| 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 | 37.9 | Very low | 33.9 | Very low | 248 Ų | 248 | 141.5 Ų | 141.5 | 100% | 1.222 | 81% | 0.807 | S | S | * | * | 0 | 87 | 0 | -77 | 173.6 | 176 | 0 | 0 | 107.3 | |||||
| 2 | T | 30.6 | Very low | 34.3 | Very low | 139 Ų | 139 | 141.1 Ų | 141.1 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | trans | -114.6 | 112.7 | 177.2 | 39.1 | 0 | 0 | 0 | 0 | 106.2 | D4 | T2-D4 PolarHBondContact O-N 3.21Š| ||
| 3 | S | 32.7 | Very low | 34.4 | Very low | 117 Ų | 117 | 142.4 Ų | 142.4 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | -79.2 | 107.4 | -180 | 48.9 | 0 | 0 | 0 | 0 | 109.7 | F5 | S3-F5 PolarHBondContact O-N 2.97Š| ||
| 4 | D | 30.8 | Very low | 35.4 | Very low | 158 Ų | 158 | 137.3 Ų | 137.3 | 85% | 0.845 | 77% | 0.774 | S | S | * | * | trans | -72.8 | 115.8 | 165.5 | -87.7 | -28.2 | 0 | 0 | 0 | 109.2 | T2 T6 | T2-D4 PolarHBondContact O-N 3.21Å; D4-T6 PolarHBondContact O-N 3.45Å | ||
| 5 | F | 35.3 | Very low | 35.8 | Very low | 192 Ų | 192 | 138.3 Ų | 138.3 | 84% | 0.842 | 78% | 0.776 | S | S | * | * | trans | -89.9 | 90.5 | 174.5 | -152.2 | -90.2 | 0 | 0 | 0 | 107.9 | S3 T7 | S3-F5 PolarHBondContact O-N 2.97Å; F5-T7 PolarHBondContact O-N 3.01Å; F5-T7 VanDerWaalsContact O-N 3.16Å | ||
| 6 | T | 34.7 | Very low | 36.2 | Very low | 130 Ų | 130 | 138.1 Ų | 138.1 | 80% | 0.798 | 78% | 0.78 | S | S | * | * | trans | -71.4 | 105.6 | 172.5 | -11.6 | 0 | 0 | 0 | 0 | 108.9 | D4 | D4-T6 PolarHBondContact O-N 3.45Š| ||
| 7 | T | 33.3 | Very low | 36.9 | Very low | 103 Ų | 103 | 132.8 Ų | 132.8 | 63% | 0.632 | 75% | 0.753 | S | S | * | * | trans | -63.3 | 128.9 | 168.6 | 44.7 | 0 | 0 | 0 | 0 | 109.8 | F5 N9 | F5-T7 PolarHBondContact O-N 3.01Å; F5-T7 VanDerWaalsContact O-N 3.16Å; T7-N9 PolarHBondContact O-N 3.29Å | ||
| 8 | P | 33.7 | Very low | 37.2 | Very low | 111 Ų | 111 | 135.8 Ų | 135.8 | 72% | 0.721 | 76% | 0.76 | S | S | * | * | trans | -74.6 | 116.9 | 172.3 | 28.3 | -27.5 | 0 | 0 | 0 | 108.6 | T10 | P8-T10 PolarHBondContact O-N 3.46Š| ||
| 9 | N | 31.4 | Very low | 37.9 | Very low | 153 Ų | 153 | 133.5 Ų | 133.5 | 82% | 0.818 | 75% | 0.746 | S | S | * | * | trans | -60.6 | 100.5 | 165.2 | -91.8 | -14.7 | 0 | 0 | 0 | 108.5 | T7 S11 | T7-N9 PolarHBondContact O-N 3.29Å; N9-S11 PolarHBondContact O-N 3.13Å | ||
| 10 | T | 35.2 | Very low | 38.2 | Very low | 119 Ų | 119 | 133.4 Ų | 133.4 | 73% | 0.73 | 75% | 0.748 | S | S | * | * | trans | -77.7 | 72.6 | 163.8 | 34.7 | 0 | 0 | 0 | 0 | 109.1 | P8 N12 | P8-T10 PolarHBondContact O-N 3.46Å; T10-N12 VanDerWaalsContact C-N 3.32Å; T10-N12 PolarHBondContact O-N 3.15Å | ||
| 11 | S | 36.9 | Very low | 38.7 | Very low | 86 Ų | 86 | 132.1 Ų | 132.1 | 60% | 0.601 | 74% | 0.739 | S | S | * | * | trans | -63.7 | 101.5 | 153.3 | 46.9 | 0 | 0 | 0 | 0 | 106.7 | N9 E13 | N9-S11 PolarHBondContact O-N 3.13Å; S11-E13 PolarHBondContact O-N 3.36Å | ||
| 12 | N | 38.8 | Very low | 39.8 | Very low | 137 Ų | 137 | 122.5 Ų | 122.5 | 73% | 0.733 | 69% | 0.693 | S | S | * | * | trans | -65.3 | 81.7 | 168.3 | -74.2 | -28.2 | 0 | 0 | 0 | 107.9 | T10 C14 | T10-N12 VanDerWaalsContact C-N 3.32Å; T10-N12 PolarHBondContact O-N 3.15Å; N12-C14 PolarHBondContact O-N 3.45Å; N12-C14 VanDerWaalsContact O-N 3.1Å | ||
| 13 | E | 36 | Very low | 41.3 | Very low | 158 Ų | 158 | 122.2 Ų | 122.2 | 74% | 0.738 | 68% | 0.68 | S | S | * | * | trans | -63.7 | 109.3 | 171.6 | -70.1 | -173.9 | 155.8 | 0 | 0 | 107.7 | S11 N15 | S11-E13 PolarHBondContact O-N 3.36Å; E13-N15 PolarHBondContact O-N 3.49Å | ||
| 14 | C | 48 | Very low | 43.1 | Very low | 71 Ų | 71 | 124.3 Ų | 124.3 | 48% | 0.48 | 68% | 0.679 | S | S | . | * | trans | -67 | 100.6 | 171.1 | -49.7 | 0 | 0 | 0 | 0 | 105.6 | N12 T16 C170 | N12-C14 PolarHBondContact O-N 3.45Å; N12-C14 VanDerWaalsContact O-N 3.1Å; C14-T16 PolarHBondContact O-N 3.06Å; C14-C170 HydrophobicContact CB-CB 4.42Å; C14-C170 WeakPolarHBondContact CB-SG 3.45Å; C14-C170 WeakPolarHBondContact SG-CB 3.26Å; C14-C170 CovalentContact SG-SG 2.09Å; C14-C170 PolarHBondContact SG-SG 3.39Å | ||
| 15 | N | 41 | Very low | 45.6 | Very low | 152 Ų | 152 | 118.8 Ų | 118.8 | 81% | 0.813 | 65% | 0.649 | S | S | * | * | trans | -47.7 | 109.1 | 177.5 | -82.7 | -11.9 | 0 | 0 | 0 | 109.8 | E13 S17 | E13-N15 PolarHBondContact O-N 3.49Å; N15-S17 PolarHBondContact O-N 3.24Å | ||
| 16 | T | 43.1 | Very low | 48.1 | Very low | 136 Ų | 136 | 110.5 Ų | 110.5 | 83% | 0.834 | 61% | 0.613 | S | S | * | * | trans | -64.6 | 102.9 | 169.9 | 6.1 | 0 | 0 | 0 | 0 | 107.2 | C14 E18 | C14-T16 PolarHBondContact O-N 3.06Å; T16-E18 PolarHBondContact O-N 3.22Å | ||
| 17 | S | 48.4 | Very low | 50.7 | Low | 47 Ų | 47 | 108.7 Ų | 108.7 | 33% | 0.329 | 60% | 0.602 | S | S | . | * | trans | -57.1 | 113.5 | 169.8 | 31.6 | 0 | 0 | 0 | 0 | 108.6 | N15 K175 | N15-S17 PolarHBondContact O-N 3.24Å; S17-K175 PolarHBondContact OG-NZ 2.93Å | ||
| 18 | E | 42.3 | Very low | 53.5 | Low | 187 Ų | 187 | 106.6 Ų | 106.6 | 87% | 0.874 | 59% | 0.59 | S | S | * | * | trans | -64 | 153.3 | 179.6 | -101.9 | -173.2 | 147.8 | 0 | 0 | 112.5 | T16 V20 | T16-E18 PolarHBondContact O-N 3.22Å; E18-V20 PolarHBondContact O-N 3.21Å | ||
| 19 | L | 49.3 | Very low | 56.3 | Low | 93 Ų | 93 | 101.8 Ų | 101.8 | 49% | 0.487 | 56% | 0.558 | S | S | . | * | S | Bend | trans | -100.4 | 47 | -145.7 | -164.9 | 97.1 | 0 | 0 | 0 | 113.7 | ||
| 20 | V | 43.9 | Very low | 59.3 | Low | 130 Ų | 130 | 94.7 Ų | 94.7 | 79% | 0.788 | 52% | 0.521 | S | S | * | . | S | Bend | trans | -106.2 | -15.1 | -164 | -171.8 | 0 | 0 | 0 | 0 | 116.1 | E18 | E18-V20 PolarHBondContact O-N 3.21Š|
| 21 | D | 50.3 | Low | 62.2 | Low | 107 Ų | 107 | 92.7 Ų | 92.7 | 57% | 0.572 | 51% | 0.508 | S | S | * | . | S | Bend | trans | -137.2 | 18.3 | -173.8 | -160.3 | 34.9 | 0 | 0 | 0 | 116.9 | K280 | D21-K280 PolarHBondContact O-NZ 3.03Å; D21-K280 IonicContact OD2-NZ 3.77Å; D21-K280 PolarHBondContact OD2-NZ 3.4Å |
| 22 | D | 59.4 | Low | 65 | Low | 46 Ų | 46 | 92.1 Ų | 92.1 | 25% | 0.246 | 50% | 0.498 | C | S | . | . | S | Bend | trans | -94.3 | -17 | 179 | -79.8 | -17.2 | 0 | 0 | 0 | 114 | M24 L25 Q26 | D22-M24 VanDerWaalsContact C-N 3.3Å; D22-M24 PolarHBondContact O-N 3.36Å; D22-L25 PolarHBondContact O-N 2.87Å; D22-Q26 WeakPolarHBondContact O-CG 3.36Å; D22-Q26 PolarHBondContact O-N 3.17Å |
| 23 | K | 62.5 | Low | 67.8 | Low | 134 Ų | 134 | 85.6 Ų | 85.6 | 58% | 0.583 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -62.8 | -33.8 | -174.1 | -70 | -178.1 | -178.1 | 173.6 | 0 | 113.4 | L25 | K23-L25 VanDerWaalsContact C-N 3.26Å; K23-L25 PolarHBondContact O-N 2.69Å |
| 24 | M | 71.3 | Confident | 70.7 | Confident | 161 Ų | 161 | 80 Ų | 80 | 79% | 0.793 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -65.1 | -28.3 | -178.2 | -70.9 | -101.3 | 104 | 0 | 0 | 112.6 | D22 P28 | D22-M24 VanDerWaalsContact C-N 3.3Å; D22-M24 PolarHBondContact O-N 3.36Å; M24-P28 VanDerWaalsContact O-CD 3.24Å; M24-P28 WeakPolarHBondContact O-CD 3.41Å; M24-P28 WeakPolarHBondContact O-CG 3.37Å |
| 25 | L | 82.8 | Confident | 73.1 | Confident | 41 Ų | 41 | 80.7 Ų | 80.7 | 22% | 0.215 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -100.6 | -24.4 | -174.8 | -169.9 | 61.7 | 0 | 0 | 0 | 113.2 | D22 K23 T27 P28 L29 K280 I284 | D22-L25 PolarHBondContact O-N 2.87Å; K23-L25 VanDerWaalsContact C-N 3.26Å; K23-L25 PolarHBondContact O-N 2.69Å; L25-T27 PolarHBondContact O-N 3.3Å; L25-P28 WeakPolarHBondContact O-CD 3.27Å; L25-L29 HydrophobicContact CD1-CD1 4.49Å; L25-L29 HydrophobicContact CD1-CD2 4.47Å; L25-L29 HydrophobicContact CD1-CG 4.13Å; L25-L29 HydrophobicContact CD2-CD1 4.03Å; L25-L29 HydrophobicContact CG-CD1 3.68Å; L25-L29 HydrophobicContact CG-CD2 4.49Å; L25-L29 HydrophobicContact CG-CG 3.83Å; L25-L29 WeakPolarHBondContact O-CB 3.2Å; L25-L29 WeakPolarHBondContact O-CG 3.45Å; L25-L29 PolarHBondContact O-N 3.5Å; L25-K280 HydrophobicContact CD2-CB 4.26Å; L25-K280 HydrophobicContact CD2-CG 4.24Å; L25-I284 HydrophobicContact CD1-CD1 4.38Å; L25-I284 HydrophobicContact CD1-CG1 4.27Å; L25-I284 HydrophobicContact CD2-CD1 4.38Å; L25-I284 HydrophobicContact CD2-CG1 4.26Å |
| 26 | Q | 87.7 | Confident | 75.8 | Confident | 19 Ų | 19 | 73.5 Ų | 73.5 | 9% | 0.089 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -54.9 | -53.8 | 180 | -76.3 | 165.2 | 5.7 | 0 | 0 | 113.1 | D22 L29 A30 N90 | D22-Q26 WeakPolarHBondContact O-CG 3.36Å; D22-Q26 PolarHBondContact O-N 3.17Å; Q26-L29 PolarHBondContact O-N 3.03Å; Q26-A30 WeakPolarHBondContact O-CB 3.35Å; Q26-A30 PolarHBondContact O-N 3.35Å; Q26-N90 PolarHBondContact NE2-ND2 3.37Å |
| 27 | T | 89.3 | Confident | 78.4 | Confident | 92 Ų | 92 | 69.9 Ų | 69.9 | 56% | 0.564 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -64.7 | -48.7 | -178.2 | -53.8 | 0 | 0 | 0 | 0 | 112.2 | L25 L29 A30 V31 | L25-T27 PolarHBondContact O-N 3.3Å; T27-L29 VanDerWaalsContact C-N 3.33Å; T27-L29 PolarHBondContact O-N 3.28Å; T27-A30 PolarHBondContact O-N 3.39Å; T27-V31 HydrophobicContact CG2-CG2 4.5Å; T27-V31 WeakPolarHBondContact O-CG2 3.41Å; T27-V31 PolarHBondContact O-N 3.49Å |
| 28 | P | 92.8 | Very high | 80.7 | Confident | 59 Ų | 59 | 72.4 Ų | 72.4 | 38% | 0.383 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -55.6 | -43 | 173.2 | -27.6 | 35 | 0 | 0 | 0 | 113.9 | M24 L25 V31 L32 | M24-P28 VanDerWaalsContact O-CD 3.24Å; M24-P28 WeakPolarHBondContact O-CD 3.41Å; M24-P28 WeakPolarHBondContact O-CG 3.37Å; L25-P28 WeakPolarHBondContact O-CD 3.27Å; P28-V31 PolarHBondContact O-N 2.91Å; P28-L32 WeakPolarHBondContact O-CB 3.36Å; P28-L32 VanDerWaalsContact O-CG 3.24Å; P28-L32 WeakPolarHBondContact O-CG 3.24Å; P28-L32 PolarHBondContact O-N 2.95Å |
| 29 | L | 92.8 | Very high | 83.2 | Confident | 9 Ų | 9 | 67.7 Ų | 67.7 | 5% | 0.047 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -63.1 | -46.4 | 178.1 | -72.5 | 175.3 | 0 | 0 | 0 | 111.8 | L25 Q26 T27 V31 L32 Y33 V287 | L25-L29 HydrophobicContact CD1-CD1 4.49Å; L25-L29 HydrophobicContact CD1-CD2 4.47Å; L25-L29 HydrophobicContact CD1-CG 4.13Å; L25-L29 HydrophobicContact CD2-CD1 4.03Å; L25-L29 HydrophobicContact CG-CD1 3.68Å; L25-L29 HydrophobicContact CG-CD2 4.49Å; L25-L29 HydrophobicContact CG-CG 3.83Å; L25-L29 WeakPolarHBondContact O-CB 3.2Å; L25-L29 WeakPolarHBondContact O-CG 3.45Å; L25-L29 PolarHBondContact O-N 3.5Å; Q26-L29 PolarHBondContact O-N 3.03Å; T27-L29 VanDerWaalsContact C-N 3.33Å; T27-L29 PolarHBondContact O-N 3.28Å; L29-V31 VanDerWaalsContact C-N 3.31Å; L29-V31 PolarHBondContact O-N 3.48Å; L29-L32 PolarHBondContact O-N 3.28Å; L29-Y33 HydrophobicContact CB-CE2 4.46Å; L29-Y33 HydrophobicContact CD2-CE2 4.48Å; L29-Y33 WeakPolarHBondContact O-CD2 3.43Å; L29-Y33 PolarHBondContact O-N 2.87Å; L29-V287 HydrophobicContact CD2-CG2 3.39Å |
| 30 | A | 94.3 | Very high | 85.5 | Confident | 4 Ų | 4 | 63.3 Ų | 63.3 | 3% | 0.033 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.4 | -42.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q26 T27 S34 I83 H86 L87 | Q26-A30 WeakPolarHBondContact O-CB 3.35Å; Q26-A30 PolarHBondContact O-N 3.35Å; T27-A30 PolarHBondContact O-N 3.39Å; A30-S34 WeakPolarHBondContact O-CB 3.34Å; A30-S34 PolarHBondContact O-N 3.41Å; A30-S34 PolarHBondContact O-OG 2.71Å; A30-I83 HydrophobicContact CB-CG2 4.31Å; A30-H86 HydrophobicContact CB-CB 4.22Å; A30-L87 HydrophobicContact CB-CD2 3.94Å; A30-L87 HydrophobicContact CB-CG 4.17Å |
| 31 | V | 95.6 | Very high | 88 | Confident | 78 Ų | 78 | 59.4 Ų | 59.4 | 47% | 0.473 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.6 | -47.5 | 176.1 | 170.8 | 0 | 0 | 0 | 0 | 111.2 | T27 P28 L29 S34 I35 | T27-V31 HydrophobicContact CG2-CG2 4.5Å; T27-V31 WeakPolarHBondContact O-CG2 3.41Å; T27-V31 PolarHBondContact O-N 3.49Å; P28-V31 PolarHBondContact O-N 2.91Å; L29-V31 VanDerWaalsContact C-N 3.31Å; L29-V31 PolarHBondContact O-N 3.48Å; V31-S34 WeakPolarHBondContact O-CB 3.37Å; V31-S34 PolarHBondContact O-N 3.25Å; V31-I35 HydrophobicContact CG1-CD1 4.01Å; V31-I35 WeakPolarHBondContact O-CG1 3.03Å; V31-I35 PolarHBondContact O-N 3.19Å |
| 32 | L | 96.3 | Very high | 90 | Very high | 74 Ų | 74 | 58.1 Ų | 58.1 | 39% | 0.387 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62.4 | -47 | 179.8 | -71.9 | 168.7 | 0 | 0 | 0 | 111.5 | P28 L29 S34 I35 I36 V287 | P28-L32 WeakPolarHBondContact O-CB 3.36Å; P28-L32 VanDerWaalsContact O-CG 3.24Å; P28-L32 WeakPolarHBondContact O-CG 3.24Å; P28-L32 PolarHBondContact O-N 2.95Å; L29-L32 PolarHBondContact O-N 3.28Å; L32-S34 VanDerWaalsContact C-N 3.28Å; L32-S34 PolarHBondContact O-N 3.27Å; L32-I35 PolarHBondContact O-N 3.3Å; L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.32Å; L32-I36 PolarHBondContact O-N 3.34Å; L32-V287 HydrophobicContact CB-CG1 4.07Å; L32-V287 HydrophobicContact CD1-CG1 4.14Å |
| 33 | Y | 97 | Very high | 91.6 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -63.6 | -33.1 | 175.2 | -74.5 | -54.1 | 0 | 0 | 0 | 112.7 | L29 I36 F37 L79 R82 H86 F106 V287 A290 | L29-Y33 HydrophobicContact CB-CE2 4.46Å; L29-Y33 HydrophobicContact CD2-CE2 4.48Å; L29-Y33 WeakPolarHBondContact O-CD2 3.43Å; L29-Y33 PolarHBondContact O-N 2.87Å; Y33-I36 HydrophobicContact CD1-CD1 4.23Å; Y33-I36 PolarHBondContact O-N 3.46Å; Y33-F37 VanDerWaalsContact O-CB 3.28Å; Y33-F37 WeakPolarHBondContact O-CB 2.96Å; Y33-F37 PolarHBondContact O-N 2.92Å; Y33-L79 HydrophobicContact CD1-CD2 3.76Å; Y33-L79 HydrophobicContact CE1-CD2 4.24Å; Y33-R82 HydrophobicContact CD2-CG 4.23Å; Y33-R82 HydrophobicContact CE2-CG 4.05Å; Y33-R82 VanDerWaalsContact CZ-CZ 3.46Å; Y33-R82 PolarHBondContact OH-NE 3.02Å; Y33-R82 PolarHBondContact OH-NH1 3.31Å; Y33-R82 PolarHBondContact OH-NH2 3.46Å; Y33-R82 VanDerWaalsContact OH-NH2 3.17Å; Y33-H86 AromaticContact CD2-CD2 3.94Å; Y33-H86 AromaticContact CE2-NE2 3.65Å; Y33-F106 HydrophobicContact CE1-CE2 4.28Å; Y33-V287 HydrophobicContact CE1-CG2 4.21Å; Y33-V287 HydrophobicContact CE2-CG2 4.06Å; Y33-V287 VanDerWaalsContact OH-CG2 3.29Å; Y33-V287 WeakPolarHBondContact OH-CG2 3.26Å; Y33-A290 HydrophobicContact CD1-CB 4.43Å; Y33-A290 HydrophobicContact CE1-CB 3.9Å |
| 34 | S | 97.7 | Very high | 93.2 | Very high | 41 Ų | 41 | 50.4 Ų | 50.4 | 29% | 0.287 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -65.8 | -41.6 | 174.5 | -60.5 | 0 | 0 | 0 | 0 | 112.1 | A30 V31 L32 F37 I38 | A30-S34 WeakPolarHBondContact O-CB 3.34Å; A30-S34 PolarHBondContact O-N 3.41Å; A30-S34 PolarHBondContact O-OG 2.71Å; V31-S34 WeakPolarHBondContact O-CB 3.37Å; V31-S34 PolarHBondContact O-N 3.25Å; L32-S34 VanDerWaalsContact C-N 3.28Å; L32-S34 PolarHBondContact O-N 3.27Å; S34-F37 WeakPolarHBondContact O-CB 3.37Å; S34-F37 PolarHBondContact O-N 3Å; S34-I38 WeakPolarHBondContact O-CG1 3.33Å; S34-I38 PolarHBondContact O-N 2.92Å |
| 35 | I | 97.3 | Very high | 94.3 | Very high | 84 Ų | 84 | 47.1 Ų | 47.1 | 43% | 0.431 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -62.7 | -47.3 | 174.5 | -67.4 | 166.5 | 0 | 0 | 0 | 110.1 | V31 L32 F37 I38 L39 | V31-I35 HydrophobicContact CG1-CD1 4.01Å; V31-I35 WeakPolarHBondContact O-CG1 3.03Å; V31-I35 PolarHBondContact O-N 3.19Å; L32-I35 PolarHBondContact O-N 3.3Å; I35-F37 VanDerWaalsContact C-N 3.29Å; I35-F37 PolarHBondContact O-N 3.48Å; I35-I38 PolarHBondContact O-N 3.03Å; I35-L39 HydrophobicContact CG2-CD1 3.72Å; I35-L39 HydrophobicContact CG2-CG 4.32Å; I35-L39 WeakPolarHBondContact O-CB 3.35Å; I35-L39 WeakPolarHBondContact O-CG 3.13Å; I35-L39 PolarHBondContact O-N 2.84Å |
| 36 | I | 97.6 | Very high | 94.7 | Very high | 1 Ų | 1 | 47.2 Ų | 47.2 | 1% | 0.005 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -60.4 | -41.8 | 177.6 | -64.2 | 165.4 | 0 | 0 | 0 | 110.4 | L32 Y33 G40 L79 V287 A290 L291 C294 | L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.32Å; L32-I36 PolarHBondContact O-N 3.34Å; Y33-I36 HydrophobicContact CD1-CD1 4.23Å; Y33-I36 PolarHBondContact O-N 3.46Å; I36-G40 VanDerWaalsContact O-CA 3.29Å; I36-G40 WeakPolarHBondContact O-CA 3.23Å; I36-G40 PolarHBondContact O-N 3.31Å; I36-L79 HydrophobicContact CB-CD1 3.99Å; I36-L79 HydrophobicContact CG2-CD1 3.54Å; I36-V287 HydrophobicContact CD1-CG1 4.11Å; I36-A290 HydrophobicContact CD1-CB 3.88Å; I36-A290 HydrophobicContact CG2-CB 4.42Å; I36-A290 WeakPolarHBondContact CG2-O 3.4Å; I36-L291 HydrophobicContact CD1-CD2 3.9Å; I36-L291 HydrophobicContact CD1-CG 4.23Å; I36-L291 HydrophobicContact CG1-CD2 3.85Å; I36-C294 HydrophobicContact CG2-CB 4.38Å |
| 37 | F | 97.8 | Very high | 94.8 | Very high | 60 Ų | 60 | 46.3 Ų | 46.3 | 26% | 0.263 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -58.7 | -53.8 | 177.2 | 170.2 | -108 | 0 | 0 | 0 | 111.7 | Y33 S34 I35 L41 V76 L79 P80 I83 | Y33-F37 VanDerWaalsContact O-CB 3.28Å; Y33-F37 WeakPolarHBondContact O-CB 2.96Å; Y33-F37 PolarHBondContact O-N 2.92Å; S34-F37 WeakPolarHBondContact O-CB 3.37Å; S34-F37 PolarHBondContact O-N 3Å; I35-F37 VanDerWaalsContact C-N 3.29Å; I35-F37 PolarHBondContact O-N 3.48Å; F37-L41 HydrophobicContact CE2-CD2 4.09Å; F37-L41 HydrophobicContact CZ-CD2 3.85Å; F37-L41 WeakPolarHBondContact O-CB 3.27Å; F37-L41 PolarHBondContact O-N 2.85Å; F37-V76 HydrophobicContact CD2-CG1 3.61Å; F37-V76 VanDerWaalsContact CD2-O 3.27Å; F37-V76 WeakPolarHBondContact CD2-O 3.47Å; F37-V76 HydrophobicContact CE2-CG1 4.05Å; F37-L79 HydrophobicContact CB-CB 4.28Å; F37-L79 HydrophobicContact CB-CD1 4.24Å; F37-P80 HydrophobicContact CD2-CG 3.96Å; F37-P80 HydrophobicContact CE2-CG 3.73Å; F37-P80 HydrophobicContact CZ-CG 4.17Å; F37-I83 HydrophobicContact CB-CD1 4.41Å |
| 38 | I | 96.9 | Very high | 95 | Very high | 101 Ų | 101 | 43 Ų | 43 | 52% | 0.518 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -64 | -49.6 | -176.2 | -65.1 | 167.6 | 0 | 0 | 0 | 110.9 | S34 I35 T42 | S34-I38 WeakPolarHBondContact O-CG1 3.33Å; S34-I38 PolarHBondContact O-N 2.92Å; I35-I38 PolarHBondContact O-N 3.03Å; I38-T42 WeakPolarHBondContact O-CB 3.45Å; I38-T42 WeakPolarHBondContact O-CG2 3.34Å; I38-T42 PolarHBondContact O-N 3.21Å; I38-T42 VanDerWaalsContact O-N 3.14Å; I38-T42 PolarHBondContact O-OG1 3.37Å |
| 39 | L | 95.6 | Very high | 94.9 | Very high | 88 Ų | 88 | 46 Ų | 46 | 46% | 0.461 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -69.7 | -41.8 | -177.2 | -65 | -178.9 | 0 | 0 | 0 | 111.9 | I35 T42 G43 C294 | I35-L39 HydrophobicContact CG2-CD1 3.72Å; I35-L39 HydrophobicContact CG2-CG 4.32Å; I35-L39 WeakPolarHBondContact O-CB 3.35Å; I35-L39 WeakPolarHBondContact O-CG 3.13Å; I35-L39 PolarHBondContact O-N 2.84Å; L39-T42 PolarHBondContact O-OG1 2.99Å; L39-G43 PolarHBondContact O-N 3.05Å; L39-C294 HydrophobicContact CB-CB 3.73Å |
| 40 | G | 96.4 | Very high | 94.6 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -64.9 | -45 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | I36 N44 | I36-G40 VanDerWaalsContact O-CA 3.29Å; I36-G40 WeakPolarHBondContact O-CA 3.23Å; I36-G40 PolarHBondContact O-N 3.31Å; G40-N44 VanDerWaalsContact O-CB 3.25Å; G40-N44 WeakPolarHBondContact O-CB 3.44Å; G40-N44 PolarHBondContact O-N 2.93Å; G40-N44 PolarHBondContact O-ND2 3.23Å |
| 41 | L | 96.5 | Very high | 94.3 | Very high | 49 Ų | 49 | 45.4 Ų | 45.4 | 26% | 0.257 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -63.2 | -55 | -179.6 | -174.5 | 60.9 | 0 | 0 | 0 | 110.8 | F37 L45 L73 V76 | F37-L41 HydrophobicContact CE2-CD2 4.09Å; F37-L41 HydrophobicContact CZ-CD2 3.85Å; F37-L41 WeakPolarHBondContact O-CB 3.27Å; F37-L41 PolarHBondContact O-N 2.85Å; L41-L45 HydrophobicContact CD1-CD1 3.82Å; L41-L45 HydrophobicContact CD1-CG 4.25Å; L41-L45 HydrophobicContact CG-CD1 3.96Å; L41-L45 WeakPolarHBondContact O-CB 3.3Å; L41-L45 WeakPolarHBondContact O-CG 3.19Å; L41-L45 PolarHBondContact O-N 3.14Å; L41-L45 VanDerWaalsContact O-N 3.08Å; L41-L73 HydrophobicContact CD1-CD2 3.94Å; L41-V76 HydrophobicContact CB-CG1 3.65Å; L41-V76 HydrophobicContact CD1-CG1 4.16Å; L41-V76 HydrophobicContact CG-CG1 4.46Å |
| 42 | T | 93.4 | Very high | 93.8 | Very high | 79 Ų | 79 | 47.1 Ų | 47.1 | 49% | 0.485 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.9 | -47 | -177.4 | 54 | 0 | 0 | 0 | 0 | 111.7 | I38 L39 V46 | I38-T42 WeakPolarHBondContact O-CB 3.45Å; I38-T42 WeakPolarHBondContact O-CG2 3.34Å; I38-T42 PolarHBondContact O-N 3.21Å; I38-T42 VanDerWaalsContact O-N 3.14Å; I38-T42 PolarHBondContact O-OG1 3.37Å; L39-T42 PolarHBondContact O-OG1 2.99Å; T42-V46 VanDerWaalsContact O-CG2 3.27Å; T42-V46 WeakPolarHBondContact O-CG2 3.27Å; T42-V46 PolarHBondContact O-N 3.34Å; T42-V46 VanDerWaalsContact O-N 3.16Å |
| 43 | G | 92.8 | Very high | 93.1 | Very high | 18 Ų | 18 | 51 Ų | 51 | 19% | 0.186 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -65.1 | -45.3 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | L39 A47 | L39-G43 PolarHBondContact O-N 3.05Å; G43-A47 WeakPolarHBondContact O-CB 3.42Å; G43-A47 PolarHBondContact O-N 2.88Å |
| 44 | N | 95.3 | Very high | 92.2 | Very high | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -73.5 | -35.3 | -178.3 | -72 | -66.1 | 0 | 0 | 0 | 112.8 | G40 A47 L48 A69 L73 S293 F300 | G40-N44 VanDerWaalsContact O-CB 3.25Å; G40-N44 WeakPolarHBondContact O-CB 3.44Å; G40-N44 PolarHBondContact O-N 2.93Å; G40-N44 PolarHBondContact O-ND2 3.23Å; N44-A47 PolarHBondContact O-N 3.29Å; N44-L48 PolarHBondContact O-N 3.48Å; N44-A69 HydrophobicContact CB-CB 4.4Å; N44-L73 HydrophobicContact CB-CD2 3.77Å; N44-L73 HydrophobicContact CB-CG 3.83Å; N44-S293 PolarHBondContact ND2-O 2.99Å; N44-F300 WeakPolarHBondContact OD1-CE2 3.28Å |
| 45 | L | 94.4 | Very high | 91 | Very high | 93 Ų | 93 | 53.3 Ų | 53.3 | 49% | 0.487 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62.2 | -46.7 | 173.2 | -73.4 | 174.8 | 0 | 0 | 0 | 111.6 | L41 A47 L48 W49 L73 | L41-L45 HydrophobicContact CD1-CD1 3.82Å; L41-L45 HydrophobicContact CD1-CG 4.25Å; L41-L45 HydrophobicContact CG-CD1 3.96Å; L41-L45 WeakPolarHBondContact O-CB 3.3Å; L41-L45 WeakPolarHBondContact O-CG 3.19Å; L41-L45 PolarHBondContact O-N 3.14Å; L41-L45 VanDerWaalsContact O-N 3.08Å; L45-A47 VanDerWaalsContact C-N 3.29Å; L45-A47 PolarHBondContact O-N 2.92Å; L45-L48 PolarHBondContact O-N 3.13Å; L45-W49 WeakPolarHBondContact O-CB 3.32Å; L45-W49 PolarHBondContact O-N 3.5Å; L45-L73 HydrophobicContact CD2-CD1 3.91Å; L45-L73 HydrophobicContact CD2-CD2 4.15Å; L45-L73 HydrophobicContact CG-CD2 4.02Å |
| 46 | V | 91.1 | Very high | 89.3 | Confident | 42 Ų | 42 | 55.1 Ų | 55.1 | 26% | 0.255 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -61 | -41.3 | 176.1 | 170.6 | 0 | 0 | 0 | 0 | 110.9 | T42 A50 V311 | T42-V46 VanDerWaalsContact O-CG2 3.27Å; T42-V46 WeakPolarHBondContact O-CG2 3.27Å; T42-V46 PolarHBondContact O-N 3.34Å; T42-V46 VanDerWaalsContact O-N 3.16Å; V46-A50 WeakPolarHBondContact O-CB 3.31Å; V46-A50 PolarHBondContact O-N 2.87Å; V46-V311 HydrophobicContact CG1-CG2 4.26Å |
| 47 | A | 90.9 | Very high | 88.1 | Confident | 1 Ų | 1 | 63.4 Ų | 63.4 | 1% | 0.008 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -63.8 | -49.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | G43 N44 L45 W49 A50 F51 F300 | G43-A47 WeakPolarHBondContact O-CB 3.42Å; G43-A47 PolarHBondContact O-N 2.88Å; N44-A47 PolarHBondContact O-N 3.29Å; L45-A47 VanDerWaalsContact C-N 3.29Å; L45-A47 PolarHBondContact O-N 2.92Å; A47-W49 VanDerWaalsContact C-N 3.35Å; A47-W49 PolarHBondContact O-N 2.87Å; A47-A50 PolarHBondContact O-N 3.4Å; A47-F51 HydrophobicContact CB-CD2 4.45Å; A47-F51 HydrophobicContact CB-CE2 4.01Å; A47-F51 WeakPolarHBondContact O-CD2 3.42Å; A47-F51 VanDerWaalsContact O-CG 3.25Å; A47-F51 WeakPolarHBondContact O-CG 3.25Å; A47-F51 PolarHBondContact O-N 2.95Å; A47-F300 HydrophobicContact CB-CD2 3.42Å; A47-F300 VanDerWaalsContact CB-CD2 3.42Å; A47-F300 HydrophobicContact CB-CE2 3.93Å; A47-F300 HydrophobicContact CB-CG 4.39Å |
| 48 | L | 91.8 | Very high | 87.3 | Confident | 21 Ų | 21 | 65 Ų | 65 | 11% | 0.11 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -59.4 | -46 | 176.5 | -78.7 | -174 | 0 | 0 | 0 | 111.5 | N44 L45 A50 F51 F52 M66 A69 L73 | N44-L48 PolarHBondContact O-N 3.48Å; L45-L48 PolarHBondContact O-N 3.13Å; L48-A50 VanDerWaalsContact C-N 3.33Å; L48-A50 PolarHBondContact O-N 3.45Å; L48-F51 PolarHBondContact O-N 3.16Å; L48-F51 VanDerWaalsContact O-N 3.11Å; L48-F52 HydrophobicContact CB-CD2 4.37Å; L48-F52 HydrophobicContact CD2-CE2 4.08Å; L48-F52 VanDerWaalsContact O-CD2 3.24Å; L48-F52 WeakPolarHBondContact O-CD2 3.34Å; L48-F52 PolarHBondContact O-N 3.45Å; L48-M66 HydrophobicContact CD2-CB 4.27Å; L48-M66 WeakPolarHBondContact CD2-O 3.5Å; L48-A69 HydrophobicContact CD2-CB 3.77Å; L48-A69 HydrophobicContact CG-CB 3.82Å; L48-L73 HydrophobicContact CD1-CD1 3.41Å; L48-L73 VanDerWaalsContact CD1-CD1 3.41Å; L48-L73 HydrophobicContact CG-CD1 4.45Å |
| 49 | W | 90.5 | Very high | 86.7 | Confident | 124 Ų | 124 | 62.7 Ų | 62.7 | 47% | 0.47 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -56.8 | -47.1 | 176.2 | 178.3 | 83.2 | 0 | 0 | 0 | 111.6 | L45 A47 F51 F52 F53 V54 E310 | L45-W49 WeakPolarHBondContact O-CB 3.32Å; L45-W49 PolarHBondContact O-N 3.5Å; A47-W49 VanDerWaalsContact C-N 3.35Å; A47-W49 PolarHBondContact O-N 2.87Å; W49-F51 VanDerWaalsContact C-N 3.31Å; W49-F51 PolarHBondContact O-N 3.28Å; W49-F52 PolarHBondContact O-N 2.92Å; W49-F53 HydrophobicContact CB-CD2 4.5Å; W49-F53 AromaticContact CD1-CD2 3.31Å; W49-F53 AromaticContact CD1-CE2 3.77Å; W49-F53 AromaticContact CG-CD2 3.96Å; W49-F53 HydrophobicContact CG-CD2 3.96Å; W49-F53 AromaticContact NE1-CD2 3.67Å; W49-F53 WeakPolarHBondContact O-CB 3.42Å; W49-F53 WeakPolarHBondContact O-CD2 3.38Å; W49-F53 PolarHBondContact O-N 2.81Å; W49-V54 HydrophobicContact CH2-CG2 4.19Å; W49-V54 HydrophobicContact CZ3-CG2 4.17Å; W49-E310 HydrophobicContact CE3-CB 4.35Å; W49-E310 HydrophobicContact CE3-CG 4.09Å; W49-E310 HydrophobicContact CH2-CG 4.33Å; W49-E310 WeakPolarHBondContact CH2-OE2 3.44Å; W49-E310 HydrophobicContact CZ3-CB 3.81Å; W49-E310 HydrophobicContact CZ3-CG 3.45Å; W49-E310 VanDerWaalsContact CZ3-CG 3.45Å; W49-E310 WeakPolarHBondContact CZ3-OE2 3.34Å |
| 50 | A | 87.9 | Confident | 86.4 | Confident | 0 Ų | 0 | 58.5 Ų | 58.5 | 0% | 0 | 30% | 0.296 | C | S | . | . | I | π-helix | trans | -62.2 | -37 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | V46 A47 L48 V54 H55 V307 E310 | V46-A50 WeakPolarHBondContact O-CB 3.31Å; V46-A50 PolarHBondContact O-N 2.87Å; A47-A50 PolarHBondContact O-N 3.4Å; L48-A50 VanDerWaalsContact C-N 3.33Å; L48-A50 PolarHBondContact O-N 3.45Å; A50-V54 VanDerWaalsContact O-CB 3.32Å; A50-V54 WeakPolarHBondContact O-CB 3.36Å; A50-V54 PolarHBondContact O-N 2.79Å; A50-H55 PolarHBondContact O-N 3.44Å; A50-V307 HydrophobicContact CB-CG2 4.07Å; A50-E310 HydrophobicContact CB-CB 4.15Å; A50-E310 HydrophobicContact CB-CG 3.76Å |
| 51 | F | 87.3 | Confident | 86 | Confident | 0 Ų | 0 | 59.6 Ų | 59.6 | 0% | 0 | 30% | 0.301 | C | S | . | . | I | π-helix | trans | -73.4 | -35.3 | 178.6 | -64.9 | -46 | 0 | 0 | 0 | 113.5 | A47 L48 W49 L65 M66 F300 V307 | A47-F51 HydrophobicContact CB-CD2 4.45Å; A47-F51 HydrophobicContact CB-CE2 4.01Å; A47-F51 WeakPolarHBondContact O-CD2 3.42Å; A47-F51 VanDerWaalsContact O-CG 3.25Å; A47-F51 WeakPolarHBondContact O-CG 3.25Å; A47-F51 PolarHBondContact O-N 2.95Å; L48-F51 PolarHBondContact O-N 3.16Å; L48-F51 VanDerWaalsContact O-N 3.11Å; W49-F51 VanDerWaalsContact C-N 3.31Å; W49-F51 PolarHBondContact O-N 3.28Å; F51-L65 HydrophobicContact CE1-CB 4.44Å; F51-L65 HydrophobicContact CE1-CD1 4.26Å; F51-L65 HydrophobicContact CE2-CB 3.87Å; F51-L65 HydrophobicContact CZ-CB 3.72Å; F51-L65 HydrophobicContact CZ-CD1 3.95Å; F51-L65 HydrophobicContact CZ-CG 4.47Å; F51-M66 HydrophobicContact CB-CE 3.88Å; F51-M66 HydrophobicContact CB-CG 3.47Å; F51-M66 VanDerWaalsContact CB-CG 3.47Å; F51-M66 HydrophobicContact CB-SD 3.84Å; F51-M66 HydrophobicContact CD2-CG 3.73Å; F51-M66 HydrophobicContact CG-CG 3.77Å; F51-F300 HydrophobicContact CE2-CD2 4.47Å; F51-F300 HydrophobicContact CZ-CB 4.48Å; F51-F300 HydrophobicContact CZ-CG 4.39Å; F51-V307 HydrophobicContact CD1-CG2 4.31Å; F51-V307 HydrophobicContact CE1-CG2 3.67Å; F51-V307 HydrophobicContact CE2-CG2 4.42Å; F51-V307 HydrophobicContact CZ-CG2 3.71Å |
| 52 | F | 85.9 | Confident | 85.7 | Confident | 113 Ų | 113 | 57.9 Ų | 57.9 | 50% | 0.496 | 29% | 0.292 | S | S | . | . | I | π-helix | trans | -80.7 | -44 | 179.9 | -81.2 | -71.8 | 0 | 0 | 0 | 113.2 | L48 W49 M66 | L48-F52 HydrophobicContact CB-CD2 4.37Å; L48-F52 HydrophobicContact CD2-CE2 4.08Å; L48-F52 VanDerWaalsContact O-CD2 3.24Å; L48-F52 WeakPolarHBondContact O-CD2 3.34Å; L48-F52 PolarHBondContact O-N 3.45Å; W49-F52 PolarHBondContact O-N 2.92Å; F52-M66 HydrophobicContact CD1-CE 3.41Å; F52-M66 VanDerWaalsContact CD1-CE 3.41Å; F52-M66 HydrophobicContact CD2-CE 3.51Å; F52-M66 HydrophobicContact CE1-CE 3.28Å; F52-M66 HydrophobicContact CE2-CE 3.38Å; F52-M66 HydrophobicContact CG-CE 3.52Å; F52-M66 HydrophobicContact CZ-CE 3.26Å |
| 53 | F | 81.9 | Confident | 85.7 | Confident | 156 Ų | 156 | 54.6 Ų | 54.6 | 68% | 0.684 | 27% | 0.272 | S | S | * | . | I | π-helix | trans | -104.3 | -24.1 | -166.4 | -62.8 | -75.7 | 0 | 0 | 0 | 114.2 | W49 | W49-F53 HydrophobicContact CB-CD2 4.5Å; W49-F53 AromaticContact CD1-CD2 3.31Å; W49-F53 AromaticContact CD1-CE2 3.77Å; W49-F53 AromaticContact CG-CD2 3.96Å; W49-F53 HydrophobicContact CG-CD2 3.96Å; W49-F53 AromaticContact NE1-CD2 3.67Å; W49-F53 WeakPolarHBondContact O-CB 3.42Å; W49-F53 WeakPolarHBondContact O-CD2 3.38Å; W49-F53 PolarHBondContact O-N 2.81Å |
| 54 | V | 77.8 | Confident | 85.7 | Confident | 38 Ų | 38 | 53.8 Ų | 53.8 | 23% | 0.23 | 26% | 0.263 | C | S | . | . | I | π-helix | trans | -100.6 | -23.9 | -175.8 | -178.6 | 0 | 0 | 0 | 0 | 111.8 | W49 A50 E310 | W49-V54 HydrophobicContact CH2-CG2 4.19Å; W49-V54 HydrophobicContact CZ3-CG2 4.17Å; A50-V54 VanDerWaalsContact O-CB 3.32Å; A50-V54 WeakPolarHBondContact O-CB 3.36Å; A50-V54 PolarHBondContact O-N 2.79Å; V54-E310 HydrophobicContact CB-CG 4.36Å; V54-E310 HydrophobicContact CG1-CG 4.34Å; V54-E310 VanDerWaalsContact CG1-OE1 3.31Å; V54-E310 WeakPolarHBondContact CG1-OE1 3.14Å; V54-E310 HydrophobicContact CG2-CG 3.72Å |
| 55 | H | 72.6 | Confident | 85.6 | Confident | 52 Ų | 52 | 53.9 Ų | 53.9 | 24% | 0.241 | 26% | 0.264 | C | S | . | . | trans | -108.4 | 99 | -175.4 | -151.8 | 87.7 | 0 | 0 | 0 | 112.6 | A50 K57 Q62 S306 | A50-H55 PolarHBondContact O-N 3.44Å; H55-K57 VanDerWaalsContact C-N 3.34Å; H55-K57 PolarHBondContact CD2-O 3.32Å; H55-K57 PolarHBondContact NE2-O 3.29Å; H55-K57 VanDerWaalsContact NE2-O 3.09Å; H55-K57 PolarHBondContact O-N 3.38Å; H55-Q62 PolarHBondContact CD2-NE2 3.23Å; H55-Q62 PolarHBondContact CD2-OE1 3.04Å; H55-Q62 PolarHBondContact CE1-NE2 2.89Å; H55-Q62 VanDerWaalsContact CG-NE2 3.28Å; H55-Q62 PolarHBondContact ND1-NE2 3.34Å; H55-Q62 PolarHBondContact NE2-NE2 3.15Å; H55-S306 PolarHBondContact ND1-OG 3.4Å | ||
| 56 | S | 61.9 | Low | 85.5 | Confident | 122 Ų | 122 | 50.1 Ų | 50.1 | 85% | 0.853 | 24% | 0.244 | S | C | * | . | S | Bend | trans | -72.6 | -19.7 | -176.3 | -46.3 | 0 | 0 | 0 | 0 | 114.8 | ||
| 57 | K | 72.4 | Confident | 85.8 | Confident | 174 Ų | 174 | 49.6 Ų | 49.6 | 76% | 0.757 | 24% | 0.24 | S | C | * | . | S | Bend | trans | -118.5 | 96.5 | -177.5 | -69.6 | -172.2 | -178.7 | -179.7 | 0 | 112.7 | H55 N59 Q62 | H55-K57 VanDerWaalsContact C-N 3.34Å; H55-K57 PolarHBondContact CD2-O 3.32Å; H55-K57 PolarHBondContact NE2-O 3.29Å; H55-K57 VanDerWaalsContact NE2-O 3.09Å; H55-K57 PolarHBondContact O-N 3.38Å; K57-N59 PolarHBondContact O-N 3.43Å; K57-Q62 PolarHBondContact O-OE1 3.37Å |
| 58 | K | 79.5 | Confident | 86 | Confident | 93 Ų | 93 | 49.6 Ų | 49.6 | 40% | 0.404 | 24% | 0.239 | S | C | . | . | trans | -68.6 | 122.7 | 177.7 | -61.3 | -173.4 | -177.8 | -179.8 | 0 | 111.3 | M66 P141 | K58-M66 HydrophobicContact CD-SD 4.19Å; K58-P141 WeakPolarHBondContact O-CG 3.15Å | ||
| 59 | N | 84.9 | Confident | 86.2 | Confident | 54 Ų | 54 | 48.6 Ų | 48.6 | 29% | 0.289 | 23% | 0.234 | S | C | . | . | trans | -105.8 | 170.9 | 170.1 | 68.6 | 24.5 | 0 | 0 | 0 | 110.8 | K57 L61 Q62 V63 | K57-N59 PolarHBondContact O-N 3.43Å; N59-L61 VanDerWaalsContact C-N 3.29Å; N59-L61 PolarHBondContact O-N 3.21Å; N59-L61 PolarHBondContact OD1-N 3.1Å; N59-Q62 PolarHBondContact O-N 2.93Å; N59-Q62 VanDerWaalsContact O-N 3.1Å; N59-Q62 WeakPolarHBondContact OD1-CG 3.46Å; N59-Q62 PolarHBondContact OD1-N 3.43Å; N59-V63 PolarHBondContact O-N 3.09Å | ||
