 21 Ų | 21 | 44.1 Ų | 44.1 | 11% | 0.108 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.1 | -51.6 | 175.2 | -69.8 | 161.8 | 0 | 0 | 0 | 109.7 | C47 A53 N54 F55 M85 F86 L89 | C47-I51 WeakPolarHBondContact O-CB 3.4Å; C47-I51 WeakPolarHBondContact O-CD1 3.38Å; C47-I51 WeakPolarHBondContact O-CG1 3.29Å; C47-I51 PolarHBondContact O-N 3.43Å; I51-A53 VanDerWaalsContact C-N 3.35Å; I51-A53 PolarHBondContact O-N 3.22Å; I51-N54 PolarHBondContact O-N 2.91Å; I51-F55 HydrophobicContact CG2-CD2 3.6Å; I51-F55 HydrophobicContact CG2-CE2 3.47Å; I51-F55 VanDerWaalsContact CG2-CE2 3.47Å; I51-F55 WeakPolarHBondContact O-CD2 3.44Å; I51-F55 PolarHBondContact O-N 3.15Å; I51-M85 HydrophobicContact CD1-CB 4.37Å; I51-M85 HydrophobicContact CG1-CB 3.72Å; I51-F86 HydrophobicContact CD1-CB 4.19Å; I51-F86 HydrophobicContact CD1-CD2 4.46Å; I51-L89 HydrophobicContact CD1-CB 4.44Å; I51-L89 HydrophobicContact CD1-CD2 3.88Å |
| 52 | L | 96.3 | Very high | 95.8 | Very high | 122 Ų | 122 | 38.3 Ų | 38.3 | 64% | 0.639 | 21% | 0.211 | S | C | * | . | H | α-helix | trans | -60.1 | -44.4 | 178.4 | -66.8 | 174.3 | 0 | 0 | 0 | 112 | C48 L49 F55 A56 | C48-L52 WeakPolarHBondContact O-CG 3.24Å; C48-L52 PolarHBondContact O-N 3.44Å; L49-L52 PolarHBondContact O-N 3.09Å; L52-F55 PolarHBondContact O-N 3.47Å; L52-A56 WeakPolarHBondContact O-CB 3.32Å; L52-A56 PolarHBondContact O-N 2.84Å |
| 53 | A | 96.5 | Very high | 95.8 | Very high | 15 Ų | 15 | 40.2 Ų | 40.2 | 12% | 0.124 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63.3 | -41.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L49 G50 I51 T57 F325 | L49-A53 WeakPolarHBondContact O-CB 3.38Å; L49-A53 PolarHBondContact O-N 2.99Å; G50-A53 PolarHBondContact O-N 3.17Å; I51-A53 VanDerWaalsContact C-N 3.35Å; I51-A53 PolarHBondContact O-N 3.22Å; A53-T57 WeakPolarHBondContact O-CB 3.39Å; A53-T57 PolarHBondContact O-N 3.46Å; A53-T57 PolarHBondContact O-OG1 3.22Å; A53-F325 HydrophobicContact CB-CB 3.7Å; A53-F325 HydrophobicContact CB-CD1 3.96Å; A53-F325 HydrophobicContact CB-CD2 4.49Å; A53-F325 HydrophobicContact CB-CG 3.8Å; A53-F325 WeakPolarHBondContact O-CD2 3.33Å |
| 54 | N | 96.9 | Very high | 95.8 | Very high | 2 Ų | 2 | 44.5 Ų | 44.5 | 1% | 0.011 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -70.6 | -40.3 | 176.9 | -79.5 | -66.2 | 0 | 0 | 0 | 111.6 | G50 I51 A56 T57 I58 A78 A82 S321 | G50-N54 WeakPolarHBondContact O-CB 3.43Å; G50-N54 PolarHBondContact O-N 2.82Å; G50-N54 PolarHBondContact O-ND2 3.15Å; I51-N54 PolarHBondContact O-N 2.91Å; N54-A56 PolarHBondContact O-N 2.95Å; N54-T57 WeakPolarHBondContact O-CB 3.29Å; N54-T57 PolarHBondContact O-N 3.35Å; N54-I58 VanDerWaalsContact O-CG1 3.28Å; N54-I58 WeakPolarHBondContact O-CG1 3.46Å; N54-I58 PolarHBondContact O-N 3.18Å; N54-A78 HydrophobicContact CB-CB 4.39Å; N54-A78 WeakPolarHBondContact CB-O 3.43Å; N54-A78 WeakPolarHBondContact OD1-CA 3.49Å; N54-A82 HydrophobicContact CB-CB 3.89Å; N54-S321 PolarHBondContact ND2-O 2.94Å |
| 55 | F | 96.6 | Very high | 95.6 | Very high | 125 Ų | 125 | 46.9 Ų | 46.9 | 55% | 0.548 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.2 | -44.4 | 172.4 | -84.4 | -62.6 | 0 | 0 | 0 | 112.6 | I51 L52 T57 I58 A59 | I51-F55 HydrophobicContact CG2-CD2 3.6Å; I51-F55 HydrophobicContact CG2-CE2 3.47Å; I51-F55 VanDerWaalsContact CG2-CE2 3.47Å; I51-F55 WeakPolarHBondContact O-CD2 3.44Å; I51-F55 PolarHBondContact O-N 3.15Å; L52-F55 PolarHBondContact O-N 3.47Å; F55-T57 VanDerWaalsContact C-N 3.3Å; F55-T57 PolarHBondContact O-N 3.45Å; F55-I58 PolarHBondContact O-N 3.32Å; F55-A59 WeakPolarHBondContact O-CB 3.49Å; F55-A59 PolarHBondContact O-N 2.9Å |
| 56 | A | 95.9 | Very high | 95.3 | Very high | 10 Ų | 10 | 42.2 Ų | 42.2 | 8% | 0.083 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60.7 | -41.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112 | L52 N54 A59 V60 F325 F339 F343 | L52-A56 WeakPolarHBondContact O-CB 3.32Å; L52-A56 PolarHBondContact O-N 2.84Å; N54-A56 PolarHBondContact O-N 2.95Å; A56-A59 PolarHBondContact O-N 3.29Å; A56-V60 WeakPolarHBondContact O-CG2 3.49Å; A56-V60 PolarHBondContact O-N 3.04Å; A56-F325 HydrophobicContact CB-CD2 4.3Å; A56-F325 HydrophobicContact CB-CE2 3.76Å; A56-F325 HydrophobicContact CB-CZ 4.46Å; A56-F339 HydrophobicContact CB-CE2 4.05Å; A56-F343 HydrophobicContact CB-CE2 4.01Å; A56-F343 HydrophobicContact CB-CZ 3.88Å |
| 57 | T | 96.2 | Very high | 95.1 | Very high | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.3 | -49.2 | 175.4 | -61.1 | 0 | 0 | 0 | 0 | 111.4 | A53 N54 F55 A59 V60 L61 A78 F325 Y328 F335 | A53-T57 WeakPolarHBondContact O-CB 3.39Å; A53-T57 PolarHBondContact O-N 3.46Å; A53-T57 PolarHBondContact O-OG1 3.22Å; N54-T57 WeakPolarHBondContact O-CB 3.29Å; N54-T57 PolarHBondContact O-N 3.35Å; F55-T57 VanDerWaalsContact C-N 3.3Å; F55-T57 PolarHBondContact O-N 3.45Å; T57-A59 PolarHBondContact O-N 3.26Å; T57-V60 PolarHBondContact O-N 2.93Å; T57-L61 HydrophobicContact CG2-CD1 3.55Å; T57-L61 HydrophobicContact CG2-CG 4.13Å; T57-L61 WeakPolarHBondContact O-CB 3.48Å; T57-L61 VanDerWaalsContact O-CG 3.29Å; T57-L61 WeakPolarHBondContact O-CG 3.05Å; T57-L61 PolarHBondContact O-N 2.9Å; T57-A78 HydrophobicContact CG2-CB 3.86Å; T57-F325 WeakPolarHBondContact OG1-CD2 3.5Å; T57-Y328 HydrophobicContact CG2-CD2 3.86Å; T57-Y328 HydrophobicContact CG2-CE2 3.51Å; T57-F335 HydrophobicContact CG2-CE2 4.43Å |
| 58 | I | 96.9 | Very high | 94.9 | Very high | 41 Ų | 41 | 49.4 Ų | 49.4 | 21% | 0.21 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -60 | -48.7 | 178 | -64.1 | 161.5 | 0 | 0 | 0 | 110.5 | N54 F55 V60 L61 T62 A78 A79 | N54-I58 VanDerWaalsContact O-CG1 3.28Å; N54-I58 WeakPolarHBondContact O-CG1 3.46Å; N54-I58 PolarHBondContact O-N 3.18Å; F55-I58 PolarHBondContact O-N 3.32Å; I58-V60 VanDerWaalsContact C-N 3.26Å; I58-V60 PolarHBondContact O-N 3.47Å; I58-L61 PolarHBondContact O-N 3.43Å; I58-T62 HydrophobicContact CG2-CG2 4.19Å; I58-T62 WeakPolarHBondContact O-CB 3.3Å; I58-T62 VanDerWaalsContact O-CG2 3.23Å; I58-T62 WeakPolarHBondContact O-CG2 3.49Å; I58-T62 PolarHBondContact O-N 2.57Å; I58-T62 VanDerWaalsContact O-N 3.11Å; I58-T62 PolarHBondContact O-OG1 3.43Å; I58-A78 HydrophobicContact CD1-CB 4.36Å; I58-A78 HydrophobicContact CG1-CB 3.76Å; I58-A79 HydrophobicContact CD1-CB 3.97Å |
| 59 | A | 96.2 | Very high | 94.7 | Very high | 37 Ų | 37 | 46.8 Ų | 46.8 | 31% | 0.306 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -59.2 | -37.2 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | F55 A56 T57 R63 V342 | F55-A59 WeakPolarHBondContact O-CB 3.49Å; F55-A59 PolarHBondContact O-N 2.9Å; A56-A59 PolarHBondContact O-N 3.29Å; T57-A59 PolarHBondContact O-N 3.26Å; A59-R63 WeakPolarHBondContact O-CG 3.26Å; A59-V342 HydrophobicContact CB-CG1 4.29Å |
| 60 | V | 95.7 | Very high | 94.5 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -78.5 | -49.1 | 178.7 | 173.8 | 0 | 0 | 0 | 0 | 112.1 | A56 T57 I58 T62 R63 F335 E338 F339 V342 F343 | A56-V60 WeakPolarHBondContact O-CG2 3.49Å; A56-V60 PolarHBondContact O-N 3.04Å; T57-V60 PolarHBondContact O-N 2.93Å; I58-V60 VanDerWaalsContact C-N 3.26Å; I58-V60 PolarHBondContact O-N 3.47Å; V60-T62 PolarHBondContact O-N 3.28Å; V60-R63 WeakPolarHBondContact O-CB 3.31Å; V60-R63 WeakPolarHBondContact O-CG 3.49Å; V60-R63 PolarHBondContact O-N 3.35Å; V60-F335 HydrophobicContact CB-CD2 4.09Å; V60-F335 HydrophobicContact CB-CE2 3.68Å; V60-F335 HydrophobicContact CB-CZ 4.1Å; V60-F335 HydrophobicContact CG1-CD2 3.42Å; V60-F335 VanDerWaalsContact CG1-CD2 3.42Å; V60-F335 HydrophobicContact CG1-CE2 3.56Å; V60-F335 HydrophobicContact CG1-CG 3.94Å; V60-F335 HydrophobicContact CG1-CZ 4.18Å; V60-F335 HydrophobicContact CG2-CE2 4.38Å; V60-F335 HydrophobicContact CG2-CZ 4.31Å; V60-E338 HydrophobicContact CG1-CB 3.81Å; V60-F339 HydrophobicContact CG2-CB 3.87Å; V60-F339 HydrophobicContact CG2-CD2 3.88Å; V60-F339 HydrophobicContact CG2-CG 4.37Å; V60-V342 HydrophobicContact CG2-CG2 4.5Å; V60-F343 HydrophobicContact CG2-CE2 4.41Å |
| 61 | L | 94.5 | Very high | 94.3 | Very high | 2 Ų | 2 | 43.3 Ų | 43.3 | 1% | 0.01 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -68.9 | -21.6 | -174.2 | -67.2 | -177.6 | 0 | 0 | 0 | 113.4 | T57 I58 M66 N71 L74 A75 Y328 F335 | T57-L61 HydrophobicContact CG2-CD1 3.55Å; T57-L61 HydrophobicContact CG2-CG 4.13Å; T57-L61 WeakPolarHBondContact O-CB 3.48Å; T57-L61 VanDerWaalsContact O-CG 3.29Å; T57-L61 WeakPolarHBondContact O-CG 3.05Å; T57-L61 PolarHBondContact O-N 2.9Å; I58-L61 PolarHBondContact O-N 3.43Å; L61-M66 HydrophobicContact CD2-CE 3.83Å; L61-M66 WeakPolarHBondContact O-CB 3.42Å; L61-N71 HydrophobicContact CB-CB 4.42Å; L61-N71 HydrophobicContact CD2-CB 4.2Å; L61-L74 HydrophobicContact CD1-CB 3.64Å; L61-A75 HydrophobicContact CB-CB 4.14Å; L61-Y328 HydrophobicContact CD1-CE2 4.47Å; L61-F335 HydrophobicContact CD2-CD2 3.84Å; L61-F335 HydrophobicContact CD2-CE2 4.17Å; L61-F335 HydrophobicContact CG-CD2 4.36Å; L61-F335 HydrophobicContact CG-CE2 4.19Å |
| 62 | T | 95.2 | Very high | 94.2 | Very high | 50 Ų | 50 | 43.1 Ų | 43.1 | 31% | 0.307 | 23% | 0.232 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -88.7 | -4.2 | 179 | 58.1 | 0 | 0 | 0 | 0 | 114.1 | I58 V60 R67 A75 | I58-T62 HydrophobicContact CG2-CG2 4.19Å; I58-T62 WeakPolarHBondContact O-CB 3.3Å; I58-T62 VanDerWaalsContact O-CG2 3.23Å; I58-T62 WeakPolarHBondContact O-CG2 3.49Å; I58-T62 PolarHBondContact O-N 2.57Å; I58-T62 VanDerWaalsContact O-N 3.11Å; I58-T62 PolarHBondContact O-OG1 3.43Å; V60-T62 PolarHBondContact O-N 3.28Å; T62-R67 PolarHBondContact O-NE 3.42Å; T62-R67 PolarHBondContact O-NH2 2.94Å; T62-A75 HydrophobicContact CG2-CB 4Å |
| 63 | R | 94.6 | Very high | 94.2 | Very high | 106 Ų | 106 | 37.3 Ų | 37.3 | 40% | 0.4 | 20% | 0.201 | S | C | . | . | S | Bend | trans | -61.1 | 142.3 | 175.7 | -70.3 | -67 | -68.5 | 177.2 | 0.7 | 111.2 | A59 V60 A65 M66 R67 V342 | A59-R63 WeakPolarHBondContact O-CG 3.26Å; V60-R63 WeakPolarHBondContact O-CB 3.31Å; V60-R63 WeakPolarHBondContact O-CG 3.49Å; V60-R63 PolarHBondContact O-N 3.35Å; R63-A65 PolarHBondContact O-N 2.91Å; R63-A65 VanDerWaalsContact O-N 3.07Å; R63-M66 HydrophobicContact CB-CG 4.45Å; R63-M66 WeakPolarHBondContact O-CA 3.48Å; R63-M66 WeakPolarHBondContact O-CB 3.42Å; R63-M66 PolarHBondContact O-N 2.92Å; R63-R67 WeakPolarHBondContact O-CG 3.43Å; R63-R67 PolarHBondContact O-N 2.9Å; R63-V342 HydrophobicContact CG-CG2 3.69Å |
| 64 | P | 92.3 | Very high | 94.1 | Very high | 90 Ų | 90 | 36.7 Ų | 36.7 | 58% | 0.584 | 20% | 0.196 | S | C | * | . | G | 310 helix | trans | -49.5 | -38.9 | -178.1 | -30.2 | 35.9 | 0 | 0 | 0 | 114.9 | M66 R67 | P64-M66 PolarHBondContact O-N 2.91Å; P64-R67 PolarHBondContact O-N 3.42Å |
| 65 | A | 90.1 | Very high | 94.1 | Very high | 72 Ų | 72 | 37 Ų | 37 | 60% | 0.595 | 20% | 0.199 | S | C | * | . | G | 310 helix | trans | -66.9 | -19.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | R63 | R63-A65 PolarHBondContact O-N 2.91Å; R63-A65 VanDerWaalsContact O-N 3.07Å |
| 66 | M | 89.4 | Confident | 94.1 | Very high | 5 Ų | 5 | 31.6 Ų | 31.6 | 3% | 0.025 | 18% | 0.178 | C | C | . | . | G | 310 helix | trans | -103.7 | -3.9 | -176.4 | -66.1 | -66.5 | -78.4 | 0 | 0 | 113 | L61 R63 P64 T68 N71 M334 F335 E338 | L61-M66 HydrophobicContact CD2-CE 3.83Å; L61-M66 WeakPolarHBondContact O-CB 3.42Å; R63-M66 HydrophobicContact CB-CG 4.45Å; R63-M66 WeakPolarHBondContact O-CA 3.48Å; R63-M66 WeakPolarHBondContact O-CB 3.42Å; R63-M66 PolarHBondContact O-N 2.92Å; P64-M66 PolarHBondContact O-N 2.91Å; M66-T68 PolarHBondContact O-N 3.31Å; M66-N71 WeakPolarHBondContact O-CB 3.43Å; M66-N71 PolarHBondContact O-ND2 3Å; M66-M334 HydrophobicContact CE-CG 4.32Å; M66-M334 HydrophobicContact CE-SD 4.39Å; M66-M334 HydrophobicContact SD-CB 4.18Å; M66-M334 HydrophobicContact SD-CG 3.38Å; M66-M334 WeakPolarHBondContact SD-CG 3.43Å; M66-M334 HydrophobicContact SD-SD 3.39Å; M66-F335 HydrophobicContact CE-CB 4.44Å; M66-E338 HydrophobicContact CG-CB 4.37Å; M66-E338 HydrophobicContact CG-CG 3.81Å; M66-E338 HydrophobicContact SD-CG 4.07Å |
| 67 | R | 91.2 | Very high | 94.1 | Very high | 144 Ų | 144 | 31.3 Ų | 31.3 | 54% | 0.543 | 18% | 0.175 | S | C | . | . | trans | -73.1 | 84.9 | -169.5 | -72 | -176.5 | -178.1 | -179.4 | -3.6 | 113.1 | T62 R63 P64 I72 A156 | T62-R67 PolarHBondContact O-NE 3.42Å; T62-R67 PolarHBondContact O-NH2 2.94Å; R63-R67 WeakPolarHBondContact O-CG 3.43Å; R63-R67 PolarHBondContact O-N 2.9Å; P64-R67 PolarHBondContact O-N 3.42Å; R67-I72 HydrophobicContact CG-CD1 4.44Å; R67-A156 HydrophobicContact CB-CB 4.13Å | ||
| 68 | T | 91.5 | Very high | 94.1 | Very high | 36 Ų | 36 | 31.4 Ų | 31.4 | 22% | 0.221 | 18% | 0.176 | C | C | . | . | trans | -113.8 | 160.4 | 165.8 | 62.8 | 0 | 0 | 0 | 0 | 109.6 | M66 V70 N71 I72 N154 | M66-T68 PolarHBondContact O-N 3.31Å; T68-V70 PolarHBondContact O-N 3.39Å; T68-N71 PolarHBondContact O-N 3.42Å; T68-N71 WeakPolarHBondContact OG1-CB 3.42Å; T68-N71 PolarHBondContact OG1-N 3.42Å; T68-N71 PolarHBondContact OG1-ND2 3.29Å; T68-I72 VanDerWaalsContact O-CG1 3.29Å; T68-I72 WeakPolarHBondContact O-CG1 3.35Å; T68-I72 PolarHBondContact O-N 3.48Å; T68-N154 WeakPolarHBondContact CA-O 3.4Å; T68-N154 WeakPolarHBondContact CB-OD1 3.09Å | ||
| 69 | S | 92.6 | Very high | 94.2 | Very high | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -51.7 | -45.4 | 173.5 | 53.9 | 0 | 0 | 0 | 0 | 112.4 | I72 I73 V139 A153 N154 T155 | S69-I72 PolarHBondContact O-N 3.37Å; S69-I73 VanDerWaalsContact O-CG1 3.29Å; S69-I73 WeakPolarHBondContact O-CG1 3.49Å; S69-I73 PolarHBondContact O-N 2.8Å; S69-V139 VanDerWaalsContact OG-CG1 3.26Å; S69-V139 WeakPolarHBondContact OG-CG1 3.22Å; S69-A153 WeakPolarHBondContact CB-O 3.34Å; S69-A153 PolarHBondContact OG-O 3.04Å; S69-N154 PolarHBondContact N-O 3.32Å; S69-N154 WeakPolarHBondContact OG-CA 3.43Å; S69-T155 WeakPolarHBondContact CA-O 3.5Å; S69-T155 VanDerWaalsContact CB-O 3.23Å; S69-T155 WeakPolarHBondContact CB-O 3.44Å; S69-T155 PolarHBondContact N-O 3.17Å |
| 70 | V | 90.9 | Very high | 94.2 | Very high | 7 Ų | 7 | 30.1 Ų | 30.1 | 4% | 0.042 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -56.6 | -52.3 | 177.7 | 163.1 | 0 | 0 | 0 | 0 | 111.1 | T68 I72 I73 L74 L136 V139 L275 | T68-V70 PolarHBondContact O-N 3.39Å; V70-I72 VanDerWaalsContact C-N 3.33Å; V70-I72 PolarHBondContact O-N 3.22Å; V70-I73 PolarHBondContact O-N 3.17Å; V70-L74 HydrophobicContact CG1-CD1 3.95Å; V70-L74 WeakPolarHBondContact O-CB 3.48Å; V70-L74 VanDerWaalsContact O-CG 3.27Å; V70-L74 WeakPolarHBondContact O-CG 3.36Å; V70-L74 PolarHBondContact O-N 2.96Å; V70-L136 HydrophobicContact CB-CD1 3.96Å; V70-L136 HydrophobicContact CG1-CD1 3.69Å; V70-L136 HydrophobicContact CG2-CD1 3.89Å; V70-V139 HydrophobicContact CG2-CG1 4.09Å; V70-L275 HydrophobicContact CG1-CD1 4.41Å; V70-L275 HydrophobicContact CG1-CD2 4.28Å |
| 71 | N | 93.2 | Very high | 94.3 | Very high | 25 Ų | 25 | 30.4 Ų | 30.4 | 13% | 0.134 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -69.4 | -33.2 | -177.2 | -71.7 | -11.7 | 0 | 0 | 0 | 112.1 | L61 M66 T68 A75 | L61-N71 HydrophobicContact CB-CB 4.42Å; L61-N71 HydrophobicContact CD2-CB 4.2Å; M66-N71 WeakPolarHBondContact O-CB 3.43Å; M66-N71 PolarHBondContact O-ND2 3Å; T68-N71 PolarHBondContact O-N 3.42Å; T68-N71 WeakPolarHBondContact OG1-CB 3.42Å; T68-N71 PolarHBondContact OG1-N 3.42Å; T68-N71 PolarHBondContact OG1-ND2 3.29Å; N71-A75 WeakPolarHBondContact O-CB 3.45Å; N71-A75 PolarHBondContact O-N 2.94Å |
| 72 | I | 96 | Very high | 94.4 | Very high | 16 Ų | 16 | 30.6 Ų | 30.6 | 8% | 0.082 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -65.6 | -46.1 | 173.2 | -67.4 | -59.6 | 0 | 0 | 0 | 111 | R67 T68 S69 V70 L74 A75 G76 A156 L160 I163 | R67-I72 HydrophobicContact CG-CD1 4.44Å; T68-I72 VanDerWaalsContact O-CG1 3.29Å; T68-I72 WeakPolarHBondContact O-CG1 3.35Å; T68-I72 PolarHBondContact O-N 3.48Å; S69-I72 PolarHBondContact O-N 3.37Å; V70-I72 VanDerWaalsContact C-N 3.33Å; V70-I72 PolarHBondContact O-N 3.22Å; I72-L74 VanDerWaalsContact C-N 3.33Å; I72-L74 PolarHBondContact O-N 2.98Å; I72-A75 WeakPolarHBondContact O-CB 3.28Å; I72-A75 PolarHBondContact O-N 2.94Å; I72-A75 VanDerWaalsContact O-N 3.15Å; I72-G76 PolarHBondContact O-N 3.34Å; I72-A156 HydrophobicContact CG1-CB 3.98Å; I72-L160 HydrophobicContact CG2-CD2 3.8Å; I72-L160 HydrophobicContact CG2-CG 3.96Å; I72-I163 HydrophobicContact CG2-CD1 3.81Å; I72-I163 WeakPolarHBondContact O-CD1 3.18Å |
| 73 | I | 95.6 | Very high | 94.4 | Very high | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -60.5 | -44.2 | 176.1 | -68.4 | 164.8 | 0 | 0 | 0 | 110.7 | S69 V70 A75 G76 I77 L132 L136 V139 T162 | S69-I73 VanDerWaalsContact O-CG1 3.29Å; S69-I73 WeakPolarHBondContact O-CG1 3.49Å; S69-I73 PolarHBondContact O-N 2.8Å; V70-I73 PolarHBondContact O-N 3.17Å; I73-A75 VanDerWaalsContact C-N 3.31Å; I73-A75 PolarHBondContact O-N 2.88Å; I73-G76 WeakPolarHBondContact O-CA 3.35Å; I73-G76 PolarHBondContact O-N 2.94Å; I73-G76 VanDerWaalsContact O-N 3.07Å; I73-I77 HydrophobicContact CG2-CD1 4.22Å; I73-I77 PolarHBondContact O-N 3.35Å; I73-L132 HydrophobicContact CG2-CB 4.02Å; I73-L132 HydrophobicContact CG2-CD2 4.34Å; I73-L136 HydrophobicContact CG2-CB 3.95Å; I73-V139 HydrophobicContact CD1-CG2 4.14Å; I73-T162 HydrophobicContact CD1-CG2 3.98Å; I73-T162 HydrophobicContact CG1-CG2 4.32Å |
| 74 | L | 94.3 | Very high | 94.5 | Very high | 3 Ų | 3 | 26.6 Ų | 26.6 | 2% | 0.016 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.1 | -37.2 | 175.1 | -73.3 | 174.3 | 0 | 0 | 0 | 112.6 | L61 V70 I72 G76 I77 A78 L136 L275 I278 Y328 | L61-L74 HydrophobicContact CD1-CB 3.64Å; V70-L74 HydrophobicContact CG1-CD1 3.95Å; V70-L74 WeakPolarHBondContact O-CB 3.48Å; V70-L74 VanDerWaalsContact O-CG 3.27Å; V70-L74 WeakPolarHBondContact O-CG 3.36Å; V70-L74 PolarHBondContact O-N 2.96Å; I72-L74 VanDerWaalsContact C-N 3.33Å; I72-L74 PolarHBondContact O-N 2.98Å; L74-G76 VanDerWaalsContact C-N 3.34Å; L74-I77 HydrophobicContact CD2-CD1 4.26Å; L74-I77 PolarHBondContact O-N 3.46Å; L74-A78 PolarHBondContact O-N 3.48Å; L74-L136 HydrophobicContact CD2-CD2 3.44Å; L74-L136 VanDerWaalsContact CD2-CD2 3.44Å; L74-L136 HydrophobicContact CG-CD1 4.43Å; L74-L136 HydrophobicContact CG-CD2 4.05Å; L74-L275 HydrophobicContact CD1-CD2 4.22Å; L74-I278 HydrophobicContact CD2-CD1 4.41Å; L74-Y328 HydrophobicContact CD1-CE1 3.97Å; L74-Y328 WeakPolarHBondContact CD1-OH 3.48Å; L74-Y328 WeakPolarHBondContact CD2-OH 3.32Å |
| 75 | A | 96.4 | Very high | 94.6 | Very high | 8 Ų | 8 | 22.3 Ų | 22.3 | 7% | 0.066 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -66.1 | -36.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | L61 T62 N71 I72 I73 A78 A79 | L61-A75 HydrophobicContact CB-CB 4.14Å; T62-A75 HydrophobicContact CG2-CB 4Å; N71-A75 WeakPolarHBondContact O-CB 3.45Å; N71-A75 PolarHBondContact O-N 2.94Å; I72-A75 WeakPolarHBondContact O-CB 3.28Å; I72-A75 PolarHBondContact O-N 2.94Å; I72-A75 VanDerWaalsContact O-N 3.15Å; I73-A75 VanDerWaalsContact C-N 3.31Å; I73-A75 PolarHBondContact O-N 2.88Å; A75-A78 PolarHBondContact O-N 3.12Å; A75-A79 WeakPolarHBondContact O-CB 2.94Å; A75-A79 PolarHBondContact O-N 2.91Å |
| 76 | G | 97.3 | Very high | 94.9 | Very high | 11 Ų | 11 | 24.3 Ų | 24.3 | 11% | 0.113 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -62.6 | -42.8 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | I72 I73 L74 A79 C80 | I72-G76 PolarHBondContact O-N 3.34Å; I73-G76 WeakPolarHBondContact O-CA 3.35Å; I73-G76 PolarHBondContact O-N 2.94Å; I73-G76 VanDerWaalsContact O-N 3.07Å; L74-G76 VanDerWaalsContact C-N 3.34Å; G76-A79 PolarHBondContact O-N 2.89Å; G76-C80 PolarHBondContact O-N 3.24Å; G76-C80 PolarHBondContact O-SG 3.1Å |
| 77 | I | 96.3 | Very high | 95.1 | Very high | 4 Ų | 4 | 25.3 Ų | 25.3 | 2% | 0.021 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -59.2 | -48.9 | 172.7 | -71.9 | 167.4 | 0 | 0 | 0 | 110.5 | I73 L74 A79 C80 H81 S129 L132 | I73-I77 HydrophobicContact CG2-CD1 4.22Å; I73-I77 PolarHBondContact O-N 3.35Å; L74-I77 HydrophobicContact CD2-CD1 4.26Å; L74-I77 PolarHBondContact O-N 3.46Å; I77-A79 VanDerWaalsContact C-N 3.29Å; I77-A79 PolarHBondContact O-N 3.43Å; I77-C80 WeakPolarHBondContact O-CB 3.35Å; I77-C80 PolarHBondContact O-N 2.95Å; I77-H81 VanDerWaalsContact CG2-CE1 3.45Å; I77-H81 WeakPolarHBondContact CG2-CE1 3.41Å; I77-H81 PolarHBondContact O-N 3.37Å; I77-S129 WeakPolarHBondContact CG2-OG 3.49Å; I77-L132 HydrophobicContact CD1-CB 4.06Å; I77-L132 HydrophobicContact CG1-CB 3.73Å; I77-L132 HydrophobicContact CG1-CD1 4.13Å |
| 78 | A | 97 | Very high | 95.3 | Very high | 2 Ų | 2 | 19 Ų | 19 | 2% | 0.017 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -61.4 | -36.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | N54 T57 I58 L74 A75 H81 A82 | N54-A78 HydrophobicContact CB-CB 4.39Å; N54-A78 WeakPolarHBondContact CB-O 3.43Å; N54-A78 WeakPolarHBondContact OD1-CA 3.49Å; T57-A78 HydrophobicContact CG2-CB 3.86Å; I58-A78 HydrophobicContact CD1-CB 4.36Å; I58-A78 HydrophobicContact CG1-CB 3.76Å; L74-A78 PolarHBondContact O-N 3.48Å; A75-A78 PolarHBondContact O-N 3.12Å; A78-H81 PolarHBondContact O-N 3.36Å; A78-A82 WeakPolarHBondContact O-CB 3.39Å; A78-A82 PolarHBondContact O-N 3.28Å |
| 79 | A | 97.4 | Very high | 95.4 | Very high | 40 Ų | 40 | 18.4 Ų | 18.4 | 33% | 0.331 | 11% | 0.107 | S | C | . | . | H | α-helix | trans | -65.1 | -43.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | I58 A75 G76 I77 H81 A82 V83 | I58-A79 HydrophobicContact CD1-CB 3.97Å; A75-A79 WeakPolarHBondContact O-CB 2.94Å; A75-A79 PolarHBondContact O-N 2.91Å; G76-A79 PolarHBondContact O-N 2.89Å; I77-A79 VanDerWaalsContact C-N 3.29Å; I77-A79 PolarHBondContact O-N 3.43Å; A79-H81 VanDerWaalsContact C-N 3.35Å; A79-H81 PolarHBondContact O-N 3.37Å; A79-A82 PolarHBondContact O-N 2.96Å; A79-V83 WeakPolarHBondContact O-CG2 3.43Å; A79-V83 PolarHBondContact O-N 3.39Å; A79-V83 VanDerWaalsContact O-N 3.12Å |
| 80 | C | 97.3 | Very high | 95.5 | Very high | 12 Ų | 12 | 21.8 Ų | 21.8 | 8% | 0.081 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -58.5 | -48.3 | 174.3 | -62.6 | 0 | 0 | 0 | 0 | 110.8 | G76 I77 A82 V83 T84 L125 | G76-C80 PolarHBondContact O-N 3.24Å; G76-C80 PolarHBondContact O-SG 3.1Å; I77-C80 WeakPolarHBondContact O-CB 3.35Å; I77-C80 PolarHBondContact O-N 2.95Å; C80-A82 PolarHBondContact O-N 2.95Å; C80-V83 PolarHBondContact O-N 3.39Å; C80-T84 PolarHBondContact O-N 3.03Å; C80-T84 PolarHBondContact O-OG1 3.05Å; C80-L125 HydrophobicContact CB-CB 4.26Å; C80-L125 HydrophobicContact CB-CD2 4.36Å |
| 81 | H | 96.5 | Very high | 95.4 | Very high | 5 Ų | 5 | 25.2 Ų | 25.2 | 2% | 0.023 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -62.1 | -42.4 | 178.4 | -66.2 | 170.8 | 0 | 0 | 0 | 112.7 | I77 A78 A79 V83 T84 M85 S129 | I77-H81 VanDerWaalsContact CG2-CE1 3.45Å; I77-H81 WeakPolarHBondContact CG2-CE1 3.41Å; I77-H81 PolarHBondContact O-N 3.37Å; A78-H81 PolarHBondContact O-N 3.36Å; A79-H81 VanDerWaalsContact C-N 3.35Å; A79-H81 PolarHBondContact O-N 3.37Å; H81-V83 PolarHBondContact O-N 2.83Å; H81-T84 PolarHBondContact O-N 3.11Å; H81-M85 VanDerWaalsContact O-CB 3.32Å; H81-M85 WeakPolarHBondContact O-CB 3.49Å; H81-M85 VanDerWaalsContact O-CG 3.25Å; H81-M85 WeakPolarHBondContact O-CG 3.42Å; H81-M85 PolarHBondContact O-N 3.38Å; H81-S129 PolarHBondContact NE2-OG 3.36Å |
| 82 | A | 96.9 | Very high | 95.3 | Very high | 6 Ų | 6 | 24.4 Ų | 24.4 | 5% | 0.05 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -60.3 | -44.4 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | N54 A78 A79 C80 F86 | N54-A82 HydrophobicContact CB-CB 3.89Å; A78-A82 WeakPolarHBondContact O-CB 3.39Å; A78-A82 PolarHBondContact O-N 3.28Å; A79-A82 PolarHBondContact O-N 2.96Å; C80-A82 PolarHBondContact O-N 2.95Å; A82-F86 VanDerWaalsContact O-CB 3.31Å; A82-F86 WeakPolarHBondContact O-CB 3.31Å; A82-F86 PolarHBondContact O-N 3.16Å |
| 83 | V | 96.3 | Very high | 95.1 | Very high | 65 Ų | 65 | 27.6 Ų | 27.6 | 39% | 0.394 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -70.6 | -42.9 | -179.7 | 178 | 0 | 0 | 0 | 0 | 111.4 | A79 C80 H81 M85 F86 T87 L121 L125 | A79-V83 WeakPolarHBondContact O-CG2 3.43Å; A79-V83 PolarHBondContact O-N 3.39Å; A79-V83 VanDerWaalsContact O-N 3.12Å; C80-V83 PolarHBondContact O-N 3.39Å; H81-V83 PolarHBondContact O-N 2.83Å; V83-M85 PolarHBondContact O-N 2.9Å; V83-F86 PolarHBondContact O-N 3.15Å; V83-T87 PolarHBondContact O-N 2.92Å; V83-T87 PolarHBondContact O-OG1 3.37Å; V83-T87 VanDerWaalsContact O-OG1 3.11Å; V83-L121 HydrophobicContact CG1-CD2 3.98Å; V83-L125 HydrophobicContact CB-CD1 3.7Å; V83-L125 HydrophobicContact CG1-CD1 3.5Å; V83-L125 VanDerWaalsContact CG1-CD1 3.5Å |
| 84 | T | 95.6 | Very high | 94.8 | Very high | 7 Ų | 7 | 30.8 Ų | 30.8 | 4% | 0.043 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59.4 | -47.3 | 174.3 | -56 | 0 | 0 | 0 | 0 | 110.8 | C80 H81 F86 T87 Y88 L125 Q126 | C80-T84 PolarHBondContact O-N 3.03Å; C80-T84 PolarHBondContact O-OG1 3.05Å; H81-T84 PolarHBondContact O-N 3.11Å; T84-F86 VanDerWaalsContact C-N 3.35Å; T84-F86 PolarHBondContact O-N 3.23Å; T84-T87 PolarHBondContact O-N 3.23Å; T84-T87 PolarHBondContact O-OG1 3.07Å; T84-Y88 VanDerWaalsContact O-CB 3.3Å; T84-Y88 WeakPolarHBondContact O-CB 3.38Å; T84-Y88 PolarHBondContact O-N 3.41Å; T84-L125 WeakPolarHBondContact OG1-CB 3.49Å; T84-Q126 HydrophobicContact CG2-CG 4.44Å |
| 85 | M | 95.6 | Very high | 94.4 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -65 | -36.6 | 178.4 | -73.6 | 177.4 | 144.2 | 0 | 0 | 112.9 | I46 G50 I51 H81 V83 L89 L318 C322 | I46-M85 HydrophobicContact CG2-CE 4.27Å; G50-M85 VanDerWaalsContact CA-SD 3.58Å; I51-M85 HydrophobicContact CD1-CB 4.37Å; I51-M85 HydrophobicContact CG1-CB 3.72Å; H81-M85 VanDerWaalsContact O-CB 3.32Å; H81-M85 WeakPolarHBondContact O-CB 3.49Å; H81-M85 VanDerWaalsContact O-CG 3.25Å; H81-M85 WeakPolarHBondContact O-CG 3.42Å; H81-M85 PolarHBondContact O-N 3.38Å; V83-M85 PolarHBondContact O-N 2.9Å; M85-L89 WeakPolarHBondContact O-CB 3.44Å; M85-L89 PolarHBondContact O-N 3.45Å; M85-L318 HydrophobicContact CE-CB 4.5Å; M85-L318 HydrophobicContact CE-CD2 4.21Å; M85-L318 VanDerWaalsContact CE-O 3.22Å; M85-L318 WeakPolarHBondContact CE-O 3.13Å; M85-L318 HydrophobicContact CG-CD2 4.11Å; M85-C322 HydrophobicContact CE-CB 4.37Å; M85-C322 WeakPolarHBondContact CE-SG 3.5Å |
| 86 | F | 95.7 | Very high | 93.9 | Very high | 114 Ų | 114 | 35.8 Ų | 35.8 | 50% | 0.5 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -65.2 | -46.2 | 176.3 | 177.6 | -100.6 | 0 | 0 | 0 | 112.2 | I51 A82 V83 T84 Y88 L89 I90 | I51-F86 HydrophobicContact CD1-CB 4.19Å; I51-F86 HydrophobicContact CD1-CD2 4.46Å; A82-F86 VanDerWaalsContact O-CB 3.31Å; A82-F86 WeakPolarHBondContact O-CB 3.31Å; A82-F86 PolarHBondContact O-N 3.16Å; V83-F86 PolarHBondContact O-N 3.15Å; T84-F86 VanDerWaalsContact C-N 3.35Å; T84-F86 PolarHBondContact O-N 3.23Å; F86-Y88 VanDerWaalsContact C-N 3.35Å; F86-L89 WeakPolarHBondContact O-CB 3.4Å; F86-L89 PolarHBondContact O-N 3.18Å; F86-I90 HydrophobicContact CD1-CD1 4.39Å; F86-I90 HydrophobicContact CE1-CD1 3.85Å; F86-I90 HydrophobicContact CZ-CD1 4.16Å; F86-I90 PolarHBondContact O-N 3.02Å |
| 87 | T | 94.6 | Very high | 93.3 | Very high | 26 Ų | 26 | 40 Ų | 40 | 16% | 0.16 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -68.1 | -36.4 | 177.5 | 55.2 | 0 | 0 | 0 | 0 | 112 | V83 T84 I90 F91 H118 L121 | V83-T87 PolarHBondContact O-N 2.92Å; V83-T87 PolarHBondContact O-OG1 3.37Å; V83-T87 VanDerWaalsContact O-OG1 3.11Å; T84-T87 PolarHBondContact O-N 3.23Å; T84-T87 PolarHBondContact O-OG1 3.07Å; T87-I90 PolarHBondContact O-N 2.96Å; T87-F91 PolarHBondContact O-N 3.24Å; T87-H118 WeakPolarHBondContact CB-ND1 3.42Å; T87-H118 PolarHBondContact OG1-CE1 3Å; T87-H118 PolarHBondContact OG1-ND1 2.99Å; T87-L121 HydrophobicContact CG2-CD2 4.14Å |
| 88 | Y | 94 | Very high | 92.8 | Very high | 11 Ų | 11 | 42.1 Ų | 42.1 | 4% | 0.043 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -64.8 | -38.5 | 173.5 | -162.4 | -93.3 | 0 | 0 | 0 | 112.4 | H39 T84 F86 I90 F91 T92 H118 D314 L318 | H39-Y88 PolarHBondContact CE1-OH 3.17Å; H39-Y88 PolarHBondContact NE2-OH 3.46Å; T84-Y88 VanDerWaalsContact O-CB 3.3Å; T84-Y88 WeakPolarHBondContact O-CB 3.38Å; T84-Y88 PolarHBondContact O-N 3.41Å; F86-Y88 VanDerWaalsContact C-N 3.35Å; Y88-I90 VanDerWaalsContact C-N 3.28Å; Y88-I90 PolarHBondContact O-N 3.44Å; Y88-F91 CarbonylContact O-C 3.52Å; Y88-F91 WeakPolarHBondContact O-CA 3.49Å; Y88-F91 WeakPolarHBondContact O-CB 3.43Å; Y88-F91 PolarHBondContact O-N 3.46Å; Y88-T92 HydrophobicContact CD1-CG2 3.49Å; Y88-T92 VanDerWaalsContact CD1-CG2 3.49Å; Y88-T92 HydrophobicContact CE1-CG2 3.2Å; Y88-T92 WeakPolarHBondContact O-CG2 3.4Å; Y88-T92 PolarHBondContact O-N 2.93Å; Y88-H118 AromaticContact CD2-CE1 3.84Å; Y88-H118 AromaticContact CD2-NE2 3.52Å; Y88-H118 PolarHBondContact N-CE1 3.47Å; Y88-D314 HydrophobicContact CE2-CB 3.95Å; Y88-D314 WeakPolarHBondContact CE2-OD2 3.44Å; Y88-D314 WeakPolarHBondContact OH-CB 3.27Å; Y88-D314 PolarHBondContact OH-OD2 2.79Å; Y88-L318 HydrophobicContact CD1-CD1 3.98Å; Y88-L318 HydrophobicContact CD1-CD2 4.06Å; Y88-L318 HydrophobicContact CD1-CG 4.48Å; Y88-L318 HydrophobicContact CE1-CD1 3.71Å; Y88-L318 HydrophobicContact CE1-CG 4.46Å; Y88-L318 HydrophobicContact CG-CD2 4.35Å |
