| 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 | 48.3 | Very low | 44.1 | Very low | 224 Ų | 224 | 130.1 Ų | 130.1 | 100% | 1.103 | 68% | 0.678 | S | S | * | * | 0 | -17.3 | 0 | -84.7 | 174.6 | 163.6 | 0 | 0 | 114.8 | |||||
| 2 | A | 46.1 | Very low | 44.9 | Very low | 85 Ų | 85 | 124.1 Ų | 124.1 | 70% | 0.702 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -78.3 | -20.7 | -176 | 0 | 0 | 0 | 0 | 0 | 117 | ||
| 3 | K | 40.5 | Very low | 45.5 | Very low | 185 Ų | 185 | 125.8 Ų | 125.8 | 80% | 0.804 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -84.2 | -14.2 | -177.5 | -88 | -175.8 | 174.1 | -179.3 | 0 | 115.7 | ||
| 4 | V | 43.1 | Very low | 45.7 | Very low | 122 Ų | 122 | 124.7 Ų | 124.7 | 74% | 0.739 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -86.4 | -25.3 | -179.7 | 179.9 | 0 | 0 | 0 | 0 | 111.5 | ||
| 5 | Q | 40.4 | Very low | 46.1 | Very low | 160 Ų | 160 | 123.9 Ų | 123.9 | 75% | 0.748 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -79.5 | -28.5 | -177.9 | -127.3 | 158.2 | -22.3 | 0 | 0 | 113 | H9 | Q5-H9 PolarHBondContact O-N 2.76Å |
| 6 | E | 43 | Very low | 46.4 | Very low | 142 Ų | 142 | 127.3 Ų | 127.3 | 66% | 0.664 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -73.5 | -39.7 | 179.3 | -120.7 | 179.7 | 171.2 | 0 | 0 | 112.8 | H9 T10 | E6-H9 PolarHBondContact O-N 3.24Å; E6-T10 PolarHBondContact O-N 3.17Å; E6-T10 PolarHBondContact O-OG1 3.33Å |
| 7 | H | 40.9 | Very low | 46.9 | Very low | 142 Ų | 142 | 124.6 Ų | 124.6 | 66% | 0.657 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -68.2 | -36.7 | 178 | -97.8 | 43.1 | 0 | 0 | 0 | 113 | H9 H11 | H7-H9 VanDerWaalsContact C-N 3.33Å; H7-H11 PolarHBondContact O-N 3.38Å |
| 8 | G | 41.7 | Very low | 47 | Very low | 37 Ų | 37 | 124.8 Ų | 124.8 | 38% | 0.381 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -63 | -40.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | H11 T12 | G8-H11 PolarHBondContact O-N 2.83Å; G8-T12 PolarHBondContact O-N 2.96Å; G8-T12 VanDerWaalsContact O-N 3.13Å; G8-T12 PolarHBondContact O-OG1 3.49Å |
| 9 | H | 44.3 | Very low | 47.4 | Very low | 138 Ų | 138 | 122.7 Ų | 122.7 | 64% | 0.639 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -72.5 | -29.3 | -177.9 | -124 | 28.9 | 0 | 0 | 0 | 114.1 | Q5 E6 H7 K13 | Q5-H9 PolarHBondContact O-N 2.76Å; E6-H9 PolarHBondContact O-N 3.24Å; H7-H9 VanDerWaalsContact C-N 3.33Å; H9-K13 PolarHBondContact O-N 2.91Å |
| 10 | T | 49.1 | Very low | 47.5 | Very low | 72 Ų | 72 | 123.5 Ų | 123.5 | 44% | 0.442 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -75.3 | -38.6 | 175.2 | 2 | 0 | 0 | 0 | 0 | 112 | E6 K13 M14 | E6-T10 PolarHBondContact O-N 3.17Å; E6-T10 PolarHBondContact O-OG1 3.33Å; T10-K13 PolarHBondContact O-N 3.2Å; T10-M14 HydrophobicContact CG2-CE 4.47Å; T10-M14 PolarHBondContact O-N 3.02Å |
| 11 | H | 47.9 | Very low | 47.6 | Very low | 124 Ų | 124 | 124.7 Ų | 124.7 | 57% | 0.574 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -64.8 | -45.1 | 175.5 | -107.5 | -79.5 | 0 | 0 | 0 | 112.2 | H7 G8 K13 M14 E15 | H7-H11 PolarHBondContact O-N 3.38Å; G8-H11 PolarHBondContact O-N 2.83Å; H11-K13 VanDerWaalsContact C-N 3.3Å; H11-K13 PolarHBondContact O-N 3.22Å; H11-M14 PolarHBondContact O-N 3.36Å; H11-E15 PolarHBondContact O-N 3.13Å |
| 12 | T | 53.4 | Low | 47.4 | Very low | 58 Ų | 58 | 120.8 Ų | 120.8 | 36% | 0.356 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -66.5 | -30.4 | 177.8 | -37.9 | 0 | 0 | 0 | 0 | 112.6 | G8 R16 | G8-T12 PolarHBondContact O-N 2.96Å; G8-T12 VanDerWaalsContact O-N 3.13Å; G8-T12 PolarHBondContact O-OG1 3.49Å; T12-R16 VanDerWaalsContact O-CB 3.31Å; T12-R16 WeakPolarHBondContact O-CB 3.24Å; T12-R16 WeakPolarHBondContact O-CG 3.38Å; T12-R16 PolarHBondContact O-N 3.5Å; T12-R16 VanDerWaalsContact O-N 3.07Å |
| 13 | K | 52.6 | Low | 47.4 | Very low | 147 Ų | 147 | 122.7 Ų | 122.7 | 64% | 0.639 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -71 | -40.5 | 172.8 | -92.9 | -177.9 | 174.9 | 177.4 | 0 | 112.2 | H9 T10 H11 T17 | H9-K13 PolarHBondContact O-N 2.91Å; T10-K13 PolarHBondContact O-N 3.2Å; H11-K13 VanDerWaalsContact C-N 3.3Å; H11-K13 PolarHBondContact O-N 3.22Å; K13-T17 WeakPolarHBondContact O-CB 3.19Å; K13-T17 PolarHBondContact O-N 2.82Å; K13-T17 PolarHBondContact O-OG1 3.37Å |
| 14 | M | 48.9 | Very low | 47.5 | Very low | 110 Ų | 110 | 118.1 Ų | 118.1 | 54% | 0.542 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -67 | -43.9 | 176.3 | -84.7 | -173.8 | -90.7 | 0 | 0 | 112.3 | T10 H11 T17 Q18 | T10-M14 HydrophobicContact CG2-CE 4.47Å; T10-M14 PolarHBondContact O-N 3.02Å; H11-M14 PolarHBondContact O-N 3.36Å; M14-T17 PolarHBondContact O-N 3.39Å; M14-Q18 PolarHBondContact O-N 3.28Å |
| 15 | E | 51.2 | Low | 47.4 | Very low | 112 Ų | 112 | 119.2 Ų | 119.2 | 52% | 0.523 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -61 | -46.2 | 173.5 | -86.9 | 179.7 | 149.5 | 0 | 0 | 112 | H11 T17 Q18 I19 | H11-E15 PolarHBondContact O-N 3.13Å; E15-T17 PolarHBondContact O-N 2.83Å; E15-Q18 PolarHBondContact O-N 3.38Å; E15-I19 WeakPolarHBondContact O-CB 3.39Å; E15-I19 VanDerWaalsContact O-CG1 3.24Å; E15-I19 WeakPolarHBondContact O-CG1 3.42Å; E15-I19 PolarHBondContact O-N 3.29Å |
| 16 | R | 51.2 | Low | 47.3 | Very low | 179 Ų | 179 | 113.1 Ų | 113.1 | 68% | 0.675 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -62.5 | -32 | 176.3 | -76.3 | 176.3 | 179.8 | -172.4 | 0.6 | 112.5 | T12 K20 | T12-R16 VanDerWaalsContact O-CB 3.31Å; T12-R16 WeakPolarHBondContact O-CB 3.24Å; T12-R16 WeakPolarHBondContact O-CG 3.38Å; T12-R16 PolarHBondContact O-N 3.5Å; T12-R16 VanDerWaalsContact O-N 3.07Å; R16-K20 WeakPolarHBondContact O-CB 3.47Å; R16-K20 PolarHBondContact O-N 2.9Å |
| 17 | T | 54.6 | Low | 47.1 | Very low | 81 Ų | 81 | 113 Ų | 113 | 50% | 0.497 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -76.2 | -33.9 | 177.4 | -51.2 | 0 | 0 | 0 | 0 | 111.7 | K13 M14 E15 K21 | K13-T17 WeakPolarHBondContact O-CB 3.19Å; K13-T17 PolarHBondContact O-N 2.82Å; K13-T17 PolarHBondContact O-OG1 3.37Å; M14-T17 PolarHBondContact O-N 3.39Å; E15-T17 PolarHBondContact O-N 2.83Å; T17-K21 WeakPolarHBondContact O-CB 3.21Å; T17-K21 PolarHBondContact O-N 3.14Å |
| 18 | Q | 49.6 | Very low | 47 | Very low | 128 Ų | 128 | 112.6 Ų | 112.6 | 60% | 0.598 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -70 | -46.1 | 172.8 | -76.8 | -178 | -16.2 | 0 | 0 | 111.9 | M14 E15 K20 K21 E22 | M14-Q18 PolarHBondContact O-N 3.28Å; E15-Q18 PolarHBondContact O-N 3.38Å; Q18-K20 VanDerWaalsContact C-N 3.28Å; Q18-K20 PolarHBondContact O-N 2.97Å; Q18-K21 CarbonylContact O-C 3.57Å; Q18-K21 PolarHBondContact O-N 2.85Å; Q18-K21 VanDerWaalsContact O-N 3.14Å; Q18-E22 PolarHBondContact O-N 3.2Å |
| 19 | I | 54.5 | Low | 47 | Very low | 86 Ų | 86 | 117.6 Ų | 117.6 | 44% | 0.441 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -61.1 | -39.3 | 175.5 | -65.2 | 163.8 | 0 | 0 | 0 | 110.6 | E15 E22 Q23 | E15-I19 WeakPolarHBondContact O-CB 3.39Å; E15-I19 VanDerWaalsContact O-CG1 3.24Å; E15-I19 WeakPolarHBondContact O-CG1 3.42Å; E15-I19 PolarHBondContact O-N 3.29Å; I19-E22 PolarHBondContact O-N 3.03Å; I19-Q23 HydrophobicContact CG2-CG 4.5Å; I19-Q23 WeakPolarHBondContact O-CB 3.31Å; I19-Q23 WeakPolarHBondContact O-CG 3.44Å; I19-Q23 PolarHBondContact O-N 3.45Å |
| 20 | K | 49.6 | Very low | 46.9 | Very low | 137 Ų | 137 | 118.7 Ų | 118.7 | 60% | 0.596 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -70.6 | -35.6 | 176.5 | -154.3 | 174.7 | -172.2 | -174.2 | 0 | 112.3 | R16 Q18 Q23 D24 | R16-K20 WeakPolarHBondContact O-CB 3.47Å; R16-K20 PolarHBondContact O-N 2.9Å; Q18-K20 VanDerWaalsContact C-N 3.28Å; Q18-K20 PolarHBondContact O-N 2.97Å; K20-Q23 PolarHBondContact O-N 3.19Å; K20-D24 VanDerWaalsContact O-CB 3.29Å; K20-D24 WeakPolarHBondContact O-CB 3.3Å; K20-D24 PolarHBondContact O-N 2.64Å |
| 21 | K | 47.8 | Very low | 46.5 | Very low | 150 Ų | 150 | 122 Ų | 122 | 65% | 0.652 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -68.3 | -33.9 | 170.8 | -88.6 | -176.8 | 173.7 | -178.8 | 0 | 113.1 | T17 Q18 K25 | T17-K21 WeakPolarHBondContact O-CB 3.21Å; T17-K21 PolarHBondContact O-N 3.14Å; Q18-K21 CarbonylContact O-C 3.57Å; Q18-K21 PolarHBondContact O-N 2.85Å; Q18-K21 VanDerWaalsContact O-N 3.14Å; K21-K25 VanDerWaalsContact O-CB 3.29Å; K21-K25 WeakPolarHBondContact O-CB 3.48Å; K21-K25 WeakPolarHBondContact O-CG 3.29Å; K21-K25 PolarHBondContact O-N 2.99Å |
| 22 | E | 46 | Very low | 46.4 | Very low | 141 Ų | 141 | 117.3 Ų | 117.3 | 66% | 0.659 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -73.9 | -37.4 | 173.8 | -78.5 | -179.1 | 159.3 | 0 | 0 | 111.8 | Q18 I19 K25 G26 | Q18-E22 PolarHBondContact O-N 3.2Å; I19-E22 PolarHBondContact O-N 3.03Å; E22-K25 PolarHBondContact O-N 3.07Å; E22-G26 PolarHBondContact O-N 2.89Å |
| 23 | Q | 44.2 | Very low | 46.3 | Very low | 125 Ų | 125 | 117.5 Ų | 117.5 | 58% | 0.584 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -69.4 | -38.5 | 172.4 | -78.3 | -179.2 | -23.4 | 0 | 0 | 112.7 | I19 K20 G26 K27 | I19-Q23 HydrophobicContact CG2-CG 4.5Å; I19-Q23 WeakPolarHBondContact O-CB 3.31Å; I19-Q23 WeakPolarHBondContact O-CG 3.44Å; I19-Q23 PolarHBondContact O-N 3.45Å; K20-Q23 PolarHBondContact O-N 3.19Å; Q23-G26 PolarHBondContact O-N 3.36Å; Q23-K27 WeakPolarHBondContact O-CB 3.47Å; Q23-K27 WeakPolarHBondContact O-CG 3.48Å; Q23-K27 PolarHBondContact O-N 3.34Å |
| 24 | D | 44.1 | Very low | 46.5 | Very low | 89 Ų | 89 | 117.7 Ų | 117.7 | 48% | 0.476 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -72.2 | -32.2 | 173.5 | -80.9 | -17.8 | 0 | 0 | 0 | 111.6 | K20 K27 M28 | K20-D24 VanDerWaalsContact O-CB 3.29Å; K20-D24 WeakPolarHBondContact O-CB 3.3Å; K20-D24 PolarHBondContact O-N 2.64Å; D24-K27 PolarHBondContact O-N 3.19Å; D24-M28 WeakPolarHBondContact O-CB 3.29Å; D24-M28 PolarHBondContact O-N 3.43Å |
| 25 | K | 40 | Very low | 47.1 | Very low | 145 Ų | 145 | 115.3 Ų | 115.3 | 63% | 0.63 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.1 | -43.9 | 167 | -93.4 | -174.1 | 171.6 | -173.8 | 0 | 111.8 | K21 E22 K27 M28 E29 | K21-K25 VanDerWaalsContact O-CB 3.29Å; K21-K25 WeakPolarHBondContact O-CB 3.48Å; K21-K25 WeakPolarHBondContact O-CG 3.29Å; K21-K25 PolarHBondContact O-N 2.99Å; E22-K25 PolarHBondContact O-N 3.07Å; K25-K27 VanDerWaalsContact C-N 3.32Å; K25-K27 PolarHBondContact O-N 3.4Å; K25-M28 PolarHBondContact O-N 3.28Å; K25-E29 WeakPolarHBondContact O-CB 3.34Å; K25-E29 WeakPolarHBondContact O-CG 3.33Å; K25-E29 PolarHBondContact O-N 2.87Å |
| 26 | G | 38 | Very low | 47.7 | Very low | 33 Ų | 33 | 117.2 Ų | 117.2 | 34% | 0.34 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -64.1 | -35.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | E22 Q23 E30 | E22-G26 PolarHBondContact O-N 2.89Å; Q23-G26 PolarHBondContact O-N 3.36Å; G26-E30 PolarHBondContact O-N 3.5Å; G26-E30 VanDerWaalsContact O-N 3.16Å |
| 27 | K | 38.7 | Very low | 48.8 | Very low | 138 Ų | 138 | 116.1 Ų | 116.1 | 60% | 0.6 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -74.8 | -39.8 | 173.7 | -79.3 | -177.9 | 173.1 | -177.2 | 0 | 113.3 | Q23 D24 K25 E29 E30 E31 | Q23-K27 WeakPolarHBondContact O-CB 3.47Å; Q23-K27 WeakPolarHBondContact O-CG 3.48Å; Q23-K27 PolarHBondContact O-N 3.34Å; D24-K27 PolarHBondContact O-N 3.19Å; K25-K27 VanDerWaalsContact C-N 3.32Å; K25-K27 PolarHBondContact O-N 3.4Å; K27-E29 VanDerWaalsContact C-N 3.3Å; K27-E29 PolarHBondContact O-N 2.83Å; K27-E30 PolarHBondContact O-N 2.85Å; K27-E31 PolarHBondContact O-N 3.47Å |
| 28 | M | 39.9 | Very low | 49.8 | Very low | 135 Ų | 135 | 118.3 Ų | 118.3 | 67% | 0.665 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65.1 | -33.1 | 171.4 | -85.6 | -175.8 | 74.6 | 0 | 0 | 112 | D24 K25 E30 E31 A32 | D24-M28 WeakPolarHBondContact O-CB 3.29Å; D24-M28 PolarHBondContact O-N 3.43Å; K25-M28 PolarHBondContact O-N 3.28Å; M28-E30 VanDerWaalsContact C-N 3.33Å; M28-E31 PolarHBondContact O-N 3.38Å; M28-A32 PolarHBondContact O-N 2.91Å |
| 29 | E | 41.2 | Very low | 51.2 | Low | 142 Ų | 142 | 112.9 Ų | 112.9 | 66% | 0.664 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -71 | -26.4 | 173.5 | -79.2 | -177.3 | 175.2 | 0 | 0 | 112.9 | K25 K27 | K25-E29 WeakPolarHBondContact O-CB 3.34Å; K25-E29 WeakPolarHBondContact O-CG 3.33Å; K25-E29 PolarHBondContact O-N 2.87Å; K27-E29 VanDerWaalsContact C-N 3.3Å; K27-E29 PolarHBondContact O-N 2.83Å |
| 30 | E | 42.1 | Very low | 52.7 | Low | 161 Ų | 161 | 109.6 Ų | 109.6 | 75% | 0.752 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -76.2 | -27.4 | 169.3 | -83.7 | -171.3 | 145.4 | 0 | 0 | 113.3 | G26 K27 M28 | G26-E30 PolarHBondContact O-N 3.5Å; G26-E30 VanDerWaalsContact O-N 3.16Å; K27-E30 PolarHBondContact O-N 2.85Å; M28-E30 VanDerWaalsContact C-N 3.33Å |
| 31 | E | 41.9 | Very low | 54.5 | Low | 142 Ų | 142 | 106.3 Ų | 106.3 | 66% | 0.664 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -82.4 | -26.2 | 177.3 | -76.7 | -178.7 | 161.8 | 0 | 0 | 113.6 | K27 M28 V33 | K27-E31 PolarHBondContact O-N 3.47Å; M28-E31 PolarHBondContact O-N 3.38Å; E31-V33 PolarHBondContact O-N 2.82Å; E31-V33 VanDerWaalsContact O-N 3.11Å |
| 32 | A | 45.5 | Very low | 56.3 | Low | 24 Ų | 24 | 104.7 Ų | 104.7 | 20% | 0.198 | 50% | 0.498 | C | S | . | . | S | Bend | trans | -67.3 | 111.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | M28 R34 E494 | M28-A32 PolarHBondContact O-N 2.91Å; A32-R34 VanDerWaalsContact C-N 3.33Å; A32-R34 PolarHBondContact O-N 3.19Å; A32-E494 WeakPolarHBondContact CA-OE2 3.36Å |
| 33 | V | 51.2 | Low | 58.1 | Low | 62 Ų | 62 | 100.3 Ų | 100.3 | 38% | 0.376 | 48% | 0.482 | S | S | . | . | trans | -67.6 | 86.9 | 178.1 | -176 | 0 | 0 | 0 | 0 | 109.9 | E31 Q493 | E31-V33 PolarHBondContact O-N 2.82Å; E31-V33 VanDerWaalsContact O-N 3.11Å; V33-Q493 WeakPolarHBondContact O-CG 3.37Å; V33-Q493 PolarHBondContact O-NE2 2.89Å; V33-Q493 VanDerWaalsContact O-NE2 3.1Å | ||
| 34 | R | 56.9 | Low | 60.2 | Low | 152 Ų | 152 | 94.3 Ų | 94.3 | 57% | 0.574 | 45% | 0.454 | S | S | * | . | trans | -107.6 | 148.7 | 174.4 | -68.4 | -178.6 | 173 | 173.6 | -1.1 | 111.8 | A32 R36 V495 | A32-R34 VanDerWaalsContact C-N 3.33Å; A32-R34 PolarHBondContact O-N 3.19Å; R34-R36 PolarHBondContact O-N 3.34Å; R34-V495 PolarHBondContact NH2-OXT 3.41Å | ||
| 35 | L | 60.9 | Low | 62.4 | Low | 59 Ų | 59 | 91.2 Ų | 91.2 | 31% | 0.309 | 44% | 0.438 | S | S | . | . | trans | -63 | 122.5 | 170.8 | -70 | 170.8 | 0 | 0 | 0 | 108.7 | E254 | L35-E254 HydrophobicContact CB-CG 4.18Š| ||
| 36 | R | 64.4 | Low | 64.7 | Low | 152 Ų | 152 | 84.7 Ų | 84.7 | 57% | 0.574 | 41% | 0.411 | S | S | * | . | trans | -81 | 142.4 | -177.9 | -70.3 | -175.5 | 175.6 | -170.8 | -4.3 | 110.8 | R34 E38 | R34-R36 PolarHBondContact O-N 3.34Å; R36-E38 HydrophobicContact CB-CG 3.81Å; R36-E38 WeakPolarHBondContact CB-OE1 3.37Å; R36-E38 WeakPolarHBondContact CD-OE1 3.48Å; R36-E38 PolarHBondContact O-N 2.94Å; R36-E38 VanDerWaalsContact O-N 3.12Å | ||
| 37 | R | 74.4 | Confident | 67 | Low | 156 Ų | 156 | 83.7 Ų | 83.7 | 59% | 0.589 | 40% | 0.397 | S | S | * | . | trans | -77.3 | 91.4 | 172 | -75.6 | 179.2 | -179.3 | 178.8 | 2.8 | 110.4 | E253 E254 I256 | R37-E253 WeakPolarHBondContact CG-O 3.49Å; R37-E254 CarbonylContact C-O 3.58Å; R37-E254 WeakPolarHBondContact CA-O 3.45Å; R37-I256 HydrophobicContact CB-CG1 4.34Å | ||
| 38 | E | 74.1 | Confident | 69.5 | Low | 128 Ų | 128 | 77.1 Ų | 77.1 | 60% | 0.598 | 37% | 0.368 | S | S | * | . | trans | -115.8 | -11.7 | -175.5 | -63.3 | -175.8 | 177.6 | 0 | 0 | 113.1 | R36 G40 E254 | R36-E38 HydrophobicContact CB-CG 3.81Å; R36-E38 WeakPolarHBondContact CB-OE1 3.37Å; R36-E38 WeakPolarHBondContact CD-OE1 3.48Å; R36-E38 PolarHBondContact O-N 2.94Å; R36-E38 VanDerWaalsContact O-N 3.12Å; E38-G40 PolarHBondContact O-N 2.88Å; E38-E254 PolarHBondContact N-O 3.21Å; E38-E254 VanDerWaalsContact N-O 3.08Å | ||
| 39 | I | 79.8 | Confident | 72 | Confident | 13 Ų | 13 | 71.3 Ų | 71.3 | 7% | 0.067 | 34% | 0.34 | C | S | . | . | B | Isolated β-bridge | trans | -91.3 | 103.2 | -173.5 | -54.2 | 178.9 | 0 | 0 | 0 | 110.1 | P43 A44 V251 E254 V255 I256 F332 | I39-P43 HydrophobicContact CG2-CB 4.13Å; I39-A44 HydrophobicContact CG2-CB 4.07Å; I39-V251 HydrophobicContact CD1-CB 4.32Å; I39-V251 HydrophobicContact CD1-CG2 4.27Å; I39-E254 HydrophobicContact CD1-CB 3.91Å; I39-E254 HydrophobicContact CG1-CB 4.25Å; I39-E254 PolarHBondContact N-O 2.88Å; I39-V255 HydrophobicContact CB-CG2 4.34Å; I39-V255 HydrophobicContact CG2-CG2 4.34Å; I39-V255 WeakPolarHBondContact O-CA 3.41Å; I39-I256 PolarHBondContact O-N 3.39Å; I39-F332 HydrophobicContact CD1-CE1 4.42Å |
| 40 | G | 85.4 | Confident | 74.2 | Confident | 18 Ų | 18 | 64.5 Ų | 64.5 | 19% | 0.186 | 31% | 0.308 | C | S | . | . | trans | -76.2 | -178.7 | 170.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | E38 P43 A44 | E38-G40 PolarHBondContact O-N 2.88Å; G40-P43 WeakPolarHBondContact O-CD 3.48Å; G40-A44 VanDerWaalsContact O-CB 3.32Å; G40-A44 WeakPolarHBondContact O-CB 3.21Å; G40-A44 PolarHBondContact O-N 3.46Å | ||
| 41 | L | 87.6 | Confident | 76.4 | Confident | 67 Ų | 67 | 57.3 Ų | 57.3 | 35% | 0.351 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -62.7 | -48.4 | -176.6 | -179 | 65.4 | 0 | 0 | 0 | 113.5 | A44 V45 N261 L264 A265 | L41-A44 WeakPolarHBondContact O-CB 3.35Å; L41-A44 PolarHBondContact O-N 3.45Å; L41-V45 HydrophobicContact CD1-CG2 4.36Å; L41-V45 WeakPolarHBondContact O-CG2 3.48Å; L41-V45 PolarHBondContact O-N 3.24Å; L41-N261 HydrophobicContact CD1-CB 4.18Å; L41-L264 HydrophobicContact CD1-CB 3.92Å; L41-A265 HydrophobicContact CD1-CB 4.19Å |
| 42 | L | 85.9 | Confident | 78.7 | Confident | 117 Ų | 117 | 50.8 Ų | 50.8 | 61% | 0.613 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -64.4 | -48.2 | -178.5 | 178.5 | 71.7 | 0 | 0 | 0 | 111.7 | A44 V45 S46 | L42-A44 VanDerWaalsContact C-N 3.28Å; L42-A44 PolarHBondContact O-N 3.08Å; L42-V45 PolarHBondContact O-N 2.95Å; L42-S46 WeakPolarHBondContact O-CB 3.36Å; L42-S46 PolarHBondContact O-N 2.83Å; L42-S46 PolarHBondContact O-OG 3.02Å |
| 43 | P | 84.8 | Confident | 80.8 | Confident | 48 Ų | 48 | 49.7 Ų | 49.7 | 31% | 0.312 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -55.8 | -38.6 | 169.9 | -27.8 | 35.7 | 0 | 0 | 0 | 113.7 | I39 G40 S46 F47 | I39-P43 HydrophobicContact CG2-CB 4.13Å; G40-P43 WeakPolarHBondContact O-CD 3.48Å; P43-S46 PolarHBondContact O-N 3.28Å; P43-F47 WeakPolarHBondContact O-CB 3.47Å; P43-F47 PolarHBondContact O-N 3.37Å |
| 44 | A | 87.7 | Confident | 82.3 | Confident | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -65.4 | -43.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | I39 G40 L41 L42 F47 I48 L248 A265 | I39-A44 HydrophobicContact CG2-CB 4.07Å; G40-A44 VanDerWaalsContact O-CB 3.32Å; G40-A44 WeakPolarHBondContact O-CB 3.21Å; G40-A44 PolarHBondContact O-N 3.46Å; L41-A44 WeakPolarHBondContact O-CB 3.35Å; L41-A44 PolarHBondContact O-N 3.45Å; L42-A44 VanDerWaalsContact C-N 3.28Å; L42-A44 PolarHBondContact O-N 3.08Å; A44-F47 PolarHBondContact O-N 3.05Å; A44-I48 WeakPolarHBondContact O-CG1 3.48Å; A44-I48 PolarHBondContact O-N 3.37Å; A44-I48 VanDerWaalsContact O-N 3.07Å; A44-L248 HydrophobicContact CB-CD1 3.77Å; A44-L248 HydrophobicContact CB-CD2 4.05Å; A44-A265 HydrophobicContact CB-CB 3.9Å |
| 45 | V | 90.6 | Very high | 83.5 | Confident | 23 Ų | 23 | 39.8 Ų | 39.8 | 14% | 0.139 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -61.2 | -50.8 | 174.2 | 171.7 | 0 | 0 | 0 | 0 | 110.1 | L41 L42 F47 I48 I49 A265 C268 | L41-V45 HydrophobicContact CD1-CG2 4.36Å; L41-V45 WeakPolarHBondContact O-CG2 3.48Å; L41-V45 PolarHBondContact O-N 3.24Å; L42-V45 PolarHBondContact O-N 2.95Å; V45-F47 VanDerWaalsContact C-N 3.26Å; V45-F47 PolarHBondContact O-N 2.87Å; V45-I48 PolarHBondContact O-N 3.26Å; V45-I49 HydrophobicContact CG1-CD1 3.67Å; V45-I49 HydrophobicContact CG1-CG1 4.3Å; V45-I49 WeakPolarHBondContact O-CG1 3.25Å; V45-I49 PolarHBondContact O-N 3.41Å; V45-A265 HydrophobicContact CG2-CB 3.95Å; V45-C268 HydrophobicContact CG2-CB 4.43Å |
| 46 | S | 88.1 | Confident | 84.7 | Confident | 8 Ų | 8 | 37.2 Ų | 37.2 | 6% | 0.056 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.9 | -36.2 | 178.3 | -64.6 | 0 | 0 | 0 | 0 | 111.9 | L42 P43 G50 T191 | L42-S46 WeakPolarHBondContact O-CB 3.36Å; L42-S46 PolarHBondContact O-N 2.83Å; L42-S46 PolarHBondContact O-OG 3.02Å; P43-S46 PolarHBondContact O-N 3.28Å; S46-G50 WeakPolarHBondContact O-CA 3.37Å; S46-G50 PolarHBondContact O-N 3.46Å; S46-T191 WeakPolarHBondContact O-CG2 3.28Å; S46-T191 PolarHBondContact O-OG1 2.62Å |
| 47 | F | 86.7 | Confident | 85.9 | Confident | 12 Ų | 12 | 30 Ų | 30 | 5% | 0.053 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -64.6 | -44.1 | 176.3 | -174.7 | -96.2 | 0 | 0 | 0 | 112 | P43 A44 V45 G50 T51 Q187 L248 F332 | P43-F47 WeakPolarHBondContact O-CB 3.47Å; P43-F47 PolarHBondContact O-N 3.37Å; A44-F47 PolarHBondContact O-N 3.05Å; V45-F47 VanDerWaalsContact C-N 3.26Å; V45-F47 PolarHBondContact O-N 2.87Å; F47-G50 PolarHBondContact O-N 3.15Å; F47-T51 HydrophobicContact CE1-CG2 4.16Å; F47-T51 HydrophobicContact CZ-CG2 4.13Å; F47-T51 WeakPolarHBondContact O-CB 3.45Å; F47-T51 WeakPolarHBondContact O-CG2 3.33Å; F47-T51 PolarHBondContact O-N 3.14Å; F47-T51 PolarHBondContact O-OG1 2.78Å; F47-Q187 HydrophobicContact CD2-CG 3.85Å; F47-Q187 HydrophobicContact CE2-CG 4.36Å; F47-L248 HydrophobicContact CD1-CD1 4.42Å; F47-F332 HydrophobicContact CD2-CD1 4.43Å; F47-F332 HydrophobicContact CE2-CB 4.06Å; F47-F332 AromaticContact CE2-CD1 3.46Å; F47-F332 HydrophobicContact CE2-CD1 3.46Å; F47-F332 VanDerWaalsContact CE2-CD1 3.46Å; F47-F332 HydrophobicContact CE2-CE1 4.14Å; F47-F332 AromaticContact CE2-CG 3.97Å; F47-F332 HydrophobicContact CE2-CG 3.97Å; F47-F332 HydrophobicContact CZ-CB 4.3Å; F47-F332 AromaticContact CZ-CD1 3.67Å; F47-F332 HydrophobicContact CZ-CD1 3.67Å; F47-F332 HydrophobicContact CZ-CE1 4.49Å; F47-F332 HydrophobicContact CZ-CG 4.38Å |
| 48 | I | 90.6 | Very high | 86.5 | Confident | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -66.8 | -49.5 | 176.5 | -63.1 | 168.4 | 0 | 0 | 0 | 110.8 | A44 V45 G50 T51 V52 L248 A265 I266 S269 | A44-I48 WeakPolarHBondContact O-CG1 3.48Å; A44-I48 PolarHBondContact O-N 3.37Å; A44-I48 VanDerWaalsContact O-N 3.07Å; V45-I48 PolarHBondContact O-N 3.26Å; I48-G50 PolarHBondContact O-N 3.09Å; I48-T51 WeakPolarHBondContact CA-OG1 3.33Å; I48-T51 PolarHBondContact O-N 3Å; I48-T51 VanDerWaalsContact O-N 3.12Å; I48-T51 PolarHBondContact O-OG1 2.6Å; I48-V52 HydrophobicContact CG2-CG2 3.97Å; I48-V52 WeakPolarHBondContact O-CG2 3.33Å; I48-V52 PolarHBondContact O-N 2.77Å; I48-L248 HydrophobicContact CD1-CB 3.88Å; I48-L248 HydrophobicContact CD1-CD2 3.64Å; I48-L248 HydrophobicContact CD1-CG 4.32Å; I48-L248 HydrophobicContact CG1-CB 3.82Å; I48-L248 HydrophobicContact CG1-CD2 4.31Å; I48-A265 HydrophobicContact CD1-CB 3.97Å; I48-I266 HydrophobicContact CD1-CB 4.46Å; I48-I266 HydrophobicContact CD1-CG1 3.7Å; I48-S269 WeakPolarHBondContact CG2-OG 3.29Å |
| 49 | I | 91.7 | Very high | 87 | Confident | 13 Ų | 13 | 17.4 Ų | 17.4 | 7% | 0.067 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -57.8 | -43.1 | 177.1 | -65.1 | 175.5 | 0 | 0 | 0 | 109.8 | V45 T51 V53 T191 M195 T272 V273 | V45-I49 HydrophobicContact CG1-CD1 3.67Å; V45-I49 HydrophobicContact CG1-CG1 4.3Å; V45-I49 WeakPolarHBondContact O-CG1 3.25Å; V45-I49 PolarHBondContact O-N 3.41Å; I49-T51 VanDerWaalsContact C-N 3.29Å; I49-T51 PolarHBondContact O-N 2.7Å; I49-V53 HydrophobicContact CG2-CG2 3.96Å; I49-V53 WeakPolarHBondContact O-CA 3.34Å; I49-V53 WeakPolarHBondContact O-CB 3.49Å; I49-V53 WeakPolarHBondContact O-CG2 3.46Å; I49-V53 PolarHBondContact O-N 3.1Å; I49-T191 HydrophobicContact CB-CG2 4.05Å; I49-T191 HydrophobicContact CG2-CG2 3.85Å; I49-M195 HydrophobicContact CG2-CG 4.06Å; I49-M195 HydrophobicContact CG2-SD 3.49Å; I49-M195 WeakPolarHBondContact CG2-SD 3.37Å; I49-T272 HydrophobicContact CD1-CG2 4.27Å; I49-V273 HydrophobicContact CG1-CG2 4.44Å |
| 50 | G | 87.9 | Confident | 87.4 | Confident | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -69.1 | -21.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 115 | S46 F47 I48 Q187 T191 K194 | S46-G50 WeakPolarHBondContact O-CA 3.37Å; S46-G50 PolarHBondContact O-N 3.46Å; F47-G50 PolarHBondContact O-N 3.15Å; I48-G50 PolarHBondContact O-N 3.09Å; G50-Q187 PolarHBondContact O-NE2 2.84Å; G50-T191 VanDerWaalsContact CA-OG1 3.3Å; G50-T191 WeakPolarHBondContact CA-OG1 3.28Å; G50-K194 PolarHBondContact O-NZ 3.38Å |
| 51 | T | 87.4 | Confident | 87.7 | Confident | 10 Ų | 10 | 16.1 Ų | 16.1 | 6% | 0.061 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -91.5 | -39.4 | 175.8 | 43.7 | 0 | 0 | 0 | 0 | 112.1 | F47 I48 I49 Y247 | F47-T51 HydrophobicContact CE1-CG2 4.16Å; F47-T51 HydrophobicContact CZ-CG2 4.13Å; F47-T51 WeakPolarHBondContact O-CB 3.45Å; F47-T51 WeakPolarHBondContact O-CG2 3.33Å; F47-T51 PolarHBondContact O-N 3.14Å; F47-T51 PolarHBondContact O-OG1 2.78Å; I48-T51 WeakPolarHBondContact CA-OG1 3.33Å; I48-T51 PolarHBondContact O-N 3Å; I48-T51 VanDerWaalsContact O-N 3.12Å; I48-T51 PolarHBondContact O-OG1 2.6Å; I49-T51 VanDerWaalsContact C-N 3.29Å; I49-T51 PolarHBondContact O-N 2.7Å; T51-Y247 HydrophobicContact CG2-CD2 4.03Å; T51-Y247 HydrophobicContact CG2-CG 4.23Å |
| 52 | V | 90.4 | Very high | 87.8 | Confident | 5 Ų | 5 | 14.8 Ų | 14.8 | 3% | 0.03 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -72.9 | -49.6 | 177.6 | 179.1 | 0 | 0 | 0 | 0 | 110.7 | I48 G54 W245 M270 V273 Y277 | I48-V52 HydrophobicContact CG2-CG2 3.97Å; I48-V52 WeakPolarHBondContact O-CG2 3.33Å; I48-V52 PolarHBondContact O-N 2.77Å; V52-G54 PolarHBondContact O-N 2.71Å; V52-W245 HydrophobicContact CG2-CB 4.17Å; V52-W245 VanDerWaalsContact CG2-N 3.33Å; V52-M270 HydrophobicContact CG2-SD 4.47Å; V52-V273 HydrophobicContact CB-CG2 4.44Å; V52-V273 HydrophobicContact CG1-CG1 3.79Å; V52-V273 HydrophobicContact CG1-CG2 4.25Å; V52-Y277 PolarHBondContact O-OH 2.95Å |
| 53 | V | 89.6 | Confident | 87.8 | Confident | 1 Ų | 1 | 9.7 Ų | 9.7 | 1% | 0.006 | 6% | 0.059 | C | C | . | . | S | Bend | trans | -75.1 | 101.8 | 175 | -173.9 | 0 | 0 | 0 | 0 | 109 | I49 K194 L198 V273 Y277 | I49-V53 HydrophobicContact CG2-CG2 3.96Å; I49-V53 WeakPolarHBondContact O-CA 3.34Å; I49-V53 WeakPolarHBondContact O-CB 3.49Å; I49-V53 WeakPolarHBondContact O-CG2 3.46Å; I49-V53 PolarHBondContact O-N 3.1Å; V53-K194 HydrophobicContact CB-CD 3.75Å; V53-K194 HydrophobicContact CG1-CD 3.77Å; V53-K194 HydrophobicContact CG1-CG 4.17Å; V53-K194 VanDerWaalsContact O-CD 3.28Å; V53-K194 WeakPolarHBondContact O-CD 3.43Å; V53-K194 PolarHBondContact O-NZ 3Å; V53-L198 HydrophobicContact CG1-CD1 3.88Å; V53-V273 HydrophobicContact CG2-CG1 4.3Å; V53-V273 HydrophobicContact CG2-CG2 3.71Å; V53-Y277 WeakPolarHBondContact CA-OH 3.47Å; V53-Y277 HydrophobicContact CG1-CE1 4.42Å; V53-Y277 HydrophobicContact CG2-CE1 4.05Å |
| 54 | G | 84.1 | Confident | 88.1 | Confident | 3 Ų | 3 | 7.4 Ų | 7.4 | 3% | 0.031 | 4% | 0.044 | C | C | . | . | S | Bend | trans | -143.3 | -139.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | V52 G56 F58 | V52-G54 PolarHBondContact O-N 2.71Å; G54-G56 PolarHBondContact O-N 3.45Å; G54-F58 WeakPolarHBondContact O-CD2 3.41Å; G54-F58 WeakPolarHBondContact O-CE2 3.26Å |
| 55 | S | 80.9 | Confident | 88.2 | Confident | 3 Ų | 3 | 7.7 Ų | 7.7 | 2% | 0.021 | 5% | 0.046 | C | C | . | . | S | Bend | trans | -64.8 | -20.5 | 177.7 | 59.7 | 0 | 0 | 0 | 0 | 113.6 | I57 F58 I59 | S55-I57 PolarHBondContact O-N 2.91Å; S55-F58 PolarHBondContact O-N 2.83Å; S55-F58 VanDerWaalsContact O-N 3.16Å; S55-I59 WeakPolarHBondContact O-CG1 3.34Å; S55-I59 PolarHBondContact O-N 2.84Å |
| 56 | G | 86.1 | Confident | 88.1 | Confident | 5 Ų | 5 | 12 Ų | 12 | 5% | 0.052 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -56.8 | -50 | -172.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | G54 F58 I59 A60 | G54-G56 PolarHBondContact O-N 3.45Å; G56-F58 PolarHBondContact O-N 3.36Å; G56-I59 PolarHBondContact O-N 2.92Å; G56-A60 WeakPolarHBondContact O-CB 3.32Å; G56-A60 PolarHBondContact O-N 2.85Å |
| 57 | I | 90.6 | Very high | 88 | Confident | 0 Ų | 0 | 12.7 Ų | 12.7 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -65.8 | -20.2 | -178.9 | -170.5 | 54.9 | 0 | 0 | 0 | 113.5 | S55 P61 W78 L198 Y277 V280 | S55-I57 PolarHBondContact O-N 2.91Å; I57-P61 WeakPolarHBondContact O-CD 3.4Å; I57-P61 WeakPolarHBondContact O-CG 3.25Å; I57-W78 HydrophobicContact CD1-CE3 4.5Å; I57-W78 HydrophobicContact CD1-CH2 3.58Å; I57-W78 HydrophobicContact CD1-CZ2 4.16Å; I57-W78 HydrophobicContact CD1-CZ3 3.78Å; I57-L198 HydrophobicContact CG2-CD2 4.28Å; I57-Y277 HydrophobicContact CB-CD1 4.12Å; I57-Y277 HydrophobicContact CB-CE1 3.66Å; I57-Y277 HydrophobicContact CB-CE2 4.45Å; I57-Y277 HydrophobicContact CD1-CD1 3.73Å; I57-Y277 HydrophobicContact CD1-CD2 4.16Å; I57-Y277 HydrophobicContact CD1-CE1 4.18Å; I57-Y277 HydrophobicContact CD1-CG 3.7Å; I57-Y277 HydrophobicContact CG1-CD1 3.75Å; I57-Y277 HydrophobicContact CG1-CE1 3.83Å; I57-Y277 HydrophobicContact CG1-CG 4.25Å; I57-Y277 HydrophobicContact CG2-CE1 4.13Å; I57-V280 HydrophobicContact CD1-CG1 4.25Å; I57-V280 HydrophobicContact CG1-CG1 4.02Å |
| 58 | F | 86.9 | Confident | 88 | Confident | 1 Ų | 1 | 12.1 Ų | 12.1 | 0% | 0.004 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -96.1 | -13.9 | -179 | -50.9 | -66.7 | 0 | 0 | 0 | 113.3 | G54 S55 G56 Y145 L198 I201 A300 V319 | G54-F58 WeakPolarHBondContact O-CD2 3.41Å; G54-F58 WeakPolarHBondContact O-CE2 3.26Å; S55-F58 PolarHBondContact O-N 2.83Å; S55-F58 VanDerWaalsContact O-N 3.16Å; G56-F58 PolarHBondContact O-N 3.36Å; F58-Y145 HydrophobicContact CB-CE2 4.09Å; F58-Y145 VanDerWaalsContact CB-OH 3.25Å; F58-Y145 WeakPolarHBondContact CB-OH 3.48Å; F58-Y145 PolarHBondContact O-OH 2.72Å; F58-Y145 VanDerWaalsContact O-OH 3.13Å; F58-L198 HydrophobicContact CE1-CD2 4.06Å; F58-L198 HydrophobicContact CZ-CD2 3.89Å; F58-I201 HydrophobicContact CE1-CD1 4.07Å; F58-A300 HydrophobicContact CD1-CB 3.85Å; F58-A300 HydrophobicContact CE1-CB 4.34Å; F58-V319 HydrophobicContact CB-CG1 4.33Å; F58-V319 HydrophobicContact CD1-CG1 4.27Å; F58-V319 HydrophobicContact CD1-CG2 4.03Å; F58-V319 HydrophobicContact CD2-CG1 3.49Å; F58-V319 VanDerWaalsContact CD2-CG1 3.49Å; F58-V319 HydrophobicContact CD2-CG2 4.44Å; F58-V319 HydrophobicContact CE1-CG1 4.47Å; F58-V319 HydrophobicContact CE1-CG2 3.71Å; F58-V319 HydrophobicContact CE2-CB 4.33Å; F58-V319 HydrophobicContact CE2-CG1 3.73Å; F58-V319 HydrophobicContact CE2-CG2 4.14Å; F58-V319 HydrophobicContact CG-CG1 3.78Å; F58-V319 HydrophobicContact CG-CG2 4.38Å; F58-V319 HydrophobicContact CZ-CB 4.42Å; F58-V319 HydrophobicContact CZ-CG1 4.21Å; F58-V319 HydrophobicContact CZ-CG2 3.76Å |
| 59 | I | 84.5 | Confident | 87.7 | Confident | 19 Ų | 19 | 13.9 Ų | 13.9 | 10% | 0.097 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -109 | -44.1 | -179.9 | -62.3 | 171.4 | 0 | 0 | 0 | 110.9 | S55 G56 A141 I381 Y382 | S55-I59 WeakPolarHBondContact O-CG1 3.34Å; S55-I59 PolarHBondContact O-N 2.84Å; G56-I59 PolarHBondContact O-N 2.92Å; I59-A141 HydrophobicContact CD1-CB 3.86Å; I59-I381 HydrophobicContact CD1-CG2 4.31Å; I59-Y382 HydrophobicContact CG2-CE1 4.21Å |
| 60 | A | 88.7 | Confident | 87.5 | Confident | 4 Ų | 4 | 13.6 Ų | 13.6 | 3% | 0.033 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -62.6 | -32.3 | -173.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | G56 K62 G63 V64 W78 N237 Y240 A241 | G56-A60 WeakPolarHBondContact O-CB 3.32Å; G56-A60 PolarHBondContact O-N 2.85Å; A60-K62 PolarHBondContact O-N 3.41Å; A60-G63 PolarHBondContact O-N 3.48Å; A60-V64 WeakPolarHBondContact O-CG2 3.44Å; A60-V64 PolarHBondContact O-N 2.84Å; A60-W78 HydrophobicContact CB-CH2 3.83Å; A60-W78 HydrophobicContact CB-CZ2 3.95Å; A60-N237 WeakPolarHBondContact CB-O 3.27Å; A60-Y240 HydrophobicContact CB-CD1 4.45Å; A60-A241 HydrophobicContact CB-CB 3.9Å |
| 61 | P | 90.9 | Very high | 87.5 | Confident | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -54.1 | -39.1 | -178.7 | -29.3 | 35.9 | 0 | 0 | 0 | 113.8 | I57 V64 L65 W78 Y284 L293 | I57-P61 WeakPolarHBondContact O-CD 3.4Å; I57-P61 WeakPolarHBondContact O-CG 3.25Å; P61-V64 PolarHBondContact O-N 3.5Å; P61-L65 VanDerWaalsContact O-CB 3.27Å; P61-L65 WeakPolarHBondContact O-CB 3.24Å; P61-L65 PolarHBondContact O-N 2.89Å; P61-W78 HydrophobicContact CG-CZ2 3.97Å; P61-Y284 HydrophobicContact CB-CD2 4.47Å; P61-Y284 HydrophobicContact CG-CD2 4.32Å; P61-Y284 HydrophobicContact CG-CE2 4.11Å; P61-L293 HydrophobicContact CB-CD2 4.34Å |
| 62 | K | 88.9 | Confident | 87.6 | Confident | 38 Ų | 38 | 13.9 Ų | 13.9 | 17% | 0.165 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -60.8 | -49.4 | 175.6 | 178.1 | 170.7 | -179.4 | 157 | 0 | 111.4 | A60 M66 L293 L294 S296 D297 | A60-K62 PolarHBondContact O-N 3.41Å; K62-M66 VanDerWaalsContact O-CB 3.24Å; K62-M66 WeakPolarHBondContact O-CB 3.44Å; K62-M66 PolarHBondContact O-N 3Å; K62-L293 HydrophobicContact CB-CD2 4.31Å; K62-L294 WeakPolarHBondContact CE-O 3.39Å; K62-L294 HydrophobicContact CG-CD2 4.42Å; K62-L294 PolarHBondContact NZ-O 3.33Å; K62-L294 VanDerWaalsContact NZ-O 3.09Å; K62-S296 WeakPolarHBondContact CD-O 3.33Å; K62-S296 PolarHBondContact NZ-O 2.77Å; K62-D297 IonicContact NZ-OD1 2.81Å; K62-D297 PolarHBondContact NZ-OD1 3.27Å |
| 63 | G | 86.4 | Confident | 87.5 | Confident | 11 Ų | 11 | 15 Ų | 15 | 11% | 0.113 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -70.2 | -31.5 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | A60 N67 N237 | A60-G63 PolarHBondContact O-N 3.48Å; G63-N67 WeakPolarHBondContact O-CB 3.22Å; G63-N67 PolarHBondContact O-N 3.09Å; G63-N67 PolarHBondContact O-ND2 3.36Å; G63-N67 VanDerWaalsContact O-ND2 3.11Å; G63-N237 VanDerWaalsContact C-ND2 3.31Å; G63-N237 WeakPolarHBondContact CA-ND2 3.37Å; G63-N237 PolarHBondContact O-ND2 3.39Å; G63-N237 VanDerWaalsContact O-ND2 3.11Å |
| 64 | V | 90.8 | Very high | 87.6 | Confident | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -73.2 | -45.2 | 175.7 | 177.9 | 0 | 0 | 0 | 0 | 110.1 | A60 P61 N67 S68 S74 V77 W78 A234 N237 | A60-V64 WeakPolarHBondContact O-CG2 3.44Å; A60-V64 PolarHBondContact O-N 2.84Å; P61-V64 PolarHBondContact O-N 3.5Å; V64-N67 PolarHBondContact O-N 2.9Å; V64-S68 VanDerWaalsContact O-CB 3.31Å; V64-S68 WeakPolarHBondContact O-CB 3.44Å; V64-S68 PolarHBondContact O-N 3.46Å; V64-S68 PolarHBondContact O-OG 2.92Å; V64-S74 WeakPolarHBondContact CG1-OG 3.48Å; V64-V77 HydrophobicContact CG1-CB 4.17Å; V64-V77 HydrophobicContact CG1-CG1 3.92Å; V64-W78 HydrophobicContact CG2-CZ2 4.28Å; V64-A234 HydrophobicContact CG1-CB 4.44Å; V64-N237 HydrophobicContact CG2-CB 3.91Å |
| 65 | L | 90.2 | Very high | 88 | Confident | 6 Ų | 6 | 16.2 Ų | 16.2 | 3% | 0.031 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -64.6 | -44.6 | 178.6 | -176 | 65.8 | 0 | 0 | 0 | 111.8 | P61 N67 S68 G69 V71 Y285 P290 L293 L294 | P61-L65 VanDerWaalsContact O-CB 3.27Å; P61-L65 WeakPolarHBondContact O-CB 3.24Å; P61-L65 PolarHBondContact O-N 2.89Å; L65-N67 PolarHBondContact O-N 2.93Å; L65-S68 WeakPolarHBondContact CA-OG 3.31Å; L65-S68 PolarHBondContact O-N 3.41Å; L65-S68 PolarHBondContact O-OG 3.37Å; L65-G69 PolarHBondContact O-N 3.4Å; L65-V71 HydrophobicContact CD1-CG2 4.35Å; L65-Y285 HydrophobicContact CD1-CE1 4.12Å; L65-Y285 HydrophobicContact CD2-CE1 4.1Å; L65-P290 HydrophobicContact CD2-CB 4.06Å; L65-L293 HydrophobicContact CB-CD2 4.41Å; L65-L293 HydrophobicContact CD2-CB 4.28Å; L65-L293 HydrophobicContact CD2-CD2 3.85Å; L65-L293 HydrophobicContact CD2-CG 4.47Å; L65-L294 HydrophobicContact CB-CD2 4.19Å; L65-L294 HydrophobicContact CD2-CD2 4.03Å; L65-L294 HydrophobicContact CD2-CG 3.98Å; L65-L294 HydrophobicContact CG-CD2 4.2Å |
| 66 | M | 88.6 | Confident | 88.6 | Confident | 114 Ų | 114 | 20.1 Ų | 20.1 | 56% | 0.562 | 12% | 0.118 | S | C | * | . | H | α-helix | trans | -59 | -34.5 | 179.5 | -174.3 | 176.8 | -178.8 | 0 | 0 | 113 | K62 L294 | K62-M66 VanDerWaalsContact O-CB 3.24Å; K62-M66 WeakPolarHBondContact O-CB 3.44Å; K62-M66 PolarHBondContact O-N 3Å; M66-L294 HydrophobicContact CB-CD2 3.86Å |
| 67 | N | 87.2 | Confident | 88.9 | Confident | 21 Ų | 21 | 20 Ų | 20 | 11% | 0.112 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -95.9 | -17.9 | -176.7 | -70 | -27.4 | 0 | 0 | 0 | 114 | G63 V64 L65 T227 R230 L233 A234 N237 | G63-N67 WeakPolarHBondContact O-CB 3.22Å; G63-N67 PolarHBondContact O-N 3.09Å; G63-N67 PolarHBondContact O-ND2 3.36Å; G63-N67 VanDerWaalsContact O-ND2 3.11Å; V64-N67 PolarHBondContact O-N 2.9Å; L65-N67 PolarHBondContact O-N 2.93Å; N67-T227 PolarHBondContact O-OG1 3.04Å; N67-R230 HydrophobicContact CB-CB 4.27Å; N67-R230 CarbonylContact O-C 3.55Å; N67-R230 WeakPolarHBondContact O-CB 2.99Å; N67-L233 HydrophobicContact CB-CB 4.27Å; N67-L233 WeakPolarHBondContact ND2-CB 3.24Å; N67-A234 HydrophobicContact CB-CB 3.81Å; N67-N237 PolarHBondContact ND2-ND2 3.37Å; N67-N237 VanDerWaalsContact ND2-ND2 3.18Å |
| 68 | S | 86.3 | Confident | 89.2 | Confident | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -90.8 | -25.5 | 173.9 | 53.8 | 0 | 0 | 0 | 0 | 112.2 | V64 L65 S70 S74 | V64-S68 VanDerWaalsContact O-CB 3.31Å; V64-S68 WeakPolarHBondContact O-CB 3.44Å; V64-S68 PolarHBondContact O-N 3.46Å; V64-S68 PolarHBondContact O-OG 2.92Å; L65-S68 WeakPolarHBondContact CA-OG 3.31Å; L65-S68 PolarHBondContact O-N 3.41Å; L65-S68 PolarHBondContact O-OG 3.37Å; S68-S70 PolarHBondContact O-N 3.32Å; S68-S74 WeakPolarHBondContact OG-CB 3.44Å |