| 60 | S | 89.5 | Confident | 86.5 | Confident | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -50.3 | -46.9 | -178.7 | 171.3 | 0 | 0 | 0 | 0 | 113.5 | Q62 V63 F64 D123 M138 S144 | S60-Q62 PolarHBondContact O-N 3.24Å; S60-V63 PolarHBondContact O-N 2.99Å; S60-F64 WeakPolarHBondContact O-CD2 3.49Å; S60-F64 PolarHBondContact O-N 3.45Å; S60-D123 VanDerWaalsContact CB-OD1 3.23Å; S60-D123 WeakPolarHBondContact CB-OD1 3.43Å; S60-D123 PolarHBondContact OG-OD1 3.26Å; S60-M138 WeakPolarHBondContact CB-O 3.26Å; S60-S144 WeakPolarHBondContact CA-OG 3.28Å; S60-S144 PolarHBondContact O-OG 3.12Å |
| 61 | L | 87.9 | Confident | 86.9 | Confident | 23 Ų | 23 | 47.4 Ų | 47.4 | 12% | 0.12 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.6 | -44.3 | 179.3 | 172.9 | 64.7 | 0 | 0 | 0 | 112.1 | N59 V63 F64 L65 I120 R124 | N59-L61 VanDerWaalsContact C-N 3.29Å; N59-L61 PolarHBondContact O-N 3.21Å; N59-L61 PolarHBondContact OD1-N 3.1Å; L61-V63 VanDerWaalsContact C-N 3.31Å; L61-V63 PolarHBondContact O-N 2.68Å; L61-F64 PolarHBondContact O-N 2.8Å; L61-L65 HydrophobicContact CD1-CD1 4.13Å; L61-L65 HydrophobicContact CD1-CD2 4.42Å; L61-L65 HydrophobicContact CD1-CG 4.09Å; L61-L65 HydrophobicContact CG-CD1 3.96Å; L61-L65 HydrophobicContact CG-CG 4.31Å; L61-L65 WeakPolarHBondContact O-CG 3.24Å; L61-L65 PolarHBondContact O-N 3.05Å; L61-I120 HydrophobicContact CD1-CB 4.44Å; L61-I120 HydrophobicContact CD1-CG1 4.1Å; L61-I120 HydrophobicContact CD1-CG2 3.73Å; L61-R124 VanDerWaalsContact CD2-NH2 3.34Å |
| 62 | Q | 89 | Confident | 87.4 | Confident | 13 Ų | 13 | 47.4 Ų | 47.4 | 6% | 0.061 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -64.2 | -37.4 | -179.4 | -77.3 | 172.6 | 7.9 | 0 | 0 | 112.5 | H55 K57 N59 S60 F64 L65 M66 | H55-Q62 PolarHBondContact CD2-NE2 3.23Å; H55-Q62 PolarHBondContact CD2-OE1 3.04Å; H55-Q62 PolarHBondContact CE1-NE2 2.89Å; H55-Q62 VanDerWaalsContact CG-NE2 3.28Å; H55-Q62 PolarHBondContact ND1-NE2 3.34Å; H55-Q62 PolarHBondContact NE2-NE2 3.15Å; K57-Q62 PolarHBondContact O-OE1 3.37Å; N59-Q62 PolarHBondContact O-N 2.93Å; N59-Q62 VanDerWaalsContact O-N 3.1Å; N59-Q62 WeakPolarHBondContact OD1-CG 3.46Å; N59-Q62 PolarHBondContact OD1-N 3.43Å; S60-Q62 PolarHBondContact O-N 3.24Å; Q62-F64 VanDerWaalsContact C-N 3.31Å; Q62-F64 PolarHBondContact O-N 3.49Å; Q62-L65 PolarHBondContact O-N 3.42Å; Q62-M66 WeakPolarHBondContact O-CB 3.39Å; Q62-M66 WeakPolarHBondContact O-CG 3.25Å; Q62-M66 PolarHBondContact O-N 3.37Å |
| 63 | V | 93.3 | Very high | 87.9 | Confident | 10 Ų | 10 | 43 Ų | 43 | 6% | 0.061 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -59.6 | -45.4 | 175.2 | 176.8 | 0 | 0 | 0 | 0 | 110.2 | N59 S60 L61 M66 N67 P141 S144 I145 | N59-V63 PolarHBondContact O-N 3.09Å; S60-V63 PolarHBondContact O-N 2.99Å; L61-V63 VanDerWaalsContact C-N 3.31Å; L61-V63 PolarHBondContact O-N 2.68Å; V63-M66 PolarHBondContact O-N 2.86Å; V63-N67 PolarHBondContact O-N 3.3Å; V63-N67 PolarHBondContact O-ND2 2.9Å; V63-P141 HydrophobicContact CG2-CB 3.89Å; V63-S144 VanDerWaalsContact CB-OG 3.26Å; V63-S144 WeakPolarHBondContact CB-OG 3.2Å; V63-S144 WeakPolarHBondContact CG2-OG 3.48Å; V63-I145 HydrophobicContact CG1-CG1 3.99Å; V63-I145 HydrophobicContact CG2-CG1 4.07Å |
| 64 | F | 93.6 | Very high | 88.6 | Confident | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -62.9 | -45 | 176.2 | -63.7 | -46.1 | 0 | 0 | 0 | 112.9 | S60 L61 Q62 M66 N67 L68 L116 L119 I120 D123 W143 V147 C148 | S60-F64 WeakPolarHBondContact O-CD2 3.49Å; S60-F64 PolarHBondContact O-N 3.45Å; L61-F64 PolarHBondContact O-N 2.8Å; Q62-F64 VanDerWaalsContact C-N 3.31Å; Q62-F64 PolarHBondContact O-N 3.49Å; F64-M66 VanDerWaalsContact C-N 3.31Å; F64-M66 PolarHBondContact O-N 3.32Å; F64-N67 PolarHBondContact O-N 3.19Å; F64-L68 WeakPolarHBondContact O-CB 3.02Å; F64-L68 PolarHBondContact O-N 2.96Å; F64-L116 HydrophobicContact CD1-CD2 3.82Å; F64-L119 HydrophobicContact CD1-CB 4.5Å; F64-L119 HydrophobicContact CE1-CB 4.13Å; F64-L119 HydrophobicContact CE1-CD1 4Å; F64-L119 HydrophobicContact CE2-CB 4.14Å; F64-L119 HydrophobicContact CZ-CB 3.92Å; F64-L119 HydrophobicContact CZ-CD1 4.35Å; F64-I120 HydrophobicContact CB-CD1 3.98Å; F64-I120 HydrophobicContact CB-CG1 3.58Å; F64-I120 HydrophobicContact CD2-CG1 4.1Å; F64-I120 HydrophobicContact CG-CG1 4.16Å; F64-D123 HydrophobicContact CE2-CB 4.24Å; F64-W143 HydrophobicContact CE2-CE3 4.46Å; F64-W143 HydrophobicContact CE2-CH2 4.23Å; F64-W143 AromaticContact CE2-CZ3 3.59Å; F64-W143 HydrophobicContact CE2-CZ3 3.59Å; F64-W143 HydrophobicContact CZ-CE3 4.09Å; F64-W143 AromaticContact CZ-CH2 3.78Å; F64-W143 HydrophobicContact CZ-CH2 3.78Å; F64-W143 AromaticContact CZ-CZ3 3.33Å; F64-W143 HydrophobicContact CZ-CZ3 3.33Å; F64-V147 HydrophobicContact CE1-CG1 4.39Å; F64-C148 VanDerWaalsContact CD1-SG 3.51Å |
| 65 | L | 92.6 | Very high | 89.5 | Confident | 2 Ų | 2 | 36.4 Ų | 36.4 | 1% | 0.01 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -63.5 | -35.9 | 178.6 | -63.2 | 175.9 | 0 | 0 | 0 | 112.4 | F51 L61 Q62 L68 A69 I120 F300 | F51-L65 HydrophobicContact CE1-CB 4.44Å; F51-L65 HydrophobicContact CE1-CD1 4.26Å; F51-L65 HydrophobicContact CE2-CB 3.87Å; F51-L65 HydrophobicContact CZ-CB 3.72Å; F51-L65 HydrophobicContact CZ-CD1 3.95Å; F51-L65 HydrophobicContact CZ-CG 4.47Å; L61-L65 HydrophobicContact CD1-CD1 4.13Å; L61-L65 HydrophobicContact CD1-CD2 4.42Å; L61-L65 HydrophobicContact CD1-CG 4.09Å; L61-L65 HydrophobicContact CG-CD1 3.96Å; L61-L65 HydrophobicContact CG-CG 4.31Å; L61-L65 WeakPolarHBondContact O-CG 3.24Å; L61-L65 PolarHBondContact O-N 3.05Å; Q62-L65 PolarHBondContact O-N 3.42Å; L65-L68 PolarHBondContact O-N 3.25Å; L65-A69 WeakPolarHBondContact O-CB 3.39Å; L65-A69 PolarHBondContact O-N 3.4Å; L65-I120 HydrophobicContact CD2-CD1 3.76Å; L65-F300 HydrophobicContact CB-CE1 4.33Å; L65-F300 HydrophobicContact CD2-CD1 3.73Å; L65-F300 HydrophobicContact CD2-CE1 3.64Å |
| 66 | M | 93.7 | Very high | 90.7 | Very high | 14 Ų | 14 | 33.9 Ų | 33.9 | 7% | 0.069 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -67.4 | -42.5 | 175.1 | -70.2 | 174.4 | 88.2 | 0 | 0 | 111.8 | L48 F51 F52 K58 Q62 V63 F64 L68 F70 | L48-M66 HydrophobicContact CD2-CB 4.27Å; L48-M66 WeakPolarHBondContact CD2-O 3.5Å; F51-M66 HydrophobicContact CB-CE 3.88Å; F51-M66 HydrophobicContact CB-CG 3.47Å; F51-M66 VanDerWaalsContact CB-CG 3.47Å; F51-M66 HydrophobicContact CB-SD 3.84Å; F51-M66 HydrophobicContact CD2-CG 3.73Å; F51-M66 HydrophobicContact CG-CG 3.77Å; F52-M66 HydrophobicContact CD1-CE 3.41Å; F52-M66 VanDerWaalsContact CD1-CE 3.41Å; F52-M66 HydrophobicContact CD2-CE 3.51Å; F52-M66 HydrophobicContact CE1-CE 3.28Å; F52-M66 HydrophobicContact CE2-CE 3.38Å; F52-M66 HydrophobicContact CG-CE 3.52Å; F52-M66 HydrophobicContact CZ-CE 3.26Å; K58-M66 HydrophobicContact CD-SD 4.19Å; Q62-M66 WeakPolarHBondContact O-CB 3.39Å; Q62-M66 WeakPolarHBondContact O-CG 3.25Å; Q62-M66 PolarHBondContact O-N 3.37Å; V63-M66 PolarHBondContact O-N 2.86Å; F64-M66 VanDerWaalsContact C-N 3.31Å; F64-M66 PolarHBondContact O-N 3.32Å; M66-L68 VanDerWaalsContact C-N 3.33Å; M66-F70 WeakPolarHBondContact O-CB 3.34Å; M66-F70 PolarHBondContact O-N 3.09Å |
| 67 | N | 96.2 | Very high | 92.4 | Very high | 32 Ų | 32 | 32.3 Ų | 32.3 | 17% | 0.171 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -67.4 | -35.8 | 176.7 | -79.1 | -91 | 0 | 0 | 0 | 111.8 | V63 F64 F70 A71 L116 C148 W152 | V63-N67 PolarHBondContact O-N 3.3Å; V63-N67 PolarHBondContact O-ND2 2.9Å; F64-N67 PolarHBondContact O-N 3.19Å; N67-F70 PolarHBondContact O-N 3.28Å; N67-A71 WeakPolarHBondContact O-CB 3.37Å; N67-A71 PolarHBondContact O-N 2.94Å; N67-L116 HydrophobicContact CB-CD1 3.89Å; N67-L116 HydrophobicContact CB-CD2 4.32Å; N67-C148 PolarHBondContact ND2-SG 2.95Å; N67-W152 PolarHBondContact OD1-NE1 2.83Å |
| 68 | L | 95.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -63.8 | -51.9 | 175.7 | -175.2 | 58.1 | 0 | 0 | 0 | 110.5 | F64 L65 M66 F70 A71 D72 S113 L116 L117 I120 D296 F300 | F64-L68 WeakPolarHBondContact O-CB 3.02Å; F64-L68 PolarHBondContact O-N 2.96Å; L65-L68 PolarHBondContact O-N 3.25Å; M66-L68 VanDerWaalsContact C-N 3.33Å; L68-F70 VanDerWaalsContact C-N 3.26Å; L68-F70 PolarHBondContact O-N 3.38Å; L68-A71 PolarHBondContact O-N 3.11Å; L68-A71 VanDerWaalsContact O-N 3.12Å; L68-D72 PolarHBondContact O-N 2.95Å; L68-S113 VanDerWaalsContact CD1-OG 3.31Å; L68-S113 WeakPolarHBondContact CD1-OG 3.29Å; L68-L116 HydrophobicContact CB-CD1 4.03Å; L68-L116 HydrophobicContact CD1-CB 4.43Å; L68-L116 HydrophobicContact CD1-CD1 4.34Å; L68-L117 HydrophobicContact CD2-CD2 3.74Å; L68-L117 HydrophobicContact CD2-CG 4.21Å; L68-I120 HydrophobicContact CD2-CD1 4.28Å; L68-D296 WeakPolarHBondContact CD2-OD2 3.45Å; L68-D296 WeakPolarHBondContact CG-OD2 3.18Å; L68-F300 HydrophobicContact CB-CZ 4.42Å; L68-F300 HydrophobicContact CD2-CE1 3.97Å; L68-F300 HydrophobicContact CD2-CZ 4.22Å; L68-F300 HydrophobicContact CG-CE1 4.45Å; L68-F300 HydrophobicContact CG-CZ 4.21Å |
| 69 | A | 96 | Very high | 94.2 | Very high | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -59.7 | -35.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | N44 L48 L65 L73 F300 | N44-A69 HydrophobicContact CB-CB 4.4Å; L48-A69 HydrophobicContact CD2-CB 3.77Å; L48-A69 HydrophobicContact CG-CB 3.82Å; L65-A69 WeakPolarHBondContact O-CB 3.39Å; L65-A69 PolarHBondContact O-N 3.4Å; A69-L73 WeakPolarHBondContact O-CG 3.41Å; A69-L73 PolarHBondContact O-N 2.94Å; A69-F300 HydrophobicContact CB-CE2 3.81Å; A69-F300 HydrophobicContact CB-CZ 4.09Å |
| 70 | F | 96.7 | Very high | 94.8 | Very high | 98 Ų | 98 | 19.9 Ų | 19.9 | 43% | 0.43 | 11% | 0.108 | S | C | . | . | H | α-helix | trans | -68.1 | -44.7 | 174.8 | -176.7 | -102.6 | 0 | 0 | 0 | 112.1 | M66 N67 L68 D72 L73 L74 W152 | M66-F70 WeakPolarHBondContact O-CB 3.34Å; M66-F70 PolarHBondContact O-N 3.09Å; N67-F70 PolarHBondContact O-N 3.28Å; L68-F70 VanDerWaalsContact C-N 3.26Å; L68-F70 PolarHBondContact O-N 3.38Å; F70-D72 VanDerWaalsContact C-N 3.29Å; F70-D72 PolarHBondContact O-N 3.16Å; F70-L73 PolarHBondContact O-N 2.99Å; F70-L74 HydrophobicContact CD1-CD1 4.38Å; F70-L74 HydrophobicContact CE1-CD1 3.95Å; F70-L74 HydrophobicContact CE1-CG 4.3Å; F70-L74 HydrophobicContact CZ-CD2 4.34Å; F70-L74 PolarHBondContact O-N 2.89Å; F70-L74 VanDerWaalsContact O-N 3.15Å; F70-W152 AromaticContact CD1-CH2 3.5Å; F70-W152 HydrophobicContact CD1-CH2 3.5Å; F70-W152 AromaticContact CD1-CZ2 3.54Å; F70-W152 HydrophobicContact CD1-CZ2 3.54Å; F70-W152 HydrophobicContact CD1-CZ3 4.32Å; F70-W152 AromaticContact CE1-CH2 3.75Å; F70-W152 HydrophobicContact CE1-CH2 3.75Å; F70-W152 HydrophobicContact CE1-CZ2 4.12Å; F70-W152 HydrophobicContact CE1-CZ3 4.12Å |
| 71 | A | 97.1 | Very high | 95.1 | Very high | 1 Ų | 1 | 23.5 Ų | 23.5 | 1% | 0.008 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.2 | -39.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | N67 L68 L74 L75 N109 V112 W152 | N67-A71 WeakPolarHBondContact O-CB 3.37Å; N67-A71 PolarHBondContact O-N 2.94Å; L68-A71 PolarHBondContact O-N 3.11Å; L68-A71 VanDerWaalsContact O-N 3.12Å; A71-L74 WeakPolarHBondContact O-CB 3.25Å; A71-L74 PolarHBondContact O-N 3.05Å; A71-L75 PolarHBondContact O-N 3.14Å; A71-N109 PolarHBondContact O-ND2 2.9Å; A71-V112 HydrophobicContact CB-CB 4.45Å; A71-V112 HydrophobicContact CB-CG1 3.81Å; A71-W152 HydrophobicContact CB-CH2 4.14Å; A71-W152 HydrophobicContact CB-CZ2 4.19Å |
| 72 | D | 97.3 | Very high | 95.3 | Very high | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -64.3 | -39.3 | 175.9 | -71.4 | -33.1 | 0 | 0 | 0 | 112.7 | L68 F70 L74 L75 V76 N109 S293 D296 | L68-D72 PolarHBondContact O-N 2.95Å; F70-D72 VanDerWaalsContact C-N 3.29Å; F70-D72 PolarHBondContact O-N 3.16Å; D72-L74 VanDerWaalsContact C-N 3.31Å; D72-L74 PolarHBondContact O-N 3.15Å; D72-L75 PolarHBondContact O-N 3.26Å; D72-V76 WeakPolarHBondContact O-CB 3.34Å; D72-V76 WeakPolarHBondContact O-CG2 3.43Å; D72-V76 PolarHBondContact O-N 2.92Å; D72-N109 VanDerWaalsContact CA-ND2 3.28Å; D72-N109 WeakPolarHBondContact CA-ND2 3.17Å; D72-N109 PolarHBondContact N-ND2 3.45Å; D72-N109 PolarHBondContact OD1-ND2 3.33Å; D72-S293 WeakPolarHBondContact OD1-CA 3.33Å; D72-S293 WeakPolarHBondContact OD1-CB 3.39Å; D72-S293 PolarHBondContact OD1-OG 3.06Å; D72-D296 VanDerWaalsContact OD2-OD2 3.09Å |
| 73 | L | 97.4 | Very high | 95.6 | Very high | 22 Ų | 22 | 23 Ų | 23 | 12% | 0.115 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -63.5 | -37.5 | 174.4 | -73 | 175.3 | 0 | 0 | 0 | 112.5 | L41 N44 L45 L48 A69 F70 L75 V76 V77 | L41-L73 HydrophobicContact CD1-CD2 3.94Å; N44-L73 HydrophobicContact CB-CD2 3.77Å; N44-L73 HydrophobicContact CB-CG 3.83Å; L45-L73 HydrophobicContact CD2-CD1 3.91Å; L45-L73 HydrophobicContact CD2-CD2 4.15Å; L45-L73 HydrophobicContact CG-CD2 4.02Å; L48-L73 HydrophobicContact CD1-CD1 3.41Å; L48-L73 VanDerWaalsContact CD1-CD1 3.41Å; L48-L73 HydrophobicContact CG-CD1 4.45Å; A69-L73 WeakPolarHBondContact O-CG 3.41Å; A69-L73 PolarHBondContact O-N 2.94Å; F70-L73 PolarHBondContact O-N 2.99Å; L73-L75 VanDerWaalsContact C-N 3.34Å; L73-L75 PolarHBondContact O-N 3.47Å; L73-V76 PolarHBondContact O-N 2.55Å; L73-V77 WeakPolarHBondContact O-CB 3.17Å; L73-V77 WeakPolarHBondContact O-CG2 3.48Å; L73-V77 PolarHBondContact O-N 3.39Å |
| 74 | L | 96.5 | Very high | 95.6 | Very high | 54 Ų | 54 | 26 Ų | 26 | 28% | 0.283 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -60.7 | -43.8 | 174.8 | -65.8 | 179.4 | 0 | 0 | 0 | 111.4 | F70 A71 D72 C78 W152 | F70-L74 HydrophobicContact CD1-CD1 4.38Å; F70-L74 HydrophobicContact CE1-CD1 3.95Å; F70-L74 HydrophobicContact CE1-CG 4.3Å; F70-L74 HydrophobicContact CZ-CD2 4.34Å; F70-L74 PolarHBondContact O-N 2.89Å; F70-L74 VanDerWaalsContact O-N 3.15Å; A71-L74 WeakPolarHBondContact O-CB 3.25Å; A71-L74 PolarHBondContact O-N 3.05Å; D72-L74 VanDerWaalsContact C-N 3.31Å; D72-L74 PolarHBondContact O-N 3.15Å; L74-C78 PolarHBondContact O-N 3.29Å; L74-C78 PolarHBondContact O-SG 3.4Å; L74-W152 HydrophobicContact CD1-CH2 3.63Å; L74-W152 HydrophobicContact CD1-CZ3 3.67Å |
| 75 | L | 96.8 | Very high | 95.5 | Very high | 0 Ų | 0 | 26.1 Ų | 26.1 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -65 | -49.4 | 174.5 | 170.3 | 56 | 0 | 0 | 0 | 111.5 | A71 D72 L73 V77 C78 L79 F106 N109 A290 S293 | A71-L75 PolarHBondContact O-N 3.14Å; D72-L75 PolarHBondContact O-N 3.26Å; L73-L75 VanDerWaalsContact C-N 3.34Å; L73-L75 PolarHBondContact O-N 3.47Å; L75-V77 VanDerWaalsContact C-N 3.3Å; L75-V77 PolarHBondContact O-N 3.5Å; L75-C78 CarbonylContact O-C 3.59Å; L75-C78 WeakPolarHBondContact O-CA 3.45Å; L75-C78 VanDerWaalsContact O-CB 3.26Å; L75-C78 WeakPolarHBondContact O-CB 3.47Å; L75-C78 PolarHBondContact O-N 2.87Å; L75-L79 HydrophobicContact CD1-CD2 3.79Å; L75-L79 HydrophobicContact CD1-CG 4.4Å; L75-L79 HydrophobicContact CG-CD2 4.29Å; L75-L79 PolarHBondContact O-N 2.87Å; L75-L79 VanDerWaalsContact O-N 3.12Å; L75-F106 HydrophobicContact CD1-CB 4.32Å; L75-F106 HydrophobicContact CD1-CD2 3.28Å; L75-F106 HydrophobicContact CD1-CE2 3.69Å; L75-F106 HydrophobicContact CD1-CG 3.99Å; L75-F106 HydrophobicContact CD2-CE2 4.43Å; L75-N109 HydrophobicContact CB-CB 3.69Å; L75-N109 HydrophobicContact CD2-CB 4.11Å; L75-N109 VanDerWaalsContact CD2-OD1 3.29Å; L75-N109 WeakPolarHBondContact CD2-OD1 3.32Å; L75-N109 HydrophobicContact CG-CB 4.43Å; L75-A290 HydrophobicContact CD2-CB 4.4Å; L75-S293 WeakPolarHBondContact CD2-OG 3.31Å |
| 76 | V | 97.4 | Very high | 95.4 | Very high | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -58.5 | -41.7 | -176.2 | 165.8 | 0 | 0 | 0 | 0 | 111.3 | F37 L41 D72 L73 C78 L79 P80 | F37-V76 HydrophobicContact CD2-CG1 3.61Å; F37-V76 VanDerWaalsContact CD2-O 3.27Å; F37-V76 WeakPolarHBondContact CD2-O 3.47Å; F37-V76 HydrophobicContact CE2-CG1 4.05Å; L41-V76 HydrophobicContact CB-CG1 3.65Å; L41-V76 HydrophobicContact CD1-CG1 4.16Å; L41-V76 HydrophobicContact CG-CG1 4.46Å; D72-V76 WeakPolarHBondContact O-CB 3.34Å; D72-V76 WeakPolarHBondContact O-CG2 3.43Å; D72-V76 PolarHBondContact O-N 2.92Å; L73-V76 PolarHBondContact O-N 2.55Å; V76-C78 PolarHBondContact O-N 2.92Å; V76-L79 HydrophobicContact CG2-CD1 4.47Å; V76-L79 WeakPolarHBondContact O-CB 3.42Å; V76-L79 PolarHBondContact O-N 2.99Å; V76-L79 VanDerWaalsContact O-N 3.12Å; V76-P80 VanDerWaalsContact O-CD 3.28Å; V76-P80 WeakPolarHBondContact O-CD 3.24Å |
| 77 | V | 96.3 | Very high | 95.2 | Very high | 88 Ų | 88 | 31.1 Ų | 31.1 | 53% | 0.533 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -63.5 | -23.9 | 174.6 | 169.4 | 0 | 0 | 0 | 0 | 112.5 | L73 L75 P80 | L73-V77 WeakPolarHBondContact O-CB 3.17Å; L73-V77 WeakPolarHBondContact O-CG2 3.48Å; L73-V77 PolarHBondContact O-N 3.39Å; L75-V77 VanDerWaalsContact C-N 3.3Å; L75-V77 PolarHBondContact O-N 3.5Å; V77-P80 WeakPolarHBondContact O-CD 3.4Å |
| 78 | C | 95.1 | Very high | 94.9 | Very high | 11 Ų | 11 | 32.2 Ų | 32.2 | 7% | 0.074 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -83.8 | -20.7 | 175.7 | -63.9 | 0 | 0 | 0 | 0 | 113.9 | L74 L75 V76 P80 F81 V102 L105 | L74-C78 PolarHBondContact O-N 3.29Å; L74-C78 PolarHBondContact O-SG 3.4Å; L75-C78 CarbonylContact O-C 3.59Å; L75-C78 WeakPolarHBondContact O-CA 3.45Å; L75-C78 VanDerWaalsContact O-CB 3.26Å; L75-C78 WeakPolarHBondContact O-CB 3.47Å; L75-C78 PolarHBondContact O-N 2.87Å; V76-C78 PolarHBondContact O-N 2.92Å; C78-P80 VanDerWaalsContact C-CD 3.49Å; C78-F81 WeakPolarHBondContact O-CD2 3.25Å; C78-F81 PolarHBondContact O-N 3.25Å; C78-V102 HydrophobicContact CB-CG1 4.18Å; C78-L105 WeakPolarHBondContact SG-CD1 3.44Å |
| 79 | L | 96 | Very high | 94.5 | Very high | 1 Ų | 1 | 36.2 Ų | 36.2 | 1% | 0.005 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -60.8 | -37.1 | -176.8 | -64.6 | -177 | 0 | 0 | 0 | 114.5 | Y33 I36 F37 L75 V76 F81 R82 I83 F106 | Y33-L79 HydrophobicContact CD1-CD2 3.76Å; Y33-L79 HydrophobicContact CE1-CD2 4.24Å; I36-L79 HydrophobicContact CB-CD1 3.99Å; I36-L79 HydrophobicContact CG2-CD1 3.54Å; F37-L79 HydrophobicContact CB-CB 4.28Å; F37-L79 HydrophobicContact CB-CD1 4.24Å; L75-L79 HydrophobicContact CD1-CD2 3.79Å; L75-L79 HydrophobicContact CD1-CG 4.4Å; L75-L79 HydrophobicContact CG-CD2 4.29Å; L75-L79 PolarHBondContact O-N 2.87Å; L75-L79 VanDerWaalsContact O-N 3.12Å; V76-L79 HydrophobicContact CG2-CD1 4.47Å; V76-L79 WeakPolarHBondContact O-CB 3.42Å; V76-L79 PolarHBondContact O-N 2.99Å; V76-L79 VanDerWaalsContact O-N 3.12Å; L79-F81 PolarHBondContact O-N 2.99Å; L79-R82 PolarHBondContact O-N 3.5Å; L79-I83 VanDerWaalsContact O-CG1 3.3Å; L79-I83 WeakPolarHBondContact O-CG1 3.34Å; L79-I83 PolarHBondContact O-N 3.31Å; L79-F106 HydrophobicContact CD2-CE2 4.35Å |
| 80 | P | 96.8 | Very high | 94 | Very high | 49 Ų | 49 | 37 Ų | 37 | 32% | 0.318 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -52 | -39.5 | 173.9 | -30.3 | 37 | 0 | 0 | 0 | 113.9 | F37 V76 V77 C78 R82 I83 Q84 | F37-P80 HydrophobicContact CD2-CG 3.96Å; F37-P80 HydrophobicContact CE2-CG 3.73Å; F37-P80 HydrophobicContact CZ-CG 4.17Å; V76-P80 VanDerWaalsContact O-CD 3.28Å; V76-P80 WeakPolarHBondContact O-CD 3.24Å; V77-P80 WeakPolarHBondContact O-CD 3.4Å; C78-P80 VanDerWaalsContact C-CD 3.49Å; P80-R82 VanDerWaalsContact C-N 3.35Å; P80-R82 PolarHBondContact O-N 3.28Å; P80-I83 PolarHBondContact O-N 2.93Å; P80-Q84 WeakPolarHBondContact O-CB 3.18Å; P80-Q84 PolarHBondContact O-N 3.3Å |
| 81 | F | 94.9 | Very high | 93.5 | Very high | 76 Ų | 76 | 36.3 Ų | 36.3 | 33% | 0.333 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -66.8 | -37.5 | 177.7 | -55.4 | -71 | 0 | 0 | 0 | 112.1 | C78 L79 Y85 W92 L94 V102 | C78-F81 WeakPolarHBondContact O-CD2 3.25Å; C78-F81 PolarHBondContact O-N 3.25Å; L79-F81 PolarHBondContact O-N 2.99Å; F81-Y85 WeakPolarHBondContact O-CB 3.23Å; F81-Y85 PolarHBondContact O-N 3.34Å; F81-W92 HydrophobicContact CB-CH2 3.82Å; F81-W92 HydrophobicContact CB-CZ3 4.07Å; F81-L94 HydrophobicContact CD1-CD1 3.45Å; F81-L94 VanDerWaalsContact CD1-CD1 3.45Å; F81-L94 HydrophobicContact CE1-CD1 4.04Å; F81-L94 HydrophobicContact CG-CD1 4.41Å; F81-V102 HydrophobicContact CB-CG2 4.23Å; F81-V102 HydrophobicContact CD2-CG2 3.92Å; F81-V102 HydrophobicContact CG-CG2 4.24Å |
| 82 | R | 92.5 | Very high | 93 | Very high | 6 Ų | 6 | 37.6 Ų | 37.6 | 2% | 0.023 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -72.7 | -35.3 | 176 | -165.6 | 172.5 | -173.6 | 174.8 | 3.7 | 112.2 | Y33 L79 P80 Y85 H86 F106 F177 E283 | Y33-R82 HydrophobicContact CD2-CG 4.23Å; Y33-R82 HydrophobicContact CE2-CG 4.05Å; Y33-R82 VanDerWaalsContact CZ-CZ 3.46Å; Y33-R82 PolarHBondContact OH-NE 3.02Å; Y33-R82 PolarHBondContact OH-NH1 3.31Å; Y33-R82 PolarHBondContact OH-NH2 3.46Å; Y33-R82 VanDerWaalsContact OH-NH2 3.17Å; L79-R82 PolarHBondContact O-N 3.5Å; P80-R82 VanDerWaalsContact C-N 3.35Å; P80-R82 PolarHBondContact O-N 3.28Å; R82-Y85 WeakPolarHBondContact O-CB 3.34Å; R82-Y85 PolarHBondContact O-N 3.48Å; R82-H86 PolarHBondContact O-CD2 2.78Å; R82-H86 PolarHBondContact O-N 2.87Å; R82-H86 VanDerWaalsContact O-N 3.15Å; R82-F106 VanDerWaalsContact NH1-CD2 3.33Å; R82-F177 HydrophobicContact CG-CE2 4.36Å; R82-E283 IonicContact CZ-OE2 2.65Å; R82-E283 IonicContact NE-OE2 3.58Å; R82-E283 IonicContact NH2-OE1 2.73Å; R82-E283 PolarHBondContact NH2-OE1 2.95Å; R82-E283 VanDerWaalsContact NH2-OE1 3.15Å; R82-E283 IonicContact NH2-OE2 3.15Å; R82-E283 PolarHBondContact NH2-OE2 3.2Å |
| 83 | I | 94.9 | Very high | 92.5 | Very high | 19 Ų | 19 | 44 Ų | 44 | 10% | 0.097 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61 | -50.9 | 171.9 | -65.9 | 160.4 | 0 | 0 | 0 | 109.4 | A30 F37 L79 P80 Y85 H86 L87 | A30-I83 HydrophobicContact CB-CG2 4.31Å; F37-I83 HydrophobicContact CB-CD1 4.41Å; L79-I83 VanDerWaalsContact O-CG1 3.3Å; L79-I83 WeakPolarHBondContact O-CG1 3.34Å; L79-I83 PolarHBondContact O-N 3.31Å; P80-I83 PolarHBondContact O-N 2.93Å; I83-Y85 VanDerWaalsContact C-N 3.31Å; I83-Y85 PolarHBondContact O-N 3.36Å; I83-H86 PolarHBondContact O-N 3.11Å; I83-L87 HydrophobicContact CG2-CD1 3.95Å; I83-L87 HydrophobicContact CG2-CG 4.38Å; I83-L87 WeakPolarHBondContact O-CG 3.35Å; I83-L87 PolarHBondContact O-N 2.93Å |
| 84 | Q | 94.1 | Very high | 92 | Very high | 73 Ų | 73 | 46.4 Ų | 46.4 | 34% | 0.341 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -57 | -44.6 | 176.9 | -179.5 | 178.9 | -9.2 | 0 | 0 | 111.6 | P80 H86 L87 Q88 | P80-Q84 WeakPolarHBondContact O-CB 3.18Å; P80-Q84 PolarHBondContact O-N 3.3Å; Q84-H86 VanDerWaalsContact C-N 3.35Å; Q84-H86 PolarHBondContact O-N 3.44Å; Q84-L87 PolarHBondContact O-N 2.94Å; Q84-L87 VanDerWaalsContact O-N 3.16Å; Q84-Q88 HydrophobicContact CG-CG 4.26Å; Q84-Q88 WeakPolarHBondContact O-CB 3.49Å; Q84-Q88 WeakPolarHBondContact O-CG 3.37Å; Q84-Q88 PolarHBondContact O-N 3.27Å |
| 85 | Y | 91.2 | Very high | 91.4 | Very high | 2 Ų | 2 | 45.8 Ų | 45.8 | 1% | 0.008 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -54.2 | -47.4 | 176.2 | 171.8 | -106 | 0 | 0 | 0 | 112.7 | F81 R82 I83 Q88 N90 W92 C176 F177 | F81-Y85 WeakPolarHBondContact O-CB 3.23Å; F81-Y85 PolarHBondContact O-N 3.34Å; R82-Y85 WeakPolarHBondContact O-CB 3.34Å; R82-Y85 PolarHBondContact O-N 3.48Å; I83-Y85 VanDerWaalsContact C-N 3.31Å; I83-Y85 PolarHBondContact O-N 3.36Å; Y85-Q88 CarbonylContact O-C 3.57Å; Y85-Q88 PolarHBondContact O-N 2.97Å; Y85-N90 HydrophobicContact CE1-CB 3.86Å; Y85-N90 HydrophobicContact CE2-CB 4.13Å; Y85-N90 WeakPolarHBondContact CE2-O 3.31Å; Y85-N90 VanDerWaalsContact O-CA 3.24Å; Y85-N90 WeakPolarHBondContact O-CA 3.5Å; Y85-N90 PolarHBondContact O-N 3.15Å; Y85-N90 PolarHBondContact OH-O 3.24Å; Y85-W92 HydrophobicContact CD2-CB 4Å; Y85-W92 HydrophobicContact CD2-CE3 4.04Å; Y85-W92 HydrophobicContact CE2-CB 4.14Å; Y85-W92 HydrophobicContact CG-CE3 4.36Å; Y85-C176 HydrophobicContact CD2-CB 4.43Å; Y85-C176 HydrophobicContact CE2-CB 4.02Å; Y85-C176 PolarHBondContact OH-N 3.4Å; Y85-C176 PolarHBondContact OH-O 3.26Å; Y85-F177 HydrophobicContact CD1-CD2 4.14Å; Y85-F177 HydrophobicContact CD1-CE2 4.31Å; Y85-F177 HydrophobicContact CE1-CD2 4.2Å; Y85-F177 HydrophobicContact CG-CE2 4.3Å |
| 86 | H | 90.6 | Very high | 90.7 | Very high | 4 Ų | 4 | 49.1 Ų | 49.1 | 2% | 0.019 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -69.4 | -35.3 | 178.2 | -67.5 | -54.2 | 0 | 0 | 0 | 112.7 | A30 Y33 R82 I83 Q84 Q88 Q89 N90 E283 | A30-H86 HydrophobicContact CB-CB 4.22Å; Y33-H86 AromaticContact CD2-CD2 3.94Å; Y33-H86 AromaticContact CE2-NE2 3.65Å; R82-H86 PolarHBondContact O-CD2 2.78Å; R82-H86 PolarHBondContact O-N 2.87Å; R82-H86 VanDerWaalsContact O-N 3.15Å; I83-H86 PolarHBondContact O-N 3.11Å; Q84-H86 VanDerWaalsContact C-N 3.35Å; Q84-H86 PolarHBondContact O-N 3.44Å; H86-Q88 VanDerWaalsContact C-N 3.31Å; H86-Q88 PolarHBondContact O-N 3.45Å; H86-Q89 PolarHBondContact O-N 3.12Å; H86-N90 PolarHBondContact ND1-OD1 3.43Å; H86-E283 IonicContact CE1-OE2 3.59Å |
| 87 | L | 90.8 | Very high | 90 | Very high | 117 Ų | 117 | 53.1 Ų | 53.1 | 61% | 0.613 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -67.2 | -31.6 | 174.3 | -67 | 176.5 | 0 | 0 | 0 | 112.5 | A30 I83 Q84 Q89 | A30-L87 HydrophobicContact CB-CD2 3.94Å; A30-L87 HydrophobicContact CB-CG 4.17Å; I83-L87 HydrophobicContact CG2-CD1 3.95Å; I83-L87 HydrophobicContact CG2-CG 4.38Å; I83-L87 WeakPolarHBondContact O-CG 3.35Å; I83-L87 PolarHBondContact O-N 2.93Å; Q84-L87 PolarHBondContact O-N 2.94Å; Q84-L87 VanDerWaalsContact O-N 3.16Å; L87-Q89 PolarHBondContact O-N 3.34Å |
| 88 | Q | 89.8 | Confident | 89.5 | Confident | 56 Ų | 56 | 52.6 Ų | 52.6 | 26% | 0.262 | 27% | 0.271 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | 28.7 | 174.7 | -68.2 | -174.6 | -46.1 | 0 | 0 | 112.8 | Q84 Y85 H86 N90 K91 E93 | Q84-Q88 HydrophobicContact CG-CG 4.26Å; Q84-Q88 WeakPolarHBondContact O-CB 3.49Å; Q84-Q88 WeakPolarHBondContact O-CG 3.37Å; Q84-Q88 PolarHBondContact O-N 3.27Å; Y85-Q88 CarbonylContact O-C 3.57Å; Y85-Q88 PolarHBondContact O-N 2.97Å; H86-Q88 VanDerWaalsContact C-N 3.31Å; H86-Q88 PolarHBondContact O-N 3.45Å; Q88-N90 VanDerWaalsContact C-N 3.31Å; Q88-N90 PolarHBondContact O-N 2.88Å; Q88-K91 VanDerWaalsContact O-CB 3.27Å; Q88-K91 WeakPolarHBondContact O-CB 3.01Å; Q88-K91 WeakPolarHBondContact O-CG 3.24Å; Q88-K91 PolarHBondContact O-N 2.84Å; Q88-K91 VanDerWaalsContact O-N 3.1Å; Q88-E93 PolarHBondContact NE2-OE2 2.96Å |
| 89 | Q | 86.3 | Confident | 89.1 | Confident | 84 Ų | 84 | 52.9 Ų | 52.9 | 39% | 0.393 | 27% | 0.273 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 58.4 | 39.4 | 177.5 | -53.6 | 174.2 | -23.9 | 0 | 0 | 113.4 | H86 L87 K91 | H86-Q89 PolarHBondContact O-N 3.12Å; L87-Q89 PolarHBondContact O-N 3.34Å; Q89-K91 VanDerWaalsContact C-N 3.26Å; Q89-K91 PolarHBondContact O-N 3.48Å |
| 90 | N | 85.6 | Confident | 88.6 | Confident | 15 Ų | 15 | 53.9 Ų | 53.9 | 8% | 0.08 | 28% | 0.277 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 60.1 | 34.5 | -176.4 | -57.5 | -30.1 | 0 | 0 | 0 | 112.9 | Q26 Y85 H86 Q88 | Q26-N90 PolarHBondContact NE2-ND2 3.37Å; Y85-N90 HydrophobicContact CE1-CB 3.86Å; Y85-N90 HydrophobicContact CE2-CB 4.13Å; Y85-N90 WeakPolarHBondContact CE2-O 3.31Å; Y85-N90 VanDerWaalsContact O-CA 3.24Å; Y85-N90 WeakPolarHBondContact O-CA 3.5Å; Y85-N90 PolarHBondContact O-N 3.15Å; Y85-N90 PolarHBondContact OH-O 3.24Å; H86-N90 PolarHBondContact ND1-OD1 3.43Å; Q88-N90 VanDerWaalsContact C-N 3.31Å; Q88-N90 PolarHBondContact O-N 2.88Å |
| 91 | K | 85.4 | Confident | 88.2 | Confident | 85 Ų | 85 | 53.9 Ų | 53.9 | 37% | 0.37 | 27% | 0.274 | S | S | . | . | trans | -105.8 | 127.5 | 171.6 | -61.3 | 177.6 | -178.1 | 174.3 | 0 | 109.8 | Q88 Q89 | Q88-K91 VanDerWaalsContact O-CB 3.27Å; Q88-K91 WeakPolarHBondContact O-CB 3.01Å; Q88-K91 WeakPolarHBondContact O-CG 3.24Å; Q88-K91 PolarHBondContact O-N 2.84Å; Q88-K91 VanDerWaalsContact O-N 3.1Å; Q89-K91 VanDerWaalsContact C-N 3.26Å; Q89-K91 PolarHBondContact O-N 3.48Å | ||
| 92 | W | 87.5 | Confident | 88 | Confident | 27 Ų | 27 | 50.7 Ų | 50.7 | 10% | 0.102 | 26% | 0.261 | C | S | . | . | trans | -102.3 | 119.1 | 180 | -176.2 | -89.9 | 0 | 0 | 0 | 111.3 | F81 Y85 L94 G95 M98 C99 V102 T174 C176 F177 | F81-W92 HydrophobicContact CB-CH2 3.82Å; F81-W92 HydrophobicContact CB-CZ3 4.07Å; Y85-W92 HydrophobicContact CD2-CB 4Å; Y85-W92 HydrophobicContact CD2-CE3 4.04Å; Y85-W92 HydrophobicContact CE2-CB 4.14Å; Y85-W92 HydrophobicContact CG-CE3 4.36Å; W92-L94 HydrophobicContact CH2-CD1 4.12Å; W92-L94 HydrophobicContact CZ2-CB 3.77Å; W92-L94 HydrophobicContact CZ2-CD1 4.09Å; W92-L94 HydrophobicContact CZ2-CG 4.45Å; W92-G95 PolarHBondContact NE1-O 2.84Å; W92-M98 HydrophobicContact CZ2-CB 3.75Å; W92-C99 HydrophobicContact CD2-CB 4.19Å; W92-C99 HydrophobicContact CG-CB 4.27Å; W92-C99 HydrophobicContact CZ2-CB 4.2Å; W92-C99 VanDerWaalsContact CZ2-N 3.35Å; W92-V102 HydrophobicContact CH2-CB 4.41Å; W92-V102 HydrophobicContact CH2-CG2 4.14Å; W92-T174 WeakPolarHBondContact CB-O 3.33Å; W92-T174 PolarHBondContact N-O 3.07Å; W92-C176 HydrophobicContact CB-CB 3.66Å; W92-C176 HydrophobicContact CD2-CB 3.93Å; W92-C176 HydrophobicContact CE3-CB 4.06Å; W92-C176 HydrophobicContact CG-CB 3.77Å; W92-F177 AromaticContact CE3-CE2 3.96Å; W92-F177 HydrophobicContact CE3-CE2 3.96Å; W92-F177 HydrophobicContact CE3-CZ 4.11Å; W92-F177 HydrophobicContact CH2-CZ 4.05Å; W92-F177 AromaticContact CZ3-CE2 3.77Å; W92-F177 HydrophobicContact CZ3-CE2 3.77Å; W92-F177 AromaticContact CZ3-CZ 3.6Å; W92-F177 HydrophobicContact CZ3-CZ 3.6Å | ||
| 93 | E | 87 | Confident | 87.9 | Confident | 135 Ų | 135 | 50.7 Ų | 50.7 | 63% | 0.631 | 26% | 0.263 | S | S | * | . | trans | -110.2 | -9.4 | -174 | -63.4 | 178.4 | 167.5 | 0 | 0 | 113.7 | Q88 G95 | Q88-E93 PolarHBondContact NE2-OE2 2.96Å; E93-G95 PolarHBondContact O-N 3.4Å | ||
| 94 | L | 86.1 | Confident | 87.6 | Confident | 73 Ų | 73 | 50.7 Ų | 50.7 | 38% | 0.382 | 26% | 0.262 | S | S | . | . | S | Bend | trans | -85.8 | 15.4 | -173.2 | -60 | 171.1 | 0 | 0 | 0 | 114.1 | F81 W92 M98 | F81-L94 HydrophobicContact CD1-CD1 3.45Å; F81-L94 VanDerWaalsContact CD1-CD1 3.45Å; F81-L94 HydrophobicContact CE1-CD1 4.04Å; F81-L94 HydrophobicContact CG-CD1 4.41Å; W92-L94 HydrophobicContact CH2-CD1 4.12Å; W92-L94 HydrophobicContact CZ2-CB 3.77Å; W92-L94 HydrophobicContact CZ2-CD1 4.09Å; W92-L94 HydrophobicContact CZ2-CG 4.45Å; L94-M98 HydrophobicContact CB-CB 4.1Å; L94-M98 HydrophobicContact CB-CG 4.45Å; L94-M98 WeakPolarHBondContact O-CB 3.49Å; L94-M98 WeakPolarHBondContact O-CG 3.35Å |
| 95 | G | 84.9 | Confident | 87.5 | Confident | 41 Ų | 41 | 48.6 Ų | 48.6 | 42% | 0.423 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | 77.2 | 162.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | W92 E93 T97 M98 C99 | W92-G95 PolarHBondContact NE1-O 2.84Å; E93-G95 PolarHBondContact O-N 3.4Å; G95-T97 PolarHBondContact O-N 2.91Å; G95-M98 PolarHBondContact O-N 3.23Å; G95-C99 PolarHBondContact O-N 3.29Å |
| 96 | H | 81.3 | Confident | 87.6 | Confident | 70 Ų | 70 | 49 Ų | 49 | 32% | 0.324 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64.1 | -39.5 | -172 | -173.2 | -110.9 | 0 | 0 | 0 | 113.6 | M98 C99 K100 D168 | H96-M98 PolarHBondContact O-N 2.9Å; H96-C99 WeakPolarHBondContact O-CB 3.35Å; H96-C99 PolarHBondContact O-N 3.48Å; H96-K100 WeakPolarHBondContact CE1-CE 3.3Å; H96-K100 PolarHBondContact CE1-NZ 3.37Å; H96-K100 VanDerWaalsContact CE1-NZ 3.26Å; H96-K100 PolarHBondContact O-N 2.96Å; H96-D168 IonicContact CE1-OD2 2.72Å; H96-D168 IonicContact NE2-OD2 2.84Å; H96-D168 PolarHBondContact NE2-OD2 2.98Å |
| 97 | T | 82.7 | Confident | 87.6 | Confident | 83 Ų | 83 | 51.1 Ų | 51.1 | 51% | 0.509 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.8 | -43.9 | 179.5 | -53.3 | 0 | 0 | 0 | 0 | 112 | G95 K100 L101 V163 | G95-T97 PolarHBondContact O-N 2.91Å; T97-K100 PolarHBondContact O-N 3.43Å; T97-L101 VanDerWaalsContact O-CB 3.31Å; T97-L101 WeakPolarHBondContact O-CB 3.48Å; T97-L101 PolarHBondContact O-N 3.22Å; T97-V163 HydrophobicContact CG2-CG1 4.32Å |