| 89 | L | 94.7 | Very high | 92.1 | Very high | 25 Ų | 25 | 46.2 Ų | 46.2 | 13% | 0.131 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.2 | -39.8 | 175.5 | 178.4 | 63.2 | 0 | 0 | 0 | 112.1 | T44 C47 I51 M85 F86 F91 T92 L93 | T44-L89 HydrophobicContact CG2-CD1 3.78Å; C47-L89 HydrophobicContact CB-CB 3.97Å; C47-L89 HydrophobicContact CB-CD1 4.13Å; I51-L89 HydrophobicContact CD1-CB 4.44Å; I51-L89 HydrophobicContact CD1-CD2 3.88Å; M85-L89 WeakPolarHBondContact O-CB 3.44Å; M85-L89 PolarHBondContact O-N 3.45Å; F86-L89 WeakPolarHBondContact O-CB 3.4Å; F86-L89 PolarHBondContact O-N 3.18Å; L89-F91 VanDerWaalsContact C-N 3.3Å; L89-F91 PolarHBondContact O-N 2.69Å; L89-T92 PolarHBondContact O-N 3.16Å; L89-T92 PolarHBondContact O-OG1 2.9Å; L89-L93 HydrophobicContact CD1-CD1 4.09Å; L89-L93 HydrophobicContact CD1-CG 4.06Å; L89-L93 HydrophobicContact CG-CD1 3.97Å; L89-L93 HydrophobicContact CG-CG 4.37Å; L89-L93 WeakPolarHBondContact O-CB 3.46Å; L89-L93 WeakPolarHBondContact O-CG 3.21Å; L89-L93 PolarHBondContact O-N 3.19Å |
| 90 | I | 93.3 | Very high | 91.3 | Very high | 71 Ų | 71 | 47.5 Ų | 47.5 | 36% | 0.364 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -62.8 | -42.7 | 175.5 | -63 | 169.1 | 0 | 0 | 0 | 110.1 | F86 T87 Y88 R94 W111 | F86-I90 HydrophobicContact CD1-CD1 4.39Å; F86-I90 HydrophobicContact CE1-CD1 3.85Å; F86-I90 HydrophobicContact CZ-CD1 4.16Å; F86-I90 PolarHBondContact O-N 3.02Å; T87-I90 PolarHBondContact O-N 2.96Å; Y88-I90 VanDerWaalsContact C-N 3.28Å; Y88-I90 PolarHBondContact O-N 3.44Å; I90-R94 WeakPolarHBondContact O-CB 3.32Å; I90-R94 PolarHBondContact O-N 3.09Å; I90-R94 VanDerWaalsContact O-N 3.13Å; I90-W111 HydrophobicContact CG2-CZ3 4.4Å |
| 91 | F | 89.9 | Confident | 90.6 | Very high | 79 Ų | 79 | 48.9 Ų | 48.9 | 35% | 0.346 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -61.8 | -48.6 | 177.1 | -175.3 | -98.9 | 0 | 0 | 0 | 112.2 | T87 Y88 L89 R94 G95 W111 V115 | T87-F91 PolarHBondContact O-N 3.24Å; Y88-F91 CarbonylContact O-C 3.52Å; Y88-F91 WeakPolarHBondContact O-CA 3.49Å; Y88-F91 WeakPolarHBondContact O-CB 3.43Å; Y88-F91 PolarHBondContact O-N 3.46Å; L89-F91 VanDerWaalsContact C-N 3.3Å; L89-F91 PolarHBondContact O-N 2.69Å; F91-R94 PolarHBondContact O-N 3.39Å; F91-G95 PolarHBondContact O-N 3.49Å; F91-W111 HydrophobicContact CD2-CH2 4.28Å; F91-W111 HydrophobicContact CD2-CZ2 4.01Å; F91-W111 HydrophobicContact CE2-CZ2 4.4Å; F91-V115 HydrophobicContact CD2-CG2 4.43Å; F91-V115 HydrophobicContact CE2-CG2 4.34Å |
| 92 | T | 90.5 | Very high | 90 | Very high | 7 Ų | 7 | 50 Ų | 50 | 4% | 0.043 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -66.9 | -40.9 | -179.5 | 62.7 | 0 | 0 | 0 | 0 | 112.5 | T44 Y88 L89 R94 G95 M96 | T44-T92 PolarHBondContact OG1-OG1 3.38Å; Y88-T92 HydrophobicContact CD1-CG2 3.49Å; Y88-T92 VanDerWaalsContact CD1-CG2 3.49Å; Y88-T92 HydrophobicContact CE1-CG2 3.2Å; Y88-T92 WeakPolarHBondContact O-CG2 3.4Å; Y88-T92 PolarHBondContact O-N 2.93Å; L89-T92 PolarHBondContact O-N 3.16Å; L89-T92 PolarHBondContact O-OG1 2.9Å; T92-R94 VanDerWaalsContact C-N 3.31Å; T92-R94 PolarHBondContact O-N 3.49Å; T92-G95 PolarHBondContact O-N 2.77Å; T92-M96 WeakPolarHBondContact O-CG 3.48Å; T92-M96 PolarHBondContact O-N 3.37Å |
| 93 | L | 91.3 | Very high | 89.4 | Confident | 84 Ų | 84 | 52.9 Ų | 52.9 | 44% | 0.44 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60.6 | -41.4 | 176.9 | -72.8 | 173.9 | 0 | 0 | 0 | 111.8 | T44 L89 M96 | T44-L93 HydrophobicContact CG2-CD2 3.98Å; L89-L93 HydrophobicContact CD1-CD1 4.09Å; L89-L93 HydrophobicContact CD1-CG 4.06Å; L89-L93 HydrophobicContact CG-CD1 3.97Å; L89-L93 HydrophobicContact CG-CG 4.37Å; L89-L93 WeakPolarHBondContact O-CB 3.46Å; L89-L93 WeakPolarHBondContact O-CG 3.21Å; L89-L93 PolarHBondContact O-N 3.19Å; L93-M96 HydrophobicContact CD2-CE 3.68Å |
| 94 | R | 89.7 | Confident | 88.7 | Confident | 66 Ų | 66 | 51.5 Ų | 51.5 | 25% | 0.249 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -69.6 | -43.3 | 175.7 | -175.3 | 67.5 | 160.6 | 168.7 | 1.5 | 111.6 | I90 F91 T92 M96 L97 M98 Y106 W111 | I90-R94 WeakPolarHBondContact O-CB 3.32Å; I90-R94 PolarHBondContact O-N 3.09Å; I90-R94 VanDerWaalsContact O-N 3.13Å; F91-R94 PolarHBondContact O-N 3.39Å; T92-R94 VanDerWaalsContact C-N 3.31Å; T92-R94 PolarHBondContact O-N 3.49Å; R94-M96 PolarHBondContact O-N 3.27Å; R94-L97 WeakPolarHBondContact O-CB 3.34Å; R94-L97 PolarHBondContact O-N 2.9Å; R94-M98 HydrophobicContact CG-SD 3.95Å; R94-M98 PolarHBondContact O-N 2.88Å; R94-Y106 VanDerWaalsContact NH2-CD1 3.32Å; R94-Y106 PolarHBondContact NH2-O 2.87Å; R94-W111 HydrophobicContact CB-CH2 3.41Å; R94-W111 VanDerWaalsContact CB-CH2 3.41Å; R94-W111 HydrophobicContact CB-CZ2 3.82Å; R94-W111 HydrophobicContact CB-CZ3 3.93Å; R94-W111 HydrophobicContact CG-CD2 4.19Å; R94-W111 HydrophobicContact CG-CE3 4.13Å; R94-W111 HydrophobicContact CG-CH2 3.46Å; R94-W111 VanDerWaalsContact CG-CH2 3.46Å; R94-W111 HydrophobicContact CG-CZ2 3.49Å; R94-W111 VanDerWaalsContact CG-CZ2 3.49Å; R94-W111 HydrophobicContact CG-CZ3 3.79Å |
| 95 | G | 86.4 | Confident | 88.1 | Confident | 41 Ų | 41 | 56.2 Ų | 56.2 | 42% | 0.423 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -56.3 | -36.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | F91 T92 L97 M98 | F91-G95 PolarHBondContact O-N 3.49Å; T92-G95 PolarHBondContact O-N 2.77Å; G95-L97 PolarHBondContact O-N 3.49Å; G95-M98 PolarHBondContact O-N 3.17Å |
| 96 | M | 85.1 | Confident | 87.5 | Confident | 75 Ų | 75 | 58.8 Ų | 58.8 | 37% | 0.369 | 30% | 0.299 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | -18.1 | 175.6 | -71.4 | -171.8 | -68.6 | 0 | 0 | 114.6 | Y41 T44 T92 L93 R94 | Y41-M96 HydrophobicContact CD1-SD 4.01Å; Y41-M96 HydrophobicContact CE1-SD 4.09Å; T44-M96 HydrophobicContact CG2-CE 4.2Å; T44-M96 WeakPolarHBondContact OG1-CE 3.21Å; T92-M96 WeakPolarHBondContact O-CG 3.48Å; T92-M96 PolarHBondContact O-N 3.37Å; L93-M96 HydrophobicContact CD2-CE 3.68Å; R94-M96 PolarHBondContact O-N 3.27Å |
| 97 | L | 85.9 | Confident | 87 | Confident | 101 Ų | 101 | 53.5 Ų | 53.5 | 53% | 0.529 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.2 | -19.1 | 176.6 | -60 | 173.8 | 0 | 0 | 0 | 112.7 | R94 G95 N102 Y106 | R94-L97 WeakPolarHBondContact O-CB 3.34Å; R94-L97 PolarHBondContact O-N 2.9Å; G95-L97 PolarHBondContact O-N 3.49Å; L97-N102 PolarHBondContact O-ND2 3.29Å; L97-Y106 HydrophobicContact CB-CD1 4.4Å; L97-Y106 HydrophobicContact CB-CE1 3.71Å; L97-Y106 HydrophobicContact CD1-CE1 4.34Å |
| 98 | M | 84.3 | Confident | 86.9 | Confident | 47 Ų | 47 | 55.2 Ų | 55.2 | 23% | 0.232 | 29% | 0.286 | C | S | . | . | trans | -88.3 | 134.8 | -174.6 | -68.5 | 177.9 | 66.4 | 0 | 0 | 110.8 | R94 G95 N102 Y103 Y106 | R94-M98 HydrophobicContact CG-SD 3.95Å; R94-M98 PolarHBondContact O-N 2.88Å; G95-M98 PolarHBondContact O-N 3.17Å; M98-N102 WeakPolarHBondContact CA-OD1 3.45Å; M98-Y103 HydrophobicContact CE-CD2 3.41Å; M98-Y103 VanDerWaalsContact CE-CD2 3.41Å; M98-Y103 HydrophobicContact CE-CE2 3.7Å; M98-Y103 HydrophobicContact CE-CG 4.34Å; M98-Y106 HydrophobicContact CG-CD1 3.59Å; M98-Y106 HydrophobicContact CG-CG 3.75Å; M98-Y106 HydrophobicContact SD-CD1 4.46Å | ||
| 99 | N | 83.3 | Confident | 86.8 | Confident | 88 Ų | 88 | 60.8 Ų | 60.8 | 47% | 0.471 | 31% | 0.308 | S | S | . | . | trans | -136.6 | 171.9 | 168.3 | 68.8 | 23.9 | 0 | 0 | 0 | 109.4 | C101 N102 Y103 | N99-C101 PolarHBondContact O-N 3.45Å; N99-C101 VanDerWaalsContact O-N 3.08Å; N99-C101 WeakPolarHBondContact OD1-CA 3.36Å; N99-C101 PolarHBondContact OD1-N 3.49Å; N99-N102 PolarHBondContact N-OD1 3.29Å; N99-N102 PolarHBondContact O-N 3.36Å; N99-N102 PolarHBondContact O-OD1 3.32Å; N99-N102 VanDerWaalsContact O-OD1 3.05Å; N99-N102 PolarHBondContact OD1-N 3.04Å; N99-N102 PolarHBondContact OD1-OD1 2.68Å; N99-Y103 PolarHBondContact O-N 3.36Å | ||
| 100 | D | 79.5 | Confident | 86.7 | Confident | 68 Ų | 68 | 66.9 Ų | 66.9 | 36% | 0.364 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -22.8 | -175.9 | -59.6 | -35 | 0 | 0 | 0 | 113.4 | R193 | D100-R193 IonicContact OD2-CZ 3.83Å; D100-R193 VanDerWaalsContact OD2-CZ 3.28Å; D100-R193 IonicContact OD2-NH1 3.48Å; D100-R193 IonicContact OD2-NH2 3.39Å; D100-R193 PolarHBondContact OD2-NH2 2.92Å |
| 101 | C | 83.6 | Confident | 86.6 | Confident | 41 Ų | 41 | 64.9 Ų | 64.9 | 28% | 0.277 | 33% | 0.326 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.3 | -27.1 | -178.8 | -59.5 | 0 | 0 | 0 | 0 | 113.4 | N99 H104 L190 C194 | N99-C101 PolarHBondContact O-N 3.45Å; N99-C101 VanDerWaalsContact O-N 3.08Å; N99-C101 WeakPolarHBondContact OD1-CA 3.36Å; N99-C101 PolarHBondContact OD1-N 3.49Å; C101-H104 PolarHBondContact O-CE1 3.22Å; C101-H104 VanDerWaalsContact O-CE1 3.3Å; C101-L190 WeakPolarHBondContact O-CD1 3.24Å; C101-C194 WeakPolarHBondContact CA-SG 3.46Å; C101-C194 HydrophobicContact CB-CB 3.6Å; C101-C194 WeakPolarHBondContact CB-SG 3.27Å; C101-C194 WeakPolarHBondContact SG-CB 3.38Å; C101-C194 CovalentContact SG-SG 2.04Å; C101-C194 PolarHBondContact SG-SG 3.32Å |
| 102 | N | 84.6 | Confident | 86.8 | Confident | 28 Ų | 28 | 61.7 Ų | 61.7 | 15% | 0.15 | 31% | 0.312 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -109.3 | -3.1 | -179.6 | 73.8 | 8.7 | 0 | 0 | 0 | 113.4 | L97 M98 N99 H104 I105 Y106 | L97-N102 PolarHBondContact O-ND2 3.29Å; M98-N102 WeakPolarHBondContact CA-OD1 3.45Å; N99-N102 PolarHBondContact N-OD1 3.29Å; N99-N102 PolarHBondContact O-N 3.36Å; N99-N102 PolarHBondContact O-OD1 3.32Å; N99-N102 VanDerWaalsContact O-OD1 3.05Å; N99-N102 PolarHBondContact OD1-N 3.04Å; N99-N102 PolarHBondContact OD1-OD1 2.68Å; N102-H104 VanDerWaalsContact C-N 3.27Å; N102-H104 PolarHBondContact O-N 3.4Å; N102-H104 VanDerWaalsContact O-N 3.1Å; N102-I105 HydrophobicContact CB-CD1 4.33Å; N102-I105 WeakPolarHBondContact O-CB 3.35Å; N102-I105 PolarHBondContact O-N 2.95Å; N102-Y106 HydrophobicContact CB-CD2 4.12Å; N102-Y106 HydrophobicContact CB-CE2 3.98Å; N102-Y106 VanDerWaalsContact O-CD2 3.27Å; N102-Y106 WeakPolarHBondContact O-CD2 3.31Å; N102-Y106 PolarHBondContact O-N 3.36Å |
| 103 | Y | 84.4 | Confident | 86.9 | Confident | 66 Ų | 66 | 63 Ų | 63 | 26% | 0.259 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -44.4 | -48.4 | -177.3 | 176.6 | -93 | 0 | 0 | 0 | 113.8 | M98 N99 I105 Y106 S107 F188 T205 | M98-Y103 HydrophobicContact CE-CD2 3.41Å; M98-Y103 VanDerWaalsContact CE-CD2 3.41Å; M98-Y103 HydrophobicContact CE-CE2 3.7Å; M98-Y103 HydrophobicContact CE-CG 4.34Å; N99-Y103 PolarHBondContact O-N 3.36Å; Y103-I105 VanDerWaalsContact C-N 3.28Å; Y103-I105 PolarHBondContact O-N 3.44Å; Y103-Y106 CarbonylContact O-C 3.59Å; Y103-Y106 WeakPolarHBondContact O-CA 3.31Å; Y103-Y106 PolarHBondContact O-N 2.93Å; Y103-S107 WeakPolarHBondContact O-CB 3.28Å; Y103-S107 PolarHBondContact O-N 3.01Å; Y103-F188 HydrophobicContact CD1-CD2 4.02Å; Y103-F188 AromaticContact CD1-CE2 3.6Å; Y103-F188 HydrophobicContact CD1-CE2 3.6Å; Y103-F188 HydrophobicContact CD1-CZ 4.2Å; Y103-F188 HydrophobicContact CE1-CD2 4.4Å; Y103-F188 HydrophobicContact CE1-CE2 4.3Å; Y103-F188 HydrophobicContact CG-CE2 4.43Å; Y103-T205 WeakPolarHBondContact CE1-OG1 3.35Å |
| 104 | H | 81 | Confident | 87 | Confident | 36 Ų | 36 | 62.1 Ų | 62.1 | 17% | 0.167 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -59.9 | -34.1 | -179.9 | 65.9 | -78.5 | 0 | 0 | 0 | 113.8 | C101 N102 Y106 F188 S203 | C101-H104 PolarHBondContact O-CE1 3.22Å; C101-H104 VanDerWaalsContact O-CE1 3.3Å; N102-H104 VanDerWaalsContact C-N 3.27Å; N102-H104 PolarHBondContact O-N 3.4Å; N102-H104 VanDerWaalsContact O-N 3.1Å; H104-Y106 PolarHBondContact O-N 2.93Å; H104-F188 HydrophobicContact CB-CB 4.4Å; H104-F188 HydrophobicContact CB-CD1 3.48Å; H104-F188 VanDerWaalsContact CB-CD1 3.48Å; H104-F188 HydrophobicContact CB-CE1 3.79Å; H104-F188 HydrophobicContact CB-CG 3.93Å; H104-F188 AromaticContact CG-CD1 3.99Å; H104-F188 AromaticContact ND1-CE1 3.79Å; H104-S203 PolarHBondContact CD2-OG 3.02Å; H104-S203 VanDerWaalsContact CD2-OG 3.31Å |
| 105 | I | 82.4 | Confident | 87.1 | Confident | 106 Ų | 106 | 60.3 Ų | 60.3 | 54% | 0.544 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -68.7 | -32.5 | 176.5 | -53.3 | 174.9 | 0 | 0 | 0 | 109.9 | N102 Y103 | N102-I105 HydrophobicContact CB-CD1 4.33Å; N102-I105 WeakPolarHBondContact O-CB 3.35Å; N102-I105 PolarHBondContact O-N 2.95Å; Y103-I105 VanDerWaalsContact C-N 3.28Å; Y103-I105 PolarHBondContact O-N 3.44Å |
| 106 | Y | 83.6 | Confident | 87.4 | Confident | 55 Ų | 55 | 59.2 Ų | 59.2 | 22% | 0.216 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -91.1 | -24.5 | -172.8 | -74.1 | -116.5 | 0 | 0 | 0 | 112.8 | R94 L97 M98 N102 Y103 H104 T108 | R94-Y106 VanDerWaalsContact NH2-CD1 3.32Å; R94-Y106 PolarHBondContact NH2-O 2.87Å; L97-Y106 HydrophobicContact CB-CD1 4.4Å; L97-Y106 HydrophobicContact CB-CE1 3.71Å; L97-Y106 HydrophobicContact CD1-CE1 4.34Å; M98-Y106 HydrophobicContact CG-CD1 3.59Å; M98-Y106 HydrophobicContact CG-CG 3.75Å; M98-Y106 HydrophobicContact SD-CD1 4.46Å; N102-Y106 HydrophobicContact CB-CD2 4.12Å; N102-Y106 HydrophobicContact CB-CE2 3.98Å; N102-Y106 VanDerWaalsContact O-CD2 3.27Å; N102-Y106 WeakPolarHBondContact O-CD2 3.31Å; N102-Y106 PolarHBondContact O-N 3.36Å; Y103-Y106 CarbonylContact O-C 3.59Å; Y103-Y106 WeakPolarHBondContact O-CA 3.31Å; Y103-Y106 PolarHBondContact O-N 2.93Å; H104-Y106 PolarHBondContact O-N 2.93Å; Y106-T108 VanDerWaalsContact C-N 3.33Å; Y106-T108 PolarHBondContact O-N 3.47Å; Y106-T108 VanDerWaalsContact O-N 3.11Å |
| 107 | S | 85.4 | Confident | 87.8 | Confident | 2 Ų | 2 | 59.8 Ų | 59.8 | 1% | 0.014 | 31% | 0.31 | C | S | . | . | trans | -85 | 64.6 | -178.8 | -167.9 | 0 | 0 | 0 | 0 | 112.8 | Y103 Q112 T205 Y206 | Y103-S107 WeakPolarHBondContact O-CB 3.28Å; Y103-S107 PolarHBondContact O-N 3.01Å; S107-Q112 PolarHBondContact OG-NE2 2.91Å; S107-T205 WeakPolarHBondContact CB-OG1 3.37Å; S107-T205 PolarHBondContact OG-OG1 2.93Å; S107-Y206 WeakPolarHBondContact O-CD2 3.42Å; S107-Y206 PolarHBondContact O-N 2.94Å; S107-Y206 PolarHBondContact OG-O 2.98Å | ||
| 108 | T | 90.9 | Very high | 88.1 | Confident | 62 Ų | 62 | 56.1 Ų | 56.1 | 38% | 0.38 | 29% | 0.291 | S | S | . | . | trans | -85.3 | 160.3 | 175.4 | 62.6 | 0 | 0 | 0 | 0 | 111.6 | Y106 M110 W111 Q112 | Y106-T108 VanDerWaalsContact C-N 3.33Å; Y106-T108 PolarHBondContact O-N 3.47Å; Y106-T108 VanDerWaalsContact O-N 3.11Å; T108-M110 VanDerWaalsContact C-N 3.26Å; T108-M110 PolarHBondContact O-N 3.27Å; T108-W111 WeakPolarHBondContact O-CB 3.2Å; T108-W111 PolarHBondContact O-N 3.49Å; T108-W111 WeakPolarHBondContact OG1-CB 3.37Å; T108-W111 PolarHBondContact OG1-N 3.08Å; T108-Q112 PolarHBondContact O-N 3.4Å | ||
| 109 | Y | 92.4 | Very high | 88.5 | Confident | 128 Ų | 128 | 55.9 Ų | 55.9 | 50% | 0.502 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -52.7 | -44.9 | 173.6 | 179.2 | -91.5 | 0 | 0 | 0 | 112.2 | W111 Q112 A113 I183 Y206 | Y109-W111 VanDerWaalsContact C-N 3.31Å; Y109-W111 PolarHBondContact O-N 3.42Å; Y109-Q112 PolarHBondContact O-N 2.78Å; Y109-A113 PolarHBondContact O-N 3.34Å; Y109-I183 HydrophobicContact CD2-CB 4.22Å; Y109-I183 HydrophobicContact CD2-CD1 4.46Å; Y109-I183 HydrophobicContact CD2-CG2 3.64Å; Y109-I183 HydrophobicContact CE2-CB 3.87Å; Y109-I183 HydrophobicContact CE2-CD1 4.07Å; Y109-I183 HydrophobicContact CE2-CG2 3.84Å; Y109-Y206 AromaticContact CD2-CD1 3.99Å; Y109-Y206 HydrophobicContact CD2-CD1 3.99Å; Y109-Y206 HydrophobicContact CD2-CE1 4.1Å |
| 110 | M | 92.6 | Very high | 88.9 | Confident | 153 Ų | 153 | 52 Ų | 52 | 75% | 0.754 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -62.1 | -38.6 | 177.7 | -70.6 | -173.6 | 70 | 0 | 0 | 112.2 | T108 A113 V114 | T108-M110 VanDerWaalsContact C-N 3.26Å; T108-M110 PolarHBondContact O-N 3.27Å; M110-A113 PolarHBondContact O-N 2.95Å; M110-V114 WeakPolarHBondContact O-CG2 3.34Å; M110-V114 PolarHBondContact O-N 3.4Å; M110-V114 VanDerWaalsContact O-N 3.08Å |
| 111 | W | 92.2 | Very high | 89.6 | Confident | 29 Ų | 29 | 51.5 Ų | 51.5 | 11% | 0.11 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.9 | -45.8 | 175.6 | 177.2 | -113.9 | 0 | 0 | 0 | 111.3 | I90 F91 R94 T108 Y109 A113 V114 V115 | I90-W111 HydrophobicContact CG2-CZ3 4.4Å; F91-W111 HydrophobicContact CD2-CH2 4.28Å; F91-W111 HydrophobicContact CD2-CZ2 4.01Å; F91-W111 HydrophobicContact CE2-CZ2 4.4Å; R94-W111 HydrophobicContact CB-CH2 3.41Å; R94-W111 VanDerWaalsContact CB-CH2 3.41Å; R94-W111 HydrophobicContact CB-CZ2 3.82Å; R94-W111 HydrophobicContact CB-CZ3 3.93Å; R94-W111 HydrophobicContact CG-CD2 4.19Å; R94-W111 HydrophobicContact CG-CE3 4.13Å; R94-W111 HydrophobicContact CG-CH2 3.46Å; R94-W111 VanDerWaalsContact CG-CH2 3.46Å; R94-W111 HydrophobicContact CG-CZ2 3.49Å; R94-W111 VanDerWaalsContact CG-CZ2 3.49Å; R94-W111 HydrophobicContact CG-CZ3 3.79Å; T108-W111 WeakPolarHBondContact O-CB 3.2Å; T108-W111 PolarHBondContact O-N 3.49Å; T108-W111 WeakPolarHBondContact OG1-CB 3.37Å; T108-W111 PolarHBondContact OG1-N 3.08Å; Y109-W111 VanDerWaalsContact C-N 3.31Å; Y109-W111 PolarHBondContact O-N 3.42Å; W111-A113 VanDerWaalsContact C-N 3.27Å; W111-A113 PolarHBondContact O-N 3.43Å; W111-V114 HydrophobicContact CE3-CB 4.3Å; W111-V114 HydrophobicContact CE3-CG1 4.34Å; W111-V114 HydrophobicContact CZ3-CB 4.46Å; W111-V114 HydrophobicContact CZ3-CG1 4Å; W111-V114 WeakPolarHBondContact O-CA 3.29Å; W111-V114 WeakPolarHBondContact O-CB 3.46Å; W111-V114 PolarHBondContact O-N 3.42Å; W111-V115 HydrophobicContact CD2-CG2 4.15Å; W111-V115 HydrophobicContact CG-CG2 4.49Å; W111-V115 HydrophobicContact CH2-CG2 4.45Å; W111-V115 HydrophobicContact CZ2-CG2 3.74Å; W111-V115 WeakPolarHBondContact O-CG2 3.36Å; W111-V115 PolarHBondContact O-N 3.35Å |
| 112 | Q | 93.2 | Very high | 90 | Very high | 13 Ų | 13 | 50.3 Ų | 50.3 | 6% | 0.061 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -61.8 | -36.3 | 176.2 | -63.7 | -56 | -19 | 0 | 0 | 112.2 | S107 T108 Y109 V114 V115 V116 I183 Y206 I208 | S107-Q112 PolarHBondContact OG-NE2 2.91Å; T108-Q112 PolarHBondContact O-N 3.4Å; Y109-Q112 PolarHBondContact O-N 2.78Å; Q112-V114 VanDerWaalsContact C-N 3.32Å; Q112-V114 PolarHBondContact O-N 2.92Å; Q112-V115 PolarHBondContact O-N 3.44Å; Q112-V116 WeakPolarHBondContact O-CG2 3.33Å; Q112-V116 PolarHBondContact O-N 3.17Å; Q112-I183 HydrophobicContact CB-CD1 3.98Å; Q112-I183 HydrophobicContact CB-CG1 4.16Å; Q112-I183 HydrophobicContact CB-CG2 3.89Å; Q112-I183 HydrophobicContact CG-CG2 4.43Å; Q112-Y206 VanDerWaalsContact CD-O 3.28Å; Q112-Y206 WeakPolarHBondContact CG-O 3.13Å; Q112-Y206 PolarHBondContact NE2-O 3.5Å; Q112-I208 HydrophobicContact CB-CG1 4.31Å; Q112-I208 VanDerWaalsContact OE1-CD1 3.31Å |
| 113 | A | 93.7 | Very high | 90.3 | Very high | 34 Ų | 34 | 51 Ų | 51 | 28% | 0.281 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -61.5 | -39.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y109 M110 W111 T117 I183 | Y109-A113 PolarHBondContact O-N 3.34Å; M110-A113 PolarHBondContact O-N 2.95Å; W111-A113 VanDerWaalsContact C-N 3.27Å; W111-A113 PolarHBondContact O-N 3.43Å; A113-T117 VanDerWaalsContact O-CB 3.28Å; A113-T117 WeakPolarHBondContact O-CB 3.5Å; A113-T117 PolarHBondContact O-N 3.31Å; A113-T117 PolarHBondContact O-OG1 2.96Å; A113-I183 HydrophobicContact CB-CD1 3.96Å |
| 114 | V | 93 | Very high | 90.8 | Very high | 66 Ų | 66 | 49.3 Ų | 49.3 | 40% | 0.4 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -65.6 | -42.2 | 173.5 | 171.9 | 0 | 0 | 0 | 0 | 111.2 | M110 W111 Q112 T117 H118 | M110-V114 WeakPolarHBondContact O-CG2 3.34Å; M110-V114 PolarHBondContact O-N 3.4Å; M110-V114 VanDerWaalsContact O-N 3.08Å; W111-V114 HydrophobicContact CE3-CB 4.3Å; W111-V114 HydrophobicContact CE3-CG1 4.34Å; W111-V114 HydrophobicContact CZ3-CB 4.46Å; W111-V114 HydrophobicContact CZ3-CG1 4Å; W111-V114 WeakPolarHBondContact O-CA 3.29Å; W111-V114 WeakPolarHBondContact O-CB 3.46Å; W111-V114 PolarHBondContact O-N 3.42Å; Q112-V114 VanDerWaalsContact C-N 3.32Å; Q112-V114 PolarHBondContact O-N 2.92Å; V114-T117 PolarHBondContact O-N 2.93Å; V114-H118 WeakPolarHBondContact O-CB 3.31Å; V114-H118 PolarHBondContact O-N 3.36Å |
| 115 | V | 92.4 | Very high | 91.5 | Very high | 27 Ų | 27 | 48.7 Ų | 48.7 | 16% | 0.164 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -63 | -49.8 | 178.2 | 173.6 | 0 | 0 | 0 | 0 | 111.1 | F91 W111 Q112 T117 H118 A119 I208 | F91-V115 HydrophobicContact CD2-CG2 4.43Å; F91-V115 HydrophobicContact CE2-CG2 4.34Å; W111-V115 HydrophobicContact CD2-CG2 4.15Å; W111-V115 HydrophobicContact CG-CG2 4.49Å; W111-V115 HydrophobicContact CH2-CG2 4.45Å; W111-V115 HydrophobicContact CZ2-CG2 3.74Å; W111-V115 WeakPolarHBondContact O-CG2 3.36Å; W111-V115 PolarHBondContact O-N 3.35Å; Q112-V115 PolarHBondContact O-N 3.44Å; V115-T117 VanDerWaalsContact C-N 3.33Å; V115-T117 PolarHBondContact O-N 2.82Å; V115-H118 PolarHBondContact O-N 3.25Å; V115-A119 WeakPolarHBondContact O-CB 3.12Å; V115-A119 PolarHBondContact O-N 3.48Å; V115-I208 HydrophobicContact CB-CD1 4.09Å; V115-I208 HydrophobicContact CG1-CD1 3.69Å |
| 116 | V | 92.7 | Very high | 92 | Very high | 18 Ų | 18 | 45.1 Ų | 45.1 | 11% | 0.109 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -57.4 | -48.4 | 175.2 | 173.4 | 0 | 0 | 0 | 0 | 110.5 | Q112 H118 A119 D120 N181 I183 I208 | Q112-V116 WeakPolarHBondContact O-CG2 3.33Å; Q112-V116 PolarHBondContact O-N 3.17Å; V116-H118 VanDerWaalsContact C-N 3.32Å; V116-H118 PolarHBondContact O-N 3.31Å; V116-A119 PolarHBondContact O-N 3.11Å; V116-D120 PolarHBondContact O-N 3.46Å; V116-N181 HydrophobicContact CG1-CB 3.61Å; V116-N181 HydrophobicContact CG2-CB 4.23Å; V116-I183 HydrophobicContact CG2-CG1 4.26Å; V116-I208 HydrophobicContact CB-CD1 4.49Å; V116-I208 HydrophobicContact CG2-CB 4.25Å; V116-I208 HydrophobicContact CG2-CD1 3.35Å; V116-I208 HydrophobicContact CG2-CG1 3.5Å; V116-I208 HydrophobicContact CG2-CG2 3.69Å |
| 117 | T | 92.7 | Very high | 92.5 | Very high | 88 Ų | 88 | 42.6 Ų | 42.6 | 54% | 0.54 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -59.8 | -44.2 | -180 | -58.9 | 0 | 0 | 0 | 0 | 111.3 | A113 V114 V115 L121 | A113-T117 VanDerWaalsContact O-CB 3.28Å; A113-T117 WeakPolarHBondContact O-CB 3.5Å; A113-T117 PolarHBondContact O-N 3.31Å; A113-T117 PolarHBondContact O-OG1 2.96Å; V114-T117 PolarHBondContact O-N 2.93Å; V115-T117 VanDerWaalsContact C-N 3.33Å; V115-T117 PolarHBondContact O-N 2.82Å; T117-L121 WeakPolarHBondContact O-CB 3.4Å; T117-L121 PolarHBondContact O-N 2.85Å |
| 118 | H | 93.2 | Very high | 93 | Very high | 24 Ų | 24 | 42.9 Ų | 42.9 | 11% | 0.111 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.5 | -46.7 | 176.1 | 172 | 61.1 | 0 | 0 | 0 | 111.5 | T87 Y88 V114 V115 V116 D120 L121 S122 | T87-H118 WeakPolarHBondContact CB-ND1 3.42Å; T87-H118 PolarHBondContact OG1-CE1 3Å; T87-H118 PolarHBondContact OG1-ND1 2.99Å; Y88-H118 AromaticContact CD2-CE1 3.84Å; Y88-H118 AromaticContact CD2-NE2 3.52Å; Y88-H118 PolarHBondContact N-CE1 3.47Å; V114-H118 WeakPolarHBondContact O-CB 3.31Å; V114-H118 PolarHBondContact O-N 3.36Å; V115-H118 PolarHBondContact O-N 3.25Å; V116-H118 VanDerWaalsContact C-N 3.32Å; V116-H118 PolarHBondContact O-N 3.31Å; H118-D120 PolarHBondContact O-N 2.96Å; H118-L121 PolarHBondContact O-N 3.29Å; H118-S122 WeakPolarHBondContact O-CB 3.37Å; H118-S122 PolarHBondContact O-N 3.04Å; H118-S122 PolarHBondContact O-OG 3.39Å |
| 119 | A | 91.5 | Very high | 93.2 | Very high | 41 Ų | 41 | 40 Ų | 40 | 34% | 0.339 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -56.8 | -53.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | V115 V116 S122 V123 | V115-A119 WeakPolarHBondContact O-CB 3.12Å; V115-A119 PolarHBondContact O-N 3.48Å; V116-A119 PolarHBondContact O-N 3.11Å; A119-S122 PolarHBondContact O-N 3.4Å; A119-S122 PolarHBondContact O-OG 3.46Å; A119-V123 WeakPolarHBondContact O-CG2 3.38Å; A119-V123 PolarHBondContact O-N 3.37Å; A119-V123 VanDerWaalsContact O-N 3.17Å |
| 120 | D | 92.3 | Very high | 93.3 | Very high | 8 Ų | 8 | 34 Ų | 34 | 4% | 0.043 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -65.7 | -45.1 | -179.5 | -74.2 | -36.3 | 0 | 0 | 0 | 112.5 | V116 H118 S122 V123 I124 N177 N181 | V116-D120 PolarHBondContact O-N 3.46Å; H118-D120 PolarHBondContact O-N 2.96Å; D120-S122 VanDerWaalsContact C-N 3.32Å; D120-S122 PolarHBondContact O-N 2.9Å; D120-V123 PolarHBondContact O-N 3.45Å; D120-I124 VanDerWaalsContact O-CG1 3.3Å; D120-I124 WeakPolarHBondContact O-CG1 3.47Å; D120-I124 PolarHBondContact O-N 2.93Å; D120-N177 PolarHBondContact OD1-ND2 3.48Å; D120-N181 PolarHBondContact OD1-ND2 2.89Å; D120-N181 PolarHBondContact OD2-ND2 2.99Å; D120-N181 VanDerWaalsContact OD2-ND2 3.13Å |
| 121 | L | 93.2 | Very high | 93.4 | Very high | 57 Ų | 57 | 29.4 Ų | 29.4 | 30% | 0.298 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -64.7 | -38.3 | 179.6 | -174.5 | 63.3 | 0 | 0 | 0 | 111.5 | V83 T87 T117 H118 I124 L125 | V83-L121 HydrophobicContact CG1-CD2 3.98Å; T87-L121 HydrophobicContact CG2-CD2 4.14Å; T117-L121 WeakPolarHBondContact O-CB 3.4Å; T117-L121 PolarHBondContact O-N 2.85Å; H118-L121 PolarHBondContact O-N 3.29Å; L121-I124 PolarHBondContact O-N 3Å; L121-L125 HydrophobicContact CD1-CD1 3.86Å; L121-L125 HydrophobicContact CD1-CD2 4.46Å; L121-L125 HydrophobicContact CD1-CG 3.9Å; L121-L125 HydrophobicContact CD2-CD1 4.22Å; L121-L125 HydrophobicContact CG-CD1 3.65Å; L121-L125 HydrophobicContact CG-CG 4.11Å; L121-L125 WeakPolarHBondContact O-CB 3.05Å; L121-L125 VanDerWaalsContact O-CG 3.26Å; L121-L125 WeakPolarHBondContact O-CG 3.33Å; L121-L125 PolarHBondContact O-N 3.28Å |
| 122 | S | 93.1 | Very high | 93.6 | Very high | 16 Ų | 16 | 28 Ų | 28 | 11% | 0.112 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -64.5 | -41 | 178.5 | 78.5 | 0 | 0 | 0 | 0 | 111.3 | H118 A119 D120 Q126 | H118-S122 WeakPolarHBondContact O-CB 3.37Å; H118-S122 PolarHBondContact O-N 3.04Å; H118-S122 PolarHBondContact O-OG 3.39Å; A119-S122 PolarHBondContact O-N 3.4Å; A119-S122 PolarHBondContact O-OG 3.46Å; D120-S122 VanDerWaalsContact C-N 3.32Å; D120-S122 PolarHBondContact O-N 2.9Å; S122-Q126 VanDerWaalsContact O-CB 3.23Å; S122-Q126 WeakPolarHBondContact O-CB 3.45Å; S122-Q126 WeakPolarHBondContact O-CG 3.37Å; S122-Q126 PolarHBondContact O-N 3.31Å; S122-Q126 PolarHBondContact O-NE2 3.24Å |
| 123 | V | 91.4 | Very high | 93.6 | Very high | 42 Ų | 42 | 27.4 Ų | 27.4 | 26% | 0.255 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -63.9 | -48 | 176 | 171.4 | 0 | 0 | 0 | 0 | 110.1 | A119 D120 S127 | A119-V123 WeakPolarHBondContact O-CG2 3.38Å; A119-V123 PolarHBondContact O-N 3.37Å; A119-V123 VanDerWaalsContact O-N 3.17Å; D120-V123 PolarHBondContact O-N 3.45Å; V123-S127 VanDerWaalsContact O-CB 3.24Å; V123-S127 WeakPolarHBondContact O-CB 3.44Å; V123-S127 PolarHBondContact O-N 2.87Å; V123-S127 PolarHBondContact O-OG 2.87Å |
| 124 | I | 94.1 | Very high | 93.6 | Very high | 31 Ų | 31 | 26.3 Ų | 26.3 | 16% | 0.159 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -61.2 | -53.1 | 179.9 | -68.2 | 164.6 | 0 | 0 | 0 | 110.7 | D120 L121 Q126 S127 I128 C174 | D120-I124 VanDerWaalsContact O-CG1 3.3Å; D120-I124 WeakPolarHBondContact O-CG1 3.47Å; D120-I124 PolarHBondContact O-N 2.93Å; L121-I124 PolarHBondContact O-N 3Å; I124-Q126 PolarHBondContact O-N 2.89Å; I124-S127 WeakPolarHBondContact O-CB 3.5Å; I124-S127 PolarHBondContact O-N 3.01Å; I124-I128 HydrophobicContact CG2-CD1 3.75Å; I124-I128 HydrophobicContact CG2-CG1 4.38Å; I124-I128 VanDerWaalsContact O-CG1 3.31Å; I124-I128 WeakPolarHBondContact O-CG1 3.45Å; I124-I128 PolarHBondContact O-N 3.2Å; I124-C174 HydrophobicContact CD1-CB 4.3Å; I124-C174 HydrophobicContact CG1-CB 3.7Å |
| 125 | L | 95.6 | Very high | 93.6 | Very high | 22 Ų | 22 | 23.9 Ų | 23.9 | 12% | 0.115 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -66.6 | -38.9 | -175.4 | -69.6 | 175.6 | 0 | 0 | 0 | 112.8 | C80 V83 T84 L121 S127 I128 S129 | C80-L125 HydrophobicContact CB-CB 4.26Å; C80-L125 HydrophobicContact CB-CD2 4.36Å; V83-L125 HydrophobicContact CB-CD1 3.7Å; V83-L125 HydrophobicContact CG1-CD1 3.5Å; V83-L125 VanDerWaalsContact CG1-CD1 3.5Å; T84-L125 WeakPolarHBondContact OG1-CB 3.49Å; L121-L125 HydrophobicContact CD1-CD1 3.86Å; L121-L125 HydrophobicContact CD1-CD2 4.46Å; L121-L125 HydrophobicContact CD1-CG 3.9Å; L121-L125 HydrophobicContact CD2-CD1 4.22Å; L121-L125 HydrophobicContact CG-CD1 3.65Å; L121-L125 HydrophobicContact CG-CG 4.11Å; L121-L125 WeakPolarHBondContact O-CB 3.05Å; L121-L125 VanDerWaalsContact O-CG 3.26Å; L121-L125 WeakPolarHBondContact O-CG 3.33Å; L121-L125 PolarHBondContact O-N 3.28Å; L125-S127 VanDerWaalsContact C-N 3.32Å; L125-I128 PolarHBondContact O-N 2.87Å; L125-S129 WeakPolarHBondContact O-CB 3.26Å; L125-S129 PolarHBondContact O-N 2.82Å |