| 69 | G | 83.6 | Confident | 89.6 | Confident | 38 Ų | 38 | 21.5 Ų | 21.5 | 39% | 0.392 | 13% | 0.129 | S | C | . | . | trans | 71.5 | -19.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | L65 S225 | L65-G69 PolarHBondContact O-N 3.4Å; G69-S225 WeakPolarHBondContact CA-O 3.48Å | ||
| 70 | S | 87.4 | Confident | 90.1 | Very high | 6 Ų | 6 | 24.4 Ų | 24.4 | 4% | 0.042 | 14% | 0.144 | C | C | . | . | S | Bend | trans | -133 | 143.2 | -174.4 | -160.9 | 0 | 0 | 0 | 0 | 112.4 | S68 S74 G220 S225 | S68-S70 PolarHBondContact O-N 3.32Å; S70-S74 WeakPolarHBondContact O-CB 3.45Å; S70-S74 PolarHBondContact O-N 3.43Å; S70-G220 PolarHBondContact OG-O 3.31Å; S70-S225 WeakPolarHBondContact CB-OG 3.14Å; S70-S225 PolarHBondContact OG-OG 3.31Å |
| 71 | V | 88.2 | Confident | 90.4 | Very high | 10 Ų | 10 | 24.2 Ų | 24.2 | 6% | 0.061 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -65.4 | -44.9 | -175.6 | 175.9 | 0 | 0 | 0 | 0 | 111.9 | L65 S74 L75 F217 Y285 P290 | L65-V71 HydrophobicContact CD1-CG2 4.35Å; V71-S74 WeakPolarHBondContact O-CB 3.49Å; V71-S74 PolarHBondContact O-N 2.85Å; V71-L75 PolarHBondContact O-N 3.05Å; V71-L75 VanDerWaalsContact O-N 3.13Å; V71-F217 HydrophobicContact CG1-CE1 4.45Å; V71-Y285 HydrophobicContact CG1-CD1 4.03Å; V71-Y285 HydrophobicContact CG1-CD2 3.48Å; V71-Y285 VanDerWaalsContact CG1-CD2 3.48Å; V71-Y285 HydrophobicContact CG1-CE1 4.42Å; V71-Y285 HydrophobicContact CG1-CE2 3.91Å; V71-Y285 HydrophobicContact CG1-CG 3.55Å; V71-Y285 HydrophobicContact CG2-CD1 4.35Å; V71-P290 HydrophobicContact CG2-CG 3.76Å |
| 72 | G | 88.5 | Confident | 90.5 | Very high | 7 Ų | 7 | 24.3 Ų | 24.3 | 7% | 0.072 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -66.8 | -40.4 | 180 | 0 | 0 | 0 | 0 | 0 | 112.2 | L75 L76 G220 | G72-L75 PolarHBondContact O-N 3.4Å; G72-L76 PolarHBondContact O-N 3.02Å; G72-L76 VanDerWaalsContact O-N 3.09Å; G72-G220 WeakPolarHBondContact CA-O 3.23Å; G72-G220 PolarHBondContact N-O 3.49Å |
| 73 | L | 89 | Confident | 90.8 | Very high | 28 Ų | 28 | 26.3 Ų | 26.3 | 15% | 0.147 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -65.7 | -40.1 | 174.9 | -170.2 | 63.3 | 0 | 0 | 0 | 111.8 | L75 L76 V77 I226 L231 | L73-L75 VanDerWaalsContact C-N 3.34Å; L73-L75 PolarHBondContact O-N 2.91Å; L73-L76 PolarHBondContact O-N 2.93Å; L73-V77 WeakPolarHBondContact O-CG2 3.44Å; L73-V77 PolarHBondContact O-N 3.49Å; L73-I226 HydrophobicContact CD2-CG1 4.44Å; L73-I226 HydrophobicContact CD2-CG2 3.81Å; L73-L231 HydrophobicContact CD1-CD1 4.35Å; L73-L231 HydrophobicContact CD2-CD1 3.97Å; L73-L231 HydrophobicContact CG-CD1 4.14Å |
| 74 | S | 91.6 | Very high | 91.2 | Very high | 0 Ų | 0 | 27.1 Ų | 27.1 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -55.6 | -47 | 173.2 | 178.3 | 0 | 0 | 0 | 0 | 111.8 | V64 S68 S70 V71 L76 V77 W78 Y285 | V64-S74 WeakPolarHBondContact CG1-OG 3.48Å; S68-S74 WeakPolarHBondContact OG-CB 3.44Å; S70-S74 WeakPolarHBondContact O-CB 3.45Å; S70-S74 PolarHBondContact O-N 3.43Å; V71-S74 WeakPolarHBondContact O-CB 3.49Å; V71-S74 PolarHBondContact O-N 2.85Å; S74-L76 PolarHBondContact O-N 3.38Å; S74-V77 WeakPolarHBondContact O-CB 3.39Å; S74-V77 PolarHBondContact O-N 3.48Å; S74-V77 VanDerWaalsContact O-N 3.17Å; S74-W78 PolarHBondContact O-N 3.42Å; S74-Y285 WeakPolarHBondContact CB-OH 2.98Å; S74-Y285 PolarHBondContact OG-OH 3.48Å |
| 75 | L | 92.9 | Very high | 91.4 | Very high | 29 Ų | 29 | 27.2 Ų | 27.2 | 15% | 0.152 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -63.3 | -39.7 | 178.1 | -68.7 | 173.8 | 0 | 0 | 0 | 112.7 | V71 G72 L73 V77 W78 A79 F217 N281 V282 Y285 | V71-L75 PolarHBondContact O-N 3.05Å; V71-L75 VanDerWaalsContact O-N 3.13Å; G72-L75 PolarHBondContact O-N 3.4Å; L73-L75 VanDerWaalsContact C-N 3.34Å; L73-L75 PolarHBondContact O-N 2.91Å; L75-V77 VanDerWaalsContact C-N 3.34Å; L75-W78 PolarHBondContact O-N 3.03Å; L75-A79 PolarHBondContact O-N 3.4Å; L75-F217 HydrophobicContact CD1-CE1 4.01Å; L75-N281 HydrophobicContact CD2-CB 3.7Å; L75-V282 HydrophobicContact CD1-CG2 4.15Å; L75-V282 HydrophobicContact CD2-CG2 3.94Å; L75-Y285 HydrophobicContact CD1-CD2 4.41Å; L75-Y285 HydrophobicContact CD2-CD2 4.02Å; L75-Y285 HydrophobicContact CD2-CE2 3.89Å; L75-Y285 HydrophobicContact CG-CD2 4.19Å; L75-Y285 HydrophobicContact CG-CE2 4.04Å |
| 76 | L | 93.1 | Very high | 91.6 | Very high | 86 Ų | 86 | 28.8 Ų | 28.8 | 45% | 0.45 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -62.5 | -41.9 | 172.9 | -71.4 | 177.7 | 0 | 0 | 0 | 111.5 | G72 L73 S74 W78 A79 L80 F221 | G72-L76 PolarHBondContact O-N 3.02Å; G72-L76 VanDerWaalsContact O-N 3.09Å; L73-L76 PolarHBondContact O-N 2.93Å; S74-L76 PolarHBondContact O-N 3.38Å; L76-W78 VanDerWaalsContact C-N 3.34Å; L76-W78 PolarHBondContact O-N 3.04Å; L76-A79 PolarHBondContact O-N 2.77Å; L76-L80 WeakPolarHBondContact O-CB 3.4Å; L76-L80 VanDerWaalsContact O-CG 3.27Å; L76-L80 WeakPolarHBondContact O-CG 3.28Å; L76-L80 PolarHBondContact O-N 3.31Å; L76-F221 HydrophobicContact CD1-CE1 3.81Å; L76-F221 HydrophobicContact CD1-CZ 4.34Å; L76-F221 HydrophobicContact CG-CE1 4.49Å |
| 77 | V | 93.6 | Very high | 91.9 | Very high | 2 Ų | 2 | 25.7 Ų | 25.7 | 1% | 0.012 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -59.4 | -45.1 | 176.1 | 170.8 | 0 | 0 | 0 | 0 | 110.5 | V64 L73 S74 L75 L80 C81 L231 A234 F235 | V64-V77 HydrophobicContact CG1-CB 4.17Å; V64-V77 HydrophobicContact CG1-CG1 3.92Å; L73-V77 WeakPolarHBondContact O-CG2 3.44Å; L73-V77 PolarHBondContact O-N 3.49Å; S74-V77 WeakPolarHBondContact O-CB 3.39Å; S74-V77 PolarHBondContact O-N 3.48Å; S74-V77 VanDerWaalsContact O-N 3.17Å; L75-V77 VanDerWaalsContact C-N 3.34Å; V77-L80 PolarHBondContact O-N 2.92Å; V77-C81 VanDerWaalsContact O-CB 3.27Å; V77-C81 WeakPolarHBondContact O-CB 3Å; V77-C81 PolarHBondContact O-N 3.48Å; V77-C81 PolarHBondContact O-SG 3.31Å; V77-L231 HydrophobicContact CG2-CD1 3.76Å; V77-A234 HydrophobicContact CG1-CB 4.23Å; V77-A234 HydrophobicContact CG2-CB 4.31Å; V77-F235 HydrophobicContact CG1-CD1 4.34Å; V77-F235 HydrophobicContact CG1-CG 4.36Å; V77-F235 HydrophobicContact CG2-CD2 4.47Å; V77-F235 HydrophobicContact CG2-CE2 4.13Å; V77-F235 HydrophobicContact CG2-CZ 4.32Å |
| 78 | W | 95.3 | Very high | 92.2 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -59 | -48.1 | 175.4 | -81 | 102.2 | 0 | 0 | 0 | 112.4 | I57 A60 P61 V64 S74 L75 L76 C81 G82 A241 Y242 Y277 V278 N281 | I57-W78 HydrophobicContact CD1-CE3 4.5Å; I57-W78 HydrophobicContact CD1-CH2 3.58Å; I57-W78 HydrophobicContact CD1-CZ2 4.16Å; I57-W78 HydrophobicContact CD1-CZ3 3.78Å; A60-W78 HydrophobicContact CB-CH2 3.83Å; A60-W78 HydrophobicContact CB-CZ2 3.95Å; P61-W78 HydrophobicContact CG-CZ2 3.97Å; V64-W78 HydrophobicContact CG2-CZ2 4.28Å; S74-W78 PolarHBondContact O-N 3.42Å; L75-W78 PolarHBondContact O-N 3.03Å; L76-W78 VanDerWaalsContact C-N 3.34Å; L76-W78 PolarHBondContact O-N 3.04Å; W78-C81 PolarHBondContact O-N 3.04Å; W78-G82 PolarHBondContact O-N 2.78Å; W78-A241 HydrophobicContact CH2-CB 3.52Å; W78-A241 HydrophobicContact CZ3-CB 3.57Å; W78-Y242 AromaticContact CE3-CE2 3.61Å; W78-Y242 HydrophobicContact CE3-CE2 3.61Å; W78-Y242 AromaticContact CZ3-CE2 3.98Å; W78-Y242 HydrophobicContact CZ3-CE2 3.98Å; W78-Y242 WeakPolarHBondContact O-CE2 3.28Å; W78-Y242 PolarHBondContact O-OH 3.47Å; W78-Y277 AromaticContact CE3-CD2 3.88Å; W78-Y277 HydrophobicContact CE3-CD2 3.88Å; W78-Y277 HydrophobicContact CE3-CG 4.34Å; W78-Y277 HydrophobicContact CH2-CD2 4.5Å; W78-Y277 AromaticContact CZ3-CD2 3.43Å; W78-Y277 HydrophobicContact CZ3-CD2 3.43Å; W78-Y277 VanDerWaalsContact CZ3-CD2 3.43Å; W78-Y277 HydrophobicContact CZ3-CE2 4.02Å; W78-Y277 HydrophobicContact CZ3-CG 4.07Å; W78-V278 HydrophobicContact CB-CG2 4.32Å; W78-N281 PolarHBondContact NE1-ND2 3.45Å; W78-N281 PolarHBondContact NE1-OD1 2.88Å |
| 79 | A | 95.9 | Very high | 92.5 | Very high | 32 Ų | 32 | 24.7 Ų | 24.7 | 26% | 0.264 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -61.8 | -46 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L75 L76 G82 I83 V278 | L75-A79 PolarHBondContact O-N 3.4Å; L76-A79 PolarHBondContact O-N 2.77Å; A79-G82 PolarHBondContact O-N 3.17Å; A79-I83 WeakPolarHBondContact O-CG1 3.3Å; A79-I83 PolarHBondContact O-N 3.11Å; A79-V278 HydrophobicContact CB-CG2 4.33Å |
| 80 | L | 94.8 | Very high | 93 | Very high | 81 Ų | 81 | 24 Ų | 24 | 42% | 0.424 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -67.1 | -37.2 | 178.9 | -69.1 | 172.9 | 0 | 0 | 0 | 111.9 | L76 V77 G82 I83 L84 F235 | L76-L80 WeakPolarHBondContact O-CB 3.4Å; L76-L80 VanDerWaalsContact O-CG 3.27Å; L76-L80 WeakPolarHBondContact O-CG 3.28Å; L76-L80 PolarHBondContact O-N 3.31Å; V77-L80 PolarHBondContact O-N 2.92Å; L80-G82 VanDerWaalsContact C-N 3.29Å; L80-G82 PolarHBondContact O-N 3.48Å; L80-I83 HydrophobicContact CD2-CD1 4.46Å; L80-I83 PolarHBondContact O-N 3.29Å; L80-L84 WeakPolarHBondContact O-CB 3.22Å; L80-L84 VanDerWaalsContact O-CG 3.28Å; L80-L84 WeakPolarHBondContact O-CG 3.06Å; L80-L84 PolarHBondContact O-N 3.02Å; L80-F235 HydrophobicContact CB-CE1 3.68Å; L80-F235 HydrophobicContact CB-CZ 4.1Å; L80-F235 HydrophobicContact CD1-CE1 4.27Å; L80-F235 HydrophobicContact CD1-CZ 3.8Å |
| 81 | C | 94.4 | Very high | 93.3 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -62.1 | -37.8 | 173.1 | -71.6 | 0 | 0 | 0 | 0 | 111.7 | V77 W78 S85 F235 L239 Y242 | V77-C81 VanDerWaalsContact O-CB 3.27Å; V77-C81 WeakPolarHBondContact O-CB 3Å; V77-C81 PolarHBondContact O-N 3.48Å; V77-C81 PolarHBondContact O-SG 3.31Å; W78-C81 PolarHBondContact O-N 3.04Å; C81-S85 VanDerWaalsContact O-CB 3.22Å; C81-S85 WeakPolarHBondContact O-CB 3.41Å; C81-S85 PolarHBondContact O-N 3.18Å; C81-S85 PolarHBondContact O-OG 3.15Å; C81-F235 VanDerWaalsContact SG-CD1 3.57Å; C81-L239 HydrophobicContact CB-CD2 3.93Å; C81-L239 HydrophobicContact CB-CG 4.21Å; C81-Y242 HydrophobicContact CB-CD2 3.72Å; C81-Y242 HydrophobicContact CB-CE2 3.72Å |
| 82 | G | 94.9 | Very high | 93.5 | Very high | 1 Ų | 1 | 23.2 Ų | 23.2 | 1% | 0.01 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -62.6 | -45.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | W78 A79 L80 S85 L86 T274 | W78-G82 PolarHBondContact O-N 2.78Å; A79-G82 PolarHBondContact O-N 3.17Å; L80-G82 VanDerWaalsContact C-N 3.29Å; L80-G82 PolarHBondContact O-N 3.48Å; G82-S85 PolarHBondContact O-N 3.26Å; G82-L86 WeakPolarHBondContact O-CB 3.47Å; G82-L86 PolarHBondContact O-N 3.47Å; G82-T274 WeakPolarHBondContact CA-OG1 3.22Å |
| 83 | I | 95.3 | Very high | 93.7 | Very high | 81 Ų | 81 | 22.9 Ų | 22.9 | 42% | 0.415 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -63.5 | -47 | 177 | -65.7 | 167.1 | 0 | 0 | 0 | 111.2 | A79 L80 S85 L86 F87 | A79-I83 WeakPolarHBondContact O-CG1 3.3Å; A79-I83 PolarHBondContact O-N 3.11Å; L80-I83 HydrophobicContact CD2-CD1 4.46Å; L80-I83 PolarHBondContact O-N 3.29Å; I83-S85 VanDerWaalsContact C-N 3.3Å; I83-S85 PolarHBondContact O-N 3.13Å; I83-L86 WeakPolarHBondContact O-CB 3.4Å; I83-L86 PolarHBondContact O-N 3.3Å; I83-F87 HydrophobicContact CG2-CE1 3.96Å; I83-F87 HydrophobicContact CG2-CE2 3.99Å; I83-F87 HydrophobicContact CG2-CZ 3.66Å; I83-F87 WeakPolarHBondContact O-CG 3.43Å; I83-F87 PolarHBondContact O-N 3.39Å |
| 84 | L | 93.9 | Very high | 93.9 | Very high | 28 Ų | 28 | 21.7 Ų | 21.7 | 15% | 0.147 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -62 | -39.5 | 177.3 | -71.8 | 172.9 | 0 | 0 | 0 | 111.6 | L80 F87 G88 F235 L239 F427 V430 | L80-L84 WeakPolarHBondContact O-CB 3.22Å; L80-L84 VanDerWaalsContact O-CG 3.28Å; L80-L84 WeakPolarHBondContact O-CG 3.06Å; L80-L84 PolarHBondContact O-N 3.02Å; L84-F87 HydrophobicContact CD2-CD2 4.49Å; L84-F87 WeakPolarHBondContact O-CB 3.27Å; L84-F87 PolarHBondContact O-N 3.13Å; L84-G88 PolarHBondContact O-N 3.37Å; L84-F235 HydrophobicContact CD1-CD1 4.23Å; L84-F235 HydrophobicContact CD1-CE1 4.23Å; L84-L239 HydrophobicContact CB-CD2 4.16Å; L84-F427 VanDerWaalsContact O-CD2 3.29Å; L84-F427 WeakPolarHBondContact O-CD2 3.36Å; L84-F427 WeakPolarHBondContact O-CE2 3.38Å; L84-V430 HydrophobicContact CD1-CG1 4.23Å; L84-V430 HydrophobicContact CD2-CG1 4.31Å; L84-V430 HydrophobicContact CD2-CG2 4.09Å |
| 85 | S | 94.1 | Very high | 93.9 | Very high | 1 Ų | 1 | 21.9 Ų | 21.9 | 1% | 0.007 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -69 | -35.1 | 176.4 | -59.9 | 0 | 0 | 0 | 0 | 111.9 | C81 G82 I83 G88 A89 L239 Y242 | C81-S85 VanDerWaalsContact O-CB 3.22Å; C81-S85 WeakPolarHBondContact O-CB 3.41Å; C81-S85 PolarHBondContact O-N 3.18Å; C81-S85 PolarHBondContact O-OG 3.15Å; G82-S85 PolarHBondContact O-N 3.26Å; I83-S85 VanDerWaalsContact C-N 3.3Å; I83-S85 PolarHBondContact O-N 3.13Å; S85-G88 PolarHBondContact O-N 2.8Å; S85-A89 VanDerWaalsContact O-CB 3.3Å; S85-A89 WeakPolarHBondContact O-CB 3.48Å; S85-A89 PolarHBondContact O-N 3.09Å; S85-L239 WeakPolarHBondContact OG-CD2 3.49Å; S85-Y242 WeakPolarHBondContact OG-CB 3.46Å |
| 86 | L | 94.6 | Very high | 93.7 | Very high | 40 Ų | 40 | 20.5 Ų | 20.5 | 21% | 0.209 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -62.3 | -43.1 | 171.4 | 178.8 | 64.1 | 0 | 0 | 0 | 111 | G82 I83 G88 A89 L90 M270 | G82-L86 WeakPolarHBondContact O-CB 3.47Å; G82-L86 PolarHBondContact O-N 3.47Å; I83-L86 WeakPolarHBondContact O-CB 3.4Å; I83-L86 PolarHBondContact O-N 3.3Å; L86-G88 VanDerWaalsContact C-N 3.35Å; L86-G88 PolarHBondContact O-N 3.26Å; L86-A89 PolarHBondContact O-N 3.45Å; L86-L90 HydrophobicContact CD1-CD1 4.41Å; L86-L90 HydrophobicContact CD1-CG 4.19Å; L86-L90 HydrophobicContact CG-CD1 4.11Å; L86-L90 HydrophobicContact CG-CG 4.34Å; L86-L90 WeakPolarHBondContact O-CB 3.5Å; L86-L90 WeakPolarHBondContact O-CG 3.31Å; L86-L90 PolarHBondContact O-N 3.33Å; L86-M270 HydrophobicContact CD1-CB 3.92Å |
| 87 | F | 95 | Very high | 93.5 | Very high | 48 Ų | 48 | 16.6 Ų | 16.6 | 21% | 0.211 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -59 | -45.2 | 175 | -67.7 | -9.5 | 0 | 0 | 0 | 112.2 | I83 L84 L90 C91 I423 I426 F427 | I83-F87 HydrophobicContact CG2-CE1 3.96Å; I83-F87 HydrophobicContact CG2-CE2 3.99Å; I83-F87 HydrophobicContact CG2-CZ 3.66Å; I83-F87 WeakPolarHBondContact O-CG 3.43Å; I83-F87 PolarHBondContact O-N 3.39Å; L84-F87 HydrophobicContact CD2-CD2 4.49Å; L84-F87 WeakPolarHBondContact O-CB 3.27Å; L84-F87 PolarHBondContact O-N 3.13Å; F87-L90 PolarHBondContact O-N 3.41Å; F87-C91 PolarHBondContact O-N 2.84Å; F87-C91 PolarHBondContact O-SG 3.15Å; F87-I423 HydrophobicContact CB-CG2 3.63Å; F87-I423 HydrophobicContact CD1-CD1 4.38Å; F87-I423 HydrophobicContact CD1-CG1 4.44Å; F87-I423 HydrophobicContact CD1-CG2 3.75Å; F87-I423 HydrophobicContact CD2-CG2 4.36Å; F87-I423 HydrophobicContact CE1-CD1 4.29Å; F87-I423 HydrophobicContact CE1-CG1 4.39Å; F87-I423 HydrophobicContact CE1-CG2 4.5Å; F87-I423 HydrophobicContact CG-CG2 3.67Å; F87-I426 HydrophobicContact CD2-CG2 4.44Å; F87-F427 HydrophobicContact CB-CB 4.24Å; F87-F427 HydrophobicContact CB-CD2 4.31Å |
| 88 | G | 92.9 | Very high | 93.3 | Very high | 0 Ų | 0 | 17.2 Ų | 17.2 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -60.7 | -45.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | L84 S85 L86 L90 C91 Y92 W245 | L84-G88 PolarHBondContact O-N 3.37Å; S85-G88 PolarHBondContact O-N 2.8Å; L86-G88 VanDerWaalsContact C-N 3.35Å; L86-G88 PolarHBondContact O-N 3.26Å; G88-L90 PolarHBondContact O-N 3.33Å; G88-C91 WeakPolarHBondContact O-CB 3.49Å; G88-C91 PolarHBondContact O-N 3.35Å; G88-C91 VanDerWaalsContact O-N 3.16Å; G88-Y92 WeakPolarHBondContact O-CD2 3.38Å; G88-Y92 PolarHBondContact O-N 2.72Å; G88-W245 VanDerWaalsContact C-CH2 3.46Å; G88-W245 VanDerWaalsContact C-CZ3 3.48Å; G88-W245 WeakPolarHBondContact O-CZ3 3.28Å |
| 89 | A | 93.2 | Very high | 93 | Very high | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -66.1 | -38.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | S85 L86 C91 Y92 A93 W245 I266 M270 | S85-A89 VanDerWaalsContact O-CB 3.3Å; S85-A89 WeakPolarHBondContact O-CB 3.48Å; S85-A89 PolarHBondContact O-N 3.09Å; L86-A89 PolarHBondContact O-N 3.45Å; A89-C91 VanDerWaalsContact C-N 3.35Å; A89-Y92 PolarHBondContact O-N 3.02Å; A89-A93 PolarHBondContact O-N 3.32Å; A89-W245 HydrophobicContact CB-CB 3.94Å; A89-W245 HydrophobicContact CB-CD2 3.76Å; A89-W245 HydrophobicContact CB-CE3 3.61Å; A89-W245 HydrophobicContact CB-CG 3.9Å; A89-W245 HydrophobicContact CB-CZ3 4.35Å; A89-I266 HydrophobicContact CB-CG2 3.29Å; A89-M270 HydrophobicContact CB-CG 4.01Å |
| 90 | L | 94.1 | Very high | 92.2 | Very high | 23 Ų | 23 | 19.9 Ų | 19.9 | 12% | 0.12 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -61.6 | -42 | 171.8 | -71.5 | 173 | 0 | 0 | 0 | 111.6 | L86 F87 G88 Y92 A93 E94 I267 F417 V419 | L86-L90 HydrophobicContact CD1-CD1 4.41Å; L86-L90 HydrophobicContact CD1-CG 4.19Å; L86-L90 HydrophobicContact CG-CD1 4.11Å; L86-L90 HydrophobicContact CG-CG 4.34Å; L86-L90 WeakPolarHBondContact O-CB 3.5Å; L86-L90 WeakPolarHBondContact O-CG 3.31Å; L86-L90 PolarHBondContact O-N 3.33Å; F87-L90 PolarHBondContact O-N 3.41Å; G88-L90 PolarHBondContact O-N 3.33Å; L90-Y92 VanDerWaalsContact C-N 3.27Å; L90-Y92 PolarHBondContact O-N 2.85Å; L90-A93 WeakPolarHBondContact O-CB 3.45Å; L90-A93 PolarHBondContact O-N 3.39Å; L90-E94 PolarHBondContact O-N 2.95Å; L90-E94 VanDerWaalsContact O-N 3.13Å; L90-I267 HydrophobicContact CD2-CD1 3.84Å; L90-I267 HydrophobicContact CD2-CG1 3.7Å; L90-F417 HydrophobicContact CD2-CE1 4.23Å; L90-F417 HydrophobicContact CD2-CZ 3.85Å; L90-V419 HydrophobicContact CB-CG1 3.77Å; L90-V419 VanDerWaalsContact O-CG1 3.28Å; L90-V419 WeakPolarHBondContact O-CG1 3.38Å |
| 91 | C | 94.3 | Very high | 91.5 | Very high | 0 Ų | 0 | 20.5 Ų | 20.5 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -60.9 | -39.9 | 175.9 | -66.6 | 0 | 0 | 0 | 0 | 111.6 | F87 G88 A89 E94 L95 T400 M403 | F87-C91 PolarHBondContact O-N 2.84Å; F87-C91 PolarHBondContact O-SG 3.15Å; G88-C91 WeakPolarHBondContact O-CB 3.49Å; G88-C91 PolarHBondContact O-N 3.35Å; G88-C91 VanDerWaalsContact O-N 3.16Å; A89-C91 VanDerWaalsContact C-N 3.35Å; C91-E94 PolarHBondContact O-N 2.71Å; C91-L95 PolarHBondContact O-N 3.48Å; C91-L95 VanDerWaalsContact O-N 3.13Å; C91-T400 HydrophobicContact CB-CG2 4.33Å; C91-M403 VanDerWaalsContact CA-CE 3.45Å; C91-M403 HydrophobicContact CB-CE 3.58Å; C91-M403 WeakPolarHBondContact O-CE 3.44Å |
| 92 | Y | 92.3 | Very high | 90.7 | Very high | 1 Ų | 1 | 20.7 Ų | 20.7 | 0% | 0.004 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -73 | -30 | 175.9 | -87.2 | -112 | 0 | 0 | 0 | 113.4 | G88 A89 L90 E94 L95 G96 H105 Y108 W245 F246 N249 I396 A399 T400 | G88-Y92 WeakPolarHBondContact O-CD2 3.38Å; G88-Y92 PolarHBondContact O-N 2.72Å; A89-Y92 PolarHBondContact O-N 3.02Å; L90-Y92 VanDerWaalsContact C-N 3.27Å; L90-Y92 PolarHBondContact O-N 2.85Å; Y92-E94 VanDerWaalsContact C-N 3.3Å; Y92-E94 PolarHBondContact O-N 3.05Å; Y92-L95 PolarHBondContact O-N 3.06Å; Y92-G96 PolarHBondContact O-N 3.13Å; Y92-H105 AromaticContact CE1-CE1 3.3Å; Y92-H105 WeakPolarHBondContact CE1-CE1 3.48Å; Y92-H105 AromaticContact CE1-ND1 3.24Å; Y92-H105 WeakPolarHBondContact CE1-ND1 3.4Å; Y92-H105 AromaticContact CZ-CE1 3.46Å; Y92-H105 VanDerWaalsContact CZ-CE1 3.46Å; Y92-H105 AromaticContact CZ-ND1 3.38Å; Y92-H105 PolarHBondContact OH-CE1 3.06Å; Y92-H105 PolarHBondContact OH-ND1 3.07Å; Y92-Y108 HydrophobicContact CD1-CD2 4.28Å; Y92-Y108 AromaticContact CD1-CE2 3.78Å; Y92-Y108 HydrophobicContact CD1-CE2 3.78Å; Y92-Y108 HydrophobicContact CE1-CD2 4.07Å; Y92-Y108 AromaticContact CE1-CE2 3.99Å; Y92-Y108 HydrophobicContact CE1-CE2 3.99Å; Y92-W245 HydrophobicContact CD1-CZ3 4.15Å; Y92-W245 AromaticContact CD2-CH2 3.55Å; Y92-W245 HydrophobicContact CD2-CH2 3.55Å; Y92-W245 AromaticContact CD2-CZ3 3.31Å; Y92-W245 HydrophobicContact CD2-CZ3 3.31Å; Y92-W245 AromaticContact CE2-CH2 3.7Å; Y92-W245 HydrophobicContact CE2-CH2 3.7Å; Y92-W245 AromaticContact CE2-CZ3 3.87Å; Y92-W245 HydrophobicContact CE2-CZ3 3.87Å; Y92-W245 HydrophobicContact CG-CE3 4.45Å; Y92-W245 HydrophobicContact CG-CH2 4.17Å; Y92-W245 AromaticContact CG-CZ3 3.47Å; Y92-W245 HydrophobicContact CG-CZ3 3.47Å; Y92-W245 VanDerWaalsContact CG-CZ3 3.47Å; Y92-F246 HydrophobicContact CD1-CB 3.86Å; Y92-F246 HydrophobicContact CE1-CB 4.06Å; Y92-F246 HydrophobicContact CG-CB 4.44Å; Y92-N249 PolarHBondContact O-OD1 3.18Å; Y92-I396 HydrophobicContact CE2-CG2 4.28Å; Y92-A399 WeakPolarHBondContact OH-CB 3.43Å; Y92-T400 HydrophobicContact CE2-CG2 4.03Å |
| 93 | A | 92.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -61.5 | -40.4 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | A89 L90 T97 P263 I266 F417 | A89-A93 PolarHBondContact O-N 3.32Å; L90-A93 WeakPolarHBondContact O-CB 3.45Å; L90-A93 PolarHBondContact O-N 3.39Å; A93-T97 WeakPolarHBondContact O-CB 3.27Å; A93-T97 VanDerWaalsContact O-CG2 3.27Å; A93-T97 WeakPolarHBondContact O-CG2 3.48Å; A93-T97 PolarHBondContact O-N 3.5Å; A93-T97 PolarHBondContact O-OG1 3.34Å; A93-P263 HydrophobicContact CB-CB 4.36Å; A93-P263 HydrophobicContact CB-CG 4.35Å; A93-I266 HydrophobicContact CB-CD1 3.79Å; A93-F417 HydrophobicContact CB-CD1 3.95Å; A93-F417 HydrophobicContact CB-CE1 3.86Å |
| 94 | E | 92.8 | Very high | 89.4 | Confident | 3 Ų | 3 | 16.8 Ų | 16.8 | 1% | 0.014 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -64.9 | -45.3 | 172.6 | 169.7 | 167.8 | 169.3 | 0 | 0 | 112 | L90 C91 Y92 G96 T97 T98 M403 R407 R415 F417 K418 V419 | L90-E94 PolarHBondContact O-N 2.95Å; L90-E94 VanDerWaalsContact O-N 3.13Å; C91-E94 PolarHBondContact O-N 2.71Å; Y92-E94 VanDerWaalsContact C-N 3.3Å; Y92-E94 PolarHBondContact O-N 3.05Å; E94-G96 PolarHBondContact O-N 3.31Å; E94-T97 PolarHBondContact O-N 3.07Å; E94-T97 PolarHBondContact O-OG1 3.2Å; E94-T97 VanDerWaalsContact O-OG1 3.1Å; E94-T98 VanDerWaalsContact O-CB 3.28Å; E94-T98 WeakPolarHBondContact O-CB 3.49Å; E94-T98 PolarHBondContact O-N 3.16Å; E94-T98 PolarHBondContact O-OG1 3.47Å; E94-M403 HydrophobicContact CB-CE 3.99Å; E94-M403 HydrophobicContact CG-CE 4.1Å; E94-R407 IonicContact OE1-CZ 3.21Å; E94-R407 IonicContact OE1-NE 2.84Å; E94-R407 PolarHBondContact OE1-NE 3.26Å; E94-R407 IonicContact OE1-NH2 2.77Å; E94-R407 PolarHBondContact OE1-NH2 3.43Å; E94-R407 IonicContact OE2-CZ 3.53Å; E94-R407 IonicContact OE2-NE 3.88Å; E94-R407 IonicContact OE2-NH2 2.6Å; E94-R407 PolarHBondContact OE2-NH2 2.96Å; E94-R415 WeakPolarHBondContact OE1-CD 3.4Å; E94-F417 HydrophobicContact CB-CD1 4.17Å; E94-F417 WeakPolarHBondContact CG-O 3.42Å; E94-K418 WeakPolarHBondContact OE2-CA 3.41Å; E94-V419 HydrophobicContact CB-CG1 4.48Å; E94-V419 VanDerWaalsContact OE2-CG2 3.25Å; E94-V419 WeakPolarHBondContact OE2-CG2 3.24Å; E94-V419 PolarHBondContact OE2-N 3.32Å |
| 95 | L | 91.6 | Very high | 89.1 | Confident | 3 Ų | 3 | 15.6 Ų | 15.6 | 2% | 0.016 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -61.3 | -42.7 | 177.3 | -75 | 170.5 | 0 | 0 | 0 | 112.1 | C91 Y92 T98 F99 Y108 M403 | C91-L95 PolarHBondContact O-N 3.48Å; C91-L95 VanDerWaalsContact O-N 3.13Å; Y92-L95 PolarHBondContact O-N 3.06Å; L95-T98 PolarHBondContact O-N 3.46Å; L95-F99 HydrophobicContact CD2-CD2 4.14Å; L95-F99 HydrophobicContact CD2-CE2 3.96Å; L95-F99 PolarHBondContact O-N 3.19Å; L95-Y108 HydrophobicContact CB-CD1 4.08Å; L95-Y108 HydrophobicContact CB-CD2 3.93Å; L95-Y108 HydrophobicContact CB-CE1 3.96Å; L95-Y108 HydrophobicContact CB-CE2 3.79Å; L95-Y108 HydrophobicContact CB-CG 4.08Å; L95-Y108 HydrophobicContact CD1-CD2 3.87Å; L95-Y108 HydrophobicContact CD1-CE2 4.38Å; L95-Y108 HydrophobicContact CD1-CG 4.2Å; L95-Y108 HydrophobicContact CD2-CG 4.46Å; L95-Y108 HydrophobicContact CG-CD2 4.44Å; L95-Y108 HydrophobicContact CG-CG 4.5Å; L95-Y108 WeakPolarHBondContact O-CE1 3.39Å; L95-M403 HydrophobicContact CD1-CB 4.28Å; L95-M403 HydrophobicContact CD2-CB 3.88Å; L95-M403 HydrophobicContact CD2-CG 3.94Å; L95-M403 HydrophobicContact CG-CB 4.22Å; L95-M403 HydrophobicContact CG-CE 4.29Å; L95-M403 HydrophobicContact CG-CG 4.18Å |
| 96 | G | 88.6 | Confident | 88.9 | Confident | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -73.1 | -23.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 115 | Y92 E94 Y108 | Y92-G96 PolarHBondContact O-N 3.13Å; E94-G96 PolarHBondContact O-N 3.31Å; G96-Y108 WeakPolarHBondContact CA-OH 3.39Å; G96-Y108 PolarHBondContact N-OH 3.47Å |
| 97 | T | 90.1 | Very high | 88.7 | Confident | 4 Ų | 4 | 13.8 Ų | 13.8 | 3% | 0.025 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -87.7 | -22.5 | 171.5 | 55 | 0 | 0 | 0 | 0 | 112.9 | A93 E94 P263 F417 | A93-T97 WeakPolarHBondContact O-CB 3.27Å; A93-T97 VanDerWaalsContact O-CG2 3.27Å; A93-T97 WeakPolarHBondContact O-CG2 3.48Å; A93-T97 PolarHBondContact O-N 3.5Å; A93-T97 PolarHBondContact O-OG1 3.34Å; E94-T97 PolarHBondContact O-N 3.07Å; E94-T97 PolarHBondContact O-OG1 3.2Å; E94-T97 VanDerWaalsContact O-OG1 3.1Å; T97-P263 HydrophobicContact CG2-CG 3.95Å; T97-F417 HydrophobicContact CG2-CB 4.2Å |
| 98 | T | 89.9 | Confident | 88.5 | Confident | 16 Ų | 16 | 11.5 Ų | 11.5 | 10% | 0.098 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -81.8 | -46.1 | 174.8 | -55.3 | 0 | 0 | 0 | 0 | 111.3 | E94 L95 H413 R415 | E94-T98 VanDerWaalsContact O-CB 3.28Å; E94-T98 WeakPolarHBondContact O-CB 3.49Å; E94-T98 PolarHBondContact O-N 3.16Å; E94-T98 PolarHBondContact O-OG1 3.47Å; L95-T98 PolarHBondContact O-N 3.46Å; T98-H413 WeakPolarHBondContact CG2-ND1 3.38Å; T98-R415 HydrophobicContact CG2-CG 4.36Å |
| 99 | F | 87.8 | Confident | 88.5 | Confident | 18 Ų | 18 | 11.5 Ų | 11.5 | 8% | 0.079 | 6% | 0.06 | C | C | . | . | trans | -111.4 | 96.6 | 178.5 | -55.5 | -67.7 | 0 | 0 | 0 | 109.4 | L95 K101 Y108 E111 T112 H406 | L95-F99 HydrophobicContact CD2-CD2 4.14Å; L95-F99 HydrophobicContact CD2-CE2 3.96Å; L95-F99 PolarHBondContact O-N 3.19Å; F99-K101 PolarHBondContact O-N 3.29Å; F99-Y108 HydrophobicContact CB-CD1 4.09Å; F99-Y108 HydrophobicContact CB-CE1 4.01Å; F99-Y108 AromaticContact CD2-CD1 3.88Å; F99-Y108 HydrophobicContact CD2-CD1 3.88Å; F99-Y108 HydrophobicContact CD2-CE1 4.38Å; F99-Y108 HydrophobicContact CG-CD1 4.38Å; F99-E111 HydrophobicContact CD1-CB 4.05Å; F99-E111 HydrophobicContact CD1-CG 3.97Å; F99-E111 HydrophobicContact CE1-CB 3.65Å; F99-E111 HydrophobicContact CE1-CG 4.05Å; F99-E111 HydrophobicContact CE2-CB 4.49Å; F99-E111 HydrophobicContact CZ-CB 3.89Å; F99-T112 HydrophobicContact CE2-CG2 3.96Å; F99-T112 HydrophobicContact CZ-CG2 4.06Å; F99-H406 AromaticContact CZ-CD2 3.9Å; F99-H406 AromaticContact CZ-CE1 3.83Å; F99-H406 AromaticContact CZ-NE2 3.65Å | ||
| 100 | T | 79.7 | Confident | 88.5 | Confident | 70 Ų | 70 | 13 Ų | 13 | 43% | 0.429 | 7% | 0.068 | S | C | . | . | trans | -81 | 0.5 | -175.9 | 58.7 | 0 | 0 | 0 | 0 | 114.1 | E253 | T100-E253 WeakPolarHBondContact O-CG 3.32Š| ||
| 101 | K | 80.7 | Confident | 88.3 | Confident | 93 Ų | 93 | 15.6 Ų | 15.6 | 40% | 0.404 | 8% | 0.079 | S | C | . | . | S | Bend | trans | -68.1 | 141.7 | 174.1 | -70.5 | 179.7 | -176.4 | 175.4 | 0 | 109.9 | F99 T107 E111 E253 | F99-K101 PolarHBondContact O-N 3.29Å; K101-T107 HydrophobicContact CB-CG2 3.7Å; K101-T107 HydrophobicContact CD-CG2 4.1Å; K101-E111 IonicContact NZ-OE1 3.86Å; K101-E111 PolarHBondContact NZ-OE1 3.32Å; K101-E253 WeakPolarHBondContact CA-OE1 3.46Å |
| 102 | S | 76.5 | Confident | 88.2 | Confident | 4 Ų | 4 | 16.4 Ų | 16.4 | 3% | 0.028 | 8% | 0.084 | C | C | . | . | S | Bend | trans | -64.4 | 162.3 | 172.4 | -73.2 | 0 | 0 | 0 | 0 | 111.3 | T107 E253 | S102-T107 PolarHBondContact O-OG1 3.29Å; S102-E253 VanDerWaalsContact CB-CD 3.46Å; S102-E253 VanDerWaalsContact CB-OE2 3.28Å; S102-E253 WeakPolarHBondContact CB-OE2 3.45Å; S102-E253 VanDerWaalsContact N-CD 3.25Å; S102-E253 PolarHBondContact N-OE1 3.11Å; S102-E253 VanDerWaalsContact OG-CB 3.25Å; S102-E253 WeakPolarHBondContact OG-CB 3.3Å; S102-E253 WeakPolarHBondContact OG-CG 3.37Å; S102-E253 PolarHBondContact OG-OE2 3.12Å |
| 103 | G | 77.3 | Confident | 88.2 | Confident | 0 Ų | 0 | 19.2 Ų | 19.2 | 0% | 0 | 10% | 0.099 | C | C | . | . | trans | 113.5 | -8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | H105 Y106 T107 F250 | G103-H105 PolarHBondContact O-N 3.35Å; G103-Y106 PolarHBondContact O-N 3.44Å; G103-T107 WeakPolarHBondContact CA-OG1 3.49Å; G103-F250 WeakPolarHBondContact O-CD1 3.41Å | ||
| 104 | G | 86.5 | Confident | 88.1 | Confident | 1 Ų | 1 | 20.1 Ų | 20.1 | 1% | 0.01 | 11% | 0.108 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 53.6 | -122.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y106 T107 Y108 N249 | G104-Y106 PolarHBondContact O-N 3.3Å; G104-Y106 VanDerWaalsContact O-N 3.13Å; G104-T107 PolarHBondContact O-N 2.88Å; G104-T107 VanDerWaalsContact O-N 3.15Å; G104-Y108 VanDerWaalsContact O-CD2 3.28Å; G104-Y108 WeakPolarHBondContact O-CD2 3.39Å; G104-Y108 PolarHBondContact O-N 2.96Å; G104-N249 PolarHBondContact N-O 3.45Å |
| 105 | H | 86.6 | Confident | 87.9 | Confident | 2 Ų | 2 | 22.8 Ų | 22.8 | 1% | 0.009 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -51.7 | -38.9 | -178 | -54.2 | -74.4 | 0 | 0 | 0 | 114 | Y92 G103 L109 R121 F246 F250 | Y92-H105 AromaticContact CE1-CE1 3.3Å; Y92-H105 WeakPolarHBondContact CE1-CE1 3.48Å; Y92-H105 AromaticContact CE1-ND1 3.24Å; Y92-H105 WeakPolarHBondContact CE1-ND1 3.4Å; Y92-H105 AromaticContact CZ-CE1 3.46Å; Y92-H105 VanDerWaalsContact CZ-CE1 3.46Å; Y92-H105 AromaticContact CZ-ND1 3.38Å; Y92-H105 PolarHBondContact OH-CE1 3.06Å; Y92-H105 PolarHBondContact OH-ND1 3.07Å; G103-H105 PolarHBondContact O-N 3.35Å; H105-L109 WeakPolarHBondContact O-CB 3.35Å; H105-L109 VanDerWaalsContact O-CG 3.23Å; H105-L109 WeakPolarHBondContact O-CG 3.39Å; H105-L109 PolarHBondContact O-N 2.97Å; H105-R121 HydrophobicContact CB-CG 4.2Å; H105-R121 PolarHBondContact CD2-NH2 3.29Å; H105-R121 VanDerWaalsContact CD2-NH2 3.29Å; H105-F246 AromaticContact CE1-CD2 3.94Å; H105-F246 AromaticContact CE1-CG 3.87Å; H105-F246 AromaticContact NE2-CD2 3.29Å; H105-F246 VanDerWaalsContact NE2-CD2 3.29Å; H105-F246 WeakPolarHBondContact NE2-CD2 3.35Å; H105-F246 AromaticContact NE2-CE2 3.66Å; H105-F246 AromaticContact NE2-CG 3.7Å; H105-F250 AromaticContact CD2-CE1 3.66Å; H105-F250 AromaticContact CD2-CZ 3.35Å; H105-F250 WeakPolarHBondContact CD2-CZ 3.45Å; H105-F250 AromaticContact NE2-CZ 3.67Å |
| 106 | Y | 89.9 | Confident | 87.9 | Confident | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -59.6 | -52.8 | -178.6 | 169 | -108.8 | 0 | 0 | 0 | 110.6 | G103 G104 Y108 L109 L110 A118 L122 V340 E344 H346 | G103-Y106 PolarHBondContact O-N 3.44Å; G104-Y106 PolarHBondContact O-N 3.3Å; G104-Y106 VanDerWaalsContact O-N 3.13Å; Y106-Y108 PolarHBondContact O-N 2.92Å; Y106-L109 PolarHBondContact O-N 2.93Å; Y106-L110 HydrophobicContact CE1-CD2 4.15Å; Y106-L110 WeakPolarHBondContact O-CB 3.33Å; Y106-L110 PolarHBondContact O-N 2.96Å; Y106-A118 HydrophobicContact CD2-CB 3.81Å; Y106-A118 VanDerWaalsContact CD2-O 3.28Å; Y106-A118 WeakPolarHBondContact CD2-O 3.46Å; Y106-A118 HydrophobicContact CE2-CB 3.57Å; Y106-L122 HydrophobicContact CD1-CD1 4.47Å; Y106-L122 HydrophobicContact CD2-CD1 3.3Å; Y106-L122 HydrophobicContact CD2-CG 3.56Å; Y106-L122 HydrophobicContact CE1-CD1 4.34Å; Y106-L122 HydrophobicContact CE2-CD1 3.12Å; Y106-L122 HydrophobicContact CE2-CG 3.93Å; Y106-L122 HydrophobicContact CG-CD1 3.99Å; Y106-L122 HydrophobicContact CG-CG 4.12Å; Y106-V340 HydrophobicContact CD1-CG1 3.92Å; Y106-V340 HydrophobicContact CE1-CG1 3.92Å; Y106-E344 HydrophobicContact CE1-CB 4.44Å; Y106-E344 HydrophobicContact CE1-CG 4Å; Y106-E344 WeakPolarHBondContact OH-CB 3.28Å; Y106-H346 AromaticContact CE2-ND1 3.64Å; Y106-H346 AromaticContact CZ-ND1 3.64Å; Y106-H346 PolarHBondContact OH-CE1 2.93Å; Y106-H346 PolarHBondContact OH-ND1 2.93Å |
| 107 | T | 90.3 | Very high | 88.1 | Confident | 3 Ų | 3 | 26.8 Ų | 26.8 | 2% | 0.018 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -67.4 | -38.1 | -176.9 | -46.8 | 0 | 0 | 0 | 0 | 111.4 | K101 S102 G103 G104 L109 L110 E111 | K101-T107 HydrophobicContact CB-CG2 3.7Å; K101-T107 HydrophobicContact CD-CG2 4.1Å; S102-T107 PolarHBondContact O-OG1 3.29Å; G103-T107 WeakPolarHBondContact CA-OG1 3.49Å; G104-T107 PolarHBondContact O-N 2.88Å; G104-T107 VanDerWaalsContact O-N 3.15Å; T107-L109 PolarHBondContact O-N 3.5Å; T107-L110 PolarHBondContact O-N 3.2Å; T107-E111 HydrophobicContact CG2-CG 4.38Å; T107-E111 WeakPolarHBondContact O-CG 3.4Å; T107-E111 PolarHBondContact O-N 3.3Å |
| 108 | Y | 91.8 | Very high | 88.1 | Confident | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -63.2 | -42.9 | 175.6 | -55.8 | -25.9 | 0 | 0 | 0 | 112 | Y92 L95 G96 F99 G104 Y106 T112 N249 | Y92-Y108 HydrophobicContact CD1-CD2 4.28Å; Y92-Y108 AromaticContact CD1-CE2 3.78Å; Y92-Y108 HydrophobicContact CD1-CE2 3.78Å; Y92-Y108 HydrophobicContact CE1-CD2 4.07Å; Y92-Y108 AromaticContact CE1-CE2 3.99Å; Y92-Y108 HydrophobicContact CE1-CE2 3.99Å; L95-Y108 HydrophobicContact CB-CD1 4.08Å; L95-Y108 HydrophobicContact CB-CD2 3.93Å; L95-Y108 HydrophobicContact CB-CE1 3.96Å; L95-Y108 HydrophobicContact CB-CE2 3.79Å; L95-Y108 HydrophobicContact CB-CG 4.08Å; L95-Y108 HydrophobicContact CD1-CD2 3.87Å; L95-Y108 HydrophobicContact CD1-CE2 4.38Å; L95-Y108 HydrophobicContact CD1-CG 4.2Å; L95-Y108 HydrophobicContact CD2-CG 4.46Å; L95-Y108 HydrophobicContact CG-CD2 4.44Å; L95-Y108 HydrophobicContact CG-CG 4.5Å; L95-Y108 WeakPolarHBondContact O-CE1 3.39Å; G96-Y108 WeakPolarHBondContact CA-OH 3.39Å; G96-Y108 PolarHBondContact N-OH 3.47Å; F99-Y108 HydrophobicContact CB-CD1 4.09Å; F99-Y108 HydrophobicContact CB-CE1 4.01Å; F99-Y108 AromaticContact CD2-CD1 3.88Å; F99-Y108 HydrophobicContact CD2-CD1 3.88Å; F99-Y108 HydrophobicContact CD2-CE1 4.38Å; F99-Y108 HydrophobicContact CG-CD1 4.38Å; G104-Y108 VanDerWaalsContact O-CD2 3.28Å; G104-Y108 WeakPolarHBondContact O-CD2 3.39Å; G104-Y108 PolarHBondContact O-N 2.96Å; Y106-Y108 PolarHBondContact O-N 2.92Å; Y108-T112 WeakPolarHBondContact O-CB 3.49Å; Y108-T112 VanDerWaalsContact O-CG2 3.28Å; Y108-T112 WeakPolarHBondContact O-CG2 3.28Å; Y108-T112 PolarHBondContact O-N 2.88Å; Y108-T112 VanDerWaalsContact O-N 3.14Å; Y108-T112 PolarHBondContact O-OG1 2.88Å; Y108-N249 HydrophobicContact CE2-CB 4.33Å; Y108-N249 VanDerWaalsContact OH-CB 3.3Å; Y108-N249 WeakPolarHBondContact OH-CB 3.39Å; Y108-N249 PolarHBondContact OH-OD1 3.36Å |
| 109 | L | 92.8 | Very high | 88.1 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -68.2 | -38.6 | 177 | -68.9 | 169.6 | 0 | 0 | 0 | 111.5 | H105 Y106 T107 T112 L113 G114 A118 R121 F395 L398 A399 | H105-L109 WeakPolarHBondContact O-CB 3.35Å; H105-L109 VanDerWaalsContact O-CG 3.23Å; H105-L109 WeakPolarHBondContact O-CG 3.39Å; H105-L109 PolarHBondContact O-N 2.97Å; Y106-L109 PolarHBondContact O-N 2.93Å; T107-L109 PolarHBondContact O-N 3.5Å; L109-T112 PolarHBondContact O-N 3.27Å; L109-L113 HydrophobicContact CD2-CD1 3.83Å; L109-L113 CarbonylContact O-C 3.49Å; L109-L113 WeakPolarHBondContact O-CA 3.33Å; L109-L113 PolarHBondContact O-N 2.84Å; L109-G114 PolarHBondContact O-N 3.47Å; L109-A118 HydrophobicContact CB-CB 4.26Å; L109-R121 HydrophobicContact CD1-CB 3.63Å; L109-R121 HydrophobicContact CD1-CG 3.81Å; L109-F395 HydrophobicContact CD1-CD1 3.82Å; L109-F395 HydrophobicContact CD1-CE1 4.47Å; L109-L398 HydrophobicContact CD2-CB 3.81Å; L109-A399 HydrophobicContact CD2-CB 4.3Å |
| 110 | L | 92.5 | Very high | 88.3 | Confident | 32 Ų | 32 | 26.3 Ų | 26.3 | 17% | 0.168 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -60.6 | -48.8 | 178.6 | -176 | 62.5 | 0 | 0 | 0 | 111.7 | Y106 T107 G114 P115 A118 E344 | Y106-L110 HydrophobicContact CE1-CD2 4.15Å; Y106-L110 WeakPolarHBondContact O-CB 3.33Å; Y106-L110 PolarHBondContact O-N 2.96Å; T107-L110 PolarHBondContact O-N 3.2Å; L110-G114 WeakPolarHBondContact O-CA 3.46Å; L110-G114 PolarHBondContact O-N 3Å; L110-P115 HydrophobicContact CD1-CB 4.12Å; L110-A118 HydrophobicContact CB-CB 3.79Å; L110-A118 HydrophobicContact CD1-CB 4.06Å; L110-E344 HydrophobicContact CD2-CG 4.02Å |
| 111 | E | 90.8 | Very high | 88.8 | Confident | 77 Ų | 77 | 23.2 Ų | 23.2 | 36% | 0.36 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -75 | -26 | -177.2 | -63.6 | -71 | -179.3 | 0 | 0 | 113 | F99 K101 T107 | F99-E111 HydrophobicContact CD1-CB 4.05Å; F99-E111 HydrophobicContact CD1-CG 3.97Å; F99-E111 HydrophobicContact CE1-CB 3.65Å; F99-E111 HydrophobicContact CE1-CG 4.05Å; F99-E111 HydrophobicContact CE2-CB 4.49Å; F99-E111 HydrophobicContact CZ-CB 3.89Å; K101-E111 IonicContact NZ-OE1 3.86Å; K101-E111 PolarHBondContact NZ-OE1 3.32Å; T107-E111 HydrophobicContact CG2-CG 4.38Å; T107-E111 WeakPolarHBondContact O-CG 3.4Å; T107-E111 PolarHBondContact O-N 3.3Å |
| 112 | T | 92.1 | Very high | 89.1 | Confident | 18 Ų | 18 | 18.8 Ų | 18.8 | 11% | 0.11 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -102.8 | -47.1 | -174.2 | 62 | 0 | 0 | 0 | 0 | 114.5 | F99 Y108 L109 G402 H406 | F99-T112 HydrophobicContact CE2-CG2 3.96Å; F99-T112 HydrophobicContact CZ-CG2 4.06Å; Y108-T112 WeakPolarHBondContact O-CB 3.49Å; Y108-T112 VanDerWaalsContact O-CG2 3.28Å; Y108-T112 WeakPolarHBondContact O-CG2 3.28Å; Y108-T112 PolarHBondContact O-N 2.88Å; Y108-T112 VanDerWaalsContact O-N 3.14Å; Y108-T112 PolarHBondContact O-OG1 2.88Å; L109-T112 PolarHBondContact O-N 3.27Å; T112-G402 WeakPolarHBondContact CB-O 3.45Å; T112-H406 HydrophobicContact CG2-CB 3.75Å |