| 98 | M | 86.9 | Confident | 87.7 | Confident | 77 Ų | 77 | 46.1 Ų | 46.1 | 38% | 0.379 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -68.9 | -37.9 | 177.9 | -70 | -66.2 | 113.5 | 0 | 0 | 111.7 | W92 L94 G95 H96 K100 L101 V102 | W92-M98 HydrophobicContact CZ2-CB 3.75Å; L94-M98 HydrophobicContact CB-CB 4.1Å; L94-M98 HydrophobicContact CB-CG 4.45Å; L94-M98 WeakPolarHBondContact O-CB 3.49Å; L94-M98 WeakPolarHBondContact O-CG 3.35Å; G95-M98 PolarHBondContact O-N 3.23Å; H96-M98 PolarHBondContact O-N 2.9Å; M98-K100 VanDerWaalsContact C-N 3.34Å; M98-K100 PolarHBondContact O-N 3.48Å; M98-L101 HydrophobicContact CE-CD2 3.79Å; M98-L101 PolarHBondContact O-N 2.82Å; M98-L101 HydrophobicContact SD-CD2 4.22Å; M98-V102 WeakPolarHBondContact O-CB 3.43Å; M98-V102 WeakPolarHBondContact O-CG2 3.37Å; M98-V102 PolarHBondContact O-N 3.17Å |
| 99 | C | 87 | Confident | 88 | Confident | 17 Ų | 17 | 43.5 Ų | 43.5 | 12% | 0.115 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -56.7 | -49.8 | 174.7 | 171.7 | 0 | 0 | 0 | 0 | 111 | W92 G95 H96 G103 C176 F177 | W92-C99 HydrophobicContact CD2-CB 4.19Å; W92-C99 HydrophobicContact CG-CB 4.27Å; W92-C99 HydrophobicContact CZ2-CB 4.2Å; W92-C99 VanDerWaalsContact CZ2-N 3.35Å; G95-C99 PolarHBondContact O-N 3.29Å; H96-C99 WeakPolarHBondContact O-CB 3.35Å; H96-C99 PolarHBondContact O-N 3.48Å; C99-G103 PolarHBondContact O-N 3.37Å; C99-C176 WeakPolarHBondContact CA-SG 3.37Å; C99-C176 HydrophobicContact CB-CB 4.05Å; C99-C176 WeakPolarHBondContact CB-SG 3.45Å; C99-C176 VanDerWaalsContact SG-CA 3.56Å; C99-C176 WeakPolarHBondContact SG-CB 3.46Å; C99-C176 CovalentContact SG-SG 2.02Å; C99-C176 PolarHBondContact SG-SG 3.45Å; C99-F177 WeakPolarHBondContact O-CE1 3.38Å |
| 100 | K | 84.8 | Confident | 88.4 | Confident | 23 Ų | 23 | 39.5 Ų | 39.5 | 10% | 0.1 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.6 | -45.4 | 177.1 | -76.5 | 176 | 155.6 | -175.8 | 0 | 112.6 | H96 T97 M98 G103 Y104 F162 E165 | H96-K100 WeakPolarHBondContact CE1-CE 3.3Å; H96-K100 PolarHBondContact CE1-NZ 3.37Å; H96-K100 VanDerWaalsContact CE1-NZ 3.26Å; H96-K100 PolarHBondContact O-N 2.96Å; T97-K100 PolarHBondContact O-N 3.43Å; M98-K100 VanDerWaalsContact C-N 3.34Å; M98-K100 PolarHBondContact O-N 3.48Å; K100-G103 PolarHBondContact O-N 2.87Å; K100-Y104 WeakPolarHBondContact O-CB 3.2Å; K100-Y104 PolarHBondContact O-N 2.79Å; K100-F162 HydrophobicContact CB-CD1 4.38Å; K100-F162 HydrophobicContact CB-CE1 4.22Å; K100-F162 HydrophobicContact CG-CE1 4.5Å; K100-F162 WeakPolarHBondContact O-CE1 3.36Å; K100-E165 PolarHBondContact NZ-O 3.1Å |
| 101 | L | 87.8 | Confident | 88.7 | Confident | 49 Ų | 49 | 40.9 Ų | 40.9 | 26% | 0.257 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -59.9 | -49.6 | 179.8 | 176.9 | 59.5 | 0 | 0 | 0 | 111.4 | T97 M98 Y104 L105 M159 | T97-L101 VanDerWaalsContact O-CB 3.31Å; T97-L101 WeakPolarHBondContact O-CB 3.48Å; T97-L101 PolarHBondContact O-N 3.22Å; M98-L101 HydrophobicContact CE-CD2 3.79Å; M98-L101 PolarHBondContact O-N 2.82Å; M98-L101 HydrophobicContact SD-CD2 4.22Å; L101-Y104 PolarHBondContact O-N 3.4Å; L101-L105 HydrophobicContact CD1-CD1 3.93Å; L101-L105 HydrophobicContact CD1-CG 4.17Å; L101-L105 HydrophobicContact CG-CD1 4.08Å; L101-L105 WeakPolarHBondContact O-CB 2.92Å; L101-L105 WeakPolarHBondContact O-CG 3.23Å; L101-L105 PolarHBondContact O-N 2.97Å; L101-M159 HydrophobicContact CD1-CE 3.27Å |
| 102 | V | 91.5 | Very high | 89.2 | Confident | 8 Ų | 8 | 37 Ų | 37 | 5% | 0.048 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.9 | -43.9 | 178.7 | 170.1 | 0 | 0 | 0 | 0 | 110.8 | C78 F81 W92 M98 Y104 L105 F106 F177 | C78-V102 HydrophobicContact CB-CG1 4.18Å; F81-V102 HydrophobicContact CB-CG2 4.23Å; F81-V102 HydrophobicContact CD2-CG2 3.92Å; F81-V102 HydrophobicContact CG-CG2 4.24Å; W92-V102 HydrophobicContact CH2-CB 4.41Å; W92-V102 HydrophobicContact CH2-CG2 4.14Å; M98-V102 WeakPolarHBondContact O-CB 3.43Å; M98-V102 WeakPolarHBondContact O-CG2 3.37Å; M98-V102 PolarHBondContact O-N 3.17Å; V102-Y104 PolarHBondContact O-N 3.17Å; V102-L105 PolarHBondContact O-N 2.95Å; V102-F106 PolarHBondContact O-N 3.23Å; V102-F177 HydrophobicContact CB-CE1 3.94Å; V102-F177 HydrophobicContact CB-CZ 4.01Å; V102-F177 HydrophobicContact CG1-CE1 3.61Å; V102-F177 HydrophobicContact CG1-CZ 3.49Å; V102-F177 VanDerWaalsContact CG1-CZ 3.49Å |
| 103 | G | 89.4 | Confident | 89.6 | Confident | 7 Ų | 7 | 35.8 Ų | 35.8 | 7% | 0.072 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.9 | -42.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | C99 K100 F106 Y107 | C99-G103 PolarHBondContact O-N 3.37Å; K100-G103 PolarHBondContact O-N 2.87Å; G103-F106 WeakPolarHBondContact O-CB 3.3Å; G103-F106 PolarHBondContact O-N 3.29Å; G103-Y107 WeakPolarHBondContact O-CD2 3.46Å; G103-Y107 PolarHBondContact O-N 3.06Å |
| 104 | Y | 88.9 | Confident | 89.9 | Confident | 19 Ų | 19 | 29.4 Ų | 29.4 | 8% | 0.075 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -60.9 | -50 | 175.4 | 177.5 | -88.9 | 0 | 0 | 0 | 111.5 | K100 L101 V102 F106 Y107 M108 A155 F158 M159 F162 | K100-Y104 WeakPolarHBondContact O-CB 3.2Å; K100-Y104 PolarHBondContact O-N 2.79Å; L101-Y104 PolarHBondContact O-N 3.4Å; V102-Y104 PolarHBondContact O-N 3.17Å; Y104-F106 PolarHBondContact O-N 3.17Å; Y104-Y107 PolarHBondContact O-N 3.03Å; Y104-M108 HydrophobicContact CD1-CB 4.23Å; Y104-M108 HydrophobicContact CE1-CB 3.72Å; Y104-M108 HydrophobicContact CE1-CG 3.9Å; Y104-M108 HydrophobicContact CE1-SD 4.43Å; Y104-M108 WeakPolarHBondContact O-CB 3.21Å; Y104-M108 PolarHBondContact O-N 3.35Å; Y104-A155 PolarHBondContact OH-O 2.82Å; Y104-F158 HydrophobicContact CE2-CB 4.5Å; Y104-M159 HydrophobicContact CD1-CB 4.14Å; Y104-M159 HydrophobicContact CD1-CE 3.42Å; Y104-M159 VanDerWaalsContact CD1-CE 3.42Å; Y104-M159 HydrophobicContact CD1-CG 3.61Å; Y104-M159 HydrophobicContact CD1-SD 4.26Å; Y104-M159 HydrophobicContact CD2-CB 4.41Å; Y104-M159 HydrophobicContact CD2-CG 4.35Å; Y104-M159 HydrophobicContact CE1-CB 3.57Å; Y104-M159 HydrophobicContact CE1-CE 3.7Å; Y104-M159 HydrophobicContact CE1-CG 3.51Å; Y104-M159 HydrophobicContact CE1-SD 4.1Å; Y104-M159 HydrophobicContact CE2-CB 3.87Å; Y104-M159 HydrophobicContact CE2-CG 4.27Å; Y104-M159 HydrophobicContact CG-CE 4.42Å; Y104-M159 HydrophobicContact CG-CG 4.06Å; Y104-M159 VanDerWaalsContact CZ-CA 3.48Å; Y104-M159 VanDerWaalsContact CZ-CB 3.43Å; Y104-M159 PolarHBondContact OH-N 3.4Å; Y104-F162 HydrophobicContact CD2-CB 3.92Å; Y104-F162 AromaticContact CD2-CD1 3.92Å; Y104-F162 HydrophobicContact CD2-CD1 3.92Å; Y104-F162 HydrophobicContact CD2-CD2 4.42Å; Y104-F162 AromaticContact CD2-CG 3.83Å; Y104-F162 HydrophobicContact CD2-CG 3.83Å; Y104-F162 HydrophobicContact CG-CD1 4.17Å |
| 105 | L | 92.8 | Very high | 90.3 | Very high | 28 Ų | 28 | 28 Ų | 28 | 15% | 0.147 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.7 | -31.7 | 179.9 | -72.9 | 172.3 | 0 | 0 | 0 | 112 | C78 L101 V102 M108 N109 M159 | C78-L105 WeakPolarHBondContact SG-CD1 3.44Å; L101-L105 HydrophobicContact CD1-CD1 3.93Å; L101-L105 HydrophobicContact CD1-CG 4.17Å; L101-L105 HydrophobicContact CG-CD1 4.08Å; L101-L105 WeakPolarHBondContact O-CB 2.92Å; L101-L105 WeakPolarHBondContact O-CG 3.23Å; L101-L105 PolarHBondContact O-N 2.97Å; V102-L105 PolarHBondContact O-N 2.95Å; L105-M108 HydrophobicContact CD2-SD 4.17Å; L105-N109 WeakPolarHBondContact O-CB 3.5Å; L105-N109 PolarHBondContact O-N 3.18Å; L105-M159 HydrophobicContact CD2-CE 4.04Å; L105-M159 HydrophobicContact CG-CE 4.32Å |
| 106 | F | 93.3 | Very high | 90.7 | Very high | 10 Ų | 10 | 26.1 Ų | 26.1 | 4% | 0.044 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -62.4 | -54.5 | 173.1 | -163.5 | -76.3 | 0 | 0 | 0 | 112.5 | Y33 L75 L79 R82 V102 G103 Y104 M108 N109 M110 L286 A290 | Y33-F106 HydrophobicContact CE1-CE2 4.28Å; L75-F106 HydrophobicContact CD1-CB 4.32Å; L75-F106 HydrophobicContact CD1-CD2 3.28Å; L75-F106 HydrophobicContact CD1-CE2 3.69Å; L75-F106 HydrophobicContact CD1-CG 3.99Å; L75-F106 HydrophobicContact CD2-CE2 4.43Å; L79-F106 HydrophobicContact CD2-CE2 4.35Å; R82-F106 VanDerWaalsContact NH1-CD2 3.33Å; V102-F106 PolarHBondContact O-N 3.23Å; G103-F106 WeakPolarHBondContact O-CB 3.3Å; G103-F106 PolarHBondContact O-N 3.29Å; Y104-F106 PolarHBondContact O-N 3.17Å; F106-M108 VanDerWaalsContact C-N 3.33Å; F106-M108 PolarHBondContact O-N 2.94Å; F106-N109 PolarHBondContact O-N 3.42Å; F106-M110 PolarHBondContact O-N 2.94Å; F106-M110 VanDerWaalsContact O-N 3.12Å; F106-L286 HydrophobicContact CD1-CD2 4.01Å; F106-L286 HydrophobicContact CE1-CB 4.05Å; F106-L286 HydrophobicContact CE1-CD2 3.5Å; F106-L286 HydrophobicContact CE1-CG 4.33Å; F106-L286 HydrophobicContact CZ-CB 4.12Å; F106-L286 HydrophobicContact CZ-CD2 4.41Å; F106-L286 WeakPolarHBondContact CZ-O 3.32Å; F106-A290 HydrophobicContact CE2-CB 3.97Å; F106-A290 HydrophobicContact CZ-CB 3.79Å |
| 107 | Y | 90.6 | Very high | 91.2 | Very high | 49 Ų | 49 | 23 Ų | 23 | 19% | 0.192 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -67 | -36.6 | 178.5 | -71.3 | -64.1 | 0 | 0 | 0 | 112.4 | G103 Y104 M110 Y111 Y255 L286 | G103-Y107 WeakPolarHBondContact O-CD2 3.46Å; G103-Y107 PolarHBondContact O-N 3.06Å; Y104-Y107 PolarHBondContact O-N 3.03Å; Y107-M110 HydrophobicContact CD1-CE 3.84Å; Y107-M110 HydrophobicContact CE1-CE 4.41Å; Y107-M110 WeakPolarHBondContact O-CB 3.29Å; Y107-M110 PolarHBondContact O-N 2.83Å; Y107-Y111 WeakPolarHBondContact O-CD2 3.26Å; Y107-Y111 PolarHBondContact O-N 3.29Å; Y107-Y255 HydrophobicContact CE1-CE2 4.28Å; Y107-Y255 AromaticContact CE1-CZ 3.83Å; Y107-Y255 WeakPolarHBondContact CE1-OH 3.39Å; Y107-L286 HydrophobicContact CE1-CD2 3.86Å |
| 108 | M | 92.5 | Very high | 91.6 | Very high | 12 Ų | 12 | 19.2 Ų | 19.2 | 6% | 0.059 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -60.2 | -48.9 | 175.8 | -174.8 | -128.5 | 169.1 | 0 | 0 | 110.9 | Y104 L105 F106 M110 Y111 V112 W152 A155 | Y104-M108 HydrophobicContact CD1-CB 4.23Å; Y104-M108 HydrophobicContact CE1-CB 3.72Å; Y104-M108 HydrophobicContact CE1-CG 3.9Å; Y104-M108 HydrophobicContact CE1-SD 4.43Å; Y104-M108 WeakPolarHBondContact O-CB 3.21Å; Y104-M108 PolarHBondContact O-N 3.35Å; L105-M108 HydrophobicContact CD2-SD 4.17Å; F106-M108 VanDerWaalsContact C-N 3.33Å; F106-M108 PolarHBondContact O-N 2.94Å; M108-M110 PolarHBondContact O-N 2.98Å; M108-Y111 PolarHBondContact O-N 2.89Å; M108-V112 HydrophobicContact CE-CG2 3.94Å; M108-V112 HydrophobicContact CG-CG2 4.27Å; M108-V112 VanDerWaalsContact O-CB 3.25Å; M108-V112 WeakPolarHBondContact O-CB 3.41Å; M108-V112 WeakPolarHBondContact O-CG2 3.43Å; M108-V112 PolarHBondContact O-N 3.41Å; M108-W152 HydrophobicContact CE-CD2 4.38Å; M108-W152 HydrophobicContact CE-CE3 3.33Å; M108-W152 HydrophobicContact CE-CH2 3.77Å; M108-W152 HydrophobicContact CE-CZ3 3Å; M108-W152 HydrophobicContact SD-CZ3 4.24Å; M108-A155 HydrophobicContact CE-CB 3.68Å; M108-A155 HydrophobicContact CG-CB 4.01Å |
| 109 | N | 95.3 | Very high | 91.8 | Very high | 2 Ų | 2 | 16.8 Ų | 16.8 | 1% | 0.011 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -54.8 | -52.5 | 172.3 | 169.5 | -83.9 | 0 | 0 | 0 | 110.9 | A71 D72 L75 L105 F106 Y111 V112 S113 | A71-N109 PolarHBondContact O-ND2 2.9Å; D72-N109 VanDerWaalsContact CA-ND2 3.28Å; D72-N109 WeakPolarHBondContact CA-ND2 3.17Å; D72-N109 PolarHBondContact N-ND2 3.45Å; D72-N109 PolarHBondContact OD1-ND2 3.33Å; L75-N109 HydrophobicContact CB-CB 3.69Å; L75-N109 HydrophobicContact CD2-CB 4.11Å; L75-N109 VanDerWaalsContact CD2-OD1 3.29Å; L75-N109 WeakPolarHBondContact CD2-OD1 3.32Å; L75-N109 HydrophobicContact CG-CB 4.43Å; L105-N109 WeakPolarHBondContact O-CB 3.5Å; L105-N109 PolarHBondContact O-N 3.18Å; F106-N109 PolarHBondContact O-N 3.42Å; N109-Y111 PolarHBondContact O-N 3.42Å; N109-V112 PolarHBondContact O-N 2.85Å; N109-S113 VanDerWaalsContact O-CB 3.28Å; N109-S113 WeakPolarHBondContact O-CB 3.35Å; N109-S113 PolarHBondContact O-N 2.97Å; N109-S113 PolarHBondContact O-OG 2.92Å |
| 110 | M | 94.3 | Very high | 91.9 | Very high | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -52.4 | -52 | -178.1 | 179.3 | 177.4 | 80.3 | 0 | 0 | 112 | F106 Y107 M108 S113 I114 F252 Y255 S289 | F106-M110 PolarHBondContact O-N 2.94Å; F106-M110 VanDerWaalsContact O-N 3.12Å; Y107-M110 HydrophobicContact CD1-CE 3.84Å; Y107-M110 HydrophobicContact CE1-CE 4.41Å; Y107-M110 WeakPolarHBondContact O-CB 3.29Å; Y107-M110 PolarHBondContact O-N 2.83Å; M108-M110 PolarHBondContact O-N 2.98Å; M110-S113 PolarHBondContact O-N 2.85Å; M110-I114 HydrophobicContact CG-CD1 3.77Å; M110-I114 WeakPolarHBondContact O-CB 3.45Å; M110-I114 VanDerWaalsContact O-CD1 3.28Å; M110-I114 WeakPolarHBondContact O-CD1 3.47Å; M110-I114 WeakPolarHBondContact O-CG1 3.34Å; M110-I114 PolarHBondContact O-N 3.01Å; M110-F252 HydrophobicContact CG-CD1 3.94Å; M110-F252 HydrophobicContact CG-CE1 3.94Å; M110-Y255 HydrophobicContact CE-CD1 3.86Å; M110-Y255 HydrophobicContact CE-CE1 3.39Å; M110-Y255 HydrophobicContact SD-CD1 3.68Å; M110-Y255 HydrophobicContact SD-CE1 3.8Å; M110-Y255 HydrophobicContact SD-CG 4.27Å; M110-S289 WeakPolarHBondContact CG-OG 3.44Å; M110-S289 PolarHBondContact SD-OG 2.81Å; M110-S289 VanDerWaalsContact SD-OG 3.34Å |
| 111 | Y | 93.4 | Very high | 92 | Very high | 44 Ų | 44 | 15 Ų | 15 | 17% | 0.173 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -74.3 | -34.5 | -177 | -70.3 | -60.9 | 0 | 0 | 0 | 113.8 | Y107 M108 N109 I114 T115 V196 H256 | Y107-Y111 WeakPolarHBondContact O-CD2 3.26Å; Y107-Y111 PolarHBondContact O-N 3.29Å; M108-Y111 PolarHBondContact O-N 2.89Å; N109-Y111 PolarHBondContact O-N 3.42Å; Y111-I114 HydrophobicContact CD1-CD1 4.22Å; Y111-T115 WeakPolarHBondContact O-CB 3.14Å; Y111-T115 PolarHBondContact O-N 2.91Å; Y111-T115 PolarHBondContact O-OG1 3.45Å; Y111-V196 HydrophobicContact CD1-CB 4.35Å; Y111-V196 HydrophobicContact CE1-CB 3.67Å; Y111-V196 HydrophobicContact CE1-CG1 4.46Å; Y111-V196 HydrophobicContact CE1-CG2 4.13Å; Y111-V196 HydrophobicContact CE2-CB 4.17Å; Y111-V196 HydrophobicContact CE2-CG1 4.35Å; Y111-V196 HydrophobicContact CE2-CG2 4.22Å; Y111-V196 WeakPolarHBondContact OH-CG2 3.46Å; Y111-H256 AromaticContact CE1-NE2 3.53Å |
| 112 | V | 95.3 | Very high | 92 | Very high | 4 Ų | 4 | 15.4 Ų | 15.4 | 2% | 0.024 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -63.5 | -46.1 | 172.6 | 169.4 | 0 | 0 | 0 | 0 | 109.6 | A71 M108 N109 T115 L116 I151 W152 A155 | A71-V112 HydrophobicContact CB-CB 4.45Å; A71-V112 HydrophobicContact CB-CG1 3.81Å; M108-V112 HydrophobicContact CE-CG2 3.94Å; M108-V112 HydrophobicContact CG-CG2 4.27Å; M108-V112 VanDerWaalsContact O-CB 3.25Å; M108-V112 WeakPolarHBondContact O-CB 3.41Å; M108-V112 WeakPolarHBondContact O-CG2 3.43Å; M108-V112 PolarHBondContact O-N 3.41Å; N109-V112 PolarHBondContact O-N 2.85Å; V112-T115 PolarHBondContact O-N 2.93Å; V112-L116 HydrophobicContact CG1-CD1 3.63Å; V112-L116 HydrophobicContact CG1-CG 4.19Å; V112-L116 WeakPolarHBondContact O-CB 3.38Å; V112-L116 VanDerWaalsContact O-CG 3.24Å; V112-L116 WeakPolarHBondContact O-CG 3.3Å; V112-L116 PolarHBondContact O-N 3.36Å; V112-I151 HydrophobicContact CG1-CG2 4.25Å; V112-I151 HydrophobicContact CG2-CG2 4.05Å; V112-W152 HydrophobicContact CG1-CZ2 4.49Å; V112-A155 HydrophobicContact CG2-CB 4.2Å |
| 113 | S | 95.6 | Very high | 91.8 | Very high | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -62.3 | -47 | 178.2 | -64.5 | 0 | 0 | 0 | 0 | 112 | L68 N109 M110 T115 L116 L117 | L68-S113 VanDerWaalsContact CD1-OG 3.31Å; L68-S113 WeakPolarHBondContact CD1-OG 3.29Å; N109-S113 VanDerWaalsContact O-CB 3.28Å; N109-S113 WeakPolarHBondContact O-CB 3.35Å; N109-S113 PolarHBondContact O-N 2.97Å; N109-S113 PolarHBondContact O-OG 2.92Å; M110-S113 PolarHBondContact O-N 2.85Å; S113-T115 VanDerWaalsContact C-N 3.32Å; S113-T115 PolarHBondContact O-N 3.43Å; S113-L116 PolarHBondContact O-N 3.39Å; S113-L117 WeakPolarHBondContact O-CB 3.41Å; S113-L117 WeakPolarHBondContact O-CG 3.46Å; S113-L117 PolarHBondContact O-N 3.39Å |
| 114 | I | 94.3 | Very high | 91.6 | Very high | 1 Ų | 1 | 17 Ų | 17 | 1% | 0.005 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -54.9 | -49 | 174.5 | -72.7 | 158.2 | 0 | 0 | 0 | 111 | M110 Y111 L117 G118 F200 V203 F248 F252 H256 | M110-I114 HydrophobicContact CG-CD1 3.77Å; M110-I114 WeakPolarHBondContact O-CB 3.45Å; M110-I114 VanDerWaalsContact O-CD1 3.28Å; M110-I114 WeakPolarHBondContact O-CD1 3.47Å; M110-I114 WeakPolarHBondContact O-CG1 3.34Å; M110-I114 PolarHBondContact O-N 3.01Å; Y111-I114 HydrophobicContact CD1-CD1 4.22Å; I114-L117 PolarHBondContact O-N 3.48Å; I114-G118 PolarHBondContact O-N 2.95Å; I114-F200 HydrophobicContact CD1-CD2 3.89Å; I114-F200 HydrophobicContact CD1-CE2 4.43Å; I114-F200 HydrophobicContact CG1-CD2 4.38Å; I114-F200 HydrophobicContact CG2-CD2 4.22Å; I114-V203 HydrophobicContact CG2-CB 4.07Å; I114-V203 HydrophobicContact CG2-CG1 3.79Å; I114-V203 HydrophobicContact CG2-CG2 4.32Å; I114-F248 HydrophobicContact CB-CE2 4.29Å; I114-F248 HydrophobicContact CG1-CE2 4.08Å; I114-F248 HydrophobicContact CG1-CZ 4.3Å; I114-F248 HydrophobicContact CG2-CE2 4.08Å; I114-F248 HydrophobicContact CG2-CZ 4.05Å; I114-F252 HydrophobicContact CD1-CB 4.35Å; I114-F252 HydrophobicContact CD1-CD1 3.72Å; I114-F252 HydrophobicContact CD1-CE1 4.14Å; I114-F252 HydrophobicContact CD1-CG 4.02Å; I114-F252 HydrophobicContact CG1-CB 4.32Å; I114-F252 HydrophobicContact CG1-CD1 3.67Å; I114-F252 HydrophobicContact CG1-CD2 3.9Å; I114-F252 HydrophobicContact CG1-CE1 3.82Å; I114-F252 HydrophobicContact CG1-CE2 4.06Å; I114-F252 HydrophobicContact CG1-CG 3.69Å; I114-F252 HydrophobicContact CG1-CZ 4Å; I114-H256 VanDerWaalsContact CD1-CE1 3.48Å; I114-H256 WeakPolarHBondContact CD1-CE1 3.46Å |
| 115 | T | 93.9 | Very high | 91.4 | Very high | 43 Ų | 43 | 19.1 Ų | 19.1 | 26% | 0.264 | 9% | 0.089 | S | C | . | . | H | α-helix | trans | -64.4 | -45.5 | -178.1 | -57.5 | 0 | 0 | 0 | 0 | 111.5 | Y111 V112 S113 G118 L119 I151 | Y111-T115 WeakPolarHBondContact O-CB 3.14Å; Y111-T115 PolarHBondContact O-N 2.91Å; Y111-T115 PolarHBondContact O-OG1 3.45Å; V112-T115 PolarHBondContact O-N 2.93Å; S113-T115 VanDerWaalsContact C-N 3.32Å; S113-T115 PolarHBondContact O-N 3.43Å; T115-G118 PolarHBondContact O-N 3.43Å; T115-L119 HydrophobicContact CG2-CD1 4.17Å; T115-L119 WeakPolarHBondContact O-CG 3.41Å; T115-L119 PolarHBondContact O-N 3.42Å; T115-I151 HydrophobicContact CG2-CD1 3.75Å; T115-I151 HydrophobicContact CG2-CG1 4.14Å |
| 116 | L | 94.1 | Very high | 91.2 | Very high | 2 Ų | 2 | 20.1 Ų | 20.1 | 1% | 0.01 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -65 | -41.5 | 178.8 | -69.9 | 174.2 | 0 | 0 | 0 | 112 | F64 N67 L68 V112 S113 G118 L119 I120 I151 | F64-L116 HydrophobicContact CD1-CD2 3.82Å; N67-L116 HydrophobicContact CB-CD1 3.89Å; N67-L116 HydrophobicContact CB-CD2 4.32Å; L68-L116 HydrophobicContact CB-CD1 4.03Å; L68-L116 HydrophobicContact CD1-CB 4.43Å; L68-L116 HydrophobicContact CD1-CD1 4.34Å; V112-L116 HydrophobicContact CG1-CD1 3.63Å; V112-L116 HydrophobicContact CG1-CG 4.19Å; V112-L116 WeakPolarHBondContact O-CB 3.38Å; V112-L116 VanDerWaalsContact O-CG 3.24Å; V112-L116 WeakPolarHBondContact O-CG 3.3Å; V112-L116 PolarHBondContact O-N 3.36Å; S113-L116 PolarHBondContact O-N 3.39Å; L116-G118 VanDerWaalsContact C-N 3.35Å; L116-L119 PolarHBondContact O-N 3Å; L116-I120 WeakPolarHBondContact O-CB 3.27Å; L116-I120 VanDerWaalsContact O-CG1 3.23Å; L116-I120 WeakPolarHBondContact O-CG1 3.17Å; L116-I120 PolarHBondContact O-N 3Å; L116-I151 HydrophobicContact CD2-CD1 4.01Å |
| 117 | L | 90.9 | Very high | 90.8 | Very high | 4 Ų | 4 | 22.6 Ų | 22.6 | 2% | 0.021 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -63.9 | -39.7 | 175.3 | -70.5 | 172 | 0 | 0 | 0 | 111.9 | L68 S113 I114 I120 S121 F248 F252 M299 | L68-L117 HydrophobicContact CD2-CD2 3.74Å; L68-L117 HydrophobicContact CD2-CG 4.21Å; S113-L117 WeakPolarHBondContact O-CB 3.41Å; S113-L117 WeakPolarHBondContact O-CG 3.46Å; S113-L117 PolarHBondContact O-N 3.39Å; I114-L117 PolarHBondContact O-N 3.48Å; L117-I120 HydrophobicContact CD2-CD1 4.36Å; L117-I120 PolarHBondContact O-N 2.93Å; L117-S121 PolarHBondContact O-N 2.93Å; L117-S121 VanDerWaalsContact O-N 3.12Å; L117-S121 PolarHBondContact O-OG 3.32Å; L117-S121 VanDerWaalsContact O-OG 3.07Å; L117-F248 HydrophobicContact CB-CD2 4.23Å; L117-F248 HydrophobicContact CD1-CD2 3.94Å; L117-F252 HydrophobicContact CD1-CE2 3.69Å; L117-F252 HydrophobicContact CD1-CZ 4.38Å; L117-M299 HydrophobicContact CD2-CE 3.54Å; L117-M299 HydrophobicContact CD2-SD 3.64Å |
| 118 | G | 90.9 | Very high | 90.4 | Very high | 4 Ų | 4 | 23.3 Ų | 23.3 | 4% | 0.041 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -58 | -49.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | I114 T115 L116 I120 S121 I122 | I114-G118 PolarHBondContact O-N 2.95Å; T115-G118 PolarHBondContact O-N 3.43Å; L116-G118 VanDerWaalsContact C-N 3.35Å; G118-I120 PolarHBondContact O-N 3.21Å; G118-S121 WeakPolarHBondContact O-CB 3.39Å; G118-S121 PolarHBondContact O-N 3.47Å; G118-S121 VanDerWaalsContact O-N 3.15Å; G118-I122 WeakPolarHBondContact O-CG1 3.48Å; G118-I122 PolarHBondContact O-N 2.96Å |
| 119 | L | 91.8 | Very high | 89.9 | Confident | 27 Ų | 27 | 26.6 Ų | 26.6 | 14% | 0.141 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -65.7 | -36.2 | 178.6 | -72.1 | 169 | 0 | 0 | 0 | 113.3 | F64 T115 L116 S121 I122 D123 W143 V147 I151 | F64-L119 HydrophobicContact CD1-CB 4.5Å; F64-L119 HydrophobicContact CE1-CB 4.13Å; F64-L119 HydrophobicContact CE1-CD1 4Å; F64-L119 HydrophobicContact CE2-CB 4.14Å; F64-L119 HydrophobicContact CZ-CB 3.92Å; F64-L119 HydrophobicContact CZ-CD1 4.35Å; T115-L119 HydrophobicContact CG2-CD1 4.17Å; T115-L119 WeakPolarHBondContact O-CG 3.41Å; T115-L119 PolarHBondContact O-N 3.42Å; L116-L119 PolarHBondContact O-N 3Å; L119-S121 PolarHBondContact O-N 2.99Å; L119-I122 PolarHBondContact O-N 3.42Å; L119-D123 VanDerWaalsContact O-CB 3.25Å; L119-D123 WeakPolarHBondContact O-CB 3.36Å; L119-D123 PolarHBondContact O-N 2.98Å; L119-W143 HydrophobicContact CD2-CH2 4.15Å; L119-W143 HydrophobicContact CD2-CZ2 4.49Å; L119-V147 HydrophobicContact CD1-CG1 3.43Å; L119-V147 VanDerWaalsContact CD1-CG1 3.43Å; L119-V147 HydrophobicContact CD2-CG1 4.25Å; L119-I151 HydrophobicContact CD1-CD1 3.54Å |
| 120 | I | 89.5 | Confident | 89.3 | Confident | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -59.7 | -40.4 | 172.5 | -73.6 | 163.3 | 0 | 0 | 0 | 110.3 | L61 F64 L65 L68 L116 L117 G118 D123 R124 M299 | L61-I120 HydrophobicContact CD1-CB 4.44Å; L61-I120 HydrophobicContact CD1-CG1 4.1Å; L61-I120 HydrophobicContact CD1-CG2 3.73Å; F64-I120 HydrophobicContact CB-CD1 3.98Å; F64-I120 HydrophobicContact CB-CG1 3.58Å; F64-I120 HydrophobicContact CD2-CG1 4.1Å; F64-I120 HydrophobicContact CG-CG1 4.16Å; L65-I120 HydrophobicContact CD2-CD1 3.76Å; L68-I120 HydrophobicContact CD2-CD1 4.28Å; L116-I120 WeakPolarHBondContact O-CB 3.27Å; L116-I120 VanDerWaalsContact O-CG1 3.23Å; L116-I120 WeakPolarHBondContact O-CG1 3.17Å; L116-I120 PolarHBondContact O-N 3Å; L117-I120 HydrophobicContact CD2-CD1 4.36Å; L117-I120 PolarHBondContact O-N 2.93Å; G118-I120 PolarHBondContact O-N 3.21Å; I120-D123 PolarHBondContact O-N 3.12Å; I120-R124 WeakPolarHBondContact O-CG 3.36Å; I120-R124 PolarHBondContact O-N 3.4Å; I120-M299 HydrophobicContact CD1-CE 4.22Å; I120-M299 HydrophobicContact CG2-CE 4.19Å |
| 121 | S | 86.3 | Confident | 89 | Confident | 1 Ų | 1 | 30.4 Ų | 30.4 | 1% | 0.007 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -72.2 | -41.4 | 179.9 | -61.6 | 0 | 0 | 0 | 0 | 112.2 | L117 G118 L119 D123 R124 Y125 L207 Y211 | L117-S121 PolarHBondContact O-N 2.93Å; L117-S121 VanDerWaalsContact O-N 3.12Å; L117-S121 PolarHBondContact O-OG 3.32Å; L117-S121 VanDerWaalsContact O-OG 3.07Å; G118-S121 WeakPolarHBondContact O-CB 3.39Å; G118-S121 PolarHBondContact O-N 3.47Å; G118-S121 VanDerWaalsContact O-N 3.15Å; L119-S121 PolarHBondContact O-N 2.99Å; S121-D123 VanDerWaalsContact C-N 3.34Å; S121-D123 PolarHBondContact O-N 2.97Å; S121-R124 PolarHBondContact O-N 3.35Å; S121-Y125 WeakPolarHBondContact O-CB 3.33Å; S121-Y125 PolarHBondContact O-N 2.88Å; S121-L207 WeakPolarHBondContact OG-CD2 3.21Å; S121-Y211 VanDerWaalsContact OG-CE2 3.23Å; S121-Y211 WeakPolarHBondContact OG-CE2 3.06Å; S121-Y211 VanDerWaalsContact OG-CZ 3.23Å; S121-Y211 PolarHBondContact OG-OH 3.36Å; S121-Y211 VanDerWaalsContact OG-OH 3.06Å |
| 122 | I | 87.4 | Confident | 88.6 | Confident | 58 Ų | 58 | 31.4 Ų | 31.4 | 30% | 0.297 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -60.4 | -44.4 | 171 | -67.3 | 168.2 | 0 | 0 | 0 | 110.5 | G118 L119 R124 Y125 L126 | G118-I122 WeakPolarHBondContact O-CG1 3.48Å; G118-I122 PolarHBondContact O-N 2.96Å; L119-I122 PolarHBondContact O-N 3.42Å; I122-R124 VanDerWaalsContact C-N 3.32Å; I122-R124 PolarHBondContact O-N 3.37Å; I122-Y125 PolarHBondContact O-N 3.35Å; I122-L126 HydrophobicContact CG2-CD1 3.71Å; I122-L126 HydrophobicContact CG2-CG 4.08Å; I122-L126 WeakPolarHBondContact O-CB 3.38Å; I122-L126 WeakPolarHBondContact O-CG 3.38Å; I122-L126 PolarHBondContact O-N 3.01Å |
| 123 | D | 88.1 | Confident | 88.1 | Confident | 1 Ų | 1 | 33.6 Ų | 33.6 | 1% | 0.005 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -57.8 | -44.6 | 178 | 170.5 | 95.9 | 0 | 0 | 0 | 111.7 | S60 F64 L119 I120 S121 K127 M138 | S60-D123 VanDerWaalsContact CB-OD1 3.23Å; S60-D123 WeakPolarHBondContact CB-OD1 3.43Å; S60-D123 PolarHBondContact OG-OD1 3.26Å; F64-D123 HydrophobicContact CE2-CB 4.24Å; L119-D123 VanDerWaalsContact O-CB 3.25Å; L119-D123 WeakPolarHBondContact O-CB 3.36Å; L119-D123 PolarHBondContact O-N 2.98Å; I120-D123 PolarHBondContact O-N 3.12Å; S121-D123 VanDerWaalsContact C-N 3.34Å; S121-D123 PolarHBondContact O-N 2.97Å; D123-K127 WeakPolarHBondContact O-CB 3.35Å; D123-K127 VanDerWaalsContact O-CG 3.27Å; D123-K127 WeakPolarHBondContact O-CG 3.46Å; D123-K127 PolarHBondContact O-N 3.3Å; D123-K127 VanDerWaalsContact O-N 3.09Å; D123-K127 WeakPolarHBondContact OD1-CE 3.18Å; D123-K127 IonicContact OD1-NZ 2.86Å; D123-K127 PolarHBondContact OD1-NZ 3.48Å; D123-K127 WeakPolarHBondContact OD2-CE 3.18Å; D123-K127 IonicContact OD2-NZ 2.68Å; D123-K127 PolarHBondContact OD2-NZ 3.24Å; D123-M138 VanDerWaalsContact CA-CE 3.5Å; D123-M138 HydrophobicContact CB-CE 3.55Å; D123-M138 WeakPolarHBondContact OD1-CE 3.25Å |
| 124 | R | 85.1 | Confident | 87.6 | Confident | 47 Ų | 47 | 36 Ų | 36 | 18% | 0.177 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64.4 | -46.5 | 175.2 | -73.3 | 175.6 | -177.4 | -74.4 | -13.3 | 111.9 | L61 I120 S121 I122 K127 I128 I214 | L61-R124 VanDerWaalsContact CD2-NH2 3.34Å; I120-R124 WeakPolarHBondContact O-CG 3.36Å; I120-R124 PolarHBondContact O-N 3.4Å; S121-R124 PolarHBondContact O-N 3.35Å; I122-R124 VanDerWaalsContact C-N 3.32Å; I122-R124 PolarHBondContact O-N 3.37Å; R124-K127 PolarHBondContact O-N 2.86Å; R124-I128 WeakPolarHBondContact O-CG1 3.01Å; R124-I128 PolarHBondContact O-N 3.42Å; R124-I214 HydrophobicContact CB-CD1 4.49Å |
| 125 | Y | 85.3 | Confident | 87.2 | Confident | 65 Ų | 65 | 40.9 Ų | 40.9 | 26% | 0.255 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -59.4 | -50.5 | 179.9 | -179.4 | -96.8 | 0 | 0 | 0 | 111.4 | S121 I122 K127 I128 Y129 K213 I214 | S121-Y125 WeakPolarHBondContact O-CB 3.33Å; S121-Y125 PolarHBondContact O-N 2.88Å; I122-Y125 PolarHBondContact O-N 3.35Å; Y125-K127 VanDerWaalsContact C-N 3.3Å; Y125-K127 PolarHBondContact O-N 3.47Å; Y125-I128 PolarHBondContact O-N 2.93Å; Y125-Y129 AromaticContact CD2-CD2 3.73Å; Y125-Y129 HydrophobicContact CD2-CD2 3.73Å; Y125-Y129 AromaticContact CD2-CE2 3.99Å; Y125-Y129 HydrophobicContact CD2-CE2 3.99Å; Y125-Y129 AromaticContact CE2-CD2 3.54Å; Y125-Y129 HydrophobicContact CE2-CD2 3.54Å; Y125-Y129 AromaticContact CE2-CE2 3.77Å; Y125-Y129 HydrophobicContact CE2-CE2 3.77Å; Y125-Y129 HydrophobicContact CE2-CG 4.07Å; Y125-Y129 HydrophobicContact CG-CD2 4.36Å; Y125-Y129 PolarHBondContact O-N 3.46Å; Y125-K213 HydrophobicContact CE2-CB 4.18Å; Y125-K213 HydrophobicContact CE2-CD 4.33Å; Y125-I214 HydrophobicContact CD2-CG1 4.4Å |
| 126 | L | 87.3 | Confident | 86.7 | Confident | 49 Ų | 49 | 48.8 Ų | 48.8 | 26% | 0.257 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -65.5 | -30.1 | 179.9 | -67.3 | 179.4 | 0 | 0 | 0 | 112.8 | I122 I128 G130 T134 M138 | I122-L126 HydrophobicContact CG2-CD1 3.71Å; I122-L126 HydrophobicContact CG2-CG 4.08Å; I122-L126 WeakPolarHBondContact O-CB 3.38Å; I122-L126 WeakPolarHBondContact O-CG 3.38Å; I122-L126 PolarHBondContact O-N 3.01Å; L126-I128 VanDerWaalsContact C-N 3.31Å; L126-I128 PolarHBondContact O-N 2.7Å; L126-G130 WeakPolarHBondContact O-CA 3.45Å; L126-G130 PolarHBondContact O-N 3.26Å; L126-T134 HydrophobicContact CB-CG2 4.1Å; L126-T134 HydrophobicContact CD1-CG2 4.33Å; L126-T134 HydrophobicContact CD2-CG2 4.26Å; L126-T134 HydrophobicContact CG-CG2 4.47Å; L126-M138 HydrophobicContact CB-CG 4.01Å; L126-M138 HydrophobicContact CD1-CG 4.4Å; L126-M138 HydrophobicContact CD1-SD 3.98Å |
| 127 | K | 85.2 | Confident | 86.2 | Confident | 61 Ų | 61 | 54.9 Ų | 54.9 | 27% | 0.265 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -68.3 | -28.2 | 172.2 | -77.4 | 170 | -178.2 | 161.8 | 0 | 113.2 | D123 R124 Y125 R135 M138 | D123-K127 WeakPolarHBondContact O-CB 3.35Å; D123-K127 VanDerWaalsContact O-CG 3.27Å; D123-K127 WeakPolarHBondContact O-CG 3.46Å; D123-K127 PolarHBondContact O-N 3.3Å; D123-K127 VanDerWaalsContact O-N 3.09Å; D123-K127 WeakPolarHBondContact OD1-CE 3.18Å; D123-K127 IonicContact OD1-NZ 2.86Å; D123-K127 PolarHBondContact OD1-NZ 3.48Å; D123-K127 WeakPolarHBondContact OD2-CE 3.18Å; D123-K127 IonicContact OD2-NZ 2.68Å; D123-K127 PolarHBondContact OD2-NZ 3.24Å; R124-K127 PolarHBondContact O-N 2.86Å; Y125-K127 VanDerWaalsContact C-N 3.3Å; Y125-K127 PolarHBondContact O-N 3.47Å; K127-R135 WeakPolarHBondContact O-CD 3.41Å; K127-M138 WeakPolarHBondContact CE-O 3.16Å; K127-M138 HydrophobicContact CG-CB 3.99Å; K127-M138 PolarHBondContact NZ-O 3.19Å |
| 128 | I | 81.7 | Confident | 85.8 | Confident | 65 Ų | 65 | 55 Ų | 55 | 33% | 0.333 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -91.5 | -32.7 | -178.1 | -64.2 | 166.6 | 0 | 0 | 0 | 112.5 | R124 Y125 L126 I214 K217 | R124-I128 WeakPolarHBondContact O-CG1 3.01Å; R124-I128 PolarHBondContact O-N 3.42Å; Y125-I128 PolarHBondContact O-N 2.93Å; L126-I128 VanDerWaalsContact C-N 3.31Å; L126-I128 PolarHBondContact O-N 2.7Å; I128-I214 HydrophobicContact CD1-CD1 4.18Å; I128-I214 HydrophobicContact CD1-CG1 3.99Å; I128-I214 HydrophobicContact CD1-CG2 4.18Å; I128-K217 HydrophobicContact CG2-CD 4.21Å; I128-K217 PolarHBondContact O-NZ 2.94Å |
| 129 | Y | 82.1 | Confident | 85.3 | Confident | 80 Ų | 80 | 63.7 Ų | 63.7 | 31% | 0.314 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -120.4 | -17.5 | -172.8 | -67.9 | -92.5 | 0 | 0 | 0 | 114.9 | Y125 K213 I214 K217 | Y125-Y129 AromaticContact CD2-CD2 3.73Å; Y125-Y129 HydrophobicContact CD2-CD2 3.73Å; Y125-Y129 AromaticContact CD2-CE2 3.99Å; Y125-Y129 HydrophobicContact CD2-CE2 3.99Å; Y125-Y129 AromaticContact CE2-CD2 3.54Å; Y125-Y129 HydrophobicContact CE2-CD2 3.54Å; Y125-Y129 AromaticContact CE2-CE2 3.77Å; Y125-Y129 HydrophobicContact CE2-CE2 3.77Å; Y125-Y129 HydrophobicContact CE2-CG 4.07Å; Y125-Y129 HydrophobicContact CG-CD2 4.36Å; Y125-Y129 PolarHBondContact O-N 3.46Å; Y129-K213 PolarHBondContact OH-O 3.15Å; Y129-I214 HydrophobicContact CE2-CG1 4.26Å; Y129-K217 HydrophobicContact CD1-CD 4.26Å; Y129-K217 HydrophobicContact CE1-CD 3.36Å; Y129-K217 HydrophobicContact CE2-CD 4.05Å; Y129-K217 WeakPolarHBondContact OH-CB 3.46Å; Y129-K217 WeakPolarHBondContact OH-CD 3.21Å |
| 130 | G | 82.8 | Confident | 85 | Confident | 10 Ų | 10 | 64.4 Ų | 64.4 | 10% | 0.103 | 32% | 0.317 | C | S | . | . | S | Bend | trans | -68.3 | 159 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113 | L126 R135 | L126-G130 WeakPolarHBondContact O-CA 3.45Å; L126-G130 PolarHBondContact O-N 3.26Å; G130-R135 PolarHBondContact O-NH1 3.4Å |
| 131 | S | 87.9 | Confident | 85.1 | Confident | 73 Ų | 73 | 66.1 Ų | 66.1 | 51% | 0.51 | 33% | 0.328 | S | S | . | . | trans | -62 | 167.7 | 173.8 | 70.5 | 0 | 0 | 0 | 0 | 112.1 | G133 T134 R135 | S131-G133 VanDerWaalsContact C-N 3.27Å; S131-G133 PolarHBondContact O-N 2.89Å; S131-T134 PolarHBondContact O-N 3.3Å; S131-T134 VanDerWaalsContact O-N 3.17Å; S131-T134 PolarHBondContact OG-N 3.06Å; S131-T134 PolarHBondContact OG-OG1 3.39Å; S131-T134 VanDerWaalsContact OG-OG1 3.13Å; S131-R135 WeakPolarHBondContact O-CG 3.44Å; S131-R135 PolarHBondContact O-N 2.6Å | ||