| 126 | Q | 93.1 | Very high | 93.6 | Very high | 31 Ų | 31 | 22.7 Ų | 22.7 | 15% | 0.145 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -64.4 | -40.2 | 174.1 | -73.8 | -179.1 | 70.7 | 0 | 0 | 111.3 | T84 S122 I124 S129 L130 S317 | T84-Q126 HydrophobicContact CG2-CG 4.44Å; S122-Q126 VanDerWaalsContact O-CB 3.23Å; S122-Q126 WeakPolarHBondContact O-CB 3.45Å; S122-Q126 WeakPolarHBondContact O-CG 3.37Å; S122-Q126 PolarHBondContact O-N 3.31Å; S122-Q126 PolarHBondContact O-NE2 3.24Å; I124-Q126 PolarHBondContact O-N 2.89Å; Q126-S129 PolarHBondContact O-N 2.99Å; Q126-L130 WeakPolarHBondContact O-CB 3.21Å; Q126-L130 PolarHBondContact O-N 2.88Å; Q126-S317 VanDerWaalsContact CD-OG 3.31Å; Q126-S317 PolarHBondContact OE1-OG 3.48Å |
| 127 | S | 93.8 | Very high | 93.4 | Very high | 2 Ų | 2 | 22 Ų | 22 | 1% | 0.014 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -66.4 | -42.5 | 176.9 | -57.5 | 0 | 0 | 0 | 0 | 111.8 | V123 I124 L125 L130 W131 M230 | V123-S127 VanDerWaalsContact O-CB 3.24Å; V123-S127 WeakPolarHBondContact O-CB 3.44Å; V123-S127 PolarHBondContact O-N 2.87Å; V123-S127 PolarHBondContact O-OG 2.87Å; I124-S127 WeakPolarHBondContact O-CB 3.5Å; I124-S127 PolarHBondContact O-N 3.01Å; L125-S127 VanDerWaalsContact C-N 3.32Å; S127-L130 PolarHBondContact O-N 3.46Å; S127-W131 VanDerWaalsContact O-CD1 3.27Å; S127-W131 PolarHBondContact O-N 3.25Å; S127-M230 WeakPolarHBondContact OG-CB 3.4Å |
| 128 | I | 96.2 | Very high | 93.3 | Very high | 9 Ų | 9 | 20.3 Ų | 20.3 | 5% | 0.046 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -58.6 | -51.2 | 172.8 | -69 | 170.9 | 0 | 0 | 0 | 109.7 | I124 L125 L130 W131 L132 T166 V170 | I124-I128 HydrophobicContact CG2-CD1 3.75Å; I124-I128 HydrophobicContact CG2-CG1 4.38Å; I124-I128 VanDerWaalsContact O-CG1 3.31Å; I124-I128 WeakPolarHBondContact O-CG1 3.45Å; I124-I128 PolarHBondContact O-N 3.2Å; L125-I128 PolarHBondContact O-N 2.87Å; I128-L130 VanDerWaalsContact C-N 3.27Å; I128-L130 PolarHBondContact O-N 3.34Å; I128-W131 PolarHBondContact O-N 2.95Å; I128-L132 HydrophobicContact CG2-CD1 3.78Å; I128-L132 HydrophobicContact CG2-CG 4.05Å; I128-L132 WeakPolarHBondContact O-CB 3.37Å; I128-L132 WeakPolarHBondContact O-CG 3.41Å; I128-L132 PolarHBondContact O-N 3.49Å; I128-T166 HydrophobicContact CG2-CG2 4.37Å; I128-V170 HydrophobicContact CG1-CB 3.79Å; I128-V170 HydrophobicContact CG1-CG1 3.78Å; I128-V170 HydrophobicContact CG1-CG2 4.19Å |
| 129 | S | 95.2 | Very high | 93.1 | Very high | 0 Ų | 0 | 19.7 Ų | 19.7 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -56 | -41.5 | 178.9 | -177.9 | 0 | 0 | 0 | 0 | 112.6 | I77 H81 L125 Q126 L132 T133 | I77-S129 WeakPolarHBondContact CG2-OG 3.49Å; H81-S129 PolarHBondContact NE2-OG 3.36Å; L125-S129 WeakPolarHBondContact O-CB 3.26Å; L125-S129 PolarHBondContact O-N 2.82Å; Q126-S129 PolarHBondContact O-N 2.99Å; S129-L132 PolarHBondContact O-N 3.48Å; S129-T133 PolarHBondContact O-N 3.47Å; S129-T133 PolarHBondContact O-OG1 3.21Å |
| 130 | L | 93.5 | Very high | 92.8 | Very high | 2 Ų | 2 | 18.8 Ų | 18.8 | 1% | 0.01 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -66.1 | -48.5 | 178 | 174.9 | 47.1 | 0 | 0 | 0 | 112.4 | Q126 S127 I128 L132 T133 V134 M230 P234 L238 F282 | Q126-L130 WeakPolarHBondContact O-CB 3.21Å; Q126-L130 PolarHBondContact O-N 2.88Å; S127-L130 PolarHBondContact O-N 3.46Å; I128-L130 VanDerWaalsContact C-N 3.27Å; I128-L130 PolarHBondContact O-N 3.34Å; L130-L132 VanDerWaalsContact C-N 3.32Å; L130-L132 PolarHBondContact O-N 2.9Å; L130-T133 WeakPolarHBondContact O-CB 3.35Å; L130-T133 PolarHBondContact O-N 2.95Å; L130-T133 VanDerWaalsContact O-N 3.12Å; L130-V134 PolarHBondContact O-N 3.44Å; L130-V134 VanDerWaalsContact O-N 3.07Å; L130-M230 WeakPolarHBondContact CD2-O 3.4Å; L130-P234 HydrophobicContact CD1-CB 3.48Å; L130-P234 VanDerWaalsContact CD1-CB 3.48Å; L130-P234 HydrophobicContact CD2-CB 3.64Å; L130-P234 HydrophobicContact CD2-CG 3.98Å; L130-P234 HydrophobicContact CG-CB 3.35Å; L130-P234 HydrophobicContact CG-CG 3.97Å; L130-L238 HydrophobicContact CD1-CD1 3.52Å; L130-L238 HydrophobicContact CD1-CG 4.21Å; L130-F282 VanDerWaalsContact CA-CZ 3.4Å; L130-F282 HydrophobicContact CB-CE1 3.45Å; L130-F282 VanDerWaalsContact CB-CE1 3.45Å; L130-F282 HydrophobicContact CB-CZ 3.56Å; L130-F282 HydrophobicContact CD1-CD1 3.62Å; L130-F282 HydrophobicContact CD1-CE1 3.15Å; L130-F282 HydrophobicContact CD1-CZ 4.15Å; L130-F282 HydrophobicContact CD2-CE1 4.15Å; L130-F282 HydrophobicContact CG-CE1 3.69Å; L130-F282 HydrophobicContact CG-CZ 4.33Å |
| 131 | W | 95.9 | Very high | 92.5 | Very high | 58 Ų | 58 | 22.1 Ų | 22.1 | 22% | 0.22 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -66.5 | -33 | 176.1 | -81.2 | 106.6 | 0 | 0 | 0 | 112.9 | S127 I128 T133 V134 G135 T166 V170 M229 L233 P234 L237 | S127-W131 VanDerWaalsContact O-CD1 3.27Å; S127-W131 PolarHBondContact O-N 3.25Å; I128-W131 PolarHBondContact O-N 2.95Å; W131-T133 VanDerWaalsContact C-N 3.31Å; W131-V134 WeakPolarHBondContact O-CB 3.46Å; W131-V134 PolarHBondContact O-N 2.8Å; W131-G135 PolarHBondContact O-N 3.45Å; W131-T166 HydrophobicContact CB-CG2 3.45Å; W131-T166 VanDerWaalsContact CB-CG2 3.45Å; W131-V170 HydrophobicContact CB-CG2 4.41Å; W131-V170 HydrophobicContact CG-CG2 4.2Å; W131-M229 WeakPolarHBondContact CZ2-O 3.46Å; W131-M229 PolarHBondContact NE1-O 3.35Å; W131-M229 VanDerWaalsContact NE1-O 3.12Å; W131-L233 HydrophobicContact CH2-CD2 3.76Å; W131-L233 HydrophobicContact CH2-CG 4.06Å; W131-L233 HydrophobicContact CZ2-CD2 4.08Å; W131-L233 HydrophobicContact CZ2-CG 4.42Å; W131-P234 HydrophobicContact CD2-CG 4.16Å; W131-P234 HydrophobicContact CH2-CG 4.38Å; W131-P234 HydrophobicContact CZ2-CG 3.73Å; W131-L237 HydrophobicContact CH2-CD1 4.14Å; W131-L237 HydrophobicContact CZ3-CD1 3.89Å |
| 132 | L | 95.8 | Very high | 92.3 | Very high | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -65.1 | -36 | 170.8 | -73.5 | -177.3 | 0 | 0 | 0 | 112 | I73 I77 I128 S129 L130 G135 L136 T162 I163 T166 | I73-L132 HydrophobicContact CG2-CB 4.02Å; I73-L132 HydrophobicContact CG2-CD2 4.34Å; I77-L132 HydrophobicContact CD1-CB 4.06Å; I77-L132 HydrophobicContact CG1-CB 3.73Å; I77-L132 HydrophobicContact CG1-CD1 4.13Å; I128-L132 HydrophobicContact CG2-CD1 3.78Å; I128-L132 HydrophobicContact CG2-CG 4.05Å; I128-L132 WeakPolarHBondContact O-CB 3.37Å; I128-L132 WeakPolarHBondContact O-CG 3.41Å; I128-L132 PolarHBondContact O-N 3.49Å; S129-L132 PolarHBondContact O-N 3.48Å; L130-L132 VanDerWaalsContact C-N 3.32Å; L130-L132 PolarHBondContact O-N 2.9Å; L132-G135 PolarHBondContact O-N 3.3Å; L132-L136 WeakPolarHBondContact O-CB 3.36Å; L132-L136 PolarHBondContact O-N 3.38Å; L132-T162 HydrophobicContact CD2-CG2 4.19Å; L132-I163 HydrophobicContact CD1-CG1 4.25Å; L132-I163 HydrophobicContact CD2-CB 4.49Å; L132-I163 HydrophobicContact CD2-CG1 3.99Å; L132-T166 HydrophobicContact CD2-CG2 4Å; L132-T166 HydrophobicContact CG-CG2 4.09Å |
| 133 | T | 93.5 | Very high | 91.9 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -65.5 | -39.9 | 174.9 | -58.1 | 0 | 0 | 0 | 0 | 111.1 | S129 L130 W131 L136 A137 L238 V279 F282 | S129-T133 PolarHBondContact O-N 3.47Å; S129-T133 PolarHBondContact O-OG1 3.21Å; L130-T133 WeakPolarHBondContact O-CB 3.35Å; L130-T133 PolarHBondContact O-N 2.95Å; L130-T133 VanDerWaalsContact O-N 3.12Å; W131-T133 VanDerWaalsContact C-N 3.31Å; T133-L136 WeakPolarHBondContact O-CB 3.31Å; T133-L136 PolarHBondContact O-N 3.29Å; T133-A137 PolarHBondContact O-N 2.84Å; T133-A137 VanDerWaalsContact O-N 3.11Å; T133-L238 HydrophobicContact CG2-CD1 4.49Å; T133-L238 HydrophobicContact CG2-CD2 3.83Å; T133-V279 HydrophobicContact CG2-CG2 3.9Å; T133-F282 HydrophobicContact CG2-CB 4.43Å; T133-F282 HydrophobicContact CG2-CG 4.34Å |
| 134 | V | 93.5 | Very high | 91.4 | Very high | 10 Ų | 10 | 23 Ų | 23 | 6% | 0.061 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -62.1 | -49.6 | 170.9 | 177.2 | 0 | 0 | 0 | 0 | 110.7 | L130 W131 L136 A137 V138 P234 L237 L238 F241 | L130-V134 PolarHBondContact O-N 3.44Å; L130-V134 VanDerWaalsContact O-N 3.07Å; W131-V134 WeakPolarHBondContact O-CB 3.46Å; W131-V134 PolarHBondContact O-N 2.8Å; V134-L136 VanDerWaalsContact C-N 3.31Å; V134-L136 PolarHBondContact O-N 3.07Å; V134-A137 WeakPolarHBondContact O-CB 3.33Å; V134-A137 PolarHBondContact O-N 3.12Å; V134-A137 VanDerWaalsContact O-N 3.12Å; V134-V138 PolarHBondContact O-N 3.32Å; V134-V138 VanDerWaalsContact O-N 3.07Å; V134-P234 HydrophobicContact CG2-CB 4.21Å; V134-L237 HydrophobicContact CG1-CB 4.12Å; V134-L237 HydrophobicContact CG1-CD1 4.06Å; V134-L237 HydrophobicContact CG2-CB 4.27Å; V134-L238 HydrophobicContact CB-CD2 4.42Å; V134-L238 HydrophobicContact CG2-CD2 3.62Å; V134-L238 HydrophobicContact CG2-CG 3.98Å; V134-F241 HydrophobicContact CG1-CD2 4.14Å; V134-F241 HydrophobicContact CG1-CE2 3.78Å |
| 135 | G | 93.4 | Very high | 91 | Very high | 16 Ų | 16 | 25.2 Ų | 25.2 | 17% | 0.165 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -59.9 | -39.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113 | W131 L132 A137 V138 V139 | W131-G135 PolarHBondContact O-N 3.45Å; L132-G135 PolarHBondContact O-N 3.3Å; G135-A137 PolarHBondContact O-N 3.26Å; G135-V138 WeakPolarHBondContact O-CB 3.38Å; G135-V138 PolarHBondContact O-N 2.97Å; G135-V139 WeakPolarHBondContact O-CG2 3.48Å; G135-V139 PolarHBondContact O-N 2.93Å |
| 136 | L | 92.1 | Very high | 90.4 | Very high | 2 Ų | 2 | 31.9 Ų | 31.9 | 1% | 0.01 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -59.9 | -44.2 | 173.7 | 173.9 | 65 | 0 | 0 | 0 | 111.8 | V70 I73 L74 L132 T133 V134 V138 V139 R140 L275 | V70-L136 HydrophobicContact CB-CD1 3.96Å; V70-L136 HydrophobicContact CG1-CD1 3.69Å; V70-L136 HydrophobicContact CG2-CD1 3.89Å; I73-L136 HydrophobicContact CG2-CB 3.95Å; L74-L136 HydrophobicContact CD2-CD2 3.44Å; L74-L136 VanDerWaalsContact CD2-CD2 3.44Å; L74-L136 HydrophobicContact CG-CD1 4.43Å; L74-L136 HydrophobicContact CG-CD2 4.05Å; L132-L136 WeakPolarHBondContact O-CB 3.36Å; L132-L136 PolarHBondContact O-N 3.38Å; T133-L136 WeakPolarHBondContact O-CB 3.31Å; T133-L136 PolarHBondContact O-N 3.29Å; V134-L136 VanDerWaalsContact C-N 3.31Å; V134-L136 PolarHBondContact O-N 3.07Å; L136-V138 VanDerWaalsContact C-N 3.34Å; L136-V139 PolarHBondContact O-N 3.33Å; L136-R140 WeakPolarHBondContact O-CB 3.49Å; L136-R140 PolarHBondContact O-N 3.11Å; L136-L275 HydrophobicContact CD1-CD2 4.05Å; L136-L275 HydrophobicContact CD2-CD2 3.64Å; L136-L275 HydrophobicContact CG-CD2 4.03Å |
| 137 | A | 89.5 | Confident | 89.6 | Confident | 2 Ų | 2 | 35.8 Ų | 35.8 | 2% | 0.017 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -64.3 | -38.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | T133 V134 G135 R140 Y141 F241 L245 | T133-A137 PolarHBondContact O-N 2.84Å; T133-A137 VanDerWaalsContact O-N 3.11Å; V134-A137 WeakPolarHBondContact O-CB 3.33Å; V134-A137 PolarHBondContact O-N 3.12Å; V134-A137 VanDerWaalsContact O-N 3.12Å; G135-A137 PolarHBondContact O-N 3.26Å; A137-R140 PolarHBondContact O-N 2.96Å; A137-Y141 WeakPolarHBondContact O-CB 3.36Å; A137-Y141 PolarHBondContact O-N 3.16Å; A137-F241 HydrophobicContact CB-CB 3.66Å; A137-F241 HydrophobicContact CB-CD1 4.01Å; A137-F241 HydrophobicContact CB-CD2 4.16Å; A137-F241 HydrophobicContact CB-CG 3.67Å; A137-L245 HydrophobicContact CB-CD1 4.24Å |
| 138 | V | 89.7 | Confident | 88.9 | Confident | 54 Ų | 54 | 47.5 Ų | 47.5 | 33% | 0.327 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -61.7 | -51.7 | 172.9 | 174.6 | 0 | 0 | 0 | 0 | 111.2 | V134 G135 L136 R140 Y141 L142 F241 | V134-V138 PolarHBondContact O-N 3.32Å; V134-V138 VanDerWaalsContact O-N 3.07Å; G135-V138 WeakPolarHBondContact O-CB 3.38Å; G135-V138 PolarHBondContact O-N 2.97Å; L136-V138 VanDerWaalsContact C-N 3.34Å; V138-R140 VanDerWaalsContact C-N 3.28Å; V138-R140 PolarHBondContact O-N 3.36Å; V138-Y141 WeakPolarHBondContact O-CB 3.46Å; V138-Y141 PolarHBondContact O-N 3.34Å; V138-Y141 VanDerWaalsContact O-N 3.17Å; V138-L142 HydrophobicContact CG1-CD1 4.05Å; V138-L142 HydrophobicContact CG1-CG 4.43Å; V138-L142 WeakPolarHBondContact O-CG 3.26Å; V138-L142 PolarHBondContact O-N 3.46Å; V138-F241 HydrophobicContact CB-CZ 4.49Å; V138-F241 HydrophobicContact CG2-CE1 3.76Å; V138-F241 HydrophobicContact CG2-CE2 3.84Å; V138-F241 HydrophobicContact CG2-CZ 3.25Å |
| 139 | V | 89.3 | Confident | 88.2 | Confident | 10 Ų | 10 | 48.9 Ų | 48.9 | 6% | 0.061 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -58.4 | -44 | 178.9 | 169.5 | 0 | 0 | 0 | 0 | 110.3 | S69 V70 I73 G135 L136 Y141 L142 V143 A153 | S69-V139 VanDerWaalsContact OG-CG1 3.26Å; S69-V139 WeakPolarHBondContact OG-CG1 3.22Å; V70-V139 HydrophobicContact CG2-CG1 4.09Å; I73-V139 HydrophobicContact CD1-CG2 4.14Å; G135-V139 WeakPolarHBondContact O-CG2 3.48Å; G135-V139 PolarHBondContact O-N 2.93Å; L136-V139 PolarHBondContact O-N 3.33Å; V139-Y141 PolarHBondContact O-N 2.93Å; V139-L142 PolarHBondContact O-N 3.12Å; V139-V143 HydrophobicContact CG1-CG2 4.37Å; V139-V143 WeakPolarHBondContact O-CB 3.38Å; V139-V143 VanDerWaalsContact O-CG2 3.3Å; V139-V143 WeakPolarHBondContact O-CG2 3.41Å; V139-V143 PolarHBondContact O-N 3.07Å; V139-A153 WeakPolarHBondContact CG1-O 3.16Å |
| 140 | R | 85.7 | Confident | 87.6 | Confident | 22 Ų | 22 | 49.8 Ų | 49.8 | 8% | 0.083 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.9 | -43.6 | 177.4 | -174.8 | 60.1 | 174.6 | 173.3 | 4.9 | 111.8 | L136 A137 V138 L142 V143 L144 L245 S268 S272 L275 | L136-R140 WeakPolarHBondContact O-CB 3.49Å; L136-R140 PolarHBondContact O-N 3.11Å; A137-R140 PolarHBondContact O-N 2.96Å; V138-R140 VanDerWaalsContact C-N 3.28Å; V138-R140 PolarHBondContact O-N 3.36Å; R140-L142 VanDerWaalsContact C-N 3.35Å; R140-L142 PolarHBondContact O-N 2.65Å; R140-V143 PolarHBondContact O-N 3.03Å; R140-L144 HydrophobicContact CG-CD1 3.97Å; R140-L144 HydrophobicContact CG-CG 4.48Å; R140-L144 WeakPolarHBondContact O-CB 3.28Å; R140-L144 VanDerWaalsContact O-CG 3.27Å; R140-L144 WeakPolarHBondContact O-CG 3.33Å; R140-L144 PolarHBondContact O-N 2.77Å; R140-L245 HydrophobicContact CB-CD2 4.3Å; R140-L245 HydrophobicContact CG-CD2 3.84Å; R140-S268 PolarHBondContact NH2-O 3.02Å; R140-S268 PolarHBondContact NH2-OG 3.44Å; R140-S272 PolarHBondContact NE-OG 3.14Å; R140-S272 VanDerWaalsContact NE-OG 3.16Å; R140-S272 PolarHBondContact NH2-OG 2.85Å; R140-L275 HydrophobicContact CB-CD1 4.15Å; R140-L275 VanDerWaalsContact CD-CD1 3.49Å; R140-L275 HydrophobicContact CG-CD1 3.62Å |
| 141 | Y | 85.9 | Confident | 87.1 | Confident | 78 Ų | 78 | 53.3 Ų | 53.3 | 31% | 0.306 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -57.9 | -47.6 | 175.4 | 176.4 | -87 | 0 | 0 | 0 | 111.3 | A137 V138 V139 L144 R145 L244 I248 | A137-Y141 WeakPolarHBondContact O-CB 3.36Å; A137-Y141 PolarHBondContact O-N 3.16Å; V138-Y141 WeakPolarHBondContact O-CB 3.46Å; V138-Y141 PolarHBondContact O-N 3.34Å; V138-Y141 VanDerWaalsContact O-N 3.17Å; V139-Y141 PolarHBondContact O-N 2.93Å; Y141-L144 PolarHBondContact O-N 3.34Å; Y141-R145 HydrophobicContact CD2-CG 4.35Å; Y141-R145 HydrophobicContact CE1-CB 4.32Å; Y141-R145 HydrophobicContact CE1-CG 4.33Å; Y141-R145 HydrophobicContact CE2-CG 3.99Å; Y141-R145 WeakPolarHBondContact O-CB 3.28Å; Y141-R145 PolarHBondContact O-N 3.14Å; Y141-L244 HydrophobicContact CD2-CB 4.47Å; Y141-I248 HydrophobicContact CD2-CD1 3.35Å; Y141-I248 HydrophobicContact CE2-CD1 3.7Å; Y141-I248 HydrophobicContact CG-CD1 4.3Å |
| 142 | L | 87.9 | Confident | 86.7 | Confident | 61 Ų | 61 | 55.3 Ų | 55.3 | 32% | 0.319 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.6 | -46.7 | 179.3 | -69.1 | 174.4 | 0 | 0 | 0 | 112 | V138 V139 R140 L144 R145 R146 A153 | V138-L142 HydrophobicContact CG1-CD1 4.05Å; V138-L142 HydrophobicContact CG1-CG 4.43Å; V138-L142 WeakPolarHBondContact O-CG 3.26Å; V138-L142 PolarHBondContact O-N 3.46Å; V139-L142 PolarHBondContact O-N 3.12Å; R140-L142 VanDerWaalsContact C-N 3.35Å; R140-L142 PolarHBondContact O-N 2.65Å; L142-L144 VanDerWaalsContact C-N 3.26Å; L142-L144 PolarHBondContact O-N 3.35Å; L142-R145 PolarHBondContact O-N 2.88Å; L142-R146 HydrophobicContact CD2-CG 4.43Å; L142-R146 WeakPolarHBondContact O-CA 3.39Å; L142-R146 WeakPolarHBondContact O-CB 3.49Å; L142-R146 PolarHBondContact O-N 3.36Å; L142-A153 HydrophobicContact CB-CB 4.4Å |
| 143 | V | 84.4 | Confident | 86.2 | Confident | 32 Ų | 32 | 55.8 Ų | 55.8 | 19% | 0.194 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60 | -36.5 | 177.8 | 169.9 | 0 | 0 | 0 | 0 | 111.6 | V139 R140 A150 A153 N154 | V139-V143 HydrophobicContact CG1-CG2 4.37Å; V139-V143 WeakPolarHBondContact O-CB 3.38Å; V139-V143 VanDerWaalsContact O-CG2 3.3Å; V139-V143 WeakPolarHBondContact O-CG2 3.41Å; V139-V143 PolarHBondContact O-N 3.07Å; R140-V143 PolarHBondContact O-N 3.03Å; V143-A150 HydrophobicContact CG1-CB 4.43Å; V143-A153 HydrophobicContact CG2-CB 4.01Å; V143-N154 HydrophobicContact CG2-CB 4.18Å |
| 144 | L | 81.6 | Confident | 85.9 | Confident | 40 Ų | 40 | 59 Ų | 59 | 21% | 0.209 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -82.7 | -32.2 | -178.7 | -68.4 | 176.9 | 0 | 0 | 0 | 114.2 | R140 Y141 L142 I248 M252 | R140-L144 HydrophobicContact CG-CD1 3.97Å; R140-L144 HydrophobicContact CG-CG 4.48Å; R140-L144 WeakPolarHBondContact O-CB 3.28Å; R140-L144 VanDerWaalsContact O-CG 3.27Å; R140-L144 WeakPolarHBondContact O-CG 3.33Å; R140-L144 PolarHBondContact O-N 2.77Å; Y141-L144 PolarHBondContact O-N 3.34Å; L142-L144 VanDerWaalsContact C-N 3.26Å; L142-L144 PolarHBondContact O-N 3.35Å; L144-I248 HydrophobicContact CB-CG2 4.05Å; L144-I248 HydrophobicContact CD1-CG2 3.68Å; L144-I248 HydrophobicContact CG-CG2 4.46Å; L144-M252 HydrophobicContact CD1-CE 4.23Å; L144-M252 HydrophobicContact CD2-CE 4.35Å; L144-M252 HydrophobicContact CD2-SD 3.89Å |
| 145 | R | 85 | Confident | 85.8 | Confident | 79 Ų | 79 | 61.2 Ų | 61.2 | 30% | 0.298 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -102.1 | -24.6 | -173.2 | -74.4 | -72.3 | -166.9 | -170.5 | -6.5 | 114.5 | Y141 L142 P147 H247 I248 E251 | Y141-R145 HydrophobicContact CD2-CG 4.35Å; Y141-R145 HydrophobicContact CE1-CB 4.32Å; Y141-R145 HydrophobicContact CE1-CG 4.33Å; Y141-R145 HydrophobicContact CE2-CG 3.99Å; Y141-R145 WeakPolarHBondContact O-CB 3.28Å; Y141-R145 PolarHBondContact O-N 3.14Å; L142-R145 PolarHBondContact O-N 2.88Å; R145-P147 WeakPolarHBondContact O-CD 3.3Å; R145-H247 PolarHBondContact NH2-ND1 3.14Å; R145-I248 HydrophobicContact CG-CD1 3.87Å; R145-I248 HydrophobicContact CG-CG1 4.37Å; R145-E251 IonicContact CZ-OE2 3.45Å; R145-E251 VanDerWaalsContact NH1-CD 3.26Å; R145-E251 IonicContact NH1-OE1 2.74Å; R145-E251 PolarHBondContact NH1-OE1 3.13Å; R145-E251 VanDerWaalsContact NH1-OE1 3.14Å; R145-E251 IonicContact NH1-OE2 3.24Å; R145-E251 PolarHBondContact NH1-OE2 2.98Å; R145-E251 IonicContact NH2-OE2 3.44Å; R145-E251 PolarHBondContact NH2-OE2 3.08Å |
| 146 | R | 83.9 | Confident | 85.8 | Confident | 162 Ų | 162 | 61.7 Ų | 61.7 | 61% | 0.611 | 33% | 0.325 | S | S | * | . | trans | -125.2 | 84.6 | -171 | -63.6 | -75.5 | -172.7 | 153.2 | 0.5 | 109.7 | L142 R148 A149 A150 | L142-R146 HydrophobicContact CD2-CG 4.43Å; L142-R146 WeakPolarHBondContact O-CA 3.39Å; L142-R146 WeakPolarHBondContact O-CB 3.49Å; L142-R146 PolarHBondContact O-N 3.36Å; R146-R148 PolarHBondContact O-N 3.34Å; R146-R148 VanDerWaalsContact O-N 3.12Å; R146-A149 HydrophobicContact CB-CB 3.81Å; R146-A149 CarbonylContact O-C 3.58Å; R146-A149 PolarHBondContact O-N 3.05Å; R146-A150 PolarHBondContact O-N 3.42Å | ||
| 147 | P | 76 | Confident | 85.9 | Confident | 112 Ų | 112 | 70.7 Ų | 70.7 | 73% | 0.727 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -53.2 | -38.1 | -178.9 | -27.1 | 34.2 | 0 | 0 | 0 | 113.6 | R145 A149 A150 | R145-P147 WeakPolarHBondContact O-CD 3.3Å; P147-A149 PolarHBondContact O-N 3.36Å; P147-A150 WeakPolarHBondContact O-CB 3.44Å; P147-A150 PolarHBondContact O-N 3.47Å |
| 148 | R | 79.2 | Confident | 86.1 | Confident | 248 Ų | 248 | 72.1 Ų | 72.1 | 94% | 0.936 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -65.1 | -35.7 | 176.6 | -67.4 | -176 | 178.8 | 143.7 | -0.3 | 113.4 | R146 | R146-R148 PolarHBondContact O-N 3.34Å; R146-R148 VanDerWaalsContact O-N 3.12Å |
| 149 | A | 82.5 | Confident | 86.4 | Confident | 39 Ų | 39 | 69.6 Ų | 69.6 | 32% | 0.322 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -84.7 | -20.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | R146 P147 A151 V152 A153 | R146-A149 HydrophobicContact CB-CB 3.81Å; R146-A149 CarbonylContact O-C 3.58Å; R146-A149 PolarHBondContact O-N 3.05Å; P147-A149 PolarHBondContact O-N 3.36Å; A149-A151 VanDerWaalsContact C-N 3.3Å; A149-A151 PolarHBondContact O-N 3.34Å; A149-V152 PolarHBondContact O-N 3.13Å; A149-A153 WeakPolarHBondContact O-CB 3.38Å; A149-A153 PolarHBondContact O-N 3.5Å |
| 150 | A | 82.1 | Confident | 86.7 | Confident | 18 Ų | 18 | 74.1 Ų | 74.1 | 15% | 0.149 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -60.1 | -37.9 | -175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | V143 R146 P147 V152 A153 N154 | V143-A150 HydrophobicContact CG1-CB 4.43Å; R146-A150 PolarHBondContact O-N 3.42Å; P147-A150 WeakPolarHBondContact O-CB 3.44Å; P147-A150 PolarHBondContact O-N 3.47Å; A150-V152 PolarHBondContact O-N 2.85Å; A150-A153 PolarHBondContact O-N 2.92Å; A150-N154 WeakPolarHBondContact O-CB 3.48Å; A150-N154 PolarHBondContact O-N 3.31Å |
| 151 | A | 82.9 | Confident | 87.2 | Confident | 76 Ų | 76 | 78 Ų | 78 | 63% | 0.628 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -58.6 | -48.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | A149 T155 | A149-A151 VanDerWaalsContact C-N 3.3Å; A149-A151 PolarHBondContact O-N 3.34Å; A151-T155 VanDerWaalsContact O-CG2 3.27Å; A151-T155 WeakPolarHBondContact O-CG2 3.34Å |
| 152 | V | 86.5 | Confident | 87.7 | Confident | 100 Ų | 100 | 75.6 Ų | 75.6 | 61% | 0.606 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -72 | -49.4 | 177.6 | -179.5 | 0 | 0 | 0 | 0 | 110.6 | A149 A150 N154 T155 T158 | A149-V152 PolarHBondContact O-N 3.13Å; A150-V152 PolarHBondContact O-N 2.85Å; V152-N154 PolarHBondContact O-N 3.33Å; V152-T155 WeakPolarHBondContact O-CB 3.32Å; V152-T155 WeakPolarHBondContact O-CG2 3.32Å; V152-T155 PolarHBondContact O-N 3Å; V152-T155 PolarHBondContact O-OG1 2.87Å; V152-T158 PolarHBondContact O-OG1 3.5Å |
| 153 | A | 86.6 | Confident | 88.2 | Confident | 10 Ų | 10 | 74.4 Ų | 74.4 | 8% | 0.083 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -62.2 | -26.6 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113 | S69 V139 L142 V143 A149 A150 | S69-A153 WeakPolarHBondContact CB-O 3.34Å; S69-A153 PolarHBondContact OG-O 3.04Å; V139-A153 WeakPolarHBondContact CG1-O 3.16Å; L142-A153 HydrophobicContact CB-CB 4.4Å; V143-A153 HydrophobicContact CG2-CB 4.01Å; A149-A153 WeakPolarHBondContact O-CB 3.38Å; A149-A153 PolarHBondContact O-N 3.5Å; A150-A153 PolarHBondContact O-N 2.92Å |
| 154 | N | 87.3 | Confident | 88.8 | Confident | 67 Ų | 67 | 75.5 Ų | 75.5 | 36% | 0.358 | 40% | 0.396 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.5 | -4.3 | 179.6 | -162.6 | 44.7 | 0 | 0 | 0 | 113.6 | T68 S69 V143 A150 V152 | T68-N154 WeakPolarHBondContact CA-O 3.4Å; T68-N154 WeakPolarHBondContact CB-OD1 3.09Å; S69-N154 PolarHBondContact N-O 3.32Å; S69-N154 WeakPolarHBondContact OG-CA 3.43Å; V143-N154 HydrophobicContact CG2-CB 4.18Å; A150-N154 WeakPolarHBondContact O-CB 3.48Å; A150-N154 PolarHBondContact O-N 3.31Å; V152-N154 PolarHBondContact O-N 3.33Å |
| 155 | T | 91.6 | Very high | 89.6 | Confident | 57 Ų | 57 | 81 Ų | 81 | 35% | 0.35 | 42% | 0.419 | S | S | . | . | S | Bend | trans | -70.8 | 142.9 | -178.4 | 67.8 | 0 | 0 | 0 | 0 | 112.4 | S69 A151 V152 R157 T158 G159 | S69-T155 WeakPolarHBondContact CA-O 3.5Å; S69-T155 VanDerWaalsContact CB-O 3.23Å; S69-T155 WeakPolarHBondContact CB-O 3.44Å; S69-T155 PolarHBondContact N-O 3.17Å; A151-T155 VanDerWaalsContact O-CG2 3.27Å; A151-T155 WeakPolarHBondContact O-CG2 3.34Å; V152-T155 WeakPolarHBondContact O-CB 3.32Å; V152-T155 WeakPolarHBondContact O-CG2 3.32Å; V152-T155 PolarHBondContact O-N 3Å; V152-T155 PolarHBondContact O-OG1 2.87Å; T155-R157 PolarHBondContact O-N 3.07Å; T155-T158 PolarHBondContact O-N 3.48Å; T155-T158 VanDerWaalsContact O-N 3.09Å; T155-T158 PolarHBondContact OG1-N 3.29Å; T155-T158 PolarHBondContact OG1-OG1 3.18Å; T155-G159 PolarHBondContact O-N 2.88Å |
| 156 | A | 93.2 | Very high | 90.2 | Very high | 27 Ų | 27 | 78 Ų | 78 | 22% | 0.223 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -56.8 | -32.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | R67 I72 G159 L160 | R67-A156 HydrophobicContact CB-CB 4.13Å; I72-A156 HydrophobicContact CG1-CB 3.98Å; A156-G159 PolarHBondContact O-N 3.15Å; A156-L160 PolarHBondContact O-N 3.06Å |
| 157 | R | 94.4 | Very high | 90.8 | Very high | 191 Ų | 191 | 71.9 Ų | 71.9 | 72% | 0.721 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -61.4 | -44.6 | 175.6 | -173.3 | 177 | -178.1 | 175.4 | 0.6 | 111.7 | T155 G159 L160 L161 | T155-R157 PolarHBondContact O-N 3.07Å; R157-G159 VanDerWaalsContact C-N 3.29Å; R157-G159 PolarHBondContact O-N 3.4Å; R157-L160 PolarHBondContact O-N 3.02Å; R157-L161 HydrophobicContact CG-CD1 4.22Å; R157-L161 HydrophobicContact CG-CG 4.49Å; R157-L161 WeakPolarHBondContact O-CG 3.22Å; R157-L161 PolarHBondContact O-N 3.36Å |
| 158 | T | 93.4 | Very high | 91.8 | Very high | 32 Ų | 32 | 71.8 Ų | 71.8 | 20% | 0.196 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -58.9 | -43.1 | 174.1 | -61.5 | 0 | 0 | 0 | 0 | 111.1 | V152 T155 L160 L161 T162 | V152-T158 PolarHBondContact O-OG1 3.5Å; T155-T158 PolarHBondContact O-N 3.48Å; T155-T158 VanDerWaalsContact O-N 3.09Å; T155-T158 PolarHBondContact OG1-N 3.29Å; T155-T158 PolarHBondContact OG1-OG1 3.18Å; T158-L160 PolarHBondContact O-N 3.39Å; T158-L161 PolarHBondContact O-N 2.91Å; T158-T162 PolarHBondContact O-N 2.91Å; T158-T162 PolarHBondContact O-OG1 3.04Å |
| 159 | G | 95.1 | Very high | 92.6 | Very high | 0 Ų | 0 | 61.9 Ų | 61.9 | 0% | 0 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -59.5 | -45.4 | 176 | 0 | 0 | 0 | 0 | 0 | 113.3 | T155 A156 R157 T162 I163 | T155-G159 PolarHBondContact O-N 2.88Å; A156-G159 PolarHBondContact O-N 3.15Å; R157-G159 VanDerWaalsContact C-N 3.29Å; R157-G159 PolarHBondContact O-N 3.4Å; G159-T162 PolarHBondContact O-N 3.22Å; G159-I163 WeakPolarHBondContact O-CG1 3.25Å; G159-I163 PolarHBondContact O-N 2.91Å |
| 160 | L | 96.5 | Very high | 93.3 | Very high | 105 Ų | 105 | 60.1 Ų | 60.1 | 55% | 0.55 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -63.7 | -41.8 | 176.6 | -70.4 | 172.9 | 0 | 0 | 0 | 112.4 | I72 A156 R157 T158 I163 A164 | I72-L160 HydrophobicContact CG2-CD2 3.8Å; I72-L160 HydrophobicContact CG2-CG 3.96Å; A156-L160 PolarHBondContact O-N 3.06Å; R157-L160 PolarHBondContact O-N 3.02Å; T158-L160 PolarHBondContact O-N 3.39Å; L160-I163 PolarHBondContact O-N 3.05Å; L160-A164 PolarHBondContact O-N 3.48Å |
| 161 | L | 96.3 | Very high | 93.9 | Very high | 104 Ų | 104 | 62.2 Ų | 62.2 | 55% | 0.545 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -65.2 | -38.9 | 176.8 | -70.5 | 174.8 | 0 | 0 | 0 | 111.8 | R157 T158 I163 A164 F165 | R157-L161 HydrophobicContact CG-CD1 4.22Å; R157-L161 HydrophobicContact CG-CG 4.49Å; R157-L161 WeakPolarHBondContact O-CG 3.22Å; R157-L161 PolarHBondContact O-N 3.36Å; T158-L161 PolarHBondContact O-N 2.91Å; L161-I163 VanDerWaalsContact C-N 3.35Å; L161-A164 PolarHBondContact O-N 3.44Å; L161-F165 VanDerWaalsContact O-CB 3.31Å; L161-F165 WeakPolarHBondContact O-CB 3.33Å; L161-F165 PolarHBondContact O-N 3.45Å |
| 162 | T | 95.7 | Very high | 94.4 | Very high | 28 Ų | 28 | 61 Ų | 61 | 17% | 0.172 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -59.6 | -46 | 172.3 | -58.4 | 0 | 0 | 0 | 0 | 110.7 | I73 L132 T158 G159 T166 | I73-T162 HydrophobicContact CD1-CG2 3.98Å; I73-T162 HydrophobicContact CG1-CG2 4.32Å; L132-T162 HydrophobicContact CD2-CG2 4.19Å; T158-T162 PolarHBondContact O-N 2.91Å; T158-T162 PolarHBondContact O-OG1 3.04Å; G159-T162 PolarHBondContact O-N 3.22Å; T162-T166 VanDerWaalsContact O-CB 3.28Å; T162-T166 WeakPolarHBondContact O-CB 3.47Å; T162-T166 PolarHBondContact O-N 3.48Å; T162-T166 PolarHBondContact O-OG1 2.93Å |
| 163 | I | 98 | Very high | 94.7 | Very high | 36 Ų | 36 | 59.7 Ų | 59.7 | 19% | 0.185 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60 | -49.5 | 176.7 | -65.4 | 166.6 | 0 | 0 | 0 | 111.8 | I72 L132 G159 L160 L161 S167 | I72-I163 HydrophobicContact CG2-CD1 3.81Å; I72-I163 WeakPolarHBondContact O-CD1 3.18Å; L132-I163 HydrophobicContact CD1-CG1 4.25Å; L132-I163 HydrophobicContact CD2-CB 4.49Å; L132-I163 HydrophobicContact CD2-CG1 3.99Å; G159-I163 WeakPolarHBondContact O-CG1 3.25Å; G159-I163 PolarHBondContact O-N 2.91Å; L160-I163 PolarHBondContact O-N 3.05Å; L161-I163 VanDerWaalsContact C-N 3.35Å; I163-S167 VanDerWaalsContact O-CB 3.31Å; I163-S167 WeakPolarHBondContact O-CB 3.43Å; I163-S167 PolarHBondContact O-N 3.29Å; I163-S167 PolarHBondContact O-OG 3.08Å |