| 113 | L | 91.4 | Very high | 89.7 | Confident | 60 Ų | 60 | 19.9 Ų | 19.9 | 31% | 0.314 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -109.9 | -8.6 | -174.4 | -63 | -179.3 | 0 | 0 | 0 | 113.1 | L109 P117 L398 | L109-L113 HydrophobicContact CD2-CD1 3.83Å; L109-L113 CarbonylContact O-C 3.49Å; L109-L113 WeakPolarHBondContact O-CA 3.33Å; L109-L113 PolarHBondContact O-N 2.84Å; L113-P117 HydrophobicContact CB-CB 4.32Å; L113-P117 HydrophobicContact CB-CG 4.01Å; L113-L398 HydrophobicContact CD1-CB 4.22Å; L113-L398 HydrophobicContact CD1-CD2 4.46Å; L113-L398 WeakPolarHBondContact CD1-O 3.25Å |
| 114 | G | 90.4 | Very high | 90.1 | Very high | 18 Ų | 18 | 20 Ų | 20 | 19% | 0.186 | 11% | 0.111 | C | C | . | . | trans | 97 | -172.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | L109 L110 | L109-G114 PolarHBondContact O-N 3.47Å; L110-G114 WeakPolarHBondContact O-CA 3.46Å; L110-G114 PolarHBondContact O-N 3Å | ||
| 115 | P | 89.8 | Confident | 89.8 | Confident | 60 Ų | 60 | 20.2 Ų | 20.2 | 39% | 0.39 | 11% | 0.112 | S | C | . | . | H | α-helix | trans | -74.5 | -31.3 | -165.8 | 27.5 | -35.4 | 0 | 0 | 0 | 114.5 | L110 A118 F119 Y460 | L110-P115 HydrophobicContact CD1-CB 4.12Å; P115-A118 PolarHBondContact O-N 2.95Å; P115-F119 WeakPolarHBondContact O-CB 3.45Å; P115-F119 PolarHBondContact O-N 3.29Å; P115-Y460 HydrophobicContact CB-CE2 4.47Å; P115-Y460 WeakPolarHBondContact CB-OH 3.46Å; P115-Y460 WeakPolarHBondContact CG-OH 3.42Å |
| 116 | L | 90.8 | Very high | 89.2 | Confident | 56 Ų | 56 | 20.2 Ų | 20.2 | 29% | 0.293 | 11% | 0.112 | S | C | . | . | H | α-helix | trans | -65.6 | -54 | -179 | 172.5 | 74.3 | 0 | 0 | 0 | 112.2 | A118 F119 L120 Y460 | L116-A118 PolarHBondContact O-N 2.84Å; L116-F119 PolarHBondContact O-N 3.36Å; L116-L120 HydrophobicContact CD1-CG 4.43Å; L116-L120 HydrophobicContact CG-CD1 4.43Å; L116-L120 WeakPolarHBondContact O-CG 3.29Å; L116-L120 PolarHBondContact O-N 2.93Å; L116-Y460 HydrophobicContact CB-CD1 4.4Å; L116-Y460 HydrophobicContact CB-CE1 4.03Å; L116-Y460 HydrophobicContact CD1-CD1 3.41Å; L116-Y460 VanDerWaalsContact CD1-CD1 3.41Å; L116-Y460 HydrophobicContact CD1-CE1 3.91Å; L116-Y460 HydrophobicContact CD1-CG 3.77Å |
| 117 | P | 91.8 | Very high | 88 | Confident | 30 Ų | 30 | 23.7 Ų | 23.7 | 20% | 0.195 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -60 | -34.5 | 175.7 | -25.7 | 36.1 | 0 | 0 | 0 | 113.3 | L113 L120 R121 | L113-P117 HydrophobicContact CB-CB 4.32Å; L113-P117 HydrophobicContact CB-CG 4.01Å; P117-L120 PolarHBondContact O-N 3.04Å; P117-R121 WeakPolarHBondContact O-CB 3.35Å; P117-R121 PolarHBondContact O-N 3.33Å |
| 118 | A | 91.1 | Very high | 86.3 | Confident | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -65.9 | -43.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y106 L109 L110 P115 L116 R121 L122 | Y106-A118 HydrophobicContact CD2-CB 3.81Å; Y106-A118 VanDerWaalsContact CD2-O 3.28Å; Y106-A118 WeakPolarHBondContact CD2-O 3.46Å; Y106-A118 HydrophobicContact CE2-CB 3.57Å; L109-A118 HydrophobicContact CB-CB 4.26Å; L110-A118 HydrophobicContact CB-CB 3.79Å; L110-A118 HydrophobicContact CD1-CB 4.06Å; P115-A118 PolarHBondContact O-N 2.95Å; L116-A118 PolarHBondContact O-N 2.84Å; A118-R121 WeakPolarHBondContact O-CB 3.39Å; A118-R121 PolarHBondContact O-N 2.82Å; A118-L122 PolarHBondContact O-N 3.49Å; A118-L122 VanDerWaalsContact O-N 3.13Å |
| 119 | F | 90.5 | Very high | 84.8 | Confident | 4 Ų | 4 | 26.7 Ų | 26.7 | 2% | 0.018 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -62.7 | -47 | 173.8 | -179.9 | -88.7 | 0 | 0 | 0 | 111.6 | P115 L116 R121 L122 W123 H346 G456 V459 Y460 V464 | P115-F119 WeakPolarHBondContact O-CB 3.45Å; P115-F119 PolarHBondContact O-N 3.29Å; L116-F119 PolarHBondContact O-N 3.36Å; F119-R121 PolarHBondContact O-N 3.11Å; F119-L122 WeakPolarHBondContact O-CB 3.36Å; F119-L122 PolarHBondContact O-N 3.29Å; F119-L122 VanDerWaalsContact O-N 3.11Å; F119-W123 HydrophobicContact CD1-CB 4.4Å; F119-W123 HydrophobicContact CE1-CB 4.18Å; F119-W123 HydrophobicContact CE1-CD2 4.16Å; F119-W123 AromaticContact CE1-CE3 3.81Å; F119-W123 HydrophobicContact CE1-CE3 3.81Å; F119-W123 HydrophobicContact CE1-CG 4.36Å; F119-W123 HydrophobicContact CZ-CD2 4.47Å; F119-W123 AromaticContact CZ-CE3 3.68Å; F119-W123 HydrophobicContact CZ-CE3 3.68Å; F119-W123 HydrophobicContact CZ-CZ3 4.17Å; F119-W123 VanDerWaalsContact O-CB 3.32Å; F119-W123 WeakPolarHBondContact O-CB 3.24Å; F119-W123 PolarHBondContact O-N 3.33Å; F119-H346 HydrophobicContact CD2-CB 3.98Å; F119-H346 WeakPolarHBondContact CE2-O 3.2Å; F119-G456 WeakPolarHBondContact CE1-O 3.43Å; F119-V459 HydrophobicContact CZ-CG1 4.16Å; F119-Y460 HydrophobicContact CB-CD2 3.49Å; F119-Y460 VanDerWaalsContact CB-CD2 3.49Å; F119-Y460 HydrophobicContact CB-CE2 3.93Å; F119-Y460 HydrophobicContact CB-CG 4.41Å; F119-Y460 AromaticContact CD1-CD2 3.86Å; F119-Y460 HydrophobicContact CD1-CD2 3.86Å; F119-Y460 HydrophobicContact CD1-CG 4.17Å; F119-Y460 AromaticContact CD2-CD2 3.87Å; F119-Y460 HydrophobicContact CD2-CD2 3.87Å; F119-Y460 AromaticContact CG-CD2 3.46Å; F119-Y460 HydrophobicContact CG-CD2 3.46Å; F119-Y460 VanDerWaalsContact CG-CD2 3.46Å; F119-Y460 HydrophobicContact CG-CE2 4.32Å; F119-Y460 HydrophobicContact CG-CG 4.22Å; F119-V464 HydrophobicContact CD2-CG2 4Å; F119-V464 HydrophobicContact CE2-CG2 4.03Å |
| 120 | L | 91.1 | Very high | 83.8 | Confident | 24 Ų | 24 | 27 Ų | 27 | 13% | 0.126 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -58 | -39.1 | 177.1 | -68 | 179.3 | 0 | 0 | 0 | 111.5 | L116 P117 W123 V124 F395 T453 V457 | L116-L120 HydrophobicContact CD1-CG 4.43Å; L116-L120 HydrophobicContact CG-CD1 4.43Å; L116-L120 WeakPolarHBondContact O-CG 3.29Å; L116-L120 PolarHBondContact O-N 2.93Å; P117-L120 PolarHBondContact O-N 3.04Å; L120-W123 WeakPolarHBondContact O-CB 3.3Å; L120-W123 PolarHBondContact O-N 3.45Å; L120-V124 VanDerWaalsContact O-CG2 3.29Å; L120-V124 WeakPolarHBondContact O-CG2 3.31Å; L120-V124 PolarHBondContact O-N 3.07Å; L120-F395 HydrophobicContact CB-CE1 4.26Å; L120-F395 HydrophobicContact CB-CZ 4.06Å; L120-T453 WeakPolarHBondContact CD2-O 3.36Å; L120-V457 HydrophobicContact CD1-CG2 4.17Å; L120-V457 HydrophobicContact CD2-CG2 3.88Å |
| 121 | R | 89.4 | Confident | 83.3 | Confident | 6 Ų | 6 | 26 Ų | 26 | 2% | 0.023 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -59.5 | -47.8 | 174.9 | 177.7 | 72.1 | -171.1 | 87.7 | -3.6 | 111.9 | H105 L109 P117 A118 F119 E125 M337 F395 | H105-R121 HydrophobicContact CB-CG 4.2Å; H105-R121 PolarHBondContact CD2-NH2 3.29Å; H105-R121 VanDerWaalsContact CD2-NH2 3.29Å; L109-R121 HydrophobicContact CD1-CB 3.63Å; L109-R121 HydrophobicContact CD1-CG 3.81Å; P117-R121 WeakPolarHBondContact O-CB 3.35Å; P117-R121 PolarHBondContact O-N 3.33Å; A118-R121 WeakPolarHBondContact O-CB 3.39Å; A118-R121 PolarHBondContact O-N 2.82Å; F119-R121 PolarHBondContact O-N 3.11Å; R121-E125 IonicContact CZ-OE1 3.6Å; R121-E125 IonicContact CZ-OE2 2.62Å; R121-E125 VanDerWaalsContact NH1-CB 3.34Å; R121-E125 IonicContact NH1-OE1 2.71Å; R121-E125 PolarHBondContact NH1-OE1 3.46Å; R121-E125 IonicContact NH1-OE2 2.72Å; R121-E125 PolarHBondContact NH1-OE2 3.16Å; R121-E125 IonicContact NH2-OE1 3.57Å; R121-E125 PolarHBondContact NH2-OE1 2.74Å; R121-E125 IonicContact NH2-OE2 3.42Å; R121-E125 PolarHBondContact NH2-OE2 3.04Å; R121-E125 VanDerWaalsContact O-CB 3.26Å; R121-E125 WeakPolarHBondContact O-CB 3.32Å; R121-E125 PolarHBondContact O-N 3.13Å; R121-E125 VanDerWaalsContact O-N 3.1Å; R121-M337 HydrophobicContact CG-CE 3.57Å; R121-F395 VanDerWaalsContact CA-CE1 3.48Å; R121-F395 HydrophobicContact CB-CD1 3.78Å; R121-F395 HydrophobicContact CB-CE1 3.68Å; R121-F395 HydrophobicContact CB-CG 4.4Å; R121-F395 HydrophobicContact CB-CZ 4.23Å; R121-F395 HydrophobicContact CG-CD1 4.18Å; R121-F395 HydrophobicContact CG-CG 4.39Å |
| 122 | L | 88.3 | Confident | 83.1 | Confident | 0 Ų | 0 | 22.5 Ų | 22.5 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -64.5 | -43.4 | 176.6 | -90.1 | 165.2 | 0 | 0 | 0 | 112.3 | Y106 A118 F119 E125 F126 M337 L338 H346 | Y106-L122 HydrophobicContact CD1-CD1 4.47Å; Y106-L122 HydrophobicContact CD2-CD1 3.3Å; Y106-L122 HydrophobicContact CD2-CG 3.56Å; Y106-L122 HydrophobicContact CE1-CD1 4.34Å; Y106-L122 HydrophobicContact CE2-CD1 3.12Å; Y106-L122 HydrophobicContact CE2-CG 3.93Å; Y106-L122 HydrophobicContact CG-CD1 3.99Å; Y106-L122 HydrophobicContact CG-CG 4.12Å; A118-L122 PolarHBondContact O-N 3.49Å; A118-L122 VanDerWaalsContact O-N 3.13Å; F119-L122 WeakPolarHBondContact O-CB 3.36Å; F119-L122 PolarHBondContact O-N 3.29Å; F119-L122 VanDerWaalsContact O-N 3.11Å; L122-E125 PolarHBondContact O-N 3.46Å; L122-F126 HydrophobicContact CD2-CD2 3.95Å; L122-F126 HydrophobicContact CD2-CE2 3.97Å; L122-F126 PolarHBondContact O-N 3.37Å; L122-F126 VanDerWaalsContact O-N 3.07Å; L122-M337 HydrophobicContact CD2-CE 4Å; L122-M337 HydrophobicContact CD2-CG 4.13Å; L122-M337 HydrophobicContact CG-CE 4.08Å; L122-L338 HydrophobicContact CD2-CD1 4.35Å; L122-H346 HydrophobicContact CD1-CB 4.3Å |
| 123 | W | 88.3 | Confident | 82.9 | Confident | 27 Ų | 27 | 21.6 Ų | 21.6 | 10% | 0.102 | 12% | 0.118 | C | C | . | . | I | π-helix | trans | -56.9 | -50.7 | 179.4 | -175.7 | -100.5 | 0 | 0 | 0 | 111.4 | F119 L120 E125 L127 F128 T455 G456 V459 | F119-W123 HydrophobicContact CD1-CB 4.4Å; F119-W123 HydrophobicContact CE1-CB 4.18Å; F119-W123 HydrophobicContact CE1-CD2 4.16Å; F119-W123 AromaticContact CE1-CE3 3.81Å; F119-W123 HydrophobicContact CE1-CE3 3.81Å; F119-W123 HydrophobicContact CE1-CG 4.36Å; F119-W123 HydrophobicContact CZ-CD2 4.47Å; F119-W123 AromaticContact CZ-CE3 3.68Å; F119-W123 HydrophobicContact CZ-CE3 3.68Å; F119-W123 HydrophobicContact CZ-CZ3 4.17Å; F119-W123 VanDerWaalsContact O-CB 3.32Å; F119-W123 WeakPolarHBondContact O-CB 3.24Å; F119-W123 PolarHBondContact O-N 3.33Å; L120-W123 WeakPolarHBondContact O-CB 3.3Å; L120-W123 PolarHBondContact O-N 3.45Å; W123-E125 VanDerWaalsContact C-N 3.33Å; W123-E125 PolarHBondContact O-N 3.07Å; W123-L127 HydrophobicContact CD2-CB 4.43Å; W123-L127 HydrophobicContact CD2-CD1 4.07Å; W123-L127 HydrophobicContact CE3-CD1 3.37Å; W123-L127 HydrophobicContact CH2-CD1 3.73Å; W123-L127 HydrophobicContact CZ2-CD1 4.44Å; W123-L127 HydrophobicContact CZ3-CD1 3.16Å; W123-L127 HydrophobicContact CZ3-CG 4.46Å; W123-L127 WeakPolarHBondContact O-CA 3.2Å; W123-L127 VanDerWaalsContact O-CB 3.31Å; W123-L127 WeakPolarHBondContact O-CB 3.3Å; W123-L127 PolarHBondContact O-N 3.13Å; W123-F128 AromaticContact CD1-CD2 3.55Å; W123-F128 AromaticContact CD1-CE2 3.98Å; W123-F128 HydrophobicContact CD2-CD2 4.21Å; W123-F128 HydrophobicContact CD2-CE2 4.12Å; W123-F128 AromaticContact CE2-CD2 3.56Å; W123-F128 AromaticContact CE2-CE2 3.15Å; W123-F128 HydrophobicContact CG-CD2 4.22Å; W123-F128 HydrophobicContact CH2-CE2 4.15Å; W123-F128 HydrophobicContact CZ2-CD2 4.09Å; W123-F128 AromaticContact CZ2-CE2 3.21Å; W123-F128 HydrophobicContact CZ2-CE2 3.21Å; W123-F128 AromaticContact CZ2-CZ 3.93Å; W123-F128 HydrophobicContact CZ2-CZ 3.93Å; W123-F128 AromaticContact NE1-CD2 3.09Å; W123-F128 AromaticContact NE1-CE2 3.07Å; W123-F128 PolarHBondContact O-N 3.25Å; W123-T455 PolarHBondContact NE1-OG1 2.79Å; W123-G456 VanDerWaalsContact CD1-CA 3.41Å; W123-G456 VanDerWaalsContact NE1-CA 3.28Å; W123-G456 VanDerWaalsContact NE1-N 3.19Å; W123-V459 HydrophobicContact CE3-CG1 4.37Å; W123-V459 HydrophobicContact CH2-CB 3.8Å; W123-V459 HydrophobicContact CH2-CG1 3.62Å; W123-V459 HydrophobicContact CH2-CG2 3.56Å; W123-V459 HydrophobicContact CZ2-CB 4.15Å; W123-V459 HydrophobicContact CZ2-CG1 4.46Å; W123-V459 HydrophobicContact CZ2-CG2 3.73Å; W123-V459 HydrophobicContact CZ3-CB 4.02Å; W123-V459 HydrophobicContact CZ3-CG1 3.52Å; W123-V459 HydrophobicContact CZ3-CG2 4.29Å |
| 124 | V | 85.5 | Confident | 82.7 | Confident | 1 Ų | 1 | 19.8 Ų | 19.8 | 1% | 0.006 | 11% | 0.109 | C | C | . | . | I | π-helix | trans | -71.9 | -30.9 | -179.8 | -179.4 | 0 | 0 | 0 | 0 | 112.2 | L120 F128 S130 S391 F395 T453 | L120-V124 VanDerWaalsContact O-CG2 3.29Å; L120-V124 WeakPolarHBondContact O-CG2 3.31Å; L120-V124 PolarHBondContact O-N 3.07Å; V124-F128 CarbonylContact O-C 3.58Å; V124-S130 WeakPolarHBondContact CG1-OG 3.28Å; V124-S130 PolarHBondContact O-N 2.88Å; V124-S391 WeakPolarHBondContact CG1-OG 3.49Å; V124-F395 HydrophobicContact CB-CE2 3.89Å; V124-F395 HydrophobicContact CB-CZ 4.48Å; V124-F395 HydrophobicContact CG1-CE2 4.21Å; V124-F395 HydrophobicContact CG2-CE2 3.98Å; V124-F395 HydrophobicContact CG2-CZ 4.25Å; V124-T453 HydrophobicContact CG2-CG2 3.67Å; V124-T453 VanDerWaalsContact CG2-OG1 3.31Å; V124-T453 WeakPolarHBondContact CG2-OG1 3.35Å |
| 125 | E | 81.6 | Confident | 82.6 | Confident | 6 Ų | 6 | 19.3 Ų | 19.3 | 3% | 0.028 | 10% | 0.104 | C | C | . | . | I | π-helix | trans | -66.3 | -47.7 | 179.2 | -162.6 | 72.4 | 140.5 | 0 | 0 | 113.2 | R121 L122 W123 R131 M337 | R121-E125 IonicContact CZ-OE1 3.6Å; R121-E125 IonicContact CZ-OE2 2.62Å; R121-E125 VanDerWaalsContact NH1-CB 3.34Å; R121-E125 IonicContact NH1-OE1 2.71Å; R121-E125 PolarHBondContact NH1-OE1 3.46Å; R121-E125 IonicContact NH1-OE2 2.72Å; R121-E125 PolarHBondContact NH1-OE2 3.16Å; R121-E125 IonicContact NH2-OE1 3.57Å; R121-E125 PolarHBondContact NH2-OE1 2.74Å; R121-E125 IonicContact NH2-OE2 3.42Å; R121-E125 PolarHBondContact NH2-OE2 3.04Å; R121-E125 VanDerWaalsContact O-CB 3.26Å; R121-E125 WeakPolarHBondContact O-CB 3.32Å; R121-E125 PolarHBondContact O-N 3.13Å; R121-E125 VanDerWaalsContact O-N 3.1Å; L122-E125 PolarHBondContact O-N 3.46Å; W123-E125 VanDerWaalsContact C-N 3.33Å; W123-E125 PolarHBondContact O-N 3.07Å; E125-R131 VanDerWaalsContact CD-CG 3.45Å; E125-R131 HydrophobicContact CG-CG 3.51Å; E125-R131 WeakPolarHBondContact O-CB 3.35Å; E125-R131 PolarHBondContact O-N 3.36Å; E125-R131 IonicContact OE1-CZ 2.99Å; E125-R131 IonicContact OE1-NE 3.52Å; E125-R131 PolarHBondContact OE1-NE 3.07Å; E125-R131 IonicContact OE1-NH2 3.33Å; E125-R131 PolarHBondContact OE1-NH2 3.48Å; E125-R131 IonicContact OE2-NE 3.23Å; E125-M337 HydrophobicContact CB-CE 3.91Å; E125-M337 HydrophobicContact CB-SD 4.5Å; E125-M337 HydrophobicContact CG-CE 4.01Å; E125-M337 HydrophobicContact CG-SD 3.94Å |
| 126 | F | 72.8 | Confident | 82.7 | Confident | 3 Ų | 3 | 16.5 Ų | 16.5 | 1% | 0.013 | 9% | 0.086 | C | C | . | . | I | π-helix | trans | -107.3 | -39.4 | -168.6 | -69.5 | -79.2 | 0 | 0 | 0 | 114.2 | L122 S334 M337 L338 W347 L371 | L122-F126 HydrophobicContact CD2-CD2 3.95Å; L122-F126 HydrophobicContact CD2-CE2 3.97Å; L122-F126 PolarHBondContact O-N 3.37Å; L122-F126 VanDerWaalsContact O-N 3.07Å; F126-S334 WeakPolarHBondContact CZ-O 3.48Å; F126-M337 HydrophobicContact CE2-CB 4.14Å; F126-M337 HydrophobicContact CE2-CE 4.39Å; F126-M337 HydrophobicContact CE2-CG 4.15Å; F126-M337 HydrophobicContact CE2-SD 4.18Å; F126-M337 HydrophobicContact CZ-CB 4.22Å; F126-L338 HydrophobicContact CB-CD1 4.36Å; F126-L338 HydrophobicContact CD1-CB 4.14Å; F126-L338 HydrophobicContact CD1-CD1 4.47Å; F126-L338 HydrophobicContact CD1-CD2 4.05Å; F126-L338 HydrophobicContact CD1-CG 4.46Å; F126-L338 HydrophobicContact CD2-CB 4.07Å; F126-L338 HydrophobicContact CD2-CD1 3.93Å; F126-L338 HydrophobicContact CD2-CG 4.5Å; F126-L338 HydrophobicContact CE1-CB 3.86Å; F126-L338 HydrophobicContact CE1-CD2 4.42Å; F126-L338 HydrophobicContact CE2-CB 3.8Å; F126-L338 HydrophobicContact CE2-CD1 4.47Å; F126-L338 HydrophobicContact CG-CB 4.27Å; F126-L338 HydrophobicContact CG-CD1 3.98Å; F126-L338 HydrophobicContact CG-CD2 4.33Å; F126-L338 HydrophobicContact CG-CG 4.43Å; F126-L338 HydrophobicContact CZ-CB 3.73Å; F126-W347 HydrophobicContact CB-CH2 4.36Å; F126-W347 HydrophobicContact CB-CZ2 4.18Å; F126-L371 VanDerWaalsContact O-CD1 3.23Å; F126-L371 WeakPolarHBondContact O-CD1 3.47Å |
| 127 | L | 64.2 | Low | 82.5 | Confident | 73 Ų | 73 | 14.4 Ų | 14.4 | 38% | 0.382 | 7% | 0.074 | S | C | . | . | I | π-helix | trans | -87 | -38.1 | -179 | -96.9 | 154.5 | 0 | 0 | 0 | 112.7 | W123 W347 | W123-L127 HydrophobicContact CD2-CB 4.43Å; W123-L127 HydrophobicContact CD2-CD1 4.07Å; W123-L127 HydrophobicContact CE3-CD1 3.37Å; W123-L127 HydrophobicContact CH2-CD1 3.73Å; W123-L127 HydrophobicContact CZ2-CD1 4.44Å; W123-L127 HydrophobicContact CZ3-CD1 3.16Å; W123-L127 HydrophobicContact CZ3-CG 4.46Å; W123-L127 WeakPolarHBondContact O-CA 3.2Å; W123-L127 VanDerWaalsContact O-CB 3.31Å; W123-L127 WeakPolarHBondContact O-CB 3.3Å; W123-L127 PolarHBondContact O-N 3.13Å; L127-W347 HydrophobicContact CD1-CH2 3.32Å; L127-W347 HydrophobicContact CD1-CZ2 3.4Å; L127-W347 HydrophobicContact CD1-CZ3 4.33Å; L127-W347 HydrophobicContact CG-CH2 3.58Å; L127-W347 HydrophobicContact CG-CZ2 3.91Å |
| 128 | F | 56.2 | Low | 82.5 | Confident | 48 Ų | 48 | 13.4 Ų | 13.4 | 21% | 0.211 | 7% | 0.067 | C | C | . | . | S | Bend | trans | -118.6 | 50.1 | -170.3 | -70.9 | -87.5 | 0 | 0 | 0 | 114.1 | W123 V124 S130 L452 | W123-F128 AromaticContact CD1-CD2 3.55Å; W123-F128 AromaticContact CD1-CE2 3.98Å; W123-F128 HydrophobicContact CD2-CD2 4.21Å; W123-F128 HydrophobicContact CD2-CE2 4.12Å; W123-F128 AromaticContact CE2-CD2 3.56Å; W123-F128 AromaticContact CE2-CE2 3.15Å; W123-F128 HydrophobicContact CG-CD2 4.22Å; W123-F128 HydrophobicContact CH2-CE2 4.15Å; W123-F128 HydrophobicContact CZ2-CD2 4.09Å; W123-F128 AromaticContact CZ2-CE2 3.21Å; W123-F128 HydrophobicContact CZ2-CE2 3.21Å; W123-F128 AromaticContact CZ2-CZ 3.93Å; W123-F128 HydrophobicContact CZ2-CZ 3.93Å; W123-F128 AromaticContact NE1-CD2 3.09Å; W123-F128 AromaticContact NE1-CE2 3.07Å; W123-F128 PolarHBondContact O-N 3.25Å; V124-F128 CarbonylContact O-C 3.58Å; F128-S130 PolarHBondContact O-N 3.25Å; F128-L452 HydrophobicContact CB-CB 4.09Å; F128-L452 HydrophobicContact CD1-CB 3.58Å; F128-L452 HydrophobicContact CD1-CD1 4.04Å; F128-L452 HydrophobicContact CD1-CD2 3.35Å; F128-L452 HydrophobicContact CD1-CG 3.8Å; F128-L452 HydrophobicContact CE1-CB 4.29Å; F128-L452 HydrophobicContact CE1-CD2 3.36Å; F128-L452 HydrophobicContact CE1-CG 4.3Å; F128-L452 HydrophobicContact CG-CB 4Å |
| 129 | I | 60.1 | Low | 82.6 | Confident | 18 Ų | 18 | 13.4 Ų | 13.4 | 9% | 0.092 | 7% | 0.067 | C | C | . | . | S | Bend | trans | 89.8 | -19.9 | 153 | -45.1 | 111.2 | 0 | 0 | 0 | 118.1 | R131 P132 A133 M375 F387 L452 | I129-R131 PolarHBondContact O-N 3.14Å; I129-P132 WeakPolarHBondContact O-CD 3.31Å; I129-A133 HydrophobicContact CG2-CB 3.47Å; I129-A133 VanDerWaalsContact CG2-CB 3.47Å; I129-A133 WeakPolarHBondContact O-CB 3.25Å; I129-A133 PolarHBondContact O-N 2.84Å; I129-M375 HydrophobicContact CB-CE 4.25Å; I129-M375 HydrophobicContact CB-SD 4.45Å; I129-M375 HydrophobicContact CD1-CE 4.36Å; I129-M375 HydrophobicContact CG1-CE 3.37Å; I129-M375 HydrophobicContact CG1-SD 4.15Å; I129-M375 HydrophobicContact CG2-CE 3.94Å; I129-M375 HydrophobicContact CG2-CG 4.11Å; I129-M375 HydrophobicContact CG2-SD 3.51Å; I129-M375 VanDerWaalsContact CG2-SD 3.51Å; I129-F387 HydrophobicContact CB-CD1 3.95Å; I129-F387 HydrophobicContact CB-CE1 3.29Å; I129-F387 HydrophobicContact CB-CZ 4.2Å; I129-F387 HydrophobicContact CD1-CE1 3.38Å; I129-F387 HydrophobicContact CD1-CZ 3.44Å; I129-F387 VanDerWaalsContact CD1-CZ 3.44Å; I129-F387 HydrophobicContact CG1-CE1 3.5Å; I129-F387 VanDerWaalsContact CG1-CE1 3.5Å; I129-F387 HydrophobicContact CG1-CZ 4.12Å; I129-F387 HydrophobicContact CG2-CD1 3.4Å; I129-F387 HydrophobicContact CG2-CE1 3.2Å; I129-F387 HydrophobicContact CG2-CZ 4.46Å; I129-L452 HydrophobicContact CD1-CD1 3.58Å |
| 130 | S | 71.4 | Confident | 82.6 | Confident | 7 Ų | 7 | 13.4 Ų | 13.4 | 5% | 0.049 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -59.9 | -45.3 | -172.9 | -68.7 | 0 | 0 | 0 | 0 | 113.7 | V124 F128 V134 S391 | V124-S130 WeakPolarHBondContact CG1-OG 3.28Å; V124-S130 PolarHBondContact O-N 2.88Å; F128-S130 PolarHBondContact O-N 3.25Å; S130-V134 WeakPolarHBondContact O-CB 3.47Å; S130-V134 WeakPolarHBondContact O-CG2 3.4Å; S130-V134 PolarHBondContact O-N 3.42Å; S130-S391 VanDerWaalsContact OG-CB 3.27Å; S130-S391 WeakPolarHBondContact OG-CB 3.41Å; S130-S391 PolarHBondContact OG-OG 3.4Å |
| 131 | R | 82.9 | Confident | 82.6 | Confident | 10 Ų | 10 | 12.3 Ų | 12.3 | 4% | 0.038 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -76.2 | -46.1 | 173.2 | -68.2 | -68 | 171.9 | 112.1 | 3 | 113.6 | E125 I129 A133 V134 A135 Y247 S334 L368 | E125-R131 VanDerWaalsContact CD-CG 3.45Å; E125-R131 HydrophobicContact CG-CG 3.51Å; E125-R131 WeakPolarHBondContact O-CB 3.35Å; E125-R131 PolarHBondContact O-N 3.36Å; E125-R131 IonicContact OE1-CZ 2.99Å; E125-R131 IonicContact OE1-NE 3.52Å; E125-R131 PolarHBondContact OE1-NE 3.07Å; E125-R131 IonicContact OE1-NH2 3.33Å; E125-R131 PolarHBondContact OE1-NH2 3.48Å; E125-R131 IonicContact OE2-NE 3.23Å; I129-R131 PolarHBondContact O-N 3.14Å; R131-A133 PolarHBondContact O-N 3.24Å; R131-V134 PolarHBondContact O-N 2.87Å; R131-A135 PolarHBondContact O-N 3.21Å; R131-Y247 VanDerWaalsContact NH1-CE1 3.3Å; R131-S334 WeakPolarHBondContact CD-OG 3.17Å; R131-S334 VanDerWaalsContact NH1-CA 3.29Å; R131-S334 VanDerWaalsContact NH1-CB 3.32Å; R131-S334 PolarHBondContact NH1-OG 3.41Å; R131-L368 HydrophobicContact CB-CD1 3.97Å |
| 132 | P | 86.1 | Confident | 82.7 | Confident | 3 Ų | 3 | 13.4 Ų | 13.4 | 2% | 0.019 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -51.2 | -51.3 | 174.2 | -29.9 | 34.4 | 0 | 0 | 0 | 113.6 | I129 V134 A135 S136 L368 L371 V372 M375 | I129-P132 WeakPolarHBondContact O-CD 3.31Å; P132-V134 VanDerWaalsContact C-N 3.33Å; P132-V134 PolarHBondContact O-N 3.19Å; P132-A135 PolarHBondContact O-N 3.05Å; P132-S136 WeakPolarHBondContact O-CB 3.34Å; P132-S136 PolarHBondContact O-N 2.98Å; P132-S136 PolarHBondContact O-OG 3.44Å; P132-L368 HydrophobicContact CG-CD1 3.82Å; P132-L371 HydrophobicContact CB-CB 4.04Å; P132-L371 HydrophobicContact CG-CB 3.67Å; P132-L371 HydrophobicContact CG-CD1 4.3Å; P132-V372 HydrophobicContact CB-CG2 4.31Å; P132-M375 HydrophobicContact CB-CG 3.95Å |
| 133 | A | 87.3 | Confident | 82.9 | Confident | 0 Ų | 0 | 13.4 Ų | 13.4 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -61.6 | -39.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | I129 R131 S136 Y137 L384 A388 | I129-A133 HydrophobicContact CG2-CB 3.47Å; I129-A133 VanDerWaalsContact CG2-CB 3.47Å; I129-A133 WeakPolarHBondContact O-CB 3.25Å; I129-A133 PolarHBondContact O-N 2.84Å; R131-A133 PolarHBondContact O-N 3.24Å; A133-S136 PolarHBondContact O-N 3.24Å; A133-Y137 WeakPolarHBondContact O-CD1 3.09Å; A133-Y137 PolarHBondContact O-N 2.85Å; A133-L384 HydrophobicContact CB-CB 4.3Å; A133-L384 HydrophobicContact CB-CD2 3.84Å; A133-A388 HydrophobicContact CB-CB 4.11Å |
| 134 | V | 86.8 | Confident | 82.9 | Confident | 21 Ų | 21 | 15.1 Ų | 15.1 | 13% | 0.127 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -60.2 | -51.2 | 175.7 | 171.5 | 0 | 0 | 0 | 0 | 111.9 | S130 R131 P132 S136 Y137 V138 A388 | S130-V134 WeakPolarHBondContact O-CB 3.47Å; S130-V134 WeakPolarHBondContact O-CG2 3.4Å; S130-V134 PolarHBondContact O-N 3.42Å; R131-V134 PolarHBondContact O-N 2.87Å; P132-V134 VanDerWaalsContact C-N 3.33Å; P132-V134 PolarHBondContact O-N 3.19Å; V134-S136 VanDerWaalsContact C-N 3.31Å; V134-S136 PolarHBondContact O-N 3.48Å; V134-Y137 HydrophobicContact CB-CE1 4.02Å; V134-Y137 HydrophobicContact CG1-CE1 4.38Å; V134-Y137 HydrophobicContact CG2-CE1 3.73Å; V134-V138 VanDerWaalsContact O-CG2 3.27Å; V134-V138 WeakPolarHBondContact O-CG2 3.12Å; V134-V138 PolarHBondContact O-N 3.41Å; V134-A388 HydrophobicContact CG2-CB 4.09Å |
| 135 | A | 89.5 | Confident | 83.1 | Confident | 9 Ų | 9 | 15.3 Ų | 15.3 | 7% | 0.074 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -63.3 | -38.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | R131 P132 S139 L327 F331 V372 | R131-A135 PolarHBondContact O-N 3.21Å; P132-A135 PolarHBondContact O-N 3.05Å; A135-S139 WeakPolarHBondContact O-CB 3.28Å; A135-S139 PolarHBondContact O-N 3.23Å; A135-L327 HydrophobicContact CB-CD2 4.1Å; A135-L327 VanDerWaalsContact O-CD2 3.24Å; A135-L327 WeakPolarHBondContact O-CD2 3.04Å; A135-F331 HydrophobicContact CB-CE2 4Å; A135-F331 HydrophobicContact CB-CZ 4.39Å; A135-V372 HydrophobicContact CB-CG1 3.98Å; A135-V372 HydrophobicContact CB-CG2 3.72Å |
| 136 | S | 90.6 | Very high | 83.5 | Confident | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -63.6 | -49.3 | 178.7 | -59.5 | 0 | 0 | 0 | 0 | 112.4 | P132 A133 V134 V138 S139 L140 V372 M375 L376 | P132-S136 WeakPolarHBondContact O-CB 3.34Å; P132-S136 PolarHBondContact O-N 2.98Å; P132-S136 PolarHBondContact O-OG 3.44Å; A133-S136 PolarHBondContact O-N 3.24Å; V134-S136 VanDerWaalsContact C-N 3.31Å; V134-S136 PolarHBondContact O-N 3.48Å; S136-V138 PolarHBondContact O-N 3.44Å; S136-S139 PolarHBondContact O-N 3.5Å; S136-L140 WeakPolarHBondContact O-CB 3.11Å; S136-L140 VanDerWaalsContact O-CG 3.25Å; S136-L140 WeakPolarHBondContact O-CG 3.36Å; S136-L140 PolarHBondContact O-N 3.31Å; S136-V372 PolarHBondContact OG-O 3.08Å; S136-M375 VanDerWaalsContact OG-CB 3.24Å; S136-M375 WeakPolarHBondContact OG-CB 3.02Å; S136-L376 PolarHBondContact OG-N 3.01Å |
| 137 | Y | 87.9 | Confident | 84.3 | Confident | 13 Ų | 13 | 17.6 Ų | 17.6 | 5% | 0.051 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -69.9 | -34.2 | -178.5 | 73.1 | -117.5 | 0 | 0 | 0 | 112.8 | A133 V134 S139 L140 A141 Y240 L384 I385 R392 | A133-Y137 WeakPolarHBondContact O-CD1 3.09Å; A133-Y137 PolarHBondContact O-N 2.85Å; V134-Y137 HydrophobicContact CB-CE1 4.02Å; V134-Y137 HydrophobicContact CG1-CE1 4.38Å; V134-Y137 HydrophobicContact CG2-CE1 3.73Å; Y137-S139 VanDerWaalsContact C-N 3.33Å; Y137-L140 PolarHBondContact O-N 3Å; Y137-A141 PolarHBondContact O-N 3.46Å; Y137-Y240 HydrophobicContact CD2-CE2 4.35Å; Y137-Y240 VanDerWaalsContact CD2-OH 3.27Å; Y137-Y240 WeakPolarHBondContact CD2-OH 3.15Å; Y137-Y240 HydrophobicContact CE1-CE2 4.3Å; Y137-Y240 AromaticContact CE2-CE2 3.56Å; Y137-Y240 HydrophobicContact CE2-CE2 3.56Å; Y137-Y240 AromaticContact CE2-CZ 3.73Å; Y137-Y240 WeakPolarHBondContact CE2-OH 3.26Å; Y137-Y240 AromaticContact CZ-CE2 3.57Å; Y137-L384 HydrophobicContact CD1-CB 4.25Å; Y137-I385 HydrophobicContact CD1-CG1 3.85Å; Y137-I385 HydrophobicContact CD2-CG1 4.15Å; Y137-I385 HydrophobicContact CE1-CG1 4.12Å; Y137-I385 HydrophobicContact CE2-CG1 4.49Å; Y137-I385 HydrophobicContact CG-CG1 3.91Å; Y137-R392 PolarHBondContact OH-NH2 3.27Å |
| 138 | V | 90.6 | Very high | 85.2 | Confident | 9 Ų | 9 | 16.2 Ų | 16.2 | 6% | 0.055 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -68.6 | -38.3 | 175.5 | 179.1 | 0 | 0 | 0 | 0 | 110.1 | V134 S136 A141 F142 C323 A326 L327 | V134-V138 VanDerWaalsContact O-CG2 3.27Å; V134-V138 WeakPolarHBondContact O-CG2 3.12Å; V134-V138 PolarHBondContact O-N 3.41Å; S136-V138 PolarHBondContact O-N 3.44Å; V138-A141 WeakPolarHBondContact O-CB 3.49Å; V138-A141 PolarHBondContact O-N 3.27Å; V138-F142 PolarHBondContact O-N 2.72Å; V138-C323 HydrophobicContact CG1-CB 4.2Å; V138-C323 WeakPolarHBondContact CG1-O 3.47Å; V138-A326 HydrophobicContact CG1-CB 4.01Å; V138-L327 HydrophobicContact CB-CD2 3.77Å; V138-L327 HydrophobicContact CB-CG 4.18Å; V138-L327 HydrophobicContact CG1-CD2 3.89Å; V138-L327 HydrophobicContact CG1-CG 3.72Å |
| 139 | S | 93 | Very high | 86.5 | Confident | 0 Ų | 0 | 16.3 Ų | 16.3 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -67 | -41.7 | 175.2 | 172.3 | 0 | 0 | 0 | 0 | 112.4 | A135 S136 Y137 A141 F142 G143 S165 V169 L376 | A135-S139 WeakPolarHBondContact O-CB 3.28Å; A135-S139 PolarHBondContact O-N 3.23Å; S136-S139 PolarHBondContact O-N 3.5Å; Y137-S139 VanDerWaalsContact C-N 3.33Å; S139-A141 VanDerWaalsContact C-N 3.28Å; S139-A141 PolarHBondContact O-N 3.16Å; S139-F142 WeakPolarHBondContact O-CA 3.48Å; S139-F142 VanDerWaalsContact O-CB 3.27Å; S139-F142 WeakPolarHBondContact O-CB 3.49Å; S139-F142 PolarHBondContact O-N 2.88Å; S139-F142 VanDerWaalsContact O-N 3.11Å; S139-G143 PolarHBondContact O-N 3.03Å; S139-S165 WeakPolarHBondContact O-CB 3.49Å; S139-S165 PolarHBondContact O-OG 3.02Å; S139-S165 WeakPolarHBondContact OG-CA 3.49Å; S139-S165 VanDerWaalsContact OG-CB 3.23Å; S139-S165 WeakPolarHBondContact OG-CB 3.21Å; S139-S165 PolarHBondContact OG-O 2.93Å; S139-V169 VanDerWaalsContact CB-CG2 3.44Å; S139-V169 WeakPolarHBondContact OG-CG2 3.39Å; S139-L376 WeakPolarHBondContact OG-CD1 3.09Å |
| 140 | L | 91.6 | Very high | 87.6 | Confident | 4 Ų | 4 | 21.9 Ų | 21.9 | 2% | 0.021 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -60.8 | -38.9 | 172.7 | -73.5 | 170.2 | 0 | 0 | 0 | 111.8 | S136 Y137 G143 R144 I161 K162 S165 L376 I381 L384 | S136-L140 WeakPolarHBondContact O-CB 3.11Å; S136-L140 VanDerWaalsContact O-CG 3.25Å; S136-L140 WeakPolarHBondContact O-CG 3.36Å; S136-L140 PolarHBondContact O-N 3.31Å; Y137-L140 PolarHBondContact O-N 3Å; L140-G143 PolarHBondContact O-N 3.41Å; L140-R144 WeakPolarHBondContact O-CG 2.99Å; L140-R144 PolarHBondContact O-N 2.92Å; L140-I161 HydrophobicContact CD2-CG2 4.47Å; L140-K162 HydrophobicContact CD2-CG 3.98Å; L140-S165 WeakPolarHBondContact CA-OG 3.49Å; L140-L376 HydrophobicContact CD2-CD2 4.19Å; L140-L376 HydrophobicContact CD2-CG 4.13Å; L140-L376 HydrophobicContact CG-CG 4.29Å; L140-I381 HydrophobicContact CB-CD1 3.79Å; L140-I381 HydrophobicContact CB-CG1 3.68Å; L140-I381 HydrophobicContact CD1-CG1 4.01Å; L140-L384 HydrophobicContact CD1-CD1 4.03Å |
| 141 | A | 90.1 | Very high | 88.2 | Confident | 1 Ų | 1 | 25.2 Ų | 25.2 | 1% | 0.008 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -61.9 | -45.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | I59 Y137 V138 S139 G143 R144 Y145 | I59-A141 HydrophobicContact CD1-CB 3.86Å; Y137-A141 PolarHBondContact O-N 3.46Å; V138-A141 WeakPolarHBondContact O-CB 3.49Å; V138-A141 PolarHBondContact O-N 3.27Å; S139-A141 VanDerWaalsContact C-N 3.28Å; S139-A141 PolarHBondContact O-N 3.16Å; A141-G143 VanDerWaalsContact C-N 3.35Å; A141-G143 PolarHBondContact O-N 3.23Å; A141-R144 PolarHBondContact O-N 3.41Å; A141-Y145 VanDerWaalsContact O-CD2 3.23Å; A141-Y145 WeakPolarHBondContact O-CD2 3.26Å; A141-Y145 PolarHBondContact O-N 3.1Å |
| 142 | F | 92.6 | Very high | 87.8 | Confident | 29 Ų | 29 | 28.1 Ų | 28.1 | 13% | 0.127 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -53.3 | -50.1 | 172.8 | 165.3 | -98.2 | 0 | 0 | 0 | 111.8 | V138 S139 R144 Y145 V146 V164 A320 C323 L324 | V138-F142 PolarHBondContact O-N 2.72Å; S139-F142 WeakPolarHBondContact O-CA 3.48Å; S139-F142 VanDerWaalsContact O-CB 3.27Å; S139-F142 WeakPolarHBondContact O-CB 3.49Å; S139-F142 PolarHBondContact O-N 2.88Å; S139-F142 VanDerWaalsContact O-N 3.11Å; F142-R144 PolarHBondContact O-N 3.02Å; F142-Y145 PolarHBondContact O-N 3.35Å; F142-V146 HydrophobicContact CD2-CG2 4.33Å; F142-V146 HydrophobicContact CE2-CG2 3.97Å; F142-V146 HydrophobicContact CZ-CG2 4.1Å; F142-V146 WeakPolarHBondContact O-CG2 3.46Å; F142-V146 PolarHBondContact O-N 2.94Å; F142-V164 HydrophobicContact CD1-CG1 4.46Å; F142-V164 HydrophobicContact CE1-CG1 3.93Å; F142-V164 WeakPolarHBondContact CE1-O 3.27Å; F142-A320 HydrophobicContact CD2-CB 3.74Å; F142-A320 VanDerWaalsContact CD2-O 3.32Å; F142-A320 WeakPolarHBondContact CD2-O 3.18Å; F142-A320 HydrophobicContact CE2-CB 3.93Å; F142-C323 HydrophobicContact CB-CB 3.8Å; F142-L324 HydrophobicContact CE2-CD1 4.5Å |
| 143 | G | 91.3 | Very high | 87.3 | Confident | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -61 | -42.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | S139 L140 A141 V146 V147 S165 | S139-G143 PolarHBondContact O-N 3.03Å; L140-G143 PolarHBondContact O-N 3.41Å; A141-G143 VanDerWaalsContact C-N 3.35Å; A141-G143 PolarHBondContact O-N 3.23Å; G143-V146 PolarHBondContact O-N 3.18Å; G143-V147 WeakPolarHBondContact O-CB 3.5Å; G143-V147 VanDerWaalsContact O-CG2 3.25Å; G143-V147 WeakPolarHBondContact O-CG2 3.3Å; G143-V147 PolarHBondContact O-N 3.33Å; G143-S165 WeakPolarHBondContact CA-OG 3.21Å |
| 144 | R | 88.8 | Confident | 87 | Confident | 63 Ų | 63 | 38.5 Ų | 38.5 | 24% | 0.238 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61.2 | -49.2 | 178 | -76.4 | -174.8 | -173.3 | 177.6 | 1.9 | 112 | L140 A141 F142 V146 V147 E148 I161 E380 I381 | L140-R144 WeakPolarHBondContact O-CG 2.99Å; L140-R144 PolarHBondContact O-N 2.92Å; A141-R144 PolarHBondContact O-N 3.41Å; F142-R144 PolarHBondContact O-N 3.02Å; R144-V146 PolarHBondContact O-N 3.1Å; R144-V147 PolarHBondContact O-N 3.29Å; R144-E148 VanDerWaalsContact O-CB 3.32Å; R144-E148 WeakPolarHBondContact O-CB 3.46Å; R144-E148 WeakPolarHBondContact O-CG 3.22Å; R144-E148 PolarHBondContact O-N 3.37Å; R144-I161 HydrophobicContact CG-CD1 4Å; R144-I161 HydrophobicContact CG-CG1 4.35Å; R144-I161 HydrophobicContact CG-CG2 3.72Å; R144-E380 IonicContact NH2-OE2 2.97Å; R144-E380 PolarHBondContact NH2-OE2 3.29Å; R144-E380 VanDerWaalsContact NH2-OE2 3.12Å; R144-I381 VanDerWaalsContact CZ-CD1 3.44Å |
| 145 | Y | 88.9 | Confident | 86.7 | Confident | 5 Ų | 5 | 43.4 Ų | 43.4 | 2% | 0.02 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -65.6 | -25 | -179.6 | -81.7 | -74.2 | 0 | 0 | 0 | 114 | F58 A141 F142 P149 A298 A300 V301 P316 V319 | F58-Y145 HydrophobicContact CB-CE2 4.09Å; F58-Y145 VanDerWaalsContact CB-OH 3.25Å; F58-Y145 WeakPolarHBondContact CB-OH 3.48Å; F58-Y145 PolarHBondContact O-OH 2.72Å; F58-Y145 VanDerWaalsContact O-OH 3.13Å; A141-Y145 VanDerWaalsContact O-CD2 3.23Å; A141-Y145 WeakPolarHBondContact O-CD2 3.26Å; A141-Y145 PolarHBondContact O-N 3.1Å; F142-Y145 PolarHBondContact O-N 3.35Å; Y145-P149 WeakPolarHBondContact O-CD 3.26Å; Y145-P149 WeakPolarHBondContact O-CG 3.48Å; Y145-A298 HydrophobicContact CD1-CB 4.34Å; Y145-A298 HydrophobicContact CE1-CB 3.69Å; Y145-A300 HydrophobicContact CE1-CB 4.21Å; Y145-V301 HydrophobicContact CD1-CG2 4.01Å; Y145-V301 HydrophobicContact CE1-CG2 4.07Å; Y145-P316 VanDerWaalsContact O-CB 3.26Å; Y145-P316 WeakPolarHBondContact O-CB 3.49Å; Y145-V319 HydrophobicContact CD1-CB 3.98Å; Y145-V319 HydrophobicContact CD1-CG1 3.54Å; Y145-V319 HydrophobicContact CD2-CG1 3.54Å; Y145-V319 HydrophobicContact CE1-CB 4.37Å; Y145-V319 HydrophobicContact CE1-CG1 3.71Å; Y145-V319 HydrophobicContact CE2-CG1 3.75Å; Y145-V319 HydrophobicContact CG-CB 4.15Å; Y145-V319 HydrophobicContact CG-CG1 3.48Å; Y145-V319 VanDerWaalsContact CG-CG1 3.48Å |
| 146 | V | 90.4 | Very high | 86.5 | Confident | 53 Ų | 53 | 44 Ų | 44 | 32% | 0.321 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -80.1 | -41.7 | 173.8 | 173.5 | 0 | 0 | 0 | 0 | 111.7 | F142 G143 R144 V164 A320 | F142-V146 HydrophobicContact CD2-CG2 4.33Å; F142-V146 HydrophobicContact CE2-CG2 3.97Å; F142-V146 HydrophobicContact CZ-CG2 4.1Å; F142-V146 WeakPolarHBondContact O-CG2 3.46Å; F142-V146 PolarHBondContact O-N 2.94Å; G143-V146 PolarHBondContact O-N 3.18Å; R144-V146 PolarHBondContact O-N 3.1Å; V146-V164 HydrophobicContact CB-CG1 4.13Å; V146-V164 HydrophobicContact CG1-CG1 4.05Å; V146-A320 HydrophobicContact CG2-CB 3.57Å |
| 147 | V | 89.8 | Confident | 86.4 | Confident | 3 Ų | 3 | 46.9 Ų | 46.9 | 2% | 0.018 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -88.2 | -41.6 | -169.5 | -179.7 | 0 | 0 | 0 | 0 | 112.5 | G143 R144 P149 L150 F151 A156 L160 I161 V164 | G143-V147 WeakPolarHBondContact O-CB 3.5Å; G143-V147 VanDerWaalsContact O-CG2 3.25Å; G143-V147 WeakPolarHBondContact O-CG2 3.3Å; G143-V147 PolarHBondContact O-N 3.33Å; R144-V147 PolarHBondContact O-N 3.29Å; V147-P149 VanDerWaalsContact C-CD 3.45Å; V147-L150 WeakPolarHBondContact O-CB 3.31Å; V147-L150 PolarHBondContact O-N 2.9Å; V147-F151 HydrophobicContact CG1-CD2 3.67Å; V147-F151 HydrophobicContact CG1-CE2 3.75Å; V147-F151 WeakPolarHBondContact O-CD2 3.43Å; V147-A156 HydrophobicContact CG1-CB 3.7Å; V147-L160 HydrophobicContact CG1-CD2 3.73Å; V147-L160 HydrophobicContact CG1-CG 4.04Å; V147-L160 HydrophobicContact CG2-CD2 4.46Å; V147-L160 HydrophobicContact CG2-CG 4.1Å; V147-I161 HydrophobicContact CB-CG1 4.1Å; V147-I161 HydrophobicContact CG1-CG1 4.26Å; V147-I161 HydrophobicContact CG2-CG1 4.41Å; V147-V164 HydrophobicContact CG2-CB 4.2Å; V147-V164 HydrophobicContact CG2-CG1 4.47Å; V147-V164 HydrophobicContact CG2-CG2 3.81Å |
| 148 | E | 83.4 | Confident | 86.4 | Confident | 44 Ų | 44 | 49.9 Ų | 49.9 | 21% | 0.206 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -54.3 | -42.7 | -175.1 | -75.7 | 175.8 | -167.1 | 0 | 0 | 114.5 | R144 L150 F151 A152 A156 A298 | R144-E148 VanDerWaalsContact O-CB 3.32Å; R144-E148 WeakPolarHBondContact O-CB 3.46Å; R144-E148 WeakPolarHBondContact O-CG 3.22Å; R144-E148 PolarHBondContact O-N 3.37Å; E148-L150 PolarHBondContact O-N 3.08Å; E148-F151 PolarHBondContact O-N 2.97Å; E148-A152 PolarHBondContact O-N 3.12Å; E148-A152 VanDerWaalsContact O-N 3.1Å; E148-A156 HydrophobicContact CG-CB 4.41Å; E148-A298 WeakPolarHBondContact OE2-CB 3.43Å |
| 149 | P | 82.6 | Confident | 86.4 | Confident | 50 Ų | 50 | 52.8 Ų | 52.8 | 33% | 0.325 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -62.6 | -26.4 | 178 | -21.2 | 32.6 | 0 | 0 | 0 | 114 | Y145 V147 F151 P316 | Y145-P149 WeakPolarHBondContact O-CD 3.26Å; Y145-P149 WeakPolarHBondContact O-CG 3.48Å; V147-P149 VanDerWaalsContact C-CD 3.45Å; P149-F151 VanDerWaalsContact C-N 3.35Å; P149-P316 HydrophobicContact CB-CG 4.2Å; P149-P316 HydrophobicContact CG-CB 3.45Å; P149-P316 VanDerWaalsContact CG-CB 3.45Å; P149-P316 HydrophobicContact CG-CG 3.52Å |