| 132 | A | 85.4 | Confident | 85.3 | Confident | 64 Ų | 64 | 73.7 Ų | 73.7 | 53% | 0.529 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -56.4 | -41 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | R135 R136 | A132-R135 PolarHBondContact O-N 3.23Å; A132-R136 PolarHBondContact O-N 2.95Å |
| 133 | G | 85.6 | Confident | 85.4 | Confident | 50 Ų | 50 | 73.8 Ų | 73.8 | 52% | 0.515 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -62.4 | -48.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | S131 R135 R136 K137 | S131-G133 VanDerWaalsContact C-N 3.27Å; S131-G133 PolarHBondContact O-N 2.89Å; G133-R135 PolarHBondContact O-N 3.37Å; G133-R136 PolarHBondContact O-N 3.05Å; G133-K137 PolarHBondContact O-N 3.03Å |
| 134 | T | 85.1 | Confident | 85.7 | Confident | 50 Ų | 50 | 73.7 Ų | 73.7 | 31% | 0.307 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -60.3 | -45.6 | 176.5 | -56.9 | 0 | 0 | 0 | 0 | 111.3 | L126 S131 R136 K137 M138 | L126-T134 HydrophobicContact CB-CG2 4.1Å; L126-T134 HydrophobicContact CD1-CG2 4.33Å; L126-T134 HydrophobicContact CD2-CG2 4.26Å; L126-T134 HydrophobicContact CG-CG2 4.47Å; S131-T134 PolarHBondContact O-N 3.3Å; S131-T134 VanDerWaalsContact O-N 3.17Å; S131-T134 PolarHBondContact OG-N 3.06Å; S131-T134 PolarHBondContact OG-OG1 3.39Å; S131-T134 VanDerWaalsContact OG-OG1 3.13Å; T134-R136 VanDerWaalsContact C-N 3.31Å; T134-R136 PolarHBondContact O-N 3.2Å; T134-K137 PolarHBondContact O-N 2.94Å; T134-M138 HydrophobicContact CG2-CG 4.27Å; T134-M138 VanDerWaalsContact O-CG 3.27Å; T134-M138 WeakPolarHBondContact O-CG 3.12Å; T134-M138 PolarHBondContact O-N 3.24Å |
| 135 | R | 84.7 | Confident | 86.2 | Confident | 105 Ų | 105 | 75.9 Ų | 75.9 | 40% | 0.396 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60.7 | -39.1 | 177.1 | -68.1 | -172.1 | -54 | -101.8 | 8.1 | 112.3 | K127 G130 S131 A132 G133 R139 | K127-R135 WeakPolarHBondContact O-CD 3.41Å; G130-R135 PolarHBondContact O-NH1 3.4Å; S131-R135 WeakPolarHBondContact O-CG 3.44Å; S131-R135 PolarHBondContact O-N 2.6Å; A132-R135 PolarHBondContact O-N 3.23Å; G133-R135 PolarHBondContact O-N 3.37Å; R135-R139 WeakPolarHBondContact O-CG 3.19Å; R135-R139 PolarHBondContact O-N 2.78Å |
| 136 | R | 83.5 | Confident | 86.7 | Confident | 209 Ų | 209 | 76.9 Ų | 76.9 | 79% | 0.789 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -64.7 | -45 | 175.7 | -172.3 | 179.4 | -178.4 | -167.7 | 1.1 | 111.1 | A132 G133 T134 R139 | A132-R136 PolarHBondContact O-N 2.95Å; G133-R136 PolarHBondContact O-N 3.05Å; T134-R136 VanDerWaalsContact C-N 3.31Å; T134-R136 PolarHBondContact O-N 3.2Å; R136-R139 PolarHBondContact O-N 3.46Å |
| 137 | K | 82.9 | Confident | 87.1 | Confident | 130 Ų | 130 | 75.9 Ų | 75.9 | 57% | 0.565 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -59.2 | -47.7 | 176.2 | -171.1 | 176.4 | -179.8 | 178.6 | 0 | 111.5 | G133 T134 R139 S140 | G133-K137 PolarHBondContact O-N 3.03Å; T134-K137 PolarHBondContact O-N 2.94Å; K137-R139 PolarHBondContact O-N 3.43Å; K137-S140 WeakPolarHBondContact O-CB 3.44Å; K137-S140 PolarHBondContact O-N 2.85Å |
| 138 | M | 83.1 | Confident | 87.6 | Confident | 6 Ų | 6 | 73.1 Ų | 73.1 | 3% | 0.03 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -68.3 | -15 | 179.8 | -64.3 | -52.4 | -54.3 | 0 | 0 | 114.5 | S60 D123 L126 K127 T134 W143 | S60-M138 WeakPolarHBondContact CB-O 3.26Å; D123-M138 VanDerWaalsContact CA-CE 3.5Å; D123-M138 HydrophobicContact CB-CE 3.55Å; D123-M138 WeakPolarHBondContact OD1-CE 3.25Å; L126-M138 HydrophobicContact CB-CG 4.01Å; L126-M138 HydrophobicContact CD1-CG 4.4Å; L126-M138 HydrophobicContact CD1-SD 3.98Å; K127-M138 WeakPolarHBondContact CE-O 3.16Å; K127-M138 HydrophobicContact CG-CB 3.99Å; K127-M138 PolarHBondContact NZ-O 3.19Å; T134-M138 HydrophobicContact CG2-CG 4.27Å; T134-M138 VanDerWaalsContact O-CG 3.27Å; T134-M138 WeakPolarHBondContact O-CG 3.12Å; T134-M138 PolarHBondContact O-N 3.24Å; M138-W143 HydrophobicContact CE-CE3 3.68Å; M138-W143 HydrophobicContact CE-CH2 3.97Å; M138-W143 HydrophobicContact CE-CZ3 3.29Å; M138-W143 HydrophobicContact SD-CD2 4.37Å; M138-W143 HydrophobicContact SD-CE3 4Å; M138-W143 HydrophobicContact SD-CH2 4.45Å; M138-W143 HydrophobicContact SD-CZ3 4.02Å |
| 139 | R | 81.1 | Confident | 88.4 | Confident | 187 Ų | 187 | 72.8 Ų | 72.8 | 71% | 0.706 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -79.7 | -27.2 | 171.7 | -78.3 | 177.2 | 176.4 | 173.2 | -1.3 | 112.2 | R135 R136 K137 | R135-R139 WeakPolarHBondContact O-CG 3.19Å; R135-R139 PolarHBondContact O-N 2.78Å; R136-R139 PolarHBondContact O-N 3.46Å; K137-R139 PolarHBondContact O-N 3.43Å |
| 140 | S | 86.1 | Confident | 89.1 | Confident | 41 Ų | 41 | 73.7 Ų | 73.7 | 29% | 0.287 | 38% | 0.384 | S | S | . | . | S | Bend | trans | -76.2 | 139.2 | 178.3 | -172.9 | 0 | 0 | 0 | 0 | 111.1 | K137 K142 | K137-S140 WeakPolarHBondContact O-CB 3.44Å; K137-S140 PolarHBondContact O-N 2.85Å; S140-K142 PolarHBondContact O-N 3.12Å; S140-K142 PolarHBondContact OG-N 3.21Å |
| 141 | P | 90.2 | Very high | 89.7 | Confident | 36 Ų | 36 | 74.4 Ų | 74.4 | 23% | 0.234 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -74 | -14.5 | 173.1 | 31.6 | -36.4 | 0 | 0 | 0 | 113 | K58 V63 W143 S144 I145 | K58-P141 WeakPolarHBondContact O-CG 3.15Å; V63-P141 HydrophobicContact CG2-CB 3.89Å; P141-W143 VanDerWaalsContact C-N 3.3Å; P141-W143 PolarHBondContact O-N 2.9Å; P141-S144 PolarHBondContact O-N 3.28Å; P141-S144 PolarHBondContact O-OG 2.72Å; P141-I145 HydrophobicContact CB-CD1 4.14Å; P141-I145 VanDerWaalsContact O-CG1 3.24Å; P141-I145 WeakPolarHBondContact O-CG1 3.28Å; P141-I145 PolarHBondContact O-N 2.92Å |
| 142 | K | 91.1 | Very high | 90.1 | Very high | 160 Ų | 160 | 72.8 Ų | 72.8 | 70% | 0.696 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -57.1 | -43.5 | -174.2 | -66.9 | -175.2 | 178.9 | -175.8 | 0 | 112.4 | S140 I145 V146 | S140-K142 PolarHBondContact O-N 3.12Å; S140-K142 PolarHBondContact OG-N 3.21Å; K142-I145 PolarHBondContact O-N 3.44Å; K142-V146 WeakPolarHBondContact O-CG2 3.39Å; K142-V146 PolarHBondContact O-N 3.48Å; K142-V146 VanDerWaalsContact O-N 3.15Å |
| 143 | W | 90.2 | Very high | 90.6 | Very high | 60 Ų | 60 | 72.6 Ų | 72.6 | 23% | 0.227 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -66 | -45.5 | -179.4 | 172.9 | 75.8 | 0 | 0 | 0 | 112.1 | F64 L119 M138 P141 I145 V146 V147 | F64-W143 HydrophobicContact CE2-CE3 4.46Å; F64-W143 HydrophobicContact CE2-CH2 4.23Å; F64-W143 AromaticContact CE2-CZ3 3.59Å; F64-W143 HydrophobicContact CE2-CZ3 3.59Å; F64-W143 HydrophobicContact CZ-CE3 4.09Å; F64-W143 AromaticContact CZ-CH2 3.78Å; F64-W143 HydrophobicContact CZ-CH2 3.78Å; F64-W143 AromaticContact CZ-CZ3 3.33Å; F64-W143 HydrophobicContact CZ-CZ3 3.33Å; L119-W143 HydrophobicContact CD2-CH2 4.15Å; L119-W143 HydrophobicContact CD2-CZ2 4.49Å; M138-W143 HydrophobicContact CE-CE3 3.68Å; M138-W143 HydrophobicContact CE-CH2 3.97Å; M138-W143 HydrophobicContact CE-CZ3 3.29Å; M138-W143 HydrophobicContact SD-CD2 4.37Å; M138-W143 HydrophobicContact SD-CE3 4Å; M138-W143 HydrophobicContact SD-CH2 4.45Å; M138-W143 HydrophobicContact SD-CZ3 4.02Å; P141-W143 VanDerWaalsContact C-N 3.3Å; P141-W143 PolarHBondContact O-N 2.9Å; W143-I145 VanDerWaalsContact C-N 3.34Å; W143-I145 PolarHBondContact O-N 3.46Å; W143-V146 PolarHBondContact O-N 3.27Å; W143-V147 HydrophobicContact CD2-CG2 4.24Å; W143-V147 HydrophobicContact CZ2-CG2 3.89Å; W143-V147 WeakPolarHBondContact O-CG2 3.49Å; W143-V147 PolarHBondContact O-N 3.28Å |
| 144 | S | 94 | Very high | 91 | Very high | 0 Ų | 0 | 73.8 Ų | 73.8 | 0% | 0 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -68.5 | -33.6 | 179.4 | 55.8 | 0 | 0 | 0 | 0 | 112.3 | S60 V63 P141 V147 C148 | S60-S144 WeakPolarHBondContact CA-OG 3.28Å; S60-S144 PolarHBondContact O-OG 3.12Å; V63-S144 VanDerWaalsContact CB-OG 3.26Å; V63-S144 WeakPolarHBondContact CB-OG 3.2Å; V63-S144 WeakPolarHBondContact CG2-OG 3.48Å; P141-S144 PolarHBondContact O-N 3.28Å; P141-S144 PolarHBondContact O-OG 2.72Å; S144-V147 PolarHBondContact O-N 3.04Å; S144-C148 WeakPolarHBondContact O-CB 3.5Å; S144-C148 PolarHBondContact O-N 3.28Å; S144-C148 PolarHBondContact O-SG 2.69Å |
| 145 | I | 95.2 | Very high | 91.3 | Very high | 92 Ų | 92 | 72 Ų | 72 | 47% | 0.472 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -60.7 | -49.4 | 173.7 | -69.4 | 165.3 | 0 | 0 | 0 | 110.4 | V63 P141 K142 W143 V147 C148 A149 | V63-I145 HydrophobicContact CG1-CG1 3.99Å; V63-I145 HydrophobicContact CG2-CG1 4.07Å; P141-I145 HydrophobicContact CB-CD1 4.14Å; P141-I145 VanDerWaalsContact O-CG1 3.24Å; P141-I145 WeakPolarHBondContact O-CG1 3.28Å; P141-I145 PolarHBondContact O-N 2.92Å; K142-I145 PolarHBondContact O-N 3.44Å; W143-I145 VanDerWaalsContact C-N 3.34Å; W143-I145 PolarHBondContact O-N 3.46Å; I145-V147 PolarHBondContact O-N 3.47Å; I145-C148 PolarHBondContact O-N 3.5Å; I145-A149 WeakPolarHBondContact O-CB 3.39Å; I145-A149 PolarHBondContact O-N 3Å |
| 146 | V | 95.4 | Very high | 91.6 | Very high | 86 Ų | 86 | 71.3 Ų | 71.3 | 52% | 0.521 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -61.4 | -46.4 | 179 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | K142 W143 C148 A149 I150 | K142-V146 WeakPolarHBondContact O-CG2 3.39Å; K142-V146 PolarHBondContact O-N 3.48Å; K142-V146 VanDerWaalsContact O-N 3.15Å; W143-V146 PolarHBondContact O-N 3.27Å; V146-C148 PolarHBondContact O-N 3.46Å; V146-A149 PolarHBondContact O-N 2.81Å; V146-I150 HydrophobicContact CG1-CD1 4.01Å; V146-I150 WeakPolarHBondContact O-CG1 3.31Å; V146-I150 PolarHBondContact O-N 3.12Å |
| 147 | V | 95.3 | Very high | 91.9 | Very high | 28 Ų | 28 | 64 Ų | 64 | 17% | 0.17 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -63.2 | -43.9 | 179.4 | 172.4 | 0 | 0 | 0 | 0 | 111.5 | F64 L119 W143 S144 I145 I150 I151 | F64-V147 HydrophobicContact CE1-CG1 4.39Å; L119-V147 HydrophobicContact CD1-CG1 3.43Å; L119-V147 VanDerWaalsContact CD1-CG1 3.43Å; L119-V147 HydrophobicContact CD2-CG1 4.25Å; W143-V147 HydrophobicContact CD2-CG2 4.24Å; W143-V147 HydrophobicContact CZ2-CG2 3.89Å; W143-V147 WeakPolarHBondContact O-CG2 3.49Å; W143-V147 PolarHBondContact O-N 3.28Å; S144-V147 PolarHBondContact O-N 3.04Å; I145-V147 PolarHBondContact O-N 3.47Å; V147-I150 PolarHBondContact O-N 3.03Å; V147-I151 HydrophobicContact CG1-CD1 3.95Å; V147-I151 WeakPolarHBondContact O-CG1 3.17Å; V147-I151 PolarHBondContact O-N 3.1Å |
| 148 | C | 97.1 | Very high | 91.9 | Very high | 4 Ų | 4 | 62.5 Ų | 62.5 | 3% | 0.027 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -62.2 | -42.7 | 175.1 | -73.3 | 0 | 0 | 0 | 0 | 112 | F64 N67 S144 I145 V146 I150 I151 W152 | F64-C148 VanDerWaalsContact CD1-SG 3.51Å; N67-C148 PolarHBondContact ND2-SG 2.95Å; S144-C148 WeakPolarHBondContact O-CB 3.5Å; S144-C148 PolarHBondContact O-N 3.28Å; S144-C148 PolarHBondContact O-SG 2.69Å; I145-C148 PolarHBondContact O-N 3.5Å; V146-C148 PolarHBondContact O-N 3.46Å; C148-I150 VanDerWaalsContact C-N 3.28Å; C148-I150 PolarHBondContact O-N 3.44Å; C148-I151 PolarHBondContact O-N 3.31Å; C148-I151 VanDerWaalsContact O-N 3.16Å; C148-W152 PolarHBondContact O-N 3.46Å |
| 149 | A | 97 | Very high | 91.8 | Very high | 58 Ų | 58 | 64.2 Ų | 64.2 | 48% | 0.479 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -58.9 | -41.3 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | I145 V146 W152 A153 | I145-A149 WeakPolarHBondContact O-CB 3.39Å; I145-A149 PolarHBondContact O-N 3Å; V146-A149 PolarHBondContact O-N 2.81Å; A149-W152 PolarHBondContact O-N 2.86Å; A149-A153 WeakPolarHBondContact O-CB 3.41Å; A149-A153 PolarHBondContact O-N 3.28Å |
| 150 | I | 96.8 | Very high | 91.5 | Very high | 99 Ų | 99 | 61.1 Ų | 61.1 | 51% | 0.508 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -63.4 | -46.1 | 174.7 | -66.2 | 165.3 | 0 | 0 | 0 | 110.8 | V146 V147 C148 W152 A153 V154 | V146-I150 HydrophobicContact CG1-CD1 4.01Å; V146-I150 WeakPolarHBondContact O-CG1 3.31Å; V146-I150 PolarHBondContact O-N 3.12Å; V147-I150 PolarHBondContact O-N 3.03Å; C148-I150 VanDerWaalsContact C-N 3.28Å; C148-I150 PolarHBondContact O-N 3.44Å; I150-W152 VanDerWaalsContact C-N 3.32Å; I150-W152 PolarHBondContact O-N 2.74Å; I150-A153 PolarHBondContact O-N 2.72Å; I150-V154 HydrophobicContact CG2-CG2 4.18Å; I150-V154 WeakPolarHBondContact O-CB 3.24Å; I150-V154 VanDerWaalsContact O-CG2 3.27Å; I150-V154 WeakPolarHBondContact O-CG2 3.24Å; I150-V154 PolarHBondContact O-N 3.42Å |
| 151 | I | 96.3 | Very high | 90.8 | Very high | 25 Ų | 25 | 63 Ų | 63 | 13% | 0.128 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -57.4 | -46.6 | 178.4 | -69.4 | 164.6 | 0 | 0 | 0 | 110.9 | V112 T115 L116 L119 V147 C148 V154 A155 | V112-I151 HydrophobicContact CG1-CG2 4.25Å; V112-I151 HydrophobicContact CG2-CG2 4.05Å; T115-I151 HydrophobicContact CG2-CD1 3.75Å; T115-I151 HydrophobicContact CG2-CG1 4.14Å; L116-I151 HydrophobicContact CD2-CD1 4.01Å; L119-I151 HydrophobicContact CD1-CD1 3.54Å; V147-I151 HydrophobicContact CG1-CD1 3.95Å; V147-I151 WeakPolarHBondContact O-CG1 3.17Å; V147-I151 PolarHBondContact O-N 3.1Å; C148-I151 PolarHBondContact O-N 3.31Å; C148-I151 VanDerWaalsContact O-N 3.16Å; I151-V154 PolarHBondContact O-N 3.12Å; I151-A155 VanDerWaalsContact O-CB 3.31Å; I151-A155 WeakPolarHBondContact O-CB 3.47Å; I151-A155 PolarHBondContact O-N 3.1Å |
| 152 | W | 96.9 | Very high | 89.8 | Confident | 39 Ų | 39 | 65.4 Ų | 65.4 | 15% | 0.148 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -65.9 | -43.8 | 178.2 | -77 | 107.7 | 0 | 0 | 0 | 112.4 | N67 F70 A71 L74 M108 V112 C148 A149 I150 V154 A155 L156 | N67-W152 PolarHBondContact OD1-NE1 2.83Å; F70-W152 AromaticContact CD1-CH2 3.5Å; F70-W152 HydrophobicContact CD1-CH2 3.5Å; F70-W152 AromaticContact CD1-CZ2 3.54Å; F70-W152 HydrophobicContact CD1-CZ2 3.54Å; F70-W152 HydrophobicContact CD1-CZ3 4.32Å; F70-W152 AromaticContact CE1-CH2 3.75Å; F70-W152 HydrophobicContact CE1-CH2 3.75Å; F70-W152 HydrophobicContact CE1-CZ2 4.12Å; F70-W152 HydrophobicContact CE1-CZ3 4.12Å; A71-W152 HydrophobicContact CB-CH2 4.14Å; A71-W152 HydrophobicContact CB-CZ2 4.19Å; L74-W152 HydrophobicContact CD1-CH2 3.63Å; L74-W152 HydrophobicContact CD1-CZ3 3.67Å; M108-W152 HydrophobicContact CE-CD2 4.38Å; M108-W152 HydrophobicContact CE-CE3 3.33Å; M108-W152 HydrophobicContact CE-CH2 3.77Å; M108-W152 HydrophobicContact CE-CZ3 3Å; M108-W152 HydrophobicContact SD-CZ3 4.24Å; V112-W152 HydrophobicContact CG1-CZ2 4.49Å; C148-W152 PolarHBondContact O-N 3.46Å; A149-W152 PolarHBondContact O-N 2.86Å; I150-W152 VanDerWaalsContact C-N 3.32Å; I150-W152 PolarHBondContact O-N 2.74Å; W152-V154 VanDerWaalsContact C-N 3.35Å; W152-V154 PolarHBondContact O-N 2.85Å; W152-A155 PolarHBondContact O-N 3.48Å; W152-L156 WeakPolarHBondContact O-CB 3.48Å; W152-L156 VanDerWaalsContact O-CG 3.25Å; W152-L156 WeakPolarHBondContact O-CG 3.22Å; W152-L156 PolarHBondContact O-N 2.79Å |
| 153 | A | 95.9 | Very high | 88.7 | Confident | 60 Ų | 60 | 60.1 Ų | 60.1 | 50% | 0.496 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -60.5 | -45.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | A149 I150 A157 | A149-A153 WeakPolarHBondContact O-CB 3.41Å; A149-A153 PolarHBondContact O-N 3.28Å; I150-A153 PolarHBondContact O-N 2.72Å; A153-A157 VanDerWaalsContact O-CB 3.3Å; A153-A157 WeakPolarHBondContact O-CB 3.35Å; A153-A157 PolarHBondContact O-N 3.06Å |
| 154 | V | 92.4 | Very high | 87.5 | Confident | 74 Ų | 74 | 64.9 Ų | 64.9 | 45% | 0.448 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63 | -47.4 | 176.7 | 171.7 | 0 | 0 | 0 | 0 | 110.6 | I150 I151 W152 A157 F158 | I150-V154 HydrophobicContact CG2-CG2 4.18Å; I150-V154 WeakPolarHBondContact O-CB 3.24Å; I150-V154 VanDerWaalsContact O-CG2 3.27Å; I150-V154 WeakPolarHBondContact O-CG2 3.24Å; I150-V154 PolarHBondContact O-N 3.42Å; I151-V154 PolarHBondContact O-N 3.12Å; W152-V154 VanDerWaalsContact C-N 3.35Å; W152-V154 PolarHBondContact O-N 2.85Å; V154-A157 PolarHBondContact O-N 3.25Å; V154-F158 HydrophobicContact CG1-CD2 3.81Å; V154-F158 HydrophobicContact CG1-CE2 3.6Å; V154-F158 WeakPolarHBondContact O-CD2 3.2Å; V154-F158 PolarHBondContact O-N 3.32Å; V154-F158 VanDerWaalsContact O-N 3.13Å |
| 155 | A | 91.9 | Very high | 85.9 | Confident | 12 Ų | 12 | 68.3 Ų | 68.3 | 10% | 0.099 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -57.4 | -58 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | Y104 M108 V112 I151 W152 A157 F158 M159 | Y104-A155 PolarHBondContact OH-O 2.82Å; M108-A155 HydrophobicContact CE-CB 3.68Å; M108-A155 HydrophobicContact CG-CB 4.01Å; V112-A155 HydrophobicContact CG2-CB 4.2Å; I151-A155 VanDerWaalsContact O-CB 3.31Å; I151-A155 WeakPolarHBondContact O-CB 3.47Å; I151-A155 PolarHBondContact O-N 3.1Å; W152-A155 PolarHBondContact O-N 3.48Å; A155-A157 PolarHBondContact O-N 2.95Å; A155-A157 VanDerWaalsContact O-N 3.14Å; A155-F158 WeakPolarHBondContact O-CA 3.21Å; A155-F158 WeakPolarHBondContact O-CB 3.15Å; A155-F158 PolarHBondContact O-N 3.07Å; A155-M159 PolarHBondContact O-N 3.5Å |
| 156 | L | 91.3 | Very high | 83.7 | Confident | 91 Ų | 91 | 68.7 Ų | 68.7 | 48% | 0.476 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -56.5 | -34.7 | 179.6 | -66.4 | 171.6 | 0 | 0 | 0 | 113.1 | W152 M159 | W152-L156 WeakPolarHBondContact O-CB 3.48Å; W152-L156 VanDerWaalsContact O-CG 3.25Å; W152-L156 WeakPolarHBondContact O-CG 3.22Å; W152-L156 PolarHBondContact O-N 2.79Å; L156-M159 WeakPolarHBondContact O-CB 3.37Å; L156-M159 PolarHBondContact O-N 3.24Å; L156-M159 VanDerWaalsContact O-N 3.14Å |
| 157 | A | 89.3 | Confident | 81.5 | Confident | 55 Ų | 55 | 70.9 Ų | 70.9 | 46% | 0.455 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -62.6 | -41.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | A153 V154 A155 M159 I160 P161 | A153-A157 VanDerWaalsContact O-CB 3.3Å; A153-A157 WeakPolarHBondContact O-CB 3.35Å; A153-A157 PolarHBondContact O-N 3.06Å; V154-A157 PolarHBondContact O-N 3.25Å; A155-A157 PolarHBondContact O-N 2.95Å; A155-A157 VanDerWaalsContact O-N 3.14Å; A157-M159 PolarHBondContact O-N 3.09Å; A157-I160 PolarHBondContact O-N 2.94Å; A157-P161 WeakPolarHBondContact O-CD 3.29Å |
| 158 | F | 83 | Confident | 79.5 | Confident | 100 Ų | 100 | 71.5 Ų | 71.5 | 44% | 0.439 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -67.4 | -17.6 | 174.5 | -80.4 | -72.9 | 0 | 0 | 0 | 113.6 | Y104 V154 A155 | Y104-F158 HydrophobicContact CE2-CB 4.5Å; V154-F158 HydrophobicContact CG1-CD2 3.81Å; V154-F158 HydrophobicContact CG1-CE2 3.6Å; V154-F158 WeakPolarHBondContact O-CD2 3.2Å; V154-F158 PolarHBondContact O-N 3.32Å; V154-F158 VanDerWaalsContact O-N 3.13Å; A155-F158 WeakPolarHBondContact O-CA 3.21Å; A155-F158 WeakPolarHBondContact O-CB 3.15Å; A155-F158 PolarHBondContact O-N 3.07Å |
| 159 | M | 80.9 | Confident | 77.2 | Confident | 41 Ų | 41 | 80.7 Ų | 80.7 | 20% | 0.202 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -68.8 | -38.4 | 176.1 | -167.4 | -176.1 | -132.5 | 0 | 0 | 112.6 | L101 Y104 L105 A155 L156 A157 F162 V163 | L101-M159 HydrophobicContact CD1-CE 3.27Å; Y104-M159 HydrophobicContact CD1-CB 4.14Å; Y104-M159 HydrophobicContact CD1-CE 3.42Å; Y104-M159 VanDerWaalsContact CD1-CE 3.42Å; Y104-M159 HydrophobicContact CD1-CG 3.61Å; Y104-M159 HydrophobicContact CD1-SD 4.26Å; Y104-M159 HydrophobicContact CD2-CB 4.41Å; Y104-M159 HydrophobicContact CD2-CG 4.35Å; Y104-M159 HydrophobicContact CE1-CB 3.57Å; Y104-M159 HydrophobicContact CE1-CE 3.7Å; Y104-M159 HydrophobicContact CE1-CG 3.51Å; Y104-M159 HydrophobicContact CE1-SD 4.1Å; Y104-M159 HydrophobicContact CE2-CB 3.87Å; Y104-M159 HydrophobicContact CE2-CG 4.27Å; Y104-M159 HydrophobicContact CG-CE 4.42Å; Y104-M159 HydrophobicContact CG-CG 4.06Å; Y104-M159 VanDerWaalsContact CZ-CA 3.48Å; Y104-M159 VanDerWaalsContact CZ-CB 3.43Å; Y104-M159 PolarHBondContact OH-N 3.4Å; L105-M159 HydrophobicContact CD2-CE 4.04Å; L105-M159 HydrophobicContact CG-CE 4.32Å; A155-M159 PolarHBondContact O-N 3.5Å; L156-M159 WeakPolarHBondContact O-CB 3.37Å; L156-M159 PolarHBondContact O-N 3.24Å; L156-M159 VanDerWaalsContact O-N 3.14Å; A157-M159 PolarHBondContact O-N 3.09Å; M159-F162 WeakPolarHBondContact O-CB 3.47Å; M159-F162 PolarHBondContact O-N 3.16Å; M159-F162 VanDerWaalsContact O-N 3.15Å; M159-V163 HydrophobicContact CG-CG2 4.01Å; M159-V163 PolarHBondContact O-N 3.4Å |
| 160 | I | 75.1 | Confident | 75.1 | Confident | 123 Ų | 123 | 80.1 Ų | 80.1 | 63% | 0.631 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -56 | -55.6 | -172.2 | -63.3 | 165.8 | 0 | 0 | 0 | 112.3 | A157 F162 H164 | A157-I160 PolarHBondContact O-N 2.94Å; I160-F162 VanDerWaalsContact C-N 3.28Å; I160-F162 PolarHBondContact O-N 3.36Å; I160-H164 WeakPolarHBondContact O-CB 3.33Å; I160-H164 PolarHBondContact O-N 3.48Å; I160-H164 VanDerWaalsContact O-N 3.16Å |
| 161 | P | 71.6 | Confident | 72.9 | Confident | 81 Ų | 81 | 81.4 Ų | 81.4 | 53% | 0.526 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -65.3 | -33.7 | 179 | 26 | -34.3 | 0 | 0 | 0 | 112.1 | A157 V163 H164 E165 | A157-P161 WeakPolarHBondContact O-CD 3.29Å; P161-V163 PolarHBondContact O-N 3.14Å; P161-H164 PolarHBondContact O-N 3.08Å; P161-E165 WeakPolarHBondContact O-CB 3.41Å; P161-E165 PolarHBondContact O-N 3.43Å |
| 162 | F | 68.9 | Low | 70.8 | Confident | 85 Ų | 85 | 87.7 Ų | 87.7 | 37% | 0.373 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -65.8 | -38.9 | -176.5 | -164.7 | -87.5 | 0 | 0 | 0 | 113 | K100 Y104 M159 I160 | K100-F162 HydrophobicContact CB-CD1 4.38Å; K100-F162 HydrophobicContact CB-CE1 4.22Å; K100-F162 HydrophobicContact CG-CE1 4.5Å; K100-F162 WeakPolarHBondContact O-CE1 3.36Å; Y104-F162 HydrophobicContact CD2-CB 3.92Å; Y104-F162 AromaticContact CD2-CD1 3.92Å; Y104-F162 HydrophobicContact CD2-CD1 3.92Å; Y104-F162 HydrophobicContact CD2-CD2 4.42Å; Y104-F162 AromaticContact CD2-CG 3.83Å; Y104-F162 HydrophobicContact CD2-CG 3.83Å; Y104-F162 HydrophobicContact CG-CD1 4.17Å; M159-F162 WeakPolarHBondContact O-CB 3.47Å; M159-F162 PolarHBondContact O-N 3.16Å; M159-F162 VanDerWaalsContact O-N 3.15Å; I160-F162 VanDerWaalsContact C-N 3.28Å; I160-F162 PolarHBondContact O-N 3.36Å |
| 163 | V | 68.1 | Low | 69.1 | Low | 50 Ų | 50 | 88.4 Ų | 88.4 | 30% | 0.303 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -80.2 | -39.1 | 178.3 | 178.8 | 0 | 0 | 0 | 0 | 111.1 | T97 M159 P161 E165 | T97-V163 HydrophobicContact CG2-CG1 4.32Å; M159-V163 HydrophobicContact CG-CG2 4.01Å; M159-V163 PolarHBondContact O-N 3.4Å; P161-V163 PolarHBondContact O-N 3.14Å; V163-E165 PolarHBondContact O-N 3.46Å |
| 164 | H | 64.3 | Low | 67.8 | Low | 160 Ų | 160 | 89.2 Ų | 89.2 | 74% | 0.741 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -80.4 | -13.3 | -171.3 | -154.9 | 74.9 | 0 | 0 | 0 | 114.9 | I160 P161 S166 | I160-H164 WeakPolarHBondContact O-CB 3.33Å; I160-H164 PolarHBondContact O-N 3.48Å; I160-H164 VanDerWaalsContact O-N 3.16Å; P161-H164 PolarHBondContact O-N 3.08Å; H164-S166 PolarHBondContact O-N 3.41Å |
| 165 | E | 61.9 | Low | 66.9 | Low | 71 Ų | 71 | 88.2 Ų | 88.2 | 33% | 0.332 | 48% | 0.479 | S | S | . | . | trans | -67.1 | 92 | -177 | -160.8 | 178.6 | -180 | 0 | 0 | 112.5 | K100 P161 V163 N167 K189 | K100-E165 PolarHBondContact NZ-O 3.1Å; P161-E165 WeakPolarHBondContact O-CB 3.41Å; P161-E165 PolarHBondContact O-N 3.43Å; V163-E165 PolarHBondContact O-N 3.46Å; E165-N167 VanDerWaalsContact C-N 3.26Å; E165-N167 PolarHBondContact O-N 2.88Å; E165-K189 VanDerWaalsContact CD-NZ 3.27Å; E165-K189 WeakPolarHBondContact OE1-CE 3.38Å; E165-K189 IonicContact OE1-NZ 3.12Å; E165-K189 PolarHBondContact OE1-NZ 2.96Å; E165-K189 WeakPolarHBondContact OE2-CE 3.31Å; E165-K189 IonicContact OE2-NZ 2.69Å; E165-K189 PolarHBondContact OE2-NZ 3.08Å; E165-K189 VanDerWaalsContact OE2-NZ 3.12Å | ||
| 166 | S | 47.9 | Very low | 66.2 | Low | 101 Ų | 101 | 87.8 Ų | 87.8 | 71% | 0.706 | 48% | 0.475 | S | S | * | . | trans | -77.4 | -0.3 | -174.9 | 56.7 | 0 | 0 | 0 | 0 | 115.2 | H164 D168 | H164-S166 PolarHBondContact O-N 3.41Å; S166-D168 PolarHBondContact O-N 3.11Å | ||
| 167 | N | 49.3 | Very low | 65.3 | Low | 131 Ų | 131 | 85 Ų | 85 | 70% | 0.701 | 46% | 0.459 | S | S | * | . | trans | -97.5 | 29.4 | -166.6 | -77.1 | -7.9 | 0 | 0 | 0 | 114.9 | E165 K169 | E165-N167 VanDerWaalsContact C-N 3.26Å; E165-N167 PolarHBondContact O-N 2.88Å; N167-K169 PolarHBondContact O-N 3.22Å | ||
| 168 | D | 54 | Low | 64.2 | Low | 41 Ų | 41 | 84.4 Ų | 84.4 | 22% | 0.219 | 45% | 0.447 | C | S | . | . | trans | -71.8 | 100.9 | 167 | -91.8 | -10.2 | 0 | 0 | 0 | 109 | H96 S166 C170 R180 | H96-D168 IonicContact CE1-OD2 2.72Å; H96-D168 IonicContact NE2-OD2 2.84Å; H96-D168 PolarHBondContact NE2-OD2 2.98Å; S166-D168 PolarHBondContact O-N 3.11Å; D168-C170 PolarHBondContact O-N 3.41Å; D168-R180 VanDerWaalsContact CG-NH1 3.31Å; D168-R180 IonicContact OD2-CZ 3.68Å; D168-R180 IonicContact OD2-NE 3.85Å; D168-R180 IonicContact OD2-NH1 3.96Å; D168-R180 PolarHBondContact OD2-NH1 3.39Å | ||
| 169 | K | 48.5 | Very low | 62.9 | Low | 198 Ų | 198 | 81.4 Ų | 81.4 | 86% | 0.861 | 43% | 0.434 | S | S | * | . | S | Bend | trans | -59.3 | -12.8 | -179.7 | -63.4 | -177.7 | -178.1 | 178.2 | 0 | 114.2 | N167 | N167-K169 PolarHBondContact O-N 3.22Š|
| 170 | C | 52.1 | Low | 61.8 | Low | 45 Ų | 45 | 83.1 Ų | 83.1 | 30% | 0.304 | 44% | 0.438 | S | S | . | . | trans | -107 | 81.4 | 170.9 | -62.5 | 0 | 0 | 0 | 0 | 110.1 | C14 D168 N172 R180 | C14-C170 HydrophobicContact CB-CB 4.42Å; C14-C170 WeakPolarHBondContact CB-SG 3.45Å; C14-C170 WeakPolarHBondContact SG-CB 3.26Å; C14-C170 CovalentContact SG-SG 2.09Å; C14-C170 PolarHBondContact SG-SG 3.39Å; D168-C170 PolarHBondContact O-N 3.41Å; C170-N172 PolarHBondContact O-N 2.95Å; C170-R180 PolarHBondContact O-NH1 3.49Å; C170-R180 VanDerWaalsContact O-NH1 3.16Å | ||
| 171 | V | 51.5 | Low | 60.6 | Low | 127 Ų | 127 | 82 Ų | 82 | 77% | 0.77 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69 | -19.5 | 175 | 178.1 | 0 | 0 | 0 | 0 | 112.1 | ||
| 172 | N | 51.7 | Low | 59.6 | Low | 157 Ų | 157 | 79 Ų | 79 | 84% | 0.84 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.6 | 10.6 | -175.4 | -72.7 | -9.3 | 0 | 0 | 0 | 115.6 | C170 T174 | C170-N172 PolarHBondContact O-N 2.95Å; N172-T174 PolarHBondContact O-N 3.23Å |
| 173 | S | 61.1 | Low | 58.7 | Low | 54 Ų | 54 | 78.6 Ų | 78.6 | 38% | 0.378 | 42% | 0.422 | S | S | . | . | trans | -79.6 | 118.7 | 175.7 | -175.9 | 0 | 0 | 0 | 0 | 110.7 | K175 | S173-K175 PolarHBondContact O-N 3.42Å; S173-K175 PolarHBondContact OG-N 3.41Å | ||
| 174 | T | 69.9 | Low | 57.8 | Low | 77 Ų | 77 | 85.5 Ų | 85.5 | 47% | 0.472 | 45% | 0.451 | S | S | . | . | trans | -74.9 | -6.5 | 175.1 | 57.7 | 0 | 0 | 0 | 0 | 113 | W92 N172 | W92-T174 WeakPolarHBondContact CB-O 3.33Å; W92-T174 PolarHBondContact N-O 3.07Å; N172-T174 PolarHBondContact O-N 3.23Å | ||
| 175 | K | 73.1 | Confident | 57.1 | Low | 53 Ų | 53 | 86.6 Ų | 86.6 | 23% | 0.23 | 46% | 0.457 | C | S | . | . | trans | -84 | 133.6 | 177.2 | -68.7 | -170.3 | 176.7 | -179.9 | 0 | 110.4 | S17 S173 | S17-K175 PolarHBondContact OG-NZ 2.93Å; S173-K175 PolarHBondContact O-N 3.42Å; S173-K175 PolarHBondContact OG-N 3.41Å | ||
| 176 | C | 76.9 | Confident | 57.3 | Low | 3 Ų | 3 | 85 Ų | 85 | 2% | 0.02 | 45% | 0.45 | C | S | . | . | trans | -120.4 | 157.8 | 177 | -177 | 0 | 0 | 0 | 0 | 109.9 | Y85 W92 C99 H178 | Y85-C176 HydrophobicContact CD2-CB 4.43Å; Y85-C176 HydrophobicContact CE2-CB 4.02Å; Y85-C176 PolarHBondContact OH-N 3.4Å; Y85-C176 PolarHBondContact OH-O 3.26Å; W92-C176 HydrophobicContact CB-CB 3.66Å; W92-C176 HydrophobicContact CD2-CB 3.93Å; W92-C176 HydrophobicContact CE3-CB 4.06Å; W92-C176 HydrophobicContact CG-CB 3.77Å; C99-C176 WeakPolarHBondContact CA-SG 3.37Å; C99-C176 HydrophobicContact CB-CB 4.05Å; C99-C176 WeakPolarHBondContact CB-SG 3.45Å; C99-C176 VanDerWaalsContact SG-CA 3.56Å; C99-C176 WeakPolarHBondContact SG-CB 3.46Å; C99-C176 CovalentContact SG-SG 2.02Å; C99-C176 PolarHBondContact SG-SG 3.45Å; C176-H178 PolarHBondContact O-CD2 3.01Å; C176-H178 PolarHBondContact O-N 3.46Å | ||
| 177 | F | 72.2 | Confident | 58.2 | Low | 33 Ų | 33 | 85.3 Ų | 85.3 | 15% | 0.145 | 44% | 0.442 | C | S | . | . | S | Bend | trans | 68.1 | -13.3 | 178.1 | -43.5 | -60.6 | 0 | 0 | 0 | 117.3 | R82 Y85 W92 C99 V102 | R82-F177 HydrophobicContact CG-CE2 4.36Å; Y85-F177 HydrophobicContact CD1-CD2 4.14Å; Y85-F177 HydrophobicContact CD1-CE2 4.31Å; Y85-F177 HydrophobicContact CE1-CD2 4.2Å; Y85-F177 HydrophobicContact CG-CE2 4.3Å; W92-F177 AromaticContact CE3-CE2 3.96Å; W92-F177 HydrophobicContact CE3-CE2 3.96Å; W92-F177 HydrophobicContact CE3-CZ 4.11Å; W92-F177 HydrophobicContact CH2-CZ 4.05Å; W92-F177 AromaticContact CZ3-CE2 3.77Å; W92-F177 HydrophobicContact CZ3-CE2 3.77Å; W92-F177 AromaticContact CZ3-CZ 3.6Å; W92-F177 HydrophobicContact CZ3-CZ 3.6Å; C99-F177 WeakPolarHBondContact O-CE1 3.38Å; V102-F177 HydrophobicContact CB-CE1 3.94Å; V102-F177 HydrophobicContact CB-CZ 4.01Å; V102-F177 HydrophobicContact CG1-CE1 3.61Å; V102-F177 HydrophobicContact CG1-CZ 3.49Å; V102-F177 VanDerWaalsContact CG1-CZ 3.49Å |
| 178 | H | 66.3 | Low | 59.4 | Low | 42 Ų | 42 | 84.6 Ų | 84.6 | 19% | 0.194 | 44% | 0.437 | C | S | . | . | S | Bend | trans | -69 | 139.1 | 167.9 | -71.2 | -96.6 | 0 | 0 | 0 | 110.6 | C176 R180 D279 | C176-H178 PolarHBondContact O-CD2 3.01Å; C176-H178 PolarHBondContact O-N 3.46Å; H178-R180 PolarHBondContact O-N 3.44Å; H178-D279 IonicContact CE1-OD2 2.85Å; H178-D279 IonicContact CG-OD2 3.84Å; H178-D279 IonicContact ND1-OD1 2.81Å; H178-D279 IonicContact ND1-OD2 3.57Å; H178-D279 PolarHBondContact ND1-OD2 3.43Å |
| 179 | F | 55.5 | Low | 60.3 | Low | 36 Ų | 36 | 85.3 Ų | 85.3 | 16% | 0.158 | 44% | 0.439 | C | S | . | . | trans | -69.2 | 102 | 175 | -161.5 | -98.5 | 0 | 0 | 0 | 108.1 | T181 I182 Y262 I263 Q266 | F179-T181 PolarHBondContact O-N 3.24Å; F179-I182 HydrophobicContact CD1-CG1 4.39Å; F179-I182 HydrophobicContact CE1-CD1 3.45Å; F179-I182 VanDerWaalsContact CE1-CD1 3.45Å; F179-I182 HydrophobicContact CE1-CG1 3.46Å; F179-I182 VanDerWaalsContact CE1-CG1 3.46Å; F179-I182 HydrophobicContact CZ-CD1 3.41Å; F179-I182 VanDerWaalsContact CZ-CD1 3.41Å; F179-I182 HydrophobicContact CZ-CG1 3.74Å; F179-Y262 HydrophobicContact CB-CE1 3.43Å; F179-Y262 VanDerWaalsContact CB-CE1 3.43Å; F179-Y262 WeakPolarHBondContact CB-OH 3.46Å; F179-Y262 HydrophobicContact CD1-CE1 4.48Å; F179-Y262 HydrophobicContact CD2-CE1 4.23Å; F179-Y262 AromaticContact CG-CE1 3.87Å; F179-Y262 HydrophobicContact CG-CE1 3.87Å; F179-Y262 PolarHBondContact N-OH 3.41Å; F179-I263 HydrophobicContact CZ-CG1 4.37Å; F179-Q266 HydrophobicContact CB-CG 4.3Å; F179-Q266 HydrophobicContact CD1-CB 3.69Å; F179-Q266 HydrophobicContact CD1-CG 3.75Å; F179-Q266 HydrophobicContact CE1-CB 4.09Å; F179-Q266 HydrophobicContact CE1-CG 4.49Å; F179-Q266 HydrophobicContact CG-CG 4.42Å; F179-Q266 PolarHBondContact O-NE2 2.91Å | ||
| 180 | R | 58.3 | Low | 61.5 | Low | 77 Ų | 77 | 77.4 Ų | 77.4 | 29% | 0.291 | 41% | 0.411 | S | S | . | . | trans | -60.6 | 137.7 | 172.2 | -65.6 | -177.5 | 179.1 | -162.3 | -8.8 | 107.1 | D168 C170 H178 I182 | D168-R180 VanDerWaalsContact CG-NH1 3.31Å; D168-R180 IonicContact OD2-CZ 3.68Å; D168-R180 IonicContact OD2-NE 3.85Å; D168-R180 IonicContact OD2-NH1 3.96Å; D168-R180 PolarHBondContact OD2-NH1 3.39Å; C170-R180 PolarHBondContact O-NH1 3.49Å; C170-R180 VanDerWaalsContact O-NH1 3.16Å; H178-R180 PolarHBondContact O-N 3.44Å; R180-I182 PolarHBondContact O-N 2.91Å | ||
| 181 | T | 48.8 | Very low | 62.9 | Low | 99 Ų | 99 | 82.1 Ų | 82.1 | 61% | 0.607 | 42% | 0.423 | S | S | * | . | trans | -41.1 | 114.8 | 174.8 | 37.2 | 0 | 0 | 0 | 0 | 108.3 | F179 P183 | F179-T181 PolarHBondContact O-N 3.24Å; T181-P183 WeakPolarHBondContact O-CD 3.48Å | ||
| 182 | I | 50.8 | Low | 64.3 | Low | 19 Ų | 19 | 79.1 Ų | 79.1 | 10% | 0.097 | 40% | 0.402 | C | S | . | . | trans | -59.1 | 118.2 | 169.5 | -63.8 | 172.1 | 0 | 0 | 0 | 103.4 | F179 R180 Q184 D186 K189 I267 | F179-I182 HydrophobicContact CD1-CG1 4.39Å; F179-I182 HydrophobicContact CE1-CD1 3.45Å; F179-I182 VanDerWaalsContact CE1-CD1 3.45Å; F179-I182 HydrophobicContact CE1-CG1 3.46Å; F179-I182 VanDerWaalsContact CE1-CG1 3.46Å; F179-I182 HydrophobicContact CZ-CD1 3.41Å; F179-I182 VanDerWaalsContact CZ-CD1 3.41Å; F179-I182 HydrophobicContact CZ-CG1 3.74Å; R180-I182 PolarHBondContact O-N 2.91Å; I182-Q184 PolarHBondContact O-N 3.37Å; I182-D186 HydrophobicContact CG2-CB 3.65Å; I182-K189 HydrophobicContact CD1-CB 4.39Å; I182-I267 HydrophobicContact CB-CG2 4.48Å; I182-I267 HydrophobicContact CD1-CG2 4.31Å | ||