| 164 | A | 97.8 | Very high | 95 | Very high | 54 Ų | 54 | 59.3 Ų | 59.3 | 45% | 0.446 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.2 | -49.4 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L160 L161 S167 V168 | L160-A164 PolarHBondContact O-N 3.48Å; L161-A164 PolarHBondContact O-N 3.44Å; A164-S167 PolarHBondContact O-N 3.33Å; A164-V168 WeakPolarHBondContact O-CG2 3.24Å; A164-V168 PolarHBondContact O-N 3.43Å |
| 165 | F | 97.5 | Very high | 95.3 | Very high | 157 Ų | 157 | 61.9 Ų | 61.9 | 69% | 0.689 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -62.4 | -47.8 | -180 | 178.8 | -97.5 | 0 | 0 | 0 | 112 | L161 S167 V168 A169 | L161-F165 VanDerWaalsContact O-CB 3.31Å; L161-F165 WeakPolarHBondContact O-CB 3.33Å; L161-F165 PolarHBondContact O-N 3.45Å; F165-S167 VanDerWaalsContact C-N 3.33Å; F165-S167 PolarHBondContact O-N 3.48Å; F165-V168 PolarHBondContact O-N 3.05Å; F165-A169 VanDerWaalsContact O-CB 3.31Å; F165-A169 WeakPolarHBondContact O-CB 3.35Å; F165-A169 PolarHBondContact O-N 3Å |
| 166 | T | 97.4 | Very high | 95.2 | Very high | 15 Ų | 15 | 61.7 Ų | 61.7 | 9% | 0.092 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -61.4 | -42.2 | 178.1 | -64 | 0 | 0 | 0 | 0 | 111.4 | I128 W131 L132 T162 A169 V170 | I128-T166 HydrophobicContact CG2-CG2 4.37Å; W131-T166 HydrophobicContact CB-CG2 3.45Å; W131-T166 VanDerWaalsContact CB-CG2 3.45Å; L132-T166 HydrophobicContact CD2-CG2 4Å; L132-T166 HydrophobicContact CG-CG2 4.09Å; T162-T166 VanDerWaalsContact O-CB 3.28Å; T162-T166 WeakPolarHBondContact O-CB 3.47Å; T162-T166 PolarHBondContact O-N 3.48Å; T162-T166 PolarHBondContact O-OG1 2.93Å; T166-A169 PolarHBondContact O-N 3.38Å; T166-V170 HydrophobicContact CG2-CG2 4.22Å; T166-V170 WeakPolarHBondContact O-CB 3.42Å; T166-V170 VanDerWaalsContact O-CG2 3.28Å; T166-V170 WeakPolarHBondContact O-CG2 3.44Å; T166-V170 PolarHBondContact O-N 2.92Å |
| 167 | S | 97.2 | Very high | 95.1 | Very high | 33 Ų | 33 | 61.5 Ų | 61.5 | 23% | 0.231 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -63.3 | -47.3 | 179.4 | -55 | 0 | 0 | 0 | 0 | 111.6 | I163 A164 F165 C171 | I163-S167 VanDerWaalsContact O-CB 3.31Å; I163-S167 WeakPolarHBondContact O-CB 3.43Å; I163-S167 PolarHBondContact O-N 3.29Å; I163-S167 PolarHBondContact O-OG 3.08Å; A164-S167 PolarHBondContact O-N 3.33Å; F165-S167 VanDerWaalsContact C-N 3.33Å; F165-S167 PolarHBondContact O-N 3.48Å; S167-C171 WeakPolarHBondContact O-CB 3.41Å; S167-C171 PolarHBondContact O-N 3.44Å; S167-C171 PolarHBondContact O-SG 3.28Å |
| 168 | V | 97.2 | Very high | 94.9 | Very high | 110 Ų | 110 | 58.3 Ų | 58.3 | 67% | 0.667 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -63.2 | -45.3 | 178.2 | 172.9 | 0 | 0 | 0 | 0 | 111.3 | A164 F165 G172 | A164-V168 WeakPolarHBondContact O-CG2 3.24Å; A164-V168 PolarHBondContact O-N 3.43Å; F165-V168 PolarHBondContact O-N 3.05Å; V168-G172 PolarHBondContact O-N 3.39Å |
| 169 | A | 96.4 | Very high | 94.9 | Very high | 40 Ų | 40 | 59.4 Ų | 59.4 | 33% | 0.331 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -62.5 | -46.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112 | F165 T166 G172 L173 | F165-A169 VanDerWaalsContact O-CB 3.31Å; F165-A169 WeakPolarHBondContact O-CB 3.35Å; F165-A169 PolarHBondContact O-N 3Å; T166-A169 PolarHBondContact O-N 3.38Å; A169-G172 PolarHBondContact O-N 3.2Å; A169-L173 WeakPolarHBondContact O-CG 3.3Å; A169-L173 PolarHBondContact O-N 2.85Å |
| 170 | V | 96.1 | Very high | 94.8 | Very high | 3 Ų | 3 | 63 Ų | 63 | 2% | 0.018 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -66.4 | -45 | 178.9 | 172.2 | 0 | 0 | 0 | 0 | 111.3 | I128 W131 T166 G172 L173 C174 M230 | I128-V170 HydrophobicContact CG1-CB 3.79Å; I128-V170 HydrophobicContact CG1-CG1 3.78Å; I128-V170 HydrophobicContact CG1-CG2 4.19Å; W131-V170 HydrophobicContact CB-CG2 4.41Å; W131-V170 HydrophobicContact CG-CG2 4.2Å; T166-V170 HydrophobicContact CG2-CG2 4.22Å; T166-V170 WeakPolarHBondContact O-CB 3.42Å; T166-V170 VanDerWaalsContact O-CG2 3.28Å; T166-V170 WeakPolarHBondContact O-CG2 3.44Å; T166-V170 PolarHBondContact O-N 2.92Å; V170-G172 VanDerWaalsContact C-N 3.27Å; V170-G172 PolarHBondContact O-N 3.35Å; V170-L173 PolarHBondContact O-N 3.24Å; V170-L173 VanDerWaalsContact O-N 3.16Å; V170-C174 WeakPolarHBondContact O-CB 3.46Å; V170-C174 PolarHBondContact O-N 2.69Å; V170-C174 PolarHBondContact O-SG 3.4Å; V170-M230 HydrophobicContact CG1-CE 4.46Å; V170-M230 HydrophobicContact CG1-SD 4.25Å |
| 171 | C | 94.9 | Very high | 94.6 | Very high | 61 Ų | 61 | 60 Ų | 60 | 41% | 0.412 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -58.7 | -40.1 | 175.5 | -71.3 | 0 | 0 | 0 | 0 | 112 | S167 C174 F175 | S167-C171 WeakPolarHBondContact O-CB 3.41Å; S167-C171 PolarHBondContact O-N 3.44Å; S167-C171 PolarHBondContact O-SG 3.28Å; C171-C174 PolarHBondContact O-N 2.99Å; C171-F175 PolarHBondContact O-N 3.44Å; C171-F175 VanDerWaalsContact O-N 3.14Å |
| 172 | G | 94.4 | Very high | 94.4 | Very high | 50 Ų | 50 | 56.7 Ų | 56.7 | 52% | 0.515 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62.3 | -43.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V168 A169 V170 F175 | V168-G172 PolarHBondContact O-N 3.39Å; A169-G172 PolarHBondContact O-N 3.2Å; V170-G172 VanDerWaalsContact C-N 3.27Å; V170-G172 PolarHBondContact O-N 3.35Å; G172-F175 VanDerWaalsContact O-CB 3.3Å; G172-F175 WeakPolarHBondContact O-CB 3.36Å; G172-F175 PolarHBondContact O-N 2.9Å |
| 173 | L | 92.9 | Very high | 94.4 | Very high | 73 Ų | 73 | 57 Ų | 57 | 38% | 0.382 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -70.2 | -30.5 | 177.1 | -68.4 | 170.9 | 0 | 0 | 0 | 112.9 | A169 V170 F175 M229 M230 | A169-L173 WeakPolarHBondContact O-CG 3.3Å; A169-L173 PolarHBondContact O-N 2.85Å; V170-L173 PolarHBondContact O-N 3.24Å; V170-L173 VanDerWaalsContact O-N 3.16Å; L173-F175 VanDerWaalsContact C-N 3.3Å; L173-M229 HydrophobicContact CD1-CB 4.43Å; L173-M230 HydrophobicContact CB-CE 3.27Å; L173-M230 HydrophobicContact CD1-CE 4.28Å; L173-M230 HydrophobicContact CG-CE 4.42Å |
| 174 | C | 92.6 | Very high | 94.2 | Very high | 3 Ų | 3 | 58.9 Ų | 58.9 | 2% | 0.02 | 32% | 0.323 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.7 | -5.2 | 175.7 | -73 | 0 | 0 | 0 | 0 | 113.8 | I124 V170 C171 L176 N177 F178 M230 | I124-C174 HydrophobicContact CD1-CB 4.3Å; I124-C174 HydrophobicContact CG1-CB 3.7Å; V170-C174 WeakPolarHBondContact O-CB 3.46Å; V170-C174 PolarHBondContact O-N 2.69Å; V170-C174 PolarHBondContact O-SG 3.4Å; C171-C174 PolarHBondContact O-N 2.99Å; C174-L176 VanDerWaalsContact C-N 3.29Å; C174-L176 PolarHBondContact O-N 3.2Å; C174-N177 WeakPolarHBondContact O-CA 3.48Å; C174-N177 WeakPolarHBondContact O-CB 3.25Å; C174-N177 PolarHBondContact O-N 2.85Å; C174-F178 PolarHBondContact O-N 2.81Å; C174-F178 VanDerWaalsContact O-N 3.11Å; C174-M230 HydrophobicContact CB-CE 4.44Å; C174-M230 WeakPolarHBondContact SG-CE 3.28Å |
| 175 | F | 91.9 | Very high | 93.9 | Very high | 121 Ų | 121 | 61.9 Ų | 61.9 | 53% | 0.531 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -58.4 | -40.6 | -175.1 | 179.8 | -104.8 | 0 | 0 | 0 | 112.7 | C171 G172 L173 N177 F178 L179 | C171-F175 PolarHBondContact O-N 3.44Å; C171-F175 VanDerWaalsContact O-N 3.14Å; G172-F175 VanDerWaalsContact O-CB 3.3Å; G172-F175 WeakPolarHBondContact O-CB 3.36Å; G172-F175 PolarHBondContact O-N 2.9Å; L173-F175 VanDerWaalsContact C-N 3.3Å; F175-N177 VanDerWaalsContact C-N 3.31Å; F175-N177 PolarHBondContact O-N 3.45Å; F175-F178 WeakPolarHBondContact O-CB 3.13Å; F175-F178 PolarHBondContact O-N 3.38Å; F175-L179 HydrophobicContact CD1-CD1 4.12Å; F175-L179 HydrophobicContact CE1-CD1 3.52Å; F175-L179 HydrophobicContact CE1-CG 4.18Å; F175-L179 HydrophobicContact CZ-CD1 3.91Å; F175-L179 HydrophobicContact CZ-CD2 4.38Å; F175-L179 HydrophobicContact CZ-CG 4.21Å; F175-L179 PolarHBondContact O-N 3.32Å |
| 176 | L | 91.3 | Very high | 93.5 | Very high | 52 Ų | 52 | 56 Ų | 56 | 27% | 0.272 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -64 | -37.1 | 174.9 | -69.8 | 177.8 | 0 | 0 | 0 | 111.9 | C174 F178 L179 R180 W214 I221 I225 | C174-L176 VanDerWaalsContact C-N 3.29Å; C174-L176 PolarHBondContact O-N 3.2Å; L176-F178 VanDerWaalsContact C-N 3.31Å; L176-F178 PolarHBondContact O-N 3.27Å; L176-L179 WeakPolarHBondContact O-CB 3.17Å; L176-L179 PolarHBondContact O-N 3.01Å; L176-R180 PolarHBondContact O-N 3.42Å; L176-W214 WeakPolarHBondContact O-CH2 3.5Å; L176-I221 HydrophobicContact CD1-CG2 4.03Å; L176-I225 HydrophobicContact CD1-CD1 3.86Å |
| 177 | N | 90.3 | Very high | 93.1 | Very high | 23 Ų | 23 | 59.6 Ų | 59.6 | 12% | 0.123 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -64.1 | -38.9 | 178.3 | -167.3 | 79 | 0 | 0 | 0 | 111.8 | D120 C174 F175 L179 R180 N222 V226 | D120-N177 PolarHBondContact OD1-ND2 3.48Å; C174-N177 WeakPolarHBondContact O-CA 3.48Å; C174-N177 WeakPolarHBondContact O-CB 3.25Å; C174-N177 PolarHBondContact O-N 2.85Å; F175-N177 VanDerWaalsContact C-N 3.31Å; F175-N177 PolarHBondContact O-N 3.45Å; N177-L179 VanDerWaalsContact C-N 3.29Å; N177-L179 PolarHBondContact O-N 3.25Å; N177-R180 VanDerWaalsContact O-CB 3.26Å; N177-R180 WeakPolarHBondContact O-CB 3.23Å; N177-R180 PolarHBondContact O-N 3.4Å; N177-N222 WeakPolarHBondContact CA-OD1 3.37Å; N177-N222 WeakPolarHBondContact CB-OD1 3.49Å; N177-N222 PolarHBondContact N-OD1 3.49Å; N177-N222 PolarHBondContact OD1-ND2 3.27Å; N177-N222 VanDerWaalsContact OD1-ND2 3.14Å; N177-V226 HydrophobicContact CB-CG2 4.18Å |
| 178 | F | 90.8 | Very high | 92.6 | Very high | 124 Ų | 124 | 59.6 Ų | 59.6 | 54% | 0.544 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.2 | -38.7 | 175.5 | 179.6 | -99.5 | 0 | 0 | 0 | 112.2 | C174 F175 L176 R180 | C174-F178 PolarHBondContact O-N 2.81Å; C174-F178 VanDerWaalsContact O-N 3.11Å; F175-F178 WeakPolarHBondContact O-CB 3.13Å; F175-F178 PolarHBondContact O-N 3.38Å; L176-F178 VanDerWaalsContact C-N 3.31Å; L176-F178 PolarHBondContact O-N 3.27Å; F178-R180 PolarHBondContact O-N 2.93Å |
| 179 | L | 92.6 | Very high | 92 | Very high | 55 Ų | 55 | 62 Ų | 62 | 29% | 0.288 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -69.8 | -14.9 | 178.3 | -74.8 | -173.2 | 0 | 0 | 0 | 113.9 | F175 L176 N177 W213 W214 | F175-L179 HydrophobicContact CD1-CD1 4.12Å; F175-L179 HydrophobicContact CE1-CD1 3.52Å; F175-L179 HydrophobicContact CE1-CG 4.18Å; F175-L179 HydrophobicContact CZ-CD1 3.91Å; F175-L179 HydrophobicContact CZ-CD2 4.38Å; F175-L179 HydrophobicContact CZ-CG 4.21Å; F175-L179 PolarHBondContact O-N 3.32Å; L176-L179 WeakPolarHBondContact O-CB 3.17Å; L176-L179 PolarHBondContact O-N 3.01Å; N177-L179 VanDerWaalsContact C-N 3.29Å; N177-L179 PolarHBondContact O-N 3.25Å; L179-W213 HydrophobicContact CB-CH2 4.07Å; L179-W214 HydrophobicContact CB-CZ3 3.85Å |
| 180 | R | 92.9 | Very high | 91.4 | Very high | 76 Ų | 76 | 60.9 Ų | 60.9 | 29% | 0.287 | 31% | 0.307 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | -23.2 | -178 | -172.9 | 179.2 | 179.6 | -76 | -2.7 | 113.3 | L176 N177 F178 P210 P211 W214 D219 | L176-R180 PolarHBondContact O-N 3.42Å; N177-R180 VanDerWaalsContact O-CB 3.26Å; N177-R180 WeakPolarHBondContact O-CB 3.23Å; N177-R180 PolarHBondContact O-N 3.4Å; F178-R180 PolarHBondContact O-N 2.93Å; R180-P210 VanDerWaalsContact O-CA 3.24Å; R180-P210 WeakPolarHBondContact O-CA 3.24Å; R180-P211 WeakPolarHBondContact O-CD 3.3Å; R180-W214 HydrophobicContact CB-CD2 4.45Å; R180-W214 HydrophobicContact CB-CE3 4.46Å; R180-W214 HydrophobicContact CB-CH2 3.84Å; R180-W214 HydrophobicContact CB-CZ2 3.77Å; R180-W214 HydrophobicContact CB-CZ3 4.18Å; R180-W214 HydrophobicContact CG-CD2 4.33Å; R180-W214 HydrophobicContact CG-CH2 4.4Å; R180-W214 HydrophobicContact CG-CZ2 3.83Å; R180-D219 IonicContact CZ-OD1 2.65Å; R180-D219 IonicContact NE-OD1 3.14Å; R180-D219 PolarHBondContact NE-OD1 3.38Å; R180-D219 IonicContact NH2-OD1 2.77Å; R180-D219 PolarHBondContact NH2-OD1 2.87Å |
| 181 | N | 92.3 | Very high | 90.8 | Very high | 42 Ų | 42 | 62.5 Ų | 62.5 | 23% | 0.225 | 32% | 0.318 | C | S | . | . | trans | -102.4 | 122.4 | -169.4 | -60.8 | -44.3 | 0 | 0 | 0 | 112 | V116 D120 I208 | V116-N181 HydrophobicContact CG1-CB 3.61Å; V116-N181 HydrophobicContact CG2-CB 4.23Å; D120-N181 PolarHBondContact OD1-ND2 2.89Å; D120-N181 PolarHBondContact OD2-ND2 2.99Å; D120-N181 VanDerWaalsContact OD2-ND2 3.13Å; N181-I208 HydrophobicContact CB-CG2 4.03Å | ||
| 182 | S | 93.1 | Very high | 90.2 | Very high | 35 Ų | 35 | 65.2 Ų | 65.2 | 25% | 0.245 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.5 | 150.6 | 171.9 | -177.9 | 0 | 0 | 0 | 0 | 110.6 | I208 D209 | S182-I208 CarbonylContact O-C 3.58Å; S182-I208 WeakPolarHBondContact O-CA 3.25Å; S182-D209 WeakPolarHBondContact CA-O 3.38Å; S182-D209 WeakPolarHBondContact CB-O 3.22Å; S182-D209 PolarHBondContact N-O 3.48Å; S182-D209 PolarHBondContact O-N 3.39Å; S182-D209 VanDerWaalsContact O-O 3.09Å |
| 183 | I | 94.2 | Very high | 89.7 | Confident | 34 Ų | 34 | 70.4 Ų | 70.4 | 17% | 0.174 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.9 | 125.5 | -176.9 | -57.6 | 168.2 | 0 | 0 | 0 | 109.3 | Y109 Q112 A113 V116 Y206 E207 | Y109-I183 HydrophobicContact CD2-CB 4.22Å; Y109-I183 HydrophobicContact CD2-CD1 4.46Å; Y109-I183 HydrophobicContact CD2-CG2 3.64Å; Y109-I183 HydrophobicContact CE2-CB 3.87Å; Y109-I183 HydrophobicContact CE2-CD1 4.07Å; Y109-I183 HydrophobicContact CE2-CG2 3.84Å; Q112-I183 HydrophobicContact CB-CD1 3.98Å; Q112-I183 HydrophobicContact CB-CG1 4.16Å; Q112-I183 HydrophobicContact CB-CG2 3.89Å; Q112-I183 HydrophobicContact CG-CG2 4.43Å; A113-I183 HydrophobicContact CB-CD1 3.96Å; V116-I183 HydrophobicContact CG2-CG1 4.26Å; I183-Y206 HydrophobicContact CG2-CD1 4.05Å; I183-Y206 HydrophobicContact CG2-CG 4.38Å; I183-E207 WeakPolarHBondContact CA-O 3.28Å |
| 184 | Y | 93.5 | Very high | 89.2 | Confident | 75 Ų | 75 | 67.3 Ų | 67.3 | 29% | 0.294 | 32% | 0.316 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.5 | 147.6 | -179.2 | -66.9 | -78 | 0 | 0 | 0 | 111.6 | Y206 E207 D209 P211 T212 | Y184-Y206 CarbonylContact O-C 3.55Å; Y184-Y206 VanDerWaalsContact O-CA 3.26Å; Y184-Y206 WeakPolarHBondContact O-CA 3.49Å; Y184-E207 PolarHBondContact N-O 2.86Å; Y184-E207 PolarHBondContact O-N 2.81Å; Y184-D209 HydrophobicContact CD2-CB 3.89Å; Y184-D209 HydrophobicContact CE2-CB 4.12Å; Y184-P211 VanDerWaalsContact OH-CA 3.31Å; Y184-P211 WeakPolarHBondContact OH-CA 3.43Å; Y184-T212 PolarHBondContact OH-N 2.9Å |
| 185 | E | 92.6 | Very high | 87.9 | Confident | 117 Ų | 117 | 70.4 Ų | 70.4 | 55% | 0.547 | 34% | 0.335 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.4 | 133.5 | 171.8 | -175.6 | 174.7 | -169.6 | 0 | 0 | 110.1 | T204 Y206 | E185-T204 HydrophobicContact CG-CG2 4.45Å; E185-T204 WeakPolarHBondContact OE1-CB 3.46Å; E185-T204 VanDerWaalsContact OE1-CG2 3.3Å; E185-T204 WeakPolarHBondContact OE1-CG2 3.42Å; E185-Y206 HydrophobicContact CB-CD1 4.22Å; E185-Y206 HydrophobicContact CB-CE1 3.93Å; E185-Y206 HydrophobicContact CG-CE1 4.31Å |
| 186 | R | 89.7 | Confident | 86.5 | Confident | 34 Ų | 34 | 69.3 Ų | 69.3 | 13% | 0.128 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 146.2 | 177.8 | -60.1 | -152.2 | -168.8 | -114.7 | 9.9 | 112 | S6 T204 T205 E207 D209 | S6-R186 PolarHBondContact O-NH2 3.04Å; S6-R186 WeakPolarHBondContact OG-CD 3.3Å; S6-R186 PolarHBondContact OG-NE 3.35Å; S6-R186 VanDerWaalsContact OG-NE 3.16Å; S6-R186 PolarHBondContact OG-NH1 3.13Å; R186-T204 WeakPolarHBondContact O-CA 3.41Å; R186-T205 HydrophobicContact CB-CG2 4.09Å; R186-T205 PolarHBondContact N-O 3.46Å; R186-T205 WeakPolarHBondContact O-CG2 3.39Å; R186-T205 PolarHBondContact O-N 3.42Å; R186-E207 WeakPolarHBondContact CD-OE2 3.47Å; R186-E207 HydrophobicContact CG-CB 4.23Å; R186-E207 HydrophobicContact CG-CG 4.3Å; R186-E207 IonicContact CZ-OE2 2.62Å; R186-E207 IonicContact NE-OE2 3.74Å; R186-E207 PolarHBondContact NE-OE2 2.93Å; R186-D209 IonicContact CZ-OD2 3.09Å; R186-D209 IonicContact NE-OD2 3.01Å; R186-D209 PolarHBondContact NE-OD2 2.93Å; R186-D209 IonicContact NH2-OD1 3.28Å; R186-D209 PolarHBondContact NH2-OD1 3.49Å; R186-D209 VanDerWaalsContact NH2-OD1 3.09Å; R186-D209 IonicContact NH2-OD2 3.87Å; R186-D209 PolarHBondContact NH2-OD2 3.48Å |
| 187 | P | 89.2 | Confident | 85.1 | Confident | 91 Ų | 91 | 75.3 Ų | 75.3 | 59% | 0.591 | 38% | 0.376 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -69.2 | 133.4 | 171.2 | 29.3 | -33.1 | 0 | 0 | 0 | 110.2 | Y189 | P187-Y189 HydrophobicContact CB-CE2 4.38Å |
| 188 | F | 85.5 | Confident | 83.6 | Confident | 32 Ų | 32 | 76.4 Ų | 76.4 | 14% | 0.14 | 39% | 0.388 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.8 | 130.3 | 175.3 | -178.3 | -93.4 | 0 | 0 | 0 | 110.3 | Y103 H104 L190 S203 T205 | Y103-F188 HydrophobicContact CD1-CD2 4.02Å; Y103-F188 AromaticContact CD1-CE2 3.6Å; Y103-F188 HydrophobicContact CD1-CE2 3.6Å; Y103-F188 HydrophobicContact CD1-CZ 4.2Å; Y103-F188 HydrophobicContact CE1-CD2 4.4Å; Y103-F188 HydrophobicContact CE1-CE2 4.3Å; Y103-F188 HydrophobicContact CG-CE2 4.43Å; H104-F188 HydrophobicContact CB-CB 4.4Å; H104-F188 HydrophobicContact CB-CD1 3.48Å; H104-F188 VanDerWaalsContact CB-CD1 3.48Å; H104-F188 HydrophobicContact CB-CE1 3.79Å; H104-F188 HydrophobicContact CB-CG 3.93Å; H104-F188 AromaticContact CG-CD1 3.99Å; H104-F188 AromaticContact ND1-CE1 3.79Å; F188-L190 HydrophobicContact CE1-CD1 3.88Å; F188-S203 PolarHBondContact N-O 3.3Å; F188-S203 PolarHBondContact O-N 2.89Å; F188-T205 HydrophobicContact CB-CG2 3.88Å; F188-T205 HydrophobicContact CD2-CG2 4.38Å |
| 189 | Y | 84.8 | Confident | 82.1 | Confident | 162 Ų | 162 | 75 Ų | 75 | 64% | 0.635 | 41% | 0.409 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 121 | 176.1 | -58.9 | -80.1 | 0 | 0 | 0 | 109.3 | P187 | P187-Y189 HydrophobicContact CB-CE2 4.38Å |
| 190 | L | 83.9 | Confident | 80.8 | Confident | 16 Ų | 16 | 77.9 Ų | 77.9 | 8% | 0.084 | 42% | 0.424 | C | S | . | . | trans | -65.2 | 128.9 | -178.2 | -162.1 | 69.5 | 0 | 0 | 0 | 110.8 | C101 F188 C194 A198 K201 | C101-L190 WeakPolarHBondContact O-CD1 3.24Å; F188-L190 HydrophobicContact CE1-CD1 3.88Å; L190-C194 HydrophobicContact CD1-CB 4.2Å; L190-C194 HydrophobicContact CD2-CB 3.92Å; L190-C194 HydrophobicContact CG-CB 3.79Å; L190-A198 HydrophobicContact CD2-CB 4.04Å; L190-K201 PolarHBondContact N-O 3.15Å | ||
| 191 | P | 83.7 | Confident | 79.7 | Confident | 36 Ų | 36 | 79.3 Ų | 79.3 | 23% | 0.234 | 43% | 0.432 | C | S | . | . | trans | -57.4 | 143.8 | 178.4 | -25.7 | 34.4 | 0 | 0 | 0 | 112.3 | R193 C194 | P191-R193 HydrophobicContact CB-CG 3.99Å; P191-R193 PolarHBondContact O-N 2.94Å; P191-C194 WeakPolarHBondContact O-CB 3.29Å; P191-C194 PolarHBondContact O-N 3.17Å | ||
| 192 | D | 81.5 | Confident | 79 | Confident | 119 Ų | 119 | 82.3 Ų | 82.3 | 64% | 0.636 | 45% | 0.449 | S | S | * | . | G | 310 helix | trans | -57.8 | -30.8 | -174.6 | -75.4 | -38.9 | 0 | 0 | 0 | 113.4 | C194 T195 K201 | D192-C194 PolarHBondContact O-N 3.02Å; D192-C194 VanDerWaalsContact O-N 3.15Å; D192-T195 WeakPolarHBondContact O-CB 3.49Å; D192-T195 VanDerWaalsContact O-CG2 3.26Å; D192-T195 WeakPolarHBondContact O-CG2 3.16Å; D192-T195 PolarHBondContact O-N 2.66Å; D192-T195 PolarHBondContact O-OG1 3.02Å; D192-K201 IonicContact OD1-NZ 3.82Å; D192-K201 PolarHBondContact OD1-NZ 3.27Å |
| 193 | R | 85.3 | Confident | 78.4 | Confident | 159 Ų | 159 | 82.3 Ų | 82.3 | 60% | 0.6 | 45% | 0.449 | S | S | * | . | G | 310 helix | trans | -62.1 | -16 | 174.5 | 61.8 | -178.5 | 170 | -160.9 | -7 | 114.9 | D100 P191 | D100-R193 IonicContact OD2-CZ 3.83Å; D100-R193 VanDerWaalsContact OD2-CZ 3.28Å; D100-R193 IonicContact OD2-NH1 3.48Å; D100-R193 IonicContact OD2-NH2 3.39Å; D100-R193 PolarHBondContact OD2-NH2 2.92Å; P191-R193 HydrophobicContact CB-CG 3.99Å; P191-R193 PolarHBondContact O-N 2.94Å |
| 194 | C | 81.4 | Confident | 78.1 | Confident | 7 Ų | 7 | 84.4 Ų | 84.4 | 5% | 0.047 | 46% | 0.463 | C | S | . | . | G | 310 helix | trans | -101.6 | 1.4 | -177.2 | -54.7 | 0 | 0 | 0 | 0 | 112.9 | C101 L190 P191 D192 A196 E197 | C101-C194 WeakPolarHBondContact CA-SG 3.46Å; C101-C194 HydrophobicContact CB-CB 3.6Å; C101-C194 WeakPolarHBondContact CB-SG 3.27Å; C101-C194 WeakPolarHBondContact SG-CB 3.38Å; C101-C194 CovalentContact SG-SG 2.04Å; C101-C194 PolarHBondContact SG-SG 3.32Å; L190-C194 HydrophobicContact CD1-CB 4.2Å; L190-C194 HydrophobicContact CD2-CB 3.92Å; L190-C194 HydrophobicContact CG-CB 3.79Å; P191-C194 WeakPolarHBondContact O-CB 3.29Å; P191-C194 PolarHBondContact O-N 3.17Å; D192-C194 PolarHBondContact O-N 3.02Å; D192-C194 VanDerWaalsContact O-N 3.15Å; C194-A196 PolarHBondContact O-N 3.32Å; C194-A196 VanDerWaalsContact O-N 3.14Å; C194-E197 PolarHBondContact O-N 2.95Å |
| 195 | T | 66.4 | Low | 77.9 | Confident | 68 Ų | 68 | 80.9 Ų | 80.9 | 42% | 0.417 | 45% | 0.449 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72 | -5.4 | -169.2 | 53.6 | 0 | 0 | 0 | 0 | 115.3 | D192 E197 | D192-T195 WeakPolarHBondContact O-CB 3.49Å; D192-T195 VanDerWaalsContact O-CG2 3.26Å; D192-T195 WeakPolarHBondContact O-CG2 3.16Å; D192-T195 PolarHBondContact O-N 2.66Å; D192-T195 PolarHBondContact O-OG1 3.02Å; T195-E197 PolarHBondContact O-N 3.44Å |
| 196 | A | 62.5 | Low | 77.8 | Confident | 99 Ų | 99 | 78.3 Ų | 78.3 | 82% | 0.818 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.6 | -15.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | C194 | C194-A196 PolarHBondContact O-N 3.32Å; C194-A196 VanDerWaalsContact O-N 3.14Å |
| 197 | E | 60.6 | Low | 77.8 | Confident | 178 Ų | 178 | 78.3 Ų | 78.3 | 83% | 0.832 | 44% | 0.436 | S | S | * | . | S | Bend | trans | -122 | -7.7 | -165.4 | -66.2 | -176.1 | 163.9 | 0 | 0 | 116.2 | C194 T195 | C194-E197 PolarHBondContact O-N 2.95Å; T195-E197 PolarHBondContact O-N 3.44Å |
| 198 | A | 59.4 | Low | 78 | Confident | 46 Ų | 46 | 76.4 Ų | 76.4 | 38% | 0.38 | 42% | 0.421 | S | S | . | . | trans | -141.7 | 115.5 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114 | L190 N200 | L190-A198 HydrophobicContact CD2-CB 4.04Å; A198-N200 PolarHBondContact O-N 3.23Å | ||
| 199 | G | 58.9 | Low | 78.2 | Confident | 95 Ų | 95 | 75.9 Ų | 75.9 | 98% | 0.979 | 42% | 0.419 | S | S | * | . | S | Bend | trans | -70.6 | 10.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 200 | N | 64.9 | Low | 78.6 | Confident | 114 Ų | 114 | 70.4 Ų | 70.4 | 61% | 0.61 | 40% | 0.403 | S | S | * | . | trans | -141.5 | 108.2 | 175.8 | -148.6 | 1.4 | 0 | 0 | 0 | 109.9 | A198 N202 | A198-N200 PolarHBondContact O-N 3.23Å; N200-N202 PolarHBondContact O-N 2.78Å | ||
| 201 | K | 69.7 | Low | 79.1 | Confident | 106 Ų | 106 | 70 Ų | 70 | 46% | 0.461 | 40% | 0.402 | S | S | . | . | trans | -73.8 | -16.9 | -178.2 | -68.8 | -168.1 | 175.4 | -161.8 | 0 | 113.4 | L190 D192 | L190-K201 PolarHBondContact N-O 3.15Å; D192-K201 IonicContact OD1-NZ 3.82Å; D192-K201 PolarHBondContact OD1-NZ 3.27Å | ||
| 202 | N | 77.9 | Confident | 79.5 | Confident | 106 Ų | 106 | 74.7 Ų | 74.7 | 57% | 0.567 | 43% | 0.43 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -99.2 | 115.2 | -174.3 | -63.6 | 0.2 | 0 | 0 | 0 | 109.2 | N200 | N200-N202 PolarHBondContact O-N 2.78Å |
| 203 | S | 81.8 | Confident | 80.1 | Confident | 35 Ų | 35 | 75.8 Ų | 75.8 | 25% | 0.245 | 43% | 0.426 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.3 | 166.4 | 171.2 | -69.7 | 0 | 0 | 0 | 0 | 109.8 | H104 F188 | H104-S203 PolarHBondContact CD2-OG 3.02Å; H104-S203 VanDerWaalsContact CD2-OG 3.31Å; F188-S203 PolarHBondContact N-O 3.3Å; F188-S203 PolarHBondContact O-N 2.89Å |
| 204 | T | 86.5 | Confident | 80.6 | Confident | 77 Ų | 77 | 69.4 Ų | 69.4 | 47% | 0.472 | 40% | 0.402 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.2 | 142.3 | 171 | 56.2 | 0 | 0 | 0 | 0 | 109.6 | E185 R186 | E185-T204 HydrophobicContact CG-CG2 4.45Å; E185-T204 WeakPolarHBondContact OE1-CB 3.46Å; E185-T204 VanDerWaalsContact OE1-CG2 3.3Å; E185-T204 WeakPolarHBondContact OE1-CG2 3.42Å; R186-T204 WeakPolarHBondContact O-CA 3.41Å |
| 205 | T | 89.6 | Confident | 81.2 | Confident | 1 Ų | 1 | 71.7 Ų | 71.7 | 1% | 0.006 | 42% | 0.415 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | 163.8 | 174.1 | -177.8 | 0 | 0 | 0 | 0 | 108.4 | Y103 S107 R186 F188 | Y103-T205 WeakPolarHBondContact CE1-OG1 3.35Å; S107-T205 WeakPolarHBondContact CB-OG1 3.37Å; S107-T205 PolarHBondContact OG-OG1 2.93Å; R186-T205 HydrophobicContact CB-CG2 4.09Å; R186-T205 PolarHBondContact N-O 3.46Å; R186-T205 WeakPolarHBondContact O-CG2 3.39Å; R186-T205 PolarHBondContact O-N 3.42Å; F188-T205 HydrophobicContact CB-CG2 3.88Å; F188-T205 HydrophobicContact CD2-CG2 4.38Å |
| 206 | Y | 91.8 | Very high | 82.4 | Confident | 63 Ų | 63 | 71.9 Ų | 71.9 | 25% | 0.247 | 42% | 0.417 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.4 | 138.1 | 170.2 | -65.2 | -91.2 | 0 | 0 | 0 | 109.8 | S107 Y109 Q112 I183 Y184 E185 | S107-Y206 WeakPolarHBondContact O-CD2 3.42Å; S107-Y206 PolarHBondContact O-N 2.94Å; S107-Y206 PolarHBondContact OG-O 2.98Å; Y109-Y206 AromaticContact CD2-CD1 3.99Å; Y109-Y206 HydrophobicContact CD2-CD1 3.99Å; Y109-Y206 HydrophobicContact CD2-CE1 4.1Å; Q112-Y206 VanDerWaalsContact CD-O 3.28Å; Q112-Y206 WeakPolarHBondContact CG-O 3.13Å; Q112-Y206 PolarHBondContact NE2-O 3.5Å; I183-Y206 HydrophobicContact CG2-CD1 4.05Å; I183-Y206 HydrophobicContact CG2-CG 4.38Å; Y184-Y206 CarbonylContact O-C 3.55Å; Y184-Y206 VanDerWaalsContact O-CA 3.26Å; Y184-Y206 WeakPolarHBondContact O-CA 3.49Å; E185-Y206 HydrophobicContact CB-CD1 4.22Å; E185-Y206 HydrophobicContact CB-CE1 3.93Å; E185-Y206 HydrophobicContact CG-CE1 4.31Å |
| 207 | E | 89.8 | Confident | 83.9 | Confident | 34 Ų | 34 | 72.9 Ų | 72.9 | 16% | 0.159 | 41% | 0.405 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.7 | 159.1 | 177.1 | -71.7 | -178.3 | -155 | 0 | 0 | 110.4 | S6 I183 Y184 R186 | S6-E207 PolarHBondContact OG-OE2 3.36Å; I183-E207 WeakPolarHBondContact CA-O 3.28Å; Y184-E207 PolarHBondContact N-O 2.86Å; Y184-E207 PolarHBondContact O-N 2.81Å; R186-E207 WeakPolarHBondContact CD-OE2 3.47Å; R186-E207 HydrophobicContact CG-CB 4.23Å; R186-E207 HydrophobicContact CG-CG 4.3Å; R186-E207 IonicContact CZ-OE2 2.62Å; R186-E207 IonicContact NE-OE2 3.74Å; R186-E207 PolarHBondContact NE-OE2 2.93Å |
| 208 | I | 91.7 | Very high | 85.4 | Confident | 51 Ų | 51 | 66.8 Ų | 66.8 | 26% | 0.262 | 38% | 0.378 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.1 | 120.7 | -178.8 | -58.7 | 159.9 | 0 | 0 | 0 | 108.1 | Q112 V115 V116 N181 S182 | Q112-I208 HydrophobicContact CB-CG1 4.31Å; Q112-I208 VanDerWaalsContact OE1-CD1 3.31Å; V115-I208 HydrophobicContact CB-CD1 4.09Å; V115-I208 HydrophobicContact CG1-CD1 3.69Å; V116-I208 HydrophobicContact CB-CD1 4.49Å; V116-I208 HydrophobicContact CG2-CB 4.25Å; V116-I208 HydrophobicContact CG2-CD1 3.35Å; V116-I208 HydrophobicContact CG2-CG1 3.5Å; V116-I208 HydrophobicContact CG2-CG2 3.69Å; N181-I208 HydrophobicContact CB-CG2 4.03Å; S182-I208 CarbonylContact O-C 3.58Å; S182-I208 WeakPolarHBondContact O-CA 3.25Å |
| 209 | D | 90.7 | Very high | 86.9 | Confident | 21 Ų | 21 | 67.3 Ų | 67.3 | 11% | 0.112 | 37% | 0.374 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.3 | 160.3 | 179.4 | -61 | -79.3 | 0 | 0 | 0 | 111.5 | S182 Y184 R186 | S182-D209 WeakPolarHBondContact CA-O 3.38Å; S182-D209 WeakPolarHBondContact CB-O 3.22Å; S182-D209 PolarHBondContact N-O 3.48Å; S182-D209 PolarHBondContact O-N 3.39Å; S182-D209 VanDerWaalsContact O-O 3.09Å; Y184-D209 HydrophobicContact CD2-CB 3.89Å; Y184-D209 HydrophobicContact CE2-CB 4.12Å; R186-D209 IonicContact CZ-OD2 3.09Å; R186-D209 IonicContact NE-OD2 3.01Å; R186-D209 PolarHBondContact NE-OD2 2.93Å; R186-D209 IonicContact NH2-OD1 3.28Å; R186-D209 PolarHBondContact NH2-OD1 3.49Å; R186-D209 VanDerWaalsContact NH2-OD1 3.09Å; R186-D209 IonicContact NH2-OD2 3.87Å; R186-D209 PolarHBondContact NH2-OD2 3.48Å |
| 210 | P | 93.2 | Very high | 88.3 | Confident | 47 Ų | 47 | 65 Ų | 65 | 31% | 0.305 | 35% | 0.346 | S | S | . | . | trans | -53.5 | 138.9 | 166.9 | -25.3 | 35.9 | 0 | 0 | 0 | 112.7 | R180 W214 | R180-P210 VanDerWaalsContact O-CA 3.24Å; R180-P210 WeakPolarHBondContact O-CA 3.24Å; P210-W214 HydrophobicContact CB-CB 3.89Å; P210-W214 HydrophobicContact CB-CG 3.87Å | ||
| 211 | P | 94 | Very high | 89.6 | Confident | 8 Ų | 8 | 63.5 Ų | 63.5 | 5% | 0.052 | 34% | 0.337 | C | S | . | . | trans | -64.5 | 156 | 176.9 | 23.4 | -29.4 | 0 | 0 | 0 | 111.3 | R180 Y184 W213 W214 | R180-P211 WeakPolarHBondContact O-CD 3.3Å; Y184-P211 VanDerWaalsContact OH-CA 3.31Å; Y184-P211 WeakPolarHBondContact OH-CA 3.43Å; P211-W213 HydrophobicContact CB-CD2 4.23Å; P211-W213 HydrophobicContact CB-CG 4.4Å; P211-W213 HydrophobicContact CB-CZ2 3.97Å; P211-W213 HydrophobicContact CG-CD2 4.02Å; P211-W213 VanDerWaalsContact CG-CE2 3.45Å; P211-W213 HydrophobicContact CG-CE3 4.44Å; P211-W213 HydrophobicContact CG-CH2 3.86Å; P211-W213 HydrophobicContact CG-CZ2 3.37Å; P211-W213 HydrophobicContact CG-CZ3 4.37Å; P211-W213 PolarHBondContact O-N 3.29Å; P211-W214 HydrophobicContact CG-CB 3.97Å; P211-W214 WeakPolarHBondContact O-CA 3.31Å; P211-W214 WeakPolarHBondContact O-CB 3.35Å; P211-W214 PolarHBondContact O-N 3.42Å | ||