| 150 | L | 84.8 | Confident | 86.4 | Confident | 135 Ų | 135 | 55.6 Ų | 55.6 | 71% | 0.707 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -78.7 | -20.9 | -178.7 | -59.2 | 175.1 | 0 | 0 | 0 | 112.8 | V147 E148 | V147-L150 WeakPolarHBondContact O-CB 3.31Å; V147-L150 PolarHBondContact O-N 2.9Å; E148-L150 PolarHBondContact O-N 3.08Å |
| 151 | F | 83.1 | Confident | 86.4 | Confident | 78 Ų | 78 | 56.1 Ų | 56.1 | 34% | 0.342 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -111.8 | -5.2 | -176.6 | -72.3 | -91.9 | 0 | 0 | 0 | 113.3 | V147 E148 P149 C154 A156 P157 L160 | V147-F151 HydrophobicContact CG1-CD2 3.67Å; V147-F151 HydrophobicContact CG1-CE2 3.75Å; V147-F151 WeakPolarHBondContact O-CD2 3.43Å; E148-F151 PolarHBondContact O-N 2.97Å; P149-F151 VanDerWaalsContact C-N 3.35Å; F151-C154 CarbonylContact C-O 3.42Å; F151-C154 WeakPolarHBondContact O-CA 3.29Å; F151-C154 WeakPolarHBondContact O-CB 3.31Å; F151-C154 PolarHBondContact O-N 3.29Å; F151-C154 VanDerWaalsContact O-O 3.07Å; F151-A156 HydrophobicContact CB-CB 4.33Å; F151-A156 HydrophobicContact CD2-CB 4.43Å; F151-A156 HydrophobicContact CG-CB 4.49Å; F151-P157 HydrophobicContact CE1-CG 4.35Å; F151-L160 HydrophobicContact CE2-CD2 3.49Å; F151-L160 VanDerWaalsContact CE2-CD2 3.49Å; F151-L160 HydrophobicContact CZ-CD2 3.7Å |
| 152 | A | 74.6 | Confident | 86.5 | Confident | 71 Ų | 71 | 58.3 Ų | 58.3 | 59% | 0.587 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.9 | 129.9 | 178 | 0 | 0 | 0 | 0 | 0 | 111.4 | E148 | E148-A152 PolarHBondContact O-N 3.12Å; E148-A152 VanDerWaalsContact O-N 3.1Å |
| 153 | P | 75.3 | Confident | 86.6 | Confident | 136 Ų | 136 | 61.8 Ų | 61.8 | 88% | 0.883 | 37% | 0.373 | S | S | * | . | T | Hydrogen-bonded Turn | cis | -92 | 2.2 | 12.2 | 36.1 | -36.2 | 0 | 0 | 0 | 116.2 | ||
| 154 | C | 82.7 | Confident | 86.7 | Confident | 84 Ų | 84 | 63 Ų | 63 | 57% | 0.568 | 38% | 0.38 | S | S | * | . | S | Bend | trans | -79.4 | 151.5 | -178.9 | -64.4 | 0 | 0 | 0 | 0 | 112.4 | F151 A156 | F151-C154 CarbonylContact C-O 3.42Å; F151-C154 WeakPolarHBondContact O-CA 3.29Å; F151-C154 WeakPolarHBondContact O-CB 3.31Å; F151-C154 PolarHBondContact O-N 3.29Å; F151-C154 VanDerWaalsContact O-O 3.07Å; C154-A156 PolarHBondContact O-N 2.79Å |
| 155 | P | 79.4 | Confident | 87 | Confident | 124 Ų | 124 | 60 Ų | 60 | 81% | 0.805 | 37% | 0.369 | S | S | * | . | P | Polyproline II helix | trans | -66.2 | 131 | 174.3 | 27.2 | -33.2 | 0 | 0 | 0 | 110.7 | ||
| 156 | A | 84.5 | Confident | 87.3 | Confident | 21 Ų | 21 | 61.6 Ų | 61.6 | 17% | 0.174 | 38% | 0.377 | C | S | . | . | P | Polyproline II helix | trans | -67.1 | 140.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | V147 E148 F151 C154 S158 I161 | V147-A156 HydrophobicContact CG1-CB 3.7Å; E148-A156 HydrophobicContact CG-CB 4.41Å; F151-A156 HydrophobicContact CB-CB 4.33Å; F151-A156 HydrophobicContact CD2-CB 4.43Å; F151-A156 HydrophobicContact CG-CB 4.49Å; C154-A156 PolarHBondContact O-N 2.79Å; A156-S158 PolarHBondContact O-N 3.43Å; A156-I161 HydrophobicContact CB-CD1 3.95Å; A156-I161 HydrophobicContact CB-CG1 4.38Å |
| 157 | P | 90.4 | Very high | 87.5 | Confident | 61 Ų | 61 | 64.4 Ų | 64.4 | 40% | 0.396 | 39% | 0.39 | S | S | . | . | P | Polyproline II helix | trans | -60.6 | 126.5 | 175.6 | -22.8 | 32.7 | 0 | 0 | 0 | 112.1 | F151 A159 L160 I161 | F151-P157 HydrophobicContact CE1-CG 4.35Å; P157-A159 VanDerWaalsContact C-N 3.26Å; P157-A159 PolarHBondContact O-N 3.2Å; P157-L160 HydrophobicContact CB-CB 4.26Å; P157-L160 PolarHBondContact O-N 3.11Å; P157-I161 PolarHBondContact O-N 2.89Å |
| 158 | S | 87.6 | Confident | 87.6 | Confident | 77 Ų | 77 | 64.4 Ų | 64.4 | 54% | 0.538 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -60.6 | -34 | -179 | 61.6 | 0 | 0 | 0 | 0 | 113.1 | A156 L160 I161 K162 | A156-S158 PolarHBondContact O-N 3.43Å; S158-L160 VanDerWaalsContact C-N 3.35Å; S158-L160 PolarHBondContact O-N 3.29Å; S158-I161 PolarHBondContact O-N 2.99Å; S158-K162 WeakPolarHBondContact O-CG 3.32Å; S158-K162 PolarHBondContact O-N 3.46Å |
| 159 | A | 90.9 | Very high | 88.1 | Confident | 70 Ų | 70 | 62.3 Ų | 62.3 | 58% | 0.579 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -62.3 | -40.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | P157 K162 L163 | P157-A159 VanDerWaalsContact C-N 3.26Å; P157-A159 PolarHBondContact O-N 3.2Å; A159-K162 PolarHBondContact O-N 3.32Å; A159-L163 WeakPolarHBondContact O-CB 3.49Å; A159-L163 PolarHBondContact O-N 3.19Å |
| 160 | L | 92.4 | Very high | 88.6 | Confident | 58 Ų | 58 | 62.6 Ų | 62.6 | 30% | 0.304 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -69.7 | -43.1 | 179.2 | -178.5 | 59 | 0 | 0 | 0 | 111.1 | V147 F151 P157 S158 K162 L163 V164 | V147-L160 HydrophobicContact CG1-CD2 3.73Å; V147-L160 HydrophobicContact CG1-CG 4.04Å; V147-L160 HydrophobicContact CG2-CD2 4.46Å; V147-L160 HydrophobicContact CG2-CG 4.1Å; F151-L160 HydrophobicContact CE2-CD2 3.49Å; F151-L160 VanDerWaalsContact CE2-CD2 3.49Å; F151-L160 HydrophobicContact CZ-CD2 3.7Å; P157-L160 HydrophobicContact CB-CB 4.26Å; P157-L160 PolarHBondContact O-N 3.11Å; S158-L160 VanDerWaalsContact C-N 3.35Å; S158-L160 PolarHBondContact O-N 3.29Å; L160-K162 VanDerWaalsContact C-N 3.3Å; L160-K162 PolarHBondContact O-N 2.99Å; L160-L163 PolarHBondContact O-N 3.4Å; L160-V164 HydrophobicContact CD1-CG2 4.16Å; L160-V164 HydrophobicContact CG-CG2 4.49Å; L160-V164 WeakPolarHBondContact O-CG2 3.28Å; L160-V164 PolarHBondContact O-N 3.16Å |
| 161 | I | 91.3 | Very high | 88.9 | Confident | 15 Ų | 15 | 61.5 Ų | 61.5 | 8% | 0.077 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -54.9 | -48.9 | 173.2 | -69.3 | 162.3 | 0 | 0 | 0 | 110 | L140 R144 V147 A156 P157 S158 L163 V164 S165 | L140-I161 HydrophobicContact CD2-CG2 4.47Å; R144-I161 HydrophobicContact CG-CD1 4Å; R144-I161 HydrophobicContact CG-CG1 4.35Å; R144-I161 HydrophobicContact CG-CG2 3.72Å; V147-I161 HydrophobicContact CB-CG1 4.1Å; V147-I161 HydrophobicContact CG1-CG1 4.26Å; V147-I161 HydrophobicContact CG2-CG1 4.41Å; A156-I161 HydrophobicContact CB-CD1 3.95Å; A156-I161 HydrophobicContact CB-CG1 4.38Å; P157-I161 PolarHBondContact O-N 2.89Å; S158-I161 PolarHBondContact O-N 2.99Å; I161-L163 PolarHBondContact O-N 3.11Å; I161-V164 PolarHBondContact O-N 3.27Å; I161-S165 VanDerWaalsContact O-CB 3.26Å; I161-S165 WeakPolarHBondContact O-CB 3.23Å; I161-S165 PolarHBondContact O-N 3.23Å; I161-S165 PolarHBondContact O-OG 3.37Å |
| 162 | K | 92.8 | Very high | 89.3 | Confident | 47 Ų | 47 | 58 Ų | 58 | 20% | 0.204 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -62.9 | -41.8 | 179.1 | -72.6 | 179.8 | 177.2 | -178.9 | 0 | 112.1 | L140 S158 A159 L160 S165 I166 L376 I377 | L140-K162 HydrophobicContact CD2-CG 3.98Å; S158-K162 WeakPolarHBondContact O-CG 3.32Å; S158-K162 PolarHBondContact O-N 3.46Å; A159-K162 PolarHBondContact O-N 3.32Å; L160-K162 VanDerWaalsContact C-N 3.3Å; L160-K162 PolarHBondContact O-N 2.99Å; K162-S165 WeakPolarHBondContact O-CB 3.26Å; K162-S165 PolarHBondContact O-N 3.02Å; K162-I166 VanDerWaalsContact O-CG1 3.32Å; K162-I166 WeakPolarHBondContact O-CG1 3.3Å; K162-I166 PolarHBondContact O-N 3.15Å; K162-L376 HydrophobicContact CB-CD2 3.89Å; K162-L376 HydrophobicContact CG-CD2 4.05Å; K162-I377 PolarHBondContact NZ-O 2.9Å |
| 163 | L | 94.2 | Very high | 90.1 | Very high | 103 Ų | 103 | 55.1 Ų | 55.1 | 54% | 0.539 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62 | -48.5 | 177.4 | -170.5 | 75 | 0 | 0 | 0 | 112 | A159 L160 I161 S165 I166 L167 | A159-L163 WeakPolarHBondContact O-CB 3.49Å; A159-L163 PolarHBondContact O-N 3.19Å; L160-L163 PolarHBondContact O-N 3.4Å; I161-L163 PolarHBondContact O-N 3.11Å; L163-S165 VanDerWaalsContact C-N 3.28Å; L163-S165 PolarHBondContact O-N 3.3Å; L163-I166 PolarHBondContact O-N 2.87Å; L163-L167 WeakPolarHBondContact O-CG 3.4Å; L163-L167 PolarHBondContact O-N 2.89Å |
| 164 | V | 94.2 | Very high | 90.7 | Very high | 26 Ų | 26 | 51.1 Ų | 51.1 | 16% | 0.158 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -62.6 | -38.2 | 177.1 | 174.5 | 0 | 0 | 0 | 0 | 111.1 | F142 V146 V147 L160 I161 L167 G168 | F142-V164 HydrophobicContact CD1-CG1 4.46Å; F142-V164 HydrophobicContact CE1-CG1 3.93Å; F142-V164 WeakPolarHBondContact CE1-O 3.27Å; V146-V164 HydrophobicContact CB-CG1 4.13Å; V146-V164 HydrophobicContact CG1-CG1 4.05Å; V147-V164 HydrophobicContact CG2-CB 4.2Å; V147-V164 HydrophobicContact CG2-CG1 4.47Å; V147-V164 HydrophobicContact CG2-CG2 3.81Å; L160-V164 HydrophobicContact CD1-CG2 4.16Å; L160-V164 HydrophobicContact CG-CG2 4.49Å; L160-V164 WeakPolarHBondContact O-CG2 3.28Å; L160-V164 PolarHBondContact O-N 3.16Å; I161-V164 PolarHBondContact O-N 3.27Å; V164-L167 PolarHBondContact O-N 3.47Å; V164-G168 PolarHBondContact O-N 3Å |
| 165 | S | 94.4 | Very high | 91 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61 | -46.3 | 175.7 | -57.9 | 0 | 0 | 0 | 0 | 111.5 | S139 L140 G143 I161 K162 L163 L167 G168 V169 | S139-S165 WeakPolarHBondContact O-CB 3.49Å; S139-S165 PolarHBondContact O-OG 3.02Å; S139-S165 WeakPolarHBondContact OG-CA 3.49Å; S139-S165 VanDerWaalsContact OG-CB 3.23Å; S139-S165 WeakPolarHBondContact OG-CB 3.21Å; S139-S165 PolarHBondContact OG-O 2.93Å; L140-S165 WeakPolarHBondContact CA-OG 3.49Å; G143-S165 WeakPolarHBondContact CA-OG 3.21Å; I161-S165 VanDerWaalsContact O-CB 3.26Å; I161-S165 WeakPolarHBondContact O-CB 3.23Å; I161-S165 PolarHBondContact O-N 3.23Å; I161-S165 PolarHBondContact O-OG 3.37Å; K162-S165 WeakPolarHBondContact O-CB 3.26Å; K162-S165 PolarHBondContact O-N 3.02Å; L163-S165 VanDerWaalsContact C-N 3.28Å; L163-S165 PolarHBondContact O-N 3.3Å; S165-L167 PolarHBondContact O-N 3.49Å; S165-G168 PolarHBondContact O-N 3.29Å; S165-V169 PolarHBondContact O-N 3.3Å |
| 166 | I | 94.7 | Very high | 91.3 | Very high | 38 Ų | 38 | 43 Ų | 43 | 20% | 0.195 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59.1 | -47.3 | 175.6 | -68.5 | 164.7 | 0 | 0 | 0 | 110.3 | K162 L163 G168 V169 T170 V373 L376 | K162-I166 VanDerWaalsContact O-CG1 3.32Å; K162-I166 WeakPolarHBondContact O-CG1 3.3Å; K162-I166 PolarHBondContact O-N 3.15Å; L163-I166 PolarHBondContact O-N 2.87Å; I166-G168 VanDerWaalsContact C-N 3.27Å; I166-G168 PolarHBondContact O-N 3.37Å; I166-V169 PolarHBondContact O-N 3.07Å; I166-V169 VanDerWaalsContact O-N 3.12Å; I166-T170 PolarHBondContact O-N 3.32Å; I166-T170 PolarHBondContact O-OG1 2.71Å; I166-V373 HydrophobicContact CD1-CG1 4.47Å; I166-L376 HydrophobicContact CD1-CD2 4.14Å; I166-L376 HydrophobicContact CG1-CD1 3.93Å; I166-L376 HydrophobicContact CG1-CD2 3.74Å; I166-L376 HydrophobicContact CG1-CG 4.45Å |
| 167 | L | 94.5 | Very high | 91.3 | Very high | 111 Ų | 111 | 43.1 Ų | 43.1 | 58% | 0.581 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -56 | -42.1 | 176.9 | -69.2 | 172.9 | 0 | 0 | 0 | 112.2 | L163 V164 S165 T170 F171 | L163-L167 WeakPolarHBondContact O-CG 3.4Å; L163-L167 PolarHBondContact O-N 2.89Å; V164-L167 PolarHBondContact O-N 3.47Å; S165-L167 PolarHBondContact O-N 3.49Å; L167-T170 PolarHBondContact O-N 3Å; L167-F171 WeakPolarHBondContact O-CB 3.42Å; L167-F171 PolarHBondContact O-N 3.1Å |
| 168 | G | 92.6 | Very high | 91.1 | Very high | 4 Ų | 4 | 49 Ų | 49 | 4% | 0.041 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62 | -43.1 | 176 | 0 | 0 | 0 | 0 | 0 | 113.2 | V164 S165 I166 F171 V172 | V164-G168 PolarHBondContact O-N 3Å; S165-G168 PolarHBondContact O-N 3.29Å; I166-G168 VanDerWaalsContact C-N 3.27Å; I166-G168 PolarHBondContact O-N 3.37Å; G168-F171 PolarHBondContact O-N 3.12Å; G168-V172 WeakPolarHBondContact O-CG2 3.41Å; G168-V172 PolarHBondContact O-N 3.28Å; G168-V172 VanDerWaalsContact O-N 3.14Å |
| 169 | V | 93 | Very high | 90.8 | Very high | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -66.4 | -44.6 | 176.3 | 171.5 | 0 | 0 | 0 | 0 | 110.9 | S139 S165 I166 F171 V172 V173 L327 F331 Y369 V372 | S139-V169 VanDerWaalsContact CB-CG2 3.44Å; S139-V169 WeakPolarHBondContact OG-CG2 3.39Å; S165-V169 PolarHBondContact O-N 3.3Å; I166-V169 PolarHBondContact O-N 3.07Å; I166-V169 VanDerWaalsContact O-N 3.12Å; V169-F171 VanDerWaalsContact C-N 3.29Å; V169-F171 PolarHBondContact O-N 3.46Å; V169-V172 PolarHBondContact O-N 3.49Å; V169-V173 HydrophobicContact CG1-CG2 4.21Å; V169-V173 WeakPolarHBondContact O-CB 3.22Å; V169-V173 WeakPolarHBondContact O-CG2 3.49Å; V169-V173 PolarHBondContact O-N 3.07Å; V169-L327 HydrophobicContact CG2-CD1 4.36Å; V169-F331 HydrophobicContact CG1-CE2 4.28Å; V169-F331 HydrophobicContact CG1-CZ 4.08Å; V169-Y369 HydrophobicContact CG1-CD2 3.84Å; V169-Y369 HydrophobicContact CG1-CE2 3.98Å; V169-V372 HydrophobicContact CG1-CG1 3.9Å; V169-V372 HydrophobicContact CG2-CG1 4.04Å |
| 170 | T | 93.3 | Very high | 90 | Very high | 55 Ų | 55 | 44.9 Ų | 44.9 | 34% | 0.337 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -59 | -42.6 | 178.2 | -53.3 | 0 | 0 | 0 | 0 | 111.3 | I166 L167 V173 A174 Y369 | I166-T170 PolarHBondContact O-N 3.32Å; I166-T170 PolarHBondContact O-OG1 2.71Å; L167-T170 PolarHBondContact O-N 3Å; T170-V173 PolarHBondContact O-N 3.43Å; T170-A174 VanDerWaalsContact O-CB 3.3Å; T170-A174 WeakPolarHBondContact O-CB 3.48Å; T170-A174 PolarHBondContact O-N 3.43Å; T170-Y369 PolarHBondContact OG1-OH 3.33Å |
| 171 | F | 91.8 | Very high | 89.4 | Confident | 113 Ų | 113 | 44.5 Ų | 44.5 | 50% | 0.496 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -59.8 | -49.9 | 175.2 | 174.8 | -98.4 | 0 | 0 | 0 | 111.9 | L167 G168 V169 V173 A174 V175 L324 | L167-F171 WeakPolarHBondContact O-CB 3.42Å; L167-F171 PolarHBondContact O-N 3.1Å; G168-F171 PolarHBondContact O-N 3.12Å; V169-F171 VanDerWaalsContact C-N 3.29Å; V169-F171 PolarHBondContact O-N 3.46Å; F171-V173 VanDerWaalsContact C-N 3.34Å; F171-V173 PolarHBondContact O-N 2.87Å; F171-A174 PolarHBondContact O-N 3.49Å; F171-V175 HydrophobicContact CE1-CG2 4.1Å; F171-V175 HydrophobicContact CE2-CG2 4.11Å; F171-V175 HydrophobicContact CZ-CG2 3.89Å; F171-V175 WeakPolarHBondContact O-CG2 3.35Å; F171-V175 PolarHBondContact O-N 2.98Å; F171-L324 HydrophobicContact CD1-CD1 4.3Å; F171-L324 HydrophobicContact CD1-CD2 4.01Å; F171-L324 HydrophobicContact CE1-CD2 3.94Å |
| 172 | V | 90.9 | Very high | 88.9 | Confident | 3 Ų | 3 | 48.2 Ų | 48.2 | 2% | 0.018 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.7 | -43.8 | 179.3 | 170.8 | 0 | 0 | 0 | 0 | 111.4 | G168 V169 V175 N176 L324 L327 N328 F331 | G168-V172 WeakPolarHBondContact O-CG2 3.41Å; G168-V172 PolarHBondContact O-N 3.28Å; G168-V172 VanDerWaalsContact O-N 3.14Å; V169-V172 PolarHBondContact O-N 3.49Å; V172-V175 PolarHBondContact O-N 2.97Å; V172-N176 PolarHBondContact O-N 3.37Å; V172-N176 PolarHBondContact O-ND2 3.44Å; V172-L324 HydrophobicContact CG2-CD1 3.5Å; V172-L324 VanDerWaalsContact CG2-CD1 3.5Å; V172-L324 HydrophobicContact CG2-CG 3.95Å; V172-L327 HydrophobicContact CG1-CB 4.38Å; V172-L327 HydrophobicContact CG2-CB 4.09Å; V172-N328 HydrophobicContact CG1-CB 4.07Å; V172-F331 HydrophobicContact CG1-CB 4.04Å; V172-F331 HydrophobicContact CG1-CD2 3.76Å; V172-F331 HydrophobicContact CG1-CG 4.13Å |
| 173 | V | 90.3 | Very high | 88.4 | Confident | 11 Ų | 11 | 46 Ų | 46 | 7% | 0.067 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.3 | -46.9 | 176.9 | 166.8 | 0 | 0 | 0 | 0 | 110.5 | V169 T170 F171 V175 N176 C177 F331 V365 Y369 | V169-V173 HydrophobicContact CG1-CG2 4.21Å; V169-V173 WeakPolarHBondContact O-CB 3.22Å; V169-V173 WeakPolarHBondContact O-CG2 3.49Å; V169-V173 PolarHBondContact O-N 3.07Å; T170-V173 PolarHBondContact O-N 3.43Å; F171-V173 VanDerWaalsContact C-N 3.34Å; F171-V173 PolarHBondContact O-N 2.87Å; V173-V175 PolarHBondContact O-N 3.39Å; V173-N176 PolarHBondContact O-N 3.45Å; V173-C177 WeakPolarHBondContact O-CB 3.19Å; V173-C177 PolarHBondContact O-N 2.85Å; V173-C177 PolarHBondContact O-SG 3.41Å; V173-F331 HydrophobicContact CG2-CD1 3.9Å; V173-F331 HydrophobicContact CG2-CE1 3.43Å; V173-F331 VanDerWaalsContact CG2-CE1 3.43Å; V173-F331 HydrophobicContact CG2-CE2 4.3Å; V173-F331 HydrophobicContact CG2-CG 4.49Å; V173-F331 HydrophobicContact CG2-CZ 3.66Å; V173-V365 HydrophobicContact CG1-CG1 3.89Å; V173-V365 HydrophobicContact CG2-CG1 4.44Å; V173-Y369 HydrophobicContact CB-CD2 4.39Å; V173-Y369 HydrophobicContact CG1-CD2 4.48Å; V173-Y369 HydrophobicContact CG2-CD2 3.94Å |
| 174 | A | 89.8 | Confident | 87.8 | Confident | 53 Ų | 53 | 42.9 Ų | 42.9 | 44% | 0.438 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -58.8 | -44.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | T170 F171 N176 C177 W178 | T170-A174 VanDerWaalsContact O-CB 3.3Å; T170-A174 WeakPolarHBondContact O-CB 3.48Å; T170-A174 PolarHBondContact O-N 3.43Å; F171-A174 PolarHBondContact O-N 3.49Å; A174-N176 PolarHBondContact O-N 3.06Å; A174-C177 PolarHBondContact O-N 3.26Å; A174-W178 WeakPolarHBondContact O-CB 3.29Å; A174-W178 PolarHBondContact O-N 2.9Å |
| 175 | V | 88.1 | Confident | 87.4 | Confident | 25 Ų | 25 | 49.4 Ų | 49.4 | 15% | 0.152 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.6 | -43.2 | 177.1 | 172.8 | 0 | 0 | 0 | 0 | 111.5 | F171 V172 V173 W178 S179 A183 | F171-V175 HydrophobicContact CE1-CG2 4.1Å; F171-V175 HydrophobicContact CE2-CG2 4.11Å; F171-V175 HydrophobicContact CZ-CG2 3.89Å; F171-V175 WeakPolarHBondContact O-CG2 3.35Å; F171-V175 PolarHBondContact O-N 2.98Å; V172-V175 PolarHBondContact O-N 2.97Å; V173-V175 PolarHBondContact O-N 3.39Å; V175-W178 PolarHBondContact O-N 3.34Å; V175-S179 PolarHBondContact O-N 2.93Å; V175-A183 HydrophobicContact CG1-CB 4.32Å |
| 176 | N | 86.3 | Confident | 87 | Confident | 11 Ų | 11 | 51.1 Ų | 51.1 | 6% | 0.059 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -70.2 | -31.7 | 179 | -80.6 | -88.1 | 0 | 0 | 0 | 112.8 | V172 V173 A174 A183 N328 T360 | V172-N176 PolarHBondContact O-N 3.37Å; V172-N176 PolarHBondContact O-ND2 3.44Å; V173-N176 PolarHBondContact O-N 3.45Å; A174-N176 PolarHBondContact O-N 3.06Å; N176-A183 WeakPolarHBondContact OD1-CB 3.2Å; N176-N328 PolarHBondContact ND2-OD1 2.87Å; N176-T360 VanDerWaalsContact O-CG2 3.29Å; N176-T360 WeakPolarHBondContact O-CG2 3.25Å |
| 177 | C | 84.9 | Confident | 86.6 | Confident | 24 Ų | 24 | 49.4 Ų | 49.4 | 16% | 0.162 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -71.1 | -38.3 | 173.9 | -68.3 | 0 | 0 | 0 | 0 | 111.8 | V173 A174 T360 L362 | V173-C177 WeakPolarHBondContact O-CB 3.19Å; V173-C177 PolarHBondContact O-N 2.85Å; V173-C177 PolarHBondContact O-SG 3.41Å; A174-C177 PolarHBondContact O-N 3.26Å; C177-T360 PolarHBondContact O-OG1 2.83Å; C177-T360 VanDerWaalsContact O-OG1 3.08Å; C177-L362 HydrophobicContact CB-CD1 3.6Å; C177-L362 WeakPolarHBondContact SG-CD1 3.4Å |
| 178 | W | 85.2 | Confident | 86.3 | Confident | 185 Ų | 185 | 45.9 Ų | 45.9 | 70% | 0.701 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -70.6 | -51.8 | -175.9 | -167.7 | -63.4 | 0 | 0 | 0 | 112.7 | A174 V175 Q358 | A174-W178 WeakPolarHBondContact O-CB 3.29Å; A174-W178 PolarHBondContact O-N 2.9Å; V175-W178 PolarHBondContact O-N 3.34Å; W178-Q358 WeakPolarHBondContact O-CB 3.47Å; W178-Q358 WeakPolarHBondContact O-CG 3.27Å; W178-Q358 PolarHBondContact O-OE1 3.48Å |
| 179 | S | 80.8 | Confident | 86.2 | Confident | 23 Ų | 23 | 49.7 Ų | 49.7 | 16% | 0.161 | 26% | 0.261 | C | S | . | . | trans | -160.7 | 131.2 | -179.5 | 176.2 | 0 | 0 | 0 | 0 | 112.8 | V175 S181 M182 A183 | V175-S179 PolarHBondContact O-N 2.93Å; S179-S181 VanDerWaalsContact C-N 3.28Å; S179-S181 PolarHBondContact O-N 3.19Å; S179-S181 PolarHBondContact OG-N 2.97Å; S179-M182 PolarHBondContact O-N 3.06Å; S179-A183 PolarHBondContact O-N 3.29Å | ||
| 180 | V | 75.2 | Confident | 86.1 | Confident | 38 Ų | 38 | 50.3 Ų | 50.3 | 23% | 0.23 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.9 | -39 | 174.2 | -173.5 | 0 | 0 | 0 | 0 | 111.5 | A183 S184 F332 T360 | V180-A183 PolarHBondContact O-N 3.35Å; V180-S184 WeakPolarHBondContact O-CB 3.3Å; V180-S184 PolarHBondContact O-N 3.3Å; V180-F332 HydrophobicContact CG1-CE2 3.55Å; V180-F332 HydrophobicContact CG1-CZ 3.89Å; V180-T360 HydrophobicContact CG2-CG2 3.49Å; V180-T360 VanDerWaalsContact CG2-CG2 3.49Å |
| 181 | S | 79.3 | Confident | 86 | Confident | 49 Ų | 49 | 47.9 Ų | 47.9 | 34% | 0.343 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -67 | -41.6 | -179.8 | -166.9 | 0 | 0 | 0 | 0 | 111.4 | S179 S184 R185 | S179-S181 VanDerWaalsContact C-N 3.28Å; S179-S181 PolarHBondContact O-N 3.19Å; S179-S181 PolarHBondContact OG-N 2.97Å; S181-S184 PolarHBondContact O-N 2.62Å; S181-R185 WeakPolarHBondContact O-CB 3.36Å; S181-R185 WeakPolarHBondContact O-CG 3.46Å; S181-R185 PolarHBondContact O-N 2.63Å |
| 182 | M | 81.8 | Confident | 86 | Confident | 93 Ų | 93 | 48.4 Ų | 48.4 | 46% | 0.458 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -65.5 | -40.9 | 174.9 | -71.3 | -60.4 | -62.2 | 0 | 0 | 112.1 | S179 S184 R185 T186 | S179-M182 PolarHBondContact O-N 3.06Å; M182-S184 VanDerWaalsContact C-N 3.34Å; M182-S184 PolarHBondContact O-N 2.71Å; M182-R185 PolarHBondContact O-N 3.23Å; M182-T186 VanDerWaalsContact O-CB 3.23Å; M182-T186 WeakPolarHBondContact O-CB 3.48Å; M182-T186 PolarHBondContact O-N 2.98Å; M182-T186 PolarHBondContact O-OG1 2.72Å |
| 183 | A | 82.3 | Confident | 86 | Confident | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.9 | -41.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | V175 N176 S179 V180 Q187 N328 F332 | V175-A183 HydrophobicContact CG1-CB 4.32Å; N176-A183 WeakPolarHBondContact OD1-CB 3.2Å; S179-A183 PolarHBondContact O-N 3.29Å; V180-A183 PolarHBondContact O-N 3.35Å; A183-Q187 PolarHBondContact O-N 2.93Å; A183-N328 PolarHBondContact O-ND2 3.48Å; A183-F332 HydrophobicContact CB-CD2 4.09Å; A183-F332 HydrophobicContact CB-CE2 4.39Å |
| 184 | S | 81.6 | Confident | 86 | Confident | 39 Ų | 39 | 50.1 Ų | 50.1 | 27% | 0.273 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -65.5 | -48 | 176.1 | -179.5 | 0 | 0 | 0 | 0 | 112.5 | V180 S181 M182 T186 Q187 V188 | V180-S184 WeakPolarHBondContact O-CB 3.3Å; V180-S184 PolarHBondContact O-N 3.3Å; S181-S184 PolarHBondContact O-N 2.62Å; M182-S184 VanDerWaalsContact C-N 3.34Å; M182-S184 PolarHBondContact O-N 2.71Å; S184-T186 PolarHBondContact O-N 2.78Å; S184-Q187 WeakPolarHBondContact O-CB 3.4Å; S184-Q187 PolarHBondContact O-N 3.5Å; S184-Q187 VanDerWaalsContact O-N 3.14Å; S184-V188 PolarHBondContact O-N 3.01Å; S184-V188 VanDerWaalsContact O-N 3.08Å |
| 185 | R | 85.1 | Confident | 86.1 | Confident | 163 Ų | 163 | 49 Ų | 49 | 62% | 0.615 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -60.7 | -44.5 | 176 | -71.3 | 174.7 | -175.8 | -172.7 | 0.9 | 111.8 | S181 M182 Q187 V188 T189 | S181-R185 WeakPolarHBondContact O-CB 3.36Å; S181-R185 WeakPolarHBondContact O-CG 3.46Å; S181-R185 PolarHBondContact O-N 2.63Å; M182-R185 PolarHBondContact O-N 3.23Å; R185-Q187 VanDerWaalsContact C-N 3.28Å; R185-Q187 PolarHBondContact O-N 3.4Å; R185-V188 PolarHBondContact O-N 3.23Å; R185-T189 PolarHBondContact O-N 3.46Å; R185-T189 PolarHBondContact O-OG1 3.12Å |
| 186 | T | 86.2 | Confident | 86.2 | Confident | 35 Ų | 35 | 53.5 Ų | 53.5 | 22% | 0.215 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -57.6 | -41.9 | 174.5 | -60.7 | 0 | 0 | 0 | 0 | 111.1 | M182 S184 V188 T189 L190 | M182-T186 VanDerWaalsContact O-CB 3.23Å; M182-T186 WeakPolarHBondContact O-CB 3.48Å; M182-T186 PolarHBondContact O-N 2.98Å; M182-T186 PolarHBondContact O-OG1 2.72Å; S184-T186 PolarHBondContact O-N 2.78Å; T186-V188 PolarHBondContact O-N 3.03Å; T186-T189 PolarHBondContact O-N 2.92Å; T186-L190 HydrophobicContact CG2-CD1 3.64Å; T186-L190 HydrophobicContact CG2-CG 4.17Å; T186-L190 WeakPolarHBondContact O-CB 3.49Å; T186-L190 VanDerWaalsContact O-CG 3.25Å; T186-L190 WeakPolarHBondContact O-CG 3.35Å; T186-L190 PolarHBondContact O-N 3.31Å |
| 187 | Q | 86.8 | Confident | 86.4 | Confident | 3 Ų | 3 | 53 Ų | 53 | 1% | 0.014 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -60.8 | -46 | 176.7 | -169.6 | 65.7 | 8.6 | 0 | 0 | 112.4 | F47 G50 A183 S184 R185 L190 T191 G325 N328 | F47-Q187 HydrophobicContact CD2-CG 3.85Å; F47-Q187 HydrophobicContact CE2-CG 4.36Å; G50-Q187 PolarHBondContact O-NE2 2.84Å; A183-Q187 PolarHBondContact O-N 2.93Å; S184-Q187 WeakPolarHBondContact O-CB 3.4Å; S184-Q187 PolarHBondContact O-N 3.5Å; S184-Q187 VanDerWaalsContact O-N 3.14Å; R185-Q187 VanDerWaalsContact C-N 3.28Å; R185-Q187 PolarHBondContact O-N 3.4Å; Q187-L190 PolarHBondContact O-N 2.87Å; Q187-T191 WeakPolarHBondContact O-CB 3.41Å; Q187-T191 PolarHBondContact O-N 3Å; Q187-T191 PolarHBondContact O-OG1 3.42Å; Q187-G325 PolarHBondContact NE2-O 2.93Å; Q187-G325 PolarHBondContact OE1-O 3.05Å; Q187-N328 PolarHBondContact OE1-ND2 2.99Å |
| 188 | V | 87.4 | Confident | 86.8 | Confident | 37 Ų | 37 | 51.9 Ų | 51.9 | 22% | 0.224 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -61.7 | -48.5 | 179.2 | 174 | 0 | 0 | 0 | 0 | 110.2 | S184 R185 T186 L190 T191 F192 | S184-V188 PolarHBondContact O-N 3.01Å; S184-V188 VanDerWaalsContact O-N 3.08Å; R185-V188 PolarHBondContact O-N 3.23Å; T186-V188 PolarHBondContact O-N 3.03Å; V188-L190 PolarHBondContact O-N 3.25Å; V188-T191 WeakPolarHBondContact O-CB 3.43Å; V188-T191 PolarHBondContact O-N 2.86Å; V188-T191 VanDerWaalsContact O-N 3.13Å; V188-F192 HydrophobicContact CG1-CD2 3.92Å; V188-F192 HydrophobicContact CG1-CE2 3.57Å; V188-F192 VanDerWaalsContact O-CD2 3.24Å; V188-F192 WeakPolarHBondContact O-CD2 3.33Å; V188-F192 PolarHBondContact O-N 2.92Å; V188-F192 VanDerWaalsContact O-N 3.08Å |
| 189 | T | 90.6 | Very high | 87.1 | Confident | 83 Ų | 83 | 45.5 Ų | 45.5 | 51% | 0.509 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -59.8 | -48.5 | 178.1 | -56.8 | 0 | 0 | 0 | 0 | 112.1 | R185 T186 T191 F192 I193 | R185-T189 PolarHBondContact O-N 3.46Å; R185-T189 PolarHBondContact O-OG1 3.12Å; T186-T189 PolarHBondContact O-N 2.92Å; T189-T191 PolarHBondContact O-N 3.47Å; T189-F192 PolarHBondContact O-N 3.41Å; T189-I193 HydrophobicContact CG2-CD1 4.06Å; T189-I193 WeakPolarHBondContact O-CG1 3.14Å; T189-I193 PolarHBondContact O-N 3.06Å |
| 190 | L | 91.4 | Very high | 87.6 | Confident | 13 Ų | 13 | 45.9 Ų | 45.9 | 7% | 0.068 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.4 | -27.7 | 177.4 | -69 | 173.3 | 0 | 0 | 0 | 112.3 | T186 Q187 V188 I193 K194 L321 | T186-L190 HydrophobicContact CG2-CD1 3.64Å; T186-L190 HydrophobicContact CG2-CG 4.17Å; T186-L190 WeakPolarHBondContact O-CB 3.49Å; T186-L190 VanDerWaalsContact O-CG 3.25Å; T186-L190 WeakPolarHBondContact O-CG 3.35Å; T186-L190 PolarHBondContact O-N 3.31Å; Q187-L190 PolarHBondContact O-N 2.87Å; V188-L190 PolarHBondContact O-N 3.25Å; L190-I193 HydrophobicContact CD2-CD1 4.44Å; L190-K194 VanDerWaalsContact O-CE 3.31Å; L190-K194 WeakPolarHBondContact O-CE 3.31Å; L190-K194 WeakPolarHBondContact O-CG 3.48Å; L190-K194 PolarHBondContact O-N 3.45Å; L190-L321 HydrophobicContact CD2-CB 4.19Å; L190-L321 HydrophobicContact CD2-CD2 4.17Å |
| 191 | T | 90.8 | Very high | 88.3 | Confident | 4 Ų | 4 | 44.1 Ų | 44.1 | 3% | 0.025 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -70.5 | -42.2 | 174.5 | -55.1 | 0 | 0 | 0 | 0 | 112.1 | S46 I49 G50 Q187 V188 T189 I193 K194 M195 | S46-T191 WeakPolarHBondContact O-CG2 3.28Å; S46-T191 PolarHBondContact O-OG1 2.62Å; I49-T191 HydrophobicContact CB-CG2 4.05Å; I49-T191 HydrophobicContact CG2-CG2 3.85Å; G50-T191 VanDerWaalsContact CA-OG1 3.3Å; G50-T191 WeakPolarHBondContact CA-OG1 3.28Å; Q187-T191 WeakPolarHBondContact O-CB 3.41Å; Q187-T191 PolarHBondContact O-N 3Å; Q187-T191 PolarHBondContact O-OG1 3.42Å; V188-T191 WeakPolarHBondContact O-CB 3.43Å; V188-T191 PolarHBondContact O-N 2.86Å; V188-T191 VanDerWaalsContact O-N 3.13Å; T189-T191 PolarHBondContact O-N 3.47Å; T191-I193 VanDerWaalsContact C-N 3.34Å; T191-I193 PolarHBondContact O-N 3.21Å; T191-K194 VanDerWaalsContact O-CG 3.23Å; T191-K194 WeakPolarHBondContact O-CG 3.41Å; T191-K194 PolarHBondContact O-N 3.33Å; T191-M195 HydrophobicContact CG2-CG 4.45Å; T191-M195 WeakPolarHBondContact O-CB 3.47Å; T191-M195 VanDerWaalsContact O-CG 3.24Å; T191-M195 WeakPolarHBondContact O-CG 3.32Å; T191-M195 PolarHBondContact O-N 3.3Å |
| 192 | F | 91.4 | Very high | 89 | Confident | 125 Ų | 125 | 42.7 Ų | 42.7 | 55% | 0.548 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -63.3 | -42.5 | 173.3 | -76.6 | -70.6 | 0 | 0 | 0 | 111.7 | V188 T189 K194 M195 F196 | V188-F192 HydrophobicContact CG1-CD2 3.92Å; V188-F192 HydrophobicContact CG1-CE2 3.57Å; V188-F192 VanDerWaalsContact O-CD2 3.24Å; V188-F192 WeakPolarHBondContact O-CD2 3.33Å; V188-F192 PolarHBondContact O-N 2.92Å; V188-F192 VanDerWaalsContact O-N 3.08Å; T189-F192 PolarHBondContact O-N 3.41Å; F192-K194 PolarHBondContact O-N 3.38Å; F192-M195 PolarHBondContact O-N 2.65Å; F192-F196 WeakPolarHBondContact O-CB 3.44Å; F192-F196 PolarHBondContact O-N 2.87Å |
| 193 | I | 91.7 | Very high | 89.5 | Confident | 49 Ų | 49 | 42.5 Ų | 42.5 | 25% | 0.251 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -60.6 | -47 | 178.1 | -66.9 | 169 | 0 | 0 | 0 | 111.4 | T189 L190 T191 F196 A197 L318 L321 | T189-I193 HydrophobicContact CG2-CD1 4.06Å; T189-I193 WeakPolarHBondContact O-CG1 3.14Å; T189-I193 PolarHBondContact O-N 3.06Å; L190-I193 HydrophobicContact CD2-CD1 4.44Å; T191-I193 VanDerWaalsContact C-N 3.34Å; T191-I193 PolarHBondContact O-N 3.21Å; I193-F196 WeakPolarHBondContact O-CB 3.39Å; I193-F196 PolarHBondContact O-N 2.68Å; I193-A197 PolarHBondContact O-N 3.07Å; I193-L318 HydrophobicContact CG2-CD2 3.67Å; I193-L321 HydrophobicContact CG2-CB 4.16Å; I193-L321 HydrophobicContact CG2-CD1 3.97Å |
| 194 | K | 89.4 | Confident | 89.9 | Confident | 1 Ų | 1 | 43.5 Ų | 43.5 | 0% | 0.004 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -67.8 | -36.8 | 179.7 | 73.4 | -177.4 | 80.3 | -152.8 | 0 | 112.5 | G50 V53 L190 T191 F192 F196 A197 L198 S322 | G50-K194 PolarHBondContact O-NZ 3.38Å; V53-K194 HydrophobicContact CB-CD 3.75Å; V53-K194 HydrophobicContact CG1-CD 3.77Å; V53-K194 HydrophobicContact CG1-CG 4.17Å; V53-K194 VanDerWaalsContact O-CD 3.28Å; V53-K194 WeakPolarHBondContact O-CD 3.43Å; V53-K194 PolarHBondContact O-NZ 3Å; L190-K194 VanDerWaalsContact O-CE 3.31Å; L190-K194 WeakPolarHBondContact O-CE 3.31Å; L190-K194 WeakPolarHBondContact O-CG 3.48Å; L190-K194 PolarHBondContact O-N 3.45Å; T191-K194 VanDerWaalsContact O-CG 3.23Å; T191-K194 WeakPolarHBondContact O-CG 3.41Å; T191-K194 PolarHBondContact O-N 3.33Å; F192-K194 PolarHBondContact O-N 3.38Å; K194-F196 VanDerWaalsContact C-N 3.33Å; K194-A197 WeakPolarHBondContact O-CB 3.2Å; K194-A197 PolarHBondContact O-N 3.28Å; K194-L198 WeakPolarHBondContact O-CG 3.32Å; K194-L198 PolarHBondContact O-N 2.89Å; K194-S322 WeakPolarHBondContact CB-OG 3.41Å; K194-S322 PolarHBondContact NZ-O 2.96Å |
| 195 | M | 91.6 | Very high | 90.3 | Very high | 30 Ų | 30 | 41.7 Ų | 41.7 | 15% | 0.148 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -65.7 | -40.7 | 176.8 | -70.1 | -55.4 | -68.9 | 0 | 0 | 110.7 | I49 T191 F192 A197 L198 V199 T272 F276 | I49-M195 HydrophobicContact CG2-CG 4.06Å; I49-M195 HydrophobicContact CG2-SD 3.49Å; I49-M195 WeakPolarHBondContact CG2-SD 3.37Å; T191-M195 HydrophobicContact CG2-CG 4.45Å; T191-M195 WeakPolarHBondContact O-CB 3.47Å; T191-M195 VanDerWaalsContact O-CG 3.24Å; T191-M195 WeakPolarHBondContact O-CG 3.32Å; T191-M195 PolarHBondContact O-N 3.3Å; F192-M195 PolarHBondContact O-N 2.65Å; M195-A197 VanDerWaalsContact C-N 3.33Å; M195-A197 PolarHBondContact O-N 2.73Å; M195-L198 PolarHBondContact O-N 3.07Å; M195-L198 HydrophobicContact SD-CD1 4.44Å; M195-V199 WeakPolarHBondContact O-CG2 3.31Å; M195-V199 PolarHBondContact O-N 3.46Å; M195-T272 HydrophobicContact CE-CG2 3.87Å; M195-F276 HydrophobicContact CE-CD1 3.65Å; M195-F276 HydrophobicContact CE-CD2 4.05Å; M195-F276 HydrophobicContact CE-CE1 3.43Å; M195-F276 VanDerWaalsContact CE-CE1 3.43Å; M195-F276 HydrophobicContact CE-CE2 3.84Å; M195-F276 HydrophobicContact CE-CG 3.95Å; M195-F276 HydrophobicContact CE-CZ 3.53Å |
| 196 | F | 91.6 | Very high | 90.6 | Very high | 118 Ų | 118 | 37.8 Ų | 37.8 | 52% | 0.518 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -59.4 | -42.5 | 171.4 | 178.3 | -106.1 | 0 | 0 | 0 | 112.2 | F192 I193 K194 L198 V199 L200 L318 | F192-F196 WeakPolarHBondContact O-CB 3.44Å; F192-F196 PolarHBondContact O-N 2.87Å; I193-F196 WeakPolarHBondContact O-CB 3.39Å; I193-F196 PolarHBondContact O-N 2.68Å; K194-F196 VanDerWaalsContact C-N 3.33Å; F196-L198 VanDerWaalsContact C-N 3.33Å; F196-L198 PolarHBondContact O-N 3.36Å; F196-V199 PolarHBondContact O-N 2.89Å; F196-L200 HydrophobicContact CD1-CD1 4.02Å; F196-L200 HydrophobicContact CD1-CG 4.41Å; F196-L200 HydrophobicContact CE1-CD1 3.45Å; F196-L200 VanDerWaalsContact CE1-CD1 3.45Å; F196-L200 HydrophobicContact CE1-CG 3.99Å; F196-L200 HydrophobicContact CE2-CD2 4.46Å; F196-L200 HydrophobicContact CE2-CG 4.4Å; F196-L200 HydrophobicContact CZ-CD1 3.84Å; F196-L200 HydrophobicContact CZ-CD2 4.06Å; F196-L200 HydrophobicContact CZ-CG 3.98Å; F196-L200 PolarHBondContact O-N 3.2Å; F196-L318 HydrophobicContact CD1-CD1 4.39Å |
| 197 | A | 90.3 | Very high | 90.8 | Very high | 2 Ų | 2 | 40 Ų | 40 | 2% | 0.017 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -59 | -42 | 176 | 0 | 0 | 0 | 0 | 0 | 112.9 | I193 K194 M195 L200 I201 L318 | I193-A197 PolarHBondContact O-N 3.07Å; K194-A197 WeakPolarHBondContact O-CB 3.2Å; K194-A197 PolarHBondContact O-N 3.28Å; M195-A197 VanDerWaalsContact C-N 3.33Å; M195-A197 PolarHBondContact O-N 2.73Å; A197-L200 PolarHBondContact O-N 3.01Å; A197-I201 PolarHBondContact O-N 3.34Å; A197-L318 HydrophobicContact CB-CB 3.7Å; A197-L318 HydrophobicContact CB-CD1 4.07Å; A197-L318 HydrophobicContact CB-CG 4.42Å |
| 198 | L | 92.1 | Very high | 90.9 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -66.4 | -40.7 | 175.9 | -61.6 | -174.1 | 0 | 0 | 0 | 111.6 | V53 I57 F58 K194 M195 F196 L200 I201 I202 F276 V280 | V53-L198 HydrophobicContact CG1-CD1 3.88Å; I57-L198 HydrophobicContact CG2-CD2 4.28Å; F58-L198 HydrophobicContact CE1-CD2 4.06Å; F58-L198 HydrophobicContact CZ-CD2 3.89Å; K194-L198 WeakPolarHBondContact O-CG 3.32Å; K194-L198 PolarHBondContact O-N 2.89Å; M195-L198 PolarHBondContact O-N 3.07Å; M195-L198 HydrophobicContact SD-CD1 4.44Å; F196-L198 VanDerWaalsContact C-N 3.33Å; F196-L198 PolarHBondContact O-N 3.36Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 2.82Å; L198-I201 PolarHBondContact O-N 2.93Å; L198-I202 VanDerWaalsContact O-CG1 3.25Å; L198-I202 WeakPolarHBondContact O-CG1 3.39Å; L198-I202 PolarHBondContact O-N 3.09Å; L198-F276 HydrophobicContact CB-CD1 3.8Å; L198-F276 HydrophobicContact CB-CE1 4.34Å; L198-F276 HydrophobicContact CD1-CB 4.16Å; L198-F276 HydrophobicContact CD1-CD1 3.94Å; L198-F276 HydrophobicContact CD1-CG 4.5Å; L198-V280 HydrophobicContact CB-CG2 4.25Å; L198-V280 HydrophobicContact CD2-CG2 4.04Å |
| 199 | V | 92.7 | Very high | 91 | Very high | 51 Ų | 51 | 41.7 Ų | 41.7 | 31% | 0.309 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -59.6 | -40.8 | 175.1 | 172.6 | 0 | 0 | 0 | 0 | 111.4 | M195 F196 I201 I202 I203 F276 | M195-V199 WeakPolarHBondContact O-CG2 3.31Å; M195-V199 PolarHBondContact O-N 3.46Å; F196-V199 PolarHBondContact O-N 2.89Å; V199-I201 PolarHBondContact O-N 3.37Å; V199-I202 PolarHBondContact O-N 3.18Å; V199-I203 HydrophobicContact CG1-CD1 3.47Å; V199-I203 VanDerWaalsContact CG1-CD1 3.47Å; V199-I203 HydrophobicContact CG1-CG1 4.01Å; V199-I203 WeakPolarHBondContact O-CG1 3.3Å; V199-I203 PolarHBondContact O-N 3.45Å; V199-F276 HydrophobicContact CG2-CE1 3.79Å; V199-F276 HydrophobicContact CG2-CZ 4.26Å |
| 200 | L | 90.6 | Very high | 91 | Very high | 31 Ų | 31 | 42 Ų | 42 | 16% | 0.162 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63.3 | -25 | 175.4 | -74.5 | -179 | 0 | 0 | 0 | 113.8 | F196 A197 L198 P204 I315 L318 | F196-L200 HydrophobicContact CD1-CD1 4.02Å; F196-L200 HydrophobicContact CD1-CG 4.41Å; F196-L200 HydrophobicContact CE1-CD1 3.45Å; F196-L200 VanDerWaalsContact CE1-CD1 3.45Å; F196-L200 HydrophobicContact CE1-CG 3.99Å; F196-L200 HydrophobicContact CE2-CD2 4.46Å; F196-L200 HydrophobicContact CE2-CG 4.4Å; F196-L200 HydrophobicContact CZ-CD1 3.84Å; F196-L200 HydrophobicContact CZ-CD2 4.06Å; F196-L200 HydrophobicContact CZ-CG 3.98Å; F196-L200 PolarHBondContact O-N 3.2Å; A197-L200 PolarHBondContact O-N 3.01Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 2.82Å; L200-P204 WeakPolarHBondContact O-CD 3.3Å; L200-P204 VanDerWaalsContact O-CG 3.26Å; L200-P204 WeakPolarHBondContact O-CG 3.39Å; L200-I315 HydrophobicContact CB-CD1 4.14Å; L200-I315 HydrophobicContact CD1-CD1 4.31Å; L200-L318 HydrophobicContact CD1-CD1 3.73Å |