| 183 | P | 51.6 | Low | 65.8 | Low | 77 Ų | 77 | 72.6 Ų | 72.6 | 50% | 0.5 | 37% | 0.367 | S | S | . | . | trans | -50.8 | 133.7 | 167.7 | -20.2 | 31.7 | 0 | 0 | 0 | 106.3 | T181 E185 D186 | T181-P183 WeakPolarHBondContact O-CD 3.48Å; P183-E185 PolarHBondContact O-N 2.9Å; P183-D186 PolarHBondContact O-N 3.33Å | ||
| 184 | Q | 47.8 | Very low | 66.9 | Low | 195 Ų | 195 | 74.8 Ų | 74.8 | 91% | 0.911 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.3 | -13.5 | -175.5 | -162.6 | 173.3 | 0.5 | 0 | 0 | 113.6 | I182 | I182-Q184 PolarHBondContact O-N 3.37Š|
| 185 | E | 50.8 | Low | 67.7 | Low | 182 Ų | 182 | 76.9 Ų | 76.9 | 85% | 0.85 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.8 | -6.8 | 179.3 | -52 | -168.9 | 175.4 | 0 | 0 | 115 | P183 M187 | P183-E185 PolarHBondContact O-N 2.9Å; E185-M187 VanDerWaalsContact C-N 3.35Å; E185-M187 PolarHBondContact O-N 3.36Å; E185-M187 VanDerWaalsContact O-N 3.12Å |
| 186 | D | 64.8 | Low | 68.3 | Low | 37 Ų | 37 | 75.5 Ų | 75.5 | 20% | 0.198 | 37% | 0.372 | C | S | . | . | trans | -94.4 | 60 | -172.2 | -143 | -16 | 0 | 0 | 0 | 112.8 | I182 P183 L188 K189 | I182-D186 HydrophobicContact CG2-CB 3.65Å; P183-D186 PolarHBondContact O-N 3.33Å; D186-L188 PolarHBondContact O-N 3.49Å; D186-L188 VanDerWaalsContact O-N 3.11Å; D186-K189 HydrophobicContact CB-CD 4.4Å; D186-K189 PolarHBondContact O-N 3.28Å; D186-K189 VanDerWaalsContact O-N 3.1Å; D186-K189 VanDerWaalsContact OD2-CD 3.25Å; D186-K189 WeakPolarHBondContact OD2-CD 3.42Å; D186-K189 WeakPolarHBondContact OD2-CE 3.29Å; D186-K189 IonicContact OD2-NZ 3.55Å; D186-K189 PolarHBondContact OD2-NZ 3.15Å | ||
| 187 | M | 68.1 | Low | 68.8 | Low | 109 Ų | 109 | 77 Ų | 77 | 54% | 0.537 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -53.7 | -31.8 | -177.7 | -71.2 | -67.6 | -77.4 | 0 | 0 | 113 | E185 K189 A190 Y191 | E185-M187 VanDerWaalsContact C-N 3.35Å; E185-M187 PolarHBondContact O-N 3.36Å; E185-M187 VanDerWaalsContact O-N 3.12Å; M187-K189 PolarHBondContact O-N 3.45Å; M187-A190 PolarHBondContact O-N 3.32Å; M187-Y191 HydrophobicContact CB-CD2 4.3Å; M187-Y191 HydrophobicContact CB-CE2 4.05Å; M187-Y191 HydrophobicContact CE-CE2 3.96Å; M187-Y191 WeakPolarHBondContact O-CD2 3.42Å; M187-Y191 PolarHBondContact O-N 2.83Å |
| 188 | L | 74 | Confident | 69.7 | Low | 115 Ų | 115 | 79.1 Ų | 79.1 | 60% | 0.602 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -61.4 | -43.9 | 178.8 | -179.5 | 60.8 | 0 | 0 | 0 | 112.2 | D186 A190 Y191 I192 | D186-L188 PolarHBondContact O-N 3.49Å; D186-L188 VanDerWaalsContact O-N 3.11Å; L188-A190 VanDerWaalsContact C-N 3.33Å; L188-A190 PolarHBondContact O-N 3.21Å; L188-Y191 PolarHBondContact O-N 3.26Å; L188-I192 HydrophobicContact CD1-CD1 4.07Å; L188-I192 HydrophobicContact CD1-CG1 4.31Å; L188-I192 HydrophobicContact CG-CD1 3.96Å; L188-I192 VanDerWaalsContact O-CG1 3.31Å; L188-I192 WeakPolarHBondContact O-CG1 3.27Å; L188-I192 PolarHBondContact O-N 3.48Å |
| 189 | K | 72.3 | Confident | 70.7 | Confident | 56 Ų | 56 | 79.2 Ų | 79.2 | 24% | 0.243 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -64.8 | -38.3 | 178.5 | -71.5 | 179.8 | -178 | 146.9 | 0 | 111.6 | E165 I182 D186 M187 N193 | E165-K189 VanDerWaalsContact CD-NZ 3.27Å; E165-K189 WeakPolarHBondContact OE1-CE 3.38Å; E165-K189 IonicContact OE1-NZ 3.12Å; E165-K189 PolarHBondContact OE1-NZ 2.96Å; E165-K189 WeakPolarHBondContact OE2-CE 3.31Å; E165-K189 IonicContact OE2-NZ 2.69Å; E165-K189 PolarHBondContact OE2-NZ 3.08Å; E165-K189 VanDerWaalsContact OE2-NZ 3.12Å; I182-K189 HydrophobicContact CD1-CB 4.39Å; D186-K189 HydrophobicContact CB-CD 4.4Å; D186-K189 PolarHBondContact O-N 3.28Å; D186-K189 VanDerWaalsContact O-N 3.1Å; D186-K189 VanDerWaalsContact OD2-CD 3.25Å; D186-K189 WeakPolarHBondContact OD2-CD 3.42Å; D186-K189 WeakPolarHBondContact OD2-CE 3.29Å; D186-K189 IonicContact OD2-NZ 3.55Å; D186-K189 PolarHBondContact OD2-NZ 3.15Å; M187-K189 PolarHBondContact O-N 3.45Å; K189-N193 PolarHBondContact O-N 2.97Å; K189-N193 PolarHBondContact O-ND2 3.35Å |
| 190 | A | 75 | Confident | 72.5 | Confident | 33 Ų | 33 | 77.5 Ų | 77.5 | 27% | 0.273 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -64.2 | -47.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | M187 L188 I192 N193 I194 | M187-A190 PolarHBondContact O-N 3.32Å; L188-A190 VanDerWaalsContact C-N 3.33Å; L188-A190 PolarHBondContact O-N 3.21Å; A190-I192 PolarHBondContact O-N 3.02Å; A190-N193 PolarHBondContact O-N 3.49Å; A190-I194 WeakPolarHBondContact O-CG1 3.5Å; A190-I194 PolarHBondContact O-N 3.2Å |
| 191 | Y | 80.5 | Confident | 74.1 | Confident | 144 Ų | 144 | 78.4 Ų | 78.4 | 57% | 0.565 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -60.4 | -43 | 176.9 | -75.8 | -58.8 | 0 | 0 | 0 | 112.7 | M187 L188 I194 F195 | M187-Y191 HydrophobicContact CB-CD2 4.3Å; M187-Y191 HydrophobicContact CB-CE2 4.05Å; M187-Y191 HydrophobicContact CE-CE2 3.96Å; M187-Y191 WeakPolarHBondContact O-CD2 3.42Å; M187-Y191 PolarHBondContact O-N 2.83Å; L188-Y191 PolarHBondContact O-N 3.26Å; Y191-I194 PolarHBondContact O-N 3.01Å; Y191-F195 VanDerWaalsContact O-CB 3.24Å; Y191-F195 WeakPolarHBondContact O-CB 3.37Å; Y191-F195 PolarHBondContact O-N 2.79Å |
| 192 | I | 81.2 | Confident | 76.1 | Confident | 63 Ų | 63 | 79.3 Ų | 79.3 | 32% | 0.323 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -60.8 | -47 | 176.4 | -69.1 | 167.7 | 0 | 0 | 0 | 110.4 | L188 A190 I194 F195 V196 | L188-I192 HydrophobicContact CD1-CD1 4.07Å; L188-I192 HydrophobicContact CD1-CG1 4.31Å; L188-I192 HydrophobicContact CG-CD1 3.96Å; L188-I192 VanDerWaalsContact O-CG1 3.31Å; L188-I192 WeakPolarHBondContact O-CG1 3.27Å; L188-I192 PolarHBondContact O-N 3.48Å; A190-I192 PolarHBondContact O-N 3.02Å; I192-I194 PolarHBondContact O-N 3.16Å; I192-F195 PolarHBondContact O-N 2.88Å; I192-V196 WeakPolarHBondContact O-CG1 3.38Å; I192-V196 WeakPolarHBondContact O-CG2 3.35Å; I192-V196 PolarHBondContact O-N 3.1Å |
| 193 | N | 82.3 | Confident | 77.9 | Confident | 21 Ų | 21 | 79.6 Ų | 79.6 | 11% | 0.112 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62 | -42.3 | 178.9 | -85.8 | -84.5 | 0 | 0 | 0 | 112.6 | K189 A190 V196 L197 R259 I263 | K189-N193 PolarHBondContact O-N 2.97Å; K189-N193 PolarHBondContact O-ND2 3.35Å; A190-N193 PolarHBondContact O-N 3.49Å; N193-V196 WeakPolarHBondContact O-CG2 3.08Å; N193-L197 WeakPolarHBondContact O-CB 3.31Å; N193-L197 PolarHBondContact O-N 3.32Å; N193-L197 VanDerWaalsContact O-N 3.09Å; N193-R259 PolarHBondContact OD1-NE 3.42Å; N193-R259 PolarHBondContact OD1-NH2 3.16Å; N193-I263 HydrophobicContact CB-CD1 3.73Å |
| 194 | I | 84.4 | Confident | 79.8 | Confident | 99 Ų | 99 | 78 Ų | 78 | 51% | 0.508 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64.4 | -45.8 | 175.6 | -68.1 | 168.2 | 0 | 0 | 0 | 110 | A190 Y191 I192 V196 L197 V198 | A190-I194 WeakPolarHBondContact O-CG1 3.5Å; A190-I194 PolarHBondContact O-N 3.2Å; Y191-I194 PolarHBondContact O-N 3.01Å; I192-I194 PolarHBondContact O-N 3.16Å; I194-V196 PolarHBondContact O-N 3.21Å; I194-L197 WeakPolarHBondContact O-CB 3.49Å; I194-L197 PolarHBondContact O-N 3.03Å; I194-V198 HydrophobicContact CG2-CG2 4.34Å; I194-V198 WeakPolarHBondContact O-CG2 3.19Å; I194-V198 PolarHBondContact O-N 2.85Å |
| 195 | F | 86.5 | Confident | 81.8 | Confident | 121 Ų | 121 | 72.3 Ų | 72.3 | 53% | 0.531 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -57.9 | -50.3 | 179.3 | 173.7 | -100.9 | 0 | 0 | 0 | 111.8 | Y191 I192 L197 V198 V199 | Y191-F195 VanDerWaalsContact O-CB 3.24Å; Y191-F195 WeakPolarHBondContact O-CB 3.37Å; Y191-F195 PolarHBondContact O-N 2.79Å; I192-F195 PolarHBondContact O-N 2.88Å; F195-L197 VanDerWaalsContact C-N 3.29Å; F195-L197 PolarHBondContact O-N 2.81Å; F195-V198 PolarHBondContact O-N 2.8Å; F195-V199 HydrophobicContact CD1-CG2 4.34Å; F195-V199 HydrophobicContact CD2-CG2 4.46Å; F195-V199 HydrophobicContact CE1-CG2 3.93Å; F195-V199 HydrophobicContact CE2-CG2 4.05Å; F195-V199 HydrophobicContact CZ-CG2 3.77Å; F195-V199 WeakPolarHBondContact O-CG2 3.33Å; F195-V199 PolarHBondContact O-N 3.5Å |
| 196 | V | 85.8 | Confident | 83.5 | Confident | 25 Ų | 25 | 65.7 Ų | 65.7 | 15% | 0.152 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -65.6 | -32.4 | 179.4 | -62.3 | 0 | 0 | 0 | 0 | 112.4 | Y111 I192 N193 I194 V199 F200 | Y111-V196 HydrophobicContact CD1-CB 4.35Å; Y111-V196 HydrophobicContact CE1-CB 3.67Å; Y111-V196 HydrophobicContact CE1-CG1 4.46Å; Y111-V196 HydrophobicContact CE1-CG2 4.13Å; Y111-V196 HydrophobicContact CE2-CB 4.17Å; Y111-V196 HydrophobicContact CE2-CG1 4.35Å; Y111-V196 HydrophobicContact CE2-CG2 4.22Å; Y111-V196 WeakPolarHBondContact OH-CG2 3.46Å; I192-V196 WeakPolarHBondContact O-CG1 3.38Å; I192-V196 WeakPolarHBondContact O-CG2 3.35Å; I192-V196 PolarHBondContact O-N 3.1Å; N193-V196 WeakPolarHBondContact O-CG2 3.08Å; I194-V196 PolarHBondContact O-N 3.21Å; V196-V199 PolarHBondContact O-N 3.38Å; V196-F200 PolarHBondContact O-N 2.66Å |
| 197 | L | 88.8 | Confident | 84.6 | Confident | 35 Ų | 35 | 64 Ų | 64 | 18% | 0.183 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -66.8 | -43.6 | 174 | -173.7 | 61.6 | 0 | 0 | 0 | 111.5 | N193 I194 F195 F200 W201 H256 R259 | N193-L197 WeakPolarHBondContact O-CB 3.31Å; N193-L197 PolarHBondContact O-N 3.32Å; N193-L197 VanDerWaalsContact O-N 3.09Å; I194-L197 WeakPolarHBondContact O-CB 3.49Å; I194-L197 PolarHBondContact O-N 3.03Å; F195-L197 VanDerWaalsContact C-N 3.29Å; F195-L197 PolarHBondContact O-N 2.81Å; L197-F200 WeakPolarHBondContact O-CB 3.47Å; L197-F200 PolarHBondContact O-N 2.79Å; L197-W201 PolarHBondContact O-N 3.37Å; L197-W201 VanDerWaalsContact O-N 3.07Å; L197-H256 HydrophobicContact CD1-CB 3.95Å; L197-H256 WeakPolarHBondContact CD1-O 3.4Å; L197-R259 HydrophobicContact CD1-CB 4.47Å |
| 198 | V | 89.5 | Confident | 85.6 | Confident | 77 Ų | 77 | 61.7 Ų | 61.7 | 47% | 0.467 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62 | -44.5 | 174.8 | 170.1 | 0 | 0 | 0 | 0 | 110.9 | I194 F195 F200 W201 L202 | I194-V198 HydrophobicContact CG2-CG2 4.34Å; I194-V198 WeakPolarHBondContact O-CG2 3.19Å; I194-V198 PolarHBondContact O-N 2.85Å; F195-V198 PolarHBondContact O-N 2.8Å; V198-F200 VanDerWaalsContact C-N 3.32Å; V198-F200 PolarHBondContact O-N 3.39Å; V198-W201 PolarHBondContact O-N 2.97Å; V198-L202 HydrophobicContact CG1-CD1 4.3Å; V198-L202 WeakPolarHBondContact O-CB 3.32Å; V198-L202 PolarHBondContact O-N 3.04Å |
| 199 | V | 88.2 | Confident | 86.2 | Confident | 44 Ų | 44 | 61.3 Ų | 61.3 | 27% | 0.267 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -58.6 | -44.7 | 175.9 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | F195 V196 L202 V203 | F195-V199 HydrophobicContact CD1-CG2 4.34Å; F195-V199 HydrophobicContact CD2-CG2 4.46Å; F195-V199 HydrophobicContact CE1-CG2 3.93Å; F195-V199 HydrophobicContact CE2-CG2 4.05Å; F195-V199 HydrophobicContact CZ-CG2 3.77Å; F195-V199 WeakPolarHBondContact O-CG2 3.33Å; F195-V199 PolarHBondContact O-N 3.5Å; V196-V199 PolarHBondContact O-N 3.38Å; V199-L202 PolarHBondContact O-N 3.06Å; V199-V203 HydrophobicContact CG1-CG2 4.5Å; V199-V203 WeakPolarHBondContact O-CG2 3.16Å; V199-V203 PolarHBondContact O-N 3.42Å |
| 200 | F | 92.6 | Very high | 86.8 | Confident | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -56.9 | -51.7 | 175.8 | 168.4 | -97.8 | 0 | 0 | 0 | 112 | I114 V196 L197 V198 L202 V203 F204 F248 F252 V253 H256 | I114-F200 HydrophobicContact CD1-CD2 3.89Å; I114-F200 HydrophobicContact CD1-CE2 4.43Å; I114-F200 HydrophobicContact CG1-CD2 4.38Å; I114-F200 HydrophobicContact CG2-CD2 4.22Å; V196-F200 PolarHBondContact O-N 2.66Å; L197-F200 WeakPolarHBondContact O-CB 3.47Å; L197-F200 PolarHBondContact O-N 2.79Å; V198-F200 VanDerWaalsContact C-N 3.32Å; V198-F200 PolarHBondContact O-N 3.39Å; F200-L202 VanDerWaalsContact C-N 3.32Å; F200-L202 PolarHBondContact O-N 2.94Å; F200-V203 PolarHBondContact O-N 2.75Å; F200-V203 VanDerWaalsContact O-N 3.17Å; F200-F204 HydrophobicContact CE1-CB 4.46Å; F200-F204 HydrophobicContact CZ-CB 4.42Å; F200-F204 WeakPolarHBondContact O-CB 3.41Å; F200-F204 PolarHBondContact O-N 3.2Å; F200-F248 HydrophobicContact CD2-CZ 4.2Å; F200-F248 AromaticContact CE2-CE1 3.67Å; F200-F248 HydrophobicContact CE2-CE1 3.67Å; F200-F248 AromaticContact CE2-CZ 3.67Å; F200-F248 HydrophobicContact CE2-CZ 3.67Å; F200-F248 HydrophobicContact CZ-CE1 4.12Å; F200-F252 HydrophobicContact CD2-CB 4.48Å; F200-F252 HydrophobicContact CE2-CB 3.57Å; F200-F252 HydrophobicContact CZ-CB 4.24Å; F200-V253 HydrophobicContact CZ-CG2 3.91Å; F200-H256 VanDerWaalsContact CB-CD2 3.41Å; F200-H256 WeakPolarHBondContact CB-CD2 3.11Å; F200-H256 HydrophobicContact CD1-CB 3.29Å; F200-H256 AromaticContact CD1-CD2 3.66Å; F200-H256 AromaticContact CD1-CG 3.38Å; F200-H256 HydrophobicContact CD2-CB 4.33Å; F200-H256 AromaticContact CD2-CD2 3.72Å; F200-H256 AromaticContact CD2-CE1 3.57Å; F200-H256 AromaticContact CD2-CG 3.59Å; F200-H256 AromaticContact CD2-ND1 3.48Å; F200-H256 WeakPolarHBondContact CD2-ND1 3.25Å; F200-H256 AromaticContact CD2-NE2 3.72Å; F200-H256 HydrophobicContact CE1-CB 3.27Å; F200-H256 AromaticContact CE1-CG 3.64Å; F200-H256 HydrophobicContact CE2-CB 4.32Å; F200-H256 AromaticContact CE2-CE1 3.95Å; F200-H256 AromaticContact CE2-CG 3.84Å; F200-H256 AromaticContact CE2-ND1 3.5Å; F200-H256 HydrophobicContact CG-CB 3.84Å; F200-H256 AromaticContact CG-CD2 3.26Å; F200-H256 WeakPolarHBondContact CG-CD2 3.36Å; F200-H256 AromaticContact CG-CE1 3.96Å; F200-H256 AromaticContact CG-CG 3.34Å; F200-H256 AromaticContact CG-ND1 3.76Å; F200-H256 AromaticContact CG-NE2 3.69Å; F200-H256 HydrophobicContact CZ-CB 3.81Å; F200-H256 AromaticContact CZ-CG 3.85Å; F200-H256 AromaticContact CZ-ND1 3.8Å |
| 201 | W | 92.8 | Very high | 87.2 | Confident | 95 Ų | 95 | 57.8 Ų | 57.8 | 36% | 0.36 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -65.4 | -35.5 | -178 | -71.2 | 114.5 | 0 | 0 | 0 | 112.4 | L197 V198 F204 V205 | L197-W201 PolarHBondContact O-N 3.37Å; L197-W201 VanDerWaalsContact O-N 3.07Å; V198-W201 PolarHBondContact O-N 2.97Å; W201-F204 AromaticContact CE3-CD1 3.79Å; W201-F204 HydrophobicContact CE3-CD1 3.79Å; W201-F204 HydrophobicContact CE3-CG 4.45Å; W201-F204 AromaticContact CZ3-CD1 3.82Å; W201-F204 HydrophobicContact CZ3-CD1 3.82Å; W201-F204 HydrophobicContact CZ3-CE1 4.12Å; W201-F204 PolarHBondContact O-N 3.11Å; W201-V205 WeakPolarHBondContact O-CB 3.38Å; W201-V205 VanDerWaalsContact O-CG2 3.29Å; W201-V205 WeakPolarHBondContact O-CG2 3.27Å; W201-V205 PolarHBondContact O-N 3.5Å |
| 202 | L | 89.4 | Confident | 87.4 | Confident | 119 Ų | 119 | 52.9 Ų | 52.9 | 62% | 0.623 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -60.4 | -47.2 | 171.2 | -92.7 | 170.8 | 0 | 0 | 0 | 112.1 | V198 V199 F200 S206 | V198-L202 HydrophobicContact CG1-CD1 4.3Å; V198-L202 WeakPolarHBondContact O-CB 3.32Å; V198-L202 PolarHBondContact O-N 3.04Å; V199-L202 PolarHBondContact O-N 3.06Å; F200-L202 VanDerWaalsContact C-N 3.32Å; F200-L202 PolarHBondContact O-N 2.94Å; L202-S206 VanDerWaalsContact O-CB 3.32Å; L202-S206 WeakPolarHBondContact O-CB 3.46Å; L202-S206 PolarHBondContact O-N 3.19Å |
| 203 | V | 89.9 | Confident | 87.5 | Confident | 25 Ų | 25 | 55.3 Ų | 55.3 | 15% | 0.152 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.9 | -44.5 | 177 | 171.5 | 0 | 0 | 0 | 0 | 110.7 | I114 V199 F200 S206 L207 F248 | I114-V203 HydrophobicContact CG2-CB 4.07Å; I114-V203 HydrophobicContact CG2-CG1 3.79Å; I114-V203 HydrophobicContact CG2-CG2 4.32Å; V199-V203 HydrophobicContact CG1-CG2 4.5Å; V199-V203 WeakPolarHBondContact O-CG2 3.16Å; V199-V203 PolarHBondContact O-N 3.42Å; F200-V203 PolarHBondContact O-N 2.75Å; F200-V203 VanDerWaalsContact O-N 3.17Å; V203-S206 WeakPolarHBondContact O-CB 3.34Å; V203-S206 PolarHBondContact O-N 3.27Å; V203-L207 HydrophobicContact CG1-CD1 3.86Å; V203-L207 HydrophobicContact CG1-CG 4.37Å; V203-L207 WeakPolarHBondContact O-CB 3.29Å; V203-L207 VanDerWaalsContact O-CG 3.3Å; V203-L207 WeakPolarHBondContact O-CG 3.45Å; V203-L207 PolarHBondContact O-N 3.09Å; V203-F248 HydrophobicContact CG1-CE2 4.39Å; V203-F248 HydrophobicContact CG1-CZ 4.23Å |
| 204 | F | 91.6 | Very high | 87.4 | Confident | 42 Ų | 42 | 54.4 Ų | 54.4 | 18% | 0.184 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -60.5 | -48.7 | 178.3 | 177.5 | -112.8 | 0 | 0 | 0 | 112.4 | F200 W201 S206 L207 V208 F248 V249 V253 | F200-F204 HydrophobicContact CE1-CB 4.46Å; F200-F204 HydrophobicContact CZ-CB 4.42Å; F200-F204 WeakPolarHBondContact O-CB 3.41Å; F200-F204 PolarHBondContact O-N 3.2Å; W201-F204 AromaticContact CE3-CD1 3.79Å; W201-F204 HydrophobicContact CE3-CD1 3.79Å; W201-F204 HydrophobicContact CE3-CG 4.45Å; W201-F204 AromaticContact CZ3-CD1 3.82Å; W201-F204 HydrophobicContact CZ3-CD1 3.82Å; W201-F204 HydrophobicContact CZ3-CE1 4.12Å; W201-F204 PolarHBondContact O-N 3.11Å; F204-S206 VanDerWaalsContact C-N 3.32Å; F204-S206 PolarHBondContact O-N 3.01Å; F204-L207 WeakPolarHBondContact O-CB 3.49Å; F204-L207 PolarHBondContact O-N 3.01Å; F204-V208 HydrophobicContact CD2-CG2 4.24Å; F204-V208 HydrophobicContact CE1-CG2 4.11Å; F204-V208 HydrophobicContact CE2-CG2 3.75Å; F204-V208 HydrophobicContact CZ-CG2 3.69Å; F204-V208 WeakPolarHBondContact O-CG2 3.49Å; F204-V208 PolarHBondContact O-N 3.31Å; F204-F248 HydrophobicContact CB-CE1 4.13Å; F204-F248 AromaticContact CD2-CD1 3.96Å; F204-F248 HydrophobicContact CD2-CD1 3.96Å; F204-F248 AromaticContact CD2-CE1 3.7Å; F204-F248 HydrophobicContact CD2-CE1 3.7Å; F204-F248 HydrophobicContact CG-CE1 4.38Å; F204-V249 HydrophobicContact CE2-CG2 3.73Å; F204-V249 HydrophobicContact CZ-CG2 4.38Å; F204-V253 HydrophobicContact CD2-CG2 4.19Å; F204-V253 HydrophobicContact CE2-CG2 3.97Å; F204-V253 HydrophobicContact CZ-CG2 4.38Å |
| 205 | V | 89.9 | Confident | 87.1 | Confident | 76 Ų | 76 | 51.3 Ų | 51.3 | 46% | 0.461 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 176.7 | 169.6 | 0 | 0 | 0 | 0 | 110.6 | W201 L207 V208 L209 | W201-V205 WeakPolarHBondContact O-CB 3.38Å; W201-V205 VanDerWaalsContact O-CG2 3.29Å; W201-V205 WeakPolarHBondContact O-CG2 3.27Å; W201-V205 PolarHBondContact O-N 3.5Å; V205-L207 VanDerWaalsContact C-N 3.32Å; V205-L207 PolarHBondContact O-N 2.99Å; V205-V208 PolarHBondContact O-N 2.86Å; V205-L209 HydrophobicContact CG1-CD1 3.74Å; V205-L209 HydrophobicContact CG1-CG 4.19Å; V205-L209 WeakPolarHBondContact O-CB 3.4Å; V205-L209 VanDerWaalsContact O-CG 3.26Å; V205-L209 WeakPolarHBondContact O-CG 3.28Å; V205-L209 PolarHBondContact O-N 3.11Å |
| 206 | S | 86.9 | Confident | 86.8 | Confident | 44 Ų | 44 | 49.5 Ų | 49.5 | 31% | 0.308 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -59.4 | -41.4 | 175.6 | -174.6 | 0 | 0 | 0 | 0 | 112.4 | L202 V203 F204 S210 | L202-S206 VanDerWaalsContact O-CB 3.32Å; L202-S206 WeakPolarHBondContact O-CB 3.46Å; L202-S206 PolarHBondContact O-N 3.19Å; V203-S206 WeakPolarHBondContact O-CB 3.34Å; V203-S206 PolarHBondContact O-N 3.27Å; F204-S206 VanDerWaalsContact C-N 3.32Å; F204-S206 PolarHBondContact O-N 3.01Å; S206-S210 WeakPolarHBondContact O-CB 3.35Å; S206-S210 PolarHBondContact O-N 2.96Å; S206-S210 PolarHBondContact O-OG 2.94Å |
| 207 | L | 87.2 | Confident | 86.4 | Confident | 2 Ų | 2 | 50.8 Ų | 50.8 | 1% | 0.01 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -62 | -51.7 | 175.1 | -77 | 165.1 | 0 | 0 | 0 | 111.7 | S121 V203 F204 V205 L209 S210 Y211 L245 F248 | S121-L207 WeakPolarHBondContact OG-CD2 3.21Å; V203-L207 HydrophobicContact CG1-CD1 3.86Å; V203-L207 HydrophobicContact CG1-CG 4.37Å; V203-L207 WeakPolarHBondContact O-CB 3.29Å; V203-L207 VanDerWaalsContact O-CG 3.3Å; V203-L207 WeakPolarHBondContact O-CG 3.45Å; V203-L207 PolarHBondContact O-N 3.09Å; F204-L207 WeakPolarHBondContact O-CB 3.49Å; F204-L207 PolarHBondContact O-N 3.01Å; V205-L207 VanDerWaalsContact C-N 3.32Å; V205-L207 PolarHBondContact O-N 2.99Å; L207-L209 PolarHBondContact O-N 2.73Å; L207-S210 PolarHBondContact O-N 2.82Å; L207-S210 PolarHBondContact O-OG 3.21Å; L207-Y211 HydrophobicContact CB-CD2 4.5Å; L207-Y211 HydrophobicContact CD2-CD2 4.23Å; L207-Y211 HydrophobicContact CD2-CE2 3.73Å; L207-Y211 WeakPolarHBondContact O-CB 3.4Å; L207-Y211 VanDerWaalsContact O-CD2 3.29Å; L207-Y211 WeakPolarHBondContact O-CD2 2.89Å; L207-Y211 PolarHBondContact O-N 3.34Å; L207-L245 HydrophobicContact CB-CD1 4.24Å; L207-F248 HydrophobicContact CD1-CD1 3.79Å; L207-F248 HydrophobicContact CD1-CD2 3.51Å; L207-F248 HydrophobicContact CD1-CE1 3.73Å; L207-F248 HydrophobicContact CD1-CE2 3.41Å; L207-F248 VanDerWaalsContact CD1-CE2 3.41Å; L207-F248 HydrophobicContact CD1-CG 3.7Å; L207-F248 HydrophobicContact CD1-CZ 3.53Å |
| 208 | V | 88.1 | Confident | 85.7 | Confident | 59 Ų | 59 | 49.8 Ų | 49.8 | 36% | 0.358 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -59.8 | -47 | 180 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | F204 V205 G212 L245 | F204-V208 HydrophobicContact CD2-CG2 4.24Å; F204-V208 HydrophobicContact CE1-CG2 4.11Å; F204-V208 HydrophobicContact CE2-CG2 3.75Å; F204-V208 HydrophobicContact CZ-CG2 3.69Å; F204-V208 WeakPolarHBondContact O-CG2 3.49Å; F204-V208 PolarHBondContact O-N 3.31Å; V205-V208 PolarHBondContact O-N 2.86Å; V208-G212 PolarHBondContact O-N 3.22Å; V208-L245 HydrophobicContact CG2-CD1 4.06Å |
| 209 | L | 87.8 | Confident | 84.8 | Confident | 108 Ų | 108 | 51 Ų | 51 | 57% | 0.565 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -66.2 | -44.5 | -179.8 | -69 | 177.1 | 0 | 0 | 0 | 112.5 | V205 L207 K213 | V205-L209 HydrophobicContact CG1-CD1 3.74Å; V205-L209 HydrophobicContact CG1-CG 4.19Å; V205-L209 WeakPolarHBondContact O-CB 3.4Å; V205-L209 VanDerWaalsContact O-CG 3.26Å; V205-L209 WeakPolarHBondContact O-CG 3.28Å; V205-L209 PolarHBondContact O-N 3.11Å; L207-L209 PolarHBondContact O-N 2.73Å; L209-K213 WeakPolarHBondContact O-CB 3.19Å; L209-K213 WeakPolarHBondContact O-CG 3.42Å; L209-K213 PolarHBondContact O-N 3.2Å |
| 210 | S | 85.4 | Confident | 84.3 | Confident | 8 Ų | 8 | 55.7 Ų | 55.7 | 6% | 0.056 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -65.1 | -47.7 | -179.8 | 60.8 | 0 | 0 | 0 | 0 | 111.2 | S206 L207 K213 I214 | S206-S210 WeakPolarHBondContact O-CB 3.35Å; S206-S210 PolarHBondContact O-N 2.96Å; S206-S210 PolarHBondContact O-OG 2.94Å; L207-S210 PolarHBondContact O-N 2.82Å; L207-S210 PolarHBondContact O-OG 3.21Å; S210-K213 PolarHBondContact O-N 3.38Å; S210-I214 WeakPolarHBondContact O-CB 3.26Å; S210-I214 WeakPolarHBondContact O-CD1 3.39Å; S210-I214 WeakPolarHBondContact O-CG1 3.32Å; S210-I214 PolarHBondContact O-N 3.4Å |
| 211 | Y | 82.9 | Confident | 83.3 | Confident | 7 Ų | 7 | 61.3 Ų | 61.3 | 3% | 0.027 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -69.3 | -37.5 | 178.7 | -75.5 | -50.9 | 0 | 0 | 0 | 113.2 | S121 L207 I214 A215 S241 V244 L245 | S121-Y211 VanDerWaalsContact OG-CE2 3.23Å; S121-Y211 WeakPolarHBondContact OG-CE2 3.06Å; S121-Y211 VanDerWaalsContact OG-CZ 3.23Å; S121-Y211 PolarHBondContact OG-OH 3.36Å; S121-Y211 VanDerWaalsContact OG-OH 3.06Å; L207-Y211 HydrophobicContact CB-CD2 4.5Å; L207-Y211 HydrophobicContact CD2-CD2 4.23Å; L207-Y211 HydrophobicContact CD2-CE2 3.73Å; L207-Y211 WeakPolarHBondContact O-CB 3.4Å; L207-Y211 VanDerWaalsContact O-CD2 3.29Å; L207-Y211 WeakPolarHBondContact O-CD2 2.89Å; L207-Y211 PolarHBondContact O-N 3.34Å; Y211-I214 HydrophobicContact CD1-CD1 4.27Å; Y211-I214 PolarHBondContact O-N 2.94Å; Y211-A215 WeakPolarHBondContact O-CB 3.37Å; Y211-A215 PolarHBondContact O-N 3.38Å; Y211-S241 VanDerWaalsContact CE1-CB 3.43Å; Y211-V244 HydrophobicContact CE2-CG1 4.29Å; Y211-V244 WeakPolarHBondContact OH-CB 3.3Å; Y211-V244 WeakPolarHBondContact OH-CG1 3.43Å; Y211-L245 HydrophobicContact CD2-CB 3.91Å; Y211-L245 HydrophobicContact CD2-CD1 4.42Å; Y211-L245 HydrophobicContact CE2-CB 4.31Å |
| 212 | G | 83.9 | Confident | 82.2 | Confident | 41 Ų | 41 | 58.8 Ų | 58.8 | 42% | 0.423 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -59.8 | -46.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | V208 A215 L216 | V208-G212 PolarHBondContact O-N 3.22Å; G212-A215 PolarHBondContact O-N 3.32Å; G212-L216 WeakPolarHBondContact O-CB 3.15Å; G212-L216 PolarHBondContact O-N 2.92Å |
| 213 | K | 84 | Confident | 81.3 | Confident | 114 Ų | 114 | 60.4 Ų | 60.4 | 50% | 0.496 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -64.9 | -42.6 | 176.5 | -74.7 | -167.4 | -177.3 | 174 | 0 | 112.3 | Y125 Y129 L209 S210 L216 K217 | Y125-K213 HydrophobicContact CE2-CB 4.18Å; Y125-K213 HydrophobicContact CE2-CD 4.33Å; Y129-K213 PolarHBondContact OH-O 3.15Å; L209-K213 WeakPolarHBondContact O-CB 3.19Å; L209-K213 WeakPolarHBondContact O-CG 3.42Å; L209-K213 PolarHBondContact O-N 3.2Å; S210-K213 PolarHBondContact O-N 3.38Å; K213-L216 PolarHBondContact O-N 3.33Å; K213-K217 PolarHBondContact O-N 3.37Å |
| 214 | I | 79.8 | Confident | 80.5 | Confident | 1 Ų | 1 | 66.4 Ų | 66.4 | 1% | 0.005 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -58.2 | -50.6 | 175.6 | -71 | 165.9 | 0 | 0 | 0 | 110 | R124 Y125 I128 Y129 S210 Y211 L216 K217 L218 | R124-I214 HydrophobicContact CB-CD1 4.49Å; Y125-I214 HydrophobicContact CD2-CG1 4.4Å; I128-I214 HydrophobicContact CD1-CD1 4.18Å; I128-I214 HydrophobicContact CD1-CG1 3.99Å; I128-I214 HydrophobicContact CD1-CG2 4.18Å; Y129-I214 HydrophobicContact CE2-CG1 4.26Å; S210-I214 WeakPolarHBondContact O-CB 3.26Å; S210-I214 WeakPolarHBondContact O-CD1 3.39Å; S210-I214 WeakPolarHBondContact O-CG1 3.32Å; S210-I214 PolarHBondContact O-N 3.4Å; Y211-I214 HydrophobicContact CD1-CD1 4.27Å; Y211-I214 PolarHBondContact O-N 2.94Å; I214-L216 PolarHBondContact O-N 2.77Å; I214-K217 PolarHBondContact O-N 3.29Å; I214-L218 HydrophobicContact CG2-CD1 3.52Å; I214-L218 HydrophobicContact CG2-CG 4.32Å; I214-L218 WeakPolarHBondContact O-CB 3.47Å; I214-L218 WeakPolarHBondContact O-CD1 3.35Å; I214-L218 WeakPolarHBondContact O-CG 3.32Å; I214-L218 PolarHBondContact O-N 3.27Å |
| 215 | A | 77.3 | Confident | 79.3 | Confident | 34 Ų | 34 | 72.2 Ų | 72.2 | 28% | 0.281 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -58.8 | -49 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y211 G212 K217 L218 L219 | Y211-A215 WeakPolarHBondContact O-CB 3.37Å; Y211-A215 PolarHBondContact O-N 3.38Å; G212-A215 PolarHBondContact O-N 3.32Å; A215-K217 PolarHBondContact O-N 3.36Å; A215-L218 PolarHBondContact O-N 3.47Å; A215-L219 WeakPolarHBondContact O-CB 3.39Å; A215-L219 VanDerWaalsContact O-CG 3.29Å; A215-L219 WeakPolarHBondContact O-CG 3.48Å; A215-L219 PolarHBondContact O-N 2.85Å |
| 216 | L | 80.3 | Confident | 78 | Confident | 83 Ų | 83 | 72.8 Ų | 72.8 | 44% | 0.435 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -59.8 | -43.9 | 180 | -177.9 | 62.2 | 0 | 0 | 0 | 112.6 | G212 K213 I214 L219 R220 | G212-L216 WeakPolarHBondContact O-CB 3.15Å; G212-L216 PolarHBondContact O-N 2.92Å; K213-L216 PolarHBondContact O-N 3.33Å; I214-L216 PolarHBondContact O-N 2.77Å; L216-L219 PolarHBondContact O-N 3.11Å; L216-R220 HydrophobicContact CD1-CG 4.4Å; L216-R220 WeakPolarHBondContact O-CB 3.03Å; L216-R220 VanDerWaalsContact O-CG 3.3Å; L216-R220 WeakPolarHBondContact O-CG 3.18Å; L216-R220 PolarHBondContact O-N 2.95Å |
| 217 | K | 78.4 | Confident | 76.8 | Confident | 52 Ų | 52 | 77.9 Ų | 77.9 | 23% | 0.226 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -67.8 | -37.8 | 177.7 | 178 | 172.3 | -177.2 | 179.7 | 0 | 112.3 | I128 Y129 K213 I214 A215 R221 | I128-K217 HydrophobicContact CG2-CD 4.21Å; I128-K217 PolarHBondContact O-NZ 2.94Å; Y129-K217 HydrophobicContact CD1-CD 4.26Å; Y129-K217 HydrophobicContact CE1-CD 3.36Å; Y129-K217 HydrophobicContact CE2-CD 4.05Å; Y129-K217 WeakPolarHBondContact OH-CB 3.46Å; Y129-K217 WeakPolarHBondContact OH-CD 3.21Å; K213-K217 PolarHBondContact O-N 3.37Å; I214-K217 PolarHBondContact O-N 3.29Å; A215-K217 PolarHBondContact O-N 3.36Å; K217-R221 WeakPolarHBondContact O-CB 3.19Å; K217-R221 WeakPolarHBondContact O-CG 3.23Å; K217-R221 PolarHBondContact O-N 3.24Å |
| 218 | L | 73.4 | Confident | 75.5 | Confident | 15 Ų | 15 | 81 Ų | 81 | 8% | 0.079 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -67.5 | -40 | 177.7 | -67.6 | 170.6 | 0 | 0 | 0 | 111.1 | I214 A215 S222 Y234 V237 A238 | I214-L218 HydrophobicContact CG2-CD1 3.52Å; I214-L218 HydrophobicContact CG2-CG 4.32Å; I214-L218 WeakPolarHBondContact O-CB 3.47Å; I214-L218 WeakPolarHBondContact O-CD1 3.35Å; I214-L218 WeakPolarHBondContact O-CG 3.32Å; I214-L218 PolarHBondContact O-N 3.27Å; A215-L218 PolarHBondContact O-N 3.47Å; L218-S222 WeakPolarHBondContact O-CB 3.38Å; L218-S222 PolarHBondContact O-N 3.31Å; L218-Y234 HydrophobicContact CD2-CD1 3.28Å; L218-Y234 HydrophobicContact CD2-CE1 4.21Å; L218-Y234 HydrophobicContact CD2-CG 3.85Å; L218-V237 HydrophobicContact CD1-CB 4.22Å; L218-V237 HydrophobicContact CD1-CG1 4.05Å; L218-A238 HydrophobicContact CB-CB 4.22Å; L218-A238 HydrophobicContact CD1-CB 3.67Å |
| 219 | L | 72.1 | Confident | 74.1 | Confident | 103 Ų | 103 | 84.1 Ų | 84.1 | 54% | 0.539 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -64.4 | -49.7 | 173.9 | -71 | 170.8 | 0 | 0 | 0 | 111.8 | A215 L216 R221 S222 Q223 | A215-L219 WeakPolarHBondContact O-CB 3.39Å; A215-L219 VanDerWaalsContact O-CG 3.29Å; A215-L219 WeakPolarHBondContact O-CG 3.48Å; A215-L219 PolarHBondContact O-N 2.85Å; L216-L219 PolarHBondContact O-N 3.11Å; L219-R221 VanDerWaalsContact C-N 3.32Å; L219-R221 PolarHBondContact O-N 3.5Å; L219-S222 WeakPolarHBondContact O-CB 3.41Å; L219-S222 PolarHBondContact O-N 3.01Å; L219-S222 VanDerWaalsContact O-N 3.12Å; L219-Q223 WeakPolarHBondContact O-CG 3.44Å; L219-Q223 PolarHBondContact O-N 3.38Å |
| 220 | R | 77.3 | Confident | 72.8 | Confident | 141 Ų | 141 | 81.5 Ų | 81.5 | 53% | 0.532 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -58.5 | -42.4 | 176.7 | -73.2 | 178.8 | -176.4 | -169.6 | 0.5 | 112.1 | L216 Q223 Q224 | L216-R220 HydrophobicContact CD1-CG 4.4Å; L216-R220 WeakPolarHBondContact O-CB 3.03Å; L216-R220 VanDerWaalsContact O-CG 3.3Å; L216-R220 WeakPolarHBondContact O-CG 3.18Å; L216-R220 PolarHBondContact O-N 2.95Å; R220-Q223 PolarHBondContact O-N 2.99Å; R220-Q224 WeakPolarHBondContact O-CB 3.3Å; R220-Q224 VanDerWaalsContact O-CG 3.27Å; R220-Q224 WeakPolarHBondContact O-CG 3.35Å; R220-Q224 PolarHBondContact O-N 2.96Å |
| 221 | R | 71.1 | Confident | 71.6 | Confident | 118 Ų | 118 | 81.8 Ų | 81.8 | 45% | 0.445 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -67.2 | -35.6 | 176 | -82.7 | -163.2 | 174.5 | -178.6 | -1.1 | 113.3 | K217 L219 Q223 R225 | K217-R221 WeakPolarHBondContact O-CB 3.19Å; K217-R221 WeakPolarHBondContact O-CG 3.23Å; K217-R221 PolarHBondContact O-N 3.24Å; L219-R221 VanDerWaalsContact C-N 3.32Å; L219-R221 PolarHBondContact O-N 3.5Å; R221-Q223 VanDerWaalsContact C-N 3.32Å; R221-R225 PolarHBondContact O-N 3.29Å |
| 222 | S | 69.4 | Low | 70.7 | Confident | 42 Ų | 42 | 84.3 Ų | 84.3 | 29% | 0.294 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -64.4 | -39.1 | 174.6 | -170.4 | 0 | 0 | 0 | 0 | 111.6 | L218 L219 | L218-S222 WeakPolarHBondContact O-CB 3.38Å; L218-S222 PolarHBondContact O-N 3.31Å; L219-S222 WeakPolarHBondContact O-CB 3.41Å; L219-S222 PolarHBondContact O-N 3.01Å; L219-S222 VanDerWaalsContact O-N 3.12Å |
| 223 | Q | 71.4 | Confident | 70.1 | Confident | 153 Ų | 153 | 87.3 Ų | 87.3 | 72% | 0.715 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -73.6 | -38 | 178.7 | -71.6 | 172 | -23.9 | 0 | 0 | 112.7 | L219 R220 R221 | L219-Q223 WeakPolarHBondContact O-CG 3.44Å; L219-Q223 PolarHBondContact O-N 3.38Å; R220-Q223 PolarHBondContact O-N 2.99Å; R221-Q223 VanDerWaalsContact C-N 3.32Å |
| 224 | Q | 72.2 | Confident | 69.3 | Low | 151 Ų | 151 | 84.3 Ų | 84.3 | 71% | 0.706 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -76.9 | -19.9 | -177.7 | -73.8 | 176.3 | -12.5 | 0 | 0 | 114.2 | R220 | R220-Q224 WeakPolarHBondContact O-CB 3.3Å; R220-Q224 VanDerWaalsContact O-CG 3.27Å; R220-Q224 WeakPolarHBondContact O-CG 3.35Å; R220-Q224 PolarHBondContact O-N 2.96Å |