| 212 | T | 92.7 | Very high | 90.6 | Very high | 135 Ų | 135 | 58.7 Ų | 58.7 | 83% | 0.828 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.6 | -18.5 | -175.4 | 56.9 | 0 | 0 | 0 | 0 | 115 | Y184 | Y184-T212 PolarHBondContact OH-N 2.9Š|
| 213 | W | 94.1 | Very high | 91 | Very high | 142 Ų | 142 | 56.5 Ų | 56.5 | 54% | 0.538 | 30% | 0.302 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.6 | -5.1 | 174.4 | 54.2 | -99 | 0 | 0 | 0 | 113 | L179 P211 T215 | L179-W213 HydrophobicContact CB-CH2 4.07Å; P211-W213 HydrophobicContact CB-CD2 4.23Å; P211-W213 HydrophobicContact CB-CG 4.4Å; P211-W213 HydrophobicContact CB-CZ2 3.97Å; P211-W213 HydrophobicContact CG-CD2 4.02Å; P211-W213 VanDerWaalsContact CG-CE2 3.45Å; P211-W213 HydrophobicContact CG-CE3 4.44Å; P211-W213 HydrophobicContact CG-CH2 3.86Å; P211-W213 HydrophobicContact CG-CZ2 3.37Å; P211-W213 HydrophobicContact CG-CZ3 4.37Å; P211-W213 PolarHBondContact O-N 3.29Å; W213-T215 PolarHBondContact O-N 3.33Å |
| 214 | W | 94.7 | Very high | 91.3 | Very high | 25 Ų | 25 | 60.2 Ų | 60.2 | 10% | 0.095 | 31% | 0.311 | C | S | . | . | trans | -75.4 | 112.2 | 176.4 | -166.6 | -93.7 | 0 | 0 | 0 | 109.8 | L176 L179 R180 P210 P211 L218 D219 N222 | L176-W214 WeakPolarHBondContact O-CH2 3.5Å; L179-W214 HydrophobicContact CB-CZ3 3.85Å; R180-W214 HydrophobicContact CB-CD2 4.45Å; R180-W214 HydrophobicContact CB-CE3 4.46Å; R180-W214 HydrophobicContact CB-CH2 3.84Å; R180-W214 HydrophobicContact CB-CZ2 3.77Å; R180-W214 HydrophobicContact CB-CZ3 4.18Å; R180-W214 HydrophobicContact CG-CD2 4.33Å; R180-W214 HydrophobicContact CG-CH2 4.4Å; R180-W214 HydrophobicContact CG-CZ2 3.83Å; P210-W214 HydrophobicContact CB-CB 3.89Å; P210-W214 HydrophobicContact CB-CG 3.87Å; P211-W214 HydrophobicContact CG-CB 3.97Å; P211-W214 WeakPolarHBondContact O-CA 3.31Å; P211-W214 WeakPolarHBondContact O-CB 3.35Å; P211-W214 PolarHBondContact O-N 3.42Å; W214-L218 HydrophobicContact CD2-CB 4.11Å; W214-L218 HydrophobicContact CE3-CB 4.47Å; W214-L218 HydrophobicContact CE3-CD1 4.33Å; W214-L218 HydrophobicContact CH2-CB 4.33Å; W214-L218 HydrophobicContact CZ2-CB 4Å; W214-D219 PolarHBondContact NE1-OD1 3.19Å; W214-N222 HydrophobicContact CH2-CB 4.3Å; W214-N222 HydrophobicContact CZ2-CB 3.85Å | ||
| 215 | T | 94.7 | Very high | 91.4 | Very high | 55 Ų | 55 | 58.8 Ų | 58.8 | 34% | 0.337 | 30% | 0.3 | S | S | . | . | trans | -88.5 | 156.8 | -177.3 | 78.8 | 0 | 0 | 0 | 0 | 111.2 | W213 E217 L218 D219 | W213-T215 PolarHBondContact O-N 3.33Å; T215-E217 WeakPolarHBondContact CB-OE2 3.49Å; T215-E217 PolarHBondContact O-N 3.11Å; T215-E217 PolarHBondContact OG1-N 2.98Å; T215-E217 PolarHBondContact OG1-OE2 3.29Å; T215-L218 WeakPolarHBondContact O-CB 3.34Å; T215-L218 PolarHBondContact O-N 3.25Å; T215-L218 PolarHBondContact OG1-N 3.12Å; T215-D219 PolarHBondContact O-N 3.23Å | ||
| 216 | P | 91.5 | Very high | 91.3 | Very high | 71 Ų | 71 | 60 Ų | 60 | 46% | 0.461 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -55.4 | -31.5 | 173.7 | -26.3 | 36 | 0 | 0 | 0 | 113.2 | D219 A220 | P216-D219 PolarHBondContact O-N 2.85Å; P216-A220 PolarHBondContact O-N 3.45Å |
| 217 | E | 93.1 | Very high | 91.1 | Very high | 120 Ų | 120 | 57.2 Ų | 57.2 | 56% | 0.561 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -67 | -40.4 | 175.8 | -56.2 | 74.9 | -160.8 | 0 | 0 | 111.8 | T215 D219 A220 I221 | T215-E217 WeakPolarHBondContact CB-OE2 3.49Å; T215-E217 PolarHBondContact O-N 3.11Å; T215-E217 PolarHBondContact OG1-N 2.98Å; T215-E217 PolarHBondContact OG1-OE2 3.29Å; E217-D219 VanDerWaalsContact C-N 3.32Å; E217-A220 PolarHBondContact O-N 3.05Å; E217-I221 WeakPolarHBondContact O-CB 3.34Å; E217-I221 WeakPolarHBondContact O-CD1 3.08Å; E217-I221 VanDerWaalsContact O-CG1 3.22Å; E217-I221 WeakPolarHBondContact O-CG1 3.42Å; E217-I221 PolarHBondContact O-N 3.45Å |
| 218 | L | 93.4 | Very high | 91 | Very high | 51 Ų | 51 | 58.6 Ų | 58.6 | 27% | 0.267 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -65.4 | -37.5 | 173.5 | -72.2 | 175.2 | 0 | 0 | 0 | 111.5 | W214 T215 I221 N222 | W214-L218 HydrophobicContact CD2-CB 4.11Å; W214-L218 HydrophobicContact CE3-CB 4.47Å; W214-L218 HydrophobicContact CE3-CD1 4.33Å; W214-L218 HydrophobicContact CH2-CB 4.33Å; W214-L218 HydrophobicContact CZ2-CB 4Å; T215-L218 WeakPolarHBondContact O-CB 3.34Å; T215-L218 PolarHBondContact O-N 3.25Å; T215-L218 PolarHBondContact OG1-N 3.12Å; L218-I221 PolarHBondContact O-N 2.78Å; L218-N222 WeakPolarHBondContact O-CB 3.32Å; L218-N222 PolarHBondContact O-N 3.46Å |
| 219 | D | 89.9 | Confident | 90.9 | Very high | 56 Ų | 56 | 59.5 Ų | 59.5 | 30% | 0.299 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -62.8 | -46.7 | 175.7 | -157.6 | 57.5 | 0 | 0 | 0 | 111.2 | R180 W214 T215 P216 E217 I221 N222 F223 | R180-D219 IonicContact CZ-OD1 2.65Å; R180-D219 IonicContact NE-OD1 3.14Å; R180-D219 PolarHBondContact NE-OD1 3.38Å; R180-D219 IonicContact NH2-OD1 2.77Å; R180-D219 PolarHBondContact NH2-OD1 2.87Å; W214-D219 PolarHBondContact NE1-OD1 3.19Å; T215-D219 PolarHBondContact O-N 3.23Å; P216-D219 PolarHBondContact O-N 2.85Å; E217-D219 VanDerWaalsContact C-N 3.32Å; D219-I221 PolarHBondContact O-N 3.26Å; D219-N222 PolarHBondContact O-N 2.99Å; D219-F223 WeakPolarHBondContact O-CB 3.47Å; D219-F223 PolarHBondContact O-N 3.45Å |
| 220 | A | 89.6 | Confident | 90.7 | Very high | 46 Ų | 46 | 58.5 Ų | 58.5 | 38% | 0.38 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -60.4 | -46.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | P216 E217 F223 W224 | P216-A220 PolarHBondContact O-N 3.45Å; E217-A220 PolarHBondContact O-N 3.05Å; A220-F223 PolarHBondContact O-N 3.17Å; A220-W224 PolarHBondContact O-N 3.28Å |
| 221 | I | 91.5 | Very high | 90.3 | Very high | 83 Ų | 83 | 57.4 Ų | 57.4 | 43% | 0.426 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -60.4 | -48 | 177.6 | -70.6 | 164.9 | 0 | 0 | 0 | 110.8 | L176 E217 L218 D219 F223 W224 I225 | L176-I221 HydrophobicContact CD1-CG2 4.03Å; E217-I221 WeakPolarHBondContact O-CB 3.34Å; E217-I221 WeakPolarHBondContact O-CD1 3.08Å; E217-I221 VanDerWaalsContact O-CG1 3.22Å; E217-I221 WeakPolarHBondContact O-CG1 3.42Å; E217-I221 PolarHBondContact O-N 3.45Å; L218-I221 PolarHBondContact O-N 2.78Å; D219-I221 PolarHBondContact O-N 3.26Å; I221-F223 VanDerWaalsContact C-N 3.34Å; I221-F223 PolarHBondContact O-N 3.46Å; I221-W224 PolarHBondContact O-N 3.43Å; I221-I225 HydrophobicContact CG2-CD1 3.6Å; I221-I225 HydrophobicContact CG2-CG1 4.38Å; I221-I225 WeakPolarHBondContact O-CB 3.41Å; I221-I225 VanDerWaalsContact O-CG1 3.29Å; I221-I225 WeakPolarHBondContact O-CG1 3.28Å; I221-I225 PolarHBondContact O-N 2.82Å |
| 222 | N | 91 | Very high | 90 | Very high | 6 Ų | 6 | 58.7 Ų | 58.7 | 3% | 0.032 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -60.2 | -46.7 | 178.1 | -178.2 | 62.9 | 0 | 0 | 0 | 111 | N177 W214 L218 D219 W224 I225 V226 | N177-N222 WeakPolarHBondContact CA-OD1 3.37Å; N177-N222 WeakPolarHBondContact CB-OD1 3.49Å; N177-N222 PolarHBondContact N-OD1 3.49Å; N177-N222 PolarHBondContact OD1-ND2 3.27Å; N177-N222 VanDerWaalsContact OD1-ND2 3.14Å; W214-N222 HydrophobicContact CH2-CB 4.3Å; W214-N222 HydrophobicContact CZ2-CB 3.85Å; L218-N222 WeakPolarHBondContact O-CB 3.32Å; L218-N222 PolarHBondContact O-N 3.46Å; D219-N222 PolarHBondContact O-N 2.99Å; N222-W224 PolarHBondContact O-N 2.69Å; N222-I225 PolarHBondContact O-N 3.5Å; N222-V226 WeakPolarHBondContact O-CB 3.5Å; N222-V226 VanDerWaalsContact O-CG2 3.29Å; N222-V226 WeakPolarHBondContact O-CG2 3.36Å; N222-V226 PolarHBondContact O-N 3.09Å |
| 223 | F | 86.7 | Confident | 90 | Very high | 60 Ų | 60 | 55.1 Ų | 55.1 | 26% | 0.263 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -56.9 | -47.4 | 177.8 | 177.6 | -83.8 | 0 | 0 | 0 | 111.8 | D219 A220 I221 G227 I293 N296 A297 | D219-F223 WeakPolarHBondContact O-CB 3.47Å; D219-F223 PolarHBondContact O-N 3.45Å; A220-F223 PolarHBondContact O-N 3.17Å; I221-F223 VanDerWaalsContact C-N 3.34Å; I221-F223 PolarHBondContact O-N 3.46Å; F223-G227 PolarHBondContact O-N 3Å; F223-I293 VanDerWaalsContact CZ-O 3.27Å; F223-I293 WeakPolarHBondContact CZ-O 3.46Å; F223-N296 HydrophobicContact CZ-CB 4.49Å; F223-A297 HydrophobicContact CD1-CB 4.34Å; F223-A297 HydrophobicContact CE1-CB 3.23Å; F223-A297 HydrophobicContact CZ-CB 3.53Å |
| 224 | W | 87.7 | Confident | 89.9 | Confident | 112 Ų | 112 | 48.4 Ų | 48.4 | 42% | 0.424 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -68.3 | -39 | 178.7 | -76.9 | 113.3 | 0 | 0 | 0 | 113 | A220 I221 N222 I228 A297 F298 | A220-W224 PolarHBondContact O-N 3.28Å; I221-W224 PolarHBondContact O-N 3.43Å; N222-W224 PolarHBondContact O-N 2.69Å; W224-I228 HydrophobicContact CE3-CD1 3.57Å; W224-I228 HydrophobicContact CE3-CG1 3.95Å; W224-I228 HydrophobicContact CZ3-CD1 4.14Å; W224-I228 HydrophobicContact CZ3-CG1 4.48Å; W224-I228 VanDerWaalsContact O-CB 3.3Å; W224-I228 WeakPolarHBondContact O-CB 3.45Å; W224-I228 WeakPolarHBondContact O-CG1 3.4Å; W224-I228 PolarHBondContact O-N 3.16Å; W224-A297 HydrophobicContact CH2-CB 4.31Å; W224-A297 HydrophobicContact CZ2-CB 4.38Å; W224-F298 HydrophobicContact CH2-CE1 4.35Å; W224-F298 HydrophobicContact CH2-CE2 4.24Å; W224-F298 AromaticContact CH2-CZ 3.72Å; W224-F298 HydrophobicContact CH2-CZ 3.72Å; W224-F298 HydrophobicContact CZ2-CZ 4.43Å |
| 225 | I | 89.1 | Confident | 89.5 | Confident | 47 Ų | 47 | 47.4 Ų | 47.4 | 24% | 0.241 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.3 | -50.9 | 176.2 | -71.2 | 170.1 | 0 | 0 | 0 | 110 | L176 I221 N222 M229 | L176-I225 HydrophobicContact CD1-CD1 3.86Å; I221-I225 HydrophobicContact CG2-CD1 3.6Å; I221-I225 HydrophobicContact CG2-CG1 4.38Å; I221-I225 WeakPolarHBondContact O-CB 3.41Å; I221-I225 VanDerWaalsContact O-CG1 3.29Å; I221-I225 WeakPolarHBondContact O-CG1 3.28Å; I221-I225 PolarHBondContact O-N 2.82Å; N222-I225 PolarHBondContact O-N 3.5Å; I225-M229 WeakPolarHBondContact O-CA 3.29Å; I225-M229 VanDerWaalsContact O-CB 3.24Å; I225-M229 WeakPolarHBondContact O-CB 3.4Å; I225-M229 PolarHBondContact O-N 3.34Å |
| 226 | V | 86.6 | Confident | 89.3 | Confident | 27 Ų | 27 | 48.4 Ų | 48.4 | 16% | 0.164 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.6 | -48.1 | 179.2 | 173.9 | 0 | 0 | 0 | 0 | 110.2 | N177 N222 M230 | N177-V226 HydrophobicContact CB-CG2 4.18Å; N222-V226 WeakPolarHBondContact O-CB 3.5Å; N222-V226 VanDerWaalsContact O-CG2 3.29Å; N222-V226 WeakPolarHBondContact O-CG2 3.36Å; N222-V226 PolarHBondContact O-N 3.09Å; V226-M230 WeakPolarHBondContact O-CA 3.43Å; V226-M230 WeakPolarHBondContact O-CB 3.41Å; V226-M230 PolarHBondContact O-N 2.91Å |
| 227 | G | 86.8 | Confident | 89.4 | Confident | 4 Ų | 4 | 47.1 Ų | 47.1 | 4% | 0.041 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -60.1 | -57.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | F223 K231 V232 | F223-G227 PolarHBondContact O-N 3Å; G227-K231 WeakPolarHBondContact O-CB 3.15Å; G227-K231 PolarHBondContact O-N 3.03Å; G227-V232 WeakPolarHBondContact O-CG2 3.42Å; G227-V232 PolarHBondContact O-N 2.86Å; G227-V232 VanDerWaalsContact O-N 3.09Å |
| 228 | I | 88.7 | Confident | 89.3 | Confident | 64 Ų | 64 | 41.4 Ų | 41.4 | 33% | 0.328 | 22% | 0.217 | S | C | . | . | I | π-helix | trans | -74.4 | -54.4 | -172.5 | -58.6 | 174.3 | 0 | 0 | 0 | 111.4 | W224 V232 L233 | W224-I228 HydrophobicContact CE3-CD1 3.57Å; W224-I228 HydrophobicContact CE3-CG1 3.95Å; W224-I228 HydrophobicContact CZ3-CD1 4.14Å; W224-I228 HydrophobicContact CZ3-CG1 4.48Å; W224-I228 VanDerWaalsContact O-CB 3.3Å; W224-I228 WeakPolarHBondContact O-CB 3.45Å; W224-I228 WeakPolarHBondContact O-CG1 3.4Å; W224-I228 PolarHBondContact O-N 3.16Å; I228-V232 PolarHBondContact O-N 3.38Å; I228-L233 WeakPolarHBondContact O-CB 3.28Å; I228-L233 PolarHBondContact O-N 2.88Å |
| 229 | M | 89.2 | Confident | 89.1 | Confident | 69 Ų | 69 | 42 Ų | 42 | 34% | 0.34 | 22% | 0.223 | S | C | . | . | I | π-helix | trans | -76.9 | -30.9 | -170.4 | -60.7 | -63.4 | 142 | 0 | 0 | 112.5 | W131 L173 I225 L233 P234 | W131-M229 WeakPolarHBondContact CZ2-O 3.46Å; W131-M229 PolarHBondContact NE1-O 3.35Å; W131-M229 VanDerWaalsContact NE1-O 3.12Å; L173-M229 HydrophobicContact CD1-CB 4.43Å; I225-M229 WeakPolarHBondContact O-CA 3.29Å; I225-M229 VanDerWaalsContact O-CB 3.24Å; I225-M229 WeakPolarHBondContact O-CB 3.4Å; I225-M229 PolarHBondContact O-N 3.34Å; M229-L233 HydrophobicContact SD-CD2 3.88Å; M229-P234 WeakPolarHBondContact O-CD 3.46Å; M229-P234 WeakPolarHBondContact O-CG 3.49Å |
| 230 | M | 86.2 | Confident | 89.2 | Confident | 1 Ų | 1 | 43.6 Ų | 43.6 | 1% | 0.005 | 23% | 0.231 | C | C | . | . | I | π-helix | trans | -94.3 | -20 | -177.5 | -50.2 | -60.7 | -179.4 | 0 | 0 | 113.8 | S127 L130 V170 L173 C174 V226 | S127-M230 WeakPolarHBondContact OG-CB 3.4Å; L130-M230 WeakPolarHBondContact CD2-O 3.4Å; V170-M230 HydrophobicContact CG1-CE 4.46Å; V170-M230 HydrophobicContact CG1-SD 4.25Å; L173-M230 HydrophobicContact CB-CE 3.27Å; L173-M230 HydrophobicContact CD1-CE 4.28Å; L173-M230 HydrophobicContact CG-CE 4.42Å; C174-M230 HydrophobicContact CB-CE 4.44Å; C174-M230 WeakPolarHBondContact SG-CE 3.28Å; V226-M230 WeakPolarHBondContact O-CA 3.43Å; V226-M230 WeakPolarHBondContact O-CB 3.41Å; V226-M230 PolarHBondContact O-N 2.91Å |
| 231 | K | 86 | Confident | 89.2 | Confident | 24 Ų | 24 | 42.8 Ų | 42.8 | 10% | 0.104 | 22% | 0.218 | C | C | . | . | I | π-helix | trans | -125.2 | -61.1 | -177.1 | -61.2 | -73.6 | -173.3 | 166 | 0 | 112.4 | G227 P234 C235 I293 | G227-K231 WeakPolarHBondContact O-CB 3.15Å; G227-K231 PolarHBondContact O-N 3.03Å; K231-P234 WeakPolarHBondContact O-CD 3.42Å; K231-C235 WeakPolarHBondContact O-CB 3.35Å; K231-C235 PolarHBondContact O-N 3.07Å; K231-C235 VanDerWaalsContact O-N 3.09Å; K231-C235 PolarHBondContact O-SG 3.06Å; K231-I293 HydrophobicContact CD-CD1 4.37Å; K231-I293 HydrophobicContact CG-CD1 3.89Å |
| 232 | V | 87.7 | Confident | 89.1 | Confident | 34 Ų | 34 | 39.7 Ų | 39.7 | 21% | 0.206 | 20% | 0.203 | C | C | . | . | I | π-helix | trans | -66.7 | -54.5 | -168.3 | -178.4 | 0 | 0 | 0 | 0 | 112.3 | G227 I228 C235 V236 I294 | G227-V232 WeakPolarHBondContact O-CG2 3.42Å; G227-V232 PolarHBondContact O-N 2.86Å; G227-V232 VanDerWaalsContact O-N 3.09Å; I228-V232 PolarHBondContact O-N 3.38Å; V232-C235 PolarHBondContact O-N 2.79Å; V232-C235 VanDerWaalsContact O-N 3.13Å; V232-V236 HydrophobicContact CG1-CG2 4.45Å; V232-V236 WeakPolarHBondContact O-CG2 3.22Å; V232-V236 PolarHBondContact O-N 3.11Å; V232-I294 HydrophobicContact CB-CD1 4.22Å; V232-I294 HydrophobicContact CG1-CD1 3.94Å; V232-I294 HydrophobicContact CG2-CD1 3.19Å; V232-I294 HydrophobicContact CG2-CG1 3.4Å; V232-I294 VanDerWaalsContact CG2-CG1 3.4Å |
| 233 | L | 91.4 | Very high | 89.1 | Confident | 61 Ų | 61 | 42.3 Ų | 42.3 | 32% | 0.319 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -59.4 | -48.5 | -176.8 | 172.7 | 64.8 | 0 | 0 | 0 | 111.2 | W131 I228 M229 C235 V236 L237 | W131-L233 HydrophobicContact CH2-CD2 3.76Å; W131-L233 HydrophobicContact CH2-CG 4.06Å; W131-L233 HydrophobicContact CZ2-CD2 4.08Å; W131-L233 HydrophobicContact CZ2-CG 4.42Å; I228-L233 WeakPolarHBondContact O-CB 3.28Å; I228-L233 PolarHBondContact O-N 2.88Å; M229-L233 HydrophobicContact SD-CD2 3.88Å; L233-C235 PolarHBondContact O-N 3.34Å; L233-V236 PolarHBondContact O-N 2.89Å; L233-L237 HydrophobicContact CD1-CD1 4.24Å; L233-L237 HydrophobicContact CD1-CG 4.26Å; L233-L237 HydrophobicContact CG-CD1 4.24Å; L233-L237 WeakPolarHBondContact O-CG 3.33Å; L233-L237 PolarHBondContact O-N 3.24Å |
| 234 | P | 91.6 | Very high | 89.2 | Confident | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.3 | -39.8 | 173.8 | -23.8 | 32.1 | 0 | 0 | 0 | 113.8 | L130 W131 V134 M229 K231 V236 L237 L238 | L130-P234 HydrophobicContact CD1-CB 3.48Å; L130-P234 VanDerWaalsContact CD1-CB 3.48Å; L130-P234 HydrophobicContact CD2-CB 3.64Å; L130-P234 HydrophobicContact CD2-CG 3.98Å; L130-P234 HydrophobicContact CG-CB 3.35Å; L130-P234 HydrophobicContact CG-CG 3.97Å; W131-P234 HydrophobicContact CD2-CG 4.16Å; W131-P234 HydrophobicContact CH2-CG 4.38Å; W131-P234 HydrophobicContact CZ2-CG 3.73Å; V134-P234 HydrophobicContact CG2-CB 4.21Å; M229-P234 WeakPolarHBondContact O-CD 3.46Å; M229-P234 WeakPolarHBondContact O-CG 3.49Å; K231-P234 WeakPolarHBondContact O-CD 3.42Å; P234-V236 PolarHBondContact O-N 3.11Å; P234-L237 PolarHBondContact O-N 2.77Å; P234-L238 WeakPolarHBondContact O-CB 3.38Å; P234-L238 VanDerWaalsContact O-CG 3.29Å; P234-L238 WeakPolarHBondContact O-CG 3.22Å; P234-L238 PolarHBondContact O-N 2.84Å |
| 235 | C | 88.2 | Confident | 89.2 | Confident | 4 Ų | 4 | 37.5 Ų | 37.5 | 3% | 0.027 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.2 | -39.7 | 177.9 | -70.6 | 0 | 0 | 0 | 0 | 112.6 | K231 V232 L233 L238 T239 L287 | K231-C235 WeakPolarHBondContact O-CB 3.35Å; K231-C235 PolarHBondContact O-N 3.07Å; K231-C235 VanDerWaalsContact O-N 3.09Å; K231-C235 PolarHBondContact O-SG 3.06Å; V232-C235 PolarHBondContact O-N 2.79Å; V232-C235 VanDerWaalsContact O-N 3.13Å; L233-C235 PolarHBondContact O-N 3.34Å; C235-L238 PolarHBondContact O-N 3.06Å; C235-T239 PolarHBondContact O-N 3.48Å; C235-T239 PolarHBondContact O-OG1 3.46Å; C235-L287 HydrophobicContact CB-CD1 4.08Å |
| 236 | V | 90.5 | Very high | 89.2 | Confident | 76 Ų | 76 | 38.4 Ų | 38.4 | 46% | 0.461 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -63.4 | -46.8 | 173.6 | 173.2 | 0 | 0 | 0 | 0 | 110.3 | V232 L233 P234 L238 T239 I240 | V232-V236 HydrophobicContact CG1-CG2 4.45Å; V232-V236 WeakPolarHBondContact O-CG2 3.22Å; V232-V236 PolarHBondContact O-N 3.11Å; L233-V236 PolarHBondContact O-N 2.89Å; P234-V236 PolarHBondContact O-N 3.11Å; V236-L238 PolarHBondContact O-N 3.49Å; V236-T239 WeakPolarHBondContact O-CB 3.24Å; V236-T239 PolarHBondContact O-N 2.98Å; V236-I240 HydrophobicContact CG1-CD1 4.24Å; V236-I240 WeakPolarHBondContact O-CG1 3.12Å; V236-I240 PolarHBondContact O-N 3.16Å; V236-I240 VanDerWaalsContact O-N 3.08Å |
| 237 | L | 92.9 | Very high | 89.3 | Confident | 45 Ų | 45 | 42 Ų | 42 | 24% | 0.236 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -61.1 | -43.6 | 176.6 | -68.8 | 175.7 | 0 | 0 | 0 | 111.8 | W131 V134 L233 P234 T239 I240 F241 | W131-L237 HydrophobicContact CH2-CD1 4.14Å; W131-L237 HydrophobicContact CZ3-CD1 3.89Å; V134-L237 HydrophobicContact CG1-CB 4.12Å; V134-L237 HydrophobicContact CG1-CD1 4.06Å; V134-L237 HydrophobicContact CG2-CB 4.27Å; L233-L237 HydrophobicContact CD1-CD1 4.24Å; L233-L237 HydrophobicContact CD1-CG 4.26Å; L233-L237 HydrophobicContact CG-CD1 4.24Å; L233-L237 WeakPolarHBondContact O-CG 3.33Å; L233-L237 PolarHBondContact O-N 3.24Å; P234-L237 PolarHBondContact O-N 2.77Å; L237-T239 VanDerWaalsContact C-N 3.31Å; L237-T239 PolarHBondContact O-N 3.35Å; L237-I240 PolarHBondContact O-N 3.06Å; L237-F241 HydrophobicContact CB-CD2 4.36Å; L237-F241 HydrophobicContact CB-CE2 4.33Å; L237-F241 WeakPolarHBondContact O-CB 3.08Å; L237-F241 WeakPolarHBondContact O-CD2 3.4Å; L237-F241 PolarHBondContact O-N 3.34Å |
| 238 | L | 90.3 | Very high | 89.2 | Confident | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.9 | -41.2 | 175.2 | -71.6 | -173.3 | 0 | 0 | 0 | 111.5 | L130 T133 V134 P234 C235 V236 I240 F241 I242 V279 F282 | L130-L238 HydrophobicContact CD1-CD1 3.52Å; L130-L238 HydrophobicContact CD1-CG 4.21Å; T133-L238 HydrophobicContact CG2-CD1 4.49Å; T133-L238 HydrophobicContact CG2-CD2 3.83Å; V134-L238 HydrophobicContact CB-CD2 4.42Å; V134-L238 HydrophobicContact CG2-CD2 3.62Å; V134-L238 HydrophobicContact CG2-CG 3.98Å; P234-L238 WeakPolarHBondContact O-CB 3.38Å; P234-L238 VanDerWaalsContact O-CG 3.29Å; P234-L238 WeakPolarHBondContact O-CG 3.22Å; P234-L238 PolarHBondContact O-N 2.84Å; C235-L238 PolarHBondContact O-N 3.06Å; V236-L238 PolarHBondContact O-N 3.49Å; L238-I240 VanDerWaalsContact C-N 3.34Å; L238-I240 PolarHBondContact O-N 2.97Å; L238-F241 PolarHBondContact O-N 2.86Å; L238-I242 WeakPolarHBondContact O-CB 3.39Å; L238-I242 WeakPolarHBondContact O-CG1 3.34Å; L238-I242 PolarHBondContact O-N 2.81Å; L238-V279 HydrophobicContact CD2-CG1 4.05Å; L238-F282 HydrophobicContact CD1-CB 4.47Å; L238-F282 HydrophobicContact CD1-CD1 3.74Å; L238-F282 HydrophobicContact CD1-CG 4.45Å |
| 239 | T | 90.6 | Very high | 89 | Confident | 64 Ų | 64 | 40.3 Ų | 40.3 | 39% | 0.393 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -58.9 | -46.5 | 176 | -54 | 0 | 0 | 0 | 0 | 111.2 | C235 V236 L237 I242 A243 W283 | C235-T239 PolarHBondContact O-N 3.48Å; C235-T239 PolarHBondContact O-OG1 3.46Å; V236-T239 WeakPolarHBondContact O-CB 3.24Å; V236-T239 PolarHBondContact O-N 2.98Å; L237-T239 VanDerWaalsContact C-N 3.31Å; L237-T239 PolarHBondContact O-N 3.35Å; T239-I242 PolarHBondContact O-N 3.31Å; T239-A243 PolarHBondContact O-N 2.97Å; T239-A243 VanDerWaalsContact O-N 3.15Å; T239-W283 PolarHBondContact OG1-NE1 3.4Å |
| 240 | I | 92.1 | Very high | 88.9 | Confident | 88 Ų | 88 | 40.7 Ų | 40.7 | 45% | 0.451 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -62 | -46.7 | 176.3 | -63.7 | 166.7 | 0 | 0 | 0 | 110.3 | V236 L237 L238 I242 A243 L244 | V236-I240 HydrophobicContact CG1-CD1 4.24Å; V236-I240 WeakPolarHBondContact O-CG1 3.12Å; V236-I240 PolarHBondContact O-N 3.16Å; V236-I240 VanDerWaalsContact O-N 3.08Å; L237-I240 PolarHBondContact O-N 3.06Å; L238-I240 VanDerWaalsContact C-N 3.34Å; L238-I240 PolarHBondContact O-N 2.97Å; I240-I242 PolarHBondContact O-N 2.89Å; I240-A243 PolarHBondContact O-N 3.19Å; I240-L244 HydrophobicContact CG2-CD1 3.95Å; I240-L244 HydrophobicContact CG2-CG 4.34Å; I240-L244 WeakPolarHBondContact O-CG 3.41Å; I240-L244 PolarHBondContact O-N 3.42Å |
| 241 | F | 88.9 | Confident | 89 | Confident | 29 Ų | 29 | 42.7 Ų | 42.7 | 13% | 0.127 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -67.9 | -34.9 | -179 | -79.1 | -58.6 | 0 | 0 | 0 | 113.6 | V134 A137 V138 L237 L238 L244 L245 | V134-F241 HydrophobicContact CG1-CD2 4.14Å; V134-F241 HydrophobicContact CG1-CE2 3.78Å; A137-F241 HydrophobicContact CB-CB 3.66Å; A137-F241 HydrophobicContact CB-CD1 4.01Å; A137-F241 HydrophobicContact CB-CD2 4.16Å; A137-F241 HydrophobicContact CB-CG 3.67Å; V138-F241 HydrophobicContact CB-CZ 4.49Å; V138-F241 HydrophobicContact CG2-CE1 3.76Å; V138-F241 HydrophobicContact CG2-CE2 3.84Å; V138-F241 HydrophobicContact CG2-CZ 3.25Å; L237-F241 HydrophobicContact CB-CD2 4.36Å; L237-F241 HydrophobicContact CB-CE2 4.33Å; L237-F241 WeakPolarHBondContact O-CB 3.08Å; L237-F241 WeakPolarHBondContact O-CD2 3.4Å; L237-F241 PolarHBondContact O-N 3.34Å; L238-F241 PolarHBondContact O-N 2.86Å; F241-L244 HydrophobicContact CD1-CD1 4.09Å; F241-L244 HydrophobicContact CE1-CD1 4.29Å; F241-L244 PolarHBondContact O-N 2.83Å; F241-L245 VanDerWaalsContact O-CB 3.28Å; F241-L245 WeakPolarHBondContact O-CB 3.39Å; F241-L245 VanDerWaalsContact O-CG 3.22Å; F241-L245 WeakPolarHBondContact O-CG 3.48Å; F241-L245 PolarHBondContact O-N 2.91Å |
| 242 | I | 88.5 | Confident | 88.7 | Confident | 19 Ų | 19 | 43.1 Ų | 43.1 | 10% | 0.097 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -58.3 | -50.6 | 171.1 | -74.2 | 167.5 | 0 | 0 | 0 | 109.3 | L238 T239 I240 L244 L245 I246 L276 V279 W283 | L238-I242 WeakPolarHBondContact O-CB 3.39Å; L238-I242 WeakPolarHBondContact O-CG1 3.34Å; L238-I242 PolarHBondContact O-N 2.81Å; T239-I242 PolarHBondContact O-N 3.31Å; I240-I242 PolarHBondContact O-N 2.89Å; I242-L244 VanDerWaalsContact C-N 3.35Å; I242-L244 PolarHBondContact O-N 3.09Å; I242-L245 PolarHBondContact O-N 2.94Å; I242-I246 HydrophobicContact CG2-CD1 3.68Å; I242-I246 HydrophobicContact CG2-CG1 4.44Å; I242-I246 WeakPolarHBondContact O-CB 3.48Å; I242-I246 VanDerWaalsContact O-CG1 3.25Å; I242-I246 WeakPolarHBondContact O-CG1 3.21Å; I242-I246 PolarHBondContact O-N 2.82Å; I242-L276 HydrophobicContact CG2-CD1 4.06Å; I242-V279 HydrophobicContact CD1-CG1 3.92Å; I242-V279 HydrophobicContact CG1-CB 4.42Å; I242-V279 HydrophobicContact CG1-CG1 3.47Å; I242-V279 VanDerWaalsContact CG1-CG1 3.47Å; I242-W283 HydrophobicContact CD1-CB 3.69Å; I242-W283 HydrophobicContact CD1-CD2 4.33Å; I242-W283 HydrophobicContact CD1-CG 3.8Å |
| 243 | A | 91.5 | Very high | 88.5 | Confident | 60 Ų | 60 | 47.9 Ų | 47.9 | 50% | 0.496 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -60 | -44 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112 | T239 I240 I246 H247 | T239-A243 PolarHBondContact O-N 2.97Å; T239-A243 VanDerWaalsContact O-N 3.15Å; I240-A243 PolarHBondContact O-N 3.19Å; A243-I246 PolarHBondContact O-N 3.3Å; A243-H247 WeakPolarHBondContact O-CB 3.41Å; A243-H247 PolarHBondContact O-N 3.44Å |
| 244 | L | 89.5 | Confident | 88.2 | Confident | 65 Ų | 65 | 51.7 Ų | 51.7 | 34% | 0.34 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -63.8 | -43.9 | 176.9 | -70.2 | 175.1 | 0 | 0 | 0 | 112.6 | Y141 I240 F241 I242 H247 I248 | Y141-L244 HydrophobicContact CD2-CB 4.47Å; I240-L244 HydrophobicContact CG2-CD1 3.95Å; I240-L244 HydrophobicContact CG2-CG 4.34Å; I240-L244 WeakPolarHBondContact O-CG 3.41Å; I240-L244 PolarHBondContact O-N 3.42Å; F241-L244 HydrophobicContact CD1-CD1 4.09Å; F241-L244 HydrophobicContact CE1-CD1 4.29Å; F241-L244 PolarHBondContact O-N 2.83Å; I242-L244 VanDerWaalsContact C-N 3.35Å; I242-L244 PolarHBondContact O-N 3.09Å; L244-H247 PolarHBondContact O-N 3.44Å; L244-I248 VanDerWaalsContact O-CG1 3.26Å; L244-I248 WeakPolarHBondContact O-CG1 3.26Å; L244-I248 PolarHBondContact O-N 3.18Å |
| 245 | L | 86.7 | Confident | 87.8 | Confident | 6 Ų | 6 | 58.5 Ų | 58.5 | 3% | 0.031 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -66 | -41.7 | 178.6 | -74.7 | 171.9 | 0 | 0 | 0 | 111.3 | A137 R140 F241 I242 I248 L249 | A137-L245 HydrophobicContact CB-CD1 4.24Å; R140-L245 HydrophobicContact CB-CD2 4.3Å; R140-L245 HydrophobicContact CG-CD2 3.84Å; F241-L245 VanDerWaalsContact O-CB 3.28Å; F241-L245 WeakPolarHBondContact O-CB 3.39Å; F241-L245 VanDerWaalsContact O-CG 3.22Å; F241-L245 WeakPolarHBondContact O-CG 3.48Å; F241-L245 PolarHBondContact O-N 2.91Å; I242-L245 PolarHBondContact O-N 2.94Å; L245-I248 PolarHBondContact O-N 2.89Å; L245-L249 WeakPolarHBondContact O-CB 3.14Å; L245-L249 WeakPolarHBondContact O-CG 3.38Å; L245-L249 PolarHBondContact O-N 3.31Å |
| 246 | I | 88.7 | Confident | 87.2 | Confident | 67 Ų | 67 | 60.3 Ų | 60.3 | 34% | 0.344 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -60.1 | -48.4 | 173.1 | -71 | 169.8 | 0 | 0 | 0 | 110.1 | I242 A243 I248 L249 I250 L276 | I242-I246 HydrophobicContact CG2-CD1 3.68Å; I242-I246 HydrophobicContact CG2-CG1 4.44Å; I242-I246 WeakPolarHBondContact O-CB 3.48Å; I242-I246 VanDerWaalsContact O-CG1 3.25Å; I242-I246 WeakPolarHBondContact O-CG1 3.21Å; I242-I246 PolarHBondContact O-N 2.82Å; A243-I246 PolarHBondContact O-N 3.3Å; I246-I248 VanDerWaalsContact C-N 3.3Å; I246-I248 PolarHBondContact O-N 3.18Å; I246-L249 WeakPolarHBondContact O-CB 3.29Å; I246-L249 PolarHBondContact O-N 3.09Å; I246-I250 HydrophobicContact CG2-CD1 3.61Å; I246-I250 HydrophobicContact CG2-CG1 4.27Å; I246-I250 VanDerWaalsContact O-CG1 3.28Å; I246-I250 WeakPolarHBondContact O-CG1 3.24Å; I246-I250 PolarHBondContact O-N 3.09Å; I246-L276 HydrophobicContact CD1-CD1 4.16Å; I246-L276 HydrophobicContact CD1-CD2 4.45Å; I246-L276 HydrophobicContact CG1-CD1 3.7Å; I246-L276 HydrophobicContact CG1-CD2 3.74Å; I246-L276 HydrophobicContact CG1-CG 4.4Å |
| 247 | H | 89.8 | Confident | 86.6 | Confident | 101 Ų | 101 | 62.4 Ų | 62.4 | 47% | 0.468 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -58.7 | -43.5 | 178.6 | -175.6 | -70.7 | 0 | 0 | 0 | 111.7 | R145 A243 L244 I250 E251 | R145-H247 PolarHBondContact NH2-ND1 3.14Å; A243-H247 WeakPolarHBondContact O-CB 3.41Å; A243-H247 PolarHBondContact O-N 3.44Å; L244-H247 PolarHBondContact O-N 3.44Å; H247-I250 PolarHBondContact O-N 3.28Å; H247-E251 IonicContact CE1-OE2 2.65Å; H247-E251 IonicContact ND1-OE2 3.4Å; H247-E251 WeakPolarHBondContact O-CB 3.38Å; H247-E251 PolarHBondContact O-N 3.32Å |
| 248 | I | 84.4 | Confident | 86.1 | Confident | 5 Ų | 5 | 70.3 Ų | 70.3 | 3% | 0.026 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -64 | -45 | 176.9 | -69.9 | 166.6 | 0 | 0 | 0 | 111.3 | Y141 L144 R145 L244 L245 I246 I250 E251 M252 | Y141-I248 HydrophobicContact CD2-CD1 3.35Å; Y141-I248 HydrophobicContact CE2-CD1 3.7Å; Y141-I248 HydrophobicContact CG-CD1 4.3Å; L144-I248 HydrophobicContact CB-CG2 4.05Å; L144-I248 HydrophobicContact CD1-CG2 3.68Å; L144-I248 HydrophobicContact CG-CG2 4.46Å; R145-I248 HydrophobicContact CG-CD1 3.87Å; R145-I248 HydrophobicContact CG-CG1 4.37Å; L244-I248 VanDerWaalsContact O-CG1 3.26Å; L244-I248 WeakPolarHBondContact O-CG1 3.26Å; L244-I248 PolarHBondContact O-N 3.18Å; L245-I248 PolarHBondContact O-N 2.89Å; I246-I248 VanDerWaalsContact C-N 3.3Å; I246-I248 PolarHBondContact O-N 3.18Å; I248-I250 PolarHBondContact O-N 2.86Å; I248-E251 PolarHBondContact O-N 2.96Å; I248-M252 HydrophobicContact CG2-CE 3.97Å; I248-M252 HydrophobicContact CG2-CG 4.31Å; I248-M252 HydrophobicContact CG2-SD 4.17Å; I248-M252 VanDerWaalsContact O-CG 3.32Å; I248-M252 WeakPolarHBondContact O-CG 3.5Å; I248-M252 PolarHBondContact O-N 3.06Å |