| 201 | I | 90.8 | Very high | 90.9 | Very high | 1 Ų | 1 | 49.1 Ų | 49.1 | 1% | 0.005 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -82.6 | -41.6 | 173.2 | -65.2 | 169.5 | 0 | 0 | 0 | 110.5 | F58 A197 L198 V199 P204 V280 A283 Y284 F303 | F58-I201 HydrophobicContact CE1-CD1 4.07Å; A197-I201 PolarHBondContact O-N 3.34Å; L198-I201 PolarHBondContact O-N 2.93Å; V199-I201 PolarHBondContact O-N 3.37Å; I201-P204 WeakPolarHBondContact O-CD 3.48Å; I201-V280 HydrophobicContact CG2-CG1 4.23Å; I201-A283 HydrophobicContact CG2-CB 4.14Å; I201-A283 WeakPolarHBondContact O-CB 3.44Å; I201-Y284 HydrophobicContact CD1-CE1 4.48Å; I201-Y284 HydrophobicContact CG2-CD1 4.22Å; I201-Y284 HydrophobicContact CG2-CE1 3.7Å; I201-F303 HydrophobicContact CB-CE1 4.17Å; I201-F303 HydrophobicContact CG1-CD1 4.32Å; I201-F303 HydrophobicContact CG1-CE1 4.29Å; I201-F303 HydrophobicContact CG2-CD1 4.1Å; I201-F303 HydrophobicContact CG2-CE1 3.82Å; I201-F303 HydrophobicContact CG2-CE2 4.39Å; I201-F303 HydrophobicContact CG2-CZ 3.96Å; I201-F303 VanDerWaalsContact O-CZ 3.27Å; I201-F303 WeakPolarHBondContact O-CZ 3.34Å |
| 202 | I | 93.3 | Very high | 90.7 | Very high | 19 Ų | 19 | 51.2 Ų | 51.2 | 10% | 0.097 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -66.1 | -46.6 | -176.6 | -66.8 | 164.9 | 0 | 0 | 0 | 111.5 | L198 V199 G205 V206 F276 L279 V280 | L198-I202 VanDerWaalsContact O-CG1 3.25Å; L198-I202 WeakPolarHBondContact O-CG1 3.39Å; L198-I202 PolarHBondContact O-N 3.09Å; V199-I202 PolarHBondContact O-N 3.18Å; I202-G205 PolarHBondContact O-N 2.83Å; I202-G205 VanDerWaalsContact O-N 3.14Å; I202-V206 HydrophobicContact CG2-CG2 4.04Å; I202-V206 WeakPolarHBondContact O-CG2 3.38Å; I202-V206 PolarHBondContact O-N 3.33Å; I202-F276 HydrophobicContact CD1-CD1 3.78Å; I202-F276 HydrophobicContact CD1-CE1 4.19Å; I202-F276 HydrophobicContact CD1-CG 4.3Å; I202-L279 HydrophobicContact CD1-CB 3.85Å; I202-L279 HydrophobicContact CD1-CD1 4.34Å; I202-L279 HydrophobicContact CG1-CB 3.89Å; I202-L279 HydrophobicContact CG2-CB 4.13Å; I202-L279 HydrophobicContact CG2-CD1 4.35Å; I202-V280 HydrophobicContact CD1-CG2 4.05Å; I202-V280 HydrophobicContact CG1-CG2 3.8Å |
| 203 | I | 92.7 | Very high | 90.4 | Very high | 89 Ų | 89 | 51.1 Ų | 51.1 | 46% | 0.456 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -58.5 | -52 | -173.8 | -68.2 | 167.8 | 0 | 0 | 0 | 112 | V199 G205 V206 I207 | V199-I203 HydrophobicContact CG1-CD1 3.47Å; V199-I203 VanDerWaalsContact CG1-CD1 3.47Å; V199-I203 HydrophobicContact CG1-CG1 4.01Å; V199-I203 WeakPolarHBondContact O-CG1 3.3Å; V199-I203 PolarHBondContact O-N 3.45Å; I203-G205 VanDerWaalsContact C-N 3.27Å; I203-G205 PolarHBondContact O-N 3.35Å; I203-V206 PolarHBondContact O-N 3.25Å; I203-I207 HydrophobicContact CG2-CD1 3.75Å; I203-I207 HydrophobicContact CG2-CG1 4.43Å; I203-I207 WeakPolarHBondContact O-CG1 3.38Å; I203-I207 PolarHBondContact O-N 2.82Å |
| 204 | P | 90.6 | Very high | 90.1 | Very high | 21 Ų | 21 | 51 Ų | 51 | 14% | 0.136 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.4 | -34.3 | 177.1 | -23.7 | 34.9 | 0 | 0 | 0 | 113.3 | L200 I201 I207 A208 F303 A307 L308 | L200-P204 WeakPolarHBondContact O-CD 3.3Å; L200-P204 VanDerWaalsContact O-CG 3.26Å; L200-P204 WeakPolarHBondContact O-CG 3.39Å; I201-P204 WeakPolarHBondContact O-CD 3.48Å; P204-I207 PolarHBondContact O-N 2.87Å; P204-A208 WeakPolarHBondContact O-CB 3.42Å; P204-A208 PolarHBondContact O-N 3.4Å; P204-F303 HydrophobicContact CB-CZ 4.27Å; P204-A307 HydrophobicContact CB-CB 3.99Å; P204-L308 HydrophobicContact CG-CD1 4.15Å; P204-L308 HydrophobicContact CG-CD2 3.71Å; P204-L308 HydrophobicContact CG-CG 3.98Å |
| 205 | G | 89.7 | Confident | 89.8 | Confident | 1 Ų | 1 | 58.4 Ų | 58.4 | 1% | 0.01 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.4 | -44.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | I202 I203 A208 L209 T286 | I202-G205 PolarHBondContact O-N 2.83Å; I202-G205 VanDerWaalsContact O-N 3.14Å; I203-G205 VanDerWaalsContact C-N 3.27Å; I203-G205 PolarHBondContact O-N 3.35Å; G205-A208 PolarHBondContact O-N 3.43Å; G205-L209 WeakPolarHBondContact O-CB 3.2Å; G205-L209 PolarHBondContact O-N 2.87Å; G205-T286 WeakPolarHBondContact CA-OG1 3.44Å; G205-T286 PolarHBondContact O-OG1 3.34Å |
| 206 | V | 91.4 | Very high | 89.2 | Confident | 80 Ų | 80 | 59.1 Ų | 59.1 | 49% | 0.485 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -64.5 | -40.5 | 175.4 | 174.9 | 0 | 0 | 0 | 0 | 111.3 | I202 I203 L209 A210 | I202-V206 HydrophobicContact CG2-CG2 4.04Å; I202-V206 WeakPolarHBondContact O-CG2 3.38Å; I202-V206 PolarHBondContact O-N 3.33Å; I203-V206 PolarHBondContact O-N 3.25Å; V206-L209 WeakPolarHBondContact O-CB 3.36Å; V206-L209 PolarHBondContact O-N 3.11Å; V206-A210 WeakPolarHBondContact O-CB 3.12Å; V206-A210 PolarHBondContact O-N 3.38Å |
| 207 | I | 90.9 | Very high | 88.7 | Confident | 82 Ų | 82 | 56.2 Ų | 56.2 | 42% | 0.421 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -63.6 | -42.1 | 174.9 | -66.8 | 166.9 | 0 | 0 | 0 | 110.9 | I203 P204 L209 A210 K211 | I203-I207 HydrophobicContact CG2-CD1 3.75Å; I203-I207 HydrophobicContact CG2-CG1 4.43Å; I203-I207 WeakPolarHBondContact O-CG1 3.38Å; I203-I207 PolarHBondContact O-N 2.82Å; P204-I207 PolarHBondContact O-N 2.87Å; I207-L209 VanDerWaalsContact C-N 3.34Å; I207-A210 PolarHBondContact O-N 2.85Å; I207-K211 HydrophobicContact CG2-CD 4.35Å; I207-K211 WeakPolarHBondContact O-CG 3.46Å; I207-K211 PolarHBondContact O-N 3.44Å |
| 208 | A | 88.6 | Confident | 88.1 | Confident | 8 Ų | 8 | 62.8 Ų | 62.8 | 7% | 0.066 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.9 | -41.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | P204 G205 K211 G212 K213 V287 | P204-A208 WeakPolarHBondContact O-CB 3.42Å; P204-A208 PolarHBondContact O-N 3.4Å; G205-A208 PolarHBondContact O-N 3.43Å; A208-K211 PolarHBondContact O-N 3.34Å; A208-G212 PolarHBondContact O-N 3.02Å; A208-K213 HydrophobicContact CB-CD 4.24Å; A208-K213 WeakPolarHBondContact O-CB 3.37Å; A208-K213 PolarHBondContact O-N 3.21Å; A208-V287 HydrophobicContact CB-CG2 4.18Å |
| 209 | L | 89.6 | Confident | 87.2 | Confident | 67 Ų | 67 | 67.5 Ų | 67.5 | 35% | 0.351 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -62.5 | -44.8 | 174.8 | -167.7 | 71.7 | 0 | 0 | 0 | 111.5 | G205 V206 I207 K211 G212 T214 F217 T286 | G205-L209 WeakPolarHBondContact O-CB 3.2Å; G205-L209 PolarHBondContact O-N 2.87Å; V206-L209 WeakPolarHBondContact O-CB 3.36Å; V206-L209 PolarHBondContact O-N 3.11Å; I207-L209 VanDerWaalsContact C-N 3.34Å; L209-K211 PolarHBondContact O-N 2.8Å; L209-G212 PolarHBondContact O-N 2.98Å; L209-T214 HydrophobicContact CD1-CG2 3.72Å; L209-F217 HydrophobicContact CD1-CE2 4.37Å; L209-T286 HydrophobicContact CB-CG2 4.09Å; L209-T286 HydrophobicContact CD1-CG2 3.79Å; L209-T286 HydrophobicContact CG-CG2 4.49Å |
| 210 | A | 89.8 | Confident | 86.1 | Confident | 89 Ų | 89 | 65.3 Ų | 65.3 | 74% | 0.736 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -64.1 | -26.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | V206 I207 G212 | V206-A210 WeakPolarHBondContact O-CB 3.12Å; V206-A210 PolarHBondContact O-N 3.38Å; I207-A210 PolarHBondContact O-N 2.85Å; A210-G212 PolarHBondContact O-N 2.8Å |
| 211 | K | 89.7 | Confident | 85.5 | Confident | 164 Ų | 164 | 69.8 Ų | 69.8 | 71% | 0.713 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.7 | 1.2 | 172.1 | -71.6 | 177 | 179.5 | -176.2 | 0 | 113.7 | I207 A208 L209 | I207-K211 HydrophobicContact CG2-CD 4.35Å; I207-K211 WeakPolarHBondContact O-CG 3.46Å; I207-K211 PolarHBondContact O-N 3.44Å; A208-K211 PolarHBondContact O-N 3.34Å; L209-K211 PolarHBondContact O-N 2.8Å |
| 212 | G | 86.1 | Confident | 84.7 | Confident | 48 Ų | 48 | 74.4 Ų | 74.4 | 50% | 0.495 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 90.3 | 8.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | A208 L209 A210 T214 | A208-G212 PolarHBondContact O-N 3.02Å; L209-G212 PolarHBondContact O-N 2.98Å; A210-G212 PolarHBondContact O-N 2.8Å; G212-T214 PolarHBondContact O-N 3.12Å; G212-T214 PolarHBondContact O-OG1 2.93Å |
| 213 | K | 85.7 | Confident | 83.4 | Confident | 122 Ų | 122 | 80.7 Ų | 80.7 | 53% | 0.53 | 43% | 0.426 | S | S | . | . | trans | -72.9 | 77.7 | 176.9 | -67.4 | -173.7 | 173.7 | -170.6 | 0 | 111.4 | A208 | A208-K213 HydrophobicContact CB-CD 4.24Å; A208-K213 WeakPolarHBondContact O-CB 3.37Å; A208-K213 PolarHBondContact O-N 3.21Å | ||
| 214 | T | 84.9 | Confident | 82.1 | Confident | 48 Ų | 48 | 86 Ų | 86 | 29% | 0.294 | 45% | 0.449 | S | S | . | . | trans | -116.6 | 5 | -175.3 | 54.7 | 0 | 0 | 0 | 0 | 113.6 | L209 G212 N216 F217 Q218 | L209-T214 HydrophobicContact CD1-CG2 3.72Å; G212-T214 PolarHBondContact O-N 3.12Å; G212-T214 PolarHBondContact O-OG1 2.93Å; T214-N216 VanDerWaalsContact C-N 3.29Å; T214-N216 PolarHBondContact O-N 3.06Å; T214-F217 WeakPolarHBondContact O-CA 3.43Å; T214-F217 WeakPolarHBondContact O-CB 3.43Å; T214-F217 PolarHBondContact O-N 3.29Å; T214-Q218 PolarHBondContact O-N 3.26Å | ||
| 215 | E | 82.4 | Confident | 80.7 | Confident | 155 Ų | 155 | 86.7 Ų | 86.7 | 72% | 0.724 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -51.1 | -45.3 | -174.1 | -63.7 | 171.8 | -168.6 | 0 | 0 | 112.5 | F217 Q218 | E215-F217 PolarHBondContact O-N 3.45Å; E215-Q218 PolarHBondContact O-N 3.47Å |
| 216 | N | 79.5 | Confident | 79.6 | Confident | 45 Ų | 45 | 89.1 Ų | 89.1 | 24% | 0.241 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -68.4 | -15 | 179.4 | -66 | -35.4 | 0 | 0 | 0 | 114.5 | T214 Y285 M288 | T214-N216 VanDerWaalsContact C-N 3.29Å; T214-N216 PolarHBondContact O-N 3.06Å; N216-Y285 PolarHBondContact ND2-O 3.07Å; N216-M288 PolarHBondContact ND2-O 3.41Å |
| 217 | F | 80.8 | Confident | 78.5 | Confident | 58 Ų | 58 | 87.4 Ų | 87.4 | 25% | 0.254 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -97.2 | -20.2 | 179.6 | -60.1 | -83.8 | 0 | 0 | 0 | 113 | V71 L75 L209 T214 E215 N219 G220 V282 T286 | V71-F217 HydrophobicContact CG1-CE1 4.45Å; L75-F217 HydrophobicContact CD1-CE1 4.01Å; L209-F217 HydrophobicContact CD1-CE2 4.37Å; T214-F217 WeakPolarHBondContact O-CA 3.43Å; T214-F217 WeakPolarHBondContact O-CB 3.43Å; T214-F217 PolarHBondContact O-N 3.29Å; E215-F217 PolarHBondContact O-N 3.45Å; F217-N219 VanDerWaalsContact C-N 3.32Å; F217-N219 PolarHBondContact O-N 2.77Å; F217-G220 PolarHBondContact O-N 2.94Å; F217-V282 HydrophobicContact CZ-CG1 4.14Å; F217-T286 HydrophobicContact CE2-CG2 3.49Å; F217-T286 VanDerWaalsContact CE2-CG2 3.49Å; F217-T286 HydrophobicContact CZ-CG2 3.82Å |
| 218 | Q | 78.5 | Confident | 77.7 | Confident | 139 Ų | 139 | 89.9 Ų | 89.9 | 65% | 0.65 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -64.7 | -37.8 | -176.8 | -69.4 | 176.5 | 6.1 | 0 | 0 | 111.8 | T214 E215 | T214-Q218 PolarHBondContact O-N 3.26Å; E215-Q218 PolarHBondContact O-N 3.47Å |
| 219 | N | 72.1 | Confident | 77.1 | Confident | 100 Ų | 100 | 95 Ų | 95 | 54% | 0.535 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.3 | 25.3 | 176.2 | -69.7 | 4.8 | 0 | 0 | 0 | 112.5 | F217 F221 E222 | F217-N219 VanDerWaalsContact C-N 3.32Å; F217-N219 PolarHBondContact O-N 2.77Å; N219-F221 PolarHBondContact O-N 3.04Å; N219-E222 HydrophobicContact CB-CG 3.94Å; N219-E222 VanDerWaalsContact CB-OE1 3.28Å; N219-E222 WeakPolarHBondContact CB-OE1 3.31Å; N219-E222 PolarHBondContact ND2-OE1 2.9Å; N219-E222 PolarHBondContact O-N 3.17Å |
| 220 | G | 70.8 | Confident | 76.7 | Confident | 5 Ų | 5 | 97.2 Ų | 97.2 | 5% | 0.052 | 50% | 0.499 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | -4.4 | -170.3 | 0 | 0 | 0 | 0 | 0 | 116 | S70 G72 F217 | S70-G220 PolarHBondContact OG-O 3.31Å; G72-G220 WeakPolarHBondContact CA-O 3.23Å; G72-G220 PolarHBondContact N-O 3.49Å; F217-G220 PolarHBondContact O-N 2.94Å |
| 221 | F | 77.2 | Confident | 76.5 | Confident | 125 Ų | 125 | 94.7 Ų | 94.7 | 55% | 0.548 | 47% | 0.474 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -132.4 | 23.7 | 179.8 | -67.5 | -79.2 | 0 | 0 | 0 | 113.1 | L76 N219 L223 | L76-F221 HydrophobicContact CD1-CE1 3.81Å; L76-F221 HydrophobicContact CD1-CZ 4.34Å; L76-F221 HydrophobicContact CG-CE1 4.49Å; N219-F221 PolarHBondContact O-N 3.04Å; F221-L223 PolarHBondContact O-N 3.37Å |
| 222 | E | 74.1 | Confident | 76.2 | Confident | 97 Ų | 97 | 88.3 Ų | 88.3 | 45% | 0.453 | 45% | 0.449 | S | S | . | . | trans | -54.2 | 114.6 | 176.7 | -81.5 | -179.5 | 179 | 0 | 0 | 111.3 | N219 E224 S225 | N219-E222 HydrophobicContact CB-CG 3.94Å; N219-E222 VanDerWaalsContact CB-OE1 3.28Å; N219-E222 WeakPolarHBondContact CB-OE1 3.31Å; N219-E222 PolarHBondContact ND2-OE1 2.9Å; N219-E222 PolarHBondContact O-N 3.17Å; E222-E224 PolarHBondContact O-N 3.05Å; E222-S225 PolarHBondContact O-N 3.12Å; E222-S225 PolarHBondContact O-OG 3.35Å | ||
| 223 | L | 65.4 | Low | 76 | Confident | 151 Ų | 151 | 87.5 Ų | 87.5 | 79% | 0.791 | 43% | 0.433 | S | S | * | . | G | 310 helix | trans | -59.9 | -29.4 | -174.3 | -96.6 | 89.6 | 0 | 0 | 0 | 113.2 | F221 S225 I226 | F221-L223 PolarHBondContact O-N 3.37Å; L223-S225 PolarHBondContact O-N 3.34Å; L223-I226 HydrophobicContact CG-CD1 4.46Å; L223-I226 PolarHBondContact O-N 2.83Å |
| 224 | E | 65.4 | Low | 76.1 | Confident | 200 Ų | 200 | 81.7 Ų | 81.7 | 94% | 0.935 | 41% | 0.408 | S | S | * | . | G | 310 helix | trans | -65.8 | -24.6 | 178.9 | -64.7 | -172.9 | 175.8 | 0 | 0 | 112.8 | E222 | E222-E224 PolarHBondContact O-N 3.05Š|
| 225 | S | 62.7 | Low | 76.3 | Confident | 37 Ų | 37 | 81.7 Ų | 81.7 | 26% | 0.259 | 40% | 0.404 | S | S | . | . | G | 310 helix | trans | -87.2 | -10.7 | 178.4 | 70 | 0 | 0 | 0 | 0 | 113.8 | G69 S70 E222 L223 T227 | G69-S225 WeakPolarHBondContact CA-O 3.48Å; S70-S225 WeakPolarHBondContact CB-OG 3.14Å; S70-S225 PolarHBondContact OG-OG 3.31Å; E222-S225 PolarHBondContact O-N 3.12Å; E222-S225 PolarHBondContact O-OG 3.35Å; L223-S225 PolarHBondContact O-N 3.34Å; S225-T227 PolarHBondContact O-N 3.19Å |
| 226 | I | 66.9 | Low | 76.4 | Confident | 51 Ų | 51 | 74.6 Ų | 74.6 | 26% | 0.262 | 37% | 0.37 | S | S | . | . | trans | -82.3 | 113.7 | -172.6 | -61.7 | 177.9 | 0 | 0 | 0 | 110.5 | L73 L223 L228 | L73-I226 HydrophobicContact CD2-CG1 4.44Å; L73-I226 HydrophobicContact CD2-CG2 3.81Å; L223-I226 HydrophobicContact CG-CD1 4.46Å; L223-I226 PolarHBondContact O-N 2.83Å; I226-L228 HydrophobicContact CG2-CG 4.18Å | ||
| 227 | T | 67.4 | Low | 76.7 | Confident | 44 Ų | 44 | 73.8 Ų | 73.8 | 27% | 0.27 | 37% | 0.366 | S | S | . | . | trans | -99.1 | 86.6 | 175.2 | 41.4 | 0 | 0 | 0 | 0 | 110.4 | N67 S225 D229 R230 L231 | N67-T227 PolarHBondContact O-OG1 3.04Å; S225-T227 PolarHBondContact O-N 3.19Å; T227-D229 VanDerWaalsContact C-OD1 3.29Å; T227-D229 WeakPolarHBondContact CA-OD1 3.48Å; T227-D229 VanDerWaalsContact CB-OD1 3.22Å; T227-D229 WeakPolarHBondContact CB-OD1 3.27Å; T227-D229 PolarHBondContact O-N 2.83Å; T227-R230 PolarHBondContact O-N 3.25Å; T227-R230 VanDerWaalsContact O-N 3.12Å; T227-L231 PolarHBondContact O-N 3.19Å | ||
| 228 | L | 73.9 | Confident | 77.2 | Confident | 135 Ų | 135 | 71 Ų | 71 | 71% | 0.707 | 35% | 0.354 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.4 | -29.2 | 179.2 | -83.4 | 149.5 | 0 | 0 | 0 | 112.9 | I226 R230 | I226-L228 HydrophobicContact CG2-CG 4.18Å; L228-R230 VanDerWaalsContact C-N 3.33Å |
| 229 | D | 76.3 | Confident | 77.7 | Confident | 115 Ų | 115 | 64.6 Ų | 64.6 | 62% | 0.615 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.4 | -33.2 | 176.3 | 63.2 | -42 | 0 | 0 | 0 | 112.8 | T227 | T227-D229 VanDerWaalsContact C-OD1 3.29Å; T227-D229 WeakPolarHBondContact CA-OD1 3.48Å; T227-D229 VanDerWaalsContact CB-OD1 3.22Å; T227-D229 WeakPolarHBondContact CB-OD1 3.27Å; T227-D229 PolarHBondContact O-N 2.83Å |
| 230 | R | 81.8 | Confident | 78.4 | Confident | 113 Ų | 113 | 60.6 Ų | 60.6 | 43% | 0.426 | 30% | 0.301 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.6 | -9.2 | -178.6 | -62.4 | -174.5 | -176 | -173.9 | -0.1 | 113.9 | N67 T227 L228 P232 L233 A234 | N67-R230 HydrophobicContact CB-CB 4.27Å; N67-R230 CarbonylContact O-C 3.55Å; N67-R230 WeakPolarHBondContact O-CB 2.99Å; T227-R230 PolarHBondContact O-N 3.25Å; T227-R230 VanDerWaalsContact O-N 3.12Å; L228-R230 VanDerWaalsContact C-N 3.33Å; R230-P232 VanDerWaalsContact C-CD 3.41Å; R230-P232 VanDerWaalsContact C-N 3.32Å; R230-L233 WeakPolarHBondContact O-CA 3.3Å; R230-L233 WeakPolarHBondContact O-CB 3.38Å; R230-L233 PolarHBondContact O-N 2.87Å; R230-A234 PolarHBondContact O-N 3.06Å |
| 231 | L | 84.1 | Confident | 79.3 | Confident | 37 Ų | 37 | 60.4 Ų | 60.4 | 19% | 0.194 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -51.3 | -41.3 | 179 | -174.6 | 63.5 | 0 | 0 | 0 | 114 | L73 V77 T227 L233 A234 F235 | L73-L231 HydrophobicContact CD1-CD1 4.35Å; L73-L231 HydrophobicContact CD2-CD1 3.97Å; L73-L231 HydrophobicContact CG-CD1 4.14Å; V77-L231 HydrophobicContact CG2-CD1 3.76Å; T227-L231 PolarHBondContact O-N 3.19Å; L231-L233 VanDerWaalsContact C-N 3.26Å; L231-L233 PolarHBondContact O-N 2.96Å; L231-A234 VanDerWaalsContact O-CB 3.31Å; L231-A234 WeakPolarHBondContact O-CB 3.47Å; L231-A234 PolarHBondContact O-N 3.5Å; L231-F235 HydrophobicContact CD1-CD2 4.36Å; L231-F235 HydrophobicContact CD1-CE2 4.06Å; L231-F235 HydrophobicContact CD2-CE2 4.35Å; L231-F235 HydrophobicContact CG-CD2 4.16Å; L231-F235 HydrophobicContact CG-CE2 3.96Å; L231-F235 WeakPolarHBondContact O-CD2 3.31Å; L231-F235 PolarHBondContact O-N 3.38Å; L231-F235 VanDerWaalsContact O-N 3.12Å |
| 232 | P | 84.1 | Confident | 79.9 | Confident | 29 Ų | 29 | 54.5 Ų | 54.5 | 19% | 0.188 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -59.2 | -36.8 | 175.7 | -25.4 | 36.7 | 0 | 0 | 0 | 113 | R230 A234 F235 Y236 F433 L437 | R230-P232 VanDerWaalsContact C-CD 3.41Å; R230-P232 VanDerWaalsContact C-N 3.32Å; P232-A234 VanDerWaalsContact C-N 3.29Å; P232-A234 PolarHBondContact O-N 2.84Å; P232-F235 WeakPolarHBondContact O-CB 3.36Å; P232-F235 PolarHBondContact O-N 3.43Å; P232-Y236 PolarHBondContact O-N 3.31Å; P232-F433 HydrophobicContact CB-CE1 4.15Å; P232-F433 HydrophobicContact CB-CZ 4.28Å; P232-F433 HydrophobicContact CG-CZ 4.25Å; P232-L437 HydrophobicContact CB-CD1 3.54Å; P232-L437 HydrophobicContact CB-CD2 3.38Å; P232-L437 HydrophobicContact CB-CG 4.05Å; P232-L437 HydrophobicContact CG-CD1 4.42Å; P232-L437 WeakPolarHBondContact O-CD2 3.26Å |
| 233 | L | 82.9 | Confident | 80.4 | Confident | 31 Ų | 31 | 51 Ų | 51 | 16% | 0.162 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -69.1 | -29.4 | 177 | -60.5 | 172.2 | 0 | 0 | 0 | 111.7 | N67 R230 L231 Y236 N237 L437 S441 | N67-L233 HydrophobicContact CB-CB 4.27Å; N67-L233 WeakPolarHBondContact ND2-CB 3.24Å; R230-L233 WeakPolarHBondContact O-CA 3.3Å; R230-L233 WeakPolarHBondContact O-CB 3.38Å; R230-L233 PolarHBondContact O-N 2.87Å; L231-L233 VanDerWaalsContact C-N 3.26Å; L231-L233 PolarHBondContact O-N 2.96Å; L233-Y236 PolarHBondContact O-N 3.1Å; L233-N237 PolarHBondContact O-N 3.22Å; L233-N237 PolarHBondContact O-ND2 3.27Å; L233-L437 HydrophobicContact CD2-CD1 4.26Å; L233-L437 HydrophobicContact CD2-CD2 4.23Å; L233-L437 HydrophobicContact CD2-CG 4.2Å; L233-S441 VanDerWaalsContact CD2-CB 3.49Å; L233-S441 VanDerWaalsContact CD2-OG 3.28Å; L233-S441 WeakPolarHBondContact CD2-OG 3.47Å |
| 234 | A | 87.9 | Confident | 81.4 | Confident | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -65.3 | -46.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 111 | V64 N67 V77 R230 L231 P232 Y236 N237 G238 | V64-A234 HydrophobicContact CG1-CB 4.44Å; N67-A234 HydrophobicContact CB-CB 3.81Å; V77-A234 HydrophobicContact CG1-CB 4.23Å; V77-A234 HydrophobicContact CG2-CB 4.31Å; R230-A234 PolarHBondContact O-N 3.06Å; L231-A234 VanDerWaalsContact O-CB 3.31Å; L231-A234 WeakPolarHBondContact O-CB 3.47Å; L231-A234 PolarHBondContact O-N 3.5Å; P232-A234 VanDerWaalsContact C-N 3.29Å; P232-A234 PolarHBondContact O-N 2.84Å; A234-Y236 VanDerWaalsContact C-N 3.29Å; A234-Y236 PolarHBondContact O-N 3.46Å; A234-N237 PolarHBondContact O-N 3.17Å; A234-G238 PolarHBondContact O-N 3.18Å |
| 235 | F | 88.3 | Confident | 82.5 | Confident | 48 Ų | 48 | 34.5 Ų | 34.5 | 21% | 0.211 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.2 | -39.6 | 173.6 | -84.2 | -81.3 | 0 | 0 | 0 | 112.4 | V77 L80 C81 L84 L231 P232 G238 L239 | V77-F235 HydrophobicContact CG1-CD1 4.34Å; V77-F235 HydrophobicContact CG1-CG 4.36Å; V77-F235 HydrophobicContact CG2-CD2 4.47Å; V77-F235 HydrophobicContact CG2-CE2 4.13Å; V77-F235 HydrophobicContact CG2-CZ 4.32Å; L80-F235 HydrophobicContact CB-CE1 3.68Å; L80-F235 HydrophobicContact CB-CZ 4.1Å; L80-F235 HydrophobicContact CD1-CE1 4.27Å; L80-F235 HydrophobicContact CD1-CZ 3.8Å; C81-F235 VanDerWaalsContact SG-CD1 3.57Å; L84-F235 HydrophobicContact CD1-CD1 4.23Å; L84-F235 HydrophobicContact CD1-CE1 4.23Å; L231-F235 HydrophobicContact CD1-CD2 4.36Å; L231-F235 HydrophobicContact CD1-CE2 4.06Å; L231-F235 HydrophobicContact CD2-CE2 4.35Å; L231-F235 HydrophobicContact CG-CD2 4.16Å; L231-F235 HydrophobicContact CG-CE2 3.96Å; L231-F235 WeakPolarHBondContact O-CD2 3.31Å; L231-F235 PolarHBondContact O-N 3.38Å; L231-F235 VanDerWaalsContact O-N 3.12Å; P232-F235 WeakPolarHBondContact O-CB 3.36Å; P232-F235 PolarHBondContact O-N 3.43Å; F235-G238 PolarHBondContact O-N 3.05Å; F235-L239 VanDerWaalsContact O-CB 3.3Å; F235-L239 WeakPolarHBondContact O-CB 3.23Å; F235-L239 VanDerWaalsContact O-CG 3.26Å; F235-L239 WeakPolarHBondContact O-CG 3.4Å; F235-L239 PolarHBondContact O-N 3.45Å |
| 236 | Y | 84.7 | Confident | 83.7 | Confident | 7 Ų | 7 | 33.1 Ų | 33.1 | 3% | 0.027 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -59.9 | -47.6 | 176.4 | 176.7 | -97.3 | 0 | 0 | 0 | 112.3 | P232 L233 A234 Y240 N386 S389 I434 S438 | P232-Y236 PolarHBondContact O-N 3.31Å; L233-Y236 PolarHBondContact O-N 3.1Å; A234-Y236 VanDerWaalsContact C-N 3.29Å; A234-Y236 PolarHBondContact O-N 3.46Å; Y236-Y240 PolarHBondContact O-N 3.38Å; Y236-Y240 VanDerWaalsContact O-N 3.12Å; Y236-N386 WeakPolarHBondContact CE1-OD1 3.46Å; Y236-N386 WeakPolarHBondContact OH-CA 3.14Å; Y236-N386 PolarHBondContact OH-OD1 3.44Å; Y236-S389 WeakPolarHBondContact OH-CB 3.49Å; Y236-S389 PolarHBondContact OH-OG 3.35Å; Y236-I434 HydrophobicContact CD2-CG2 4.01Å; Y236-S438 WeakPolarHBondContact CE2-OG 3.25Å |
| 237 | N | 86 | Confident | 84.5 | Confident | 28 Ų | 28 | 31.6 Ų | 31.6 | 15% | 0.15 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -66.8 | -37.6 | 175.8 | -74.6 | -29.1 | 0 | 0 | 0 | 112.7 | A60 G63 V64 N67 L233 A234 Y240 | A60-N237 WeakPolarHBondContact CB-O 3.27Å; G63-N237 VanDerWaalsContact C-ND2 3.31Å; G63-N237 WeakPolarHBondContact CA-ND2 3.37Å; G63-N237 PolarHBondContact O-ND2 3.39Å; G63-N237 VanDerWaalsContact O-ND2 3.11Å; V64-N237 HydrophobicContact CG2-CB 3.91Å; N67-N237 PolarHBondContact ND2-ND2 3.37Å; N67-N237 VanDerWaalsContact ND2-ND2 3.18Å; L233-N237 PolarHBondContact O-N 3.22Å; L233-N237 PolarHBondContact O-ND2 3.27Å; A234-N237 PolarHBondContact O-N 3.17Å; N237-Y240 WeakPolarHBondContact O-CB 3.47Å |
| 238 | G | 90.3 | Very high | 85.3 | Confident | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -66.1 | -49 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | A234 F235 Y240 A241 Y242 | A234-G238 PolarHBondContact O-N 3.18Å; F235-G238 PolarHBondContact O-N 3.05Å; G238-Y240 PolarHBondContact O-N 3.46Å; G238-A241 WeakPolarHBondContact O-CB 3.4Å; G238-A241 PolarHBondContact O-N 2.91Å; G238-Y242 WeakPolarHBondContact O-CD2 3.37Å; G238-Y242 PolarHBondContact O-N 2.83Å |
| 239 | L | 88.9 | Confident | 85.9 | Confident | 3 Ų | 3 | 23.1 Ų | 23.1 | 2% | 0.016 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -66.3 | -26.2 | 179.4 | -71.3 | 171.1 | 0 | 0 | 0 | 113 | C81 L84 S85 F235 A241 Y242 G243 W393 I434 | C81-L239 HydrophobicContact CB-CD2 3.93Å; C81-L239 HydrophobicContact CB-CG 4.21Å; L84-L239 HydrophobicContact CB-CD2 4.16Å; S85-L239 WeakPolarHBondContact OG-CD2 3.49Å; F235-L239 VanDerWaalsContact O-CB 3.3Å; F235-L239 WeakPolarHBondContact O-CB 3.23Å; F235-L239 VanDerWaalsContact O-CG 3.26Å; F235-L239 WeakPolarHBondContact O-CG 3.4Å; F235-L239 PolarHBondContact O-N 3.45Å; L239-A241 VanDerWaalsContact C-N 3.31Å; L239-Y242 PolarHBondContact O-N 3.08Å; L239-G243 PolarHBondContact O-N 3.4Å; L239-W393 HydrophobicContact CB-CH2 4.01Å; L239-W393 HydrophobicContact CB-CZ2 3.63Å; L239-W393 HydrophobicContact CD1-CH2 4.18Å; L239-W393 HydrophobicContact CD1-CZ2 4.31Å; L239-W393 HydrophobicContact CD2-CH2 4.37Å; L239-W393 HydrophobicContact CG-CH2 4.44Å; L239-W393 HydrophobicContact CG-CZ2 4.48Å; L239-I434 HydrophobicContact CD1-CD1 3.24Å; L239-I434 HydrophobicContact CD1-CG1 4.25Å |
| 240 | Y | 86.3 | Confident | 86.1 | Confident | 17 Ų | 17 | 17.6 Ų | 17.6 | 7% | 0.067 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -57.8 | -44.4 | 167.7 | 159.7 | -100.6 | 0 | 0 | 0 | 111.7 | A60 Y137 Y236 N237 G238 Y242 G243 I385 | A60-Y240 HydrophobicContact CB-CD1 4.45Å; Y137-Y240 HydrophobicContact CD2-CE2 4.35Å; Y137-Y240 VanDerWaalsContact CD2-OH 3.27Å; Y137-Y240 WeakPolarHBondContact CD2-OH 3.15Å; Y137-Y240 HydrophobicContact CE1-CE2 4.3Å; Y137-Y240 AromaticContact CE2-CE2 3.56Å; Y137-Y240 HydrophobicContact CE2-CE2 3.56Å; Y137-Y240 AromaticContact CE2-CZ 3.73Å; Y137-Y240 WeakPolarHBondContact CE2-OH 3.26Å; Y137-Y240 AromaticContact CZ-CE2 3.57Å; Y236-Y240 PolarHBondContact O-N 3.38Å; Y236-Y240 VanDerWaalsContact O-N 3.12Å; N237-Y240 WeakPolarHBondContact O-CB 3.47Å; G238-Y240 PolarHBondContact O-N 3.46Å; Y240-Y242 VanDerWaalsContact C-N 3.29Å; Y240-Y242 PolarHBondContact O-N 3.49Å; Y240-G243 PolarHBondContact O-N 2.72Å; Y240-G243 VanDerWaalsContact O-N 3.1Å; Y240-I385 HydrophobicContact CD2-CG1 4.45Å; Y240-I385 HydrophobicContact CD2-CG2 3.87Å; Y240-I385 HydrophobicContact CE1-CD1 4.07Å; Y240-I385 HydrophobicContact CE2-CD1 3.98Å; Y240-I385 HydrophobicContact CE2-CG1 3.77Å; Y240-I385 HydrophobicContact CE2-CG2 4.05Å; Y240-I385 HydrophobicContact CG-CG2 4.31Å |
| 241 | A | 89.9 | Confident | 85.9 | Confident | 1 Ų | 1 | 12.2 Ų | 12.2 | 1% | 0.008 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -66.9 | -30.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | A60 W78 G238 L239 G243 Y277 | A60-A241 HydrophobicContact CB-CB 3.9Å; W78-A241 HydrophobicContact CH2-CB 3.52Å; W78-A241 HydrophobicContact CZ3-CB 3.57Å; G238-A241 WeakPolarHBondContact O-CB 3.4Å; G238-A241 PolarHBondContact O-N 2.91Å; L239-A241 VanDerWaalsContact C-N 3.31Å; A241-G243 VanDerWaalsContact C-N 3.27Å; A241-G243 PolarHBondContact O-N 2.59Å; A241-Y277 HydrophobicContact CB-CE2 4.11Å; A241-Y277 WeakPolarHBondContact O-CE2 3.36Å; A241-Y277 PolarHBondContact O-OH 3.37Å |
| 242 | Y | 90.6 | Very high | 85.8 | Confident | 0 Ų | 0 | 10.5 Ų | 10.5 | 0% | 0 | 6% | 0.058 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | 6 | 174.4 | -72.6 | -84.6 | 0 | 0 | 0 | 113.9 | W78 C81 S85 G238 L239 Y240 M270 V273 Y277 | W78-Y242 AromaticContact CE3-CE2 3.61Å; W78-Y242 HydrophobicContact CE3-CE2 3.61Å; W78-Y242 AromaticContact CZ3-CE2 3.98Å; W78-Y242 HydrophobicContact CZ3-CE2 3.98Å; W78-Y242 WeakPolarHBondContact O-CE2 3.28Å; W78-Y242 PolarHBondContact O-OH 3.47Å; C81-Y242 HydrophobicContact CB-CD2 3.72Å; C81-Y242 HydrophobicContact CB-CE2 3.72Å; S85-Y242 WeakPolarHBondContact OG-CB 3.46Å; G238-Y242 WeakPolarHBondContact O-CD2 3.37Å; G238-Y242 PolarHBondContact O-N 2.83Å; L239-Y242 PolarHBondContact O-N 3.08Å; Y240-Y242 VanDerWaalsContact C-N 3.29Å; Y240-Y242 PolarHBondContact O-N 3.49Å; Y242-M270 HydrophobicContact CD1-CE 3.96Å; Y242-V273 HydrophobicContact CD1-CG1 3.97Å; Y242-V273 HydrophobicContact CE1-CG1 3.87Å; Y242-Y277 HydrophobicContact CD1-CD2 4.11Å; Y242-Y277 HydrophobicContact CD1-CE2 4.2Å; Y242-Y277 HydrophobicContact CD2-CD2 4.3Å; Y242-Y277 AromaticContact CE1-CD2 3.62Å; Y242-Y277 HydrophobicContact CE1-CD2 3.62Å; Y242-Y277 HydrophobicContact CE1-CE2 4.16Å; Y242-Y277 HydrophobicContact CE1-CG 4.4Å; Y242-Y277 AromaticContact CE2-CD2 3.84Å; Y242-Y277 HydrophobicContact CE2-CD2 3.84Å; Y242-Y277 HydrophobicContact CE2-CE2 4.49Å; Y242-Y277 HydrophobicContact CG-CD2 4.42Å; Y242-Y277 HydrophobicContact CG-CE2 4.39Å; Y242-Y277 AromaticContact CZ-CD2 3.45Å; Y242-Y277 VanDerWaalsContact CZ-CD2 3.45Å; Y242-Y277 WeakPolarHBondContact OH-CB 3.44Å |
| 243 | G | 85.4 | Confident | 85.5 | Confident | 25 Ų | 25 | 12 Ų | 12 | 26% | 0.258 | 6% | 0.062 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -68.7 | 131.2 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | L239 Y240 A241 | L239-G243 PolarHBondContact O-N 3.4Å; Y240-G243 PolarHBondContact O-N 2.72Å; Y240-G243 VanDerWaalsContact O-N 3.1Å; A241-G243 VanDerWaalsContact C-N 3.27Å; A241-G243 PolarHBondContact O-N 2.59Å |
| 244 | G | 85.3 | Confident | 85.3 | Confident | 0 Ų | 0 | 11.1 Ų | 11.1 | 0% | 0 | 6% | 0.057 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 131.2 | -5.6 | 170.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | F246 Y247 | G244-F246 PolarHBondContact O-N 2.69Å; G244-Y247 VanDerWaalsContact CA-CD2 3.41Å; G244-Y247 WeakPolarHBondContact O-CD2 3.45Å; G244-Y247 PolarHBondContact O-N 3.39Å |
| 245 | W | 89.2 | Confident | 85.2 | Confident | 4 Ų | 4 | 11.1 Ų | 11.1 | 2% | 0.015 | 6% | 0.057 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.4 | -19.9 | 179.9 | 48.4 | -105.5 | 0 | 0 | 0 | 114.4 | V52 G88 A89 Y92 M270 F427 | V52-W245 HydrophobicContact CG2-CB 4.17Å; V52-W245 VanDerWaalsContact CG2-N 3.33Å; G88-W245 VanDerWaalsContact C-CH2 3.46Å; G88-W245 VanDerWaalsContact C-CZ3 3.48Å; G88-W245 WeakPolarHBondContact O-CZ3 3.28Å; A89-W245 HydrophobicContact CB-CB 3.94Å; A89-W245 HydrophobicContact CB-CD2 3.76Å; A89-W245 HydrophobicContact CB-CE3 3.61Å; A89-W245 HydrophobicContact CB-CG 3.9Å; A89-W245 HydrophobicContact CB-CZ3 4.35Å; Y92-W245 HydrophobicContact CD1-CZ3 4.15Å; Y92-W245 AromaticContact CD2-CH2 3.55Å; Y92-W245 HydrophobicContact CD2-CH2 3.55Å; Y92-W245 AromaticContact CD2-CZ3 3.31Å; Y92-W245 HydrophobicContact CD2-CZ3 3.31Å; Y92-W245 AromaticContact CE2-CH2 3.7Å; Y92-W245 HydrophobicContact CE2-CH2 3.7Å; Y92-W245 AromaticContact CE2-CZ3 3.87Å; Y92-W245 HydrophobicContact CE2-CZ3 3.87Å; Y92-W245 HydrophobicContact CG-CE3 4.45Å; Y92-W245 HydrophobicContact CG-CH2 4.17Å; Y92-W245 AromaticContact CG-CZ3 3.47Å; Y92-W245 HydrophobicContact CG-CZ3 3.47Å; Y92-W245 VanDerWaalsContact CG-CZ3 3.47Å; W245-M270 HydrophobicContact CB-CG 4.26Å; W245-M270 HydrophobicContact CB-SD 3.48Å; W245-M270 WeakPolarHBondContact CB-SD 3.44Å; W245-M270 HydrophobicContact CG-SD 4.11Å; W245-F427 HydrophobicContact CH2-CE1 4.45Å; W245-F427 HydrophobicContact CH2-CZ 4.16Å; W245-F427 AromaticContact CZ2-CZ 3.89Å; W245-F427 HydrophobicContact CZ2-CZ 3.89Å |
| 246 | F | 87.4 | Confident | 85.1 | Confident | 8 Ų | 8 | 11.9 Ų | 11.9 | 4% | 0.035 | 6% | 0.063 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -81.4 | -10.5 | 178.1 | 50.1 | -98.8 | 0 | 0 | 0 | 114 | Y92 H105 G244 L248 N249 F250 I396 | Y92-F246 HydrophobicContact CD1-CB 3.86Å; Y92-F246 HydrophobicContact CE1-CB 4.06Å; Y92-F246 HydrophobicContact CG-CB 4.44Å; H105-F246 AromaticContact CE1-CD2 3.94Å; H105-F246 AromaticContact CE1-CG 3.87Å; H105-F246 AromaticContact NE2-CD2 3.29Å; H105-F246 VanDerWaalsContact NE2-CD2 3.29Å; H105-F246 WeakPolarHBondContact NE2-CD2 3.35Å; H105-F246 AromaticContact NE2-CE2 3.66Å; H105-F246 AromaticContact NE2-CG 3.7Å; G244-F246 PolarHBondContact O-N 2.69Å; F246-L248 VanDerWaalsContact C-N 3.28Å; F246-L248 PolarHBondContact O-N 2.94Å; F246-N249 VanDerWaalsContact O-CB 3.28Å; F246-N249 WeakPolarHBondContact O-CB 3.34Å; F246-N249 PolarHBondContact O-N 3.34Å; F246-N249 PolarHBondContact O-ND2 3.28Å; F246-F250 AromaticContact CD2-CE2 3.77Å; F246-F250 HydrophobicContact CD2-CE2 3.77Å; F246-F250 AromaticContact CD2-CZ 3.99Å; F246-F250 HydrophobicContact CD2-CZ 3.99Å; F246-F250 HydrophobicContact CE2-CE2 4.14Å; F246-F250 HydrophobicContact CE2-CZ 4.36Å; F246-I396 HydrophobicContact CD1-CD1 4.36Å; F246-I396 HydrophobicContact CE1-CD1 4.1Å |
| 247 | Y | 84.2 | Confident | 85.2 | Confident | 18 Ų | 18 | 16.7 Ų | 16.7 | 7% | 0.071 | 9% | 0.089 | C | C | . | . | G | 310 helix | trans | -63.7 | -29.5 | -171.4 | -80.5 | -74.1 | 0 | 0 | 0 | 114.4 | T51 R131 G244 N249 F250 | T51-Y247 HydrophobicContact CG2-CD2 4.03Å; T51-Y247 HydrophobicContact CG2-CG 4.23Å; R131-Y247 VanDerWaalsContact NH1-CE1 3.3Å; G244-Y247 VanDerWaalsContact CA-CD2 3.41Å; G244-Y247 WeakPolarHBondContact O-CD2 3.45Å; G244-Y247 PolarHBondContact O-N 3.39Å; Y247-N249 PolarHBondContact O-N 3.29Å; Y247-F250 AromaticContact CD1-CD2 3.65Å; Y247-F250 HydrophobicContact CD1-CD2 3.65Å; Y247-F250 AromaticContact CD1-CE2 3.49Å; Y247-F250 HydrophobicContact CD1-CE2 3.49Å; Y247-F250 VanDerWaalsContact CD1-CE2 3.49Å; Y247-F250 HydrophobicContact CE1-CD2 4.45Å; Y247-F250 AromaticContact CE1-CE2 3.98Å; Y247-F250 HydrophobicContact CE1-CE2 3.98Å; Y247-F250 HydrophobicContact CG-CD2 4.34Å; Y247-F250 HydrophobicContact CG-CE2 4.19Å; Y247-F250 WeakPolarHBondContact O-CD2 3.42Å; Y247-F250 PolarHBondContact O-N 3.07Å; Y247-F250 VanDerWaalsContact O-N 3.16Å |
| 248 | L | 84.6 | Confident | 85.2 | Confident | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 9% | 0.086 | C | C | . | . | G | 310 helix | trans | -60.7 | -29.1 | 176.1 | -171.1 | 68.3 | 0 | 0 | 0 | 111.9 | A44 F47 I48 F246 F250 V251 T252 V255 I262 A265 | A44-L248 HydrophobicContact CB-CD1 3.77Å; A44-L248 HydrophobicContact CB-CD2 4.05Å; F47-L248 HydrophobicContact CD1-CD1 4.42Å; I48-L248 HydrophobicContact CD1-CB 3.88Å; I48-L248 HydrophobicContact CD1-CD2 3.64Å; I48-L248 HydrophobicContact CD1-CG 4.32Å; I48-L248 HydrophobicContact CG1-CB 3.82Å; I48-L248 HydrophobicContact CG1-CD2 4.31Å; F246-L248 VanDerWaalsContact C-N 3.28Å; F246-L248 PolarHBondContact O-N 2.94Å; L248-F250 PolarHBondContact O-N 3.41Å; L248-V251 HydrophobicContact CD1-CG2 4.03Å; L248-V251 CarbonylContact O-C 3.57Å; L248-V251 WeakPolarHBondContact O-CG2 3.08Å; L248-V251 PolarHBondContact O-N 3.21Å; L248-V251 VanDerWaalsContact O-N 3.1Å; L248-T252 PolarHBondContact O-N 3.24Å; L248-V255 HydrophobicContact CD1-CG2 3.95Å; L248-V255 HydrophobicContact CG-CG2 4.4Å; L248-I262 HydrophobicContact CD2-CB 4.47Å; L248-I262 HydrophobicContact CD2-CG1 4.17Å; L248-I262 HydrophobicContact CD2-CG2 4.42Å; L248-A265 HydrophobicContact CD2-CB 3.82Å |
| 249 | N | 86.3 | Confident | 85.1 | Confident | 1 Ų | 1 | 19.9 Ų | 19.9 | 1% | 0.005 | 11% | 0.107 | C | C | . | . | G | 310 helix | trans | -71.1 | -15.1 | -179.6 | -64.8 | -66.8 | 0 | 0 | 0 | 113.9 | Y92 G104 Y108 F246 Y247 V251 T252 | Y92-N249 PolarHBondContact O-OD1 3.18Å; G104-N249 PolarHBondContact N-O 3.45Å; Y108-N249 HydrophobicContact CE2-CB 4.33Å; Y108-N249 VanDerWaalsContact OH-CB 3.3Å; Y108-N249 WeakPolarHBondContact OH-CB 3.39Å; Y108-N249 PolarHBondContact OH-OD1 3.36Å; F246-N249 VanDerWaalsContact O-CB 3.28Å; F246-N249 WeakPolarHBondContact O-CB 3.34Å; F246-N249 PolarHBondContact O-N 3.34Å; F246-N249 PolarHBondContact O-ND2 3.28Å; Y247-N249 PolarHBondContact O-N 3.29Å; N249-V251 VanDerWaalsContact C-N 3.3Å; N249-T252 WeakPolarHBondContact CA-OG1 2.92Å; N249-T252 PolarHBondContact O-OG1 2.92Å |
| 250 | F | 80.7 | Confident | 85.1 | Confident | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 14% | 0.139 | C | C | . | . | G | 310 helix | trans | -77.9 | -19.8 | 172.4 | -58.5 | -61.9 | 0 | 0 | 0 | 112.7 | G103 H105 F246 Y247 L248 M337 | G103-F250 WeakPolarHBondContact O-CD1 3.41Å; H105-F250 AromaticContact CD2-CE1 3.66Å; H105-F250 AromaticContact CD2-CZ 3.35Å; H105-F250 WeakPolarHBondContact CD2-CZ 3.45Å; H105-F250 AromaticContact NE2-CZ 3.67Å; F246-F250 AromaticContact CD2-CE2 3.77Å; F246-F250 HydrophobicContact CD2-CE2 3.77Å; F246-F250 AromaticContact CD2-CZ 3.99Å; F246-F250 HydrophobicContact CD2-CZ 3.99Å; F246-F250 HydrophobicContact CE2-CE2 4.14Å; F246-F250 HydrophobicContact CE2-CZ 4.36Å; Y247-F250 AromaticContact CD1-CD2 3.65Å; Y247-F250 HydrophobicContact CD1-CD2 3.65Å; Y247-F250 AromaticContact CD1-CE2 3.49Å; Y247-F250 HydrophobicContact CD1-CE2 3.49Å; Y247-F250 VanDerWaalsContact CD1-CE2 3.49Å; Y247-F250 HydrophobicContact CE1-CD2 4.45Å; Y247-F250 AromaticContact CE1-CE2 3.98Å; Y247-F250 HydrophobicContact CE1-CE2 3.98Å; Y247-F250 HydrophobicContact CG-CD2 4.34Å; Y247-F250 HydrophobicContact CG-CE2 4.19Å; Y247-F250 WeakPolarHBondContact O-CD2 3.42Å; Y247-F250 PolarHBondContact O-N 3.07Å; Y247-F250 VanDerWaalsContact O-N 3.16Å; L248-F250 PolarHBondContact O-N 3.41Å; F250-M337 HydrophobicContact CD1-CB 4.37Å; F250-M337 HydrophobicContact CE1-SD 4.1Å |
| 251 | V | 77.8 | Confident | 85.3 | Confident | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 14% | 0.14 | C | C | . | . | S | Bend | trans | -115 | 21.8 | -176.7 | -68 | 0 | 0 | 0 | 0 | 111.8 | I39 L248 N249 E253 E254 V255 F332 R336 | I39-V251 HydrophobicContact CD1-CB 4.32Å; I39-V251 HydrophobicContact CD1-CG2 4.27Å; L248-V251 HydrophobicContact CD1-CG2 4.03Å; L248-V251 CarbonylContact O-C 3.57Å; L248-V251 WeakPolarHBondContact O-CG2 3.08Å; L248-V251 PolarHBondContact O-N 3.21Å; L248-V251 VanDerWaalsContact O-N 3.1Å; N249-V251 VanDerWaalsContact C-N 3.3Å; V251-E253 PolarHBondContact O-N 3.28Å; V251-E254 WeakPolarHBondContact O-CB 3.19Å; V251-E254 PolarHBondContact O-N 3.02Å; V251-V255 PolarHBondContact O-N 3.4Å; V251-F332 HydrophobicContact CG1-CD1 4.11Å; V251-F332 HydrophobicContact CG1-CE1 3.85Å; V251-R336 VanDerWaalsContact CG1-CD 3.42Å |
| 252 | T | 80.9 | Confident | 85.4 | Confident | 1 Ų | 1 | 28.3 Ų | 28.3 | 1% | 0.006 | 14% | 0.14 | C | C | . | . | G | 310 helix | trans | -52.2 | -39 | -178.1 | -59.5 | 0 | 0 | 0 | 0 | 113 | L248 N249 E254 V255 P258 I262 | L248-T252 PolarHBondContact O-N 3.24Å; N249-T252 WeakPolarHBondContact CA-OG1 2.92Å; N249-T252 PolarHBondContact O-OG1 2.92Å; T252-E254 VanDerWaalsContact C-N 3.25Å; T252-E254 PolarHBondContact O-N 3.47Å; T252-V255 PolarHBondContact O-N 3.05Å; T252-P258 HydrophobicContact CG2-CB 4.29Å; T252-I262 HydrophobicContact CG2-CD1 3.7Å |