| 225 | R | 66.3 | Low | 68.7 | Low | 165 Ų | 165 | 87.3 Ų | 87.3 | 62% | 0.623 | 45% | 0.446 | S | S | * | . | trans | -143 | 69 | -178.9 | -64.7 | -164 | -175.5 | -162 | -0.9 | 111.2 | R221 D227 L228 | R221-R225 PolarHBondContact O-N 3.29Å; R225-D227 PolarHBondContact O-N 2.87Å; R225-L228 HydrophobicContact CB-CB 4.42Å; R225-L228 HydrophobicContact CB-CD1 4.25Å; R225-L228 PolarHBondContact O-N 3.46Å | ||
| 226 | P | 62.3 | Low | 68.6 | Low | 87 Ų | 87 | 92.2 Ų | 92.2 | 57% | 0.565 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.8 | -29.3 | -179.3 | 24.8 | -32.5 | 0 | 0 | 0 | 112.5 | L228 | P226-L228 PolarHBondContact O-N 2.99Š|
| 227 | D | 61.7 | Low | 68.1 | Low | 151 Ų | 151 | 90.1 Ų | 90.1 | 81% | 0.807 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | -1.5 | -173.8 | -49 | -47 | 0 | 0 | 0 | 114.5 | R225 | R225-D227 PolarHBondContact O-N 2.87Š|
| 228 | L | 60.7 | Low | 67.8 | Low | 67 Ų | 67 | 88.4 Ų | 88.4 | 35% | 0.351 | 44% | 0.444 | S | S | . | . | S | Bend | trans | -77.4 | 130.6 | 176.6 | -113.3 | 73.7 | 0 | 0 | 0 | 110.2 | R225 P226 T230 A231 | R225-L228 HydrophobicContact CB-CB 4.42Å; R225-L228 HydrophobicContact CB-CD1 4.25Å; R225-L228 PolarHBondContact O-N 3.46Å; P226-L228 PolarHBondContact O-N 2.99Å; L228-T230 PolarHBondContact O-N 3.13Å; L228-A231 PolarHBondContact O-N 3.16Å |
| 229 | P | 59.2 | Low | 68 | Low | 125 Ų | 125 | 96.2 Ų | 96.2 | 81% | 0.812 | 47% | 0.472 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56 | -16.9 | 177.1 | -12.5 | 14.6 | 0 | 0 | 0 | 114.2 | ||
| 230 | T | 60.3 | Low | 68.3 | Low | 54 Ų | 54 | 94.1 Ų | 94.1 | 33% | 0.331 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.4 | -9.3 | 177.7 | 17.2 | 0 | 0 | 0 | 0 | 115.9 | L228 H233 Y234 | L228-T230 PolarHBondContact O-N 3.13Å; T230-H233 HydrophobicContact CG2-CB 4.31Å; T230-H233 WeakPolarHBondContact O-CA 3.43Å; T230-H233 VanDerWaalsContact O-CB 3.3Å; T230-H233 WeakPolarHBondContact O-CB 3.49Å; T230-H233 PolarHBondContact O-N 3.29Å; T230-Y234 WeakPolarHBondContact O-CD2 3.28Å; T230-Y234 PolarHBondContact O-N 3.42Å; T230-Y234 VanDerWaalsContact O-N 3.17Å |
| 231 | A | 60.5 | Low | 68.3 | Low | 13 Ų | 13 | 87.7 Ų | 87.7 | 11% | 0.107 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -50.6 | -48.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | L228 H233 Y234 S235 | L228-A231 PolarHBondContact O-N 3.16Å; A231-H233 PolarHBondContact O-N 3.33Å; A231-Y234 PolarHBondContact O-N 3.39Å; A231-Y234 VanDerWaalsContact O-N 3.17Å; A231-S235 PolarHBondContact O-N 3.21Å |
| 232 | P | 64.4 | Low | 68.8 | Low | 61 Ų | 61 | 89 Ų | 89 | 40% | 0.396 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -69.7 | -14.1 | 175.8 | 25.8 | -35 | 0 | 0 | 0 | 114.5 | S235 R236 | P232-S235 PolarHBondContact O-OG 2.83Å; P232-R236 WeakPolarHBondContact O-CB 3.32Å; P232-R236 VanDerWaalsContact O-CG 3.31Å; P232-R236 WeakPolarHBondContact O-CG 3.5Å; P232-R236 PolarHBondContact O-N 2.83Å; P232-R236 PolarHBondContact O-NE 3.48Å |
| 233 | H | 69.7 | Low | 69.5 | Low | 103 Ų | 103 | 90 Ų | 90 | 48% | 0.477 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -77.5 | -39.7 | 171.3 | 171 | -88.9 | 0 | 0 | 0 | 110.8 | T230 A231 R236 V237 | T230-H233 HydrophobicContact CG2-CB 4.31Å; T230-H233 WeakPolarHBondContact O-CA 3.43Å; T230-H233 VanDerWaalsContact O-CB 3.3Å; T230-H233 WeakPolarHBondContact O-CB 3.49Å; T230-H233 PolarHBondContact O-N 3.29Å; A231-H233 PolarHBondContact O-N 3.33Å; H233-R236 PolarHBondContact O-N 2.86Å; H233-V237 WeakPolarHBondContact O-CG2 3.28Å; H233-V237 PolarHBondContact O-N 2.97Å |
| 234 | Y | 68.1 | Low | 70 | Confident | 52 Ų | 52 | 83 Ų | 83 | 20% | 0.204 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -65.1 | -44.8 | 178.5 | -65.7 | -55.8 | 0 | 0 | 0 | 112.5 | L218 T230 A231 R236 V237 A238 | L218-Y234 HydrophobicContact CD2-CD1 3.28Å; L218-Y234 HydrophobicContact CD2-CE1 4.21Å; L218-Y234 HydrophobicContact CD2-CG 3.85Å; T230-Y234 WeakPolarHBondContact O-CD2 3.28Å; T230-Y234 PolarHBondContact O-N 3.42Å; T230-Y234 VanDerWaalsContact O-N 3.17Å; A231-Y234 PolarHBondContact O-N 3.39Å; A231-Y234 VanDerWaalsContact O-N 3.17Å; Y234-R236 VanDerWaalsContact C-N 3.32Å; Y234-R236 PolarHBondContact O-N 3.14Å; Y234-V237 PolarHBondContact O-N 2.69Å; Y234-A238 PolarHBondContact O-N 3.31Å |
| 235 | S | 67.4 | Low | 70.8 | Confident | 64 Ų | 64 | 77 Ų | 77 | 45% | 0.448 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -61.7 | -38.4 | 174.9 | 63.3 | 0 | 0 | 0 | 0 | 112.4 | A231 P232 A238 R239 | A231-S235 PolarHBondContact O-N 3.21Å; P232-S235 PolarHBondContact O-OG 2.83Å; S235-A238 PolarHBondContact O-N 2.95Å; S235-R239 WeakPolarHBondContact O-CB 3.47Å; S235-R239 PolarHBondContact O-N 3.24Å |
| 236 | R | 73.9 | Confident | 71.9 | Confident | 136 Ų | 136 | 74.3 Ų | 74.3 | 51% | 0.513 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -63.5 | -40.8 | 174.4 | -83.2 | -176.2 | -101.7 | -173.7 | -10.2 | 112.9 | P232 H233 Y234 K240 | P232-R236 WeakPolarHBondContact O-CB 3.32Å; P232-R236 VanDerWaalsContact O-CG 3.31Å; P232-R236 WeakPolarHBondContact O-CG 3.5Å; P232-R236 PolarHBondContact O-N 2.83Å; P232-R236 PolarHBondContact O-NE 3.48Å; H233-R236 PolarHBondContact O-N 2.86Å; Y234-R236 VanDerWaalsContact C-N 3.32Å; Y234-R236 PolarHBondContact O-N 3.14Å; R236-K240 VanDerWaalsContact O-CG 3.29Å; R236-K240 WeakPolarHBondContact O-CG 3.42Å; R236-K240 PolarHBondContact O-N 2.8Å; R236-K240 VanDerWaalsContact O-N 3.11Å |
| 237 | V | 71 | Confident | 73.3 | Confident | 39 Ų | 39 | 70.7 Ų | 70.7 | 24% | 0.236 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -68.6 | -40.1 | 177.2 | 174.3 | 0 | 0 | 0 | 0 | 111 | L218 H233 Y234 S241 | L218-V237 HydrophobicContact CD1-CB 4.22Å; L218-V237 HydrophobicContact CD1-CG1 4.05Å; H233-V237 WeakPolarHBondContact O-CG2 3.28Å; H233-V237 PolarHBondContact O-N 2.97Å; Y234-V237 PolarHBondContact O-N 2.69Å; V237-S241 WeakPolarHBondContact O-CB 3.38Å; V237-S241 PolarHBondContact O-N 3.24Å; V237-S241 VanDerWaalsContact O-N 3.08Å; V237-S241 PolarHBondContact O-OG 2.74Å |
| 238 | A | 72.6 | Confident | 74.7 | Confident | 17 Ų | 17 | 63.6 Ų | 63.6 | 14% | 0.14 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63 | -47.4 | 175 | 0 | 0 | 0 | 0 | 0 | 111.6 | L218 Y234 S235 K240 S241 F242 | L218-A238 HydrophobicContact CB-CB 4.22Å; L218-A238 HydrophobicContact CD1-CB 3.67Å; Y234-A238 PolarHBondContact O-N 3.31Å; S235-A238 PolarHBondContact O-N 2.95Å; A238-K240 PolarHBondContact O-N 3.23Å; A238-S241 VanDerWaalsContact O-CB 3.27Å; A238-S241 WeakPolarHBondContact O-CB 3.46Å; A238-S241 PolarHBondContact O-N 2.85Å; A238-S241 VanDerWaalsContact O-N 3.1Å; A238-F242 PolarHBondContact O-N 3.32Å |
| 239 | R | 76.4 | Confident | 76.2 | Confident | 179 Ų | 179 | 63 Ų | 63 | 68% | 0.675 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -60.9 | -42.8 | 178.8 | -174.3 | 171.4 | 65.3 | -169.8 | 2.9 | 112.7 | S235 S241 F242 F243 | S235-R239 WeakPolarHBondContact O-CB 3.47Å; S235-R239 PolarHBondContact O-N 3.24Å; R239-S241 VanDerWaalsContact C-N 3.28Å; R239-S241 PolarHBondContact O-N 3.31Å; R239-F242 PolarHBondContact O-N 3.14Å; R239-F243 WeakPolarHBondContact O-CB 3.43Å; R239-F243 PolarHBondContact O-N 2.9Å |
| 240 | K | 77.8 | Confident | 77.9 | Confident | 59 Ų | 59 | 59 Ų | 59 | 26% | 0.257 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.8 | -37.2 | 174.9 | -72.9 | 177.6 | -178.2 | -171 | 0 | 112.2 | R236 A238 F243 V244 L302 L303 | R236-K240 VanDerWaalsContact O-CG 3.29Å; R236-K240 WeakPolarHBondContact O-CG 3.42Å; R236-K240 PolarHBondContact O-N 2.8Å; R236-K240 VanDerWaalsContact O-N 3.11Å; A238-K240 PolarHBondContact O-N 3.23Å; K240-F243 PolarHBondContact O-N 3.12Å; K240-V244 WeakPolarHBondContact O-CG2 3.33Å; K240-V244 PolarHBondContact O-N 3.12Å; K240-V244 VanDerWaalsContact O-N 3.14Å; K240-L302 WeakPolarHBondContact CD-O 3.47Å; K240-L302 WeakPolarHBondContact CE-O 3.3Å; K240-L302 HydrophobicContact CG-CB 4.46Å; K240-L302 PolarHBondContact NZ-O 3.44Å; K240-L303 HydrophobicContact CB-CD2 4.31Å; K240-L303 HydrophobicContact CD-CD2 4.48Å |
| 241 | S | 77.3 | Confident | 79.6 | Confident | 6 Ų | 6 | 56.5 Ų | 56.5 | 4% | 0.042 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -65.9 | -45.3 | 177.8 | -66 | 0 | 0 | 0 | 0 | 111.8 | Y211 V237 A238 R239 F243 V244 L245 | Y211-S241 VanDerWaalsContact CE1-CB 3.43Å; V237-S241 WeakPolarHBondContact O-CB 3.38Å; V237-S241 PolarHBondContact O-N 3.24Å; V237-S241 VanDerWaalsContact O-N 3.08Å; V237-S241 PolarHBondContact O-OG 2.74Å; A238-S241 VanDerWaalsContact O-CB 3.27Å; A238-S241 WeakPolarHBondContact O-CB 3.46Å; A238-S241 PolarHBondContact O-N 2.85Å; A238-S241 VanDerWaalsContact O-N 3.1Å; R239-S241 VanDerWaalsContact C-N 3.28Å; R239-S241 PolarHBondContact O-N 3.31Å; S241-F243 VanDerWaalsContact C-N 3.34Å; S241-F243 PolarHBondContact O-N 2.86Å; S241-V244 PolarHBondContact O-N 2.94Å; S241-L245 PolarHBondContact O-N 2.89Å; S241-L245 VanDerWaalsContact O-N 3.16Å |
| 242 | F | 81.5 | Confident | 81.2 | Confident | 145 Ų | 145 | 55.9 Ų | 55.9 | 64% | 0.636 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -62.2 | -40.8 | 174.2 | -177 | -97.4 | 0 | 0 | 0 | 112.3 | A238 R239 V244 L245 F246 | A238-F242 PolarHBondContact O-N 3.32Å; R239-F242 PolarHBondContact O-N 3.14Å; F242-V244 PolarHBondContact O-N 3.5Å; F242-L245 PolarHBondContact O-N 3.16Å; F242-F246 WeakPolarHBondContact O-CB 2.97Å; F242-F246 PolarHBondContact O-N 2.02Å |
| 243 | F | 84.3 | Confident | 82.7 | Confident | 63 Ų | 63 | 54.3 Ų | 54.3 | 28% | 0.276 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.5 | -42.3 | 177.5 | -176.2 | -97.8 | 0 | 0 | 0 | 112.6 | R239 K240 S241 L245 F246 L247 V298 L302 | R239-F243 WeakPolarHBondContact O-CB 3.43Å; R239-F243 PolarHBondContact O-N 2.9Å; K240-F243 PolarHBondContact O-N 3.12Å; S241-F243 VanDerWaalsContact C-N 3.34Å; S241-F243 PolarHBondContact O-N 2.86Å; F243-L245 VanDerWaalsContact C-N 3.35Å; F243-L245 PolarHBondContact O-N 2.99Å; F243-F246 WeakPolarHBondContact O-CB 3.4Å; F243-F246 PolarHBondContact O-N 2.78Å; F243-L247 HydrophobicContact CD1-CD1 3.97Å; F243-L247 HydrophobicContact CD1-CG 4.23Å; F243-L247 HydrophobicContact CE1-CD1 3.39Å; F243-L247 HydrophobicContact CE1-CD2 4.32Å; F243-L247 HydrophobicContact CE1-CG 3.86Å; F243-L247 HydrophobicContact CZ-CD1 3.94Å; F243-L247 HydrophobicContact CZ-CD2 4.05Å; F243-L247 HydrophobicContact CZ-CG 4.07Å; F243-L247 WeakPolarHBondContact O-CG 3.41Å; F243-L247 PolarHBondContact O-N 2.98Å; F243-V298 HydrophobicContact CE1-CG1 3.98Å; F243-V298 HydrophobicContact CZ-CG1 3.92Å; F243-L302 HydrophobicContact CD1-CD1 3.17Å; F243-L302 HydrophobicContact CE1-CD1 3.32Å; F243-L302 HydrophobicContact CG-CD1 3.88Å; F243-L302 HydrophobicContact CZ-CD1 4.16Å |
| 244 | V | 83.4 | Confident | 83.9 | Confident | 5 Ų | 5 | 51.5 Ų | 51.5 | 3% | 0.03 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.2 | -42.1 | 175.6 | 175.2 | 0 | 0 | 0 | 0 | 111.3 | Y211 K240 S241 F242 F246 L247 F248 M299 L303 | Y211-V244 HydrophobicContact CE2-CG1 4.29Å; Y211-V244 WeakPolarHBondContact OH-CB 3.3Å; Y211-V244 WeakPolarHBondContact OH-CG1 3.43Å; K240-V244 WeakPolarHBondContact O-CG2 3.33Å; K240-V244 PolarHBondContact O-N 3.12Å; K240-V244 VanDerWaalsContact O-N 3.14Å; S241-V244 PolarHBondContact O-N 2.94Å; F242-V244 PolarHBondContact O-N 3.5Å; V244-F246 VanDerWaalsContact C-N 3.34Å; V244-F246 PolarHBondContact O-N 2.97Å; V244-L247 PolarHBondContact O-N 3.06Å; V244-F248 PolarHBondContact O-N 3.16Å; V244-M299 HydrophobicContact CB-SD 4.43Å; V244-M299 HydrophobicContact CG1-CE 3.68Å; V244-M299 HydrophobicContact CG1-SD 3.81Å; V244-M299 HydrophobicContact CG2-CE 3.91Å; V244-M299 HydrophobicContact CG2-CG 3.9Å; V244-M299 HydrophobicContact CG2-SD 3.85Å; V244-L303 HydrophobicContact CG2-CD1 4.19Å |
| 245 | L | 88 | Confident | 85.2 | Confident | 26 Ų | 26 | 49.1 Ų | 49.1 | 14% | 0.136 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.6 | -43.1 | 175.1 | 179.1 | 61.6 | 0 | 0 | 0 | 111.7 | L207 V208 Y211 S241 F242 F243 F248 V249 | L207-L245 HydrophobicContact CB-CD1 4.24Å; V208-L245 HydrophobicContact CG2-CD1 4.06Å; Y211-L245 HydrophobicContact CD2-CB 3.91Å; Y211-L245 HydrophobicContact CD2-CD1 4.42Å; Y211-L245 HydrophobicContact CE2-CB 4.31Å; S241-L245 PolarHBondContact O-N 2.89Å; S241-L245 VanDerWaalsContact O-N 3.16Å; F242-L245 PolarHBondContact O-N 3.16Å; F243-L245 VanDerWaalsContact C-N 3.35Å; F243-L245 PolarHBondContact O-N 2.99Å; L245-F248 PolarHBondContact O-N 3.47Å; L245-V249 HydrophobicContact CD1-CG2 4.38Å; L245-V249 WeakPolarHBondContact O-CG2 3.34Å; L245-V249 PolarHBondContact O-N 3.1Å |
| 246 | F | 90.1 | Very high | 86.5 | Confident | 108 Ų | 108 | 46.1 Ų | 46.1 | 47% | 0.474 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -59.4 | -47.2 | 176.8 | 170.9 | -98.7 | 0 | 0 | 0 | 111.8 | F242 F243 V244 F248 V249 V250 | F242-F246 WeakPolarHBondContact O-CB 2.97Å; F242-F246 PolarHBondContact O-N 2.02Å; F243-F246 WeakPolarHBondContact O-CB 3.4Å; F243-F246 PolarHBondContact O-N 2.78Å; V244-F246 VanDerWaalsContact C-N 3.34Å; V244-F246 PolarHBondContact O-N 2.97Å; F246-F248 PolarHBondContact O-N 3.13Å; F246-V249 PolarHBondContact O-N 3.45Å; F246-V250 HydrophobicContact CD2-CG2 4.22Å; F246-V250 HydrophobicContact CE1-CG2 4.08Å; F246-V250 HydrophobicContact CE2-CG2 3.74Å; F246-V250 HydrophobicContact CZ-CG2 3.66Å; F246-V250 WeakPolarHBondContact O-CG2 3.34Å; F246-V250 PolarHBondContact O-N 3.3Å |
| 247 | L | 90.7 | Very high | 87.4 | Confident | 11 Ų | 11 | 42.6 Ų | 42.6 | 6% | 0.058 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -59.9 | -45.5 | 176.1 | -68.6 | -174.6 | 0 | 0 | 0 | 111.7 | F243 V244 V249 V250 C251 L295 M299 | F243-L247 HydrophobicContact CD1-CD1 3.97Å; F243-L247 HydrophobicContact CD1-CG 4.23Å; F243-L247 HydrophobicContact CE1-CD1 3.39Å; F243-L247 HydrophobicContact CE1-CD2 4.32Å; F243-L247 HydrophobicContact CE1-CG 3.86Å; F243-L247 HydrophobicContact CZ-CD1 3.94Å; F243-L247 HydrophobicContact CZ-CD2 4.05Å; F243-L247 HydrophobicContact CZ-CG 4.07Å; F243-L247 WeakPolarHBondContact O-CG 3.41Å; F243-L247 PolarHBondContact O-N 2.98Å; V244-L247 PolarHBondContact O-N 3.06Å; L247-V249 VanDerWaalsContact C-N 3.31Å; L247-V249 PolarHBondContact O-N 2.91Å; L247-V250 PolarHBondContact O-N 3.47Å; L247-C251 WeakPolarHBondContact O-CB 3.34Å; L247-C251 PolarHBondContact O-N 3.34Å; L247-C251 PolarHBondContact O-SG 2.93Å; L247-C251 VanDerWaalsContact O-SG 3.38Å; L247-L295 HydrophobicContact CD1-CB 4.24Å; L247-L295 HydrophobicContact CD2-CB 4.17Å; L247-L295 HydrophobicContact CD2-CD1 3.91Å; L247-L295 HydrophobicContact CD2-CG 4.43Å; L247-M299 HydrophobicContact CD1-CB 4.33Å |
| 248 | F | 90.9 | Very high | 88.4 | Confident | 3 Ų | 3 | 42.6 Ų | 42.6 | 1% | 0.013 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -58.1 | -43.8 | 176.8 | -175.8 | -82.4 | 0 | 0 | 0 | 111.9 | I114 L117 F200 V203 F204 L207 V244 L245 F246 F252 | I114-F248 HydrophobicContact CB-CE2 4.29Å; I114-F248 HydrophobicContact CG1-CE2 4.08Å; I114-F248 HydrophobicContact CG1-CZ 4.3Å; I114-F248 HydrophobicContact CG2-CE2 4.08Å; I114-F248 HydrophobicContact CG2-CZ 4.05Å; L117-F248 HydrophobicContact CB-CD2 4.23Å; L117-F248 HydrophobicContact CD1-CD2 3.94Å; F200-F248 HydrophobicContact CD2-CZ 4.2Å; F200-F248 AromaticContact CE2-CE1 3.67Å; F200-F248 HydrophobicContact CE2-CE1 3.67Å; F200-F248 AromaticContact CE2-CZ 3.67Å; F200-F248 HydrophobicContact CE2-CZ 3.67Å; F200-F248 HydrophobicContact CZ-CE1 4.12Å; V203-F248 HydrophobicContact CG1-CE2 4.39Å; V203-F248 HydrophobicContact CG1-CZ 4.23Å; F204-F248 HydrophobicContact CB-CE1 4.13Å; F204-F248 AromaticContact CD2-CD1 3.96Å; F204-F248 HydrophobicContact CD2-CD1 3.96Å; F204-F248 AromaticContact CD2-CE1 3.7Å; F204-F248 HydrophobicContact CD2-CE1 3.7Å; F204-F248 HydrophobicContact CG-CE1 4.38Å; L207-F248 HydrophobicContact CD1-CD1 3.79Å; L207-F248 HydrophobicContact CD1-CD2 3.51Å; L207-F248 HydrophobicContact CD1-CE1 3.73Å; L207-F248 HydrophobicContact CD1-CE2 3.41Å; L207-F248 VanDerWaalsContact CD1-CE2 3.41Å; L207-F248 HydrophobicContact CD1-CG 3.7Å; L207-F248 HydrophobicContact CD1-CZ 3.53Å; V244-F248 PolarHBondContact O-N 3.16Å; L245-F248 PolarHBondContact O-N 3.47Å; F246-F248 PolarHBondContact O-N 3.13Å; F248-F252 HydrophobicContact CD1-CD2 4.46Å; F248-F252 AromaticContact CD2-CD2 3.57Å; F248-F252 HydrophobicContact CD2-CD2 3.57Å; F248-F252 AromaticContact CD2-CE2 3.96Å; F248-F252 HydrophobicContact CD2-CE2 3.96Å; F248-F252 HydrophobicContact CE1-CB 4.45Å; F248-F252 AromaticContact CE2-CD2 3.72Å; F248-F252 HydrophobicContact CE2-CD2 3.72Å; F248-F252 HydrophobicContact CE2-CE2 4.21Å; F248-F252 AromaticContact CG-CD2 3.98Å; F248-F252 HydrophobicContact CG-CD2 3.98Å; F248-F252 HydrophobicContact CZ-CB 4.47Å; F248-F252 HydrophobicContact CZ-CD2 4.22Å; F248-F252 PolarHBondContact O-N 3.17Å |
| 249 | V | 93.5 | Very high | 89.2 | Confident | 53 Ų | 53 | 42.4 Ų | 42.4 | 32% | 0.321 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -61.8 | -53.2 | 178.2 | 169.3 | 0 | 0 | 0 | 0 | 110.5 | F204 L245 F246 L247 C251 V253 P254 | F204-V249 HydrophobicContact CE2-CG2 3.73Å; F204-V249 HydrophobicContact CZ-CG2 4.38Å; L245-V249 HydrophobicContact CD1-CG2 4.38Å; L245-V249 WeakPolarHBondContact O-CG2 3.34Å; L245-V249 PolarHBondContact O-N 3.1Å; F246-V249 PolarHBondContact O-N 3.45Å; L247-V249 VanDerWaalsContact C-N 3.31Å; L247-V249 PolarHBondContact O-N 2.91Å; V249-C251 VanDerWaalsContact C-N 3.29Å; V249-C251 PolarHBondContact O-N 2.96Å; V249-V253 HydrophobicContact CB-CG2 4.29Å; V249-V253 HydrophobicContact CG1-CB 4.39Å; V249-V253 HydrophobicContact CG1-CG2 4.21Å; V249-V253 HydrophobicContact CG2-CG2 4.31Å; V249-V253 VanDerWaalsContact O-CB 3.28Å; V249-V253 WeakPolarHBondContact O-CB 3.46Å; V249-V253 PolarHBondContact O-N 3.27Å; V249-V253 VanDerWaalsContact O-N 3.11Å; V249-P254 VanDerWaalsContact O-CD 3.23Å; V249-P254 WeakPolarHBondContact O-CD 3.26Å |
| 250 | V | 93.9 | Very high | 89.6 | Confident | 43 Ų | 43 | 35.6 Ų | 35.6 | 26% | 0.261 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -61 | -39.8 | -177.7 | 170.8 | 0 | 0 | 0 | 0 | 111.5 | F246 L247 P254 F288 | F246-V250 HydrophobicContact CD2-CG2 4.22Å; F246-V250 HydrophobicContact CE1-CG2 4.08Å; F246-V250 HydrophobicContact CE2-CG2 3.74Å; F246-V250 HydrophobicContact CZ-CG2 3.66Å; F246-V250 WeakPolarHBondContact O-CG2 3.34Å; F246-V250 PolarHBondContact O-N 3.3Å; L247-V250 PolarHBondContact O-N 3.47Å; V250-P254 WeakPolarHBondContact O-CD 3.27Å; V250-P254 WeakPolarHBondContact O-CG 3.47Å; V250-F288 HydrophobicContact CG1-CD1 4.15Å; V250-F288 HydrophobicContact CG1-CE1 4.43Å; V250-F288 WeakPolarHBondContact O-CD1 3.4Å |
| 251 | C | 95.3 | Very high | 90.1 | Very high | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -79.2 | -44.3 | -175.8 | -68.8 | 0 | 0 | 0 | 0 | 113.4 | L247 V249 F288 S289 N292 | L247-C251 WeakPolarHBondContact O-CB 3.34Å; L247-C251 PolarHBondContact O-N 3.34Å; L247-C251 PolarHBondContact O-SG 2.93Å; L247-C251 VanDerWaalsContact O-SG 3.38Å; V249-C251 VanDerWaalsContact C-N 3.29Å; V249-C251 PolarHBondContact O-N 2.96Å; C251-F288 WeakPolarHBondContact CA-O 3.39Å; C251-F288 WeakPolarHBondContact CB-O 3.42Å; C251-F288 CarbonylContact O-C 3.13Å; C251-S289 WeakPolarHBondContact O-CA 3.36Å; C251-S289 PolarHBondContact O-N 3.02Å; C251-N292 HydrophobicContact CB-CB 4.03Å; C251-N292 PolarHBondContact SG-N 2.93Å |
| 252 | F | 95.5 | Very high | 90.5 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -108.9 | -29.2 | -166.8 | -58.6 | -65.3 | 0 | 0 | 0 | 114.7 | M110 I114 L117 F200 F248 H256 N292 | M110-F252 HydrophobicContact CG-CD1 3.94Å; M110-F252 HydrophobicContact CG-CE1 3.94Å; I114-F252 HydrophobicContact CD1-CB 4.35Å; I114-F252 HydrophobicContact CD1-CD1 3.72Å; I114-F252 HydrophobicContact CD1-CE1 4.14Å; I114-F252 HydrophobicContact CD1-CG 4.02Å; I114-F252 HydrophobicContact CG1-CB 4.32Å; I114-F252 HydrophobicContact CG1-CD1 3.67Å; I114-F252 HydrophobicContact CG1-CD2 3.9Å; I114-F252 HydrophobicContact CG1-CE1 3.82Å; I114-F252 HydrophobicContact CG1-CE2 4.06Å; I114-F252 HydrophobicContact CG1-CG 3.69Å; I114-F252 HydrophobicContact CG1-CZ 4Å; L117-F252 HydrophobicContact CD1-CE2 3.69Å; L117-F252 HydrophobicContact CD1-CZ 4.38Å; F200-F252 HydrophobicContact CD2-CB 4.48Å; F200-F252 HydrophobicContact CE2-CB 3.57Å; F200-F252 HydrophobicContact CZ-CB 4.24Å; F248-F252 HydrophobicContact CD1-CD2 4.46Å; F248-F252 AromaticContact CD2-CD2 3.57Å; F248-F252 HydrophobicContact CD2-CD2 3.57Å; F248-F252 AromaticContact CD2-CE2 3.96Å; F248-F252 HydrophobicContact CD2-CE2 3.96Å; F248-F252 HydrophobicContact CE1-CB 4.45Å; F248-F252 AromaticContact CE2-CD2 3.72Å; F248-F252 HydrophobicContact CE2-CD2 3.72Å; F248-F252 HydrophobicContact CE2-CE2 4.21Å; F248-F252 AromaticContact CG-CD2 3.98Å; F248-F252 HydrophobicContact CG-CD2 3.98Å; F248-F252 HydrophobicContact CZ-CB 4.47Å; F248-F252 HydrophobicContact CZ-CD2 4.22Å; F248-F252 PolarHBondContact O-N 3.17Å; F252-H256 PolarHBondContact O-N 3.15Å; F252-H256 PolarHBondContact O-ND1 3.4Å; F252-N292 HydrophobicContact CE1-CB 4.17Å; F252-N292 HydrophobicContact CE2-CB 4.21Å; F252-N292 WeakPolarHBondContact CE2-OD1 3.48Å; F252-N292 HydrophobicContact CZ-CB 3.61Å; F252-N292 WeakPolarHBondContact CZ-OD1 3.28Å |
| 253 | V | 95.2 | Very high | 90.6 | Very high | 28 Ų | 28 | 31.2 Ų | 31.2 | 17% | 0.17 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -65.5 | -42.1 | -176.5 | 176.7 | 0 | 0 | 0 | 0 | 112.8 | F200 F204 V249 Y255 H256 A257 | F200-V253 HydrophobicContact CZ-CG2 3.91Å; F204-V253 HydrophobicContact CD2-CG2 4.19Å; F204-V253 HydrophobicContact CE2-CG2 3.97Å; F204-V253 HydrophobicContact CZ-CG2 4.38Å; V249-V253 HydrophobicContact CB-CG2 4.29Å; V249-V253 HydrophobicContact CG1-CB 4.39Å; V249-V253 HydrophobicContact CG1-CG2 4.21Å; V249-V253 HydrophobicContact CG2-CG2 4.31Å; V249-V253 VanDerWaalsContact O-CB 3.28Å; V249-V253 WeakPolarHBondContact O-CB 3.46Å; V249-V253 PolarHBondContact O-N 3.27Å; V249-V253 VanDerWaalsContact O-N 3.11Å; V253-Y255 VanDerWaalsContact C-N 3.33Å; V253-Y255 PolarHBondContact O-N 3.45Å; V253-H256 PolarHBondContact O-N 2.88Å; V253-A257 HydrophobicContact CG1-CB 4.45Å; V253-A257 WeakPolarHBondContact O-CB 3.28Å; V253-A257 PolarHBondContact O-N 3.38Å |
| 254 | P | 95.5 | Very high | 90.5 | Very high | 44 Ų | 44 | 33.7 Ų | 33.7 | 29% | 0.286 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -53.7 | -48.5 | 179.2 | -28.4 | 35.1 | 0 | 0 | 0 | 112.8 | V249 V250 F258 F288 | V249-P254 VanDerWaalsContact O-CD 3.23Å; V249-P254 WeakPolarHBondContact O-CD 3.26Å; V250-P254 WeakPolarHBondContact O-CD 3.27Å; V250-P254 WeakPolarHBondContact O-CG 3.47Å; P254-F258 WeakPolarHBondContact O-CB 3.45Å; P254-F258 PolarHBondContact O-N 2.67Å; P254-F258 VanDerWaalsContact O-N 3.17Å; P254-F288 HydrophobicContact CG-CB 4.4Å; P254-F288 HydrophobicContact CG-CG 4.31Å |
| 255 | Y | 94.6 | Very high | 90.4 | Very high | 2 Ų | 2 | 33.5 Ų | 33.5 | 1% | 0.008 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -62.1 | -50.7 | 179.1 | 175.3 | -94.6 | 0 | 0 | 0 | 112.4 | Y107 M110 V253 F258 R259 L286 | Y107-Y255 HydrophobicContact CE1-CE2 4.28Å; Y107-Y255 AromaticContact CE1-CZ 3.83Å; Y107-Y255 WeakPolarHBondContact CE1-OH 3.39Å; M110-Y255 HydrophobicContact CE-CD1 3.86Å; M110-Y255 HydrophobicContact CE-CE1 3.39Å; M110-Y255 HydrophobicContact SD-CD1 3.68Å; M110-Y255 HydrophobicContact SD-CE1 3.8Å; M110-Y255 HydrophobicContact SD-CG 4.27Å; V253-Y255 VanDerWaalsContact C-N 3.33Å; V253-Y255 PolarHBondContact O-N 3.45Å; Y255-F258 PolarHBondContact O-N 3.09Å; Y255-R259 HydrophobicContact CE1-CG 4.45Å; Y255-R259 WeakPolarHBondContact O-CB 3.3Å; Y255-R259 PolarHBondContact O-N 3.16Å; Y255-R259 WeakPolarHBondContact OH-CD 3.35Å; Y255-R259 PolarHBondContact OH-NE 3.12Å; Y255-R259 PolarHBondContact OH-NH1 3.18Å; Y255-L286 HydrophobicContact CD2-CD2 3.71Å; Y255-L286 HydrophobicContact CD2-CG 3.96Å; Y255-L286 HydrophobicContact CE2-CD2 3.47Å; Y255-L286 VanDerWaalsContact CE2-CD2 3.47Å; Y255-L286 HydrophobicContact CE2-CG 3.92Å |
| 256 | H | 94.4 | Very high | 89.8 | Confident | 2 Ų | 2 | 32.9 Ų | 32.9 | 1% | 0.009 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -73.6 | -31.9 | -174.6 | -67.4 | 85.6 | 0 | 0 | 0 | 113 | Y111 I114 L197 F200 F252 V253 F258 R259 | Y111-H256 AromaticContact CE1-NE2 3.53Å; I114-H256 VanDerWaalsContact CD1-CE1 3.48Å; I114-H256 WeakPolarHBondContact CD1-CE1 3.46Å; L197-H256 HydrophobicContact CD1-CB 3.95Å; L197-H256 WeakPolarHBondContact CD1-O 3.4Å; F200-H256 VanDerWaalsContact CB-CD2 3.41Å; F200-H256 WeakPolarHBondContact CB-CD2 3.11Å; F200-H256 HydrophobicContact CD1-CB 3.29Å; F200-H256 AromaticContact CD1-CD2 3.66Å; F200-H256 AromaticContact CD1-CG 3.38Å; F200-H256 HydrophobicContact CD2-CB 4.33Å; F200-H256 AromaticContact CD2-CD2 3.72Å; F200-H256 AromaticContact CD2-CE1 3.57Å; F200-H256 AromaticContact CD2-CG 3.59Å; F200-H256 AromaticContact CD2-ND1 3.48Å; F200-H256 WeakPolarHBondContact CD2-ND1 3.25Å; F200-H256 AromaticContact CD2-NE2 3.72Å; F200-H256 HydrophobicContact CE1-CB 3.27Å; F200-H256 AromaticContact CE1-CG 3.64Å; F200-H256 HydrophobicContact CE2-CB 4.32Å; F200-H256 AromaticContact CE2-CE1 3.95Å; F200-H256 AromaticContact CE2-CG 3.84Å; F200-H256 AromaticContact CE2-ND1 3.5Å; F200-H256 HydrophobicContact CG-CB 3.84Å; F200-H256 AromaticContact CG-CD2 3.26Å; F200-H256 WeakPolarHBondContact CG-CD2 3.36Å; F200-H256 AromaticContact CG-CE1 3.96Å; F200-H256 AromaticContact CG-CG 3.34Å; F200-H256 AromaticContact CG-ND1 3.76Å; F200-H256 AromaticContact CG-NE2 3.69Å; F200-H256 HydrophobicContact CZ-CB 3.81Å; F200-H256 AromaticContact CZ-CG 3.85Å; F200-H256 AromaticContact CZ-ND1 3.8Å; F252-H256 PolarHBondContact O-N 3.15Å; F252-H256 PolarHBondContact O-ND1 3.4Å; V253-H256 PolarHBondContact O-N 2.88Å; H256-F258 VanDerWaalsContact C-N 3.33Å; H256-R259 PolarHBondContact O-N 3.03Å |
| 257 | A | 93.4 | Very high | 89.1 | Confident | 62 Ų | 62 | 32.6 Ų | 32.6 | 51% | 0.512 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -64.2 | -40.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | V253 | V253-A257 HydrophobicContact CG1-CB 4.45Å; V253-A257 WeakPolarHBondContact O-CB 3.28Å; V253-A257 PolarHBondContact O-N 3.38Å |
| 258 | F | 91.6 | Very high | 88.4 | Confident | 39 Ų | 39 | 34.5 Ų | 34.5 | 17% | 0.171 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -80 | -24.4 | 179.1 | -172.6 | -110.7 | 0 | 0 | 0 | 113.5 | P254 Y255 H256 G260 F261 Y262 A278 F281 N282 | P254-F258 WeakPolarHBondContact O-CB 3.45Å; P254-F258 PolarHBondContact O-N 2.67Å; P254-F258 VanDerWaalsContact O-N 3.17Å; Y255-F258 PolarHBondContact O-N 3.09Å; H256-F258 VanDerWaalsContact C-N 3.33Å; F258-G260 VanDerWaalsContact C-N 3.3Å; F258-G260 PolarHBondContact O-N 3.14Å; F258-G260 VanDerWaalsContact O-N 3.16Å; F258-F261 HydrophobicContact CD2-CB 4.41Å; F258-F261 HydrophobicContact CD2-CD1 4.09Å; F258-F261 HydrophobicContact CE2-CB 4.36Å; F258-F261 AromaticContact CE2-CD1 3.25Å; F258-F261 HydrophobicContact CE2-CD1 3.25Å; F258-F261 AromaticContact CE2-CE1 3.81Å; F258-F261 HydrophobicContact CE2-CE1 3.81Å; F258-F261 HydrophobicContact CE2-CG 4.11Å; F258-F261 AromaticContact CZ-CD1 3.51Å; F258-F261 HydrophobicContact CZ-CD1 3.51Å; F258-F261 AromaticContact CZ-CE1 3.93Å; F258-F261 HydrophobicContact CZ-CE1 3.93Å; F258-F261 WeakPolarHBondContact O-CB 3.46Å; F258-F261 PolarHBondContact O-N 3.29Å; F258-Y262 HydrophobicContact CE1-CD2 4.08Å; F258-Y262 HydrophobicContact CE1-CG 4.32Å; F258-Y262 PolarHBondContact O-N 3.45Å; F258-A278 WeakPolarHBondContact CE1-O 3.16Å; F258-A278 HydrophobicContact CZ-CB 4.21Å; F258-F281 HydrophobicContact CD1-CB 4.09Å; F258-F281 HydrophobicContact CE1-CB 3.52Å; F258-F281 HydrophobicContact CE2-CB 4Å; F258-F281 HydrophobicContact CE2-CG 4.41Å; F258-F281 HydrophobicContact CZ-CB 3.47Å; F258-F281 VanDerWaalsContact CZ-CB 3.47Å; F258-F281 HydrophobicContact CZ-CD2 4.47Å; F258-F281 HydrophobicContact CZ-CG 4.25Å; F258-N282 HydrophobicContact CE1-CB 4.27Å |
| 259 | R | 89.6 | Confident | 87.5 | Confident | 12 Ų | 12 | 44.8 Ų | 44.8 | 5% | 0.045 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -55.5 | -39.4 | -171 | -172.6 | 57.5 | 172.7 | -168.4 | -2.8 | 114.1 | N193 L197 Y255 H256 Y262 I263 | N193-R259 PolarHBondContact OD1-NE 3.42Å; N193-R259 PolarHBondContact OD1-NH2 3.16Å; L197-R259 HydrophobicContact CD1-CB 4.47Å; Y255-R259 HydrophobicContact CE1-CG 4.45Å; Y255-R259 WeakPolarHBondContact O-CB 3.3Å; Y255-R259 PolarHBondContact O-N 3.16Å; Y255-R259 WeakPolarHBondContact OH-CD 3.35Å; Y255-R259 PolarHBondContact OH-NE 3.12Å; Y255-R259 PolarHBondContact OH-NH1 3.18Å; H256-R259 PolarHBondContact O-N 3.03Å; R259-Y262 PolarHBondContact O-N 3.3Å; R259-I263 HydrophobicContact CG-CD1 3.92Å; R259-I263 HydrophobicContact CG-CG1 4.48Å; R259-I263 VanDerWaalsContact O-CG1 3.3Å; R259-I263 WeakPolarHBondContact O-CG1 3.29Å; R259-I263 PolarHBondContact O-N 3.24Å |
| 260 | G | 86.4 | Confident | 86.9 | Confident | 37 Ų | 37 | 45.6 Ų | 45.6 | 38% | 0.381 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -64 | -43 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | F258 K264 | F258-G260 VanDerWaalsContact C-N 3.3Å; F258-G260 PolarHBondContact O-N 3.14Å; F258-G260 VanDerWaalsContact O-N 3.16Å; G260-K264 PolarHBondContact O-N 3.17Å; G260-K264 VanDerWaalsContact O-N 3.13Å |
| 261 | F | 87.9 | Confident | 86.4 | Confident | 92 Ų | 92 | 47.7 Ų | 47.7 | 40% | 0.404 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64.6 | -45.8 | 174.7 | 176.2 | -91.7 | 0 | 0 | 0 | 111 | F258 I263 K264 T265 M274 A278 | F258-F261 HydrophobicContact CD2-CB 4.41Å; F258-F261 HydrophobicContact CD2-CD1 4.09Å; F258-F261 HydrophobicContact CE2-CB 4.36Å; F258-F261 AromaticContact CE2-CD1 3.25Å; F258-F261 HydrophobicContact CE2-CD1 3.25Å; F258-F261 AromaticContact CE2-CE1 3.81Å; F258-F261 HydrophobicContact CE2-CE1 3.81Å; F258-F261 HydrophobicContact CE2-CG 4.11Å; F258-F261 AromaticContact CZ-CD1 3.51Å; F258-F261 HydrophobicContact CZ-CD1 3.51Å; F258-F261 AromaticContact CZ-CE1 3.93Å; F258-F261 HydrophobicContact CZ-CE1 3.93Å; F258-F261 WeakPolarHBondContact O-CB 3.46Å; F258-F261 PolarHBondContact O-N 3.29Å; F261-I263 PolarHBondContact O-N 2.88Å; F261-K264 WeakPolarHBondContact O-CB 3.48Å; F261-K264 PolarHBondContact O-N 3.17Å; F261-K264 VanDerWaalsContact O-N 3.13Å; F261-T265 HydrophobicContact CD1-CG2 4.08Å; F261-T265 HydrophobicContact CE1-CG2 3.61Å; F261-T265 HydrophobicContact CE2-CG2 4.24Å; F261-T265 HydrophobicContact CZ-CG2 3.69Å; F261-T265 PolarHBondContact O-N 2.87Å; F261-M274 HydrophobicContact CZ-SD 3.97Å; F261-A278 HydrophobicContact CE1-CB 4.3Å |
| 262 | Y | 86 | Confident | 85.6 | Confident | 1 Ų | 1 | 52.3 Ų | 52.3 | 0% | 0.004 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -58 | -45.1 | 177.4 | -177.3 | -108.7 | 0 | 0 | 0 | 112.6 | F179 F258 R259 K264 T265 Q266 A278 D279 N282 | F179-Y262 HydrophobicContact CB-CE1 3.43Å; F179-Y262 VanDerWaalsContact CB-CE1 3.43Å; F179-Y262 WeakPolarHBondContact CB-OH 3.46Å; F179-Y262 HydrophobicContact CD1-CE1 4.48Å; F179-Y262 HydrophobicContact CD2-CE1 4.23Å; F179-Y262 AromaticContact CG-CE1 3.87Å; F179-Y262 HydrophobicContact CG-CE1 3.87Å; F179-Y262 PolarHBondContact N-OH 3.41Å; F258-Y262 HydrophobicContact CE1-CD2 4.08Å; F258-Y262 HydrophobicContact CE1-CG 4.32Å; F258-Y262 PolarHBondContact O-N 3.45Å; R259-Y262 PolarHBondContact O-N 3.3Å; Y262-K264 VanDerWaalsContact C-N 3.31Å; Y262-K264 PolarHBondContact O-N 3.41Å; Y262-T265 PolarHBondContact O-N 2.84Å; Y262-T265 PolarHBondContact O-OG1 3.33Å; Y262-Q266 HydrophobicContact CE1-CG 4.24Å; Y262-Q266 HydrophobicContact CE2-CG 4.24Å; Y262-Q266 VanDerWaalsContact O-CG 3.27Å; Y262-Q266 WeakPolarHBondContact O-CG 3.37Å; Y262-Q266 PolarHBondContact O-N 2.68Å; Y262-Q266 PolarHBondContact OH-NE2 3.42Å; Y262-Q266 VanDerWaalsContact OH-NE2 3.09Å; Y262-A278 HydrophobicContact CD2-CB 3.97Å; Y262-A278 WeakPolarHBondContact CD2-O 3.25Å; Y262-A278 HydrophobicContact CE2-CB 4.39Å; Y262-D279 WeakPolarHBondContact CE2-OD1 3.04Å; Y262-D279 PolarHBondContact OH-OD1 3.47Å; Y262-N282 HydrophobicContact CD1-CB 4.44Å; Y262-N282 HydrophobicContact CD2-CB 3.71Å; Y262-N282 HydrophobicContact CE1-CB 4.36Å; Y262-N282 HydrophobicContact CE2-CB 3.67Å; Y262-N282 HydrophobicContact CG-CB 4.11Å |