| 249 | L | 84.9 | Confident | 85.5 | Confident | 29 Ų | 29 | 75.9 Ų | 75.9 | 15% | 0.152 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -57.4 | -48.5 | 176.6 | -86.6 | 170.3 | 0 | 0 | 0 | 111.8 | L245 I246 E251 M252 K253 L276 | L245-L249 WeakPolarHBondContact O-CB 3.14Å; L245-L249 WeakPolarHBondContact O-CG 3.38Å; L245-L249 PolarHBondContact O-N 3.31Å; I246-L249 WeakPolarHBondContact O-CB 3.29Å; I246-L249 PolarHBondContact O-N 3.09Å; L249-E251 VanDerWaalsContact C-N 3.33Å; L249-E251 PolarHBondContact O-N 3.41Å; L249-M252 HydrophobicContact CD2-CE 3.87Å; L249-M252 HydrophobicContact CG-CE 4.43Å; L249-M252 PolarHBondContact O-N 3.43Å; L249-K253 WeakPolarHBondContact O-CB 3.47Å; L249-K253 PolarHBondContact O-N 3.31Å; L249-L276 HydrophobicContact CD1-CB 4.32Å; L249-L276 HydrophobicContact CD1-CD2 3.91Å |
| 250 | I | 87.1 | Confident | 84.7 | Confident | 77 Ų | 77 | 77 Ų | 77 | 40% | 0.395 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -64.1 | -40.2 | 178.4 | -63.1 | 169.3 | 0 | 0 | 0 | 110.5 | I246 H247 I248 K253 R254 | I246-I250 HydrophobicContact CG2-CD1 3.61Å; I246-I250 HydrophobicContact CG2-CG1 4.27Å; I246-I250 VanDerWaalsContact O-CG1 3.28Å; I246-I250 WeakPolarHBondContact O-CG1 3.24Å; I246-I250 PolarHBondContact O-N 3.09Å; H247-I250 PolarHBondContact O-N 3.28Å; I248-I250 PolarHBondContact O-N 2.86Å; I250-K253 PolarHBondContact O-N 2.9Å; I250-R254 VanDerWaalsContact CG2-NH2 3.29Å; I250-R254 WeakPolarHBondContact O-CB 3.43Å; I250-R254 WeakPolarHBondContact O-CG 3.45Å; I250-R254 PolarHBondContact O-N 2.77Å |
| 251 | E | 87 | Confident | 83.4 | Confident | 42 Ų | 42 | 80.1 Ų | 80.1 | 20% | 0.196 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -65.2 | -42.7 | 177.3 | -169.9 | 180 | 155.2 | 0 | 0 | 112.5 | R145 H247 I248 L249 R254 R255 | R145-E251 IonicContact CZ-OE2 3.45Å; R145-E251 VanDerWaalsContact NH1-CD 3.26Å; R145-E251 IonicContact NH1-OE1 2.74Å; R145-E251 PolarHBondContact NH1-OE1 3.13Å; R145-E251 VanDerWaalsContact NH1-OE1 3.14Å; R145-E251 IonicContact NH1-OE2 3.24Å; R145-E251 PolarHBondContact NH1-OE2 2.98Å; R145-E251 IonicContact NH2-OE2 3.44Å; R145-E251 PolarHBondContact NH2-OE2 3.08Å; H247-E251 IonicContact CE1-OE2 2.65Å; H247-E251 IonicContact ND1-OE2 3.4Å; H247-E251 WeakPolarHBondContact O-CB 3.38Å; H247-E251 PolarHBondContact O-N 3.32Å; I248-E251 PolarHBondContact O-N 2.96Å; L249-E251 VanDerWaalsContact C-N 3.33Å; L249-E251 PolarHBondContact O-N 3.41Å; E251-R254 PolarHBondContact O-N 3.05Å; E251-R255 WeakPolarHBondContact O-CG 3.11Å; E251-R255 PolarHBondContact O-N 2.91Å; E251-R255 IonicContact OE1-CZ 3.82Å; E251-R255 IonicContact OE1-NE 2.68Å; E251-R255 PolarHBondContact OE1-NE 3.22Å; E251-R255 IonicContact OE1-NH2 3.35Å; E251-R255 PolarHBondContact OE1-NH2 3.25Å |
| 252 | M | 80.3 | Confident | 82.2 | Confident | 34 Ų | 34 | 83.3 Ų | 83.3 | 17% | 0.167 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -62.1 | -44.7 | 175.7 | -71.1 | -172.1 | -56.1 | 0 | 0 | 111.4 | L144 I248 L249 R254 R255 Q256 | L144-M252 HydrophobicContact CD1-CE 4.23Å; L144-M252 HydrophobicContact CD2-CE 4.35Å; L144-M252 HydrophobicContact CD2-SD 3.89Å; I248-M252 HydrophobicContact CG2-CE 3.97Å; I248-M252 HydrophobicContact CG2-CG 4.31Å; I248-M252 HydrophobicContact CG2-SD 4.17Å; I248-M252 VanDerWaalsContact O-CG 3.32Å; I248-M252 WeakPolarHBondContact O-CG 3.5Å; I248-M252 PolarHBondContact O-N 3.06Å; L249-M252 HydrophobicContact CD2-CE 3.87Å; L249-M252 HydrophobicContact CG-CE 4.43Å; L249-M252 PolarHBondContact O-N 3.43Å; M252-R254 VanDerWaalsContact C-N 3.34Å; M252-R254 PolarHBondContact O-N 2.85Å; M252-R255 PolarHBondContact O-N 3.36Å; M252-Q256 PolarHBondContact O-N 2.96Å |
| 253 | K | 82.7 | Confident | 80.9 | Confident | 133 Ų | 133 | 87.8 Ų | 87.8 | 58% | 0.578 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -60 | -43.3 | 175.3 | -173.2 | 176.1 | -178.5 | 178.5 | 0 | 111.7 | L249 I250 R255 Q256 V257 | L249-K253 WeakPolarHBondContact O-CB 3.47Å; L249-K253 PolarHBondContact O-N 3.31Å; I250-K253 PolarHBondContact O-N 2.9Å; K253-R255 PolarHBondContact O-N 2.93Å; K253-Q256 WeakPolarHBondContact O-CB 3.18Å; K253-Q256 PolarHBondContact O-N 3.2Å; K253-V257 WeakPolarHBondContact O-CG2 3.33Å; K253-V257 PolarHBondContact O-N 3.29Å; K253-V257 VanDerWaalsContact O-N 3.16Å |
| 254 | R | 85.9 | Confident | 79.4 | Confident | 141 Ų | 141 | 91.6 Ų | 91.6 | 53% | 0.532 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62.1 | -40.2 | 175.5 | -78.2 | -169.8 | -92.8 | -143.1 | 0.2 | 112.4 | I250 E251 M252 R258 | I250-R254 VanDerWaalsContact CG2-NH2 3.29Å; I250-R254 WeakPolarHBondContact O-CB 3.43Å; I250-R254 WeakPolarHBondContact O-CG 3.45Å; I250-R254 PolarHBondContact O-N 2.77Å; E251-R254 PolarHBondContact O-N 3.05Å; M252-R254 VanDerWaalsContact C-N 3.34Å; M252-R254 PolarHBondContact O-N 2.85Å; R254-R258 WeakPolarHBondContact O-CG 3.33Å; R254-R258 PolarHBondContact O-N 3.38Å |
| 255 | R | 82.7 | Confident | 78.1 | Confident | 144 Ų | 144 | 90.6 Ų | 90.6 | 54% | 0.543 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -67.4 | -36.3 | 175.4 | -69.6 | 174.9 | -176.3 | -147.4 | 1.7 | 112 | E251 M252 K253 R258 L259 | E251-R255 WeakPolarHBondContact O-CG 3.11Å; E251-R255 PolarHBondContact O-N 2.91Å; E251-R255 IonicContact OE1-CZ 3.82Å; E251-R255 IonicContact OE1-NE 2.68Å; E251-R255 PolarHBondContact OE1-NE 3.22Å; E251-R255 IonicContact OE1-NH2 3.35Å; E251-R255 PolarHBondContact OE1-NH2 3.25Å; M252-R255 PolarHBondContact O-N 3.36Å; K253-R255 PolarHBondContact O-N 2.93Å; R255-R258 PolarHBondContact O-N 3.01Å; R255-L259 WeakPolarHBondContact O-CB 3.29Å; R255-L259 PolarHBondContact O-N 2.84Å; R255-L259 VanDerWaalsContact O-N 3.09Å |
| 256 | Q | 76.4 | Confident | 77.1 | Confident | 42 Ų | 42 | 91.6 Ų | 91.6 | 20% | 0.196 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -61.1 | -47.6 | 177.3 | -171.6 | -165 | 14.6 | 0 | 0 | 111.6 | M252 K253 R258 L259 A260 V265 E269 | M252-Q256 PolarHBondContact O-N 2.96Å; K253-Q256 WeakPolarHBondContact O-CB 3.18Å; K253-Q256 PolarHBondContact O-N 3.2Å; Q256-R258 PolarHBondContact O-N 3.28Å; Q256-L259 PolarHBondContact O-N 3.33Å; Q256-L259 VanDerWaalsContact O-N 3.15Å; Q256-A260 PolarHBondContact O-N 3.36Å; Q256-A260 VanDerWaalsContact O-N 3.15Å; Q256-V265 HydrophobicContact CB-CG1 4.35Å; Q256-V265 HydrophobicContact CG-CG1 4.33Å; Q256-E269 PolarHBondContact OE1-OE1 3.39Å; Q256-E269 VanDerWaalsContact OE1-OE1 3.11Å |
| 257 | V | 78.6 | Confident | 76 | Confident | 120 Ų | 120 | 92.4 Ų | 92.4 | 73% | 0.727 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -58.3 | -33.6 | 177.8 | 174.6 | 0 | 0 | 0 | 0 | 111.5 | K253 | K253-V257 WeakPolarHBondContact O-CG2 3.33Å; K253-V257 PolarHBondContact O-N 3.29Å; K253-V257 VanDerWaalsContact O-N 3.16Å |
| 258 | R | 81.4 | Confident | 75 | Confident | 211 Ų | 211 | 89 Ų | 89 | 80% | 0.796 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -77.8 | -30.7 | 178.6 | -66.3 | 177.3 | -175.8 | -170.2 | -0.2 | 114.1 | R254 R255 Q256 | R254-R258 WeakPolarHBondContact O-CG 3.33Å; R254-R258 PolarHBondContact O-N 3.38Å; R255-R258 PolarHBondContact O-N 3.01Å; Q256-R258 PolarHBondContact O-N 3.28Å |
| 259 | L | 78.7 | Confident | 74.4 | Confident | 116 Ų | 116 | 91 Ų | 91 | 61% | 0.607 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -102.3 | -5.2 | -169.7 | -74.5 | 164.1 | 0 | 0 | 0 | 114.4 | R255 Q256 K261 | R255-L259 WeakPolarHBondContact O-CB 3.29Å; R255-L259 PolarHBondContact O-N 2.84Å; R255-L259 VanDerWaalsContact O-N 3.09Å; Q256-L259 PolarHBondContact O-N 3.33Å; Q256-L259 VanDerWaalsContact O-N 3.15Å; L259-K261 PolarHBondContact O-N 3.45Å |
| 260 | A | 73.8 | Confident | 74 | Confident | 88 Ų | 88 | 95.9 Ų | 95.9 | 73% | 0.727 | 48% | 0.481 | S | S | * | . | trans | 48.6 | 16.7 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | Q256 | Q256-A260 PolarHBondContact O-N 3.36Å; Q256-A260 VanDerWaalsContact O-N 3.15Å | ||
| 261 | K | 63.6 | Low | 73.5 | Confident | 153 Ų | 153 | 94.5 Ų | 94.5 | 67% | 0.665 | 48% | 0.476 | S | S | * | . | trans | -90 | 105.7 | 178.6 | -80 | -175.1 | 178.9 | -178.4 | 0 | 109.5 | L259 | L259-K261 PolarHBondContact O-N 3.45Š| ||
| 262 | T | 63 | Low | 73.2 | Confident | 96 Ų | 96 | 92.6 Ų | 92.6 | 59% | 0.589 | 47% | 0.467 | S | S | * | . | trans | -90.2 | -29 | -169.6 | -42.4 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 263 | T | 62 | Low | 73.4 | Confident | 113 Ų | 113 | 93 Ų | 93 | 69% | 0.693 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -83.4 | -54.3 | -159 | 50 | 0 | 0 | 0 | 0 | 115.3 | ||
| 264 | N | 60.2 | Low | 73.5 | Confident | 141 Ų | 141 | 87.2 Ų | 87.2 | 75% | 0.754 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -79.7 | -24.6 | -174.6 | -71.6 | -14.3 | 0 | 0 | 0 | 113.8 | ||
| 265 | V | 61.6 | Low | 73.3 | Confident | 44 Ų | 44 | 80.7 Ų | 80.7 | 27% | 0.267 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -75.7 | -37.6 | -177.8 | -177.8 | 0 | 0 | 0 | 0 | 111.2 | Q256 T267 S268 E269 | Q256-V265 HydrophobicContact CB-CG1 4.35Å; Q256-V265 HydrophobicContact CG-CG1 4.33Å; V265-T267 VanDerWaalsContact C-N 3.26Å; V265-T267 PolarHBondContact O-N 2.9Å; V265-S268 WeakPolarHBondContact O-CA 3.49Å; V265-S268 WeakPolarHBondContact O-CB 3.24Å; V265-S268 PolarHBondContact O-N 3.1Å; V265-E269 HydrophobicContact CG1-CG 4.12Å; V265-E269 WeakPolarHBondContact O-CG 3.41Å; V265-E269 PolarHBondContact O-N 3.47Å |
| 266 | A | 65.4 | Low | 73.6 | Confident | 27 Ų | 27 | 75.7 Ų | 75.7 | 22% | 0.223 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -57.3 | -36.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113 | R270 | A266-R270 WeakPolarHBondContact O-CG 3.29Å; A266-R270 PolarHBondContact O-N 2.96Å; A266-R270 VanDerWaalsContact O-N 3.1Å |
| 267 | T | 65.8 | Low | 74.1 | Confident | 83 Ų | 83 | 76.4 Ų | 76.4 | 51% | 0.509 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -67.5 | -40 | 175.5 | -52.5 | 0 | 0 | 0 | 0 | 111.9 | V265 T271 | V265-T267 VanDerWaalsContact C-N 3.26Å; V265-T267 PolarHBondContact O-N 2.9Å; T267-T271 PolarHBondContact O-N 3.29Å; T267-T271 PolarHBondContact O-OG1 3.16Å |
| 268 | S | 69.5 | Low | 74.4 | Confident | 31 Ų | 31 | 71.1 Ų | 71.1 | 22% | 0.217 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -67.1 | -40.8 | 176.6 | -170.1 | 0 | 0 | 0 | 0 | 111.8 | R140 V265 T271 S272 | R140-S268 PolarHBondContact NH2-O 3.02Å; R140-S268 PolarHBondContact NH2-OG 3.44Å; V265-S268 WeakPolarHBondContact O-CA 3.49Å; V265-S268 WeakPolarHBondContact O-CB 3.24Å; V265-S268 PolarHBondContact O-N 3.1Å; S268-T271 PolarHBondContact O-N 3.04Å; S268-S272 PolarHBondContact O-N 3Å; S268-S272 PolarHBondContact O-OG 3.14Å |
| 269 | E | 71.9 | Confident | 74.6 | Confident | 45 Ų | 45 | 61.1 Ų | 61.1 | 21% | 0.21 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -60.8 | -49.6 | 176.6 | -72.4 | -173.8 | 152.5 | 0 | 0 | 111.8 | Q256 V265 T271 S272 A273 | Q256-E269 PolarHBondContact OE1-OE1 3.39Å; Q256-E269 VanDerWaalsContact OE1-OE1 3.11Å; V265-E269 HydrophobicContact CG1-CG 4.12Å; V265-E269 WeakPolarHBondContact O-CG 3.41Å; V265-E269 PolarHBondContact O-N 3.47Å; E269-T271 VanDerWaalsContact C-N 3.31Å; E269-T271 PolarHBondContact O-N 2.91Å; E269-S272 PolarHBondContact O-N 3Å; E269-A273 WeakPolarHBondContact O-CB 3.46Å; E269-A273 PolarHBondContact O-N 2.94Å |
| 270 | R | 76.3 | Confident | 75.1 | Confident | 132 Ų | 132 | 60 Ų | 60 | 50% | 0.498 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -58.9 | -42.9 | 177.9 | -72 | 175.4 | -178.3 | 174.5 | 0.5 | 112.1 | A266 A273 L274 | A266-R270 WeakPolarHBondContact O-CG 3.29Å; A266-R270 PolarHBondContact O-N 2.96Å; A266-R270 VanDerWaalsContact O-N 3.1Å; R270-A273 PolarHBondContact O-N 3.39Å; R270-L274 WeakPolarHBondContact O-CB 3.16Å; R270-L274 PolarHBondContact O-N 2.88Å |
| 271 | T | 77.8 | Confident | 75.7 | Confident | 49 Ų | 49 | 56.6 Ų | 56.6 | 30% | 0.301 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -65.3 | -42.8 | 178.9 | -53.1 | 0 | 0 | 0 | 0 | 111.3 | T267 S268 E269 L275 | T267-T271 PolarHBondContact O-N 3.29Å; T267-T271 PolarHBondContact O-OG1 3.16Å; S268-T271 PolarHBondContact O-N 3.04Å; E269-T271 VanDerWaalsContact C-N 3.31Å; E269-T271 PolarHBondContact O-N 2.91Å; T271-L275 HydrophobicContact CG2-CD1 4.41Å; T271-L275 VanDerWaalsContact O-CG 3.31Å; T271-L275 WeakPolarHBondContact O-CG 3.27Å; T271-L275 PolarHBondContact O-N 2.8Å |
| 272 | S | 80.5 | Confident | 76.8 | Confident | 2 Ų | 2 | 49.6 Ų | 49.6 | 1% | 0.014 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -68.4 | -36.5 | 176.4 | -73.8 | 0 | 0 | 0 | 0 | 112.8 | R140 S268 E269 L275 L276 | R140-S272 PolarHBondContact NE-OG 3.14Å; R140-S272 VanDerWaalsContact NE-OG 3.16Å; R140-S272 PolarHBondContact NH2-OG 2.85Å; S268-S272 PolarHBondContact O-N 3Å; S268-S272 PolarHBondContact O-OG 3.14Å; E269-S272 PolarHBondContact O-N 3Å; S272-L275 PolarHBondContact O-N 3.14Å; S272-L276 WeakPolarHBondContact O-CB 3.34Å; S272-L276 PolarHBondContact O-N 2.8Å |
| 273 | A | 83.3 | Confident | 78 | Confident | 42 Ų | 42 | 48 Ų | 48 | 35% | 0.347 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -66.1 | -41.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | E269 R270 L276 L277 | E269-A273 WeakPolarHBondContact O-CB 3.46Å; E269-A273 PolarHBondContact O-N 2.94Å; R270-A273 PolarHBondContact O-N 3.39Å; A273-L276 PolarHBondContact O-N 3.29Å; A273-L277 PolarHBondContact O-N 3.02Å |
| 274 | L | 85 | Confident | 79.4 | Confident | 11 Ų | 11 | 47.2 Ų | 47.2 | 6% | 0.058 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -59 | -47.3 | 172.1 | 168 | 62.7 | 0 | 0 | 0 | 111.7 | R270 L276 L277 I278 A327 Y328 M331 | R270-L274 WeakPolarHBondContact O-CB 3.16Å; R270-L274 PolarHBondContact O-N 2.88Å; L274-L276 VanDerWaalsContact C-N 3.35Å; L274-L277 WeakPolarHBondContact O-CB 3.26Å; L274-L277 PolarHBondContact O-N 3.04Å; L274-I278 HydrophobicContact CD1-CD1 3.76Å; L274-I278 HydrophobicContact CD1-CG1 4.21Å; L274-I278 HydrophobicContact CG-CD1 4.04Å; L274-I278 WeakPolarHBondContact O-CG1 3.44Å; L274-I278 PolarHBondContact O-N 3.3Å; L274-A327 HydrophobicContact CD1-CB 3.81Å; L274-Y328 HydrophobicContact CD1-CD1 3.93Å; L274-Y328 HydrophobicContact CD1-CE1 4.18Å; L274-Y328 HydrophobicContact CD2-CD1 3.6Å; L274-Y328 HydrophobicContact CD2-CE1 3.88Å; L274-Y328 HydrophobicContact CG-CD1 4.24Å; L274-Y328 HydrophobicContact CG-CE1 4.3Å; L274-M331 HydrophobicContact CB-CB 3.98Å; L274-M331 HydrophobicContact CB-SD 4.15Å; L274-M331 HydrophobicContact CD1-CB 4.15Å; L274-M331 HydrophobicContact CD1-SD 4.39Å; L274-M331 HydrophobicContact CG-CB 4.49Å |
| 275 | L | 82.7 | Confident | 80.8 | Confident | 4 Ų | 4 | 40.9 Ų | 40.9 | 2% | 0.021 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -63.1 | -42 | 176.9 | -70.8 | 171.7 | 0 | 0 | 0 | 111.5 | V70 L74 L136 R140 T271 S272 L277 I278 V279 | V70-L275 HydrophobicContact CG1-CD1 4.41Å; V70-L275 HydrophobicContact CG1-CD2 4.28Å; L74-L275 HydrophobicContact CD1-CD2 4.22Å; L136-L275 HydrophobicContact CD1-CD2 4.05Å; L136-L275 HydrophobicContact CD2-CD2 3.64Å; L136-L275 HydrophobicContact CG-CD2 4.03Å; R140-L275 HydrophobicContact CB-CD1 4.15Å; R140-L275 VanDerWaalsContact CD-CD1 3.49Å; R140-L275 HydrophobicContact CG-CD1 3.62Å; T271-L275 HydrophobicContact CG2-CD1 4.41Å; T271-L275 VanDerWaalsContact O-CG 3.31Å; T271-L275 WeakPolarHBondContact O-CG 3.27Å; T271-L275 PolarHBondContact O-N 2.8Å; S272-L275 PolarHBondContact O-N 3.14Å; L275-L277 VanDerWaalsContact C-N 3.31Å; L275-L277 PolarHBondContact O-N 2.86Å; L275-I278 PolarHBondContact O-N 3.31Å; L275-V279 WeakPolarHBondContact O-CB 3.46Å; L275-V279 WeakPolarHBondContact O-CG2 3.39Å; L275-V279 PolarHBondContact O-N 3.15Å |
| 276 | L | 87.8 | Confident | 82 | Confident | 39 Ų | 39 | 38.9 Ų | 38.9 | 20% | 0.204 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -60.2 | -42.2 | 175.7 | -178 | 65.2 | 0 | 0 | 0 | 111.4 | I242 I246 L249 S272 A273 L274 F280 | I242-L276 HydrophobicContact CG2-CD1 4.06Å; I246-L276 HydrophobicContact CD1-CD1 4.16Å; I246-L276 HydrophobicContact CD1-CD2 4.45Å; I246-L276 HydrophobicContact CG1-CD1 3.7Å; I246-L276 HydrophobicContact CG1-CD2 3.74Å; I246-L276 HydrophobicContact CG1-CG 4.4Å; L249-L276 HydrophobicContact CD1-CB 4.32Å; L249-L276 HydrophobicContact CD1-CD2 3.91Å; S272-L276 WeakPolarHBondContact O-CB 3.34Å; S272-L276 PolarHBondContact O-N 2.8Å; A273-L276 PolarHBondContact O-N 3.29Å; L274-L276 VanDerWaalsContact C-N 3.35Å; L276-F280 WeakPolarHBondContact O-CB 3.3Å; L276-F280 PolarHBondContact O-N 3.4Å |
| 277 | L | 88.2 | Confident | 83.2 | Confident | 57 Ų | 57 | 39.9 Ų | 39.9 | 30% | 0.298 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -60.4 | -50.2 | 175.2 | 175.2 | 65 | 0 | 0 | 0 | 111.1 | A273 L274 L275 V279 F280 V281 A327 M331 | A273-L277 PolarHBondContact O-N 3.02Å; L274-L277 WeakPolarHBondContact O-CB 3.26Å; L274-L277 PolarHBondContact O-N 3.04Å; L275-L277 VanDerWaalsContact C-N 3.31Å; L275-L277 PolarHBondContact O-N 2.86Å; L277-V279 PolarHBondContact O-N 2.89Å; L277-F280 PolarHBondContact O-N 2.95Å; L277-V281 HydrophobicContact CD1-CG2 4.06Å; L277-V281 WeakPolarHBondContact O-CB 3.47Å; L277-V281 VanDerWaalsContact O-CG2 3.25Å; L277-V281 WeakPolarHBondContact O-CG2 3.41Å; L277-V281 PolarHBondContact O-N 2.96Å; L277-A327 HydrophobicContact CD2-CB 3.73Å; L277-M331 HydrophobicContact CB-CE 4.38Å; L277-M331 HydrophobicContact CB-SD 4.28Å; L277-M331 HydrophobicContact CD2-CE 3.51Å; L277-M331 HydrophobicContact CD2-SD 3.76Å; L277-M331 HydrophobicContact CG-CE 4.47Å |
| 278 | I | 84.3 | Confident | 84.3 | Confident | 9 Ų | 9 | 38.3 Ų | 38.3 | 5% | 0.046 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -60.5 | -48 | -179.3 | -67.6 | 166.2 | 0 | 0 | 0 | 110.5 | L74 L274 L275 F280 V281 F282 A327 Y328 | L74-I278 HydrophobicContact CD2-CD1 4.41Å; L274-I278 HydrophobicContact CD1-CD1 3.76Å; L274-I278 HydrophobicContact CD1-CG1 4.21Å; L274-I278 HydrophobicContact CG-CD1 4.04Å; L274-I278 WeakPolarHBondContact O-CG1 3.44Å; L274-I278 PolarHBondContact O-N 3.3Å; L275-I278 PolarHBondContact O-N 3.31Å; I278-F280 PolarHBondContact O-N 3.39Å; I278-V281 PolarHBondContact O-N 2.88Å; I278-F282 PolarHBondContact O-N 2.65Å; I278-A327 HydrophobicContact CG1-CB 4.48Å; I278-Y328 HydrophobicContact CD1-CE1 3.64Å; I278-Y328 WeakPolarHBondContact CD1-OH 3.49Å |
| 279 | V | 85.9 | Confident | 85.1 | Confident | 1 Ų | 1 | 37.2 Ų | 37.2 | 1% | 0.006 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -65 | -39.6 | -179.9 | 176.3 | 0 | 0 | 0 | 0 | 111.3 | T133 L238 I242 L275 L277 F282 W283 | T133-V279 HydrophobicContact CG2-CG2 3.9Å; L238-V279 HydrophobicContact CD2-CG1 4.05Å; I242-V279 HydrophobicContact CD1-CG1 3.92Å; I242-V279 HydrophobicContact CG1-CB 4.42Å; I242-V279 HydrophobicContact CG1-CG1 3.47Å; I242-V279 VanDerWaalsContact CG1-CG1 3.47Å; L275-V279 WeakPolarHBondContact O-CB 3.46Å; L275-V279 WeakPolarHBondContact O-CG2 3.39Å; L275-V279 PolarHBondContact O-N 3.15Å; L277-V279 PolarHBondContact O-N 2.89Å; V279-F282 PolarHBondContact O-N 3.18Å; V279-W283 WeakPolarHBondContact O-CB 3.28Å; V279-W283 PolarHBondContact O-N 3.45Å |
| 280 | F | 88.1 | Confident | 85.8 | Confident | 92 Ų | 92 | 35.2 Ų | 35.2 | 40% | 0.404 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -65.8 | -41.6 | 177.4 | 177.3 | -101.5 | 0 | 0 | 0 | 112.3 | L276 L277 I278 F282 W283 L284 | L276-F280 WeakPolarHBondContact O-CB 3.3Å; L276-F280 PolarHBondContact O-N 3.4Å; L277-F280 PolarHBondContact O-N 2.95Å; I278-F280 PolarHBondContact O-N 3.39Å; F280-F282 VanDerWaalsContact C-N 3.34Å; F280-W283 HydrophobicContact CD2-CE3 4.01Å; F280-W283 HydrophobicContact CD2-CZ3 4.38Å; F280-W283 AromaticContact CE2-CE3 3.85Å; F280-W283 HydrophobicContact CE2-CE3 3.85Å; F280-W283 AromaticContact CE2-CZ3 3.78Å; F280-W283 HydrophobicContact CE2-CZ3 3.78Å; F280-W283 HydrophobicContact CZ-CZ3 4.49Å; F280-W283 PolarHBondContact O-N 3.4Å; F280-L284 HydrophobicContact CE1-CD2 4.48Å; F280-L284 WeakPolarHBondContact O-CB 3.46Å; F280-L284 PolarHBondContact O-N 3.24Å |
| 281 | V | 87.7 | Confident | 86.3 | Confident | 18 Ų | 18 | 33.5 Ų | 33.5 | 11% | 0.109 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63.9 | -41.9 | 175.4 | 168.5 | 0 | 0 | 0 | 0 | 110.8 | L277 I278 W283 L284 T285 I323 | L277-V281 HydrophobicContact CD1-CG2 4.06Å; L277-V281 WeakPolarHBondContact O-CB 3.47Å; L277-V281 VanDerWaalsContact O-CG2 3.25Å; L277-V281 WeakPolarHBondContact O-CG2 3.41Å; L277-V281 PolarHBondContact O-N 2.96Å; I278-V281 PolarHBondContact O-N 2.88Å; V281-W283 VanDerWaalsContact C-N 3.34Å; V281-W283 PolarHBondContact O-N 3.22Å; V281-L284 PolarHBondContact O-N 2.89Å; V281-T285 WeakPolarHBondContact O-CG2 3.3Å; V281-T285 PolarHBondContact O-N 3.47Å; V281-T285 PolarHBondContact O-OG1 3.01Å; V281-I323 HydrophobicContact CG1-CB 4.1Å; V281-I323 HydrophobicContact CG1-CD1 3.46Å; V281-I323 VanDerWaalsContact CG1-CD1 3.46Å; V281-I323 HydrophobicContact CG1-CG1 4.38Å; V281-I323 HydrophobicContact CG1-CG2 4.06Å; V281-I323 HydrophobicContact CG2-CD1 4.42Å; V281-I323 HydrophobicContact CG2-CG2 4.04Å |
| 282 | F | 85.5 | Confident | 86.8 | Confident | 5 Ų | 5 | 32.7 Ų | 32.7 | 2% | 0.022 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -59.9 | -46.4 | 174.5 | -151.9 | -78.3 | 0 | 0 | 0 | 111.1 | L130 T133 L238 I278 V279 F280 T285 Q286 N320 | L130-F282 VanDerWaalsContact CA-CZ 3.4Å; L130-F282 HydrophobicContact CB-CE1 3.45Å; L130-F282 VanDerWaalsContact CB-CE1 3.45Å; L130-F282 HydrophobicContact CB-CZ 3.56Å; L130-F282 HydrophobicContact CD1-CD1 3.62Å; L130-F282 HydrophobicContact CD1-CE1 3.15Å; L130-F282 HydrophobicContact CD1-CZ 4.15Å; L130-F282 HydrophobicContact CD2-CE1 4.15Å; L130-F282 HydrophobicContact CG-CE1 3.69Å; L130-F282 HydrophobicContact CG-CZ 4.33Å; T133-F282 HydrophobicContact CG2-CB 4.43Å; T133-F282 HydrophobicContact CG2-CG 4.34Å; L238-F282 HydrophobicContact CD1-CB 4.47Å; L238-F282 HydrophobicContact CD1-CD1 3.74Å; L238-F282 HydrophobicContact CD1-CG 4.45Å; I278-F282 PolarHBondContact O-N 2.65Å; V279-F282 PolarHBondContact O-N 3.18Å; F280-F282 VanDerWaalsContact C-N 3.34Å; F282-T285 PolarHBondContact O-N 2.74Å; F282-T285 PolarHBondContact O-OG1 2.81Å; F282-Q286 HydrophobicContact CD1-CB 4.33Å; F282-Q286 HydrophobicContact CD1-CG 3.65Å; F282-Q286 HydrophobicContact CE1-CB 4.36Å; F282-Q286 HydrophobicContact CE1-CG 3.48Å; F282-Q286 VanDerWaalsContact CE1-CG 3.48Å; F282-Q286 HydrophobicContact CG-CG 4.47Å; F282-Q286 HydrophobicContact CZ-CG 4.2Å; F282-Q286 VanDerWaalsContact O-CB 3.24Å; F282-Q286 WeakPolarHBondContact O-CB 3.39Å; F282-Q286 WeakPolarHBondContact O-CG 3.48Å; F282-Q286 PolarHBondContact O-N 3.28Å; F282-N320 WeakPolarHBondContact CA-OD1 3.28Å; F282-N320 VanDerWaalsContact CD2-ND2 3.3Å; F282-N320 WeakPolarHBondContact CD2-ND2 3.35Å; F282-N320 WeakPolarHBondContact CE2-ND2 3.07Å |
| 283 | W | 88.8 | Confident | 87 | Confident | 64 Ų | 64 | 33.5 Ų | 33.5 | 24% | 0.242 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.3 | -46.2 | 176.3 | 176.7 | 83.9 | 0 | 0 | 0 | 112.2 | T239 I242 V279 F280 V281 T285 Q286 L287 | T239-W283 PolarHBondContact OG1-NE1 3.4Å; I242-W283 HydrophobicContact CD1-CB 3.69Å; I242-W283 HydrophobicContact CD1-CD2 4.33Å; I242-W283 HydrophobicContact CD1-CG 3.8Å; V279-W283 WeakPolarHBondContact O-CB 3.28Å; V279-W283 PolarHBondContact O-N 3.45Å; F280-W283 HydrophobicContact CD2-CE3 4.01Å; F280-W283 HydrophobicContact CD2-CZ3 4.38Å; F280-W283 AromaticContact CE2-CE3 3.85Å; F280-W283 HydrophobicContact CE2-CE3 3.85Å; F280-W283 AromaticContact CE2-CZ3 3.78Å; F280-W283 HydrophobicContact CE2-CZ3 3.78Å; F280-W283 HydrophobicContact CZ-CZ3 4.49Å; F280-W283 PolarHBondContact O-N 3.4Å; V281-W283 VanDerWaalsContact C-N 3.34Å; V281-W283 PolarHBondContact O-N 3.22Å; W283-T285 VanDerWaalsContact C-N 3.3Å; W283-T285 PolarHBondContact O-N 2.81Å; W283-Q286 PolarHBondContact O-N 3.32Å; W283-L287 HydrophobicContact CH2-CD2 4.24Å; W283-L287 HydrophobicContact CZ2-CD2 3.55Å; W283-L287 WeakPolarHBondContact O-CB 3.15Å; W283-L287 PolarHBondContact O-N 2.97Å |
| 284 | L | 90.2 | Very high | 87.1 | Confident | 96 Ų | 96 | 34.3 Ų | 34.3 | 50% | 0.503 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -62.2 | -36.7 | -178.8 | -177.8 | 65.5 | 0 | 0 | 0 | 112.7 | F280 V281 P288 | F280-L284 HydrophobicContact CE1-CD2 4.48Å; F280-L284 WeakPolarHBondContact O-CB 3.46Å; F280-L284 PolarHBondContact O-N 3.24Å; V281-L284 PolarHBondContact O-N 2.89Å; L284-P288 WeakPolarHBondContact O-CD 3.34Å; L284-P288 WeakPolarHBondContact O-CG 3.09Å |
| 285 | T | 89.7 | Confident | 87.3 | Confident | 7 Ų | 7 | 35.1 Ų | 35.1 | 4% | 0.043 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -85.1 | -34.1 | -177.6 | 53.2 | 0 | 0 | 0 | 0 | 112.7 | V281 F282 W283 N320 | V281-T285 WeakPolarHBondContact O-CG2 3.3Å; V281-T285 PolarHBondContact O-N 3.47Å; V281-T285 PolarHBondContact O-OG1 3.01Å; F282-T285 PolarHBondContact O-N 2.74Å; F282-T285 PolarHBondContact O-OG1 2.81Å; W283-T285 VanDerWaalsContact C-N 3.3Å; W283-T285 PolarHBondContact O-N 2.81Å; T285-N320 HydrophobicContact CG2-CB 4.06Å; T285-N320 WeakPolarHBondContact OG1-CB 3.01Å; T285-N320 PolarHBondContact OG1-OD1 2.95Å |
| 286 | Q | 88.6 | Confident | 87.4 | Confident | 3 Ų | 3 | 35.4 Ų | 35.4 | 1% | 0.014 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -93.7 | -28.7 | -174.4 | -61.6 | -71.8 | -33.3 | 0 | 0 | 113.8 | F282 W283 Q289 G290 | F282-Q286 HydrophobicContact CD1-CB 4.33Å; F282-Q286 HydrophobicContact CD1-CG 3.65Å; F282-Q286 HydrophobicContact CE1-CB 4.36Å; F282-Q286 HydrophobicContact CE1-CG 3.48Å; F282-Q286 VanDerWaalsContact CE1-CG 3.48Å; F282-Q286 HydrophobicContact CG-CG 4.47Å; F282-Q286 HydrophobicContact CZ-CG 4.2Å; F282-Q286 VanDerWaalsContact O-CB 3.24Å; F282-Q286 WeakPolarHBondContact O-CB 3.39Å; F282-Q286 WeakPolarHBondContact O-CG 3.48Å; F282-Q286 PolarHBondContact O-N 3.28Å; W283-Q286 PolarHBondContact O-N 3.32Å; Q286-Q289 PolarHBondContact O-N 3.05Å; Q286-G290 PolarHBondContact O-N 3.35Å |
| 287 | L | 88.7 | Confident | 87.1 | Confident | 48 Ų | 48 | 35.4 Ų | 35.4 | 25% | 0.251 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -60.2 | -47.3 | 178.8 | -179 | 75 | 0 | 0 | 0 | 111.9 | C235 W283 Q289 G290 I291 | C235-L287 HydrophobicContact CB-CD1 4.08Å; W283-L287 HydrophobicContact CH2-CD2 4.24Å; W283-L287 HydrophobicContact CZ2-CD2 3.55Å; W283-L287 WeakPolarHBondContact O-CB 3.15Å; W283-L287 PolarHBondContact O-N 2.97Å; L287-Q289 VanDerWaalsContact C-N 3.32Å; L287-Q289 PolarHBondContact O-N 3.4Å; L287-G290 PolarHBondContact O-N 2.85Å; L287-I291 HydrophobicContact CD1-CD1 4.22Å; L287-I291 HydrophobicContact CD1-CG1 4.39Å; L287-I291 HydrophobicContact CD2-CD1 4.35Å; L287-I291 HydrophobicContact CG-CD1 3.86Å; L287-I291 HydrophobicContact CG-CG1 4.41Å; L287-I291 WeakPolarHBondContact O-CG1 3.26Å; L287-I291 PolarHBondContact O-N 2.94Å |
| 288 | P | 88.9 | Confident | 87 | Confident | 49 Ų | 49 | 40.1 Ų | 40.1 | 32% | 0.318 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -59.2 | -42.9 | 177.3 | -25.2 | 36.8 | 0 | 0 | 0 | 112.3 | L284 G290 I291 V292 W313 | L284-P288 WeakPolarHBondContact O-CD 3.34Å; L284-P288 WeakPolarHBondContact O-CG 3.09Å; P288-G290 PolarHBondContact O-N 3.36Å; P288-I291 PolarHBondContact O-N 2.95Å; P288-V292 WeakPolarHBondContact O-CG2 3.23Å; P288-V292 PolarHBondContact O-N 2.86Å; P288-V292 VanDerWaalsContact O-N 3.07Å; P288-W313 HydrophobicContact CB-CH2 4.43Å; P288-W313 HydrophobicContact CB-CZ3 3.99Å |
| 289 | Q | 87.8 | Confident | 87 | Confident | 8 Ų | 8 | 42.5 Ų | 42.5 | 4% | 0.037 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -60 | -45.7 | 175.4 | -68.7 | -179.2 | 15.1 | 0 | 0 | 111.7 | Q286 L287 V292 I293 W313 | Q286-Q289 PolarHBondContact O-N 3.05Å; L287-Q289 VanDerWaalsContact C-N 3.32Å; L287-Q289 PolarHBondContact O-N 3.4Å; Q289-V292 PolarHBondContact O-N 2.85Å; Q289-I293 WeakPolarHBondContact O-CB 3.49Å; Q289-I293 WeakPolarHBondContact O-CD1 3.31Å; Q289-I293 VanDerWaalsContact O-CG1 3.23Å; Q289-I293 WeakPolarHBondContact O-CG1 3.36Å; Q289-I293 PolarHBondContact O-N 3.48Å; Q289-W313 HydrophobicContact CB-CE3 4.36Å; Q289-W313 HydrophobicContact CG-CD2 4.16Å; Q289-W313 HydrophobicContact CG-CE3 3.37Å; Q289-W313 HydrophobicContact CG-CZ3 3.88Å; Q289-W313 PolarHBondContact NE2-O 3.1Å |
| 290 | G | 86.2 | Confident | 87 | Confident | 3 Ų | 3 | 46.9 Ų | 46.9 | 3% | 0.031 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -63.9 | -39.8 | 180 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q286 L287 P288 I294 | Q286-G290 PolarHBondContact O-N 3.35Å; L287-G290 PolarHBondContact O-N 2.85Å; P288-G290 PolarHBondContact O-N 3.36Å; G290-I294 WeakPolarHBondContact O-CG1 3.45Å; G290-I294 PolarHBondContact O-N 3.35Å |