| 253 | E | 77.2 | Confident | 85.4 | Confident | 60 Ų | 60 | 28.7 Ų | 28.7 | 28% | 0.28 | 14% | 0.142 | S | C | . | . | G | 310 helix | trans | -68.8 | -23 | 179.5 | -70.1 | 169.5 | 177.8 | 0 | 0 | 113.5 | R37 T100 K101 S102 V251 | R37-E253 WeakPolarHBondContact CG-O 3.49Å; T100-E253 WeakPolarHBondContact O-CG 3.32Å; K101-E253 WeakPolarHBondContact CA-OE1 3.46Å; S102-E253 VanDerWaalsContact CB-CD 3.46Å; S102-E253 VanDerWaalsContact CB-OE2 3.28Å; S102-E253 WeakPolarHBondContact CB-OE2 3.45Å; S102-E253 VanDerWaalsContact N-CD 3.25Å; S102-E253 PolarHBondContact N-OE1 3.11Å; S102-E253 VanDerWaalsContact OG-CB 3.25Å; S102-E253 WeakPolarHBondContact OG-CB 3.3Å; S102-E253 WeakPolarHBondContact OG-CG 3.37Å; S102-E253 PolarHBondContact OG-OE2 3.12Å; V251-E253 PolarHBondContact O-N 3.28Å |
| 254 | E | 80.2 | Confident | 85.8 | Confident | 12 Ų | 12 | 30.6 Ų | 30.6 | 6% | 0.056 | 15% | 0.146 | C | C | . | . | G | 310 helix | trans | -90.2 | -10.1 | 179.7 | -63.8 | 174.5 | -148 | 0 | 0 | 112.4 | L35 R37 E38 I39 V251 T252 R336 | L35-E254 HydrophobicContact CB-CG 4.18Å; R37-E254 CarbonylContact C-O 3.58Å; R37-E254 WeakPolarHBondContact CA-O 3.45Å; E38-E254 PolarHBondContact N-O 3.21Å; E38-E254 VanDerWaalsContact N-O 3.08Å; I39-E254 HydrophobicContact CD1-CB 3.91Å; I39-E254 HydrophobicContact CG1-CB 4.25Å; I39-E254 PolarHBondContact N-O 2.88Å; V251-E254 WeakPolarHBondContact O-CB 3.19Å; V251-E254 PolarHBondContact O-N 3.02Å; T252-E254 VanDerWaalsContact C-N 3.25Å; T252-E254 PolarHBondContact O-N 3.47Å; E254-R336 VanDerWaalsContact CD-NH2 3.29Å; E254-R336 IonicContact OE1-CZ 2.63Å; E254-R336 VanDerWaalsContact OE1-CZ 3.25Å; E254-R336 IonicContact OE1-NE 2.71Å; E254-R336 PolarHBondContact OE1-NE 3.08Å; E254-R336 IonicContact OE1-NH2 3.42Å; E254-R336 PolarHBondContact OE1-NH2 3.46Å; E254-R336 IonicContact OE2-CZ 2.92Å; E254-R336 IonicContact OE2-NE 2.93Å; E254-R336 IonicContact OE2-NH2 3.12Å; E254-R336 PolarHBondContact OE2-NH2 3.39Å |
| 255 | V | 85.3 | Confident | 86.1 | Confident | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 15% | 0.146 | C | C | . | . | B | Isolated β-bridge | trans | -81.6 | 130.2 | 179.6 | 177.2 | 0 | 0 | 0 | 0 | 110.8 | I39 L248 V251 T252 N257 N261 I262 | I39-V255 HydrophobicContact CB-CG2 4.34Å; I39-V255 HydrophobicContact CG2-CG2 4.34Å; I39-V255 WeakPolarHBondContact O-CA 3.41Å; L248-V255 HydrophobicContact CD1-CG2 3.95Å; L248-V255 HydrophobicContact CG-CG2 4.4Å; V251-V255 PolarHBondContact O-N 3.4Å; T252-V255 PolarHBondContact O-N 3.05Å; V255-N257 PolarHBondContact O-N 2.98Å; V255-N261 HydrophobicContact CG1-CB 4.04Å; V255-I262 HydrophobicContact CG1-CG1 4.21Å |
| 256 | I | 86.3 | Confident | 86.3 | Confident | 65 Ų | 65 | 30.4 Ų | 30.4 | 33% | 0.333 | 15% | 0.145 | S | C | . | . | S | Bend | trans | -70.1 | 129.7 | 172.7 | -59.4 | 170.6 | 0 | 0 | 0 | 108.2 | R37 I39 N261 | R37-I256 HydrophobicContact CB-CG1 4.34Å; I39-I256 PolarHBondContact O-N 3.39Å; I256-N261 WeakPolarHBondContact O-CB 3.2Å; I256-N261 PolarHBondContact O-ND2 3.26Å |
| 257 | N | 87.2 | Confident | 86.6 | Confident | 108 Ų | 108 | 33 Ų | 33 | 58% | 0.578 | 16% | 0.159 | S | C | * | . | S | Bend | trans | 49.4 | 64.2 | 179.1 | -65.9 | -33.1 | 0 | 0 | 0 | 114 | V255 N259 R260 N261 | V255-N257 PolarHBondContact O-N 2.98Å; N257-N259 VanDerWaalsContact C-N 3.27Å; N257-N259 PolarHBondContact O-N 2.88Å; N257-R260 PolarHBondContact O-N 3.04Å; N257-R260 VanDerWaalsContact O-N 3.13Å; N257-N261 WeakPolarHBondContact O-CB 3.29Å; N257-N261 PolarHBondContact O-N 2.91Å |
| 258 | P | 85.8 | Confident | 87.1 | Confident | 13 Ų | 13 | 35.2 Ų | 35.2 | 8% | 0.084 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -57.6 | -36.6 | -171.7 | 22.4 | -33.4 | 0 | 0 | 0 | 113.3 | T252 R260 I262 | T252-P258 HydrophobicContact CG2-CB 4.29Å; P258-R260 PolarHBondContact O-N 3.25Å; P258-R260 VanDerWaalsContact O-N 3.15Å; P258-I262 HydrophobicContact CB-CD1 3.57Å; P258-I262 HydrophobicContact CB-CG1 4.21Å; P258-I262 VanDerWaalsContact O-CB 3.31Å; P258-I262 WeakPolarHBondContact O-CB 3.4Å; P258-I262 WeakPolarHBondContact O-CG1 3.48Å; P258-I262 PolarHBondContact O-N 3.46Å |
| 259 | N | 88.1 | Confident | 87.5 | Confident | 82 Ų | 82 | 35.2 Ų | 35.2 | 44% | 0.439 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -56.4 | -32.6 | 179.8 | -66.7 | -13.2 | 0 | 0 | 0 | 114.1 | N257 P416 | N257-N259 VanDerWaalsContact C-N 3.27Å; N257-N259 PolarHBondContact O-N 2.88Å; N259-P416 HydrophobicContact CB-CB 4.05Å |
| 260 | R | 89.5 | Confident | 87.9 | Confident | 180 Ų | 180 | 35.1 Ų | 35.1 | 68% | 0.679 | 18% | 0.176 | S | C | * | . | H | α-helix | trans | -102.3 | -44.2 | 179.8 | -179.2 | 180 | 175.1 | -166.4 | -0.5 | 111.6 | N257 P258 L264 | N257-R260 PolarHBondContact O-N 3.04Å; N257-R260 VanDerWaalsContact O-N 3.13Å; P258-R260 PolarHBondContact O-N 3.25Å; P258-R260 VanDerWaalsContact O-N 3.15Å; R260-L264 HydrophobicContact CG-CD1 3.74Å; R260-L264 WeakPolarHBondContact O-CB 3.38Å; R260-L264 WeakPolarHBondContact O-CD1 3.16Å; R260-L264 VanDerWaalsContact O-CG 3.28Å; R260-L264 WeakPolarHBondContact O-CG 3.35Å; R260-L264 PolarHBondContact O-N 3.14Å |
| 261 | N | 90.5 | Very high | 88.6 | Confident | 18 Ų | 18 | 38.6 Ų | 38.6 | 10% | 0.096 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -77.3 | -31.7 | -169.7 | -74.4 | -4.9 | 0 | 0 | 0 | 113 | L41 V255 I256 N257 A265 | L41-N261 HydrophobicContact CD1-CB 4.18Å; V255-N261 HydrophobicContact CG1-CB 4.04Å; I256-N261 WeakPolarHBondContact O-CB 3.2Å; I256-N261 PolarHBondContact O-ND2 3.26Å; N257-N261 WeakPolarHBondContact O-CB 3.29Å; N257-N261 PolarHBondContact O-N 2.91Å; N261-A265 WeakPolarHBondContact O-CB 3.26Å; N261-A265 PolarHBondContact O-N 3.35Å |
| 262 | I | 90.4 | Very high | 89.4 | Confident | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -66.6 | -52.7 | 178.5 | -66 | 172.7 | 0 | 0 | 0 | 111.4 | L248 T252 V255 P258 L264 A265 I266 | L248-I262 HydrophobicContact CD2-CB 4.47Å; L248-I262 HydrophobicContact CD2-CG1 4.17Å; L248-I262 HydrophobicContact CD2-CG2 4.42Å; T252-I262 HydrophobicContact CG2-CD1 3.7Å; V255-I262 HydrophobicContact CG1-CG1 4.21Å; P258-I262 HydrophobicContact CB-CD1 3.57Å; P258-I262 HydrophobicContact CB-CG1 4.21Å; P258-I262 VanDerWaalsContact O-CB 3.31Å; P258-I262 WeakPolarHBondContact O-CB 3.4Å; P258-I262 WeakPolarHBondContact O-CG1 3.48Å; P258-I262 PolarHBondContact O-N 3.46Å; I262-L264 PolarHBondContact O-N 2.92Å; I262-A265 PolarHBondContact O-N 2.84Å; I262-I266 HydrophobicContact CG2-CD1 3.72Å; I262-I266 WeakPolarHBondContact O-CB 3.24Å; I262-I266 WeakPolarHBondContact O-CG1 3.33Å; I262-I266 PolarHBondContact O-N 3.3Å |
| 263 | P | 91.9 | Very high | 90.1 | Very high | 7 Ų | 7 | 40.8 Ų | 40.8 | 5% | 0.045 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60 | -44 | 178.2 | -23.8 | 34 | 0 | 0 | 0 | 112.9 | A93 T97 I266 I267 F417 | A93-P263 HydrophobicContact CB-CB 4.36Å; A93-P263 HydrophobicContact CB-CG 4.35Å; T97-P263 HydrophobicContact CG2-CG 3.95Å; P263-I266 PolarHBondContact O-N 3.45Å; P263-I267 VanDerWaalsContact O-CG1 3.31Å; P263-I267 WeakPolarHBondContact O-CG1 3.47Å; P263-I267 PolarHBondContact O-N 2.91Å; P263-F417 HydrophobicContact CB-CD1 4.5Å; P263-F417 HydrophobicContact CB-CD2 3.8Å; P263-F417 HydrophobicContact CB-CE2 3.87Å; P263-F417 HydrophobicContact CB-CG 4.14Å; P263-F417 HydrophobicContact CB-CZ 4.24Å; P263-F417 HydrophobicContact CG-CB 4.01Å; P263-F417 HydrophobicContact CG-CD1 4.31Å; P263-F417 HydrophobicContact CG-CD2 3.85Å; P263-F417 HydrophobicContact CG-CE2 4.4Å; P263-F417 HydrophobicContact CG-CG 3.79Å |
| 264 | L | 92.6 | Very high | 91 | Very high | 66 Ų | 66 | 39 Ų | 39 | 35% | 0.346 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -63.8 | -43.6 | 178.4 | -70.8 | 175.7 | 0 | 0 | 0 | 111.9 | L41 R260 I262 I266 I267 C268 | L41-L264 HydrophobicContact CD1-CB 3.92Å; R260-L264 HydrophobicContact CG-CD1 3.74Å; R260-L264 WeakPolarHBondContact O-CB 3.38Å; R260-L264 WeakPolarHBondContact O-CD1 3.16Å; R260-L264 VanDerWaalsContact O-CG 3.28Å; R260-L264 WeakPolarHBondContact O-CG 3.35Å; R260-L264 PolarHBondContact O-N 3.14Å; I262-L264 PolarHBondContact O-N 2.92Å; L264-I266 VanDerWaalsContact C-N 3.32Å; L264-I266 PolarHBondContact O-N 2.77Å; L264-I267 PolarHBondContact O-N 2.66Å; L264-C268 WeakPolarHBondContact O-CB 3.45Å; L264-C268 PolarHBondContact O-N 3.12Å; L264-C268 PolarHBondContact O-SG 2.99Å; L264-C268 VanDerWaalsContact O-SG 3.33Å |
| 265 | A | 92.6 | Very high | 91.7 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.6 | -42.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L41 A44 V45 I48 L248 N261 I262 S269 | L41-A265 HydrophobicContact CD1-CB 4.19Å; A44-A265 HydrophobicContact CB-CB 3.9Å; V45-A265 HydrophobicContact CG2-CB 3.95Å; I48-A265 HydrophobicContact CD1-CB 3.97Å; L248-A265 HydrophobicContact CD2-CB 3.82Å; N261-A265 WeakPolarHBondContact O-CB 3.26Å; N261-A265 PolarHBondContact O-N 3.35Å; I262-A265 PolarHBondContact O-N 2.84Å; A265-S269 WeakPolarHBondContact O-CB 3.35Å; A265-S269 PolarHBondContact O-N 2.87Å; A265-S269 PolarHBondContact O-OG 3.25Å |
| 266 | I | 92.7 | Very high | 92.2 | Very high | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.9 | -48.3 | 178.1 | -75.4 | 170.5 | 0 | 0 | 0 | 111.9 | I48 A89 A93 I262 P263 L264 S269 M270 | I48-I266 HydrophobicContact CD1-CB 4.46Å; I48-I266 HydrophobicContact CD1-CG1 3.7Å; A89-I266 HydrophobicContact CB-CG2 3.29Å; A93-I266 HydrophobicContact CB-CD1 3.79Å; I262-I266 HydrophobicContact CG2-CD1 3.72Å; I262-I266 WeakPolarHBondContact O-CB 3.24Å; I262-I266 WeakPolarHBondContact O-CG1 3.33Å; I262-I266 PolarHBondContact O-N 3.3Å; P263-I266 PolarHBondContact O-N 3.45Å; L264-I266 VanDerWaalsContact C-N 3.32Å; L264-I266 PolarHBondContact O-N 2.77Å; I266-S269 PolarHBondContact O-OG 3.09Å; I266-M270 WeakPolarHBondContact O-CB 3.24Å; I266-M270 VanDerWaalsContact O-CG 3.3Å; I266-M270 WeakPolarHBondContact O-CG 3.47Å; I266-M270 PolarHBondContact O-N 3.45Å |
| 267 | I | 93.6 | Very high | 92.6 | Very high | 62 Ų | 62 | 41 Ų | 41 | 32% | 0.318 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -65.5 | -50.7 | -177.4 | -67.4 | 166.8 | 0 | 0 | 0 | 110.3 | L90 P263 L264 S269 M270 V271 | L90-I267 HydrophobicContact CD2-CD1 3.84Å; L90-I267 HydrophobicContact CD2-CG1 3.7Å; P263-I267 VanDerWaalsContact O-CG1 3.31Å; P263-I267 WeakPolarHBondContact O-CG1 3.47Å; P263-I267 PolarHBondContact O-N 2.91Å; L264-I267 PolarHBondContact O-N 2.66Å; I267-S269 VanDerWaalsContact C-N 3.32Å; I267-S269 PolarHBondContact O-N 3.04Å; I267-M270 PolarHBondContact O-N 3.45Å; I267-V271 HydrophobicContact CG2-CG2 4.43Å; I267-V271 WeakPolarHBondContact O-CG2 3.38Å; I267-V271 PolarHBondContact O-N 3.36Å |
| 268 | C | 94.6 | Very high | 93 | Very high | 64 Ų | 64 | 37.8 Ų | 37.8 | 43% | 0.432 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -61 | -42.1 | -178.6 | -68.9 | 0 | 0 | 0 | 0 | 111.9 | V45 L264 T272 | V45-C268 HydrophobicContact CG2-CB 4.43Å; L264-C268 WeakPolarHBondContact O-CB 3.45Å; L264-C268 PolarHBondContact O-N 3.12Å; L264-C268 PolarHBondContact O-SG 2.99Å; L264-C268 VanDerWaalsContact O-SG 3.33Å; C268-T272 VanDerWaalsContact O-CB 3.32Å; C268-T272 WeakPolarHBondContact O-CB 3.37Å; C268-T272 PolarHBondContact O-N 3.46Å; C268-T272 VanDerWaalsContact O-N 3.14Å; C268-T272 PolarHBondContact O-OG1 2.86Å |
| 269 | S | 94 | Very high | 93.5 | Very high | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -66.3 | -48.6 | 178.3 | 56.3 | 0 | 0 | 0 | 0 | 112.1 | I48 A265 I266 I267 V271 T272 V273 | I48-S269 WeakPolarHBondContact CG2-OG 3.29Å; A265-S269 WeakPolarHBondContact O-CB 3.35Å; A265-S269 PolarHBondContact O-N 2.87Å; A265-S269 PolarHBondContact O-OG 3.25Å; I266-S269 PolarHBondContact O-OG 3.09Å; I267-S269 VanDerWaalsContact C-N 3.32Å; I267-S269 PolarHBondContact O-N 3.04Å; S269-V271 PolarHBondContact O-N 2.93Å; S269-T272 PolarHBondContact O-N 3.12Å; S269-V273 VanDerWaalsContact O-CG2 3.29Å; S269-V273 WeakPolarHBondContact O-CG2 3.18Å; S269-V273 PolarHBondContact O-N 3.2Å |
| 270 | M | 94.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -66.1 | -38.5 | -177.1 | -71 | -52 | -60.4 | 0 | 0 | 113.5 | V52 L86 A89 Y242 W245 I266 I267 T274 | V52-M270 HydrophobicContact CG2-SD 4.47Å; L86-M270 HydrophobicContact CD1-CB 3.92Å; A89-M270 HydrophobicContact CB-CG 4.01Å; Y242-M270 HydrophobicContact CD1-CE 3.96Å; W245-M270 HydrophobicContact CB-CG 4.26Å; W245-M270 HydrophobicContact CB-SD 3.48Å; W245-M270 WeakPolarHBondContact CB-SD 3.44Å; W245-M270 HydrophobicContact CG-SD 4.11Å; I266-M270 WeakPolarHBondContact O-CB 3.24Å; I266-M270 VanDerWaalsContact O-CG 3.3Å; I266-M270 WeakPolarHBondContact O-CG 3.47Å; I266-M270 PolarHBondContact O-N 3.45Å; I267-M270 PolarHBondContact O-N 3.45Å; M270-T274 WeakPolarHBondContact O-CB 3.44Å; M270-T274 PolarHBondContact O-N 2.81Å; M270-T274 PolarHBondContact O-OG1 3.21Å |
| 271 | V | 95.6 | Very high | 94 | Very high | 72 Ų | 72 | 27.9 Ų | 27.9 | 44% | 0.436 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -63.6 | -47.2 | 174 | 172.9 | 0 | 0 | 0 | 0 | 110.2 | I267 S269 V273 T274 V275 | I267-V271 HydrophobicContact CG2-CG2 4.43Å; I267-V271 WeakPolarHBondContact O-CG2 3.38Å; I267-V271 PolarHBondContact O-N 3.36Å; S269-V271 PolarHBondContact O-N 2.93Å; V271-V273 PolarHBondContact O-N 3.34Å; V271-T274 PolarHBondContact O-N 3.16Å; V271-V275 WeakPolarHBondContact O-CG2 3.28Å; V271-V275 PolarHBondContact O-N 2.98Å |
| 272 | T | 94.5 | Very high | 94.1 | Very high | 47 Ų | 47 | 28.7 Ų | 28.7 | 29% | 0.288 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -59 | -49.3 | 178.6 | -57.4 | 0 | 0 | 0 | 0 | 111.2 | I49 M195 C268 S269 T274 V275 F276 | I49-T272 HydrophobicContact CD1-CG2 4.27Å; M195-T272 HydrophobicContact CE-CG2 3.87Å; C268-T272 VanDerWaalsContact O-CB 3.32Å; C268-T272 WeakPolarHBondContact O-CB 3.37Å; C268-T272 PolarHBondContact O-N 3.46Å; C268-T272 VanDerWaalsContact O-N 3.14Å; C268-T272 PolarHBondContact O-OG1 2.86Å; S269-T272 PolarHBondContact O-N 3.12Å; T272-T274 VanDerWaalsContact C-N 3.32Å; T272-T274 PolarHBondContact O-N 3.49Å; T272-V275 PolarHBondContact O-N 3.3Å; T272-F276 HydrophobicContact CG2-CD2 3.98Å; T272-F276 HydrophobicContact CG2-CE2 3.96Å; T272-F276 WeakPolarHBondContact O-CD2 3.31Å; T272-F276 PolarHBondContact O-N 3.34Å |
| 273 | V | 95.1 | Very high | 94.3 | Very high | 1 Ų | 1 | 28.8 Ų | 28.8 | 1% | 0.006 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.7 | -42.7 | 179.1 | 173.3 | 0 | 0 | 0 | 0 | 111.2 | I49 V52 V53 Y242 S269 V271 F276 Y277 | I49-V273 HydrophobicContact CG1-CG2 4.44Å; V52-V273 HydrophobicContact CB-CG2 4.44Å; V52-V273 HydrophobicContact CG1-CG1 3.79Å; V52-V273 HydrophobicContact CG1-CG2 4.25Å; V53-V273 HydrophobicContact CG2-CG1 4.3Å; V53-V273 HydrophobicContact CG2-CG2 3.71Å; Y242-V273 HydrophobicContact CD1-CG1 3.97Å; Y242-V273 HydrophobicContact CE1-CG1 3.87Å; S269-V273 VanDerWaalsContact O-CG2 3.29Å; S269-V273 WeakPolarHBondContact O-CG2 3.18Å; S269-V273 PolarHBondContact O-N 3.2Å; V271-V273 PolarHBondContact O-N 3.34Å; V273-F276 PolarHBondContact O-N 3.42Å; V273-Y277 HydrophobicContact CG1-CD1 4.02Å; V273-Y277 HydrophobicContact CG1-CD2 3.84Å; V273-Y277 HydrophobicContact CG1-CE1 3.8Å; V273-Y277 HydrophobicContact CG1-CE2 3.62Å; V273-Y277 HydrophobicContact CG1-CG 4.06Å; V273-Y277 WeakPolarHBondContact O-CB 3.31Å; V273-Y277 WeakPolarHBondContact O-CD1 3.32Å; V273-Y277 VanDerWaalsContact O-CG 3.3Å; V273-Y277 PolarHBondContact O-N 3.29Å |
| 274 | T | 95.7 | Very high | 94.3 | Very high | 23 Ų | 23 | 28.4 Ų | 28.4 | 14% | 0.141 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -62.3 | -47.3 | -179 | -56.3 | 0 | 0 | 0 | 0 | 111.8 | G82 M270 V271 T272 F276 Y277 V278 | G82-T274 WeakPolarHBondContact CA-OG1 3.22Å; M270-T274 WeakPolarHBondContact O-CB 3.44Å; M270-T274 PolarHBondContact O-N 2.81Å; M270-T274 PolarHBondContact O-OG1 3.21Å; V271-T274 PolarHBondContact O-N 3.16Å; T272-T274 VanDerWaalsContact C-N 3.32Å; T272-T274 PolarHBondContact O-N 3.49Å; T274-F276 PolarHBondContact O-N 2.91Å; T274-Y277 PolarHBondContact O-N 3.08Å; T274-V278 WeakPolarHBondContact O-CG2 3.35Å; T274-V278 PolarHBondContact O-N 2.92Å; T274-V278 VanDerWaalsContact O-N 3.08Å |
| 275 | V | 95.8 | Very high | 94.2 | Very high | 75 Ų | 75 | 25.4 Ų | 25.4 | 46% | 0.455 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -59.7 | -48.5 | 177.1 | 171.9 | 0 | 0 | 0 | 0 | 110.6 | V271 T272 Y277 V278 L279 | V271-V275 WeakPolarHBondContact O-CG2 3.28Å; V271-V275 PolarHBondContact O-N 2.98Å; T272-V275 PolarHBondContact O-N 3.3Å; V275-Y277 PolarHBondContact O-N 3.13Å; V275-V278 PolarHBondContact O-N 3.32Å; V275-L279 HydrophobicContact CG1-CD1 3.76Å; V275-L279 HydrophobicContact CG1-CG 4.38Å; V275-L279 WeakPolarHBondContact O-CB 3.35Å; V275-L279 VanDerWaalsContact O-CG 3.24Å; V275-L279 WeakPolarHBondContact O-CG 3.21Å; V275-L279 PolarHBondContact O-N 3.19Å |
| 276 | F | 95.4 | Very high | 94.1 | Very high | 44 Ų | 44 | 25.8 Ų | 25.8 | 19% | 0.193 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -63.8 | -41.4 | -179.1 | -87.2 | -112.4 | 0 | 0 | 0 | 112.5 | M195 L198 V199 I202 T272 V273 T274 L279 V280 | M195-F276 HydrophobicContact CE-CD1 3.65Å; M195-F276 HydrophobicContact CE-CD2 4.05Å; M195-F276 HydrophobicContact CE-CE1 3.43Å; M195-F276 VanDerWaalsContact CE-CE1 3.43Å; M195-F276 HydrophobicContact CE-CE2 3.84Å; M195-F276 HydrophobicContact CE-CG 3.95Å; M195-F276 HydrophobicContact CE-CZ 3.53Å; L198-F276 HydrophobicContact CB-CD1 3.8Å; L198-F276 HydrophobicContact CB-CE1 4.34Å; L198-F276 HydrophobicContact CD1-CB 4.16Å; L198-F276 HydrophobicContact CD1-CD1 3.94Å; L198-F276 HydrophobicContact CD1-CG 4.5Å; V199-F276 HydrophobicContact CG2-CE1 3.79Å; V199-F276 HydrophobicContact CG2-CZ 4.26Å; I202-F276 HydrophobicContact CD1-CD1 3.78Å; I202-F276 HydrophobicContact CD1-CE1 4.19Å; I202-F276 HydrophobicContact CD1-CG 4.3Å; T272-F276 HydrophobicContact CG2-CD2 3.98Å; T272-F276 HydrophobicContact CG2-CE2 3.96Å; T272-F276 WeakPolarHBondContact O-CD2 3.31Å; T272-F276 PolarHBondContact O-N 3.34Å; V273-F276 PolarHBondContact O-N 3.42Å; T274-F276 PolarHBondContact O-N 2.91Å; F276-L279 PolarHBondContact O-N 2.83Å; F276-V280 WeakPolarHBondContact O-CB 3.15Å; F276-V280 WeakPolarHBondContact O-CG2 3.29Å; F276-V280 PolarHBondContact O-N 2.86Å |
| 277 | Y | 95.6 | Very high | 93.9 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -66.2 | -42.6 | -179.9 | -77.8 | 10 | 0 | 0 | 0 | 112.2 | V52 V53 I57 W78 A241 Y242 V273 T274 V275 V280 N281 | V52-Y277 PolarHBondContact O-OH 2.95Å; V53-Y277 WeakPolarHBondContact CA-OH 3.47Å; V53-Y277 HydrophobicContact CG1-CE1 4.42Å; V53-Y277 HydrophobicContact CG2-CE1 4.05Å; I57-Y277 HydrophobicContact CB-CD1 4.12Å; I57-Y277 HydrophobicContact CB-CE1 3.66Å; I57-Y277 HydrophobicContact CB-CE2 4.45Å; I57-Y277 HydrophobicContact CD1-CD1 3.73Å; I57-Y277 HydrophobicContact CD1-CD2 4.16Å; I57-Y277 HydrophobicContact CD1-CE1 4.18Å; I57-Y277 HydrophobicContact CD1-CG 3.7Å; I57-Y277 HydrophobicContact CG1-CD1 3.75Å; I57-Y277 HydrophobicContact CG1-CE1 3.83Å; I57-Y277 HydrophobicContact CG1-CG 4.25Å; I57-Y277 HydrophobicContact CG2-CE1 4.13Å; W78-Y277 AromaticContact CE3-CD2 3.88Å; W78-Y277 HydrophobicContact CE3-CD2 3.88Å; W78-Y277 HydrophobicContact CE3-CG 4.34Å; W78-Y277 HydrophobicContact CH2-CD2 4.5Å; W78-Y277 AromaticContact CZ3-CD2 3.43Å; W78-Y277 HydrophobicContact CZ3-CD2 3.43Å; W78-Y277 VanDerWaalsContact CZ3-CD2 3.43Å; W78-Y277 HydrophobicContact CZ3-CE2 4.02Å; W78-Y277 HydrophobicContact CZ3-CG 4.07Å; A241-Y277 HydrophobicContact CB-CE2 4.11Å; A241-Y277 WeakPolarHBondContact O-CE2 3.36Å; A241-Y277 PolarHBondContact O-OH 3.37Å; Y242-Y277 HydrophobicContact CD1-CD2 4.11Å; Y242-Y277 HydrophobicContact CD1-CE2 4.2Å; Y242-Y277 HydrophobicContact CD2-CD2 4.3Å; Y242-Y277 AromaticContact CE1-CD2 3.62Å; Y242-Y277 HydrophobicContact CE1-CD2 3.62Å; Y242-Y277 HydrophobicContact CE1-CE2 4.16Å; Y242-Y277 HydrophobicContact CE1-CG 4.4Å; Y242-Y277 AromaticContact CE2-CD2 3.84Å; Y242-Y277 HydrophobicContact CE2-CD2 3.84Å; Y242-Y277 HydrophobicContact CE2-CE2 4.49Å; Y242-Y277 HydrophobicContact CG-CD2 4.42Å; Y242-Y277 HydrophobicContact CG-CE2 4.39Å; Y242-Y277 AromaticContact CZ-CD2 3.45Å; Y242-Y277 VanDerWaalsContact CZ-CD2 3.45Å; Y242-Y277 WeakPolarHBondContact OH-CB 3.44Å; V273-Y277 HydrophobicContact CG1-CD1 4.02Å; V273-Y277 HydrophobicContact CG1-CD2 3.84Å; V273-Y277 HydrophobicContact CG1-CE1 3.8Å; V273-Y277 HydrophobicContact CG1-CE2 3.62Å; V273-Y277 HydrophobicContact CG1-CG 4.06Å; V273-Y277 WeakPolarHBondContact O-CB 3.31Å; V273-Y277 WeakPolarHBondContact O-CD1 3.32Å; V273-Y277 VanDerWaalsContact O-CG 3.3Å; V273-Y277 PolarHBondContact O-N 3.29Å; T274-Y277 PolarHBondContact O-N 3.08Å; V275-Y277 PolarHBondContact O-N 3.13Å; Y277-V280 PolarHBondContact O-N 3.48Å; Y277-N281 PolarHBondContact O-N 3.07Å; Y277-N281 PolarHBondContact O-ND2 3.19Å |
| 278 | V | 95.4 | Very high | 93.6 | Very high | 39 Ų | 39 | 24.2 Ų | 24.2 | 24% | 0.236 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -62.9 | -46.9 | 174.9 | 173.9 | 0 | 0 | 0 | 0 | 110.1 | W78 A79 T274 V275 V280 N281 V282 | W78-V278 HydrophobicContact CB-CG2 4.32Å; A79-V278 HydrophobicContact CB-CG2 4.33Å; T274-V278 WeakPolarHBondContact O-CG2 3.35Å; T274-V278 PolarHBondContact O-N 2.92Å; T274-V278 VanDerWaalsContact O-N 3.08Å; V275-V278 PolarHBondContact O-N 3.32Å; V278-V280 VanDerWaalsContact C-N 3.34Å; V278-V280 PolarHBondContact O-N 3.38Å; V278-N281 PolarHBondContact O-N 3.38Å; V278-V282 HydrophobicContact CG1-CG2 4.46Å; V278-V282 WeakPolarHBondContact O-CG2 3.36Å; V278-V282 PolarHBondContact O-N 2.99Å |
| 279 | L | 95.1 | Very high | 93.4 | Very high | 67 Ų | 67 | 23.7 Ų | 23.7 | 35% | 0.351 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -62.4 | -37.8 | 179.1 | -70.9 | 174.9 | 0 | 0 | 0 | 113.1 | I202 V275 F276 V282 A283 | I202-L279 HydrophobicContact CD1-CB 3.85Å; I202-L279 HydrophobicContact CD1-CD1 4.34Å; I202-L279 HydrophobicContact CG1-CB 3.89Å; I202-L279 HydrophobicContact CG2-CB 4.13Å; I202-L279 HydrophobicContact CG2-CD1 4.35Å; V275-L279 HydrophobicContact CG1-CD1 3.76Å; V275-L279 HydrophobicContact CG1-CG 4.38Å; V275-L279 WeakPolarHBondContact O-CB 3.35Å; V275-L279 VanDerWaalsContact O-CG 3.24Å; V275-L279 WeakPolarHBondContact O-CG 3.21Å; V275-L279 PolarHBondContact O-N 3.19Å; F276-L279 PolarHBondContact O-N 2.83Å; L279-V282 PolarHBondContact O-N 3.19Å; L279-A283 WeakPolarHBondContact O-CB 3.09Å; L279-A283 PolarHBondContact O-N 3.25Å |
| 280 | V | 94.3 | Very high | 93 | Very high | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -65 | -43.5 | 175.5 | 166.2 | 0 | 0 | 0 | 0 | 111.1 | I57 L198 I201 I202 F276 Y277 V278 A283 Y284 | I57-V280 HydrophobicContact CD1-CG1 4.25Å; I57-V280 HydrophobicContact CG1-CG1 4.02Å; L198-V280 HydrophobicContact CB-CG2 4.25Å; L198-V280 HydrophobicContact CD2-CG2 4.04Å; I201-V280 HydrophobicContact CG2-CG1 4.23Å; I202-V280 HydrophobicContact CD1-CG2 4.05Å; I202-V280 HydrophobicContact CG1-CG2 3.8Å; F276-V280 WeakPolarHBondContact O-CB 3.15Å; F276-V280 WeakPolarHBondContact O-CG2 3.29Å; F276-V280 PolarHBondContact O-N 2.86Å; Y277-V280 PolarHBondContact O-N 3.48Å; V278-V280 VanDerWaalsContact C-N 3.34Å; V278-V280 PolarHBondContact O-N 3.38Å; V280-A283 WeakPolarHBondContact O-CB 3.33Å; V280-A283 PolarHBondContact O-N 3.05Å; V280-Y284 HydrophobicContact CG1-CD2 4.01Å; V280-Y284 HydrophobicContact CG1-CE1 4.3Å; V280-Y284 HydrophobicContact CG1-CE2 3.44Å; V280-Y284 VanDerWaalsContact CG1-CE2 3.44Å; V280-Y284 PolarHBondContact O-N 3.31Å |
| 281 | N | 93.9 | Very high | 92.6 | Very high | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -66.7 | -39.5 | 176.6 | -76.7 | -78.8 | 0 | 0 | 0 | 111.7 | L75 W78 Y277 V278 A283 Y284 Y285 | L75-N281 HydrophobicContact CD2-CB 3.7Å; W78-N281 PolarHBondContact NE1-ND2 3.45Å; W78-N281 PolarHBondContact NE1-OD1 2.88Å; Y277-N281 PolarHBondContact O-N 3.07Å; Y277-N281 PolarHBondContact O-ND2 3.19Å; V278-N281 PolarHBondContact O-N 3.38Å; N281-A283 VanDerWaalsContact C-N 3.3Å; N281-A283 PolarHBondContact O-N 3.02Å; N281-Y284 PolarHBondContact O-N 3.22Å; N281-Y285 HydrophobicContact CB-CE2 4.11Å; N281-Y285 WeakPolarHBondContact O-CD2 3.42Å; N281-Y285 PolarHBondContact O-N 3.36Å |
| 282 | V | 93.4 | Very high | 92.2 | Very high | 35 Ų | 35 | 27.5 Ų | 27.5 | 21% | 0.212 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -56.8 | -46.5 | 170.6 | 171.3 | 0 | 0 | 0 | 0 | 110.2 | L75 F217 V278 L279 Y284 Y285 T286 | L75-V282 HydrophobicContact CD1-CG2 4.15Å; L75-V282 HydrophobicContact CD2-CG2 3.94Å; F217-V282 HydrophobicContact CZ-CG1 4.14Å; V278-V282 HydrophobicContact CG1-CG2 4.46Å; V278-V282 WeakPolarHBondContact O-CG2 3.36Å; V278-V282 PolarHBondContact O-N 2.99Å; L279-V282 PolarHBondContact O-N 3.19Å; V282-Y284 PolarHBondContact O-N 3.12Å; V282-Y285 PolarHBondContact O-N 3.24Å; V282-T286 HydrophobicContact CG1-CG2 4.3Å; V282-T286 VanDerWaalsContact O-CG2 3.28Å; V282-T286 WeakPolarHBondContact O-CG2 3.37Å; V282-T286 PolarHBondContact O-N 2.91Å; V282-T286 PolarHBondContact O-OG1 3.46Å |
| 283 | A | 93.3 | Very high | 91.8 | Very high | 2 Ų | 2 | 25.3 Ų | 25.3 | 2% | 0.017 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -59.4 | -45 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | I201 L279 V280 N281 Y285 T286 V287 F303 | I201-A283 HydrophobicContact CG2-CB 4.14Å; I201-A283 WeakPolarHBondContact O-CB 3.44Å; L279-A283 WeakPolarHBondContact O-CB 3.09Å; L279-A283 PolarHBondContact O-N 3.25Å; V280-A283 WeakPolarHBondContact O-CB 3.33Å; V280-A283 PolarHBondContact O-N 3.05Å; N281-A283 VanDerWaalsContact C-N 3.3Å; N281-A283 PolarHBondContact O-N 3.02Å; A283-Y285 PolarHBondContact O-N 3.43Å; A283-T286 WeakPolarHBondContact CA-OG1 3.49Å; A283-T286 PolarHBondContact O-N 3Å; A283-T286 PolarHBondContact O-OG1 3.39Å; A283-V287 PolarHBondContact O-N 3.37Å; A283-F303 HydrophobicContact CB-CE2 4.26Å; A283-F303 HydrophobicContact CB-CZ 4.42Å |
| 284 | Y | 92 | Very high | 91.5 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -57.9 | -46.4 | 175.7 | -67.7 | -28.1 | 0 | 0 | 0 | 112.4 | P61 I201 V280 N281 V282 T286 V287 M288 V299 F303 | P61-Y284 HydrophobicContact CB-CD2 4.47Å; P61-Y284 HydrophobicContact CG-CD2 4.32Å; P61-Y284 HydrophobicContact CG-CE2 4.11Å; I201-Y284 HydrophobicContact CD1-CE1 4.48Å; I201-Y284 HydrophobicContact CG2-CD1 4.22Å; I201-Y284 HydrophobicContact CG2-CE1 3.7Å; V280-Y284 HydrophobicContact CG1-CD2 4.01Å; V280-Y284 HydrophobicContact CG1-CE1 4.3Å; V280-Y284 HydrophobicContact CG1-CE2 3.44Å; V280-Y284 VanDerWaalsContact CG1-CE2 3.44Å; V280-Y284 PolarHBondContact O-N 3.31Å; N281-Y284 PolarHBondContact O-N 3.22Å; V282-Y284 PolarHBondContact O-N 3.12Å; Y284-T286 VanDerWaalsContact C-N 3.34Å; Y284-T286 PolarHBondContact O-N 3.01Å; Y284-V287 PolarHBondContact O-N 3.21Å; Y284-M288 WeakPolarHBondContact O-CB 3.36Å; Y284-M288 PolarHBondContact O-N 3.02Å; Y284-V299 HydrophobicContact CD1-CG1 4.18Å; Y284-V299 HydrophobicContact CD2-CG1 3.9Å; Y284-V299 HydrophobicContact CE1-CG1 4.17Å; Y284-V299 HydrophobicContact CE2-CG1 3.87Å; Y284-V299 HydrophobicContact CG-CG1 4.06Å; Y284-F303 HydrophobicContact CD1-CB 3.99Å; Y284-F303 AromaticContact CD1-CD2 3.65Å; Y284-F303 HydrophobicContact CD1-CD2 3.65Å; Y284-F303 HydrophobicContact CD1-CE2 4.33Å; Y284-F303 AromaticContact CD1-CG 3.91Å; Y284-F303 HydrophobicContact CD1-CG 3.91Å; Y284-F303 HydrophobicContact CE1-CB 3.9Å; Y284-F303 HydrophobicContact CE1-CD2 4.16Å; Y284-F303 AromaticContact CE1-CG 3.96Å; Y284-F303 HydrophobicContact CE1-CG 3.96Å |
| 285 | Y | 90.9 | Very high | 91 | Very high | 2 Ų | 2 | 34.2 Ų | 34.2 | 1% | 0.008 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -72.5 | -21.7 | 179.8 | -59.6 | -45.7 | 0 | 0 | 0 | 114.2 | L65 V71 S74 L75 N216 N281 V282 A283 L293 | L65-Y285 HydrophobicContact CD1-CE1 4.12Å; L65-Y285 HydrophobicContact CD2-CE1 4.1Å; V71-Y285 HydrophobicContact CG1-CD1 4.03Å; V71-Y285 HydrophobicContact CG1-CD2 3.48Å; V71-Y285 VanDerWaalsContact CG1-CD2 3.48Å; V71-Y285 HydrophobicContact CG1-CE1 4.42Å; V71-Y285 HydrophobicContact CG1-CE2 3.91Å; V71-Y285 HydrophobicContact CG1-CG 3.55Å; V71-Y285 HydrophobicContact CG2-CD1 4.35Å; S74-Y285 WeakPolarHBondContact CB-OH 2.98Å; S74-Y285 PolarHBondContact OG-OH 3.48Å; L75-Y285 HydrophobicContact CD1-CD2 4.41Å; L75-Y285 HydrophobicContact CD2-CD2 4.02Å; L75-Y285 HydrophobicContact CD2-CE2 3.89Å; L75-Y285 HydrophobicContact CG-CD2 4.19Å; L75-Y285 HydrophobicContact CG-CE2 4.04Å; N216-Y285 PolarHBondContact ND2-O 3.07Å; N281-Y285 HydrophobicContact CB-CE2 4.11Å; N281-Y285 WeakPolarHBondContact O-CD2 3.42Å; N281-Y285 PolarHBondContact O-N 3.36Å; V282-Y285 PolarHBondContact O-N 3.24Å; A283-Y285 PolarHBondContact O-N 3.43Å; Y285-L293 HydrophobicContact CD1-CD1 4.29Å; Y285-L293 HydrophobicContact CE1-CD1 3.85Å |
| 286 | T | 90.3 | Very high | 90.3 | Very high | 8 Ų | 8 | 31.2 Ų | 31.2 | 5% | 0.049 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -76.4 | -30 | 173.2 | 57.6 | 0 | 0 | 0 | 0 | 113.7 | G205 L209 F217 V282 A283 Y284 | G205-T286 WeakPolarHBondContact CA-OG1 3.44Å; G205-T286 PolarHBondContact O-OG1 3.34Å; L209-T286 HydrophobicContact CB-CG2 4.09Å; L209-T286 HydrophobicContact CD1-CG2 3.79Å; L209-T286 HydrophobicContact CG-CG2 4.49Å; F217-T286 HydrophobicContact CE2-CG2 3.49Å; F217-T286 VanDerWaalsContact CE2-CG2 3.49Å; F217-T286 HydrophobicContact CZ-CG2 3.82Å; V282-T286 HydrophobicContact CG1-CG2 4.3Å; V282-T286 VanDerWaalsContact O-CG2 3.28Å; V282-T286 WeakPolarHBondContact O-CG2 3.37Å; V282-T286 PolarHBondContact O-N 2.91Å; V282-T286 PolarHBondContact O-OG1 3.46Å; A283-T286 WeakPolarHBondContact CA-OG1 3.49Å; A283-T286 PolarHBondContact O-N 3Å; A283-T286 PolarHBondContact O-OG1 3.39Å; Y284-T286 VanDerWaalsContact C-N 3.34Å; Y284-T286 PolarHBondContact O-N 3.01Å |
| 287 | V | 89.1 | Confident | 89.2 | Confident | 26 Ų | 26 | 35 Ų | 35 | 16% | 0.158 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -102.6 | -34 | -171.2 | 171.2 | 0 | 0 | 0 | 0 | 112.3 | A208 A283 Y284 F303 R306 A307 | A208-V287 HydrophobicContact CB-CG2 4.18Å; A283-V287 PolarHBondContact O-N 3.37Å; Y284-V287 PolarHBondContact O-N 3.21Å; V287-F303 HydrophobicContact CB-CD2 3.81Å; V287-F303 HydrophobicContact CB-CE2 3.58Å; V287-F303 HydrophobicContact CG1-CD2 3.89Å; V287-F303 HydrophobicContact CG1-CE2 3.95Å; V287-F303 HydrophobicContact CG2-CD2 4.2Å; V287-F303 HydrophobicContact CG2-CE2 3.45Å; V287-F303 VanDerWaalsContact CG2-CE2 3.45Å; V287-F303 HydrophobicContact CG2-CZ 4.11Å; V287-R306 HydrophobicContact CG1-CB 3.6Å; V287-A307 HydrophobicContact CG1-CB 3.96Å; V287-A307 HydrophobicContact CG2-CB 4.29Å |
| 288 | M | 88.2 | Confident | 88.5 | Confident | 3 Ų | 3 | 35.2 Ų | 35.2 | 2% | 0.015 | 20% | 0.203 | C | C | . | . | S | Bend | trans | -115.8 | 152.7 | -176.3 | -61.4 | 177.9 | 56.5 | 0 | 0 | 110.7 | N216 Y284 E292 L293 T302 F303 | N216-M288 PolarHBondContact ND2-O 3.41Å; Y284-M288 WeakPolarHBondContact O-CB 3.36Å; Y284-M288 PolarHBondContact O-N 3.02Å; M288-E292 HydrophobicContact CE-CB 4.1Å; M288-L293 HydrophobicContact CE-CB 4.48Å; M288-T302 HydrophobicContact CE-CG2 3.34Å; M288-T302 HydrophobicContact SD-CG2 4.11Å; M288-F303 HydrophobicContact SD-CB 3.94Å |
| 289 | T | 88.9 | Confident | 87.9 | Confident | 54 Ų | 54 | 33.5 Ų | 33.5 | 33% | 0.331 | 19% | 0.193 | S | C | . | . | trans | -79 | 155.4 | 170.8 | 67.2 | 0 | 0 | 0 | 0 | 110.9 | A291 E292 L293 | T289-A291 PolarHBondContact O-N 3.27Å; T289-E292 PolarHBondContact N-OE2 3.03Å; T289-E292 PolarHBondContact O-N 3.24Å; T289-E292 WeakPolarHBondContact OG1-CB 3.21Å; T289-E292 VanDerWaalsContact OG1-CD 3.26Å; T289-E292 WeakPolarHBondContact OG1-CG 3.09Å; T289-E292 PolarHBondContact OG1-N 2.92Å; T289-L293 PolarHBondContact O-N 3.46Å | ||
| 290 | P | 85.3 | Confident | 87.5 | Confident | 40 Ų | 40 | 30.3 Ų | 30.3 | 26% | 0.26 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -54.3 | -40.5 | 175.2 | -28.6 | 36.8 | 0 | 0 | 0 | 113 | L65 V71 L293 L294 | L65-P290 HydrophobicContact CD2-CB 4.06Å; V71-P290 HydrophobicContact CG2-CG 3.76Å; P290-L293 PolarHBondContact O-N 3.47Å; P290-L294 WeakPolarHBondContact O-CG 3.3Å; P290-L294 PolarHBondContact O-N 3.43Å; P290-L294 VanDerWaalsContact O-N 3.12Å |
| 291 | A | 86.4 | Confident | 87 | Confident | 60 Ų | 60 | 31.2 Ų | 31.2 | 50% | 0.496 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -64.6 | -43.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | T289 L293 L294 L295 | T289-A291 PolarHBondContact O-N 3.27Å; A291-L293 VanDerWaalsContact C-N 3.32Å; A291-L293 PolarHBondContact O-N 2.98Å; A291-L294 PolarHBondContact O-N 3.09Å; A291-L295 WeakPolarHBondContact O-CG 3.5Å; A291-L295 PolarHBondContact O-N 3.35Å |
| 292 | E | 87 | Confident | 86.5 | Confident | 51 Ų | 51 | 33.3 Ų | 33.3 | 24% | 0.238 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.6 | -39.1 | 175.8 | -74.3 | 167.6 | -176.6 | 0 | 0 | 112.2 | M288 T289 L294 L295 S296 R306 | M288-E292 HydrophobicContact CE-CB 4.1Å; T289-E292 PolarHBondContact N-OE2 3.03Å; T289-E292 PolarHBondContact O-N 3.24Å; T289-E292 WeakPolarHBondContact OG1-CB 3.21Å; T289-E292 VanDerWaalsContact OG1-CD 3.26Å; T289-E292 WeakPolarHBondContact OG1-CG 3.09Å; T289-E292 PolarHBondContact OG1-N 2.92Å; E292-L294 VanDerWaalsContact C-N 3.34Å; E292-L295 PolarHBondContact O-N 2.89Å; E292-S296 WeakPolarHBondContact O-CB 3.45Å; E292-S296 PolarHBondContact O-N 3.3Å; E292-R306 VanDerWaalsContact CD-NH1 3.26Å; E292-R306 IonicContact OE1-CZ 3.86Å; E292-R306 VanDerWaalsContact OE1-CZ 3.24Å; E292-R306 IonicContact OE1-NH1 2.93Å; E292-R306 PolarHBondContact OE1-NH1 3.07Å; E292-R306 IonicContact OE1-NH2 2.82Å; E292-R306 PolarHBondContact OE1-NH2 3.3Å; E292-R306 IonicContact OE2-CZ 2.73Å; E292-R306 IonicContact OE2-NH1 3.25Å; E292-R306 PolarHBondContact OE2-NH1 3.45Å; E292-R306 IonicContact OE2-NH2 3.69Å; E292-R306 PolarHBondContact OE2-NH2 3.19Å |
| 293 | L | 87.3 | Confident | 86.3 | Confident | 1 Ų | 1 | 31.6 Ų | 31.6 | 1% | 0.005 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64 | -40.4 | 177.3 | -168.6 | 151.2 | 0 | 0 | 0 | 111.5 | P61 K62 L65 Y285 M288 T289 P290 A291 S296 V299 | P61-L293 HydrophobicContact CB-CD2 4.34Å; K62-L293 HydrophobicContact CB-CD2 4.31Å; L65-L293 HydrophobicContact CB-CD2 4.41Å; L65-L293 HydrophobicContact CD2-CB 4.28Å; L65-L293 HydrophobicContact CD2-CD2 3.85Å; L65-L293 HydrophobicContact CD2-CG 4.47Å; Y285-L293 HydrophobicContact CD1-CD1 4.29Å; Y285-L293 HydrophobicContact CE1-CD1 3.85Å; M288-L293 HydrophobicContact CE-CB 4.48Å; T289-L293 PolarHBondContact O-N 3.46Å; P290-L293 PolarHBondContact O-N 3.47Å; A291-L293 VanDerWaalsContact C-N 3.32Å; A291-L293 PolarHBondContact O-N 2.98Å; L293-S296 PolarHBondContact O-N 2.64Å; L293-V299 HydrophobicContact CD1-CG1 4.12Å; L293-V299 HydrophobicContact CD2-CG2 4.45Å; L293-V299 HydrophobicContact CG-CG1 4.05Å; L293-V299 HydrophobicContact CG-CG2 4.31Å |
| 294 | L | 87.3 | Confident | 85.9 | Confident | 65 Ų | 65 | 31.5 Ų | 31.5 | 34% | 0.34 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -70.3 | -32.9 | 178.5 | -67.4 | 176.4 | 0 | 0 | 0 | 113 | K62 L65 M66 P290 A291 E292 | K62-L294 WeakPolarHBondContact CE-O 3.39Å; K62-L294 HydrophobicContact CG-CD2 4.42Å; K62-L294 PolarHBondContact NZ-O 3.33Å; K62-L294 VanDerWaalsContact NZ-O 3.09Å; L65-L294 HydrophobicContact CB-CD2 4.19Å; L65-L294 HydrophobicContact CD2-CD2 4.03Å; L65-L294 HydrophobicContact CD2-CG 3.98Å; L65-L294 HydrophobicContact CG-CD2 4.2Å; M66-L294 HydrophobicContact CB-CD2 3.86Å; P290-L294 WeakPolarHBondContact O-CG 3.3Å; P290-L294 PolarHBondContact O-N 3.43Å; P290-L294 VanDerWaalsContact O-N 3.12Å; A291-L294 PolarHBondContact O-N 3.09Å; E292-L294 VanDerWaalsContact C-N 3.34Å |
| 295 | L | 85.6 | Confident | 85.5 | Confident | 146 Ų | 146 | 36 Ų | 36 | 76% | 0.764 | 21% | 0.207 | S | C | * | . | H | α-helix | trans | -77.1 | -26.9 | 177.3 | -70.7 | 171.5 | 0 | 0 | 0 | 112.8 | A291 E292 | A291-L295 WeakPolarHBondContact O-CG 3.5Å; A291-L295 PolarHBondContact O-N 3.35Å; E292-L295 PolarHBondContact O-N 2.89Å |
| 296 | S | 81.1 | Confident | 85.2 | Confident | 13 Ų | 13 | 42 Ų | 42 | 9% | 0.091 | 23% | 0.23 | C | C | . | . | trans | -70.9 | 135.1 | -180 | -176.8 | 0 | 0 | 0 | 0 | 112.2 | K62 E292 L293 A298 V299 T302 | K62-S296 WeakPolarHBondContact CD-O 3.33Å; K62-S296 PolarHBondContact NZ-O 2.77Å; E292-S296 WeakPolarHBondContact O-CB 3.45Å; E292-S296 PolarHBondContact O-N 3.3Å; L293-S296 PolarHBondContact O-N 2.64Å; S296-A298 PolarHBondContact OG-N 3.41Å; S296-A298 PolarHBondContact OG-O 3.34Å; S296-V299 PolarHBondContact OG-N 3.45Å; S296-T302 WeakPolarHBondContact CB-OG1 3.5Å; S296-T302 PolarHBondContact OG-OG1 3.38Å | ||
| 297 | D | 72.8 | Confident | 84.9 | Confident | 123 Ų | 123 | 43.4 Ų | 43.4 | 66% | 0.658 | 24% | 0.242 | S | C | * | . | S | Bend | trans | -88.8 | -21.7 | 169.9 | -69.9 | -35.4 | 0 | 0 | 0 | 112.6 | K62 | K62-D297 IonicContact NZ-OD1 2.81Å; K62-D297 PolarHBondContact NZ-OD1 3.27Å |