| 263 | I | 81.8 | Confident | 85 | Confident | 24 Ų | 24 | 58.4 Ų | 58.4 | 12% | 0.123 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.2 | -42.8 | 177.1 | -68.5 | 163.7 | 0 | 0 | 0 | 110.4 | F179 N193 R259 F261 T265 Q266 I267 | F179-I263 HydrophobicContact CZ-CG1 4.37Å; N193-I263 HydrophobicContact CB-CD1 3.73Å; R259-I263 HydrophobicContact CG-CD1 3.92Å; R259-I263 HydrophobicContact CG-CG1 4.48Å; R259-I263 VanDerWaalsContact O-CG1 3.3Å; R259-I263 WeakPolarHBondContact O-CG1 3.29Å; R259-I263 PolarHBondContact O-N 3.24Å; F261-I263 PolarHBondContact O-N 2.88Å; I263-T265 PolarHBondContact O-N 3.34Å; I263-Q266 PolarHBondContact O-N 2.88Å; I263-I267 HydrophobicContact CG2-CG2 4.46Å; I263-I267 WeakPolarHBondContact O-CG1 3.34Å; I263-I267 PolarHBondContact O-N 3.01Å |
| 264 | K | 83.8 | Confident | 84.5 | Confident | 115 Ų | 115 | 60.4 Ų | 60.4 | 50% | 0.5 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -55.4 | -50.9 | 177 | -175.3 | -169.4 | 171.4 | -167 | 0 | 110.8 | G260 F261 Y262 Q266 I267 T268 | G260-K264 PolarHBondContact O-N 3.17Å; G260-K264 VanDerWaalsContact O-N 3.13Å; F261-K264 WeakPolarHBondContact O-CB 3.48Å; F261-K264 PolarHBondContact O-N 3.17Å; F261-K264 VanDerWaalsContact O-N 3.13Å; Y262-K264 VanDerWaalsContact C-N 3.31Å; Y262-K264 PolarHBondContact O-N 3.41Å; K264-Q266 PolarHBondContact O-N 2.97Å; K264-Q266 VanDerWaalsContact O-N 3.14Å; K264-I267 VanDerWaalsContact O-CG1 3.28Å; K264-I267 WeakPolarHBondContact O-CG1 3.5Å; K264-I267 PolarHBondContact O-N 3.13Å; K264-I267 VanDerWaalsContact O-N 3.12Å; K264-T268 HydrophobicContact CG-CG2 4.46Å; K264-T268 PolarHBondContact O-N 2.97Å; K264-T268 PolarHBondContact O-OG1 2.98Å |
| 265 | T | 81.4 | Confident | 83.8 | Confident | 2 Ų | 2 | 60.1 Ų | 60.1 | 1% | 0.012 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -62.7 | -23 | -177.8 | 57.1 | 0 | 0 | 0 | 0 | 113.9 | F261 Y262 I263 E270 M274 A278 | F261-T265 HydrophobicContact CD1-CG2 4.08Å; F261-T265 HydrophobicContact CE1-CG2 3.61Å; F261-T265 HydrophobicContact CE2-CG2 4.24Å; F261-T265 HydrophobicContact CZ-CG2 3.69Å; F261-T265 PolarHBondContact O-N 2.87Å; Y262-T265 PolarHBondContact O-N 2.84Å; Y262-T265 PolarHBondContact O-OG1 3.33Å; I263-T265 PolarHBondContact O-N 3.34Å; T265-E270 HydrophobicContact CG2-CG 4.35Å; T265-M274 HydrophobicContact CG2-CG 4.19Å; T265-A278 HydrophobicContact CG2-CB 4.24Å; T265-A278 WeakPolarHBondContact OG1-CB 3.33Å |
| 266 | Q | 75.4 | Confident | 83.1 | Confident | 13 Ų | 13 | 62.7 Ų | 62.7 | 6% | 0.061 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -90.7 | -15.9 | 179.2 | -57.7 | -63 | 46.1 | 0 | 0 | 114 | F179 Y262 I263 K264 D279 | F179-Q266 HydrophobicContact CB-CG 4.3Å; F179-Q266 HydrophobicContact CD1-CB 3.69Å; F179-Q266 HydrophobicContact CD1-CG 3.75Å; F179-Q266 HydrophobicContact CE1-CB 4.09Å; F179-Q266 HydrophobicContact CE1-CG 4.49Å; F179-Q266 HydrophobicContact CG-CG 4.42Å; F179-Q266 PolarHBondContact O-NE2 2.91Å; Y262-Q266 HydrophobicContact CE1-CG 4.24Å; Y262-Q266 HydrophobicContact CE2-CG 4.24Å; Y262-Q266 VanDerWaalsContact O-CG 3.27Å; Y262-Q266 WeakPolarHBondContact O-CG 3.37Å; Y262-Q266 PolarHBondContact O-N 2.68Å; Y262-Q266 PolarHBondContact OH-NE2 3.42Å; Y262-Q266 VanDerWaalsContact OH-NE2 3.09Å; I263-Q266 PolarHBondContact O-N 2.88Å; K264-Q266 PolarHBondContact O-N 2.97Å; K264-Q266 VanDerWaalsContact O-N 3.14Å; Q266-D279 PolarHBondContact NE2-OD1 3.35Å; Q266-D279 VanDerWaalsContact NE2-OD1 3.15Å |
| 267 | I | 74.8 | Confident | 82.7 | Confident | 102 Ų | 102 | 66.7 Ų | 66.7 | 52% | 0.523 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -102.4 | -26.7 | 176.6 | 65.4 | 176.3 | 0 | 0 | 0 | 112.6 | I182 I263 K264 | I182-I267 HydrophobicContact CB-CG2 4.48Å; I182-I267 HydrophobicContact CD1-CG2 4.31Å; I263-I267 HydrophobicContact CG2-CG2 4.46Å; I263-I267 WeakPolarHBondContact O-CG1 3.34Å; I263-I267 PolarHBondContact O-N 3.01Å; K264-I267 VanDerWaalsContact O-CG1 3.28Å; K264-I267 WeakPolarHBondContact O-CG1 3.5Å; K264-I267 PolarHBondContact O-N 3.13Å; K264-I267 VanDerWaalsContact O-N 3.12Å |
| 268 | T | 76.2 | Confident | 82.4 | Confident | 51 Ų | 51 | 63.8 Ų | 63.8 | 31% | 0.313 | 32% | 0.322 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.1 | 149.5 | 172.9 | 51.3 | 0 | 0 | 0 | 0 | 110.6 | K264 E270 | K264-T268 HydrophobicContact CG-CG2 4.46Å; K264-T268 PolarHBondContact O-N 2.97Å; K264-T268 PolarHBondContact O-OG1 2.98Å; T268-E270 WeakPolarHBondContact CB-OE1 3.44Å; T268-E270 PolarHBondContact O-N 3.04Å; T268-E270 WeakPolarHBondContact OG1-CG 3.27Å; T268-E270 PolarHBondContact OG1-OE1 3.41Å |
| 269 | K | 72.1 | Confident | 82.1 | Confident | 218 Ų | 218 | 63.1 Ų | 63.1 | 95% | 0.948 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.7 | 74.3 | 171.8 | -69 | -177.1 | 179.1 | 180 | 0 | 109.4 | ||
| 270 | E | 79.4 | Confident | 81.9 | Confident | 70 Ų | 70 | 64.7 Ų | 64.7 | 33% | 0.327 | 33% | 0.328 | S | S | . | . | trans | -79 | 167.9 | 173.1 | -61.1 | -59.5 | 153.3 | 0 | 0 | 111.6 | T265 T268 M274 Q275 | T265-E270 HydrophobicContact CG2-CG 4.35Å; T268-E270 WeakPolarHBondContact CB-OE1 3.44Å; T268-E270 PolarHBondContact O-N 3.04Å; T268-E270 WeakPolarHBondContact OG1-CG 3.27Å; T268-E270 PolarHBondContact OG1-OE1 3.41Å; E270-M274 HydrophobicContact CB-CB 4.23Å; E270-M274 HydrophobicContact CB-CG 4.3Å; E270-Q275 HydrophobicContact CB-CG 4.31Å | ||
| 271 | T | 83.8 | Confident | 82 | Confident | 88 Ų | 88 | 67.7 Ų | 67.7 | 54% | 0.54 | 33% | 0.33 | S | S | . | . | trans | -66.8 | 151.9 | 173.3 | 62.3 | 0 | 0 | 0 | 0 | 111.4 | D273 M274 Q275 | T271-D273 PolarHBondContact O-N 3.23Å; T271-M274 WeakPolarHBondContact O-CB 3.44Å; T271-M274 PolarHBondContact O-N 2.86Å; T271-M274 VanDerWaalsContact O-N 3.09Å; T271-M274 WeakPolarHBondContact OG1-CB 3.37Å; T271-M274 PolarHBondContact OG1-N 3.22Å; T271-Q275 PolarHBondContact O-N 2.98Å; T271-Q275 VanDerWaalsContact O-N 3.09Å | ||
| 272 | Q | 79 | Confident | 82.1 | Confident | 97 Ų | 97 | 63.4 Ų | 63.4 | 45% | 0.453 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -56.9 | -37.9 | 178.4 | -172.7 | 62.8 | 54.6 | 0 | 0 | 112.1 | M274 Q275 N276 | Q272-M274 PolarHBondContact O-N 3.46Å; Q272-Q275 PolarHBondContact O-N 3.47Å; Q272-N276 PolarHBondContact NE2-OD1 3.4Å; Q272-N276 WeakPolarHBondContact O-CB 3.13Å; Q272-N276 PolarHBondContact O-N 2.9Å; Q272-N276 PolarHBondContact O-ND2 3.41Å; Q272-N276 PolarHBondContact O-OD1 3.35Å |
| 273 | D | 83.3 | Confident | 82.3 | Confident | 128 Ų | 128 | 63.9 Ų | 63.9 | 68% | 0.684 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -64.1 | -40.5 | 177.7 | -64 | -27 | 0 | 0 | 0 | 112.2 | T271 N276 L277 | T271-D273 PolarHBondContact O-N 3.23Å; D273-N276 PolarHBondContact O-N 3.41Å; D273-L277 VanDerWaalsContact O-CB 3.32Å; D273-L277 WeakPolarHBondContact O-CB 3.18Å; D273-L277 PolarHBondContact O-N 2.85Å |
| 274 | M | 83.7 | Confident | 82.7 | Confident | 69 Ų | 69 | 65.7 Ų | 65.7 | 34% | 0.34 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -66.2 | -41.6 | 177.4 | -171.9 | 67.4 | 71.5 | 0 | 0 | 111.2 | F261 T265 E270 T271 Q272 L277 A278 | F261-M274 HydrophobicContact CZ-SD 3.97Å; T265-M274 HydrophobicContact CG2-CG 4.19Å; E270-M274 HydrophobicContact CB-CB 4.23Å; E270-M274 HydrophobicContact CB-CG 4.3Å; T271-M274 WeakPolarHBondContact O-CB 3.44Å; T271-M274 PolarHBondContact O-N 2.86Å; T271-M274 VanDerWaalsContact O-N 3.09Å; T271-M274 WeakPolarHBondContact OG1-CB 3.37Å; T271-M274 PolarHBondContact OG1-N 3.22Å; Q272-M274 PolarHBondContact O-N 3.46Å; M274-L277 PolarHBondContact O-N 3.48Å; M274-A278 VanDerWaalsContact O-CB 3.3Å; M274-A278 WeakPolarHBondContact O-CB 3.44Å; M274-A278 PolarHBondContact O-N 3.01Å |
| 275 | Q | 80.9 | Confident | 83.2 | Confident | 39 Ų | 39 | 60.7 Ų | 60.7 | 18% | 0.182 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -64.9 | -45.3 | 176.6 | -70.1 | -179 | -14.1 | 0 | 0 | 111.8 | E270 T271 Q272 L277 A278 D279 | E270-Q275 HydrophobicContact CB-CG 4.31Å; T271-Q275 PolarHBondContact O-N 2.98Å; T271-Q275 VanDerWaalsContact O-N 3.09Å; Q272-Q275 PolarHBondContact O-N 3.47Å; Q275-L277 VanDerWaalsContact C-N 3.34Å; Q275-L277 PolarHBondContact O-N 2.92Å; Q275-A278 PolarHBondContact O-N 2.98Å; Q275-D279 PolarHBondContact O-N 3.23Å |
| 276 | N | 81.4 | Confident | 83.8 | Confident | 56 Ų | 56 | 60.7 Ų | 60.7 | 30% | 0.299 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.4 | -44.3 | 176.5 | -70.3 | -14.6 | 0 | 0 | 0 | 111.3 | Q272 D273 D279 K280 | Q272-N276 PolarHBondContact NE2-OD1 3.4Å; Q272-N276 WeakPolarHBondContact O-CB 3.13Å; Q272-N276 PolarHBondContact O-N 2.9Å; Q272-N276 PolarHBondContact O-ND2 3.41Å; Q272-N276 PolarHBondContact O-OD1 3.35Å; D273-N276 PolarHBondContact O-N 3.41Å; N276-D279 PolarHBondContact O-N 2.9Å; N276-K280 WeakPolarHBondContact O-CG 3.22Å; N276-K280 PolarHBondContact O-N 3.47Å |
| 277 | L | 85.6 | Confident | 84.7 | Confident | 85 Ų | 85 | 60.5 Ų | 60.5 | 45% | 0.445 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -62.8 | -43.3 | 176.4 | -174.8 | 61.1 | 0 | 0 | 0 | 111.4 | D273 M274 Q275 K280 F281 | D273-L277 VanDerWaalsContact O-CB 3.32Å; D273-L277 WeakPolarHBondContact O-CB 3.18Å; D273-L277 PolarHBondContact O-N 2.85Å; M274-L277 PolarHBondContact O-N 3.48Å; Q275-L277 VanDerWaalsContact C-N 3.34Å; Q275-L277 PolarHBondContact O-N 2.92Å; L277-K280 PolarHBondContact O-N 3.37Å; L277-F281 HydrophobicContact CD1-CD2 3.92Å; L277-F281 HydrophobicContact CD1-CE2 3.53Å; L277-F281 HydrophobicContact CD2-CE2 4.26Å; L277-F281 HydrophobicContact CG-CD2 3.88Å; L277-F281 HydrophobicContact CG-CE2 3.73Å; L277-F281 VanDerWaalsContact O-CD2 3.28Å; L277-F281 WeakPolarHBondContact O-CD2 3.27Å; L277-F281 PolarHBondContact O-N 2.98Å |
| 278 | A | 87 | Confident | 85.8 | Confident | 1 Ų | 1 | 59.3 Ų | 59.3 | 1% | 0.008 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -64.5 | -40.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | F258 F261 Y262 T265 M274 Q275 F281 N282 | F258-A278 WeakPolarHBondContact CE1-O 3.16Å; F258-A278 HydrophobicContact CZ-CB 4.21Å; F261-A278 HydrophobicContact CE1-CB 4.3Å; Y262-A278 HydrophobicContact CD2-CB 3.97Å; Y262-A278 WeakPolarHBondContact CD2-O 3.25Å; Y262-A278 HydrophobicContact CE2-CB 4.39Å; T265-A278 HydrophobicContact CG2-CB 4.24Å; T265-A278 WeakPolarHBondContact OG1-CB 3.33Å; M274-A278 VanDerWaalsContact O-CB 3.3Å; M274-A278 WeakPolarHBondContact O-CB 3.44Å; M274-A278 PolarHBondContact O-N 3.01Å; Q275-A278 PolarHBondContact O-N 2.98Å; A278-F281 PolarHBondContact O-N 3.32Å; A278-N282 WeakPolarHBondContact O-CB 3.45Å; A278-N282 PolarHBondContact O-N 3.34Å |
| 279 | D | 84.1 | Confident | 86.7 | Confident | 25 Ų | 25 | 57 Ų | 57 | 13% | 0.134 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.3 | -45 | 173.3 | -84.2 | -16 | 0 | 0 | 0 | 111.8 | H178 Y262 Q266 Q275 N276 F281 N282 E283 | H178-D279 IonicContact CE1-OD2 2.85Å; H178-D279 IonicContact CG-OD2 3.84Å; H178-D279 IonicContact ND1-OD1 2.81Å; H178-D279 IonicContact ND1-OD2 3.57Å; H178-D279 PolarHBondContact ND1-OD2 3.43Å; Y262-D279 WeakPolarHBondContact CE2-OD1 3.04Å; Y262-D279 PolarHBondContact OH-OD1 3.47Å; Q266-D279 PolarHBondContact NE2-OD1 3.35Å; Q266-D279 VanDerWaalsContact NE2-OD1 3.15Å; Q275-D279 PolarHBondContact O-N 3.23Å; N276-D279 PolarHBondContact O-N 2.9Å; D279-F281 PolarHBondContact O-N 3.03Å; D279-N282 PolarHBondContact O-N 3.37Å; D279-E283 WeakPolarHBondContact O-CG 3.49Å; D279-E283 PolarHBondContact O-N 3.34Å |
| 280 | K | 86.2 | Confident | 87.8 | Confident | 46 Ų | 46 | 46.6 Ų | 46.6 | 20% | 0.2 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -59.1 | -46.8 | 176 | -70.3 | 179.4 | -170.8 | -167.2 | 0 | 111.6 | D21 L25 N276 L277 E283 I284 | D21-K280 PolarHBondContact O-NZ 3.03Å; D21-K280 IonicContact OD2-NZ 3.77Å; D21-K280 PolarHBondContact OD2-NZ 3.4Å; L25-K280 HydrophobicContact CD2-CB 4.26Å; L25-K280 HydrophobicContact CD2-CG 4.24Å; N276-K280 WeakPolarHBondContact O-CG 3.22Å; N276-K280 PolarHBondContact O-N 3.47Å; L277-K280 PolarHBondContact O-N 3.37Å; K280-E283 PolarHBondContact O-N 3.09Å; K280-I284 VanDerWaalsContact O-CG1 3.31Å; K280-I284 WeakPolarHBondContact O-CG1 3.43Å; K280-I284 PolarHBondContact O-N 3.37Å |
| 281 | F | 89.2 | Confident | 88.6 | Confident | 100 Ų | 100 | 45.3 Ų | 45.3 | 44% | 0.439 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -65.7 | -37.8 | 177.5 | -84.8 | -68.5 | 0 | 0 | 0 | 113.1 | F258 L277 A278 D279 S285 | F258-F281 HydrophobicContact CD1-CB 4.09Å; F258-F281 HydrophobicContact CE1-CB 3.52Å; F258-F281 HydrophobicContact CE2-CB 4Å; F258-F281 HydrophobicContact CE2-CG 4.41Å; F258-F281 HydrophobicContact CZ-CB 3.47Å; F258-F281 VanDerWaalsContact CZ-CB 3.47Å; F258-F281 HydrophobicContact CZ-CD2 4.47Å; F258-F281 HydrophobicContact CZ-CG 4.25Å; L277-F281 HydrophobicContact CD1-CD2 3.92Å; L277-F281 HydrophobicContact CD1-CE2 3.53Å; L277-F281 HydrophobicContact CD2-CE2 4.26Å; L277-F281 HydrophobicContact CG-CD2 3.88Å; L277-F281 HydrophobicContact CG-CE2 3.73Å; L277-F281 VanDerWaalsContact O-CD2 3.28Å; L277-F281 WeakPolarHBondContact O-CD2 3.27Å; L277-F281 PolarHBondContact O-N 2.98Å; A278-F281 PolarHBondContact O-N 3.32Å; D279-F281 PolarHBondContact O-N 3.03Å; F281-S285 VanDerWaalsContact O-CB 3.29Å; F281-S285 WeakPolarHBondContact O-CB 3.29Å; F281-S285 PolarHBondContact O-N 2.81Å; F281-S285 PolarHBondContact O-OG 3.41Å |
| 282 | N | 89.1 | Confident | 89.1 | Confident | 1 Ų | 1 | 41.2 Ų | 41.2 | 1% | 0.005 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -62.7 | -46.2 | 175.1 | 176.3 | 81.5 | 0 | 0 | 0 | 110.8 | F258 Y262 A278 D279 S285 L286 | F258-N282 HydrophobicContact CE1-CB 4.27Å; Y262-N282 HydrophobicContact CD1-CB 4.44Å; Y262-N282 HydrophobicContact CD2-CB 3.71Å; Y262-N282 HydrophobicContact CE1-CB 4.36Å; Y262-N282 HydrophobicContact CE2-CB 3.67Å; Y262-N282 HydrophobicContact CG-CB 4.11Å; A278-N282 WeakPolarHBondContact O-CB 3.45Å; A278-N282 PolarHBondContact O-N 3.34Å; D279-N282 PolarHBondContact O-N 3.37Å; N282-S285 PolarHBondContact O-N 3.42Å; N282-L286 WeakPolarHBondContact ND2-CD1 3.33Å; N282-L286 WeakPolarHBondContact O-CG 3.47Å; N282-L286 PolarHBondContact O-N 2.96Å |
| 283 | E | 89.5 | Confident | 89.9 | Confident | 11 Ų | 11 | 36.6 Ų | 36.6 | 5% | 0.051 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -60.4 | -48 | 176.5 | -76.2 | -61.2 | 117.5 | 0 | 0 | 112.2 | R82 H86 D279 K280 S285 L286 V287 | R82-E283 IonicContact CZ-OE2 2.65Å; R82-E283 IonicContact NE-OE2 3.58Å; R82-E283 IonicContact NH2-OE1 2.73Å; R82-E283 PolarHBondContact NH2-OE1 2.95Å; R82-E283 VanDerWaalsContact NH2-OE1 3.15Å; R82-E283 IonicContact NH2-OE2 3.15Å; R82-E283 PolarHBondContact NH2-OE2 3.2Å; H86-E283 IonicContact CE1-OE2 3.59Å; D279-E283 WeakPolarHBondContact O-CG 3.49Å; D279-E283 PolarHBondContact O-N 3.34Å; K280-E283 PolarHBondContact O-N 3.09Å; E283-S285 VanDerWaalsContact C-N 3.3Å; E283-S285 PolarHBondContact O-N 2.89Å; E283-L286 WeakPolarHBondContact O-CB 3.39Å; E283-L286 PolarHBondContact O-N 3.02Å; E283-L286 VanDerWaalsContact O-N 3.15Å; E283-V287 PolarHBondContact O-N 3.15Å |
| 284 | I | 92.1 | Very high | 90.4 | Very high | 62 Ų | 62 | 31.2 Ų | 31.2 | 32% | 0.318 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -58.2 | -45.1 | 175.8 | -69.2 | 166.4 | 0 | 0 | 0 | 110.6 | L25 K280 L286 V287 F288 | L25-I284 HydrophobicContact CD1-CD1 4.38Å; L25-I284 HydrophobicContact CD1-CG1 4.27Å; L25-I284 HydrophobicContact CD2-CD1 4.38Å; L25-I284 HydrophobicContact CD2-CG1 4.26Å; K280-I284 VanDerWaalsContact O-CG1 3.31Å; K280-I284 WeakPolarHBondContact O-CG1 3.43Å; K280-I284 PolarHBondContact O-N 3.37Å; I284-L286 VanDerWaalsContact C-N 3.3Å; I284-L286 PolarHBondContact O-N 3.23Å; I284-V287 WeakPolarHBondContact O-CB 3.48Å; I284-V287 PolarHBondContact O-N 3.41Å; I284-V287 VanDerWaalsContact O-N 3.1Å; I284-F288 HydrophobicContact CG2-CD2 4.21Å; I284-F288 HydrophobicContact CG2-CE2 3.84Å; I284-F288 VanDerWaalsContact O-CD2 3.28Å; I284-F288 WeakPolarHBondContact O-CD2 3.38Å; I284-F288 PolarHBondContact O-N 3.28Å |
| 285 | S | 93.8 | Very high | 90.8 | Very high | 10 Ų | 10 | 30.1 Ų | 30.1 | 7% | 0.07 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -66.2 | -31.7 | 179.4 | -56.8 | 0 | 0 | 0 | 0 | 112.8 | F281 N282 E283 F288 S289 | F281-S285 VanDerWaalsContact O-CB 3.29Å; F281-S285 WeakPolarHBondContact O-CB 3.29Å; F281-S285 PolarHBondContact O-N 2.81Å; F281-S285 PolarHBondContact O-OG 3.41Å; N282-S285 PolarHBondContact O-N 3.42Å; E283-S285 VanDerWaalsContact C-N 3.3Å; E283-S285 PolarHBondContact O-N 2.89Å; S285-F288 WeakPolarHBondContact O-CB 3.48Å; S285-F288 PolarHBondContact O-N 2.97Å; S285-S289 PolarHBondContact O-N 3.03Å; S285-S289 VanDerWaalsContact O-N 3.16Å |
| 286 | L | 93.2 | Very high | 91.2 | Very high | 3 Ų | 3 | 28.4 Ų | 28.4 | 2% | 0.016 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -67.1 | -35.2 | 171.7 | -73.3 | 168.4 | 0 | 0 | 0 | 111.6 | F106 Y107 Y255 N282 E283 I284 F288 S289 A290 | F106-L286 HydrophobicContact CD1-CD2 4.01Å; F106-L286 HydrophobicContact CE1-CB 4.05Å; F106-L286 HydrophobicContact CE1-CD2 3.5Å; F106-L286 HydrophobicContact CE1-CG 4.33Å; F106-L286 HydrophobicContact CZ-CB 4.12Å; F106-L286 HydrophobicContact CZ-CD2 4.41Å; F106-L286 WeakPolarHBondContact CZ-O 3.32Å; Y107-L286 HydrophobicContact CE1-CD2 3.86Å; Y255-L286 HydrophobicContact CD2-CD2 3.71Å; Y255-L286 HydrophobicContact CD2-CG 3.96Å; Y255-L286 HydrophobicContact CE2-CD2 3.47Å; Y255-L286 VanDerWaalsContact CE2-CD2 3.47Å; Y255-L286 HydrophobicContact CE2-CG 3.92Å; N282-L286 WeakPolarHBondContact ND2-CD1 3.33Å; N282-L286 WeakPolarHBondContact O-CG 3.47Å; N282-L286 PolarHBondContact O-N 2.96Å; E283-L286 WeakPolarHBondContact O-CB 3.39Å; E283-L286 PolarHBondContact O-N 3.02Å; E283-L286 VanDerWaalsContact O-N 3.15Å; I284-L286 VanDerWaalsContact C-N 3.3Å; I284-L286 PolarHBondContact O-N 3.23Å; L286-F288 VanDerWaalsContact C-N 3.31Å; L286-F288 PolarHBondContact O-N 2.96Å; L286-S289 WeakPolarHBondContact O-CB 3.49Å; L286-S289 PolarHBondContact O-N 3.44Å; L286-S289 VanDerWaalsContact O-N 3.16Å; L286-A290 PolarHBondContact O-N 3.1Å |
| 287 | V | 95.4 | Very high | 91.5 | Very high | 9 Ų | 9 | 26.9 Ų | 26.9 | 6% | 0.055 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -58.8 | -44.7 | 171.5 | -179.6 | 0 | 0 | 0 | 0 | 110.6 | L29 L32 Y33 I36 E283 I284 S289 A290 L291 | L29-V287 HydrophobicContact CD2-CG2 3.39Å; L32-V287 HydrophobicContact CB-CG1 4.07Å; L32-V287 HydrophobicContact CD1-CG1 4.14Å; Y33-V287 HydrophobicContact CE1-CG2 4.21Å; Y33-V287 HydrophobicContact CE2-CG2 4.06Å; Y33-V287 VanDerWaalsContact OH-CG2 3.29Å; Y33-V287 WeakPolarHBondContact OH-CG2 3.26Å; I36-V287 HydrophobicContact CD1-CG1 4.11Å; E283-V287 PolarHBondContact O-N 3.15Å; I284-V287 WeakPolarHBondContact O-CB 3.48Å; I284-V287 PolarHBondContact O-N 3.41Å; I284-V287 VanDerWaalsContact O-N 3.1Å; V287-S289 VanDerWaalsContact C-N 3.27Å; V287-S289 PolarHBondContact O-N 3.39Å; V287-A290 PolarHBondContact O-N 2.84Å; V287-L291 WeakPolarHBondContact O-CG 3.35Å; V287-L291 PolarHBondContact O-N 3.16Å |
| 288 | F | 96.3 | Very high | 91.5 | Very high | 77 Ų | 77 | 25.9 Ų | 25.9 | 34% | 0.338 | 13% | 0.132 | S | C | . | . | H | α-helix | trans | -56.6 | -42.6 | 174.7 | -78.2 | -82.8 | 0 | 0 | 0 | 111.8 | V250 C251 P254 I284 S285 L286 A290 L291 | V250-F288 HydrophobicContact CG1-CD1 4.15Å; V250-F288 HydrophobicContact CG1-CE1 4.43Å; V250-F288 WeakPolarHBondContact O-CD1 3.4Å; C251-F288 WeakPolarHBondContact CA-O 3.39Å; C251-F288 WeakPolarHBondContact CB-O 3.42Å; C251-F288 CarbonylContact O-C 3.13Å; P254-F288 HydrophobicContact CG-CB 4.4Å; P254-F288 HydrophobicContact CG-CG 4.31Å; I284-F288 HydrophobicContact CG2-CD2 4.21Å; I284-F288 HydrophobicContact CG2-CE2 3.84Å; I284-F288 VanDerWaalsContact O-CD2 3.28Å; I284-F288 WeakPolarHBondContact O-CD2 3.38Å; I284-F288 PolarHBondContact O-N 3.28Å; S285-F288 WeakPolarHBondContact O-CB 3.48Å; S285-F288 PolarHBondContact O-N 2.97Å; L286-F288 VanDerWaalsContact C-N 3.31Å; L286-F288 PolarHBondContact O-N 2.96Å; F288-A290 PolarHBondContact O-N 2.65Å; F288-L291 HydrophobicContact CD1-CD1 4.15Å; F288-L291 WeakPolarHBondContact O-CB 3.44Å; F288-L291 PolarHBondContact O-N 3.15Å |
| 289 | S | 95.5 | Very high | 91.5 | Very high | 1 Ų | 1 | 25.9 Ų | 25.9 | 1% | 0.007 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -62.8 | -41.5 | 174.8 | -176 | 0 | 0 | 0 | 0 | 112.3 | M110 C251 S285 L286 V287 L291 N292 | M110-S289 WeakPolarHBondContact CG-OG 3.44Å; M110-S289 PolarHBondContact SD-OG 2.81Å; M110-S289 VanDerWaalsContact SD-OG 3.34Å; C251-S289 WeakPolarHBondContact O-CA 3.36Å; C251-S289 PolarHBondContact O-N 3.02Å; S285-S289 PolarHBondContact O-N 3.03Å; S285-S289 VanDerWaalsContact O-N 3.16Å; L286-S289 WeakPolarHBondContact O-CB 3.49Å; L286-S289 PolarHBondContact O-N 3.44Å; L286-S289 VanDerWaalsContact O-N 3.16Å; V287-S289 VanDerWaalsContact C-N 3.27Å; V287-S289 PolarHBondContact O-N 3.39Å; S289-L291 VanDerWaalsContact C-N 3.29Å; S289-L291 PolarHBondContact O-N 2.78Å; S289-N292 WeakPolarHBondContact O-CB 3.43Å; S289-N292 PolarHBondContact O-N 2.09Å |
| 290 | A | 96 | Very high | 91.6 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -67.5 | -27.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y33 I36 L75 F106 L286 V287 F288 N292 S293 | Y33-A290 HydrophobicContact CD1-CB 4.43Å; Y33-A290 HydrophobicContact CE1-CB 3.9Å; I36-A290 HydrophobicContact CD1-CB 3.88Å; I36-A290 HydrophobicContact CG2-CB 4.42Å; I36-A290 WeakPolarHBondContact CG2-O 3.4Å; L75-A290 HydrophobicContact CD2-CB 4.4Å; F106-A290 HydrophobicContact CE2-CB 3.97Å; F106-A290 HydrophobicContact CZ-CB 3.79Å; L286-A290 PolarHBondContact O-N 3.1Å; V287-A290 PolarHBondContact O-N 2.84Å; F288-A290 PolarHBondContact O-N 2.65Å; A290-N292 PolarHBondContact O-N 3.38Å; A290-N292 VanDerWaalsContact O-N 3.1Å; A290-S293 PolarHBondContact O-N 3.26Å; A290-S293 VanDerWaalsContact O-N 3.09Å |
| 291 | L | 95.9 | Very high | 91.4 | Very high | 44 Ų | 44 | 26.2 Ų | 26.2 | 23% | 0.23 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -57 | -24.7 | 173.4 | -71.2 | 172.7 | 0 | 0 | 0 | 111.9 | I36 V287 F288 S289 S293 C294 L295 | I36-L291 HydrophobicContact CD1-CD2 3.9Å; I36-L291 HydrophobicContact CD1-CG 4.23Å; I36-L291 HydrophobicContact CG1-CD2 3.85Å; V287-L291 WeakPolarHBondContact O-CG 3.35Å; V287-L291 PolarHBondContact O-N 3.16Å; F288-L291 HydrophobicContact CD1-CD1 4.15Å; F288-L291 WeakPolarHBondContact O-CB 3.44Å; F288-L291 PolarHBondContact O-N 3.15Å; S289-L291 VanDerWaalsContact C-N 3.29Å; S289-L291 PolarHBondContact O-N 2.78Å; L291-S293 PolarHBondContact O-N 2.91Å; L291-C294 PolarHBondContact O-N 3.1Å; L291-C294 VanDerWaalsContact O-N 3.13Å; L291-C294 PolarHBondContact O-SG 3.17Å; L291-L295 HydrophobicContact CB-CD1 4.08Å; L291-L295 WeakPolarHBondContact O-CB 3.46Å; L291-L295 VanDerWaalsContact O-CG 3.27Å; L291-L295 WeakPolarHBondContact O-CG 3.3Å; L291-L295 PolarHBondContact O-N 3.15Å |
| 292 | N | 94.8 | Very high | 90.9 | Very high | 2 Ų | 2 | 23.7 Ų | 23.7 | 1% | 0.011 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -52 | -45.8 | 175.2 | -176.1 | 79.4 | 0 | 0 | 0 | 111.2 | C251 F252 S289 A290 C294 L295 D296 | C251-N292 HydrophobicContact CB-CB 4.03Å; C251-N292 PolarHBondContact SG-N 2.93Å; F252-N292 HydrophobicContact CE1-CB 4.17Å; F252-N292 HydrophobicContact CE2-CB 4.21Å; F252-N292 WeakPolarHBondContact CE2-OD1 3.48Å; F252-N292 HydrophobicContact CZ-CB 3.61Å; F252-N292 WeakPolarHBondContact CZ-OD1 3.28Å; S289-N292 WeakPolarHBondContact O-CB 3.43Å; S289-N292 PolarHBondContact O-N 2.09Å; A290-N292 PolarHBondContact O-N 3.38Å; A290-N292 VanDerWaalsContact O-N 3.1Å; N292-C294 VanDerWaalsContact C-N 3.26Å; N292-C294 PolarHBondContact O-N 3.28Å; N292-L295 PolarHBondContact O-N 3.46Å; N292-L295 VanDerWaalsContact O-N 3.11Å; N292-D296 PolarHBondContact ND2-OD2 3.22Å; N292-D296 WeakPolarHBondContact O-CB 3.36Å; N292-D296 PolarHBondContact O-N 3.37Å |
| 293 | S | 94.8 | Very high | 90.4 | Very high | 0 Ų | 0 | 24.9 Ų | 24.9 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -66.5 | -22.5 | -176.5 | -59.6 | 0 | 0 | 0 | 0 | 114.4 | N44 D72 L75 A290 L291 | N44-S293 PolarHBondContact ND2-O 2.99Å; D72-S293 WeakPolarHBondContact OD1-CA 3.33Å; D72-S293 WeakPolarHBondContact OD1-CB 3.39Å; D72-S293 PolarHBondContact OD1-OG 3.06Å; L75-S293 WeakPolarHBondContact CD2-OG 3.31Å; A290-S293 PolarHBondContact O-N 3.26Å; A290-S293 VanDerWaalsContact O-N 3.09Å; L291-S293 PolarHBondContact O-N 2.91Å |
| 294 | C | 93.2 | Very high | 89.9 | Confident | 14 Ų | 14 | 24.9 Ų | 24.9 | 10% | 0.095 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -97.4 | -17.3 | 172.7 | 66.5 | 0 | 0 | 0 | 0 | 114 | I36 L39 L291 N292 | I36-C294 HydrophobicContact CG2-CB 4.38Å; L39-C294 HydrophobicContact CB-CB 3.73Å; L291-C294 PolarHBondContact O-N 3.1Å; L291-C294 VanDerWaalsContact O-N 3.13Å; L291-C294 PolarHBondContact O-SG 3.17Å; N292-C294 VanDerWaalsContact C-N 3.26Å; N292-C294 PolarHBondContact O-N 3.28Å |
| 295 | L | 93.1 | Very high | 89.2 | Confident | 47 Ų | 47 | 24.8 Ų | 24.8 | 25% | 0.246 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -90.5 | -22.1 | 176.8 | -64.4 | 174.5 | 0 | 0 | 0 | 112.6 | L247 L291 N292 V298 M299 | L247-L295 HydrophobicContact CD1-CB 4.24Å; L247-L295 HydrophobicContact CD2-CB 4.17Å; L247-L295 HydrophobicContact CD2-CD1 3.91Å; L247-L295 HydrophobicContact CD2-CG 4.43Å; L291-L295 HydrophobicContact CB-CD1 4.08Å; L291-L295 WeakPolarHBondContact O-CB 3.46Å; L291-L295 VanDerWaalsContact O-CG 3.27Å; L291-L295 WeakPolarHBondContact O-CG 3.3Å; L291-L295 PolarHBondContact O-N 3.15Å; N292-L295 PolarHBondContact O-N 3.46Å; N292-L295 VanDerWaalsContact O-N 3.11Å; L295-V298 WeakPolarHBondContact O-CA 3.08Å; L295-V298 VanDerWaalsContact O-CB 3.26Å; L295-V298 WeakPolarHBondContact O-CB 3.2Å; L295-V298 PolarHBondContact O-N 2.89Å; L295-M299 PolarHBondContact O-N 3.44Å; L295-M299 VanDerWaalsContact O-N 3.11Å |
| 296 | D | 90.2 | Very high | 88.5 | Confident | 2 Ų | 2 | 25.1 Ų | 25.1 | 1% | 0.011 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -59.3 | -39.4 | 174.7 | -88.8 | -24.1 | 0 | 0 | 0 | 114 | L68 D72 N292 V298 M299 F300 | L68-D296 WeakPolarHBondContact CD2-OD2 3.45Å; L68-D296 WeakPolarHBondContact CG-OD2 3.18Å; D72-D296 VanDerWaalsContact OD2-OD2 3.09Å; N292-D296 PolarHBondContact ND2-OD2 3.22Å; N292-D296 WeakPolarHBondContact O-CB 3.36Å; N292-D296 PolarHBondContact O-N 3.37Å; D296-V298 PolarHBondContact O-N 2.91Å; D296-M299 CarbonylContact O-C 3.48Å; D296-M299 WeakPolarHBondContact O-CA 3.32Å; D296-M299 WeakPolarHBondContact O-CB 3.47Å; D296-M299 PolarHBondContact O-N 2.74Å; D296-F300 HydrophobicContact CB-CE1 4.12Å; D296-F300 HydrophobicContact CB-CE2 4.16Å; D296-F300 HydrophobicContact CB-CZ 3.76Å; D296-F300 VanDerWaalsContact O-CD1 3.24Å; D296-F300 WeakPolarHBondContact O-CD1 3.36Å; D296-F300 WeakPolarHBondContact O-CD2 3.31Å; D296-F300 WeakPolarHBondContact O-CG 3.33Å; D296-F300 PolarHBondContact O-N 2.89Å |
| 297 | P | 86.9 | Confident | 87.8 | Confident | 24 Ų | 24 | 25.2 Ų | 25.2 | 16% | 0.156 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -54.7 | -35.4 | 169.1 | -29.2 | 36.1 | 0 | 0 | 0 | 114.3 | F300 F301 | P297-F300 PolarHBondContact O-N 2.91Å; P297-F301 WeakPolarHBondContact O-CB 3.37Å; P297-F301 PolarHBondContact O-N 3.44Å |
| 298 | V | 86.3 | Confident | 87.4 | Confident | 64 Ų | 64 | 28.6 Ų | 28.6 | 39% | 0.388 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -68.1 | -44.4 | 174.1 | -175.8 | 0 | 0 | 0 | 0 | 110 | F243 L295 D296 F300 F301 L302 | F243-V298 HydrophobicContact CE1-CG1 3.98Å; F243-V298 HydrophobicContact CZ-CG1 3.92Å; L295-V298 WeakPolarHBondContact O-CA 3.08Å; L295-V298 VanDerWaalsContact O-CB 3.26Å; L295-V298 WeakPolarHBondContact O-CB 3.2Å; L295-V298 PolarHBondContact O-N 2.89Å; D296-V298 PolarHBondContact O-N 2.91Å; V298-F300 VanDerWaalsContact C-N 3.33Å; V298-F300 PolarHBondContact O-N 2.95Å; V298-F301 WeakPolarHBondContact O-CB 3.42Å; V298-F301 PolarHBondContact O-N 3.4Å; V298-L302 WeakPolarHBondContact O-CG 3.27Å; V298-L302 PolarHBondContact O-N 3.03Å |
| 299 | M | 85.8 | Confident | 86.7 | Confident | 2 Ų | 2 | 29.6 Ų | 29.6 | 1% | 0.01 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -58.5 | -43.4 | 172.3 | 173.3 | 174.5 | 170.7 | 0 | 0 | 111.5 | L117 I120 V244 L247 L295 D296 F301 L302 L303 | L117-M299 HydrophobicContact CD2-CE 3.54Å; L117-M299 HydrophobicContact CD2-SD 3.64Å; I120-M299 HydrophobicContact CD1-CE 4.22Å; I120-M299 HydrophobicContact CG2-CE 4.19Å; V244-M299 HydrophobicContact CB-SD 4.43Å; V244-M299 HydrophobicContact CG1-CE 3.68Å; V244-M299 HydrophobicContact CG1-SD 3.81Å; V244-M299 HydrophobicContact CG2-CE 3.91Å; V244-M299 HydrophobicContact CG2-CG 3.9Å; V244-M299 HydrophobicContact CG2-SD 3.85Å; L247-M299 HydrophobicContact CD1-CB 4.33Å; L295-M299 PolarHBondContact O-N 3.44Å; L295-M299 VanDerWaalsContact O-N 3.11Å; D296-M299 CarbonylContact O-C 3.48Å; D296-M299 WeakPolarHBondContact O-CA 3.32Å; D296-M299 WeakPolarHBondContact O-CB 3.47Å; D296-M299 PolarHBondContact O-N 2.74Å; M299-F301 PolarHBondContact O-N 2.98Å; M299-L302 PolarHBondContact O-N 3.5Å; M299-L302 VanDerWaalsContact O-N 3.1Å; M299-L303 HydrophobicContact CE-CD1 3.33Å; M299-L303 HydrophobicContact CG-CD1 3.52Å; M299-L303 HydrophobicContact CG-CG 4.1Å; M299-L303 WeakPolarHBondContact O-CB 3.38Å; M299-L303 VanDerWaalsContact O-CG 3.24Å; M299-L303 WeakPolarHBondContact O-CG 3.29Å; M299-L303 PolarHBondContact O-N 3.18Å; M299-L303 HydrophobicContact SD-CD1 4.22Å |
| 300 | F | 85.8 | Confident | 86.2 | Confident | 0 Ų | 0 | 29.8 Ų | 29.8 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.8 | -42.9 | 178.1 | -58.6 | -18.8 | 0 | 0 | 0 | 111.6 | N44 A47 F51 L65 L68 A69 D296 P297 V298 L302 L303 S304 V307 | N44-F300 WeakPolarHBondContact OD1-CE2 3.28Å; A47-F300 HydrophobicContact CB-CD2 3.42Å; A47-F300 VanDerWaalsContact CB-CD2 3.42Å; A47-F300 HydrophobicContact CB-CE2 3.93Å; A47-F300 HydrophobicContact CB-CG 4.39Å; F51-F300 HydrophobicContact CE2-CD2 4.47Å; F51-F300 HydrophobicContact CZ-CB 4.48Å; F51-F300 HydrophobicContact CZ-CG 4.39Å; L65-F300 HydrophobicContact CB-CE1 4.33Å; L65-F300 HydrophobicContact CD2-CD1 3.73Å; L65-F300 HydrophobicContact CD2-CE1 3.64Å; L68-F300 HydrophobicContact CB-CZ 4.42Å; L68-F300 HydrophobicContact CD2-CE1 3.97Å; L68-F300 HydrophobicContact CD2-CZ 4.22Å; L68-F300 HydrophobicContact CG-CE1 4.45Å; L68-F300 HydrophobicContact CG-CZ 4.21Å; A69-F300 HydrophobicContact CB-CE2 3.81Å; A69-F300 HydrophobicContact CB-CZ 4.09Å; D296-F300 HydrophobicContact CB-CE1 4.12Å; D296-F300 HydrophobicContact CB-CE2 4.16Å; D296-F300 HydrophobicContact CB-CZ 3.76Å; D296-F300 VanDerWaalsContact O-CD1 3.24Å; D296-F300 WeakPolarHBondContact O-CD1 3.36Å; D296-F300 WeakPolarHBondContact O-CD2 3.31Å; D296-F300 WeakPolarHBondContact O-CG 3.33Å; D296-F300 PolarHBondContact O-N 2.89Å; P297-F300 PolarHBondContact O-N 2.91Å; V298-F300 VanDerWaalsContact C-N 3.33Å; V298-F300 PolarHBondContact O-N 2.95Å; F300-L302 VanDerWaalsContact C-N 3.3Å; F300-L302 PolarHBondContact O-N 3.38Å; F300-L303 PolarHBondContact O-N 2.91Å; F300-S304 WeakPolarHBondContact O-CA 3.45Å; F300-S304 VanDerWaalsContact O-CB 3.26Å; F300-S304 WeakPolarHBondContact O-CB 3.42Å; F300-S304 PolarHBondContact O-N 3.32Å; F300-V307 HydrophobicContact CB-CG1 4.21Å; F300-V307 HydrophobicContact CB-CG2 4.37Å |
| 301 | F | 82.3 | Confident | 85.5 | Confident | 78 Ų | 78 | 31.7 Ų | 31.7 | 34% | 0.342 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -58.7 | -42.1 | 172.5 | -176.8 | -90.8 | 0 | 0 | 0 | 111.2 | P297 V298 M299 R308 V311 | P297-F301 WeakPolarHBondContact O-CB 3.37Å; P297-F301 PolarHBondContact O-N 3.44Å; V298-F301 WeakPolarHBondContact O-CB 3.42Å; V298-F301 PolarHBondContact O-N 3.4Å; M299-F301 PolarHBondContact O-N 2.98Å; F301-R308 HydrophobicContact CD1-CG 4.1Å; F301-R308 HydrophobicContact CD2-CB 4.24Å; F301-R308 HydrophobicContact CD2-CG 3.61Å; F301-R308 HydrophobicContact CE1-CG 4.14Å; F301-R308 HydrophobicContact CE2-CB 4.04Å; F301-R308 HydrophobicContact CE2-CG 3.67Å; F301-R308 HydrophobicContact CG-CG 3.83Å; F301-R308 HydrophobicContact CZ-CG 3.94Å; F301-R308 WeakPolarHBondContact O-CD 3.38Å; F301-R308 WeakPolarHBondContact O-CG 3.45Å; F301-V311 HydrophobicContact CD2-CB 4.15Å; F301-V311 HydrophobicContact CD2-CG1 4.18Å; F301-V311 HydrophobicContact CD2-CG2 4.25Å; F301-V311 HydrophobicContact CE2-CB 4.21Å; F301-V311 HydrophobicContact CE2-CG1 4.07Å |