| 291 | I | 87.6 | Confident | 87 | Confident | 96 Ų | 96 | 42.9 Ų | 42.9 | 49% | 0.492 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -64.5 | -47.5 | 176.4 | -67.2 | 167.7 | 0 | 0 | 0 | 110.5 | L287 P288 I293 I294 A295 | L287-I291 HydrophobicContact CD1-CD1 4.22Å; L287-I291 HydrophobicContact CD1-CG1 4.39Å; L287-I291 HydrophobicContact CD2-CD1 4.35Å; L287-I291 HydrophobicContact CG-CD1 3.86Å; L287-I291 HydrophobicContact CG-CG1 4.41Å; L287-I291 WeakPolarHBondContact O-CG1 3.26Å; L287-I291 PolarHBondContact O-N 2.94Å; P288-I291 PolarHBondContact O-N 2.95Å; I291-I293 VanDerWaalsContact C-N 3.34Å; I291-I293 PolarHBondContact O-N 3.35Å; I291-I294 PolarHBondContact O-N 3.44Å; I291-A295 PolarHBondContact O-N 3.49Å |
| 292 | V | 88.2 | Confident | 87.1 | Confident | 32 Ų | 32 | 44.4 Ų | 44.4 | 19% | 0.194 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.8 | -38.3 | -178.5 | 177.3 | 0 | 0 | 0 | 0 | 111.1 | P288 Q289 I294 A295 N296 I302 Y306 W313 | P288-V292 WeakPolarHBondContact O-CG2 3.23Å; P288-V292 PolarHBondContact O-N 2.86Å; P288-V292 VanDerWaalsContact O-N 3.07Å; Q289-V292 PolarHBondContact O-N 2.85Å; V292-I294 VanDerWaalsContact C-N 3.31Å; V292-I294 PolarHBondContact O-N 3.48Å; V292-A295 PolarHBondContact O-N 2.68Å; V292-A295 VanDerWaalsContact O-N 3.1Å; V292-N296 PolarHBondContact O-N 3.34Å; V292-N296 PolarHBondContact O-ND2 2.94Å; V292-N296 PolarHBondContact O-OD1 3.18Å; V292-I302 HydrophobicContact CG1-CG2 4.16Å; V292-Y306 HydrophobicContact CB-CD2 4.37Å; V292-Y306 HydrophobicContact CG1-CD2 3.55Å; V292-Y306 HydrophobicContact CG1-CE2 4.47Å; V292-Y306 HydrophobicContact CG1-CG 4.17Å; V292-W313 HydrophobicContact CB-CH2 4.24Å; V292-W313 HydrophobicContact CB-CZ2 4.05Å; V292-W313 HydrophobicContact CG1-CZ2 4.05Å; V292-W313 HydrophobicContact CG2-CH2 3.67Å; V292-W313 HydrophobicContact CG2-CZ2 3.76Å |
| 293 | I | 84.7 | Confident | 87.1 | Confident | 20 Ų | 20 | 48.1 Ų | 48.1 | 10% | 0.103 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -59.8 | -40.7 | 174.7 | -71.2 | 164.6 | 0 | 0 | 0 | 111.6 | F223 K231 Q289 I291 Y306 | F223-I293 VanDerWaalsContact CZ-O 3.27Å; F223-I293 WeakPolarHBondContact CZ-O 3.46Å; K231-I293 HydrophobicContact CD-CD1 4.37Å; K231-I293 HydrophobicContact CG-CD1 3.89Å; Q289-I293 WeakPolarHBondContact O-CB 3.49Å; Q289-I293 WeakPolarHBondContact O-CD1 3.31Å; Q289-I293 VanDerWaalsContact O-CG1 3.23Å; Q289-I293 WeakPolarHBondContact O-CG1 3.36Å; Q289-I293 PolarHBondContact O-N 3.48Å; I291-I293 VanDerWaalsContact C-N 3.34Å; I291-I293 PolarHBondContact O-N 3.35Å; I293-Y306 HydrophobicContact CG1-CE2 4.08Å |
| 294 | I | 84.5 | Confident | 87.1 | Confident | 59 Ų | 59 | 50.1 Ų | 50.1 | 30% | 0.303 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -65.7 | -44.7 | 173.5 | -63.1 | 161.6 | 0 | 0 | 0 | 110.7 | V232 G290 I291 V292 N296 A297 F298 | V232-I294 HydrophobicContact CB-CD1 4.22Å; V232-I294 HydrophobicContact CG1-CD1 3.94Å; V232-I294 HydrophobicContact CG2-CD1 3.19Å; V232-I294 HydrophobicContact CG2-CG1 3.4Å; V232-I294 VanDerWaalsContact CG2-CG1 3.4Å; G290-I294 WeakPolarHBondContact O-CG1 3.45Å; G290-I294 PolarHBondContact O-N 3.35Å; I291-I294 PolarHBondContact O-N 3.44Å; V292-I294 VanDerWaalsContact C-N 3.31Å; V292-I294 PolarHBondContact O-N 3.48Å; I294-N296 VanDerWaalsContact C-N 3.28Å; I294-N296 PolarHBondContact O-N 3.03Å; I294-A297 WeakPolarHBondContact O-CB 3.35Å; I294-A297 PolarHBondContact O-N 3.35Å; I294-F298 HydrophobicContact CG2-CD2 4.27Å; I294-F298 HydrophobicContact CG2-CE2 3.71Å; I294-F298 VanDerWaalsContact O-CD2 3.25Å; I294-F298 WeakPolarHBondContact O-CD2 3.07Å |
| 295 | A | 88.3 | Confident | 87.1 | Confident | 27 Ų | 27 | 45.9 Ų | 45.9 | 22% | 0.223 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62.4 | -37.3 | -177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | I291 V292 A297 F298 D299 I302 | I291-A295 PolarHBondContact O-N 3.49Å; V292-A295 PolarHBondContact O-N 2.68Å; V292-A295 VanDerWaalsContact O-N 3.1Å; A295-A297 PolarHBondContact O-N 2.97Å; A295-A297 VanDerWaalsContact O-N 3.13Å; A295-F298 PolarHBondContact O-N 3.15Å; A295-D299 PolarHBondContact O-N 3.42Å; A295-I302 HydrophobicContact CB-CD1 3.83Å; A295-I302 HydrophobicContact CB-CG2 3.92Å |
| 296 | N | 86.1 | Confident | 87 | Confident | 11 Ų | 11 | 48.5 Ų | 48.5 | 6% | 0.059 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -57 | -25.9 | 172.6 | -64.5 | -11 | 0 | 0 | 0 | 113.2 | F223 V292 I294 F298 I302 F303 Y306 | F223-N296 HydrophobicContact CZ-CB 4.49Å; V292-N296 PolarHBondContact O-N 3.34Å; V292-N296 PolarHBondContact O-ND2 2.94Å; V292-N296 PolarHBondContact O-OD1 3.18Å; I294-N296 VanDerWaalsContact C-N 3.28Å; I294-N296 PolarHBondContact O-N 3.03Å; N296-F298 PolarHBondContact O-N 3.4Å; N296-I302 WeakPolarHBondContact OD1-CG2 3.47Å; N296-I302 PolarHBondContact OD1-O 3.04Å; N296-I302 VanDerWaalsContact OD1-O 3.13Å; N296-F303 HydrophobicContact CB-CB 4.16Å; N296-F303 HydrophobicContact CB-CD2 4.26Å; N296-F303 PolarHBondContact OD1-N 2.87Å; N296-Y306 VanDerWaalsContact ND2-CB 3.25Å; N296-Y306 WeakPolarHBondContact ND2-CB 3.48Å; N296-Y306 WeakPolarHBondContact ND2-CD1 3.49Å |
| 297 | A | 81.1 | Confident | 87 | Confident | 39 Ų | 39 | 53.4 Ų | 53.4 | 32% | 0.322 | 27% | 0.271 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67 | -27.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | F223 W224 I294 A295 | F223-A297 HydrophobicContact CD1-CB 4.34Å; F223-A297 HydrophobicContact CE1-CB 3.23Å; F223-A297 HydrophobicContact CZ-CB 3.53Å; W224-A297 HydrophobicContact CH2-CB 4.31Å; W224-A297 HydrophobicContact CZ2-CB 4.38Å; I294-A297 WeakPolarHBondContact O-CB 3.35Å; I294-A297 PolarHBondContact O-N 3.35Å; A295-A297 PolarHBondContact O-N 2.97Å; A295-A297 VanDerWaalsContact O-N 3.13Å |
| 298 | F | 85.7 | Confident | 87 | Confident | 155 Ų | 155 | 54 Ų | 54 | 68% | 0.68 | 27% | 0.273 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -109.8 | -16.8 | -170.4 | -61.5 | -72.5 | 0 | 0 | 0 | 112.8 | W224 I294 A295 N296 | W224-F298 HydrophobicContact CH2-CE1 4.35Å; W224-F298 HydrophobicContact CH2-CE2 4.24Å; W224-F298 AromaticContact CH2-CZ 3.72Å; W224-F298 HydrophobicContact CH2-CZ 3.72Å; W224-F298 HydrophobicContact CZ2-CZ 4.43Å; I294-F298 HydrophobicContact CG2-CD2 4.27Å; I294-F298 HydrophobicContact CG2-CE2 3.71Å; I294-F298 VanDerWaalsContact O-CD2 3.25Å; I294-F298 WeakPolarHBondContact O-CD2 3.07Å; A295-F298 PolarHBondContact O-N 3.15Å; N296-F298 PolarHBondContact O-N 3.4Å |
| 299 | D | 85.4 | Confident | 87.1 | Confident | 59 Ų | 59 | 53.2 Ų | 53.2 | 32% | 0.316 | 27% | 0.267 | S | S | . | . | trans | -144.2 | 119.5 | -171.8 | -170.7 | -26.9 | 0 | 0 | 0 | 112 | A295 V301 I302 F303 | A295-D299 PolarHBondContact O-N 3.42Å; D299-V301 VanDerWaalsContact C-N 3.31Å; D299-V301 PolarHBondContact O-N 3.3Å; D299-V301 WeakPolarHBondContact OD1-CA 3.22Å; D299-V301 WeakPolarHBondContact OD1-CB 3.34Å; D299-V301 WeakPolarHBondContact OD1-CG2 3.46Å; D299-V301 PolarHBondContact OD1-N 3.31Å; D299-I302 HydrophobicContact CB-CB 4.2Å; D299-I302 HydrophobicContact CB-CD1 3.73Å; D299-I302 HydrophobicContact CB-CG1 3.76Å; D299-I302 PolarHBondContact O-N 2.94Å; D299-F303 PolarHBondContact O-N 3.2Å | ||
| 300 | Q | 85.1 | Confident | 87.1 | Confident | 93 Ų | 93 | 54 Ų | 54 | 44% | 0.435 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -66 | -30.5 | 179.2 | -71.1 | -66.9 | -22.7 | 0 | 0 | 113 | I302 F303 R304 | Q300-I302 VanDerWaalsContact C-N 3.35Å; Q300-F303 PolarHBondContact O-N 3.08Å; Q300-R304 WeakPolarHBondContact O-CG 3.47Å; Q300-R304 PolarHBondContact O-N 2.79Å |
| 301 | V | 88.8 | Confident | 87.3 | Confident | 9 Ų | 9 | 56.8 Ų | 56.8 | 6% | 0.055 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -64.5 | -45.3 | 176.5 | -172.7 | 0 | 0 | 0 | 0 | 109.5 | L16 E20 W23 L24 D299 R304 A305 | L16-V301 HydrophobicContact CD2-CB 4Å; L16-V301 HydrophobicContact CD2-CG1 4.36Å; L16-V301 HydrophobicContact CD2-CG2 3.42Å; L16-V301 VanDerWaalsContact CD2-CG2 3.42Å; E20-V301 HydrophobicContact CB-CG1 4.06Å; E20-V301 HydrophobicContact CB-CG2 3.73Å; E20-V301 HydrophobicContact CG-CG1 4.46Å; E20-V301 HydrophobicContact CG-CG2 3.57Å; E20-V301 VanDerWaalsContact OE1-CG2 3.23Å; E20-V301 WeakPolarHBondContact OE1-CG2 3.3Å; E20-V301 WeakPolarHBondContact OE2-CG2 3.04Å; W23-V301 HydrophobicContact CE3-CG1 3.58Å; W23-V301 HydrophobicContact CZ3-CG1 3.53Å; L24-V301 HydrophobicContact CD1-CG1 4.33Å; L24-V301 HydrophobicContact CD2-CG1 4.41Å; L24-V301 HydrophobicContact CG-CG1 4.2Å; D299-V301 VanDerWaalsContact C-N 3.31Å; D299-V301 PolarHBondContact O-N 3.3Å; D299-V301 WeakPolarHBondContact OD1-CA 3.22Å; D299-V301 WeakPolarHBondContact OD1-CB 3.34Å; D299-V301 WeakPolarHBondContact OD1-CG2 3.46Å; D299-V301 PolarHBondContact OD1-N 3.31Å; V301-R304 PolarHBondContact O-N 3.05Å; V301-A305 WeakPolarHBondContact O-CB 3.22Å; V301-A305 PolarHBondContact O-N 3.17Å |
| 302 | I | 88.7 | Confident | 87.4 | Confident | 49 Ų | 49 | 56.4 Ų | 56.4 | 25% | 0.251 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -67.7 | -41.6 | 178.8 | -53.3 | -178.6 | 0 | 0 | 0 | 109.7 | V292 A295 N296 D299 Q300 R304 A305 Y306 | V292-I302 HydrophobicContact CG1-CG2 4.16Å; A295-I302 HydrophobicContact CB-CD1 3.83Å; A295-I302 HydrophobicContact CB-CG2 3.92Å; N296-I302 WeakPolarHBondContact OD1-CG2 3.47Å; N296-I302 PolarHBondContact OD1-O 3.04Å; N296-I302 VanDerWaalsContact OD1-O 3.13Å; D299-I302 HydrophobicContact CB-CB 4.2Å; D299-I302 HydrophobicContact CB-CD1 3.73Å; D299-I302 HydrophobicContact CB-CG1 3.76Å; D299-I302 PolarHBondContact O-N 2.94Å; Q300-I302 VanDerWaalsContact C-N 3.35Å; I302-R304 VanDerWaalsContact C-N 3.33Å; I302-R304 PolarHBondContact O-N 3.29Å; I302-A305 PolarHBondContact O-N 3.23Å; I302-A305 VanDerWaalsContact O-N 3.17Å; I302-Y306 WeakPolarHBondContact O-CB 3.02Å; I302-Y306 PolarHBondContact O-N 3.39Å |
| 303 | F | 86.6 | Confident | 87.6 | Confident | 84 Ų | 84 | 56 Ų | 56 | 37% | 0.368 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -56 | -46 | 173.2 | 177 | -109.6 | 0 | 0 | 0 | 112.2 | N296 D299 Q300 Y306 L307 | N296-F303 HydrophobicContact CB-CB 4.16Å; N296-F303 HydrophobicContact CB-CD2 4.26Å; N296-F303 PolarHBondContact OD1-N 2.87Å; D299-F303 PolarHBondContact O-N 3.2Å; Q300-F303 PolarHBondContact O-N 3.08Å; F303-Y306 WeakPolarHBondContact O-CB 3.25Å; F303-Y306 PolarHBondContact O-N 3.32Å; F303-L307 HydrophobicContact CD1-CD1 4.28Å; F303-L307 HydrophobicContact CE1-CD1 3.68Å; F303-L307 HydrophobicContact CE1-CG 4.47Å; F303-L307 HydrophobicContact CE2-CD1 4.39Å; F303-L307 HydrophobicContact CE2-CG 4.42Å; F303-L307 HydrophobicContact CZ-CD1 3.74Å; F303-L307 HydrophobicContact CZ-CD2 4.46Å; F303-L307 HydrophobicContact CZ-CG 4.24Å; F303-L307 WeakPolarHBondContact O-CG 3.39Å; F303-L307 PolarHBondContact O-N 2.9Å; F303-L307 VanDerWaalsContact O-N 3.1Å |
| 304 | R | 87.3 | Confident | 87.9 | Confident | 106 Ų | 106 | 57.6 Ų | 57.6 | 40% | 0.4 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -64.7 | -41.9 | 175.5 | -71.9 | 176.7 | -174.8 | -147 | 8.4 | 112.3 | L24 Q300 V301 I302 Y306 L307 I308 | L24-R304 HydrophobicContact CD1-CB 4.02Å; Q300-R304 WeakPolarHBondContact O-CG 3.47Å; Q300-R304 PolarHBondContact O-N 2.79Å; V301-R304 PolarHBondContact O-N 3.05Å; I302-R304 VanDerWaalsContact C-N 3.33Å; I302-R304 PolarHBondContact O-N 3.29Å; R304-Y306 VanDerWaalsContact C-N 3.31Å; R304-Y306 PolarHBondContact O-N 3.47Å; R304-L307 PolarHBondContact O-N 2.97Å; R304-I308 WeakPolarHBondContact O-CD1 3.47Å; R304-I308 VanDerWaalsContact O-CG1 3.28Å; R304-I308 WeakPolarHBondContact O-CG1 3.34Å; R304-I308 PolarHBondContact O-N 2.76Å |
| 305 | A | 90.5 | Very high | 88.2 | Confident | 6 Ų | 6 | 55.9 Ų | 55.9 | 5% | 0.05 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61.7 | -40 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | W23 L24 I28 V301 I302 I308 L309 | W23-A305 HydrophobicContact CH2-CB 3.72Å; W23-A305 HydrophobicContact CZ3-CB 3.79Å; L24-A305 HydrophobicContact CD2-CB 3.75Å; I28-A305 HydrophobicContact CG1-CB 4.4Å; I28-A305 HydrophobicContact CG2-CB 4.41Å; V301-A305 WeakPolarHBondContact O-CB 3.22Å; V301-A305 PolarHBondContact O-N 3.17Å; I302-A305 PolarHBondContact O-N 3.23Å; I302-A305 VanDerWaalsContact O-N 3.17Å; A305-I308 PolarHBondContact O-N 3.34Å; A305-L309 WeakPolarHBondContact O-CB 3.4Å; A305-L309 WeakPolarHBondContact O-CG 3.33Å; A305-L309 PolarHBondContact O-N 3.1Å |
| 306 | Y | 88.6 | Confident | 88.4 | Confident | 63 Ų | 63 | 56.1 Ų | 56.1 | 25% | 0.247 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.7 | -45.1 | 176.7 | 174.8 | -99.1 | 0 | 0 | 0 | 111.8 | V292 I293 N296 I302 F303 R304 L309 G310 W313 | V292-Y306 HydrophobicContact CB-CD2 4.37Å; V292-Y306 HydrophobicContact CG1-CD2 3.55Å; V292-Y306 HydrophobicContact CG1-CE2 4.47Å; V292-Y306 HydrophobicContact CG1-CG 4.17Å; I293-Y306 HydrophobicContact CG1-CE2 4.08Å; N296-Y306 VanDerWaalsContact ND2-CB 3.25Å; N296-Y306 WeakPolarHBondContact ND2-CB 3.48Å; N296-Y306 WeakPolarHBondContact ND2-CD1 3.49Å; I302-Y306 WeakPolarHBondContact O-CB 3.02Å; I302-Y306 PolarHBondContact O-N 3.39Å; F303-Y306 WeakPolarHBondContact O-CB 3.25Å; F303-Y306 PolarHBondContact O-N 3.32Å; R304-Y306 VanDerWaalsContact C-N 3.31Å; R304-Y306 PolarHBondContact O-N 3.47Å; Y306-L309 CarbonylContact O-C 3.51Å; Y306-L309 PolarHBondContact O-N 2.93Å; Y306-G310 PolarHBondContact O-N 3.01Å; Y306-W313 AromaticContact CD2-CD1 3.77Å; Y306-W313 AromaticContact CD2-CE2 3.88Å; Y306-W313 HydrophobicContact CD2-CZ2 4.4Å; Y306-W313 AromaticContact CD2-NE1 3.32Å; Y306-W313 VanDerWaalsContact CD2-NE1 3.32Å; Y306-W313 AromaticContact CE2-CD1 3.72Å; Y306-W313 HydrophobicContact CE2-CD2 4.4Å; Y306-W313 HydrophobicContact CE2-CG 4.17Å; Y306-W313 AromaticContact CE2-NE1 3.7Å |
| 307 | L | 87.2 | Confident | 88.6 | Confident | 105 Ų | 105 | 56 Ų | 56 | 55% | 0.55 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -63.1 | -43.8 | 175.3 | -67.5 | 178.2 | 0 | 0 | 0 | 112 | F303 R304 L309 G310 | F303-L307 HydrophobicContact CD1-CD1 4.28Å; F303-L307 HydrophobicContact CE1-CD1 3.68Å; F303-L307 HydrophobicContact CE1-CG 4.47Å; F303-L307 HydrophobicContact CE2-CD1 4.39Å; F303-L307 HydrophobicContact CE2-CG 4.42Å; F303-L307 HydrophobicContact CZ-CD1 3.74Å; F303-L307 HydrophobicContact CZ-CD2 4.46Å; F303-L307 HydrophobicContact CZ-CG 4.24Å; F303-L307 WeakPolarHBondContact O-CG 3.39Å; F303-L307 PolarHBondContact O-N 2.9Å; F303-L307 VanDerWaalsContact O-N 3.1Å; R304-L307 PolarHBondContact O-N 2.97Å; L307-L309 VanDerWaalsContact C-N 3.26Å; L307-L309 PolarHBondContact O-N 3.09Å; L307-G310 PolarHBondContact O-N 3.46Å |
| 308 | I | 89.5 | Confident | 89.2 | Confident | 60 Ų | 60 | 54.4 Ų | 54.4 | 31% | 0.308 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -63.8 | -34.4 | 177.8 | -67 | 163.5 | 0 | 0 | 0 | 111.3 | L24 I28 V29 A32 R304 A305 G310 | L24-I308 HydrophobicContact CD2-CD1 4.21Å; I28-I308 HydrophobicContact CG2-CB 4.17Å; I28-I308 HydrophobicContact CG2-CG2 3.77Å; V29-I308 HydrophobicContact CG2-CD1 4.1Å; V29-I308 HydrophobicContact CG2-CG2 4.3Å; A32-I308 HydrophobicContact CB-CG2 3.48Å; A32-I308 VanDerWaalsContact CB-CG2 3.48Å; A32-I308 WeakPolarHBondContact CB-O 3.2Å; R304-I308 WeakPolarHBondContact O-CD1 3.47Å; R304-I308 VanDerWaalsContact O-CG1 3.28Å; R304-I308 WeakPolarHBondContact O-CG1 3.34Å; R304-I308 PolarHBondContact O-N 2.76Å; A305-I308 PolarHBondContact O-N 3.34Å; I308-G310 VanDerWaalsContact C-N 3.29Å; I308-G310 PolarHBondContact O-N 2.85Å |
| 309 | L | 90.6 | Very high | 89.4 | Confident | 34 Ų | 34 | 50 Ų | 50 | 18% | 0.178 | 25% | 0.247 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.7 | 12.5 | 178.2 | -68 | 172.4 | 0 | 0 | 0 | 113.6 | I28 A305 Y306 L307 D311 F312 W313 | I28-L309 HydrophobicContact CG2-CD1 4.14Å; I28-L309 HydrophobicContact CG2-CD2 4.06Å; I28-L309 HydrophobicContact CG2-CG 3.81Å; A305-L309 WeakPolarHBondContact O-CB 3.4Å; A305-L309 WeakPolarHBondContact O-CG 3.33Å; A305-L309 PolarHBondContact O-N 3.1Å; Y306-L309 CarbonylContact O-C 3.51Å; Y306-L309 PolarHBondContact O-N 2.93Å; L307-L309 VanDerWaalsContact C-N 3.26Å; L307-L309 PolarHBondContact O-N 3.09Å; L309-D311 PolarHBondContact O-N 3.13Å; L309-F312 WeakPolarHBondContact O-CA 3.34Å; L309-F312 WeakPolarHBondContact O-CB 3.49Å; L309-F312 PolarHBondContact O-N 3.46Å; L309-W313 PolarHBondContact O-N 2.85Å; L309-W313 VanDerWaalsContact O-N 3.14Å |
| 310 | G | 88.8 | Confident | 89.7 | Confident | 23 Ų | 23 | 47.5 Ų | 47.5 | 24% | 0.237 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -46.5 | -54 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y306 L307 I308 F312 W313 D314 | Y306-G310 PolarHBondContact O-N 3.01Å; L307-G310 PolarHBondContact O-N 3.46Å; I308-G310 VanDerWaalsContact C-N 3.29Å; I308-G310 PolarHBondContact O-N 2.85Å; G310-F312 PolarHBondContact O-N 3.16Å; G310-F312 VanDerWaalsContact O-N 3.16Å; G310-W313 WeakPolarHBondContact O-CB 3.49Å; G310-W313 PolarHBondContact O-N 3.03Å; G310-D314 PolarHBondContact O-N 3.35Å |
| 311 | D | 89.6 | Confident | 90 | Very high | 63 Ų | 63 | 43.2 Ų | 43.2 | 34% | 0.337 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -55.3 | -36.3 | 179.1 | -66.7 | 4.3 | 0 | 0 | 0 | 112.7 | Y35 H39 L309 L315 | Y35-D311 HydrophobicContact CD1-CB 3.78Å; Y35-D311 VanDerWaalsContact CE1-C 3.5Å; Y35-D311 HydrophobicContact CE1-CB 3.66Å; Y35-D311 VanDerWaalsContact CE1-O 3.3Å; Y35-D311 WeakPolarHBondContact CE1-O 3.23Å; H39-D311 HydrophobicContact CB-CB 4.45Å; H39-D311 IonicContact CD2-OD1 3.66Å; H39-D311 IonicContact CD2-OD2 3.83Å; H39-D311 PolarHBondContact CD2-OD2 3.07Å; H39-D311 PolarHBondContact CE1-O 2.88Å; H39-D311 IonicContact CG-OD2 3.13Å; H39-D311 IonicContact NE2-OD1 3.36Å; L309-D311 PolarHBondContact O-N 3.13Å; D311-L315 PolarHBondContact O-N 3.21Å |
| 312 | F | 91 | Very high | 90.2 | Very high | 87 Ų | 87 | 44 Ų | 44 | 38% | 0.382 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -70.4 | -40.1 | 178.2 | 176.7 | -94.8 | 0 | 0 | 0 | 111.6 | L309 G310 D314 L315 L316 | L309-F312 WeakPolarHBondContact O-CA 3.34Å; L309-F312 WeakPolarHBondContact O-CB 3.49Å; L309-F312 PolarHBondContact O-N 3.46Å; G310-F312 PolarHBondContact O-N 3.16Å; G310-F312 VanDerWaalsContact O-N 3.16Å; F312-D314 VanDerWaalsContact C-N 3.32Å; F312-L315 WeakPolarHBondContact O-CB 3.12Å; F312-L315 PolarHBondContact O-N 3.13Å; F312-L316 HydrophobicContact CD1-CD1 4.2Å; F312-L316 HydrophobicContact CE1-CD1 3.58Å; F312-L316 HydrophobicContact CE1-CG 4.16Å; F312-L316 HydrophobicContact CZ-CD1 4.08Å; F312-L316 HydrophobicContact CZ-CG 4.34Å; F312-L316 PolarHBondContact O-N 3.46Å; F312-L316 VanDerWaalsContact O-N 3.15Å |
| 313 | W | 90.9 | Very high | 90.2 | Very high | 24 Ų | 24 | 44.3 Ų | 44.3 | 9% | 0.091 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.8 | -39.3 | 175.4 | -60.1 | 120.8 | 0 | 0 | 0 | 111.8 | P288 Q289 V292 Y306 L309 G310 L316 S317 | P288-W313 HydrophobicContact CB-CH2 4.43Å; P288-W313 HydrophobicContact CB-CZ3 3.99Å; Q289-W313 HydrophobicContact CB-CE3 4.36Å; Q289-W313 HydrophobicContact CG-CD2 4.16Å; Q289-W313 HydrophobicContact CG-CE3 3.37Å; Q289-W313 HydrophobicContact CG-CZ3 3.88Å; Q289-W313 PolarHBondContact NE2-O 3.1Å; V292-W313 HydrophobicContact CB-CH2 4.24Å; V292-W313 HydrophobicContact CB-CZ2 4.05Å; V292-W313 HydrophobicContact CG1-CZ2 4.05Å; V292-W313 HydrophobicContact CG2-CH2 3.67Å; V292-W313 HydrophobicContact CG2-CZ2 3.76Å; Y306-W313 AromaticContact CD2-CD1 3.77Å; Y306-W313 AromaticContact CD2-CE2 3.88Å; Y306-W313 HydrophobicContact CD2-CZ2 4.4Å; Y306-W313 AromaticContact CD2-NE1 3.32Å; Y306-W313 VanDerWaalsContact CD2-NE1 3.32Å; Y306-W313 AromaticContact CE2-CD1 3.72Å; Y306-W313 HydrophobicContact CE2-CD2 4.4Å; Y306-W313 HydrophobicContact CE2-CG 4.17Å; Y306-W313 AromaticContact CE2-NE1 3.7Å; L309-W313 PolarHBondContact O-N 2.85Å; L309-W313 VanDerWaalsContact O-N 3.14Å; G310-W313 WeakPolarHBondContact O-CB 3.49Å; G310-W313 PolarHBondContact O-N 3.03Å; W313-L316 HydrophobicContact CE3-CD1 3.87Å; W313-L316 HydrophobicContact CZ3-CD1 3.98Å; W313-L316 PolarHBondContact O-N 3.37Å; W313-S317 PolarHBondContact O-N 3.06Å; W313-S317 VanDerWaalsContact O-N 3.11Å |
| 314 | D | 90.8 | Very high | 90.2 | Very high | 54 Ų | 54 | 40.8 Ų | 40.8 | 29% | 0.289 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -61.8 | -43.7 | 173.8 | -73.3 | -14.8 | 0 | 0 | 0 | 111.5 | Y88 G310 F312 L316 S317 L318 | Y88-D314 HydrophobicContact CE2-CB 3.95Å; Y88-D314 WeakPolarHBondContact CE2-OD2 3.44Å; Y88-D314 WeakPolarHBondContact OH-CB 3.27Å; Y88-D314 PolarHBondContact OH-OD2 2.79Å; G310-D314 PolarHBondContact O-N 3.35Å; F312-D314 VanDerWaalsContact C-N 3.32Å; D314-L316 VanDerWaalsContact C-N 3.31Å; D314-L316 PolarHBondContact O-N 3.07Å; D314-S317 WeakPolarHBondContact O-CA 3.25Å; D314-S317 WeakPolarHBondContact O-CB 3.39Å; D314-S317 PolarHBondContact O-N 2.96Å; D314-L318 WeakPolarHBondContact O-CG 3.17Å; D314-L318 PolarHBondContact O-N 3.14Å |
| 315 | L | 91.4 | Very high | 90.4 | Very high | 23 Ų | 23 | 37.7 Ų | 37.7 | 12% | 0.12 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -55.2 | -47 | 175.3 | -177.2 | 59.7 | 0 | 0 | 0 | 112 | Y35 L42 I46 D311 F312 S317 L318 I319 | Y35-L315 HydrophobicContact CE1-CB 4.41Å; Y35-L315 HydrophobicContact CE2-CD2 3.81Å; Y35-L315 VanDerWaalsContact OH-CB 3.28Å; Y35-L315 WeakPolarHBondContact OH-CB 3.16Å; Y35-L315 WeakPolarHBondContact OH-CD1 3.47Å; Y35-L315 WeakPolarHBondContact OH-CD2 3.36Å; L42-L315 HydrophobicContact CD2-CD1 4.12Å; I46-L315 HydrophobicContact CD1-CD1 3.76Å; D311-L315 PolarHBondContact O-N 3.21Å; F312-L315 WeakPolarHBondContact O-CB 3.12Å; F312-L315 PolarHBondContact O-N 3.13Å; L315-S317 VanDerWaalsContact C-N 3.26Å; L315-S317 PolarHBondContact O-N 2.99Å; L315-L318 PolarHBondContact O-N 3.37Å; L315-I319 HydrophobicContact CD1-CD1 4Å; L315-I319 HydrophobicContact CD1-CG1 4.16Å; L315-I319 HydrophobicContact CD2-CD1 4.34Å; L315-I319 HydrophobicContact CG-CD1 3.8Å; L315-I319 HydrophobicContact CG-CG1 4.36Å; L315-I319 WeakPolarHBondContact O-CB 3.38Å; L315-I319 VanDerWaalsContact O-CG1 3.28Å; L315-I319 WeakPolarHBondContact O-CG1 3.25Å; L315-I319 PolarHBondContact O-N 3.15Å |
| 316 | L | 91.9 | Very high | 90.5 | Very high | 32 Ų | 32 | 40.4 Ų | 40.4 | 17% | 0.168 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.8 | -38.8 | 178.3 | -71.3 | 178.5 | 0 | 0 | 0 | 111.6 | F312 W313 D314 N320 | F312-L316 HydrophobicContact CD1-CD1 4.2Å; F312-L316 HydrophobicContact CE1-CD1 3.58Å; F312-L316 HydrophobicContact CE1-CG 4.16Å; F312-L316 HydrophobicContact CZ-CD1 4.08Å; F312-L316 HydrophobicContact CZ-CG 4.34Å; F312-L316 PolarHBondContact O-N 3.46Å; F312-L316 VanDerWaalsContact O-N 3.15Å; W313-L316 HydrophobicContact CE3-CD1 3.87Å; W313-L316 HydrophobicContact CZ3-CD1 3.98Å; W313-L316 PolarHBondContact O-N 3.37Å; D314-L316 VanDerWaalsContact C-N 3.31Å; D314-L316 PolarHBondContact O-N 3.07Å; L316-N320 WeakPolarHBondContact O-CB 3.04Å; L316-N320 PolarHBondContact O-N 3.35Å |
| 317 | S | 91.9 | Very high | 90.5 | Very high | 8 Ų | 8 | 37.6 Ų | 37.6 | 6% | 0.056 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -67.4 | -41.3 | 175.9 | -166.9 | 0 | 0 | 0 | 0 | 112.6 | Q126 W313 D314 L315 N320 S321 | Q126-S317 VanDerWaalsContact CD-OG 3.31Å; Q126-S317 PolarHBondContact OE1-OG 3.48Å; W313-S317 PolarHBondContact O-N 3.06Å; W313-S317 VanDerWaalsContact O-N 3.11Å; D314-S317 WeakPolarHBondContact O-CA 3.25Å; D314-S317 WeakPolarHBondContact O-CB 3.39Å; D314-S317 PolarHBondContact O-N 2.96Å; L315-S317 VanDerWaalsContact C-N 3.26Å; L315-S317 PolarHBondContact O-N 2.99Å; S317-N320 PolarHBondContact O-N 3.31Å; S317-S321 WeakPolarHBondContact O-CB 3.39Å; S317-S321 PolarHBondContact O-N 3.29Å; S317-S321 PolarHBondContact O-OG 3.36Å |
| 318 | L | 93 | Very high | 90.6 | Very high | 6 Ų | 6 | 32.8 Ų | 32.8 | 3% | 0.031 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -65.2 | -43.6 | 176.1 | -68.6 | -179.7 | 0 | 0 | 0 | 111.9 | I46 M85 Y88 D314 L315 N320 S321 C322 | I46-L318 HydrophobicContact CG2-CB 3.85Å; M85-L318 HydrophobicContact CE-CB 4.5Å; M85-L318 HydrophobicContact CE-CD2 4.21Å; M85-L318 VanDerWaalsContact CE-O 3.22Å; M85-L318 WeakPolarHBondContact CE-O 3.13Å; M85-L318 HydrophobicContact CG-CD2 4.11Å; Y88-L318 HydrophobicContact CD1-CD1 3.98Å; Y88-L318 HydrophobicContact CD1-CD2 4.06Å; Y88-L318 HydrophobicContact CD1-CG 4.48Å; Y88-L318 HydrophobicContact CE1-CD1 3.71Å; Y88-L318 HydrophobicContact CE1-CG 4.46Å; Y88-L318 HydrophobicContact CG-CD2 4.35Å; D314-L318 WeakPolarHBondContact O-CG 3.17Å; D314-L318 PolarHBondContact O-N 3.14Å; L315-L318 PolarHBondContact O-N 3.37Å; L318-N320 PolarHBondContact O-N 3.25Å; L318-S321 WeakPolarHBondContact O-CB 3.45Å; L318-S321 PolarHBondContact O-N 2.04Å; L318-C322 PolarHBondContact O-N 3.04Å |
| 319 | I | 90.6 | Very high | 90.6 | Very high | 62 Ų | 62 | 31.7 Ų | 31.7 | 32% | 0.318 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -59.7 | -48.1 | 175.9 | -72 | 170.7 | 0 | 0 | 0 | 110.4 | L315 S321 C322 I323 | L315-I319 HydrophobicContact CD1-CD1 4Å; L315-I319 HydrophobicContact CD1-CG1 4.16Å; L315-I319 HydrophobicContact CD2-CD1 4.34Å; L315-I319 HydrophobicContact CG-CD1 3.8Å; L315-I319 HydrophobicContact CG-CG1 4.36Å; L315-I319 WeakPolarHBondContact O-CB 3.38Å; L315-I319 VanDerWaalsContact O-CG1 3.28Å; L315-I319 WeakPolarHBondContact O-CG1 3.25Å; L315-I319 PolarHBondContact O-N 3.15Å; I319-S321 PolarHBondContact O-N 2.88Å; I319-C322 PolarHBondContact O-N 3.35Å; I319-I323 HydrophobicContact CG2-CD1 3.48Å; I319-I323 VanDerWaalsContact CG2-CD1 3.48Å; I319-I323 HydrophobicContact CG2-CG1 4.23Å; I319-I323 WeakPolarHBondContact O-CG1 3.27Å; I319-I323 PolarHBondContact O-N 3.49Å; I319-I323 VanDerWaalsContact O-N 3.15Å |
| 320 | N | 90.6 | Very high | 90.5 | Very high | 6 Ų | 6 | 36 Ų | 36 | 3% | 0.032 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -54.9 | -42.8 | 176 | -177.9 | 52.3 | 0 | 0 | 0 | 111.8 | F282 T285 L316 S317 L318 C322 | F282-N320 WeakPolarHBondContact CA-OD1 3.28Å; F282-N320 VanDerWaalsContact CD2-ND2 3.3Å; F282-N320 WeakPolarHBondContact CD2-ND2 3.35Å; F282-N320 WeakPolarHBondContact CE2-ND2 3.07Å; T285-N320 HydrophobicContact CG2-CB 4.06Å; T285-N320 WeakPolarHBondContact OG1-CB 3.01Å; T285-N320 PolarHBondContact OG1-OD1 2.95Å; L316-N320 WeakPolarHBondContact O-CB 3.04Å; L316-N320 PolarHBondContact O-N 3.35Å; S317-N320 PolarHBondContact O-N 3.31Å; L318-N320 PolarHBondContact O-N 3.25Å; N320-C322 VanDerWaalsContact C-N 3.27Å; N320-C322 PolarHBondContact O-N 2.62Å |
| 321 | S | 92.4 | Very high | 90.2 | Very high | 3 Ų | 3 | 38.1 Ų | 38.1 | 2% | 0.021 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -70.2 | -20.3 | -179.3 | -62.8 | 0 | 0 | 0 | 0 | 113.7 | N54 S317 L318 I319 | N54-S321 PolarHBondContact ND2-O 2.94Å; S317-S321 WeakPolarHBondContact O-CB 3.39Å; S317-S321 PolarHBondContact O-N 3.29Å; S317-S321 PolarHBondContact O-OG 3.36Å; L318-S321 WeakPolarHBondContact O-CB 3.45Å; L318-S321 PolarHBondContact O-N 2.04Å; I319-S321 PolarHBondContact O-N 2.88Å |
| 322 | C | 91.6 | Very high | 90 | Very high | 27 Ų | 27 | 36.2 Ų | 36.2 | 18% | 0.182 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -92 | -32.6 | 179.3 | -87.8 | 0 | 0 | 0 | 0 | 114.5 | I46 G50 M85 L318 I319 N320 S324 P326 | I46-C322 VanDerWaalsContact CG2-SG 3.52Å; G50-C322 WeakPolarHBondContact CA-SG 3.23Å; M85-C322 HydrophobicContact CE-CB 4.37Å; M85-C322 WeakPolarHBondContact CE-SG 3.5Å; L318-C322 PolarHBondContact O-N 3.04Å; I319-C322 PolarHBondContact O-N 3.35Å; N320-C322 VanDerWaalsContact C-N 3.27Å; N320-C322 PolarHBondContact O-N 2.62Å; C322-S324 VanDerWaalsContact C-N 3.28Å; C322-S324 PolarHBondContact O-N 2.87Å; C322-P326 WeakPolarHBondContact O-CD 3.49Å |
| 323 | I | 88.9 | Confident | 89.7 | Confident | 55 Ų | 55 | 37.5 Ų | 37.5 | 28% | 0.282 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -67.4 | -25.5 | -167.7 | -73.3 | 164.7 | 0 | 0 | 0 | 113.5 | V281 I319 F325 P326 A327 | V281-I323 HydrophobicContact CG1-CB 4.1Å; V281-I323 HydrophobicContact CG1-CD1 3.46Å; V281-I323 VanDerWaalsContact CG1-CD1 3.46Å; V281-I323 HydrophobicContact CG1-CG1 4.38Å; V281-I323 HydrophobicContact CG1-CG2 4.06Å; V281-I323 HydrophobicContact CG2-CD1 4.42Å; V281-I323 HydrophobicContact CG2-CG2 4.04Å; I319-I323 HydrophobicContact CG2-CD1 3.48Å; I319-I323 VanDerWaalsContact CG2-CD1 3.48Å; I319-I323 HydrophobicContact CG2-CG1 4.23Å; I319-I323 WeakPolarHBondContact O-CG1 3.27Å; I319-I323 PolarHBondContact O-N 3.49Å; I319-I323 VanDerWaalsContact O-N 3.15Å; I323-F325 VanDerWaalsContact C-N 3.34Å; I323-F325 PolarHBondContact O-N 3.38Å; I323-P326 WeakPolarHBondContact O-CD 3.28Å; I323-A327 WeakPolarHBondContact O-CB 3.45Å; I323-A327 PolarHBondContact O-N 3.02Å |
| 324 | S | 88 | Confident | 89.4 | Confident | 9 Ų | 9 | 41.4 Ų | 41.4 | 6% | 0.063 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -57.3 | -44.7 | -175.7 | -50 | 0 | 0 | 0 | 0 | 112.6 | C322 A327 Y328 | C322-S324 VanDerWaalsContact C-N 3.28Å; C322-S324 PolarHBondContact O-N 2.87Å; S324-A327 WeakPolarHBondContact O-CB 3.49Å; S324-A327 PolarHBondContact O-N 3.3Å; S324-Y328 WeakPolarHBondContact O-CD2 3.26Å; S324-Y328 WeakPolarHBondContact O-CE2 3.31Å; S324-Y328 PolarHBondContact O-N 3.32Å |