| 298 | A | 80.3 | Confident | 84.4 | Confident | 5 Ų | 5 | 43.6 Ų | 43.6 | 4% | 0.041 | 24% | 0.242 | C | C | . | . | S | Bend | trans | -131.6 | 84.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | Y145 E148 S296 A300 V301 T302 | Y145-A298 HydrophobicContact CD1-CB 4.34Å; Y145-A298 HydrophobicContact CE1-CB 3.69Å; E148-A298 WeakPolarHBondContact OE2-CB 3.43Å; S296-A298 PolarHBondContact OG-N 3.41Å; S296-A298 PolarHBondContact OG-O 3.34Å; A298-A300 PolarHBondContact O-N 3.34Å; A298-A300 VanDerWaalsContact O-N 3.15Å; A298-V301 HydrophobicContact CB-CB 4.19Å; A298-V301 HydrophobicContact CB-CG2 3.86Å; A298-V301 PolarHBondContact O-N 3.23Å; A298-T302 PolarHBondContact O-N 3.26Å; A298-T302 PolarHBondContact O-OG1 3.02Å |
| 299 | V | 84.4 | Confident | 83.7 | Confident | 3 Ų | 3 | 51.5 Ų | 51.5 | 2% | 0.018 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -53.3 | -40.7 | -173.5 | -178.1 | 0 | 0 | 0 | 0 | 112.2 | Y284 L293 S296 V301 T302 F303 | Y284-V299 HydrophobicContact CD1-CG1 4.18Å; Y284-V299 HydrophobicContact CD2-CG1 3.9Å; Y284-V299 HydrophobicContact CE1-CG1 4.17Å; Y284-V299 HydrophobicContact CE2-CG1 3.87Å; Y284-V299 HydrophobicContact CG-CG1 4.06Å; L293-V299 HydrophobicContact CD1-CG1 4.12Å; L293-V299 HydrophobicContact CD2-CG2 4.45Å; L293-V299 HydrophobicContact CG-CG1 4.05Å; L293-V299 HydrophobicContact CG-CG2 4.31Å; S296-V299 PolarHBondContact OG-N 3.45Å; V299-V301 VanDerWaalsContact C-N 3.34Å; V299-V301 PolarHBondContact O-N 3.33Å; V299-T302 PolarHBondContact O-N 2.96Å; V299-F303 WeakPolarHBondContact O-CB 3.44Å; V299-F303 PolarHBondContact O-N 3.3Å |
| 300 | A | 85.3 | Confident | 82.9 | Confident | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -65 | -35.2 | 180 | 0 | 0 | 0 | 0 | 0 | 113.3 | F58 Y145 A298 A304 I315 V319 | F58-A300 HydrophobicContact CD1-CB 3.85Å; F58-A300 HydrophobicContact CE1-CB 4.34Å; Y145-A300 HydrophobicContact CE1-CB 4.21Å; A298-A300 PolarHBondContact O-N 3.34Å; A298-A300 VanDerWaalsContact O-N 3.15Å; A300-A304 WeakPolarHBondContact O-CB 3.36Å; A300-A304 PolarHBondContact O-N 3.13Å; A300-I315 HydrophobicContact CB-CG2 4.13Å; A300-V319 HydrophobicContact CB-CG2 3.88Å |
| 301 | V | 83.5 | Confident | 82.5 | Confident | 19 Ų | 19 | 54.2 Ų | 54.2 | 12% | 0.115 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -72.3 | -43.9 | 179.4 | -177.1 | 0 | 0 | 0 | 0 | 109.9 | Y145 A298 V299 F303 A304 N305 P316 | Y145-V301 HydrophobicContact CD1-CG2 4.01Å; Y145-V301 HydrophobicContact CE1-CG2 4.07Å; A298-V301 HydrophobicContact CB-CB 4.19Å; A298-V301 HydrophobicContact CB-CG2 3.86Å; A298-V301 PolarHBondContact O-N 3.23Å; V299-V301 VanDerWaalsContact C-N 3.34Å; V299-V301 PolarHBondContact O-N 3.33Å; V301-F303 VanDerWaalsContact C-N 3.33Å; V301-F303 PolarHBondContact O-N 3.11Å; V301-A304 PolarHBondContact O-N 3.01Å; V301-N305 PolarHBondContact O-N 2.99Å; V301-N305 PolarHBondContact O-ND2 3.45Å; V301-P316 HydrophobicContact CG1-CG 4.38Å; V301-P316 HydrophobicContact CG2-CB 4.08Å; V301-P316 HydrophobicContact CG2-CG 3.9Å |
| 302 | T | 84.8 | Confident | 82.1 | Confident | 43 Ų | 43 | 52.2 Ų | 52.2 | 26% | 0.264 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -62.4 | -41.1 | 176.1 | -48.5 | 0 | 0 | 0 | 0 | 111.8 | M288 S296 A298 V299 N305 R306 | M288-T302 HydrophobicContact CE-CG2 3.34Å; M288-T302 HydrophobicContact SD-CG2 4.11Å; S296-T302 WeakPolarHBondContact CB-OG1 3.5Å; S296-T302 PolarHBondContact OG-OG1 3.38Å; A298-T302 PolarHBondContact O-N 3.26Å; A298-T302 PolarHBondContact O-OG1 3.02Å; V299-T302 PolarHBondContact O-N 2.96Å; T302-N305 PolarHBondContact O-N 3.28Å; T302-R306 PolarHBondContact O-N 3.19Å |
| 303 | F | 87.7 | Confident | 81.8 | Confident | 0 Ų | 0 | 53.9 Ų | 53.9 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -59.4 | -46.7 | 172.6 | 176.3 | -89.6 | 0 | 0 | 0 | 111.6 | I201 P204 A283 Y284 V287 M288 V299 V301 N305 R306 A307 | I201-F303 HydrophobicContact CB-CE1 4.17Å; I201-F303 HydrophobicContact CG1-CD1 4.32Å; I201-F303 HydrophobicContact CG1-CE1 4.29Å; I201-F303 HydrophobicContact CG2-CD1 4.1Å; I201-F303 HydrophobicContact CG2-CE1 3.82Å; I201-F303 HydrophobicContact CG2-CE2 4.39Å; I201-F303 HydrophobicContact CG2-CZ 3.96Å; I201-F303 VanDerWaalsContact O-CZ 3.27Å; I201-F303 WeakPolarHBondContact O-CZ 3.34Å; P204-F303 HydrophobicContact CB-CZ 4.27Å; A283-F303 HydrophobicContact CB-CE2 4.26Å; A283-F303 HydrophobicContact CB-CZ 4.42Å; Y284-F303 HydrophobicContact CD1-CB 3.99Å; Y284-F303 AromaticContact CD1-CD2 3.65Å; Y284-F303 HydrophobicContact CD1-CD2 3.65Å; Y284-F303 HydrophobicContact CD1-CE2 4.33Å; Y284-F303 AromaticContact CD1-CG 3.91Å; Y284-F303 HydrophobicContact CD1-CG 3.91Å; Y284-F303 HydrophobicContact CE1-CB 3.9Å; Y284-F303 HydrophobicContact CE1-CD2 4.16Å; Y284-F303 AromaticContact CE1-CG 3.96Å; Y284-F303 HydrophobicContact CE1-CG 3.96Å; V287-F303 HydrophobicContact CB-CD2 3.81Å; V287-F303 HydrophobicContact CB-CE2 3.58Å; V287-F303 HydrophobicContact CG1-CD2 3.89Å; V287-F303 HydrophobicContact CG1-CE2 3.95Å; V287-F303 HydrophobicContact CG2-CD2 4.2Å; V287-F303 HydrophobicContact CG2-CE2 3.45Å; V287-F303 VanDerWaalsContact CG2-CE2 3.45Å; V287-F303 HydrophobicContact CG2-CZ 4.11Å; M288-F303 HydrophobicContact SD-CB 3.94Å; V299-F303 WeakPolarHBondContact O-CB 3.44Å; V299-F303 PolarHBondContact O-N 3.3Å; V301-F303 VanDerWaalsContact C-N 3.33Å; V301-F303 PolarHBondContact O-N 3.11Å; F303-N305 VanDerWaalsContact C-N 3.34Å; F303-N305 PolarHBondContact O-N 3.22Å; F303-R306 PolarHBondContact O-N 3.39Å; F303-R306 VanDerWaalsContact O-N 3.1Å; F303-A307 HydrophobicContact CD1-CB 4.4Å; F303-A307 HydrophobicContact CE1-CB 3.9Å; F303-A307 HydrophobicContact CE2-CB 4.34Å; F303-A307 HydrophobicContact CZ-CB 3.88Å; F303-A307 PolarHBondContact O-N 2.9Å |
| 304 | A | 85.6 | Confident | 81.7 | Confident | 0 Ų | 0 | 56.5 Ų | 56.5 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -61.4 | -42.1 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112 | A300 V301 R306 L308 A312 I315 | A300-A304 WeakPolarHBondContact O-CB 3.36Å; A300-A304 PolarHBondContact O-N 3.13Å; V301-A304 PolarHBondContact O-N 3.01Å; A304-R306 VanDerWaalsContact C-N 3.26Å; A304-R306 PolarHBondContact O-N 2.79Å; A304-L308 CarbonylContact O-C 3.59Å; A304-L308 VanDerWaalsContact O-C 3.25Å; A304-L308 WeakPolarHBondContact O-CA 3.42Å; A304-L308 PolarHBondContact O-N 3.06Å; A304-A312 HydrophobicContact CB-CB 4.43Å; A304-I315 HydrophobicContact CB-CB 3.72Å; A304-I315 HydrophobicContact CB-CG1 3.64Å; A304-I315 HydrophobicContact CB-CG2 4.04Å |
| 305 | N | 84.6 | Confident | 81.7 | Confident | 93 Ų | 93 | 53.5 Ų | 53.5 | 50% | 0.497 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.9 | -32.6 | 175.4 | -71.7 | -23.2 | 0 | 0 | 0 | 112.8 | V301 T302 F303 A312 | V301-N305 PolarHBondContact O-N 2.99Å; V301-N305 PolarHBondContact O-ND2 3.45Å; T302-N305 PolarHBondContact O-N 3.28Å; F303-N305 VanDerWaalsContact C-N 3.34Å; F303-N305 PolarHBondContact O-N 3.22Å; N305-A312 WeakPolarHBondContact OD1-CB 3.41Å |
| 306 | R | 83.8 | Confident | 81.7 | Confident | 129 Ų | 129 | 46.7 Ų | 46.7 | 49% | 0.487 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -81.6 | -46.3 | 179.3 | -76.5 | -76.2 | 179.3 | 102.8 | -1.7 | 113.3 | V287 E292 T302 F303 A304 | V287-R306 HydrophobicContact CG1-CB 3.6Å; E292-R306 VanDerWaalsContact CD-NH1 3.26Å; E292-R306 IonicContact OE1-CZ 3.86Å; E292-R306 VanDerWaalsContact OE1-CZ 3.24Å; E292-R306 IonicContact OE1-NH1 2.93Å; E292-R306 PolarHBondContact OE1-NH1 3.07Å; E292-R306 IonicContact OE1-NH2 2.82Å; E292-R306 PolarHBondContact OE1-NH2 3.3Å; E292-R306 IonicContact OE2-CZ 2.73Å; E292-R306 IonicContact OE2-NH1 3.25Å; E292-R306 PolarHBondContact OE2-NH1 3.45Å; E292-R306 IonicContact OE2-NH2 3.69Å; E292-R306 PolarHBondContact OE2-NH2 3.19Å; T302-R306 PolarHBondContact O-N 3.19Å; F303-R306 PolarHBondContact O-N 3.39Å; F303-R306 VanDerWaalsContact O-N 3.1Å; A304-R306 VanDerWaalsContact C-N 3.26Å; A304-R306 PolarHBondContact O-N 2.79Å |
| 307 | A | 83.4 | Confident | 82.1 | Confident | 37 Ų | 37 | 51 Ų | 51 | 31% | 0.306 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -95.1 | -28.8 | -170.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | P204 V287 F303 | P204-A307 HydrophobicContact CB-CB 3.99Å; V287-A307 HydrophobicContact CG1-CB 3.96Å; V287-A307 HydrophobicContact CG2-CB 4.29Å; F303-A307 HydrophobicContact CD1-CB 4.4Å; F303-A307 HydrophobicContact CE1-CB 3.9Å; F303-A307 HydrophobicContact CE2-CB 4.34Å; F303-A307 HydrophobicContact CZ-CB 3.88Å; F303-A307 PolarHBondContact O-N 2.9Å |
| 308 | L | 79.1 | Confident | 83 | Confident | 30 Ų | 30 | 46 Ų | 46 | 16% | 0.157 | 27% | 0.266 | C | S | . | . | trans | -133 | 59.8 | -164.6 | -70 | 175.8 | 0 | 0 | 0 | 110.9 | P204 A304 G310 L311 A312 I315 | P204-L308 HydrophobicContact CG-CD1 4.15Å; P204-L308 HydrophobicContact CG-CD2 3.71Å; P204-L308 HydrophobicContact CG-CG 3.98Å; A304-L308 CarbonylContact O-C 3.59Å; A304-L308 VanDerWaalsContact O-C 3.25Å; A304-L308 WeakPolarHBondContact O-CA 3.42Å; A304-L308 PolarHBondContact O-N 3.06Å; L308-G310 PolarHBondContact O-N 3.1Å; L308-L311 HydrophobicContact CB-CB 4.2Å; L308-L311 HydrophobicContact CD2-CD1 4.47Å; L308-L311 CarbonylContact O-C 3.54Å; L308-L311 PolarHBondContact O-N 3.29Å; L308-A312 PolarHBondContact O-N 3.38Å; L308-I315 HydrophobicContact CD1-CD1 4.26Å; L308-I315 HydrophobicContact CD1-CG1 4.36Å | ||
| 309 | Q | 73.3 | Confident | 83.5 | Confident | 170 Ų | 170 | 45.8 Ų | 45.8 | 79% | 0.794 | 26% | 0.264 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.6 | -25.3 | -175.9 | -65.8 | 178.3 | 4.4 | 0 | 0 | 114.1 | ||
| 310 | G | 73.2 | Confident | 83.8 | Confident | 74 Ų | 74 | 45.9 Ų | 45.9 | 76% | 0.763 | 27% | 0.265 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.4 | -18.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | L308 | L308-G310 PolarHBondContact O-N 3.1Š|
| 311 | L | 77.1 | Confident | 84.1 | Confident | 77 Ų | 77 | 48.4 Ų | 48.4 | 40% | 0.403 | 28% | 0.278 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -112.6 | 9.2 | 180 | -67.4 | 171.4 | 0 | 0 | 0 | 112.6 | L308 S313 V314 I315 | L308-L311 HydrophobicContact CB-CB 4.2Å; L308-L311 HydrophobicContact CD2-CD1 4.47Å; L308-L311 CarbonylContact O-C 3.54Å; L308-L311 PolarHBondContact O-N 3.29Å; L311-S313 PolarHBondContact O-N 3.39Å; L311-V314 HydrophobicContact CD2-CG2 4.17Å; L311-V314 WeakPolarHBondContact O-CB 3.49Å; L311-V314 PolarHBondContact O-N 2.96Å; L311-I315 PolarHBondContact O-N 3.35Å |
| 312 | A | 76.8 | Confident | 84.6 | Confident | 17 Ų | 17 | 47.5 Ų | 47.5 | 14% | 0.14 | 27% | 0.273 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.2 | -33.6 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | A304 N305 L308 V314 P316 | A304-A312 HydrophobicContact CB-CB 4.43Å; N305-A312 WeakPolarHBondContact OD1-CB 3.41Å; L308-A312 PolarHBondContact O-N 3.38Å; A312-V314 VanDerWaalsContact C-N 3.32Å; A312-V314 PolarHBondContact O-N 2.99Å; A312-P316 WeakPolarHBondContact O-CD 3.5Å |
| 313 | S | 80.1 | Confident | 84.9 | Confident | 87 Ų | 87 | 45.4 Ų | 45.4 | 61% | 0.608 | 26% | 0.26 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.5 | -22 | 176.5 | 55.3 | 0 | 0 | 0 | 0 | 113.9 | L311 | L311-S313 PolarHBondContact O-N 3.39Š|
| 314 | V | 85.4 | Confident | 85.1 | Confident | 56 Ų | 56 | 46.2 Ų | 46.2 | 34% | 0.339 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -85.5 | -36.6 | -174.7 | -178.2 | 0 | 0 | 0 | 0 | 111.6 | L311 A312 I317 L318 | L311-V314 HydrophobicContact CD2-CG2 4.17Å; L311-V314 WeakPolarHBondContact O-CB 3.49Å; L311-V314 PolarHBondContact O-N 2.96Å; A312-V314 VanDerWaalsContact C-N 3.32Å; A312-V314 PolarHBondContact O-N 2.99Å; V314-I317 PolarHBondContact O-N 2.81Å; V314-L318 HydrophobicContact CG1-CD1 3.85Å; V314-L318 HydrophobicContact CG1-CG 4Å; V314-L318 WeakPolarHBondContact O-CG 3.24Å; V314-L318 PolarHBondContact O-N 2.86Å |
| 315 | I | 87.2 | Confident | 85.3 | Confident | 1 Ų | 1 | 46.2 Ų | 46.2 | 1% | 0.005 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -58 | -48.1 | -176.8 | -63.1 | -64.8 | 0 | 0 | 0 | 113.2 | L200 A300 A304 L308 L311 I317 L318 V319 | L200-I315 HydrophobicContact CB-CD1 4.14Å; L200-I315 HydrophobicContact CD1-CD1 4.31Å; A300-I315 HydrophobicContact CB-CG2 4.13Å; A304-I315 HydrophobicContact CB-CB 3.72Å; A304-I315 HydrophobicContact CB-CG1 3.64Å; A304-I315 HydrophobicContact CB-CG2 4.04Å; L308-I315 HydrophobicContact CD1-CD1 4.26Å; L308-I315 HydrophobicContact CD1-CG1 4.36Å; L311-I315 PolarHBondContact O-N 3.35Å; I315-I317 VanDerWaalsContact C-N 3.28Å; I315-I317 PolarHBondContact O-N 3.45Å; I315-L318 PolarHBondContact O-N 2.87Å; I315-V319 HydrophobicContact CG2-CG2 4.22Å; I315-V319 VanDerWaalsContact O-CG2 3.29Å; I315-V319 WeakPolarHBondContact O-CG2 3.42Å; I315-V319 PolarHBondContact O-N 2.76Å |
| 316 | P | 87 | Confident | 85.6 | Confident | 4 Ų | 4 | 42.5 Ų | 42.5 | 3% | 0.026 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -59.3 | -38.1 | 178.4 | -13.4 | 19.8 | 0 | 0 | 0 | 112.9 | Y145 P149 V301 A312 V319 A320 | Y145-P316 VanDerWaalsContact O-CB 3.26Å; Y145-P316 WeakPolarHBondContact O-CB 3.49Å; P149-P316 HydrophobicContact CB-CG 4.2Å; P149-P316 HydrophobicContact CG-CB 3.45Å; P149-P316 VanDerWaalsContact CG-CB 3.45Å; P149-P316 HydrophobicContact CG-CG 3.52Å; V301-P316 HydrophobicContact CG1-CG 4.38Å; V301-P316 HydrophobicContact CG2-CB 4.08Å; V301-P316 HydrophobicContact CG2-CG 3.9Å; A312-P316 WeakPolarHBondContact O-CD 3.5Å; P316-V319 PolarHBondContact O-N 2.68Å; P316-A320 WeakPolarHBondContact O-CB 3.15Å; P316-A320 PolarHBondContact O-N 3.34Å |
| 317 | I | 89.4 | Confident | 85.9 | Confident | 103 Ų | 103 | 36.5 Ų | 36.5 | 53% | 0.528 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -65.4 | -45 | 177.5 | -60.3 | 171.7 | 0 | 0 | 0 | 110.3 | V314 I315 V319 A320 L321 | V314-I317 PolarHBondContact O-N 2.81Å; I315-I317 VanDerWaalsContact C-N 3.28Å; I315-I317 PolarHBondContact O-N 3.45Å; I317-V319 VanDerWaalsContact C-N 3.33Å; I317-V319 PolarHBondContact O-N 3.28Å; I317-A320 WeakPolarHBondContact O-CB 3.34Å; I317-A320 PolarHBondContact O-N 3.37Å; I317-L321 HydrophobicContact CG2-CD1 4.32Å; I317-L321 WeakPolarHBondContact O-CG 3.44Å; I317-L321 PolarHBondContact O-N 3.11Å |
| 318 | L | 91.1 | Very high | 86.2 | Confident | 18 Ų | 18 | 34.9 Ų | 34.9 | 9% | 0.094 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -63.4 | -39.1 | 177.1 | -68.8 | 177.2 | 0 | 0 | 0 | 112.2 | I193 F196 A197 L200 V314 I315 L321 S322 | I193-L318 HydrophobicContact CG2-CD2 3.67Å; F196-L318 HydrophobicContact CD1-CD1 4.39Å; A197-L318 HydrophobicContact CB-CB 3.7Å; A197-L318 HydrophobicContact CB-CD1 4.07Å; A197-L318 HydrophobicContact CB-CG 4.42Å; L200-L318 HydrophobicContact CD1-CD1 3.73Å; V314-L318 HydrophobicContact CG1-CD1 3.85Å; V314-L318 HydrophobicContact CG1-CG 4Å; V314-L318 WeakPolarHBondContact O-CG 3.24Å; V314-L318 PolarHBondContact O-N 2.86Å; I315-L318 PolarHBondContact O-N 2.87Å; L318-L321 PolarHBondContact O-N 3.06Å; L318-S322 PolarHBondContact O-N 3Å |
| 319 | V | 90.1 | Very high | 86.5 | Confident | 1 Ų | 1 | 33.5 Ų | 33.5 | 1% | 0.006 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -65.6 | -43.4 | 174.9 | 174.7 | 0 | 0 | 0 | 0 | 110.9 | F58 Y145 A300 I315 P316 I317 L321 S322 C323 | F58-V319 HydrophobicContact CB-CG1 4.33Å; F58-V319 HydrophobicContact CD1-CG1 4.27Å; F58-V319 HydrophobicContact CD1-CG2 4.03Å; F58-V319 HydrophobicContact CD2-CG1 3.49Å; F58-V319 VanDerWaalsContact CD2-CG1 3.49Å; F58-V319 HydrophobicContact CD2-CG2 4.44Å; F58-V319 HydrophobicContact CE1-CG1 4.47Å; F58-V319 HydrophobicContact CE1-CG2 3.71Å; F58-V319 HydrophobicContact CE2-CB 4.33Å; F58-V319 HydrophobicContact CE2-CG1 3.73Å; F58-V319 HydrophobicContact CE2-CG2 4.14Å; F58-V319 HydrophobicContact CG-CG1 3.78Å; F58-V319 HydrophobicContact CG-CG2 4.38Å; F58-V319 HydrophobicContact CZ-CB 4.42Å; F58-V319 HydrophobicContact CZ-CG1 4.21Å; F58-V319 HydrophobicContact CZ-CG2 3.76Å; Y145-V319 HydrophobicContact CD1-CB 3.98Å; Y145-V319 HydrophobicContact CD1-CG1 3.54Å; Y145-V319 HydrophobicContact CD2-CG1 3.54Å; Y145-V319 HydrophobicContact CE1-CB 4.37Å; Y145-V319 HydrophobicContact CE1-CG1 3.71Å; Y145-V319 HydrophobicContact CE2-CG1 3.75Å; Y145-V319 HydrophobicContact CG-CB 4.15Å; Y145-V319 HydrophobicContact CG-CG1 3.48Å; Y145-V319 VanDerWaalsContact CG-CG1 3.48Å; A300-V319 HydrophobicContact CB-CG2 3.88Å; I315-V319 HydrophobicContact CG2-CG2 4.22Å; I315-V319 VanDerWaalsContact O-CG2 3.29Å; I315-V319 WeakPolarHBondContact O-CG2 3.42Å; I315-V319 PolarHBondContact O-N 2.76Å; P316-V319 PolarHBondContact O-N 2.68Å; I317-V319 VanDerWaalsContact C-N 3.33Å; I317-V319 PolarHBondContact O-N 3.28Å; V319-L321 PolarHBondContact O-N 3.44Å; V319-S322 WeakPolarHBondContact O-CA 3.28Å; V319-S322 VanDerWaalsContact O-CB 3.25Å; V319-S322 WeakPolarHBondContact O-CB 3.3Å; V319-S322 PolarHBondContact O-N 2.91Å; V319-S322 VanDerWaalsContact O-N 3.08Å; V319-C323 PolarHBondContact O-N 2.94Å; V319-C323 PolarHBondContact O-SG 2.82Å |
| 320 | A | 91.6 | Very high | 87.1 | Confident | 4 Ų | 4 | 26 Ų | 26 | 3% | 0.033 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -58.7 | -46.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | F142 V146 P316 I317 S322 C323 L324 | F142-A320 HydrophobicContact CD2-CB 3.74Å; F142-A320 VanDerWaalsContact CD2-O 3.32Å; F142-A320 WeakPolarHBondContact CD2-O 3.18Å; F142-A320 HydrophobicContact CE2-CB 3.93Å; V146-A320 HydrophobicContact CG2-CB 3.57Å; P316-A320 WeakPolarHBondContact O-CB 3.15Å; P316-A320 PolarHBondContact O-N 3.34Å; I317-A320 WeakPolarHBondContact O-CB 3.34Å; I317-A320 PolarHBondContact O-N 3.37Å; A320-S322 VanDerWaalsContact C-N 3.25Å; A320-S322 PolarHBondContact O-N 3.48Å; A320-C323 WeakPolarHBondContact O-CB 3.46Å; A320-C323 PolarHBondContact O-N 2.82Å; A320-C323 VanDerWaalsContact O-N 3.14Å; A320-L324 PolarHBondContact O-N 3.13Å |
| 321 | L | 92 | Very high | 87.7 | Confident | 53 Ų | 53 | 22.6 Ų | 22.6 | 28% | 0.277 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -60.8 | -34.1 | 174.7 | -68.7 | 173.2 | 0 | 0 | 0 | 112.5 | L190 I193 I317 L318 V319 L324 G325 | L190-L321 HydrophobicContact CD2-CB 4.19Å; L190-L321 HydrophobicContact CD2-CD2 4.17Å; I193-L321 HydrophobicContact CG2-CB 4.16Å; I193-L321 HydrophobicContact CG2-CD1 3.97Å; I317-L321 HydrophobicContact CG2-CD1 4.32Å; I317-L321 WeakPolarHBondContact O-CG 3.44Å; I317-L321 PolarHBondContact O-N 3.11Å; L318-L321 PolarHBondContact O-N 3.06Å; V319-L321 PolarHBondContact O-N 3.44Å; L321-L324 PolarHBondContact O-N 3.17Å; L321-G325 PolarHBondContact O-N 3.07Å |
| 322 | S | 92.6 | Very high | 88 | Confident | 0 Ų | 0 | 19.2 Ų | 19.2 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -62.2 | -45.8 | 173.2 | -173.9 | 0 | 0 | 0 | 0 | 112.3 | K194 L318 V319 A320 L324 G325 A326 | K194-S322 WeakPolarHBondContact CB-OG 3.41Å; K194-S322 PolarHBondContact NZ-O 2.96Å; L318-S322 PolarHBondContact O-N 3Å; V319-S322 WeakPolarHBondContact O-CA 3.28Å; V319-S322 VanDerWaalsContact O-CB 3.25Å; V319-S322 WeakPolarHBondContact O-CB 3.3Å; V319-S322 PolarHBondContact O-N 2.91Å; V319-S322 VanDerWaalsContact O-N 3.08Å; A320-S322 VanDerWaalsContact C-N 3.25Å; A320-S322 PolarHBondContact O-N 3.48Å; S322-L324 VanDerWaalsContact C-N 3.34Å; S322-L324 PolarHBondContact O-N 3.3Å; S322-G325 PolarHBondContact O-N 2.91Å; S322-A326 PolarHBondContact O-N 3.49Å; S322-A326 VanDerWaalsContact O-N 3.07Å |
| 323 | C | 91.9 | Very high | 88.1 | Confident | 0 Ų | 0 | 18.4 Ų | 18.4 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -60.5 | -41.9 | 174.8 | -65.1 | 0 | 0 | 0 | 0 | 111.6 | V138 F142 V319 A320 G325 A326 L327 | V138-C323 HydrophobicContact CG1-CB 4.2Å; V138-C323 WeakPolarHBondContact CG1-O 3.47Å; F142-C323 HydrophobicContact CB-CB 3.8Å; V319-C323 PolarHBondContact O-N 2.94Å; V319-C323 PolarHBondContact O-SG 2.82Å; A320-C323 WeakPolarHBondContact O-CB 3.46Å; A320-C323 PolarHBondContact O-N 2.82Å; A320-C323 VanDerWaalsContact O-N 3.14Å; C323-G325 VanDerWaalsContact C-N 3.31Å; C323-G325 PolarHBondContact O-N 3.44Å; C323-A326 PolarHBondContact O-N 2.68Å; C323-A326 VanDerWaalsContact O-N 3.17Å; C323-L327 PolarHBondContact O-N 3.13Å |
| 324 | L | 91.7 | Very high | 87.9 | Confident | 16 Ų | 16 | 14.4 Ų | 14.4 | 8% | 0.084 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -61 | -39.1 | 176 | -162.1 | 71.9 | 0 | 0 | 0 | 112 | F142 F171 V172 A320 L321 S322 L327 N328 | F142-L324 HydrophobicContact CE2-CD1 4.5Å; F171-L324 HydrophobicContact CD1-CD1 4.3Å; F171-L324 HydrophobicContact CD1-CD2 4.01Å; F171-L324 HydrophobicContact CE1-CD2 3.94Å; V172-L324 HydrophobicContact CG2-CD1 3.5Å; V172-L324 VanDerWaalsContact CG2-CD1 3.5Å; V172-L324 HydrophobicContact CG2-CG 3.95Å; A320-L324 PolarHBondContact O-N 3.13Å; L321-L324 PolarHBondContact O-N 3.17Å; S322-L324 VanDerWaalsContact C-N 3.34Å; S322-L324 PolarHBondContact O-N 3.3Å; L324-L327 WeakPolarHBondContact O-CB 3.5Å; L324-L327 PolarHBondContact O-N 2.94Å; L324-N328 WeakPolarHBondContact O-CB 3.35Å; L324-N328 PolarHBondContact O-N 2.88Å |
| 325 | G | 90.4 | Very high | 87.7 | Confident | 0 Ų | 0 | 11.9 Ų | 11.9 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -67.4 | -35.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q187 L321 S322 C323 N328 G329 | Q187-G325 PolarHBondContact NE2-O 2.93Å; Q187-G325 PolarHBondContact OE1-O 3.05Å; L321-G325 PolarHBondContact O-N 3.07Å; S322-G325 PolarHBondContact O-N 2.91Å; C323-G325 VanDerWaalsContact C-N 3.31Å; C323-G325 PolarHBondContact O-N 3.44Å; G325-N328 PolarHBondContact O-N 3.49Å; G325-G329 PolarHBondContact O-N 3.38Å |
| 326 | A | 89.7 | Confident | 87.4 | Confident | 15 Ų | 15 | 12.8 Ų | 12.8 | 12% | 0.124 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -68 | -40.3 | 174 | 0 | 0 | 0 | 0 | 0 | 111.5 | V138 S322 C323 G330 | V138-A326 HydrophobicContact CG1-CB 4.01Å; S322-A326 PolarHBondContact O-N 3.49Å; S322-A326 VanDerWaalsContact O-N 3.07Å; C323-A326 PolarHBondContact O-N 2.68Å; C323-A326 VanDerWaalsContact O-N 3.17Å; A326-G330 PolarHBondContact O-N 3.26Å; A326-G330 VanDerWaalsContact O-N 3.1Å |
| 327 | L | 90.4 | Very high | 87.3 | Confident | 4 Ų | 4 | 12.6 Ų | 12.6 | 2% | 0.021 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -59 | -49.2 | 172 | -71.8 | 173.4 | 0 | 0 | 0 | 111.6 | A135 V138 V169 V172 C323 L324 G329 G330 F331 | A135-L327 HydrophobicContact CB-CD2 4.1Å; A135-L327 VanDerWaalsContact O-CD2 3.24Å; A135-L327 WeakPolarHBondContact O-CD2 3.04Å; V138-L327 HydrophobicContact CB-CD2 3.77Å; V138-L327 HydrophobicContact CB-CG 4.18Å; V138-L327 HydrophobicContact CG1-CD2 3.89Å; V138-L327 HydrophobicContact CG1-CG 3.72Å; V169-L327 HydrophobicContact CG2-CD1 4.36Å; V172-L327 HydrophobicContact CG1-CB 4.38Å; V172-L327 HydrophobicContact CG2-CB 4.09Å; C323-L327 PolarHBondContact O-N 3.13Å; L324-L327 WeakPolarHBondContact O-CB 3.5Å; L324-L327 PolarHBondContact O-N 2.94Å; L327-G329 PolarHBondContact O-N 3.14Å; L327-G330 WeakPolarHBondContact O-CA 3.36Å; L327-G330 PolarHBondContact O-N 2.98Å; L327-G330 VanDerWaalsContact O-N 3.11Å; L327-F331 WeakPolarHBondContact O-CD2 3.36Å; L327-F331 PolarHBondContact O-N 3.38Å |
| 328 | N | 90 | Very high | 87.1 | Confident | 3 Ų | 3 | 7.7 Ų | 7.7 | 2% | 0.016 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -60.2 | -44.7 | -178.8 | -176.8 | 59.1 | 0 | 0 | 0 | 112.1 | V172 N176 A183 Q187 L324 G325 G330 F331 F332 | V172-N328 HydrophobicContact CG1-CB 4.07Å; N176-N328 PolarHBondContact ND2-OD1 2.87Å; A183-N328 PolarHBondContact O-ND2 3.48Å; Q187-N328 PolarHBondContact OE1-ND2 2.99Å; L324-N328 WeakPolarHBondContact O-CB 3.35Å; L324-N328 PolarHBondContact O-N 2.88Å; G325-N328 PolarHBondContact O-N 3.49Å; N328-G330 VanDerWaalsContact C-N 3.29Å; N328-G330 PolarHBondContact O-N 2.97Å; N328-F331 PolarHBondContact O-N 2.95Å; N328-F332 WeakPolarHBondContact O-CB 3.49Å; N328-F332 PolarHBondContact O-N 3.35Å |
| 329 | G | 85.9 | Confident | 86.6 | Confident | 0 Ų | 0 | 7.5 Ų | 7.5 | 0% | 0 | 4% | 0.043 | C | C | . | . | H | α-helix | trans | -62.4 | -35.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | G325 L327 F332 G333 | G325-G329 PolarHBondContact O-N 3.38Å; L327-G329 PolarHBondContact O-N 3.14Å; G329-F332 PolarHBondContact O-N 3.08Å; G329-G333 PolarHBondContact O-N 3.17Å |
| 330 | G | 85.8 | Confident | 86.2 | Confident | 12 Ų | 12 | 8.2 Ų | 8.2 | 12% | 0.124 | 5% | 0.047 | C | C | . | . | H | α-helix | trans | -63.7 | -49.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | A326 L327 N328 F332 G333 S334 | A326-G330 PolarHBondContact O-N 3.26Å; A326-G330 VanDerWaalsContact O-N 3.1Å; L327-G330 WeakPolarHBondContact O-CA 3.36Å; L327-G330 PolarHBondContact O-N 2.98Å; L327-G330 VanDerWaalsContact O-N 3.11Å; N328-G330 VanDerWaalsContact C-N 3.29Å; N328-G330 PolarHBondContact O-N 2.97Å; G330-F332 VanDerWaalsContact C-N 3.26Å; G330-F332 PolarHBondContact O-N 3.5Å; G330-G333 PolarHBondContact O-N 3.24Å; G330-S334 WeakPolarHBondContact O-CB 3.24Å; G330-S334 PolarHBondContact O-N 3.5Å; G330-S334 PolarHBondContact O-OG 3.01Å |
| 331 | F | 86.2 | Confident | 85.9 | Confident | 4 Ų | 4 | 8 Ų | 8 | 2% | 0.018 | 5% | 0.046 | C | C | . | . | H | α-helix | trans | -68.4 | -23.6 | 177.1 | -84.4 | -82.8 | 0 | 0 | 0 | 113.2 | A135 V169 V172 V173 L327 N328 P335 V365 L368 V372 | A135-F331 HydrophobicContact CB-CE2 4Å; A135-F331 HydrophobicContact CB-CZ 4.39Å; V169-F331 HydrophobicContact CG1-CE2 4.28Å; V169-F331 HydrophobicContact CG1-CZ 4.08Å; V172-F331 HydrophobicContact CG1-CB 4.04Å; V172-F331 HydrophobicContact CG1-CD2 3.76Å; V172-F331 HydrophobicContact CG1-CG 4.13Å; V173-F331 HydrophobicContact CG2-CD1 3.9Å; V173-F331 HydrophobicContact CG2-CE1 3.43Å; V173-F331 VanDerWaalsContact CG2-CE1 3.43Å; V173-F331 HydrophobicContact CG2-CE2 4.3Å; V173-F331 HydrophobicContact CG2-CG 4.49Å; V173-F331 HydrophobicContact CG2-CZ 3.66Å; L327-F331 WeakPolarHBondContact O-CD2 3.36Å; L327-F331 PolarHBondContact O-N 3.38Å; N328-F331 PolarHBondContact O-N 2.95Å; F331-P335 WeakPolarHBondContact O-CD 3.31Å; F331-P335 WeakPolarHBondContact O-CG 3.23Å; F331-V365 HydrophobicContact CD1-CG1 4.31Å; F331-L368 HydrophobicContact CD1-CD2 3.79Å; F331-L368 HydrophobicContact CE1-CB 4.22Å; F331-L368 HydrophobicContact CE1-CD2 3.46Å; F331-L368 VanDerWaalsContact CE1-CD2 3.46Å; F331-L368 HydrophobicContact CE1-CG 3.82Å; F331-L368 HydrophobicContact CZ-CD2 4.07Å; F331-L368 HydrophobicContact CZ-CG 4.29Å; F331-V372 HydrophobicContact CZ-CG2 4.15Å |
| 332 | F | 82.6 | Confident | 85.5 | Confident | 6 Ų | 6 | 5.7 Ų | 5.7 | 3% | 0.026 | 3% | 0.034 | C | C | . | . | H | α-helix | trans | -70.9 | -51.7 | 170.7 | -164.3 | -98.1 | 0 | 0 | 0 | 110.8 | I39 F47 V180 A183 V251 N328 G329 G330 R336 | I39-F332 HydrophobicContact CD1-CE1 4.42Å; F47-F332 HydrophobicContact CD2-CD1 4.43Å; F47-F332 HydrophobicContact CE2-CB 4.06Å; F47-F332 AromaticContact CE2-CD1 3.46Å; F47-F332 HydrophobicContact CE2-CD1 3.46Å; F47-F332 VanDerWaalsContact CE2-CD1 3.46Å; F47-F332 HydrophobicContact CE2-CE1 4.14Å; F47-F332 AromaticContact CE2-CG 3.97Å; F47-F332 HydrophobicContact CE2-CG 3.97Å; F47-F332 HydrophobicContact CZ-CB 4.3Å; F47-F332 AromaticContact CZ-CD1 3.67Å; F47-F332 HydrophobicContact CZ-CD1 3.67Å; F47-F332 HydrophobicContact CZ-CE1 4.49Å; F47-F332 HydrophobicContact CZ-CG 4.38Å; V180-F332 HydrophobicContact CG1-CE2 3.55Å; V180-F332 HydrophobicContact CG1-CZ 3.89Å; A183-F332 HydrophobicContact CB-CD2 4.09Å; A183-F332 HydrophobicContact CB-CE2 4.39Å; V251-F332 HydrophobicContact CG1-CD1 4.11Å; V251-F332 HydrophobicContact CG1-CE1 3.85Å; N328-F332 WeakPolarHBondContact O-CB 3.49Å; N328-F332 PolarHBondContact O-N 3.35Å; G329-F332 PolarHBondContact O-N 3.08Å; G330-F332 VanDerWaalsContact C-N 3.26Å; G330-F332 PolarHBondContact O-N 3.5Å; F332-R336 PolarHBondContact O-NH1 2.9Å |
| 333 | G | 78.3 | Confident | 85.1 | Confident | 0 Ų | 0 | 11.3 Ų | 11.3 | 0% | 0 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -75.3 | -37.6 | -174.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | G329 G330 | G329-G333 PolarHBondContact O-N 3.17Å; G330-G333 PolarHBondContact O-N 3.24Å |
| 334 | S | 77.6 | Confident | 84.7 | Confident | 3 Ų | 3 | 15.4 Ų | 15.4 | 2% | 0.021 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -61.5 | -55.4 | -171.2 | -43 | 0 | 0 | 0 | 0 | 113.6 | F126 R131 G330 R336 M337 | F126-S334 WeakPolarHBondContact CZ-O 3.48Å; R131-S334 WeakPolarHBondContact CD-OG 3.17Å; R131-S334 VanDerWaalsContact NH1-CA 3.29Å; R131-S334 VanDerWaalsContact NH1-CB 3.32Å; R131-S334 PolarHBondContact NH1-OG 3.41Å; G330-S334 WeakPolarHBondContact O-CB 3.24Å; G330-S334 PolarHBondContact O-N 3.5Å; G330-S334 PolarHBondContact O-OG 3.01Å; S334-R336 PolarHBondContact O-N 3.21Å; S334-M337 WeakPolarHBondContact O-CB 3.39Å; S334-M337 PolarHBondContact O-N 2.88Å |
| 335 | P | 80.3 | Confident | 84.3 | Confident | 2 Ų | 2 | 17 Ų | 17 | 1% | 0.013 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -57.6 | -29.5 | -171.1 | -24.3 | 35 | 0 | 0 | 0 | 113.4 | F331 M337 L338 F339 P361 A364 V365 | F331-P335 WeakPolarHBondContact O-CD 3.31Å; F331-P335 WeakPolarHBondContact O-CG 3.23Å; P335-M337 VanDerWaalsContact C-N 3.33Å; P335-M337 PolarHBondContact O-N 3.16Å; P335-L338 PolarHBondContact O-N 3.46Å; P335-F339 WeakPolarHBondContact O-CB 3.47Å; P335-F339 PolarHBondContact O-N 3.48Å; P335-P361 HydrophobicContact CB-CB 4.24Å; P335-P361 HydrophobicContact CB-CG 3.76Å; P335-A364 HydrophobicContact CB-CB 3.82Å; P335-V365 HydrophobicContact CB-CG2 3.99Å; P335-V365 HydrophobicContact CG-CG2 3.49Å; P335-V365 VanDerWaalsContact CG-CG2 3.49Å |
| 336 | R | 80.9 | Confident | 83.9 | Confident | 20 Ų | 20 | 17.9 Ų | 17.9 | 8% | 0.075 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -65.7 | -32.8 | 177.4 | -68.5 | 170.7 | 168 | 101.2 | -14.4 | 113.2 | V251 E254 F332 S334 F339 V340 | V251-R336 VanDerWaalsContact CG1-CD 3.42Å; E254-R336 VanDerWaalsContact CD-NH2 3.29Å; E254-R336 IonicContact OE1-CZ 2.63Å; E254-R336 VanDerWaalsContact OE1-CZ 3.25Å; E254-R336 IonicContact OE1-NE 2.71Å; E254-R336 PolarHBondContact OE1-NE 3.08Å; E254-R336 IonicContact OE1-NH2 3.42Å; E254-R336 PolarHBondContact OE1-NH2 3.46Å; E254-R336 IonicContact OE2-CZ 2.92Å; E254-R336 IonicContact OE2-NE 2.93Å; E254-R336 IonicContact OE2-NH2 3.12Å; E254-R336 PolarHBondContact OE2-NH2 3.39Å; F332-R336 PolarHBondContact O-NH1 2.9Å; S334-R336 PolarHBondContact O-N 3.21Å; R336-F339 WeakPolarHBondContact O-CB 3.4Å; R336-V340 VanDerWaalsContact O-CG2 3.31Å; R336-V340 WeakPolarHBondContact O-CG2 3.33Å; R336-V340 PolarHBondContact O-N 2.91Å; R336-V340 VanDerWaalsContact O-N 3.08Å |
| 337 | M | 84.5 | Confident | 83.6 | Confident | 0 Ų | 0 | 18.4 Ų | 18.4 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -67.7 | -43.7 | 173.3 | -177 | -177.1 | 154.9 | 0 | 0 | 111 | R121 L122 E125 F126 F250 S334 P335 F339 V340 G341 | R121-M337 HydrophobicContact CG-CE 3.57Å; L122-M337 HydrophobicContact CD2-CE 4Å; L122-M337 HydrophobicContact CD2-CG 4.13Å; L122-M337 HydrophobicContact CG-CE 4.08Å; E125-M337 HydrophobicContact CB-CE 3.91Å; E125-M337 HydrophobicContact CB-SD 4.5Å; E125-M337 HydrophobicContact CG-CE 4.01Å; E125-M337 HydrophobicContact CG-SD 3.94Å; F126-M337 HydrophobicContact CE2-CB 4.14Å; F126-M337 HydrophobicContact CE2-CE 4.39Å; F126-M337 HydrophobicContact CE2-CG 4.15Å; F126-M337 HydrophobicContact CE2-SD 4.18Å; F126-M337 HydrophobicContact CZ-CB 4.22Å; F250-M337 HydrophobicContact CD1-CB 4.37Å; F250-M337 HydrophobicContact CE1-SD 4.1Å; S334-M337 WeakPolarHBondContact O-CB 3.39Å; S334-M337 PolarHBondContact O-N 2.88Å; P335-M337 VanDerWaalsContact C-N 3.33Å; P335-M337 PolarHBondContact O-N 3.16Å; M337-F339 VanDerWaalsContact C-N 3.33Å; M337-V340 PolarHBondContact O-N 3.48Å; M337-G341 PolarHBondContact O-N 2.99Å |
| 338 | L | 84.7 | Confident | 83.2 | Confident | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -64.3 | -40.5 | 175.9 | -173.9 | 62.6 | 0 | 0 | 0 | 111.5 | L122 F126 P335 V340 G341 A342 W347 F351 A364 L367 | L122-L338 HydrophobicContact CD2-CD1 4.35Å; F126-L338 HydrophobicContact CB-CD1 4.36Å; F126-L338 HydrophobicContact CD1-CB 4.14Å; F126-L338 HydrophobicContact CD1-CD1 4.47Å; F126-L338 HydrophobicContact CD1-CD2 4.05Å; F126-L338 HydrophobicContact CD1-CG 4.46Å; F126-L338 HydrophobicContact CD2-CB 4.07Å; F126-L338 HydrophobicContact CD2-CD1 3.93Å; F126-L338 HydrophobicContact CD2-CG 4.5Å; F126-L338 HydrophobicContact CE1-CB 3.86Å; F126-L338 HydrophobicContact CE1-CD2 4.42Å; F126-L338 HydrophobicContact CE2-CB 3.8Å; F126-L338 HydrophobicContact CE2-CD1 4.47Å; F126-L338 HydrophobicContact CG-CB 4.27Å; F126-L338 HydrophobicContact CG-CD1 3.98Å; F126-L338 HydrophobicContact CG-CD2 4.33Å; F126-L338 HydrophobicContact CG-CG 4.43Å; F126-L338 HydrophobicContact CZ-CB 3.73Å; P335-L338 PolarHBondContact O-N 3.46Å; L338-V340 PolarHBondContact O-N 3.36Å; L338-G341 PolarHBondContact O-N 2.75Å; L338-A342 WeakPolarHBondContact O-CB 3.24Å; L338-A342 PolarHBondContact O-N 2.85Å; L338-W347 HydrophobicContact CD1-CB 4.49Å; L338-W347 HydrophobicContact CD1-CD2 3.57Å; L338-W347 HydrophobicContact CD1-CE3 3.83Å; L338-W347 HydrophobicContact CD1-CG 3.86Å; L338-W347 HydrophobicContact CD1-CH2 4.4Å; L338-W347 HydrophobicContact CD1-CZ2 4.2Å; L338-W347 HydrophobicContact CD1-CZ3 4.26Å; L338-F351 HydrophobicContact CD2-CB 4.11Å; L338-F351 HydrophobicContact CD2-CD1 4.02Å; L338-F351 HydrophobicContact CD2-CG 4.09Å; L338-F351 HydrophobicContact CG-CB 4.04Å; L338-F351 HydrophobicContact CG-CG 4.46Å; L338-A364 HydrophobicContact CB-CB 4.44Å; L338-A364 HydrophobicContact CD2-CB 3.84Å; L338-A364 HydrophobicContact CG-CB 4.48Å; L338-L367 HydrophobicContact CD2-CD2 3.91Å |
| 339 | F | 80.8 | Confident | 82.7 | Confident | 14 Ų | 14 | 23.2 Ų | 23.2 | 6% | 0.061 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -55.9 | -50.3 | 175.7 | 178.8 | -90.5 | 0 | 0 | 0 | 112 | P335 R336 M337 A342 R343 S352 I354 Q493 | P335-F339 WeakPolarHBondContact O-CB 3.47Å; P335-F339 PolarHBondContact O-N 3.48Å; R336-F339 WeakPolarHBondContact O-CB 3.4Å; M337-F339 VanDerWaalsContact C-N 3.33Å; F339-A342 PolarHBondContact O-N 2.99Å; F339-R343 PolarHBondContact O-N 3.19Å; F339-S352 WeakPolarHBondContact CE2-O 3.44Å; F339-I354 HydrophobicContact CD2-CG1 4.48Å; F339-I354 HydrophobicContact CE2-CD1 3.92Å; F339-I354 HydrophobicContact CE2-CG1 3.63Å; F339-I354 HydrophobicContact CZ-CD1 3.96Å; F339-I354 HydrophobicContact CZ-CG1 4.2Å; F339-Q493 HydrophobicContact CZ-CB 4.1Å |
| 340 | V | 82.3 | Confident | 82.6 | Confident | 16 Ų | 16 | 23.7 Ų | 23.7 | 10% | 0.097 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -66.1 | -39.3 | 177.3 | 176 | 0 | 0 | 0 | 0 | 111.1 | Y106 R336 M337 L338 A342 R343 E344 | Y106-V340 HydrophobicContact CD1-CG1 3.92Å; Y106-V340 HydrophobicContact CE1-CG1 3.92Å; R336-V340 VanDerWaalsContact O-CG2 3.31Å; R336-V340 WeakPolarHBondContact O-CG2 3.33Å; R336-V340 PolarHBondContact O-N 2.91Å; R336-V340 VanDerWaalsContact O-N 3.08Å; M337-V340 PolarHBondContact O-N 3.48Å; L338-V340 PolarHBondContact O-N 3.36Å; V340-A342 VanDerWaalsContact C-N 3.34Å; V340-A342 PolarHBondContact O-N 3.06Å; V340-R343 WeakPolarHBondContact O-CB 3.5Å; V340-R343 PolarHBondContact O-N 3.43Å; V340-E344 WeakPolarHBondContact O-CG 3.23Å; V340-E344 PolarHBondContact O-N 3.2Å; V340-E344 VanDerWaalsContact O-N 3.09Å |
| 341 | G | 85 | Confident | 82.4 | Confident | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -59.4 | -41 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | M337 L338 H346 W347 | M337-G341 PolarHBondContact O-N 2.99Å; L338-G341 PolarHBondContact O-N 2.75Å; G341-H346 WeakPolarHBondContact O-CB 3.33Å; G341-H346 PolarHBondContact O-N 3.31Å; G341-H346 VanDerWaalsContact O-N 3.14Å; G341-W347 PolarHBondContact O-N 3.3Å |
| 342 | A | 84.9 | Confident | 82.1 | Confident | 5 Ų | 5 | 25 Ų | 25 | 4% | 0.041 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -70.3 | -35.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L338 F339 V340 E344 G345 W347 F351 | L338-A342 WeakPolarHBondContact O-CB 3.24Å; L338-A342 PolarHBondContact O-N 2.85Å; F339-A342 PolarHBondContact O-N 2.99Å; V340-A342 VanDerWaalsContact C-N 3.34Å; V340-A342 PolarHBondContact O-N 3.06Å; A342-E344 VanDerWaalsContact C-N 3.32Å; A342-E344 PolarHBondContact O-N 2.74Å; A342-G345 PolarHBondContact O-N 2.68Å; A342-G345 VanDerWaalsContact O-N 3.11Å; A342-W347 HydrophobicContact CB-CB 3.82Å; A342-F351 HydrophobicContact CB-CB 4.02Å |
| 343 | R | 82.6 | Confident | 82 | Confident | 117 Ų | 117 | 25.1 Ų | 25.1 | 44% | 0.442 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -62.8 | -37.1 | 174.9 | -174.4 | 179.7 | 177.4 | -177.7 | 1 | 112.8 | F339 V340 G345 | F339-R343 PolarHBondContact O-N 3.19Å; V340-R343 WeakPolarHBondContact O-CB 3.5Å; V340-R343 PolarHBondContact O-N 3.43Å; R343-G345 PolarHBondContact O-N 3.44Å |
| 344 | E | 84.4 | Confident | 82.1 | Confident | 86 Ų | 86 | 25.9 Ų | 25.9 | 40% | 0.402 | 14% | 0.14 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78.6 | 5.9 | 176.1 | -65.6 | -66.6 | 162.3 | 0 | 0 | 113.2 | Y106 L110 V340 A342 H346 | Y106-E344 HydrophobicContact CE1-CB 4.44Å; Y106-E344 HydrophobicContact CE1-CG 4Å; Y106-E344 WeakPolarHBondContact OH-CB 3.28Å; L110-E344 HydrophobicContact CD2-CG 4.02Å; V340-E344 WeakPolarHBondContact O-CG 3.23Å; V340-E344 PolarHBondContact O-N 3.2Å; V340-E344 VanDerWaalsContact O-N 3.09Å; A342-E344 VanDerWaalsContact C-N 3.32Å; A342-E344 PolarHBondContact O-N 2.74Å; E344-H346 VanDerWaalsContact C-N 3.26Å; E344-H346 PolarHBondContact O-N 3.38Å |