| 302 | L | 80.1 | Confident | 85 | Confident | 46 Ų | 46 | 36 Ų | 36 | 24% | 0.241 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -69.6 | -36.6 | 178 | -67.3 | 174.7 | 0 | 0 | 0 | 113 | K240 F243 V298 M299 F300 | K240-L302 WeakPolarHBondContact CD-O 3.47Å; K240-L302 WeakPolarHBondContact CE-O 3.3Å; K240-L302 HydrophobicContact CG-CB 4.46Å; K240-L302 PolarHBondContact NZ-O 3.44Å; F243-L302 HydrophobicContact CD1-CD1 3.17Å; F243-L302 HydrophobicContact CE1-CD1 3.32Å; F243-L302 HydrophobicContact CG-CD1 3.88Å; F243-L302 HydrophobicContact CZ-CD1 4.16Å; V298-L302 WeakPolarHBondContact O-CG 3.27Å; V298-L302 PolarHBondContact O-N 3.03Å; M299-L302 PolarHBondContact O-N 3.5Å; M299-L302 VanDerWaalsContact O-N 3.1Å; F300-L302 VanDerWaalsContact C-N 3.3Å; F300-L302 PolarHBondContact O-N 3.38Å |
| 303 | L | 77.1 | Confident | 84.6 | Confident | 27 Ų | 27 | 41.3 Ų | 41.3 | 14% | 0.141 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -94.3 | -25.1 | -170.8 | -61.9 | -176.4 | 0 | 0 | 0 | 114.4 | K240 V244 M299 F300 | K240-L303 HydrophobicContact CB-CD2 4.31Å; K240-L303 HydrophobicContact CD-CD2 4.48Å; V244-L303 HydrophobicContact CG2-CD1 4.19Å; M299-L303 HydrophobicContact CE-CD1 3.33Å; M299-L303 HydrophobicContact CG-CD1 3.52Å; M299-L303 HydrophobicContact CG-CG 4.1Å; M299-L303 WeakPolarHBondContact O-CB 3.38Å; M299-L303 VanDerWaalsContact O-CG 3.24Å; M299-L303 WeakPolarHBondContact O-CG 3.29Å; M299-L303 PolarHBondContact O-N 3.18Å; M299-L303 HydrophobicContact SD-CD1 4.22Å; F300-L303 PolarHBondContact O-N 2.91Å |
| 304 | S | 79.1 | Confident | 84 | Confident | 10 Ų | 10 | 47.3 Ų | 47.3 | 7% | 0.07 | 23% | 0.23 | C | C | . | . | trans | -115.4 | 119.1 | -174.1 | -179.6 | 0 | 0 | 0 | 0 | 112.2 | F300 S306 V307 R308 | F300-S304 WeakPolarHBondContact O-CA 3.45Å; F300-S304 VanDerWaalsContact O-CB 3.26Å; F300-S304 WeakPolarHBondContact O-CB 3.42Å; F300-S304 PolarHBondContact O-N 3.32Å; S304-S306 VanDerWaalsContact C-N 3.3Å; S304-S306 PolarHBondContact O-N 2.95Å; S304-S306 PolarHBondContact OG-N 3.45Å; S304-V307 PolarHBondContact OG-N 2.67Å; S304-R308 WeakPolarHBondContact O-CG 3.27Å; S304-R308 PolarHBondContact O-N 3.38Å | ||
| 305 | A | 78.6 | Confident | 83.6 | Confident | 60 Ų | 60 | 51.8 Ų | 51.8 | 50% | 0.496 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -65.9 | -33.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | R308 K309 | A305-R308 PolarHBondContact O-N 2.85Å; A305-K309 PolarHBondContact O-N 3.38Å |
| 306 | S | 77.7 | Confident | 83.2 | Confident | 18 Ų | 18 | 52.3 Ų | 52.3 | 13% | 0.126 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -66.2 | -47.4 | 177.7 | -64.4 | 0 | 0 | 0 | 0 | 111.3 | H55 S304 R308 K309 E310 | H55-S306 PolarHBondContact ND1-OG 3.4Å; S304-S306 VanDerWaalsContact C-N 3.3Å; S304-S306 PolarHBondContact O-N 2.95Å; S304-S306 PolarHBondContact OG-N 3.45Å; S306-R308 VanDerWaalsContact C-N 3.31Å; S306-R308 PolarHBondContact O-N 2.88Å; S306-K309 WeakPolarHBondContact O-CB 3.44Å; S306-K309 PolarHBondContact O-N 2.83Å; S306-E310 PolarHBondContact O-N 2.78Å |
| 307 | V | 79.4 | Confident | 82.9 | Confident | 4 Ų | 4 | 54.8 Ų | 54.8 | 2% | 0.024 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -59.2 | -44 | 175.7 | 175.1 | 0 | 0 | 0 | 0 | 110.4 | A50 F51 F300 S304 K309 E310 V311 | A50-V307 HydrophobicContact CB-CG2 4.07Å; F51-V307 HydrophobicContact CD1-CG2 4.31Å; F51-V307 HydrophobicContact CE1-CG2 3.67Å; F51-V307 HydrophobicContact CE2-CG2 4.42Å; F51-V307 HydrophobicContact CZ-CG2 3.71Å; F300-V307 HydrophobicContact CB-CG1 4.21Å; F300-V307 HydrophobicContact CB-CG2 4.37Å; S304-V307 PolarHBondContact OG-N 2.67Å; V307-K309 VanDerWaalsContact C-N 3.27Å; V307-K309 PolarHBondContact O-N 3.16Å; V307-E310 PolarHBondContact O-N 3Å; V307-V311 HydrophobicContact CG1-CG2 4.13Å; V307-V311 WeakPolarHBondContact O-CG2 3.43Å; V307-V311 PolarHBondContact O-N 3.2Å |
| 308 | R | 85.8 | Confident | 82.6 | Confident | 81 Ų | 81 | 56.1 Ų | 56.1 | 31% | 0.306 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -58 | -37.7 | 174.5 | -70.9 | -173 | -74.1 | 160 | 4.7 | 113.6 | F301 S304 A305 S306 R312 | F301-R308 HydrophobicContact CD1-CG 4.1Å; F301-R308 HydrophobicContact CD2-CB 4.24Å; F301-R308 HydrophobicContact CD2-CG 3.61Å; F301-R308 HydrophobicContact CE1-CG 4.14Å; F301-R308 HydrophobicContact CE2-CB 4.04Å; F301-R308 HydrophobicContact CE2-CG 3.67Å; F301-R308 HydrophobicContact CG-CG 3.83Å; F301-R308 HydrophobicContact CZ-CG 3.94Å; F301-R308 WeakPolarHBondContact O-CD 3.38Å; F301-R308 WeakPolarHBondContact O-CG 3.45Å; S304-R308 WeakPolarHBondContact O-CG 3.27Å; S304-R308 PolarHBondContact O-N 3.38Å; A305-R308 PolarHBondContact O-N 2.85Å; S306-R308 VanDerWaalsContact C-N 3.31Å; S306-R308 PolarHBondContact O-N 2.88Å; R308-R312 WeakPolarHBondContact O-CB 3.33Å; R308-R312 WeakPolarHBondContact O-CG 3.24Å; R308-R312 PolarHBondContact O-N 2.69Å; R308-R312 VanDerWaalsContact O-N 3.16Å; R308-R312 PolarHBondContact O-NH1 2.89Å |
| 309 | K | 83.4 | Confident | 82.2 | Confident | 97 Ų | 97 | 58.3 Ų | 58.3 | 42% | 0.422 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -66.4 | -44.3 | 178.7 | -172 | -174.5 | -176.3 | -172.7 | 0 | 110.5 | A305 S306 V307 R312 R313 | A305-K309 PolarHBondContact O-N 3.38Å; S306-K309 WeakPolarHBondContact O-CB 3.44Å; S306-K309 PolarHBondContact O-N 2.83Å; V307-K309 VanDerWaalsContact C-N 3.27Å; V307-K309 PolarHBondContact O-N 3.16Å; K309-R312 PolarHBondContact O-N 3.39Å; K309-R313 VanDerWaalsContact CE-NH2 3.26Å; K309-R313 WeakPolarHBondContact O-CG 3.39Å; K309-R313 PolarHBondContact O-N 3.28Å |
| 310 | E | 83.1 | Confident | 81.7 | Confident | 6 Ų | 6 | 67.5 Ų | 67.5 | 3% | 0.028 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -71.8 | -41.7 | -179.4 | -63 | -38.6 | 125.9 | 0 | 0 | 113.4 | W49 A50 V54 S306 V307 R312 R313 F314 | W49-E310 HydrophobicContact CE3-CB 4.35Å; W49-E310 HydrophobicContact CE3-CG 4.09Å; W49-E310 HydrophobicContact CH2-CG 4.33Å; W49-E310 WeakPolarHBondContact CH2-OE2 3.44Å; W49-E310 HydrophobicContact CZ3-CB 3.81Å; W49-E310 HydrophobicContact CZ3-CG 3.45Å; W49-E310 VanDerWaalsContact CZ3-CG 3.45Å; W49-E310 WeakPolarHBondContact CZ3-OE2 3.34Å; A50-E310 HydrophobicContact CB-CB 4.15Å; A50-E310 HydrophobicContact CB-CG 3.76Å; V54-E310 HydrophobicContact CB-CG 4.36Å; V54-E310 HydrophobicContact CG1-CG 4.34Å; V54-E310 VanDerWaalsContact CG1-OE1 3.31Å; V54-E310 WeakPolarHBondContact CG1-OE1 3.14Å; V54-E310 HydrophobicContact CG2-CG 3.72Å; S306-E310 PolarHBondContact O-N 2.78Å; V307-E310 PolarHBondContact O-N 3Å; E310-R312 VanDerWaalsContact C-N 3.27Å; E310-R312 PolarHBondContact O-N 2.86Å; E310-R313 VanDerWaalsContact CD-NH1 3.25Å; E310-R313 WeakPolarHBondContact O-CB 3.48Å; E310-R313 PolarHBondContact O-N 2.89Å; E310-R313 VanDerWaalsContact O-N 3.1Å; E310-R313 IonicContact OE1-CZ 3.46Å; E310-R313 IonicContact OE1-NE 3.81Å; E310-R313 IonicContact OE1-NH1 2.7Å; E310-R313 PolarHBondContact OE1-NH1 2.97Å; E310-R313 WeakPolarHBondContact OE2-CD 3.36Å; E310-R313 IonicContact OE2-CZ 3.86Å; E310-R313 IonicContact OE2-NE 3.9Å; E310-R313 IonicContact OE2-NH1 3.01Å; E310-R313 PolarHBondContact OE2-NH1 2.96Å; E310-F314 WeakPolarHBondContact O-CB 3.2Å; E310-F314 PolarHBondContact O-N 3.01Å |
| 311 | V | 82.6 | Confident | 81 | Confident | 39 Ų | 39 | 71.7 Ų | 71.7 | 24% | 0.236 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -58 | -43.4 | 172.8 | 172.1 | 0 | 0 | 0 | 0 | 110.5 | V46 F301 V307 R313 F314 M315 | V46-V311 HydrophobicContact CG1-CG2 4.26Å; F301-V311 HydrophobicContact CD2-CB 4.15Å; F301-V311 HydrophobicContact CD2-CG1 4.18Å; F301-V311 HydrophobicContact CD2-CG2 4.25Å; F301-V311 HydrophobicContact CE2-CB 4.21Å; F301-V311 HydrophobicContact CE2-CG1 4.07Å; V307-V311 HydrophobicContact CG1-CG2 4.13Å; V307-V311 WeakPolarHBondContact O-CG2 3.43Å; V307-V311 PolarHBondContact O-N 3.2Å; V311-R313 PolarHBondContact O-N 3.41Å; V311-F314 PolarHBondContact O-N 2.9Å; V311-M315 HydrophobicContact CG1-CG 4.48Å; V311-M315 HydrophobicContact CG1-SD 4.18Å; V311-M315 WeakPolarHBondContact O-CB 3.24Å; V311-M315 VanDerWaalsContact O-CG 3.3Å; V311-M315 WeakPolarHBondContact O-CG 3.36Å; V311-M315 PolarHBondContact O-N 2.96Å |
| 312 | R | 85.5 | Confident | 80.1 | Confident | 134 Ų | 134 | 76.8 Ų | 76.8 | 51% | 0.506 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -63.5 | -40.1 | 175 | -78.8 | -169.1 | -62.7 | -88.5 | -3.1 | 113 | R308 K309 E310 M315 S316 | R308-R312 WeakPolarHBondContact O-CB 3.33Å; R308-R312 WeakPolarHBondContact O-CG 3.24Å; R308-R312 PolarHBondContact O-N 2.69Å; R308-R312 VanDerWaalsContact O-N 3.16Å; R308-R312 PolarHBondContact O-NH1 2.89Å; K309-R312 PolarHBondContact O-N 3.39Å; E310-R312 VanDerWaalsContact C-N 3.27Å; E310-R312 PolarHBondContact O-N 2.86Å; R312-M315 PolarHBondContact O-N 3.48Å; R312-S316 WeakPolarHBondContact O-CB 3.4Å; R312-S316 PolarHBondContact O-N 3.3Å; R312-S316 PolarHBondContact O-OG 3.26Å |
| 313 | R | 84.9 | Confident | 79.2 | Confident | 114 Ų | 114 | 82.9 Ų | 82.9 | 43% | 0.43 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -62.3 | -48.3 | 175.7 | -77.9 | 165.3 | 168.7 | -170.2 | -8.4 | 111 | K309 E310 V311 M315 S316 S317 | K309-R313 VanDerWaalsContact CE-NH2 3.26Å; K309-R313 WeakPolarHBondContact O-CG 3.39Å; K309-R313 PolarHBondContact O-N 3.28Å; E310-R313 VanDerWaalsContact CD-NH1 3.25Å; E310-R313 WeakPolarHBondContact O-CB 3.48Å; E310-R313 PolarHBondContact O-N 2.89Å; E310-R313 VanDerWaalsContact O-N 3.1Å; E310-R313 IonicContact OE1-CZ 3.46Å; E310-R313 IonicContact OE1-NE 3.81Å; E310-R313 IonicContact OE1-NH1 2.7Å; E310-R313 PolarHBondContact OE1-NH1 2.97Å; E310-R313 WeakPolarHBondContact OE2-CD 3.36Å; E310-R313 IonicContact OE2-CZ 3.86Å; E310-R313 IonicContact OE2-NE 3.9Å; E310-R313 IonicContact OE2-NH1 3.01Å; E310-R313 PolarHBondContact OE2-NH1 2.96Å; V311-R313 PolarHBondContact O-N 3.41Å; R313-M315 PolarHBondContact O-N 2.99Å; R313-S316 WeakPolarHBondContact CA-OG 3.32Å; R313-S316 PolarHBondContact O-N 3.35Å; R313-S316 VanDerWaalsContact O-N 3.14Å; R313-S316 PolarHBondContact O-OG 3.31Å; R313-S317 PolarHBondContact O-N 3.5Å; R313-S317 PolarHBondContact O-OG 3.09Å |
| 314 | F | 83.2 | Confident | 78.5 | Confident | 127 Ų | 127 | 85.9 Ų | 85.9 | 56% | 0.557 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -59.7 | -46 | 177.1 | -175.3 | -98.4 | 0 | 0 | 0 | 111.8 | E310 V311 S316 S317 V318 | E310-F314 WeakPolarHBondContact O-CB 3.2Å; E310-F314 PolarHBondContact O-N 3.01Å; V311-F314 PolarHBondContact O-N 2.9Å; F314-S316 VanDerWaalsContact C-N 3.32Å; F314-S316 PolarHBondContact O-N 3Å; F314-S317 WeakPolarHBondContact CA-OG 3.28Å; F314-S317 PolarHBondContact O-N 2.93Å; F314-S317 PolarHBondContact O-OG 3.09Å; F314-V318 HydrophobicContact CD1-CG2 4.26Å; F314-V318 HydrophobicContact CE1-CG2 3.9Å; F314-V318 HydrophobicContact CE2-CG2 4.46Å; F314-V318 HydrophobicContact CZ-CG2 4.01Å; F314-V318 VanDerWaalsContact O-CG2 3.3Å; F314-V318 WeakPolarHBondContact O-CG2 3.39Å; F314-V318 PolarHBondContact O-N 2.98Å |
| 315 | M | 84.3 | Confident | 77.5 | Confident | 108 Ų | 108 | 89.3 Ų | 89.3 | 53% | 0.532 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -60 | -43.4 | 174.1 | -72.8 | 180 | 66.8 | 0 | 0 | 111.7 | V311 R312 R313 V318 L319 | V311-M315 HydrophobicContact CG1-CG 4.48Å; V311-M315 HydrophobicContact CG1-SD 4.18Å; V311-M315 WeakPolarHBondContact O-CB 3.24Å; V311-M315 VanDerWaalsContact O-CG 3.3Å; V311-M315 WeakPolarHBondContact O-CG 3.36Å; V311-M315 PolarHBondContact O-N 2.96Å; R312-M315 PolarHBondContact O-N 3.48Å; R313-M315 PolarHBondContact O-N 2.99Å; M315-V318 PolarHBondContact O-N 3.45Å; M315-L319 WeakPolarHBondContact O-CB 3.33Å; M315-L319 WeakPolarHBondContact O-CD1 3.43Å; M315-L319 WeakPolarHBondContact O-CG 3.4Å; M315-L319 PolarHBondContact O-N 2.93Å |
| 316 | S | 85.6 | Confident | 76.4 | Confident | 57 Ų | 57 | 88.4 Ų | 88.4 | 40% | 0.399 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -67 | -35.2 | 179.4 | 72.3 | 0 | 0 | 0 | 0 | 113.1 | R312 R313 F314 R320 | R312-S316 WeakPolarHBondContact O-CB 3.4Å; R312-S316 PolarHBondContact O-N 3.3Å; R312-S316 PolarHBondContact O-OG 3.26Å; R313-S316 WeakPolarHBondContact CA-OG 3.32Å; R313-S316 PolarHBondContact O-N 3.35Å; R313-S316 VanDerWaalsContact O-N 3.14Å; R313-S316 PolarHBondContact O-OG 3.31Å; F314-S316 VanDerWaalsContact C-N 3.32Å; F314-S316 PolarHBondContact O-N 3Å; S316-R320 WeakPolarHBondContact O-CB 3.28Å; S316-R320 WeakPolarHBondContact O-CG 3.48Å; S316-R320 PolarHBondContact O-N 3.06Å |
| 317 | S | 83.3 | Confident | 75.3 | Confident | 54 Ų | 54 | 89.9 Ų | 89.9 | 38% | 0.378 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -69.9 | -43.3 | 174.8 | 56 | 0 | 0 | 0 | 0 | 110.9 | R313 F314 L319 R320 T321 | R313-S317 PolarHBondContact O-N 3.5Å; R313-S317 PolarHBondContact O-OG 3.09Å; F314-S317 WeakPolarHBondContact CA-OG 3.28Å; F314-S317 PolarHBondContact O-N 2.93Å; F314-S317 PolarHBondContact O-OG 3.09Å; S317-L319 PolarHBondContact O-N 3.48Å; S317-R320 PolarHBondContact O-N 3.37Å; S317-T321 PolarHBondContact O-N 3.44Å; S317-T321 PolarHBondContact O-OG1 3.34Å |
| 318 | V | 80.8 | Confident | 73.9 | Confident | 52 Ų | 52 | 93 Ų | 93 | 32% | 0.315 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -61.9 | -43.3 | 175.7 | 172.3 | 0 | 0 | 0 | 0 | 111.3 | F314 M315 T321 R322 | F314-V318 HydrophobicContact CD1-CG2 4.26Å; F314-V318 HydrophobicContact CE1-CG2 3.9Å; F314-V318 HydrophobicContact CE2-CG2 4.46Å; F314-V318 HydrophobicContact CZ-CG2 4.01Å; F314-V318 VanDerWaalsContact O-CG2 3.3Å; F314-V318 WeakPolarHBondContact O-CG2 3.39Å; F314-V318 PolarHBondContact O-N 2.98Å; M315-V318 PolarHBondContact O-N 3.45Å; V318-T321 PolarHBondContact O-N 2.89Å; V318-R322 WeakPolarHBondContact O-CG 3.45Å; V318-R322 PolarHBondContact O-N 3.5Å |
| 319 | L | 78.7 | Confident | 72.3 | Confident | 111 Ų | 111 | 93.8 Ų | 93.8 | 58% | 0.581 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -63.2 | -40.8 | 175.2 | -78.2 | 158.6 | 0 | 0 | 0 | 112 | M315 S317 R322 Y323 | M315-L319 WeakPolarHBondContact O-CB 3.33Å; M315-L319 WeakPolarHBondContact O-CD1 3.43Å; M315-L319 WeakPolarHBondContact O-CG 3.4Å; M315-L319 PolarHBondContact O-N 2.93Å; S317-L319 PolarHBondContact O-N 3.48Å; L319-R322 PolarHBondContact O-N 3.34Å; L319-Y323 PolarHBondContact O-N 3.43Å |
| 320 | R | 75.4 | Confident | 70.8 | Confident | 194 Ų | 194 | 91.5 Ų | 91.5 | 73% | 0.732 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -64.6 | -44.1 | 174.7 | -80.6 | -178.2 | -176.1 | -143.6 | 0.1 | 112.2 | S316 S317 R322 Y323 V324 | S316-R320 WeakPolarHBondContact O-CB 3.28Å; S316-R320 WeakPolarHBondContact O-CG 3.48Å; S316-R320 PolarHBondContact O-N 3.06Å; S317-R320 PolarHBondContact O-N 3.37Å; R320-R322 VanDerWaalsContact C-N 3.32Å; R320-R322 PolarHBondContact O-N 3.1Å; R320-Y323 PolarHBondContact O-N 2.65Å; R320-V324 WeakPolarHBondContact O-CG2 3.33Å; R320-V324 PolarHBondContact O-N 3.09Å |
| 321 | T | 69.4 | Low | 69.3 | Low | 88 Ų | 88 | 96 Ų | 96 | 54% | 0.54 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.5 | -43.5 | 175.3 | -53.3 | 0 | 0 | 0 | 0 | 110.5 | S317 V318 Y323 V324 T325 | S317-T321 PolarHBondContact O-N 3.44Å; S317-T321 PolarHBondContact O-OG1 3.34Å; V318-T321 PolarHBondContact O-N 2.89Å; T321-Y323 PolarHBondContact O-N 3.45Å; T321-V324 PolarHBondContact O-N 3.09Å; T321-T325 PolarHBondContact O-N 3.1Å; T321-T325 PolarHBondContact O-OG1 3.28Å |
| 322 | R | 64.2 | Low | 67.8 | Low | 186 Ų | 186 | 97.5 Ų | 97.5 | 70% | 0.702 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.5 | -37 | 175.3 | -74 | -176.6 | 179.6 | -166.5 | -0.4 | 113.4 | V318 L319 R320 G326 | V318-R322 WeakPolarHBondContact O-CG 3.45Å; V318-R322 PolarHBondContact O-N 3.5Å; L319-R322 PolarHBondContact O-N 3.34Å; R320-R322 VanDerWaalsContact C-N 3.32Å; R320-R322 PolarHBondContact O-N 3.1Å; R322-G326 PolarHBondContact O-N 3.26Å |
| 323 | Y | 61.1 | Low | 66.2 | Low | 174 Ų | 174 | 94.5 Ų | 94.5 | 68% | 0.682 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -66.1 | -43.1 | 175.5 | -175.2 | -98.8 | 0 | 0 | 0 | 111.9 | L319 R320 T321 G326 T327 | L319-Y323 PolarHBondContact O-N 3.43Å; R320-Y323 PolarHBondContact O-N 2.65Å; T321-Y323 PolarHBondContact O-N 3.45Å; Y323-G326 PolarHBondContact O-N 3.31Å; Y323-T327 HydrophobicContact CE1-CG2 4.23Å; Y323-T327 PolarHBondContact O-N 3.34Å; Y323-T327 PolarHBondContact O-OG1 3.36Å |
| 324 | V | 61.8 | Low | 64.6 | Low | 89 Ų | 89 | 93.3 Ų | 93.3 | 54% | 0.539 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.6 | -43 | 176.7 | 174.3 | 0 | 0 | 0 | 0 | 111.4 | R320 T321 T327 S328 | R320-V324 WeakPolarHBondContact O-CG2 3.33Å; R320-V324 PolarHBondContact O-N 3.09Å; T321-V324 PolarHBondContact O-N 3.09Å; V324-T327 WeakPolarHBondContact CA-OG1 3.39Å; V324-T327 PolarHBondContact O-N 3.38Å; V324-T327 PolarHBondContact O-OG1 3.07Å; V324-S328 PolarHBondContact O-N 3.35Å |
| 325 | T | 59.2 | Low | 63.1 | Low | 82 Ų | 82 | 93.9 Ų | 93.9 | 50% | 0.503 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.4 | -36.8 | 176.5 | -45.2 | 0 | 0 | 0 | 0 | 111.9 | T321 V329 | T321-T325 PolarHBondContact O-N 3.1Å; T321-T325 PolarHBondContact O-OG1 3.28Å; T325-V329 WeakPolarHBondContact O-CG2 3.24Å; T325-V329 PolarHBondContact O-N 2.87Å; T325-V329 VanDerWaalsContact O-N 3.1Å |
| 326 | G | 54.8 | Low | 61.5 | Low | 42 Ų | 42 | 95 Ų | 95 | 43% | 0.433 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -68.6 | -36.5 | 176 | 0 | 0 | 0 | 0 | 0 | 113.8 | R322 Y323 A330 | R322-G326 PolarHBondContact O-N 3.26Å; Y323-G326 PolarHBondContact O-N 3.31Å; G326-A330 WeakPolarHBondContact O-CB 3.34Å; G326-A330 PolarHBondContact O-N 3.31Å; G326-A330 VanDerWaalsContact O-N 3.09Å |
| 327 | T | 54.3 | Low | 59.8 | Low | 49 Ų | 49 | 97.7 Ų | 97.7 | 30% | 0.301 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -73.9 | -36.2 | 174.2 | 37.2 | 0 | 0 | 0 | 0 | 112.4 | Y323 V324 A330 N331 | Y323-T327 HydrophobicContact CE1-CG2 4.23Å; Y323-T327 PolarHBondContact O-N 3.34Å; Y323-T327 PolarHBondContact O-OG1 3.36Å; V324-T327 WeakPolarHBondContact CA-OG1 3.39Å; V324-T327 PolarHBondContact O-N 3.38Å; V324-T327 PolarHBondContact O-OG1 3.07Å; T327-A330 PolarHBondContact O-N 3.25Å; T327-N331 VanDerWaalsContact O-CB 3.28Å; T327-N331 WeakPolarHBondContact O-CB 3.32Å; T327-N331 PolarHBondContact O-N 3.47Å; T327-N331 PolarHBondContact O-OD1 3.33Å |
| 328 | S | 50.2 | Low | 58.3 | Low | 69 Ų | 69 | 98 Ų | 98 | 48% | 0.483 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.8 | -39.7 | 172 | -87 | 0 | 0 | 0 | 0 | 112.9 | V324 S332 | V324-S328 PolarHBondContact O-N 3.35Å; S328-S332 WeakPolarHBondContact O-CB 3.35Å; S328-S332 PolarHBondContact O-N 3.33Å; S328-S332 VanDerWaalsContact O-N 3.09Å; S328-S332 PolarHBondContact O-OG 3.36Å |
| 329 | V | 52.8 | Low | 56.9 | Low | 98 Ų | 98 | 104.8 Ų | 104.8 | 59% | 0.594 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -70 | -40.3 | 176.8 | 174.6 | 0 | 0 | 0 | 0 | 111.4 | T325 S332 S333 | T325-V329 WeakPolarHBondContact O-CG2 3.24Å; T325-V329 PolarHBondContact O-N 2.87Å; T325-V329 VanDerWaalsContact O-N 3.1Å; V329-S332 PolarHBondContact O-N 2.99Å; V329-S333 PolarHBondContact O-N 3.17Å; V329-S333 PolarHBondContact O-OG 3.29Å; V329-S333 VanDerWaalsContact O-OG 3.09Å |
| 330 | A | 51.9 | Low | 55.6 | Low | 48 Ų | 48 | 102.2 Ų | 102.2 | 40% | 0.397 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -69.2 | -34.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | G326 T327 S333 T334 | G326-A330 WeakPolarHBondContact O-CB 3.34Å; G326-A330 PolarHBondContact O-N 3.31Å; G326-A330 VanDerWaalsContact O-N 3.09Å; T327-A330 PolarHBondContact O-N 3.25Å; A330-S333 PolarHBondContact O-OG 3.4Å; A330-T334 PolarHBondContact O-N 2.73Å; A330-T334 PolarHBondContact O-OG1 3.25Å |
| 331 | N | 50.9 | Low | 54.5 | Low | 102 Ų | 102 | 98 Ų | 98 | 55% | 0.545 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -74 | -30.4 | 175.6 | -73 | 3.5 | 0 | 0 | 0 | 112 | T327 T334 E335 | T327-N331 VanDerWaalsContact O-CB 3.28Å; T327-N331 WeakPolarHBondContact O-CB 3.32Å; T327-N331 PolarHBondContact O-N 3.47Å; T327-N331 PolarHBondContact O-OD1 3.33Å; N331-T334 WeakPolarHBondContact CA-OG1 3.49Å; N331-T334 PolarHBondContact O-OG1 2.78Å; N331-E335 WeakPolarHBondContact O-CB 3.41Å; N331-E335 WeakPolarHBondContact O-CG 3.38Å; N331-E335 PolarHBondContact O-N 3.32Å |
| 332 | S | 52.7 | Low | 53.7 | Low | 69 Ų | 69 | 101 Ų | 101 | 48% | 0.483 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -70.6 | -36 | 177.8 | -56.8 | 0 | 0 | 0 | 0 | 112.4 | S328 V329 L336 | S328-S332 WeakPolarHBondContact O-CB 3.35Å; S328-S332 PolarHBondContact O-N 3.33Å; S328-S332 VanDerWaalsContact O-N 3.09Å; S328-S332 PolarHBondContact O-OG 3.36Å; V329-S332 PolarHBondContact O-N 2.99Å; S332-L336 PolarHBondContact O-N 3.09Å |
| 333 | S | 51.7 | Low | 53 | Low | 72 Ų | 72 | 102.2 Ų | 102.2 | 50% | 0.503 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -75.9 | -30 | 176.5 | 41 | 0 | 0 | 0 | 0 | 113.2 | V329 A330 | V329-S333 PolarHBondContact O-N 3.17Å; V329-S333 PolarHBondContact O-OG 3.29Å; V329-S333 VanDerWaalsContact O-OG 3.09Å; A330-S333 PolarHBondContact O-OG 3.4Å |
| 334 | T | 51.1 | Low | 52.6 | Low | 89 Ų | 89 | 100.2 Ų | 100.2 | 55% | 0.546 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -79.1 | -28 | 173.2 | 38.3 | 0 | 0 | 0 | 0 | 113.3 | A330 N331 S338 | A330-T334 PolarHBondContact O-N 2.73Å; A330-T334 PolarHBondContact O-OG1 3.25Å; N331-T334 WeakPolarHBondContact CA-OG1 3.49Å; N331-T334 PolarHBondContact O-OG1 2.78Å; T334-S338 WeakPolarHBondContact O-CB 3.41Å; T334-S338 PolarHBondContact O-N 3.42Å; T334-S338 PolarHBondContact O-OG 2.81Å |
| 335 | E | 50.9 | Low | 52.1 | Low | 139 Ų | 139 | 99 Ų | 99 | 65% | 0.65 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -71.6 | -29.8 | 171.6 | -83.5 | -157.6 | 151.3 | 0 | 0 | 113.7 | N331 S338 R339 | N331-E335 WeakPolarHBondContact O-CB 3.41Å; N331-E335 WeakPolarHBondContact O-CG 3.38Å; N331-E335 PolarHBondContact O-N 3.32Å; E335-S338 WeakPolarHBondContact CA-OG 3.43Å; E335-S338 PolarHBondContact O-OG 3.16Å; E335-R339 WeakPolarHBondContact O-CB 3.46Å; E335-R339 PolarHBondContact O-N 3.25Å |
| 336 | L | 50.8 | Low | 51.6 | Low | 130 Ų | 130 | 100 Ų | 100 | 68% | 0.681 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -69.6 | -42 | 175.1 | -83.2 | 158.8 | 0 | 0 | 0 | 111.8 | S332 R339 S340 | S332-L336 PolarHBondContact O-N 3.09Å; L336-R339 PolarHBondContact O-N 3.39Å; L336-S340 PolarHBondContact O-N 3.19Å; L336-S340 PolarHBondContact O-OG 3.33Å |
| 337 | D | 49.8 | Very low | 51.4 | Low | 114 Ų | 114 | 100.8 Ų | 100.8 | 61% | 0.61 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -70.5 | -39 | -179.7 | -133.4 | 6.9 | 0 | 0 | 0 | 112.1 | R339 S340 D341 | D337-R339 VanDerWaalsContact C-N 3.32Å; D337-R339 PolarHBondContact O-N 3.17Å; D337-S340 WeakPolarHBondContact CA-OG 3.4Å; D337-S340 PolarHBondContact O-N 3.49Å; D337-S340 PolarHBondContact O-OG 3.48Å; D337-D341 PolarHBondContact O-N 3.23Å |
| 338 | S | 52 | Low | 51.2 | Low | 61 Ų | 61 | 104.3 Ų | 104.3 | 43% | 0.427 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -73.1 | -20.5 | 176.4 | 56 | 0 | 0 | 0 | 0 | 113.9 | T334 E335 K342 | T334-S338 WeakPolarHBondContact O-CB 3.41Å; T334-S338 PolarHBondContact O-N 3.42Å; T334-S338 PolarHBondContact O-OG 2.81Å; E335-S338 WeakPolarHBondContact CA-OG 3.43Å; E335-S338 PolarHBondContact O-OG 3.16Å; S338-K342 WeakPolarHBondContact O-CB 3.49Å; S338-K342 PolarHBondContact O-N 3.28Å |
| 339 | R | 51.3 | Low | 51.1 | Low | 194 Ų | 194 | 105.4 Ų | 105.4 | 73% | 0.732 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -79.9 | -31 | 171.6 | -114.5 | 176.3 | 170.2 | 174.6 | -1.3 | 112.9 | E335 L336 D337 R343 | E335-R339 WeakPolarHBondContact O-CB 3.46Å; E335-R339 PolarHBondContact O-N 3.25Å; L336-R339 PolarHBondContact O-N 3.39Å; D337-R339 VanDerWaalsContact C-N 3.32Å; D337-R339 PolarHBondContact O-N 3.17Å; R339-R343 WeakPolarHBondContact O-CB 3.49Å; R339-R343 PolarHBondContact O-N 2.94Å |
| 340 | S | 52.4 | Low | 50.7 | Low | 58 Ų | 58 | 106 Ų | 106 | 41% | 0.406 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -67.6 | -45.7 | 171.5 | 27.2 | 0 | 0 | 0 | 0 | 111.6 | L336 D337 K342 R343 Q344 | L336-S340 PolarHBondContact O-N 3.19Å; L336-S340 PolarHBondContact O-OG 3.33Å; D337-S340 WeakPolarHBondContact CA-OG 3.4Å; D337-S340 PolarHBondContact O-N 3.49Å; D337-S340 PolarHBondContact O-OG 3.48Å; S340-K342 PolarHBondContact O-N 3.29Å; S340-R343 PolarHBondContact O-N 3.04Å; S340-Q344 PolarHBondContact O-N 3.13Å |
| 341 | D | 51.3 | Low | 50.8 | Low | 105 Ų | 105 | 108 Ų | 108 | 56% | 0.561 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -65.5 | -40.3 | 179.7 | -81 | -16.8 | 0 | 0 | 0 | 112.5 | D337 R343 Q344 S345 | D337-D341 PolarHBondContact O-N 3.23Å; D341-R343 PolarHBondContact O-N 2.8Å; D341-Q344 PolarHBondContact O-N 3.19Å; D341-S345 WeakPolarHBondContact O-CB 3.49Å; D341-S345 PolarHBondContact O-N 3.47Å |
| 342 | K | 52 | Low | 50.6 | Low | 151 Ų | 151 | 106.2 Ų | 106.2 | 66% | 0.657 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -67.5 | -32.3 | 174.8 | -84.4 | -177.7 | 175.6 | 177.8 | 0 | 113.5 | S338 S340 N346 | S338-K342 WeakPolarHBondContact O-CB 3.49Å; S338-K342 PolarHBondContact O-N 3.28Å; S340-K342 PolarHBondContact O-N 3.29Å; K342-N346 WeakPolarHBondContact O-CB 3.42Å; K342-N346 VanDerWaalsContact O-CG 3.26Å; K342-N346 PolarHBondContact O-N 3.2Å; K342-N346 VanDerWaalsContact O-N 3.13Å; K342-N346 PolarHBondContact O-OD1 3.22Å |
| 343 | R | 51.1 | Low | 50.3 | Low | 211 Ų | 211 | 109.6 Ų | 109.6 | 80% | 0.796 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -71.3 | -32.9 | 174.1 | -94.7 | -175.7 | 171.1 | -166.4 | -2.7 | 112.1 | R339 S340 D341 A347 | R339-R343 WeakPolarHBondContact O-CB 3.49Å; R339-R343 PolarHBondContact O-N 2.94Å; S340-R343 PolarHBondContact O-N 3.04Å; D341-R343 PolarHBondContact O-N 2.8Å; R343-A347 WeakPolarHBondContact O-CB 3.42Å; R343-A347 PolarHBondContact O-N 3.35Å |
| 344 | Q | 51.4 | Low | 50 | Low | 133 Ų | 133 | 113.2 Ų | 113.2 | 62% | 0.621 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -76.7 | -38.5 | 178.3 | -148.3 | 165.3 | 21.1 | 0 | 0 | 111.9 | S340 D341 A347 L348 | S340-Q344 PolarHBondContact O-N 3.13Å; D341-Q344 PolarHBondContact O-N 3.19Å; Q344-A347 PolarHBondContact O-N 2.89Å; Q344-L348 PolarHBondContact O-N 3.39Å |
| 345 | S | 50.9 | Low | 49.9 | Very low | 62 Ų | 62 | 116.8 Ų | 116.8 | 43% | 0.434 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -62.1 | -47.9 | 172.7 | -169.1 | 0 | 0 | 0 | 0 | 112.2 | D341 A347 L348 D349 | D341-S345 WeakPolarHBondContact O-CB 3.49Å; D341-S345 PolarHBondContact O-N 3.47Å; S345-A347 VanDerWaalsContact C-N 3.26Å; S345-A347 PolarHBondContact O-N 3.38Å; S345-L348 PolarHBondContact O-N 3.27Å; S345-L348 VanDerWaalsContact O-N 3.16Å; S345-D349 PolarHBondContact O-N 3.11Å; S345-D349 VanDerWaalsContact O-N 3.11Å |
| 346 | N | 48.7 | Very low | 49.5 | Very low | 105 Ų | 105 | 119.4 Ų | 119.4 | 56% | 0.561 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -69.3 | -22.6 | -179.2 | -70.7 | 3.6 | 0 | 0 | 0 | 113.3 | K342 N350 | K342-N346 WeakPolarHBondContact O-CB 3.42Å; K342-N346 VanDerWaalsContact O-CG 3.26Å; K342-N346 PolarHBondContact O-N 3.2Å; K342-N346 VanDerWaalsContact O-N 3.13Å; K342-N346 PolarHBondContact O-OD1 3.22Å; N346-N350 PolarHBondContact O-N 3.38Å |
| 347 | A | 51.4 | Low | 49.3 | Very low | 58 Ų | 58 | 118.1 Ų | 118.1 | 48% | 0.479 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -78 | -29.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | R343 Q344 S345 V351 | R343-A347 WeakPolarHBondContact O-CB 3.42Å; R343-A347 PolarHBondContact O-N 3.35Å; Q344-A347 PolarHBondContact O-N 2.89Å; S345-A347 VanDerWaalsContact C-N 3.26Å; S345-A347 PolarHBondContact O-N 3.38Å; A347-V351 WeakPolarHBondContact O-CG2 3.35Å |
| 348 | L | 49.6 | Very low | 49.2 | Very low | 123 Ų | 123 | 119.5 Ų | 119.5 | 64% | 0.644 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -75.5 | -36.9 | 175.3 | -88.8 | 149.4 | 0 | 0 | 0 | 112.2 | Q344 S345 V351 S352 | Q344-L348 PolarHBondContact O-N 3.39Å; S345-L348 PolarHBondContact O-N 3.27Å; S345-L348 VanDerWaalsContact O-N 3.16Å; L348-V351 PolarHBondContact O-N 3.33Å; L348-S352 PolarHBondContact O-N 3.39Å |
| 349 | D | 48.5 | Very low | 49 | Very low | 91 Ų | 91 | 121.2 Ų | 121.2 | 49% | 0.487 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -71.8 | -33.9 | 178 | -70.6 | -27.9 | 0 | 0 | 0 | 112.9 | S345 V351 S352 E353 | S345-D349 PolarHBondContact O-N 3.11Å; S345-D349 VanDerWaalsContact O-N 3.11Å; D349-V351 VanDerWaalsContact C-N 3.3Å; D349-V351 PolarHBondContact O-N 3.16Å; D349-S352 PolarHBondContact O-N 3.22Å; D349-S352 PolarHBondContact O-OG 3.3Å; D349-E353 PolarHBondContact O-N 3.4Å |
| 350 | N | 45.3 | Very low | 48.9 | Very low | 110 Ų | 110 | 116.5 Ų | 116.5 | 59% | 0.588 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -70.8 | -23 | 175.2 | -96.3 | -1.7 | 0 | 0 | 0 | 113.6 | N346 | N346-N350 PolarHBondContact O-N 3.38Å |
| 351 | V | 52.3 | Low | 48.9 | Very low | 92 Ų | 92 | 118.2 Ų | 118.2 | 56% | 0.558 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -82.4 | -26.6 | 176.9 | 174.7 | 0 | 0 | 0 | 0 | 111.6 | A347 L348 D349 | A347-V351 WeakPolarHBondContact O-CG2 3.35Å; L348-V351 PolarHBondContact O-N 3.33Å; D349-V351 VanDerWaalsContact C-N 3.3Å; D349-V351 PolarHBondContact O-N 3.16Å |
| 352 | S | 47.8 | Very low | 48.5 | Very low | 64 Ų | 64 | 122 Ų | 122 | 45% | 0.448 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -79.4 | -36.2 | 176.5 | 56.7 | 0 | 0 | 0 | 0 | 112.4 | L348 D349 K355 | L348-S352 PolarHBondContact O-N 3.39Å; D349-S352 PolarHBondContact O-N 3.22Å; D349-S352 PolarHBondContact O-OG 3.3Å; S352-K355 PolarHBondContact O-N 3.39Å |
| 353 | E | 46.9 | Very low | 48.3 | Very low | 139 Ų | 139 | 120.6 Ų | 120.6 | 65% | 0.65 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -67 | -35.6 | 175.7 | -106.2 | -172.7 | 141.2 | 0 | 0 | 113.1 | D349 K355 Y356 | D349-E353 PolarHBondContact O-N 3.4Å; E353-K355 VanDerWaalsContact C-N 3.3Å; E353-K355 PolarHBondContact O-N 3.41Å; E353-Y356 PolarHBondContact O-N 3.4Å |
| 354 | Q | 45.4 | Very low | 48.2 | Very low | 149 Ų | 149 | 115.8 Ų | 115.8 | 70% | 0.696 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -72.5 | -20.8 | 179.3 | -120.3 | 173.4 | -6.6 | 0 | 0 | 113.8 | ||
| 355 | K | 47.3 | Very low | 48 | Very low | 164 Ų | 164 | 114.8 Ų | 114.8 | 71% | 0.713 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -81.5 | -23.6 | 174 | -90 | -177.4 | 176.4 | 178.5 | 0 | 113.6 | S352 E353 | S352-K355 PolarHBondContact O-N 3.39Å; E353-K355 VanDerWaalsContact C-N 3.3Å; E353-K355 PolarHBondContact O-N 3.41Å |
| 356 | Y | 42.8 | Very low | 47.8 | Very low | 193 Ų | 193 | 117.9 Ų | 117.9 | 76% | 0.757 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -80.5 | -29.2 | 179.6 | -116 | -88.8 | 0 | 0 | 0 | 113.1 | E353 | E353-Y356 PolarHBondContact O-N 3.4Å |
| 357 | V | 48 | Very low | 47.8 | Very low | 103 Ų | 103 | 118.8 Ų | 118.8 | 62% | 0.624 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -77.5 | -21 | -178.7 | -179.8 | 0 | 0 | 0 | 0 | 112.7 | ||
| 358 | L | 47.4 | Very low | 47.5 | Very low | 143 Ų | 143 | 122.8 Ų | 122.8 | 75% | 0.749 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.4 | -8.5 | 179.3 | -82 | 158.1 | 0 | 0 | 0 | 114.6 | ||
| 359 | S | 47.3 | Very low | 47.4 | Very low | 97 Ų | 97 | 122.8 Ų | 122.8 | 68% | 0.678 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -101 | -2.5 | 179.2 | 114.6 | 0 | 0 | 0 | 0 | 114.5 | ||
| 360 | S | 49.6 | Very low | 47.3 | Very low | 95 Ų | 95 | 125.2 Ų | 125.2 | 66% | 0.664 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -103.7 | 8.9 | 179.7 | 59 | 0 | 0 | 0 | 0 | 113.7 | ||
| 361 | S | 51.5 | Low | 47.4 | Very low | 94 Ų | 94 | 126.5 Ų | 126.5 | 66% | 0.657 | 71% | 0.707 | S | S | * | * | trans | -125.5 | 45.8 | -177.2 | -52.6 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 362 | S | 42.9 | Very low | 47 | Very low | 185 Ų | 185 | 129.6 Ų | 129.6 | 100% | 1.294 | 72% | 0.721 | S | S | * | * | trans | -152.2 | 0 | 169 | -61 | 0 | 0 | 0 | 0 | 111.2 |
Retrieved 362 of 362 residues in 115.1 ms
(Link to these results)