| 325 | F | 91.2 | Very high | 89.4 | Confident | 42 Ų | 42 | 38.9 Ų | 38.9 | 18% | 0.184 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.5 | -50.4 | -177.5 | 177 | -95.5 | 0 | 0 | 0 | 113.7 | A53 A56 T57 I323 A327 Y328 C329 F335 F339 | A53-F325 HydrophobicContact CB-CB 3.7Å; A53-F325 HydrophobicContact CB-CD1 3.96Å; A53-F325 HydrophobicContact CB-CD2 4.49Å; A53-F325 HydrophobicContact CB-CG 3.8Å; A53-F325 WeakPolarHBondContact O-CD2 3.33Å; A56-F325 HydrophobicContact CB-CD2 4.3Å; A56-F325 HydrophobicContact CB-CE2 3.76Å; A56-F325 HydrophobicContact CB-CZ 4.46Å; T57-F325 WeakPolarHBondContact OG1-CD2 3.5Å; I323-F325 VanDerWaalsContact C-N 3.34Å; I323-F325 PolarHBondContact O-N 3.38Å; F325-A327 VanDerWaalsContact C-N 3.26Å; F325-A327 PolarHBondContact O-N 3.01Å; F325-Y328 PolarHBondContact O-N 3.31Å; F325-Y328 VanDerWaalsContact O-N 3.17Å; F325-C329 VanDerWaalsContact CZ-SG 3.57Å; F325-C329 PolarHBondContact O-N 3.46Å; F325-C329 PolarHBondContact O-SG 2.99Å; F325-F335 HydrophobicContact CD2-CE1 4.22Å; F325-F335 AromaticContact CD2-CZ 3.97Å; F325-F335 HydrophobicContact CD2-CZ 3.97Å; F325-F335 AromaticContact CE2-CE1 3.98Å; F325-F335 HydrophobicContact CE2-CE1 3.98Å; F325-F335 AromaticContact CE2-CZ 3.99Å; F325-F335 HydrophobicContact CE2-CZ 3.99Å; F325-F339 HydrophobicContact CE2-CD2 4.24Å; F325-F339 AromaticContact CE2-CE2 3.88Å; F325-F339 HydrophobicContact CE2-CE2 3.88Å; F325-F339 HydrophobicContact CZ-CD2 4.49Å; F325-F339 AromaticContact CZ-CE2 3.83Å; F325-F339 HydrophobicContact CZ-CE2 3.83Å; F325-F339 HydrophobicContact CZ-CZ 4.08Å |
| 326 | P | 91 | Very high | 89.4 | Confident | 63 Ų | 63 | 43.6 Ų | 43.6 | 41% | 0.409 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -53.7 | -42.1 | 169.8 | -27.6 | 34.4 | 0 | 0 | 0 | 113 | C322 I323 Y328 C329 I330 | C322-P326 WeakPolarHBondContact O-CD 3.49Å; I323-P326 WeakPolarHBondContact O-CD 3.28Å; P326-Y328 VanDerWaalsContact C-N 3.34Å; P326-Y328 PolarHBondContact O-N 2.89Å; P326-C329 PolarHBondContact O-N 2.78Å; P326-I330 VanDerWaalsContact O-CG1 3.29Å; P326-I330 WeakPolarHBondContact O-CG1 3.38Å; P326-I330 PolarHBondContact O-N 3.32Å |
| 327 | A | 89.2 | Confident | 89.3 | Confident | 3 Ų | 3 | 44.6 Ų | 44.6 | 3% | 0.025 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -59.5 | -44 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L274 L277 I278 I323 S324 F325 I330 M331 | L274-A327 HydrophobicContact CD1-CB 3.81Å; L277-A327 HydrophobicContact CD2-CB 3.73Å; I278-A327 HydrophobicContact CG1-CB 4.48Å; I323-A327 WeakPolarHBondContact O-CB 3.45Å; I323-A327 PolarHBondContact O-N 3.02Å; S324-A327 WeakPolarHBondContact O-CB 3.49Å; S324-A327 PolarHBondContact O-N 3.3Å; F325-A327 VanDerWaalsContact C-N 3.26Å; F325-A327 PolarHBondContact O-N 3.01Å; A327-I330 PolarHBondContact O-N 3.38Å; A327-M331 WeakPolarHBondContact O-CB 3.49Å; A327-M331 PolarHBondContact O-N 3.44Å |
| 328 | Y | 89.5 | Confident | 89.3 | Confident | 4 Ų | 4 | 45.5 Ų | 45.5 | 2% | 0.016 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.9 | -44.7 | 174.6 | -64 | -51.5 | 0 | 0 | 0 | 112.7 | T57 L61 L74 L274 I278 S324 F325 P326 I330 S332 F335 | T57-Y328 HydrophobicContact CG2-CD2 3.86Å; T57-Y328 HydrophobicContact CG2-CE2 3.51Å; L61-Y328 HydrophobicContact CD1-CE2 4.47Å; L74-Y328 HydrophobicContact CD1-CE1 3.97Å; L74-Y328 WeakPolarHBondContact CD1-OH 3.48Å; L74-Y328 WeakPolarHBondContact CD2-OH 3.32Å; L274-Y328 HydrophobicContact CD1-CD1 3.93Å; L274-Y328 HydrophobicContact CD1-CE1 4.18Å; L274-Y328 HydrophobicContact CD2-CD1 3.6Å; L274-Y328 HydrophobicContact CD2-CE1 3.88Å; L274-Y328 HydrophobicContact CG-CD1 4.24Å; L274-Y328 HydrophobicContact CG-CE1 4.3Å; I278-Y328 HydrophobicContact CD1-CE1 3.64Å; I278-Y328 WeakPolarHBondContact CD1-OH 3.49Å; S324-Y328 WeakPolarHBondContact O-CD2 3.26Å; S324-Y328 WeakPolarHBondContact O-CE2 3.31Å; S324-Y328 PolarHBondContact O-N 3.32Å; F325-Y328 PolarHBondContact O-N 3.31Å; F325-Y328 VanDerWaalsContact O-N 3.17Å; P326-Y328 VanDerWaalsContact C-N 3.34Å; P326-Y328 PolarHBondContact O-N 2.89Å; Y328-I330 VanDerWaalsContact C-N 3.29Å; Y328-I330 PolarHBondContact O-N 3.05Å; Y328-S332 WeakPolarHBondContact O-CA 3.4Å; Y328-S332 WeakPolarHBondContact O-CB 3.23Å; Y328-S332 PolarHBondContact O-N 3.17Å; Y328-F335 HydrophobicContact CD2-CE2 4.1Å; Y328-F335 HydrophobicContact CD2-CZ 4.31Å; Y328-F335 HydrophobicContact CG-CD2 4.11Å; Y328-F335 HydrophobicContact CG-CE2 4.11Å; Y328-F335 HydrophobicContact CG-CG 4.4Å; Y328-F335 HydrophobicContact CG-CZ 4.41Å |
| 329 | C | 89 | Confident | 89.3 | Confident | 37 Ų | 37 | 47.4 Ų | 47.4 | 25% | 0.25 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -61.5 | -39.1 | 179.7 | -67.5 | 0 | 0 | 0 | 0 | 111.9 | F325 P326 R336 | F325-C329 VanDerWaalsContact CZ-SG 3.57Å; F325-C329 PolarHBondContact O-N 3.46Å; F325-C329 PolarHBondContact O-SG 2.99Å; P326-C329 PolarHBondContact O-N 2.78Å; C329-R336 WeakPolarHBondContact O-CD 3.2Å; C329-R336 WeakPolarHBondContact O-CG 3.46Å; C329-R336 PolarHBondContact O-NE 3.32Å |
| 330 | I | 88.4 | Confident | 89.3 | Confident | 125 Ų | 125 | 46.7 Ų | 46.7 | 64% | 0.641 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -77.7 | -47.8 | -178.7 | -65.4 | 166.5 | 0 | 0 | 0 | 111 | P326 A327 Y328 | P326-I330 VanDerWaalsContact O-CG1 3.29Å; P326-I330 WeakPolarHBondContact O-CG1 3.38Å; P326-I330 PolarHBondContact O-N 3.32Å; A327-I330 PolarHBondContact O-N 3.38Å; Y328-I330 VanDerWaalsContact C-N 3.29Å; Y328-I330 PolarHBondContact O-N 3.05Å |
| 331 | M | 82.7 | Confident | 89.3 | Confident | 67 Ų | 67 | 49.1 Ų | 49.1 | 33% | 0.33 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -98.8 | -20.6 | -165.6 | -59.7 | -170.5 | 167.4 | 0 | 0 | 114.7 | L274 L277 A327 | L274-M331 HydrophobicContact CB-CB 3.98Å; L274-M331 HydrophobicContact CB-SD 4.15Å; L274-M331 HydrophobicContact CD1-CB 4.15Å; L274-M331 HydrophobicContact CD1-SD 4.39Å; L274-M331 HydrophobicContact CG-CB 4.49Å; L277-M331 HydrophobicContact CB-CE 4.38Å; L277-M331 HydrophobicContact CB-SD 4.28Å; L277-M331 HydrophobicContact CD2-CE 3.51Å; L277-M331 HydrophobicContact CD2-SD 3.76Å; L277-M331 HydrophobicContact CG-CE 4.47Å; A327-M331 WeakPolarHBondContact O-CB 3.49Å; A327-M331 PolarHBondContact O-N 3.44Å |
| 332 | S | 85.6 | Confident | 89.3 | Confident | 23 Ų | 23 | 51.4 Ų | 51.4 | 16% | 0.161 | 27% | 0.265 | C | S | . | . | trans | -108.8 | 108.7 | -175.7 | -177.4 | 0 | 0 | 0 | 0 | 113 | Y328 M334 F335 R336 | Y328-S332 WeakPolarHBondContact O-CA 3.4Å; Y328-S332 WeakPolarHBondContact O-CB 3.23Å; Y328-S332 PolarHBondContact O-N 3.17Å; S332-M334 VanDerWaalsContact C-N 3.35Å; S332-F335 VanDerWaalsContact OG-CB 3.24Å; S332-F335 WeakPolarHBondContact OG-CB 3.4Å; S332-F335 PolarHBondContact OG-N 3.2Å; S332-F335 VanDerWaalsContact OG-N 3.09Å; S332-R336 WeakPolarHBondContact O-CG 3.23Å; S332-R336 PolarHBondContact O-N 3.4Å; S332-R336 VanDerWaalsContact O-N 3.16Å; S332-R336 PolarHBondContact O-NE 3.43Å | ||
| 333 | Q | 84.3 | Confident | 89.3 | Confident | 115 Ų | 115 | 54.8 Ų | 54.8 | 54% | 0.537 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -67.4 | -36.5 | 173.7 | -176.5 | 176.8 | -8.2 | 0 | 0 | 112.2 | R336 T337 | Q333-R336 PolarHBondContact O-N 3.04Å; Q333-T337 PolarHBondContact O-N 2.67Å; Q333-T337 PolarHBondContact O-OG1 3.21Å |
| 334 | M | 86.3 | Confident | 89.1 | Confident | 106 Ų | 106 | 54.3 Ų | 54.3 | 52% | 0.522 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -67.5 | -44.5 | 179.2 | -163.9 | -176.4 | -84 | 0 | 0 | 110.4 | M66 S332 R336 T337 E338 | M66-M334 HydrophobicContact CE-CG 4.32Å; M66-M334 HydrophobicContact CE-SD 4.39Å; M66-M334 HydrophobicContact SD-CB 4.18Å; M66-M334 HydrophobicContact SD-CG 3.38Å; M66-M334 WeakPolarHBondContact SD-CG 3.43Å; M66-M334 HydrophobicContact SD-SD 3.39Å; S332-M334 VanDerWaalsContact C-N 3.35Å; M334-R336 PolarHBondContact O-N 3.39Å; M334-T337 PolarHBondContact O-N 3.07Å; M334-E338 PolarHBondContact O-N 3.49Å |
| 335 | F | 89.7 | Confident | 88.7 | Confident | 1 Ų | 1 | 56.9 Ų | 56.9 | 0% | 0.004 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -57.9 | -49.4 | 174.6 | -176 | -88.5 | 0 | 0 | 0 | 111.6 | T57 V60 L61 M66 F325 Y328 S332 T337 E338 F339 | T57-F335 HydrophobicContact CG2-CE2 4.43Å; V60-F335 HydrophobicContact CB-CD2 4.09Å; V60-F335 HydrophobicContact CB-CE2 3.68Å; V60-F335 HydrophobicContact CB-CZ 4.1Å; V60-F335 HydrophobicContact CG1-CD2 3.42Å; V60-F335 VanDerWaalsContact CG1-CD2 3.42Å; V60-F335 HydrophobicContact CG1-CE2 3.56Å; V60-F335 HydrophobicContact CG1-CG 3.94Å; V60-F335 HydrophobicContact CG1-CZ 4.18Å; V60-F335 HydrophobicContact CG2-CE2 4.38Å; V60-F335 HydrophobicContact CG2-CZ 4.31Å; L61-F335 HydrophobicContact CD2-CD2 3.84Å; L61-F335 HydrophobicContact CD2-CE2 4.17Å; L61-F335 HydrophobicContact CG-CD2 4.36Å; L61-F335 HydrophobicContact CG-CE2 4.19Å; M66-F335 HydrophobicContact CE-CB 4.44Å; F325-F335 HydrophobicContact CD2-CE1 4.22Å; F325-F335 AromaticContact CD2-CZ 3.97Å; F325-F335 HydrophobicContact CD2-CZ 3.97Å; F325-F335 AromaticContact CE2-CE1 3.98Å; F325-F335 HydrophobicContact CE2-CE1 3.98Å; F325-F335 AromaticContact CE2-CZ 3.99Å; F325-F335 HydrophobicContact CE2-CZ 3.99Å; Y328-F335 HydrophobicContact CD2-CE2 4.1Å; Y328-F335 HydrophobicContact CD2-CZ 4.31Å; Y328-F335 HydrophobicContact CG-CD2 4.11Å; Y328-F335 HydrophobicContact CG-CE2 4.11Å; Y328-F335 HydrophobicContact CG-CG 4.4Å; Y328-F335 HydrophobicContact CG-CZ 4.41Å; S332-F335 VanDerWaalsContact OG-CB 3.24Å; S332-F335 WeakPolarHBondContact OG-CB 3.4Å; S332-F335 PolarHBondContact OG-N 3.2Å; S332-F335 VanDerWaalsContact OG-N 3.09Å; F335-T337 VanDerWaalsContact C-N 3.33Å; F335-T337 PolarHBondContact O-N 3.48Å; F335-E338 PolarHBondContact O-N 3.38Å; F335-F339 HydrophobicContact CE1-CB 4.43Å; F335-F339 HydrophobicContact CE1-CD2 4.43Å; F335-F339 VanDerWaalsContact O-CB 3.23Å; F335-F339 WeakPolarHBondContact O-CB 3.47Å; F335-F339 PolarHBondContact O-N 3.17Å |
| 336 | R | 91.4 | Very high | 87.5 | Confident | 121 Ų | 121 | 60.3 Ų | 60.3 | 46% | 0.457 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -57.7 | -44.3 | 176.8 | -76.5 | -175.9 | -75.7 | 178.7 | -0.2 | 112.6 | C329 S332 Q333 M334 F339 M340 | C329-R336 WeakPolarHBondContact O-CD 3.2Å; C329-R336 WeakPolarHBondContact O-CG 3.46Å; C329-R336 PolarHBondContact O-NE 3.32Å; S332-R336 WeakPolarHBondContact O-CG 3.23Å; S332-R336 PolarHBondContact O-N 3.4Å; S332-R336 VanDerWaalsContact O-N 3.16Å; S332-R336 PolarHBondContact O-NE 3.43Å; Q333-R336 PolarHBondContact O-N 3.04Å; M334-R336 PolarHBondContact O-N 3.39Å; R336-F339 PolarHBondContact O-N 2.91Å; R336-M340 VanDerWaalsContact O-CG 3.23Å; R336-M340 WeakPolarHBondContact O-CG 3.28Å; R336-M340 PolarHBondContact O-N 3.12Å |
| 337 | T | 90.3 | Very high | 85.9 | Confident | 54 Ų | 54 | 67.4 Ų | 67.4 | 33% | 0.331 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61.5 | -47.8 | -179.7 | -56.4 | 0 | 0 | 0 | 0 | 110.9 | Q333 M334 F335 M340 I341 | Q333-T337 PolarHBondContact O-N 2.67Å; Q333-T337 PolarHBondContact O-OG1 3.21Å; M334-T337 PolarHBondContact O-N 3.07Å; F335-T337 VanDerWaalsContact C-N 3.33Å; F335-T337 PolarHBondContact O-N 3.48Å; T337-M340 PolarHBondContact O-N 3.39Å; T337-I341 HydrophobicContact CG2-CD1 4.3Å; T337-I341 WeakPolarHBondContact O-CG1 3.45Å; T337-I341 PolarHBondContact O-N 3.44Å |
| 338 | E | 91.6 | Very high | 84.2 | Confident | 26 Ų | 26 | 72.2 Ų | 72.2 | 12% | 0.121 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -68.5 | -37.6 | 178 | -70.3 | -60.4 | 130.1 | 0 | 0 | 112.4 | V60 M66 M334 F335 M340 I341 V342 | V60-E338 HydrophobicContact CG1-CB 3.81Å; M66-E338 HydrophobicContact CG-CB 4.37Å; M66-E338 HydrophobicContact CG-CG 3.81Å; M66-E338 HydrophobicContact SD-CG 4.07Å; M334-E338 PolarHBondContact O-N 3.49Å; F335-E338 PolarHBondContact O-N 3.38Å; E338-M340 VanDerWaalsContact C-N 3.32Å; E338-M340 PolarHBondContact O-N 2.79Å; E338-I341 WeakPolarHBondContact O-CA 3.28Å; E338-I341 WeakPolarHBondContact O-CB 3.47Å; E338-I341 PolarHBondContact O-N 3.31Å; E338-I341 WeakPolarHBondContact OE1-CD1 3.3Å; E338-V342 WeakPolarHBondContact O-CG2 3.45Å; E338-V342 PolarHBondContact O-N 2.85Å |
| 339 | F | 92.5 | Very high | 82.5 | Confident | 47 Ų | 47 | 76.9 Ų | 76.9 | 21% | 0.206 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -55.7 | -46.5 | 172.6 | -179.4 | -98.7 | 0 | 0 | 0 | 111.5 | A56 V60 F325 F335 R336 I341 V342 F343 M345 | A56-F339 HydrophobicContact CB-CE2 4.05Å; V60-F339 HydrophobicContact CG2-CB 3.87Å; V60-F339 HydrophobicContact CG2-CD2 3.88Å; V60-F339 HydrophobicContact CG2-CG 4.37Å; F325-F339 HydrophobicContact CE2-CD2 4.24Å; F325-F339 AromaticContact CE2-CE2 3.88Å; F325-F339 HydrophobicContact CE2-CE2 3.88Å; F325-F339 HydrophobicContact CZ-CD2 4.49Å; F325-F339 AromaticContact CZ-CE2 3.83Å; F325-F339 HydrophobicContact CZ-CE2 3.83Å; F325-F339 HydrophobicContact CZ-CZ 4.08Å; F335-F339 HydrophobicContact CE1-CB 4.43Å; F335-F339 HydrophobicContact CE1-CD2 4.43Å; F335-F339 VanDerWaalsContact O-CB 3.23Å; F335-F339 WeakPolarHBondContact O-CB 3.47Å; F335-F339 PolarHBondContact O-N 3.17Å; R336-F339 PolarHBondContact O-N 2.91Å; F339-I341 VanDerWaalsContact C-N 3.26Å; F339-I341 PolarHBondContact O-N 2.82Å; F339-V342 PolarHBondContact O-N 2.73Å; F339-F343 AromaticContact CD2-CD2 3.48Å; F339-F343 HydrophobicContact CD2-CD2 3.48Å; F339-F343 VanDerWaalsContact CD2-CD2 3.48Å; F339-F343 AromaticContact CD2-CE2 3.54Å; F339-F343 HydrophobicContact CD2-CE2 3.54Å; F339-F343 AromaticContact CE2-CD2 3.4Å; F339-F343 HydrophobicContact CE2-CD2 3.4Å; F339-F343 AromaticContact CE2-CE2 3.4Å; F339-F343 HydrophobicContact CE2-CE2 3.4Å; F339-F343 HydrophobicContact CE2-CG 4.36Å; F339-F343 HydrophobicContact CE2-CZ 4.34Å; F339-F343 HydrophobicContact CG-CD2 4.07Å; F339-F343 AromaticContact CZ-CD2 3.96Å; F339-F343 HydrophobicContact CZ-CD2 3.96Å; F339-F343 HydrophobicContact CZ-CE2 4.31Å; F339-F343 WeakPolarHBondContact O-CD2 3.16Å; F339-F343 PolarHBondContact O-N 2.91Å; F339-M345 HydrophobicContact CD1-CE 3.49Å; F339-M345 VanDerWaalsContact CD1-CE 3.49Å; F339-M345 HydrophobicContact CE1-CE 3.16Å; F339-M345 HydrophobicContact CZ-CE 4Å |
| 340 | M | 91.8 | Very high | 81.1 | Confident | 47 Ų | 47 | 79.7 Ų | 79.7 | 23% | 0.232 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -65.3 | -28.4 | 176.5 | -62.7 | -60.6 | -82.3 | 0 | 0 | 113.1 | R336 T337 E338 G344 M345 R346 L349 | R336-M340 VanDerWaalsContact O-CG 3.23Å; R336-M340 WeakPolarHBondContact O-CG 3.28Å; R336-M340 PolarHBondContact O-N 3.12Å; T337-M340 PolarHBondContact O-N 3.39Å; E338-M340 VanDerWaalsContact C-N 3.32Å; E338-M340 PolarHBondContact O-N 2.79Å; M340-G344 CarbonylContact O-C 3.59Å; M340-G344 PolarHBondContact O-N 2.86Å; M340-M345 HydrophobicContact CE-CB 3.28Å; M340-M345 HydrophobicContact CE-CE 4.48Å; M340-M345 HydrophobicContact CE-CG 4.34Å; M340-M345 HydrophobicContact CE-SD 4.23Å; M340-M345 PolarHBondContact O-N 3.46Å; M340-M345 HydrophobicContact SD-CB 3.64Å; M340-M345 HydrophobicContact SD-CE 3.38Å; M340-M345 WeakPolarHBondContact SD-CE 3.35Å; M340-M345 HydrophobicContact SD-CG 4.34Å; M340-M345 HydrophobicContact SD-SD 3.8Å; M340-R346 HydrophobicContact CB-CB 4.39Å; M340-R346 PolarHBondContact O-N 3.48Å; M340-L349 HydrophobicContact CE-CD1 3.28Å |
| 341 | I | 90.6 | Very high | 79.4 | Confident | 56 Ų | 56 | 84.8 Ų | 84.8 | 29% | 0.287 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -74.4 | -49.7 | 175.3 | -66.4 | 165.1 | 0 | 0 | 0 | 110.3 | T337 E338 F339 G344 | T337-I341 HydrophobicContact CG2-CD1 4.3Å; T337-I341 WeakPolarHBondContact O-CG1 3.45Å; T337-I341 PolarHBondContact O-N 3.44Å; E338-I341 WeakPolarHBondContact O-CA 3.28Å; E338-I341 WeakPolarHBondContact O-CB 3.47Å; E338-I341 PolarHBondContact O-N 3.31Å; E338-I341 WeakPolarHBondContact OE1-CD1 3.3Å; F339-I341 VanDerWaalsContact C-N 3.26Å; F339-I341 PolarHBondContact O-N 2.82Å; I341-G344 PolarHBondContact O-N 3.44Å |
| 342 | V | 91.1 | Very high | 77.9 | Confident | 52 Ų | 52 | 84.8 Ų | 84.8 | 32% | 0.315 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.3 | -45.6 | -177.2 | 173.1 | 0 | 0 | 0 | 0 | 111.2 | A59 V60 R63 E338 F339 G344 | A59-V342 HydrophobicContact CB-CG1 4.29Å; V60-V342 HydrophobicContact CG2-CG2 4.5Å; R63-V342 HydrophobicContact CG-CG2 3.69Å; E338-V342 WeakPolarHBondContact O-CG2 3.45Å; E338-V342 PolarHBondContact O-N 2.85Å; F339-V342 PolarHBondContact O-N 2.73Å; V342-G344 VanDerWaalsContact C-N 3.3Å; V342-G344 PolarHBondContact O-N 2.89Å |
| 343 | F | 91.9 | Very high | 76.1 | Confident | 98 Ų | 98 | 93.5 Ų | 93.5 | 43% | 0.43 | 45% | 0.454 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.1 | 14.9 | -178.7 | -65.5 | -78.5 | 0 | 0 | 0 | 113.2 | A56 V60 F339 M345 | A56-F343 HydrophobicContact CB-CE2 4.01Å; A56-F343 HydrophobicContact CB-CZ 3.88Å; V60-F343 HydrophobicContact CG2-CE2 4.41Å; F339-F343 AromaticContact CD2-CD2 3.48Å; F339-F343 HydrophobicContact CD2-CD2 3.48Å; F339-F343 VanDerWaalsContact CD2-CD2 3.48Å; F339-F343 AromaticContact CD2-CE2 3.54Å; F339-F343 HydrophobicContact CD2-CE2 3.54Å; F339-F343 AromaticContact CE2-CD2 3.4Å; F339-F343 HydrophobicContact CE2-CD2 3.4Å; F339-F343 AromaticContact CE2-CE2 3.4Å; F339-F343 HydrophobicContact CE2-CE2 3.4Å; F339-F343 HydrophobicContact CE2-CG 4.36Å; F339-F343 HydrophobicContact CE2-CZ 4.34Å; F339-F343 HydrophobicContact CG-CD2 4.07Å; F339-F343 AromaticContact CZ-CD2 3.96Å; F339-F343 HydrophobicContact CZ-CD2 3.96Å; F339-F343 HydrophobicContact CZ-CE2 4.31Å; F339-F343 WeakPolarHBondContact O-CD2 3.16Å; F339-F343 PolarHBondContact O-N 2.91Å; F343-M345 HydrophobicContact CB-CE 3.78Å; F343-M345 PolarHBondContact O-N 3.39Å |
| 344 | G | 84.3 | Confident | 73.8 | Confident | 44 Ų | 44 | 98.2 Ų | 98.2 | 45% | 0.454 | 47% | 0.467 | S | S | . | . | S | Bend | trans | 69.8 | 2.6 | 169.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | M340 I341 V342 R346 | M340-G344 CarbonylContact O-C 3.59Å; M340-G344 PolarHBondContact O-N 2.86Å; I341-G344 PolarHBondContact O-N 3.44Å; V342-G344 VanDerWaalsContact C-N 3.3Å; V342-G344 PolarHBondContact O-N 2.89Å; G344-R346 PolarHBondContact O-N 3.3Å |
| 345 | M | 80.9 | Confident | 71.5 | Confident | 64 Ų | 64 | 99 Ų | 99 | 32% | 0.315 | 48% | 0.48 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.8 | -12.5 | -176.8 | -63.6 | 178 | -78.3 | 0 | 0 | 113.8 | F339 M340 F343 R347 C348 | F339-M345 HydrophobicContact CD1-CE 3.49Å; F339-M345 VanDerWaalsContact CD1-CE 3.49Å; F339-M345 HydrophobicContact CE1-CE 3.16Å; F339-M345 HydrophobicContact CZ-CE 4Å; M340-M345 HydrophobicContact CE-CB 3.28Å; M340-M345 HydrophobicContact CE-CE 4.48Å; M340-M345 HydrophobicContact CE-CG 4.34Å; M340-M345 HydrophobicContact CE-SD 4.23Å; M340-M345 PolarHBondContact O-N 3.46Å; M340-M345 HydrophobicContact SD-CB 3.64Å; M340-M345 HydrophobicContact SD-CE 3.38Å; M340-M345 WeakPolarHBondContact SD-CE 3.35Å; M340-M345 HydrophobicContact SD-CG 4.34Å; M340-M345 HydrophobicContact SD-SD 3.8Å; F343-M345 HydrophobicContact CB-CE 3.78Å; F343-M345 PolarHBondContact O-N 3.39Å; M345-R347 VanDerWaalsContact C-N 3.28Å; M345-R347 PolarHBondContact O-N 3.35Å; M345-C348 WeakPolarHBondContact O-CB 3.27Å; M345-C348 PolarHBondContact O-N 2.84Å; M345-C348 VanDerWaalsContact O-N 3.15Å |
| 346 | R | 65.3 | Low | 69 | Low | 114 Ų | 114 | 107 Ų | 107 | 43% | 0.43 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65 | -29.3 | 179.2 | -157.7 | 173.1 | -174.2 | -173.5 | 6.2 | 113.4 | M340 G344 C348 L349 D350 | M340-R346 HydrophobicContact CB-CB 4.39Å; M340-R346 PolarHBondContact O-N 3.48Å; G344-R346 PolarHBondContact O-N 3.3Å; R346-C348 PolarHBondContact O-N 2.97Å; R346-L349 PolarHBondContact O-N 2.96Å; R346-D350 IonicContact NE-OD2 3.74Å; R346-D350 PolarHBondContact O-N 2.91Å; R346-D350 VanDerWaalsContact O-N 3.11Å |
| 347 | R | 58.2 | Low | 66.3 | Low | 211 Ų | 211 | 107.5 Ų | 107.5 | 80% | 0.796 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.7 | -21.6 | 175.5 | -68.7 | -174.7 | -168.5 | 166.4 | 4.7 | 112.9 | M345 | M345-R347 VanDerWaalsContact C-N 3.28Å; M345-R347 PolarHBondContact O-N 3.35Å |
| 348 | C | 54.1 | Low | 63.7 | Low | 105 Ų | 105 | 116.1 Ų | 116.1 | 71% | 0.709 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -82.5 | -29.8 | 176.8 | -61.8 | 0 | 0 | 0 | 0 | 112.8 | M345 R346 | M345-C348 WeakPolarHBondContact O-CB 3.27Å; M345-C348 PolarHBondContact O-N 2.84Å; M345-C348 VanDerWaalsContact O-N 3.15Å; R346-C348 PolarHBondContact O-N 2.97Å |
| 349 | L | 53.4 | Low | 61.1 | Low | 101 Ų | 101 | 124.8 Ų | 124.8 | 53% | 0.529 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -86.2 | -36.3 | 179.8 | -89.7 | 140.3 | 0 | 0 | 0 | 113.3 | M340 R346 R351 G352 R353 | M340-L349 HydrophobicContact CE-CD1 3.28Å; R346-L349 PolarHBondContact O-N 2.96Å; L349-R351 VanDerWaalsContact C-N 3.3Å; L349-R351 PolarHBondContact O-N 3.12Å; L349-G352 PolarHBondContact O-N 2.86Å; L349-R353 PolarHBondContact O-N 3.35Å |
| 350 | D | 58.6 | Low | 58.3 | Low | 96 Ų | 96 | 131.9 Ų | 131.9 | 51% | 0.513 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -76.2 | -17.6 | 179.3 | -73.5 | -22.2 | 0 | 0 | 0 | 112.7 | R346 G352 | R346-D350 IonicContact NE-OD2 3.74Å; R346-D350 PolarHBondContact O-N 2.91Å; R346-D350 VanDerWaalsContact O-N 3.11Å; D350-G352 VanDerWaalsContact C-N 3.3Å |
| 351 | R | 52.5 | Low | 55.6 | Low | 233 Ų | 233 | 134.6 Ų | 134.6 | 88% | 0.879 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73 | -19.4 | 168.4 | -88.4 | -176.6 | -178.7 | 174.6 | 1.2 | 113.7 | L349 | L349-R351 VanDerWaalsContact C-N 3.3Å; L349-R351 PolarHBondContact O-N 3.12Å |
| 352 | G | 51.2 | Low | 52.8 | Low | 66 Ų | 66 | 141.9 Ų | 141.9 | 68% | 0.68 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.6 | -18.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | L349 D350 | L349-G352 PolarHBondContact O-N 2.86Å; D350-G352 VanDerWaalsContact C-N 3.3Å |
| 353 | R | 47.2 | Very low | 50.1 | Low | 206 Ų | 206 | 149.8 Ų | 149.8 | 78% | 0.777 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -96.9 | 95.7 | 172.1 | -77.8 | -175.6 | -175.4 | 179.5 | 1.7 | 109.5 | L349 | L349-R353 PolarHBondContact O-N 3.35Š|
| 354 | R | 37.7 | Very low | 47.5 | Very low | 215 Ų | 215 | 153.1 Ų | 153.1 | 81% | 0.811 | 72% | 0.721 | S | S | * | * | trans | -43.3 | 139.8 | 159.9 | -72.2 | -175.4 | 177.6 | -170.4 | -0.2 | 108.7 | Q356 | R354-Q356 PolarHBondContact O-N 3.1Š| ||
| 355 | P | 36.6 | Very low | 45 | Very low | 123 Ų | 123 | 154.9 Ų | 154.9 | 80% | 0.799 | 74% | 0.739 | S | S | * | * | trans | -73.4 | 73.5 | 177.8 | 31.5 | -33.3 | 0 | 0 | 0 | 109.3 | ||||
| 356 | Q | 37.8 | Very low | 42.6 | Very low | 169 Ų | 169 | 157.4 Ų | 157.4 | 79% | 0.79 | 76% | 0.762 | S | S | * | * | trans | -82.2 | 116.7 | 162.6 | -91.4 | 173.6 | -19.1 | 0 | 0 | 106.9 | R354 | R354-Q356 PolarHBondContact O-N 3.1Š| ||
| 357 | N | 35 | Very low | 41.2 | Very low | 130 Ų | 130 | 157.6 Ų | 157.6 | 70% | 0.695 | 78% | 0.781 | S | S | * | * | trans | 94.6 | 55.1 | 179.5 | -57.2 | -15.3 | 0 | 0 | 0 | 117.2 | Y359 | N357-Y359 PolarHBondContact O-N 3.04Š| ||
| 358 | R | 35.8 | Very low | 40.1 | Very low | 235 Ų | 235 | 153.8 Ų | 153.8 | 89% | 0.887 | 78% | 0.781 | S | S | * | * | trans | -76.9 | 17.8 | 147.6 | -151.1 | 176.3 | -167.1 | 172.7 | 3.5 | 113.1 | ||||
| 359 | Y | 36.4 | Very low | 39.3 | Very low | 209 Ų | 209 | 156.1 Ų | 156.1 | 82% | 0.82 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -109.6 | 3.4 | -171.8 | -106.2 | -92.7 | 0 | 0 | 0 | 116 | N357 | N357-Y359 PolarHBondContact O-N 3.04Š|
| 360 | Y | 34.1 | Very low | 38.5 | Very low | 195 Ų | 195 | 158.7 Ų | 158.7 | 77% | 0.765 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -114.6 | 6.9 | 178.4 | -86.8 | -82.5 | 0 | 0 | 0 | 115.8 | ||
| 361 | A | 34.3 | Very low | 37.5 | Very low | 104 Ų | 104 | 160 Ų | 160 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -97.8 | 19.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 362 | K | 32.7 | Very low | 37 | Very low | 209 Ų | 209 | 153.8 Ų | 153.8 | 91% | 0.909 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -112 | 29.6 | 177.8 | -153.5 | -178.5 | -178.8 | 179.2 | 0 | 113.2 | ||
| 363 | R | 33 | Very low | 36.3 | Very low | 218 Ų | 218 | 157.4 Ų | 157.4 | 82% | 0.823 | 82% | 0.815 | S | S | * | * | trans | -131.6 | 17.7 | -174 | -130.9 | -177.3 | -165.5 | 175.3 | 4.1 | 117.2 | ||||
| 364 | D | 37.5 | Very low | 36 | Very low | 169 Ų | 169 | 153 Ų | 153 | 90% | 0.904 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -123.3 | 83.1 | 167.5 | -67.3 | -37.9 | 0 | 0 | 0 | 110.3 | ||
| 365 | G | 32 | Very low | 35.8 | Very low | 81 Ų | 81 | 150.7 Ų | 150.7 | 84% | 0.835 | 82% | 0.815 | S | S | * | * | 55.2 | 65.8 | 126.8 | 0 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 366 | C | 30.5 | Very low | 35.8 | Very low | 117 Ų | 117 | 149.5 Ų | 149.5 | 79% | 0.791 | 82% | 0.816 | S | S | * | * | trans | -151.1 | 88.8 | 145.9 | -151.1 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 367 | S | 35.6 | Very low | 35.6 | Very low | 118 Ų | 118 | 148.1 Ų | 148.1 | 83% | 0.825 | 82% | 0.819 | S | S | * | * | trans | -139.8 | 82.7 | 166.4 | -57 | 0 | 0 | 0 | 0 | 106.6 | L369 | S367-L369 PolarHBondContact O-N 2.67Š| ||
| 368 | T | 36.2 | Very low | 35.7 | Very low | 130 Ų | 130 | 148.4 Ų | 148.4 | 80% | 0.798 | 83% | 0.826 | S | S | * | * | trans | -46.1 | 118 | 145.7 | 23.2 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 369 | L | 37.7 | Very low | 35.5 | Very low | 155 Ų | 155 | 145.9 Ų | 145.9 | 81% | 0.812 | 82% | 0.824 | S | S | * | * | trans | -172.8 | 91.4 | 141.1 | -93.7 | 173.8 | 0 | 0 | 0 | 107.7 | S367 | S367-L369 PolarHBondContact O-N 2.67Š| ||
| 370 | L | 36.1 | Very low | 35.3 | Very low | 154 Ų | 154 | 141.9 Ų | 141.9 | 81% | 0.806 | 83% | 0.825 | S | S | * | * | trans | 52.3 | 114.9 | 146.5 | -64.5 | 161 | 0 | 0 | 0 | 119 | ||||
| 371 | P | 38.3 | Very low | 35.1 | Very low | 125 Ų | 125 | 140 Ų | 140 | 81% | 0.812 | 83% | 0.828 | S | S | * | * | trans | -82.2 | 123.6 | 162.4 | 30.8 | -22.8 | 0 | 0 | 0 | 109.4 | N373 | P371-N373 PolarHBondContact O-N 3.22Š| ||
| 372 | A | 40.5 | Very low | 35.3 | Very low | 101 Ų | 101 | 139.9 Ų | 139.9 | 84% | 0.835 | 82% | 0.821 | S | S | * | * | trans | -66.5 | 117.6 | 159 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 373 | N | 36.5 | Very low | 35.4 | Very low | 142 Ų | 142 | 137.6 Ų | 137.6 | 76% | 0.759 | 81% | 0.813 | S | S | * | * | S | Bend | trans | 86.8 | 131.2 | 159.3 | -131.3 | -4.9 | 0 | 0 | 0 | 118.2 | P371 | P371-N373 PolarHBondContact O-N 3.22Š|
| 374 | T | 41.8 | Very low | 35.4 | Very low | 114 Ų | 114 | 135.1 Ų | 135.1 | 70% | 0.699 | 81% | 0.811 | S | S | * | * | trans | 77.9 | 93.3 | 162.6 | 58.8 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 375 | N | 34 | Very low | 35.6 | Very low | 166 Ų | 166 | 140.8 Ų | 140.8 | 89% | 0.888 | 83% | 0.828 | S | S | * | * | trans | 39.9 | 93.5 | 132.5 | -60.3 | -6.6 | 0 | 0 | 0 | 118.8 | ||||
| 376 | A | 37 | Very low | 35.8 | Very low | 99 Ų | 99 | 143.8 Ų | 143.8 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | trans | -176 | 117.1 | 132.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 377 | T | 33.2 | Very low | 36 | Very low | 139 Ų | 139 | 145.2 Ų | 145.2 | 85% | 0.853 | 83% | 0.829 | S | S | * | * | trans | -72.5 | 128.5 | 168 | 42.3 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 378 | T | 36.5 | Very low | 36.1 | Very low | 137 Ų | 137 | 146.7 Ų | 146.7 | 84% | 0.84 | 83% | 0.83 | S | S | * | * | trans | -160.3 | 111.4 | 148 | -18.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 379 | E | 31.6 | Very low | 36.1 | Very low | 181 Ų | 181 | 147.6 Ų | 147.6 | 85% | 0.846 | 83% | 0.832 | S | S | * | * | trans | -69.2 | 145.5 | 160 | -74.2 | 173.5 | 130.8 | 0 | 0 | 110.4 | ||||
| 380 | C | 33.3 | Very low | 36 | Very low | 126 Ų | 126 | 147.2 Ų | 147.2 | 85% | 0.851 | 83% | 0.833 | S | S | * | * | trans | -153.6 | 100.8 | 152.1 | -112 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 381 | N | 29.9 | Very low | 36 | Very low | 156 Ų | 156 | 146.7 Ų | 146.7 | 83% | 0.834 | 84% | 0.835 | S | S | * | * | trans | -67.5 | 138.1 | 151.1 | -80.9 | -37.3 | 0 | 0 | 0 | 108.8 | ||||
| 382 | S | 37 | Very low | 35.8 | Very low | 100 Ų | 100 | 148.3 Ų | 148.3 | 70% | 0.699 | 84% | 0.836 | S | S | * | * | trans | 175 | 126.2 | 138.4 | 38 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 383 | H | 35.8 | Very low | 35.4 | Very low | 162 Ų | 162 | 151.9 Ų | 151.9 | 75% | 0.75 | 84% | 0.836 | S | S | * | * | trans | 58.4 | 123.1 | 132.9 | -76.1 | -99.5 | 0 | 0 | 0 | 122.7 | ||||
| 384 | E | 33.7 | Very low | 35.3 | Very low | 165 Ų | 165 | 152.8 Ų | 152.8 | 77% | 0.771 | 84% | 0.843 | S | S | * | * | 55.5 | 121.1 | 129.7 | -68.3 | 177 | 118.4 | 0 | 0 | 121 | |||||
| 385 | F | 40.5 | Very low | 34.8 | Very low | 288 Ų | 288 | 156.3 Ų | 156.3 | 100% | 1.263 | 86% | 0.856 | S | S | * | * | trans | -150.8 | 0 | 131.3 | -115.5 | -77.3 | 0 | 0 | 0 | 111.8 |
Retrieved 385 of 385 residues in 287.3 ms
(Link to these results)