| 345 | G | 82.3 | Confident | 82.3 | Confident | 49 Ų | 49 | 27.1 Ų | 27.1 | 51% | 0.505 | 15% | 0.146 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 76.1 | 6.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 115 | A342 R343 W347 | A342-G345 PolarHBondContact O-N 2.68Å; A342-G345 VanDerWaalsContact O-N 3.11Å; R343-G345 PolarHBondContact O-N 3.44Å; G345-W347 VanDerWaalsContact C-N 3.32Å |
| 346 | H | 83.6 | Confident | 82.1 | Confident | 20 Ų | 20 | 31.5 Ų | 31.5 | 9% | 0.093 | 17% | 0.172 | C | C | . | . | S | Bend | trans | -80.8 | -14.1 | 175.8 | -73 | 171.8 | 0 | 0 | 0 | 113.2 | Y106 F119 L122 G341 E344 | Y106-H346 AromaticContact CE2-ND1 3.64Å; Y106-H346 AromaticContact CZ-ND1 3.64Å; Y106-H346 PolarHBondContact OH-CE1 2.93Å; Y106-H346 PolarHBondContact OH-ND1 2.93Å; F119-H346 HydrophobicContact CD2-CB 3.98Å; F119-H346 WeakPolarHBondContact CE2-O 3.2Å; L122-H346 HydrophobicContact CD1-CB 4.3Å; G341-H346 WeakPolarHBondContact O-CB 3.33Å; G341-H346 PolarHBondContact O-N 3.31Å; G341-H346 VanDerWaalsContact O-N 3.14Å; E344-H346 VanDerWaalsContact C-N 3.26Å; E344-H346 PolarHBondContact O-N 3.38Å |
| 347 | W | 82.3 | Confident | 81.8 | Confident | 26 Ų | 26 | 39.1 Ų | 39.1 | 10% | 0.098 | 20% | 0.201 | C | C | . | . | S | Bend | trans | -137 | 159.5 | 177.5 | -90.4 | 78.4 | 0 | 0 | 0 | 110.7 | F126 L127 L338 G341 A342 G345 F351 L367 | F126-W347 HydrophobicContact CB-CH2 4.36Å; F126-W347 HydrophobicContact CB-CZ2 4.18Å; L127-W347 HydrophobicContact CD1-CH2 3.32Å; L127-W347 HydrophobicContact CD1-CZ2 3.4Å; L127-W347 HydrophobicContact CD1-CZ3 4.33Å; L127-W347 HydrophobicContact CG-CH2 3.58Å; L127-W347 HydrophobicContact CG-CZ2 3.91Å; L338-W347 HydrophobicContact CD1-CB 4.49Å; L338-W347 HydrophobicContact CD1-CD2 3.57Å; L338-W347 HydrophobicContact CD1-CE3 3.83Å; L338-W347 HydrophobicContact CD1-CG 3.86Å; L338-W347 HydrophobicContact CD1-CH2 4.4Å; L338-W347 HydrophobicContact CD1-CZ2 4.2Å; L338-W347 HydrophobicContact CD1-CZ3 4.26Å; G341-W347 PolarHBondContact O-N 3.3Å; A342-W347 HydrophobicContact CB-CB 3.82Å; G345-W347 VanDerWaalsContact C-N 3.32Å; W347-F351 AromaticContact CE3-CD2 3.77Å; W347-F351 HydrophobicContact CE3-CD2 3.77Å; W347-F351 AromaticContact CE3-CE2 3.87Å; W347-F351 HydrophobicContact CE3-CE2 3.87Å; W347-F351 HydrophobicContact CZ3-CD2 4.3Å; W347-F351 AromaticContact CZ3-CE2 4Å; W347-F351 HydrophobicContact CZ3-CE2 4Å; W347-L367 HydrophobicContact CH2-CD2 4.38Å; W347-L367 HydrophobicContact CZ3-CD2 4.09Å |
| 348 | P | 82.5 | Confident | 81.1 | Confident | 39 Ų | 39 | 42.6 Ų | 42.6 | 25% | 0.253 | 22% | 0.217 | S | C | . | . | trans | -58.9 | 142.5 | 179.7 | -26.6 | 35.6 | 0 | 0 | 0 | 113.7 | I350 F351 F477 | P348-I350 HydrophobicContact CB-CG2 4.3Å; P348-I350 PolarHBondContact O-N 3.35Å; P348-F351 HydrophobicContact CB-CD2 4.25Å; P348-F351 HydrophobicContact CB-CE2 4.36Å; P348-F351 HydrophobicContact CG-CD2 4.47Å; P348-F351 HydrophobicContact CG-CE2 4.32Å; P348-F351 PolarHBondContact O-N 2.93Å; P348-F351 VanDerWaalsContact O-N 3.12Å; P348-F477 HydrophobicContact CB-CE1 3.6Å; P348-F477 HydrophobicContact CB-CE2 4.28Å; P348-F477 HydrophobicContact CB-CZ 3.24Å; P348-F477 HydrophobicContact CG-CE1 4.25Å; P348-F477 HydrophobicContact CG-CE2 4.23Å; P348-F477 HydrophobicContact CG-CZ 3.63Å | ||
| 349 | P | 80.4 | Confident | 80.7 | Confident | 69 Ų | 69 | 49 Ų | 49 | 45% | 0.448 | 24% | 0.242 | S | C | . | . | G | 310 helix | trans | -61.5 | -17.5 | -172.3 | -24.2 | 33 | 0 | 0 | 0 | 115.3 | F351 S352 M353 | P349-F351 PolarHBondContact O-N 3.39Å; P349-S352 PolarHBondContact O-N 3.45Å; P349-S352 PolarHBondContact O-OG 3.35Å; P349-M353 WeakPolarHBondContact O-CG 3.41Å |
| 350 | I | 82.1 | Confident | 80.4 | Confident | 10 Ų | 10 | 48.4 Ų | 48.4 | 5% | 0.051 | 24% | 0.239 | C | C | . | . | G | 310 helix | trans | -62.3 | -30.9 | 177 | -170.2 | 161.7 | 0 | 0 | 0 | 112.7 | P348 S352 M353 P363 F477 L484 | P348-I350 HydrophobicContact CB-CG2 4.3Å; P348-I350 PolarHBondContact O-N 3.35Å; I350-S352 VanDerWaalsContact C-N 3.28Å; I350-S352 PolarHBondContact O-N 2.97Å; I350-M353 HydrophobicContact CG1-SD 4.36Å; I350-M353 WeakPolarHBondContact O-CB 3.4Å; I350-M353 PolarHBondContact O-N 3.24Å; I350-P363 HydrophobicContact CG1-CB 4.44Å; I350-F477 HydrophobicContact CG2-CZ 4.5Å; I350-L484 HydrophobicContact CD1-CB 3.45Å; I350-L484 VanDerWaalsContact CD1-CB 3.45Å; I350-L484 HydrophobicContact CD1-CD1 3.91Å; I350-L484 HydrophobicContact CD1-CG 4.28Å |
| 351 | F | 82.5 | Confident | 80.2 | Confident | 29 Ų | 29 | 48.7 Ų | 48.7 | 13% | 0.127 | 24% | 0.241 | C | C | . | . | G | 310 helix | trans | -80.5 | -10.5 | -179.9 | -60 | -66.7 | 0 | 0 | 0 | 113.2 | L338 A342 W347 P348 P349 M353 P363 L367 | L338-F351 HydrophobicContact CD2-CB 4.11Å; L338-F351 HydrophobicContact CD2-CD1 4.02Å; L338-F351 HydrophobicContact CD2-CG 4.09Å; L338-F351 HydrophobicContact CG-CB 4.04Å; L338-F351 HydrophobicContact CG-CG 4.46Å; A342-F351 HydrophobicContact CB-CB 4.02Å; W347-F351 AromaticContact CE3-CD2 3.77Å; W347-F351 HydrophobicContact CE3-CD2 3.77Å; W347-F351 AromaticContact CE3-CE2 3.87Å; W347-F351 HydrophobicContact CE3-CE2 3.87Å; W347-F351 HydrophobicContact CZ3-CD2 4.3Å; W347-F351 AromaticContact CZ3-CE2 4Å; W347-F351 HydrophobicContact CZ3-CE2 4Å; P348-F351 HydrophobicContact CB-CD2 4.25Å; P348-F351 HydrophobicContact CB-CE2 4.36Å; P348-F351 HydrophobicContact CG-CD2 4.47Å; P348-F351 HydrophobicContact CG-CE2 4.32Å; P348-F351 PolarHBondContact O-N 2.93Å; P348-F351 VanDerWaalsContact O-N 3.12Å; P349-F351 PolarHBondContact O-N 3.39Å; F351-M353 VanDerWaalsContact C-N 3.32Å; F351-P363 HydrophobicContact CD1-CB 4.29Å; F351-L367 HydrophobicContact CD1-CD2 4.35Å; F351-L367 HydrophobicContact CE1-CB 3.97Å; F351-L367 HydrophobicContact CE1-CD1 4.31Å; F351-L367 HydrophobicContact CE1-CD2 3.76Å; F351-L367 HydrophobicContact CE1-CG 4.23Å; F351-L367 HydrophobicContact CZ-CD1 4.2Å; F351-L367 HydrophobicContact CZ-CD2 3.88Å; F351-L367 HydrophobicContact CZ-CG 4.47Å |
| 352 | S | 79.7 | Confident | 79.9 | Confident | 14 Ų | 14 | 49.7 Ų | 49.7 | 10% | 0.098 | 25% | 0.246 | C | C | . | . | G | 310 helix | trans | -94.4 | 19.2 | 168.8 | 67.6 | 0 | 0 | 0 | 0 | 112.6 | F339 P349 I350 | F339-S352 WeakPolarHBondContact CE2-O 3.44Å; P349-S352 PolarHBondContact O-N 3.45Å; P349-S352 PolarHBondContact O-OG 3.35Å; I350-S352 VanDerWaalsContact C-N 3.28Å; I350-S352 PolarHBondContact O-N 2.97Å |
| 353 | M | 81.3 | Confident | 79.8 | Confident | 9 Ų | 9 | 49.9 Ų | 49.9 | 4% | 0.044 | 25% | 0.247 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.1 | 149.4 | 178.8 | -59.9 | -179 | -178.7 | 0 | 0 | 111.7 | P349 I350 F351 Q485 V490 A491 Q492 | P349-M353 WeakPolarHBondContact O-CG 3.41Å; I350-M353 HydrophobicContact CG1-SD 4.36Å; I350-M353 WeakPolarHBondContact O-CB 3.4Å; I350-M353 PolarHBondContact O-N 3.24Å; F351-M353 VanDerWaalsContact C-N 3.32Å; M353-Q485 HydrophobicContact CE-CG 4.22Å; M353-Q485 HydrophobicContact SD-CG 3.47Å; M353-Q485 WeakPolarHBondContact SD-CG 3.37Å; M353-Q485 PolarHBondContact SD-NE2 3.21Å; M353-Q485 VanDerWaalsContact SD-NE2 3.42Å; M353-V490 HydrophobicContact CB-CB 3.85Å; M353-V490 HydrophobicContact CB-CG2 3.92Å; M353-V490 HydrophobicContact SD-CG2 4.09Å; M353-A491 CarbonylContact C-O 3.25Å; M353-A491 VanDerWaalsContact CA-O 3.31Å; M353-A491 WeakPolarHBondContact CA-O 3.46Å; M353-A491 WeakPolarHBondContact CB-O 3.47Å; M353-Q492 HydrophobicContact CE-CG 3.68Å; M353-Q492 HydrophobicContact CG-CG 3.96Å; M353-Q492 HydrophobicContact SD-CG 4.49Å |
| 354 | I | 80.1 | Confident | 79.6 | Confident | 15 Ų | 15 | 44.3 Ų | 44.3 | 8% | 0.077 | 23% | 0.226 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -119.1 | 139.8 | -175.7 | -58 | 174.4 | 0 | 0 | 0 | 108.3 | F339 V356 R359 V490 A491 Q493 | F339-I354 HydrophobicContact CD2-CG1 4.48Å; F339-I354 HydrophobicContact CE2-CD1 3.92Å; F339-I354 HydrophobicContact CE2-CG1 3.63Å; F339-I354 HydrophobicContact CZ-CD1 3.96Å; F339-I354 HydrophobicContact CZ-CG1 4.2Å; I354-V356 PolarHBondContact O-N 3.11Å; I354-R359 VanDerWaalsContact CG2-CA 3.47Å; I354-R359 HydrophobicContact CG2-CB 4.31Å; I354-V490 CarbonylContact O-C 3.51Å; I354-V490 VanDerWaalsContact O-CA 3.31Å; I354-V490 WeakPolarHBondContact O-CA 3.46Å; I354-A491 PolarHBondContact N-O 3.18Å; I354-A491 PolarHBondContact O-N 3.11Å; I354-Q493 HydrophobicContact CD1-CB 4.12Å; I354-Q493 HydrophobicContact CD1-CG 4.06Å |
| 355 | H | 81.1 | Confident | 79.5 | Confident | 29 Ų | 29 | 40.4 Ų | 40.4 | 13% | 0.134 | 21% | 0.208 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -65.5 | 129.7 | 174.6 | -173.6 | -62.6 | 0 | 0 | 0 | 110.8 | R357 Q358 R359 T360 L362 L488 V490 | H355-R357 PolarHBondContact ND1-N 3.35Å; H355-R357 VanDerWaalsContact ND1-N 3.13Å; H355-R357 PolarHBondContact O-N 3.32Å; H355-Q358 PolarHBondContact ND1-N 3.49Å; H355-R359 VanDerWaalsContact O-CA 3.24Å; H355-R359 WeakPolarHBondContact O-CA 3.44Å; H355-R359 PolarHBondContact O-N 2.95Å; H355-T360 PolarHBondContact N-O 2.98Å; H355-L362 HydrophobicContact CB-CB 4.39Å; H355-L488 PolarHBondContact CD2-O 2.93Å; H355-V490 HydrophobicContact CB-CG1 4.32Å |
| 356 | V | 75.7 | Confident | 79.5 | Confident | 94 Ų | 94 | 41.3 Ų | 41.3 | 57% | 0.57 | 20% | 0.201 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -60.4 | -49.3 | -171.3 | 175.5 | 0 | 0 | 0 | 0 | 112.4 | I354 E489 A491 | I354-V356 PolarHBondContact O-N 3.11Å; V356-E489 WeakPolarHBondContact CG2-O 3.41Å; V356-E489 PolarHBondContact N-O 3.28Å; V356-A491 HydrophobicContact CG2-CB 3.93Å |
| 357 | R | 75.3 | Confident | 79.6 | Confident | 181 Ų | 181 | 42.9 Ų | 42.9 | 68% | 0.683 | 21% | 0.21 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -75.3 | -48.4 | -177.8 | -55.2 | -179.1 | -165.3 | -156.7 | -2.4 | 114 | H355 E489 | H355-R357 PolarHBondContact ND1-N 3.35Å; H355-R357 VanDerWaalsContact ND1-N 3.13Å; H355-R357 PolarHBondContact O-N 3.32Å; R357-E489 IonicContact CZ-OE2 3.35Å; R357-E489 IonicContact NE-OE2 3.47Å; R357-E489 PolarHBondContact NE-OE2 2.97Å; R357-E489 IonicContact NH2-OE1 2.67Å; R357-E489 IonicContact NH2-OE2 3.24Å |
| 358 | Q | 70.7 | Confident | 79.6 | Confident | 73 Ų | 73 | 41.8 Ų | 41.8 | 34% | 0.341 | 21% | 0.206 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -91.9 | -11.4 | -171.4 | -59.2 | -59.7 | -4.8 | 0 | 0 | 114.4 | W178 H355 T360 | W178-Q358 WeakPolarHBondContact O-CB 3.47Å; W178-Q358 WeakPolarHBondContact O-CG 3.27Å; W178-Q358 PolarHBondContact O-OE1 3.48Å; H355-Q358 PolarHBondContact ND1-N 3.49Å; Q358-T360 HydrophobicContact CB-CG2 4.28Å; Q358-T360 PolarHBondContact O-N 3.43Å |
| 359 | R | 74.8 | Confident | 79.9 | Confident | 135 Ų | 135 | 43.1 Ų | 43.1 | 51% | 0.509 | 21% | 0.206 | S | C | . | . | trans | 55.6 | 31.4 | -178.6 | -56.5 | 179.8 | -178.6 | 178.4 | -2.6 | 113.7 | I354 H355 | I354-R359 VanDerWaalsContact CG2-CA 3.47Å; I354-R359 HydrophobicContact CG2-CB 4.31Å; H355-R359 VanDerWaalsContact O-CA 3.24Å; H355-R359 WeakPolarHBondContact O-CA 3.44Å; H355-R359 PolarHBondContact O-N 2.95Å | ||
| 360 | T | 75.7 | Confident | 80.3 | Confident | 1 Ų | 1 | 43 Ų | 43 | 1% | 0.006 | 21% | 0.205 | C | C | . | . | trans | -102.6 | 146.5 | 179.7 | 49.8 | 0 | 0 | 0 | 0 | 111.2 | N176 C177 V180 H355 Q358 L362 | N176-T360 VanDerWaalsContact O-CG2 3.29Å; N176-T360 WeakPolarHBondContact O-CG2 3.25Å; C177-T360 PolarHBondContact O-OG1 2.83Å; C177-T360 VanDerWaalsContact O-OG1 3.08Å; V180-T360 HydrophobicContact CG2-CG2 3.49Å; V180-T360 VanDerWaalsContact CG2-CG2 3.49Å; H355-T360 PolarHBondContact N-O 2.98Å; Q358-T360 HydrophobicContact CB-CG2 4.28Å; Q358-T360 PolarHBondContact O-N 3.43Å; T360-L362 PolarHBondContact O-N 2.78Å | ||
| 361 | P | 76.6 | Confident | 80.6 | Confident | 21 Ų | 21 | 45.3 Ų | 45.3 | 14% | 0.136 | 22% | 0.218 | C | C | . | . | trans | -77.1 | 63.7 | 173.8 | 33.2 | -35.8 | 0 | 0 | 0 | 111 | P335 A364 V365 | P335-P361 HydrophobicContact CB-CB 4.24Å; P335-P361 HydrophobicContact CB-CG 3.76Å; P361-A364 HydrophobicContact CB-CB 4.45Å; P361-A364 PolarHBondContact O-N 2.75Å; P361-V365 PolarHBondContact O-N 2.93Å | ||
| 362 | L | 80.1 | Confident | 81 | Confident | 22 Ų | 22 | 43.9 Ų | 43.9 | 12% | 0.115 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -56.1 | -47 | -171.4 | -176.2 | 66.1 | 0 | 0 | 0 | 113.9 | C177 H355 T360 A364 V365 L366 L488 | C177-L362 HydrophobicContact CB-CD1 3.6Å; C177-L362 WeakPolarHBondContact SG-CD1 3.4Å; H355-L362 HydrophobicContact CB-CB 4.39Å; T360-L362 PolarHBondContact O-N 2.78Å; L362-A364 VanDerWaalsContact C-N 3.28Å; L362-A364 PolarHBondContact O-N 2.67Å; L362-V365 PolarHBondContact O-N 3.47Å; L362-L366 HydrophobicContact CD1-CD1 4.05Å; L362-L366 HydrophobicContact CD1-CG 4.06Å; L362-L366 HydrophobicContact CD2-CD1 4.41Å; L362-L366 HydrophobicContact CG-CD1 3.83Å; L362-L366 HydrophobicContact CG-CG 4.24Å; L362-L366 WeakPolarHBondContact O-CG 3.28Å; L362-L366 PolarHBondContact O-N 2.85Å; L362-L488 HydrophobicContact CD2-CB 4.19Å; L362-L488 HydrophobicContact CD2-CD2 3.86Å; L362-L488 HydrophobicContact CG-CD2 4.45Å |
| 363 | P | 81.9 | Confident | 81.5 | Confident | 8 Ų | 8 | 44.6 Ų | 44.6 | 5% | 0.052 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.6 | -35.8 | -178 | -22 | 34.3 | 0 | 0 | 0 | 112.9 | I350 F351 L367 L488 V490 | I350-P363 HydrophobicContact CG1-CB 4.44Å; F351-P363 HydrophobicContact CD1-CB 4.29Å; P363-L367 PolarHBondContact O-N 3.23Å; P363-L367 VanDerWaalsContact O-N 3.07Å; P363-L488 HydrophobicContact CB-CD1 4.33Å; P363-L488 HydrophobicContact CG-CD1 4.01Å; P363-V490 HydrophobicContact CG-CB 4.49Å; P363-V490 HydrophobicContact CG-CG1 3.91Å; P363-V490 HydrophobicContact CG-CG2 4.23Å |
| 364 | A | 79.4 | Confident | 81.9 | Confident | 1 Ų | 1 | 48.1 Ų | 48.1 | 1% | 0.008 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -69.8 | -37.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | P335 L338 P361 L362 | P335-A364 HydrophobicContact CB-CB 3.82Å; L338-A364 HydrophobicContact CB-CB 4.44Å; L338-A364 HydrophobicContact CD2-CB 3.84Å; L338-A364 HydrophobicContact CG-CB 4.48Å; P361-A364 HydrophobicContact CB-CB 4.45Å; P361-A364 PolarHBondContact O-N 2.75Å; L362-A364 VanDerWaalsContact C-N 3.28Å; L362-A364 PolarHBondContact O-N 2.67Å |
| 365 | V | 80.8 | Confident | 82.3 | Confident | 3 Ų | 3 | 49.5 Ų | 49.5 | 2% | 0.018 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -68.2 | -44.1 | 174.8 | 178.6 | 0 | 0 | 0 | 0 | 110.8 | V173 F331 P335 P361 L362 L367 L368 Y369 | V173-V365 HydrophobicContact CG1-CG1 3.89Å; V173-V365 HydrophobicContact CG2-CG1 4.44Å; F331-V365 HydrophobicContact CD1-CG1 4.31Å; P335-V365 HydrophobicContact CB-CG2 3.99Å; P335-V365 HydrophobicContact CG-CG2 3.49Å; P335-V365 VanDerWaalsContact CG-CG2 3.49Å; P361-V365 PolarHBondContact O-N 2.93Å; L362-V365 PolarHBondContact O-N 3.47Å; V365-L367 VanDerWaalsContact C-N 3.3Å; V365-L367 PolarHBondContact O-N 3.03Å; V365-L368 WeakPolarHBondContact O-CB 3.03Å; V365-L368 PolarHBondContact O-N 3.17Å; V365-L368 VanDerWaalsContact O-N 3.11Å; V365-Y369 PolarHBondContact O-N 3.47Å |
| 366 | L | 83.6 | Confident | 82.6 | Confident | 69 Ų | 69 | 48.1 Ų | 48.1 | 36% | 0.361 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -65.9 | -30.2 | -179.3 | -71.1 | 177.9 | 0 | 0 | 0 | 113.1 | L362 L368 P370 L488 | L362-L366 HydrophobicContact CD1-CD1 4.05Å; L362-L366 HydrophobicContact CD1-CG 4.06Å; L362-L366 HydrophobicContact CD2-CD1 4.41Å; L362-L366 HydrophobicContact CG-CD1 3.83Å; L362-L366 HydrophobicContact CG-CG 4.24Å; L362-L366 WeakPolarHBondContact O-CG 3.28Å; L362-L366 PolarHBondContact O-N 2.85Å; L366-L368 VanDerWaalsContact C-N 3.32Å; L366-P370 WeakPolarHBondContact O-CD 3.24Å; L366-L488 HydrophobicContact CD1-CD1 4.23Å; L366-L488 HydrophobicContact CD1-CD2 3.64Å |
| 367 | L | 84.8 | Confident | 83.2 | Confident | 52 Ų | 52 | 48 Ų | 48 | 27% | 0.272 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -64.5 | -38.1 | 172.2 | -176.7 | 69.6 | 0 | 0 | 0 | 111.9 | L338 W347 F351 P363 V365 P370 | L338-L367 HydrophobicContact CD2-CD2 3.91Å; W347-L367 HydrophobicContact CH2-CD2 4.38Å; W347-L367 HydrophobicContact CZ3-CD2 4.09Å; F351-L367 HydrophobicContact CD1-CD2 4.35Å; F351-L367 HydrophobicContact CE1-CB 3.97Å; F351-L367 HydrophobicContact CE1-CD1 4.31Å; F351-L367 HydrophobicContact CE1-CD2 3.76Å; F351-L367 HydrophobicContact CE1-CG 4.23Å; F351-L367 HydrophobicContact CZ-CD1 4.2Å; F351-L367 HydrophobicContact CZ-CD2 3.88Å; F351-L367 HydrophobicContact CZ-CG 4.47Å; P363-L367 PolarHBondContact O-N 3.23Å; P363-L367 VanDerWaalsContact O-N 3.07Å; V365-L367 VanDerWaalsContact C-N 3.3Å; V365-L367 PolarHBondContact O-N 3.03Å; L367-P370 WeakPolarHBondContact O-CD 3.43Å |
| 368 | L | 83.6 | Confident | 83.7 | Confident | 4 Ų | 4 | 44.2 Ų | 44.2 | 2% | 0.021 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -73.1 | -37.2 | -174.6 | -174.9 | 60.5 | 0 | 0 | 0 | 112.1 | R131 P132 F331 V365 L366 L371 V372 | R131-L368 HydrophobicContact CB-CD1 3.97Å; P132-L368 HydrophobicContact CG-CD1 3.82Å; F331-L368 HydrophobicContact CD1-CD2 3.79Å; F331-L368 HydrophobicContact CE1-CB 4.22Å; F331-L368 HydrophobicContact CE1-CD2 3.46Å; F331-L368 VanDerWaalsContact CE1-CD2 3.46Å; F331-L368 HydrophobicContact CE1-CG 3.82Å; F331-L368 HydrophobicContact CZ-CD2 4.07Å; F331-L368 HydrophobicContact CZ-CG 4.29Å; V365-L368 WeakPolarHBondContact O-CB 3.03Å; V365-L368 PolarHBondContact O-N 3.17Å; V365-L368 VanDerWaalsContact O-N 3.11Å; L366-L368 VanDerWaalsContact C-N 3.32Å; L368-L371 PolarHBondContact O-N 2.95Å; L368-V372 HydrophobicContact CD1-CG2 4.23Å; L368-V372 HydrophobicContact CG-CG2 4.08Å; L368-V372 VanDerWaalsContact O-CG2 3.3Å; L368-V372 WeakPolarHBondContact O-CG2 3.36Å; L368-V372 PolarHBondContact O-N 3.09Å |
| 369 | Y | 88.3 | Confident | 84.1 | Confident | 67 Ų | 67 | 41 Ų | 41 | 26% | 0.263 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -54.6 | -55 | -176.1 | 178.6 | -109.9 | 0 | 0 | 0 | 115.2 | V169 T170 V173 V365 L371 V372 V373 | V169-Y369 HydrophobicContact CG1-CD2 3.84Å; V169-Y369 HydrophobicContact CG1-CE2 3.98Å; T170-Y369 PolarHBondContact OG1-OH 3.33Å; V173-Y369 HydrophobicContact CB-CD2 4.39Å; V173-Y369 HydrophobicContact CG1-CD2 4.48Å; V173-Y369 HydrophobicContact CG2-CD2 3.94Å; V365-Y369 PolarHBondContact O-N 3.47Å; Y369-L371 VanDerWaalsContact C-N 3.27Å; Y369-L371 PolarHBondContact O-N 3.38Å; Y369-V372 WeakPolarHBondContact O-CB 3.36Å; Y369-V372 PolarHBondContact O-N 3.33Å; Y369-V372 VanDerWaalsContact O-N 3.16Å; Y369-V373 HydrophobicContact CD2-CG2 4.34Å; Y369-V373 HydrophobicContact CE1-CG2 4.24Å; Y369-V373 HydrophobicContact CE2-CG2 3.93Å; Y369-V373 WeakPolarHBondContact O-CG2 3.48Å; Y369-V373 PolarHBondContact O-N 2.83Å |
| 370 | P | 89.3 | Confident | 84.5 | Confident | 65 Ų | 65 | 38.5 Ų | 38.5 | 42% | 0.422 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -63.1 | -34.9 | -179.4 | 25.1 | -34 | 0 | 0 | 0 | 112.2 | L366 L367 V372 V373 V374 | L366-P370 WeakPolarHBondContact O-CD 3.24Å; L367-P370 WeakPolarHBondContact O-CD 3.43Å; P370-V372 VanDerWaalsContact C-N 3.35Å; P370-V372 PolarHBondContact O-N 3.3Å; P370-V373 PolarHBondContact O-N 3.25Å; P370-V374 WeakPolarHBondContact O-CG2 3.49Å; P370-V374 PolarHBondContact O-N 3.21Å |
| 371 | L | 88.6 | Confident | 84.8 | Confident | 59 Ų | 59 | 38.6 Ų | 38.6 | 31% | 0.309 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -64.7 | -40 | 176.5 | -62.5 | 174.9 | 0 | 0 | 0 | 111.6 | F126 P132 L368 Y369 M375 | F126-L371 VanDerWaalsContact O-CD1 3.23Å; F126-L371 WeakPolarHBondContact O-CD1 3.47Å; P132-L371 HydrophobicContact CB-CB 4.04Å; P132-L371 HydrophobicContact CG-CB 3.67Å; P132-L371 HydrophobicContact CG-CD1 4.3Å; L368-L371 PolarHBondContact O-N 2.95Å; Y369-L371 VanDerWaalsContact C-N 3.27Å; Y369-L371 PolarHBondContact O-N 3.38Å; L371-M375 WeakPolarHBondContact O-CB 3.12Å; L371-M375 WeakPolarHBondContact O-CG 3.08Å; L371-M375 PolarHBondContact O-N 3.19Å; L371-M375 VanDerWaalsContact O-N 3.09Å |
| 372 | V | 89.4 | Confident | 84.9 | Confident | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.2 | -44.1 | 174.2 | 174.5 | 0 | 0 | 0 | 0 | 110.9 | P132 A135 S136 V169 F331 L368 Y369 P370 M375 L376 | P132-V372 HydrophobicContact CB-CG2 4.31Å; A135-V372 HydrophobicContact CB-CG1 3.98Å; A135-V372 HydrophobicContact CB-CG2 3.72Å; S136-V372 PolarHBondContact OG-O 3.08Å; V169-V372 HydrophobicContact CG1-CG1 3.9Å; V169-V372 HydrophobicContact CG2-CG1 4.04Å; F331-V372 HydrophobicContact CZ-CG2 4.15Å; L368-V372 HydrophobicContact CD1-CG2 4.23Å; L368-V372 HydrophobicContact CG-CG2 4.08Å; L368-V372 VanDerWaalsContact O-CG2 3.3Å; L368-V372 WeakPolarHBondContact O-CG2 3.36Å; L368-V372 PolarHBondContact O-N 3.09Å; Y369-V372 WeakPolarHBondContact O-CB 3.36Å; Y369-V372 PolarHBondContact O-N 3.33Å; Y369-V372 VanDerWaalsContact O-N 3.16Å; P370-V372 VanDerWaalsContact C-N 3.35Å; P370-V372 PolarHBondContact O-N 3.3Å; V372-M375 PolarHBondContact O-N 3.19Å; V372-L376 WeakPolarHBondContact O-CB 3.47Å; V372-L376 PolarHBondContact O-N 3.49Å |
| 373 | V | 90.6 | Very high | 85 | Confident | 28 Ų | 28 | 47 Ų | 47 | 17% | 0.17 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -62.9 | -44.8 | 179.5 | 174.2 | 0 | 0 | 0 | 0 | 111.2 | I166 Y369 P370 M375 L376 I377 | I166-V373 HydrophobicContact CD1-CG1 4.47Å; Y369-V373 HydrophobicContact CD2-CG2 4.34Å; Y369-V373 HydrophobicContact CE1-CG2 4.24Å; Y369-V373 HydrophobicContact CE2-CG2 3.93Å; Y369-V373 WeakPolarHBondContact O-CG2 3.48Å; Y369-V373 PolarHBondContact O-N 2.83Å; P370-V373 PolarHBondContact O-N 3.25Å; V373-M375 PolarHBondContact O-N 3.49Å; V373-L376 PolarHBondContact O-N 2.9Å; V373-I377 HydrophobicContact CG1-CD1 3.8Å; V373-I377 HydrophobicContact CG1-CG1 4.46Å; V373-I377 VanDerWaalsContact O-CG1 3.3Å; V373-I377 WeakPolarHBondContact O-CG1 3.01Å; V373-I377 PolarHBondContact O-N 3.3Å |
| 374 | V | 90.2 | Very high | 85.1 | Confident | 84 Ų | 84 | 47 Ų | 47 | 51% | 0.509 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -61.1 | -45.2 | 177.1 | 171.6 | 0 | 0 | 0 | 0 | 111.5 | P370 L376 I377 T378 | P370-V374 WeakPolarHBondContact O-CG2 3.49Å; P370-V374 PolarHBondContact O-N 3.21Å; V374-L376 VanDerWaalsContact C-N 3.32Å; V374-L376 PolarHBondContact O-N 3.44Å; V374-I377 PolarHBondContact O-N 2.87Å; V374-T378 WeakPolarHBondContact O-CG2 3.27Å; V374-T378 PolarHBondContact O-N 2.81Å; V374-T378 VanDerWaalsContact O-N 3.13Å; V374-T378 PolarHBondContact O-OG1 2.93Å |
| 375 | M | 87.4 | Confident | 85.1 | Confident | 43 Ų | 43 | 47.3 Ų | 47.3 | 21% | 0.212 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -67.2 | -33.2 | 177.7 | -73.8 | -68.1 | 149.9 | 0 | 0 | 112.8 | I129 P132 S136 L371 V372 V373 G379 L384 | I129-M375 HydrophobicContact CB-CE 4.25Å; I129-M375 HydrophobicContact CB-SD 4.45Å; I129-M375 HydrophobicContact CD1-CE 4.36Å; I129-M375 HydrophobicContact CG1-CE 3.37Å; I129-M375 HydrophobicContact CG1-SD 4.15Å; I129-M375 HydrophobicContact CG2-CE 3.94Å; I129-M375 HydrophobicContact CG2-CG 4.11Å; I129-M375 HydrophobicContact CG2-SD 3.51Å; I129-M375 VanDerWaalsContact CG2-SD 3.51Å; P132-M375 HydrophobicContact CB-CG 3.95Å; S136-M375 VanDerWaalsContact OG-CB 3.24Å; S136-M375 WeakPolarHBondContact OG-CB 3.02Å; L371-M375 WeakPolarHBondContact O-CB 3.12Å; L371-M375 WeakPolarHBondContact O-CG 3.08Å; L371-M375 PolarHBondContact O-N 3.19Å; L371-M375 VanDerWaalsContact O-N 3.09Å; V372-M375 PolarHBondContact O-N 3.19Å; V373-M375 PolarHBondContact O-N 3.49Å; M375-G379 WeakPolarHBondContact O-CA 3.27Å; M375-G379 PolarHBondContact O-N 3.03Å; M375-L384 HydrophobicContact SD-CD2 4.35Å |
| 376 | L | 88.2 | Confident | 85.1 | Confident | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -70.9 | -39.5 | 177.9 | -173.6 | 163.9 | 0 | 0 | 0 | 111.3 | S136 S139 L140 K162 I166 V372 V373 V374 | S136-L376 PolarHBondContact OG-N 3.01Å; S139-L376 WeakPolarHBondContact OG-CD1 3.09Å; L140-L376 HydrophobicContact CD2-CD2 4.19Å; L140-L376 HydrophobicContact CD2-CG 4.13Å; L140-L376 HydrophobicContact CG-CG 4.29Å; K162-L376 HydrophobicContact CB-CD2 3.89Å; K162-L376 HydrophobicContact CG-CD2 4.05Å; I166-L376 HydrophobicContact CD1-CD2 4.14Å; I166-L376 HydrophobicContact CG1-CD1 3.93Å; I166-L376 HydrophobicContact CG1-CD2 3.74Å; I166-L376 HydrophobicContact CG1-CG 4.45Å; V372-L376 WeakPolarHBondContact O-CB 3.47Å; V372-L376 PolarHBondContact O-N 3.49Å; V373-L376 PolarHBondContact O-N 2.9Å; V374-L376 VanDerWaalsContact C-N 3.32Å; V374-L376 PolarHBondContact O-N 3.44Å |
| 377 | I | 89 | Confident | 85 | Confident | 93 Ų | 93 | 46.5 Ų | 46.5 | 48% | 0.477 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -67.8 | -41.2 | 177.4 | -67.7 | 166.8 | 0 | 0 | 0 | 110.9 | K162 V373 V374 | K162-I377 PolarHBondContact NZ-O 2.9Å; V373-I377 HydrophobicContact CG1-CD1 3.8Å; V373-I377 HydrophobicContact CG1-CG1 4.46Å; V373-I377 VanDerWaalsContact O-CG1 3.3Å; V373-I377 WeakPolarHBondContact O-CG1 3.01Å; V373-I377 PolarHBondContact O-N 3.3Å; V374-I377 PolarHBondContact O-N 2.87Å |
| 378 | T | 84.9 | Confident | 85 | Confident | 100 Ų | 100 | 44 Ų | 44 | 61% | 0.613 | 23% | 0.227 | S | C | * | . | H | α-helix | trans | -90.2 | -29.2 | -172.3 | 54.3 | 0 | 0 | 0 | 0 | 114.4 | V374 | V374-T378 WeakPolarHBondContact O-CG2 3.27Å; V374-T378 PolarHBondContact O-N 2.81Å; V374-T378 VanDerWaalsContact O-N 3.13Å; V374-T378 PolarHBondContact O-OG1 2.93Å |
| 379 | G | 79.9 | Confident | 84.9 | Confident | 7 Ų | 7 | 43.9 Ų | 43.9 | 7% | 0.072 | 23% | 0.226 | C | C | . | . | trans | -97.8 | 152.3 | -168.6 | 0 | 0 | 0 | 0 | 0 | 115 | M375 | M375-G379 WeakPolarHBondContact O-CA 3.27Å; M375-G379 PolarHBondContact O-N 3.03Å | ||
| 380 | E | 82.7 | Confident | 84.8 | Confident | 82 Ų | 82 | 41.2 Ų | 41.2 | 38% | 0.383 | 22% | 0.216 | S | C | . | . | trans | -102.6 | 152.6 | 166.8 | -75.9 | -61.7 | 148.9 | 0 | 0 | 110.7 | R144 Y382 Q383 L384 | R144-E380 IonicContact NH2-OE2 2.97Å; R144-E380 PolarHBondContact NH2-OE2 3.29Å; R144-E380 VanDerWaalsContact NH2-OE2 3.12Å; E380-Y382 PolarHBondContact O-N 3.16Å; E380-Q383 HydrophobicContact CB-CG 4.45Å; E380-Q383 PolarHBondContact O-N 3.32Å; E380-L384 WeakPolarHBondContact O-CB 3.39Å; E380-L384 VanDerWaalsContact O-CG 3.28Å; E380-L384 WeakPolarHBondContact O-CG 3.05Å; E380-L384 PolarHBondContact O-N 3.2Å | ||
| 381 | I | 80.5 | Confident | 84.6 | Confident | 3 Ų | 3 | 38.1 Ų | 38.1 | 2% | 0.015 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -52.7 | -55 | -172.5 | -63.5 | -169.7 | 0 | 0 | 0 | 112.1 | I59 L140 R144 Q383 L384 I385 | I59-I381 HydrophobicContact CD1-CG2 4.31Å; L140-I381 HydrophobicContact CB-CD1 3.79Å; L140-I381 HydrophobicContact CB-CG1 3.68Å; L140-I381 HydrophobicContact CD1-CG1 4.01Å; R144-I381 VanDerWaalsContact CZ-CD1 3.44Å; I381-Q383 PolarHBondContact O-N 2.9Å; I381-L384 PolarHBondContact O-N 3.43Å; I381-I385 HydrophobicContact CG2-CD1 3.74Å; I381-I385 HydrophobicContact CG2-CG1 4.49Å; I381-I385 VanDerWaalsContact O-CG1 3.25Å; I381-I385 WeakPolarHBondContact O-CG1 3.24Å; I381-I385 PolarHBondContact O-N 3.24Å |
| 382 | Y | 79.1 | Confident | 84.6 | Confident | 114 Ų | 114 | 36.9 Ų | 36.9 | 45% | 0.447 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -67.1 | -38.2 | -175.7 | -68.8 | -74.2 | 0 | 0 | 0 | 113.2 | I59 E380 I385 N386 | I59-Y382 HydrophobicContact CG2-CE1 4.21Å; E380-Y382 PolarHBondContact O-N 3.16Å; Y382-I385 PolarHBondContact O-N 3.5Å; Y382-N386 PolarHBondContact O-N 2.99Å |
| 383 | Q | 82.8 | Confident | 84.6 | Confident | 106 Ų | 106 | 37.2 Ų | 37.2 | 50% | 0.495 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -64.2 | -43.8 | 176.4 | -66.3 | -178.9 | 4.1 | 0 | 0 | 111 | E380 I381 I385 N386 F387 | E380-Q383 HydrophobicContact CB-CG 4.45Å; E380-Q383 PolarHBondContact O-N 3.32Å; I381-Q383 PolarHBondContact O-N 2.9Å; Q383-I385 VanDerWaalsContact C-N 3.34Å; Q383-I385 PolarHBondContact O-N 3.43Å; Q383-N386 PolarHBondContact O-N 2.91Å; Q383-F387 WeakPolarHBondContact O-CB 3.47Å; Q383-F387 PolarHBondContact O-N 3.25Å |
| 384 | L | 83.1 | Confident | 84.6 | Confident | 8 Ų | 8 | 38.7 Ų | 38.7 | 4% | 0.042 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -64.7 | -37.4 | 176.5 | -70 | 171.4 | 0 | 0 | 0 | 112.1 | A133 Y137 L140 M375 E380 I381 A388 | A133-L384 HydrophobicContact CB-CB 4.3Å; A133-L384 HydrophobicContact CB-CD2 3.84Å; Y137-L384 HydrophobicContact CD1-CB 4.25Å; L140-L384 HydrophobicContact CD1-CD1 4.03Å; M375-L384 HydrophobicContact SD-CD2 4.35Å; E380-L384 WeakPolarHBondContact O-CB 3.39Å; E380-L384 VanDerWaalsContact O-CG 3.28Å; E380-L384 WeakPolarHBondContact O-CG 3.05Å; E380-L384 PolarHBondContact O-N 3.2Å; I381-L384 PolarHBondContact O-N 3.43Å; L384-A388 WeakPolarHBondContact O-CB 3.46Å; L384-A388 PolarHBondContact O-N 3.14Å |
| 385 | I | 80.9 | Confident | 84.7 | Confident | 6 Ų | 6 | 34.8 Ų | 34.8 | 3% | 0.031 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -61.5 | -49.8 | 174.4 | -70.9 | 167.4 | 0 | 0 | 0 | 110.1 | Y137 Y240 I381 Y382 Q383 F387 A388 S389 | Y137-I385 HydrophobicContact CD1-CG1 3.85Å; Y137-I385 HydrophobicContact CD2-CG1 4.15Å; Y137-I385 HydrophobicContact CE1-CG1 4.12Å; Y137-I385 HydrophobicContact CE2-CG1 4.49Å; Y137-I385 HydrophobicContact CG-CG1 3.91Å; Y240-I385 HydrophobicContact CD2-CG1 4.45Å; Y240-I385 HydrophobicContact CD2-CG2 3.87Å; Y240-I385 HydrophobicContact CE1-CD1 4.07Å; Y240-I385 HydrophobicContact CE2-CD1 3.98Å; Y240-I385 HydrophobicContact CE2-CG1 3.77Å; Y240-I385 HydrophobicContact CE2-CG2 4.05Å; Y240-I385 HydrophobicContact CG-CG2 4.31Å; I381-I385 HydrophobicContact CG2-CD1 3.74Å; I381-I385 HydrophobicContact CG2-CG1 4.49Å; I381-I385 VanDerWaalsContact O-CG1 3.25Å; I381-I385 WeakPolarHBondContact O-CG1 3.24Å; I381-I385 PolarHBondContact O-N 3.24Å; Y382-I385 PolarHBondContact O-N 3.5Å; Q383-I385 VanDerWaalsContact C-N 3.34Å; Q383-I385 PolarHBondContact O-N 3.43Å; I385-F387 VanDerWaalsContact C-N 3.34Å; I385-F387 PolarHBondContact O-N 3.04Å; I385-A388 PolarHBondContact O-N 3.21Å; I385-S389 VanDerWaalsContact O-CB 3.24Å; I385-S389 WeakPolarHBondContact O-CB 2.98Å; I385-S389 PolarHBondContact O-N 3.08Å; I385-S389 PolarHBondContact O-OG 3.36Å |
| 386 | N | 80.9 | Confident | 84.9 | Confident | 30 Ų | 30 | 32.9 Ų | 32.9 | 16% | 0.16 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61.8 | -45.2 | 179.4 | -75.2 | -14.4 | 0 | 0 | 0 | 112.2 | Y236 Y382 Q383 A388 S389 D442 | Y236-N386 WeakPolarHBondContact CE1-OD1 3.46Å; Y236-N386 WeakPolarHBondContact OH-CA 3.14Å; Y236-N386 PolarHBondContact OH-OD1 3.44Å; Y382-N386 PolarHBondContact O-N 2.99Å; Q383-N386 PolarHBondContact O-N 2.91Å; N386-A388 PolarHBondContact O-N 3.49Å; N386-S389 PolarHBondContact O-N 3.16Å; N386-D442 PolarHBondContact ND2-OD2 3.42Å |
| 387 | F | 81.5 | Confident | 85.2 | Confident | 25 Ų | 25 | 32.9 Ų | 32.9 | 11% | 0.11 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61.3 | -41.7 | -178.7 | -171 | -124.2 | 0 | 0 | 0 | 113.7 | I129 Q383 I385 N445 R448 S449 L452 | I129-F387 HydrophobicContact CB-CD1 3.95Å; I129-F387 HydrophobicContact CB-CE1 3.29Å; I129-F387 HydrophobicContact CB-CZ 4.2Å; I129-F387 HydrophobicContact CD1-CE1 3.38Å; I129-F387 HydrophobicContact CD1-CZ 3.44Å; I129-F387 VanDerWaalsContact CD1-CZ 3.44Å; I129-F387 HydrophobicContact CG1-CE1 3.5Å; I129-F387 VanDerWaalsContact CG1-CE1 3.5Å; I129-F387 HydrophobicContact CG1-CZ 4.12Å; I129-F387 HydrophobicContact CG2-CD1 3.4Å; I129-F387 HydrophobicContact CG2-CE1 3.2Å; I129-F387 HydrophobicContact CG2-CZ 4.46Å; Q383-F387 WeakPolarHBondContact O-CB 3.47Å; Q383-F387 PolarHBondContact O-N 3.25Å; I385-F387 VanDerWaalsContact C-N 3.34Å; I385-F387 PolarHBondContact O-N 3.04Å; F387-N445 HydrophobicContact CD2-CB 4.48Å; F387-N445 VanDerWaalsContact CD2-O 3.29Å; F387-N445 WeakPolarHBondContact CD2-O 3.5Å; F387-R448 HydrophobicContact CE2-CB 3.96Å; F387-S449 PolarHBondContact O-OG 3.29Å; F387-S449 VanDerWaalsContact O-OG 3.04Å; F387-L452 HydrophobicContact CE2-CD1 4.36Å; F387-L452 HydrophobicContact CZ-CD1 3.77Å |
| 388 | A | 83.2 | Confident | 85.4 | Confident | 1 Ų | 1 | 29.9 Ų | 29.9 | 1% | 0.008 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -77.9 | -27.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | A133 V134 L384 I385 N386 R392 | A133-A388 HydrophobicContact CB-CB 4.11Å; V134-A388 HydrophobicContact CG2-CB 4.09Å; L384-A388 WeakPolarHBondContact O-CB 3.46Å; L384-A388 PolarHBondContact O-N 3.14Å; I385-A388 PolarHBondContact O-N 3.21Å; N386-A388 PolarHBondContact O-N 3.49Å; A388-R392 WeakPolarHBondContact O-CB 3.37Å; A388-R392 PolarHBondContact O-N 2.98Å |
| 389 | S | 82.8 | Confident | 85.9 | Confident | 1 Ų | 1 | 25.1 Ų | 25.1 | 1% | 0.007 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -72.6 | -39.6 | -170.6 | -67.6 | 0 | 0 | 0 | 0 | 113.1 | Y236 I385 N386 S391 R392 W393 | Y236-S389 WeakPolarHBondContact OH-CB 3.49Å; Y236-S389 PolarHBondContact OH-OG 3.35Å; I385-S389 VanDerWaalsContact O-CB 3.24Å; I385-S389 WeakPolarHBondContact O-CB 2.98Å; I385-S389 PolarHBondContact O-N 3.08Å; I385-S389 PolarHBondContact O-OG 3.36Å; N386-S389 PolarHBondContact O-N 3.16Å; S389-S391 PolarHBondContact O-N 2.99Å; S389-R392 PolarHBondContact O-N 3.31Å; S389-R392 PolarHBondContact OG-NH1 2.87Å; S389-W393 PolarHBondContact O-N 3.03Å |
| 390 | F | 84.9 | Confident | 86.5 | Confident | 11 Ų | 11 | 24.9 Ų | 24.9 | 5% | 0.048 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -53.9 | -57.6 | 176.3 | 166.8 | -98.4 | 0 | 0 | 0 | 111.8 | R392 W393 F394 V435 L439 T446 C450 | F390-R392 VanDerWaalsContact C-N 3.31Å; F390-R392 PolarHBondContact O-N 3.38Å; F390-W393 PolarHBondContact O-N 2.99Å; F390-F394 WeakPolarHBondContact O-CB 3.47Å; F390-F394 PolarHBondContact O-N 3.21Å; F390-V435 HydrophobicContact CD2-CG1 3.98Å; F390-V435 HydrophobicContact CE2-CG1 3.66Å; F390-L439 HydrophobicContact CE2-CG 4.44Å; F390-T446 HydrophobicContact CB-CG2 3.74Å; F390-T446 HydrophobicContact CD1-CG2 4.35Å; F390-T446 HydrophobicContact CD2-CG2 3.31Å; F390-T446 HydrophobicContact CE2-CG2 3.97Å; F390-T446 HydrophobicContact CG-CG2 3.53Å; F390-C450 HydrophobicContact CE1-CB 3.81Å; F390-C450 HydrophobicContact CZ-CB 3.88Å |
| 391 | S | 86.9 | Confident | 87.1 | Confident | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -57.2 | -46.4 | -179.7 | 158.5 | 0 | 0 | 0 | 0 | 111 | V124 S130 S389 W393 F394 F395 | V124-S391 WeakPolarHBondContact CG1-OG 3.49Å; S130-S391 VanDerWaalsContact OG-CB 3.27Å; S130-S391 WeakPolarHBondContact OG-CB 3.41Å; S130-S391 PolarHBondContact OG-OG 3.4Å; S389-S391 PolarHBondContact O-N 2.99Å; S391-W393 PolarHBondContact O-N 3.4Å; S391-F394 PolarHBondContact O-N 2.87Å; S391-F395 VanDerWaalsContact O-CD2 3.23Å; S391-F395 WeakPolarHBondContact O-CD2 3.37Å; S391-F395 PolarHBondContact O-N 3.4Å |
| 392 | R | 87.3 | Confident | 87.8 | Confident | 32 Ų | 32 | 23.8 Ų | 23.8 | 12% | 0.121 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -56.2 | -54.2 | 179.2 | -174.4 | -169.4 | -60.3 | 124.2 | -2.6 | 111.4 | Y137 A388 S389 F390 I396 | Y137-R392 PolarHBondContact OH-NH2 3.27Å; A388-R392 WeakPolarHBondContact O-CB 3.37Å; A388-R392 PolarHBondContact O-N 2.98Å; S389-R392 PolarHBondContact O-N 3.31Å; S389-R392 PolarHBondContact OG-NH1 2.87Å; F390-R392 VanDerWaalsContact C-N 3.31Å; F390-R392 PolarHBondContact O-N 3.38Å; R392-I396 HydrophobicContact CG-CD1 3.86Å; R392-I396 WeakPolarHBondContact O-CB 3.47Å; R392-I396 WeakPolarHBondContact O-CD1 3.36Å; R392-I396 WeakPolarHBondContact O-CG1 3.45Å; R392-I396 PolarHBondContact O-N 3.02Å |
| 393 | W | 89.1 | Confident | 88.4 | Confident | 8 Ų | 8 | 18.6 Ų | 18.6 | 3% | 0.03 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -68.7 | -36.2 | -177.6 | -72.9 | 113.3 | 0 | 0 | 0 | 112.4 | L239 S389 F390 S391 I396 A397 F427 C431 I434 V435 | L239-W393 HydrophobicContact CB-CH2 4.01Å; L239-W393 HydrophobicContact CB-CZ2 3.63Å; L239-W393 HydrophobicContact CD1-CH2 4.18Å; L239-W393 HydrophobicContact CD1-CZ2 4.31Å; L239-W393 HydrophobicContact CD2-CH2 4.37Å; L239-W393 HydrophobicContact CG-CH2 4.44Å; L239-W393 HydrophobicContact CG-CZ2 4.48Å; S389-W393 PolarHBondContact O-N 3.03Å; F390-W393 PolarHBondContact O-N 2.99Å; S391-W393 PolarHBondContact O-N 3.4Å; W393-I396 HydrophobicContact CE3-CD1 4.43Å; W393-I396 PolarHBondContact O-N 3.21Å; W393-A397 WeakPolarHBondContact O-CB 3.49Å; W393-A397 PolarHBondContact O-N 3.39Å; W393-F427 HydrophobicContact CZ3-CE2 4.49Å; W393-F427 HydrophobicContact CZ3-CZ 4.25Å; W393-C431 HydrophobicContact CE3-CB 4.46Å; W393-I434 HydrophobicContact CB-CG2 4.24Å; W393-I434 HydrophobicContact CD2-CD1 4.36Å; W393-I434 HydrophobicContact CD2-CG2 3.99Å; W393-I434 HydrophobicContact CE3-CD1 4.19Å; W393-I434 HydrophobicContact CG-CG2 3.7Å; W393-I434 HydrophobicContact CH2-CD1 4.4Å; W393-I434 HydrophobicContact CZ3-CD1 4.19Å; W393-V435 HydrophobicContact CB-CG2 3.82Å |
| 394 | F | 91.2 | Very high | 89 | Confident | 58 Ų | 58 | 15.1 Ų | 15.1 | 25% | 0.254 | 7% | 0.073 | S | C | . | . | H | α-helix | trans | -60.4 | -48.8 | 176.3 | 179.8 | -108.4 | 0 | 0 | 0 | 111.7 | F390 S391 I396 A397 L398 V435 | F390-F394 WeakPolarHBondContact O-CB 3.47Å; F390-F394 PolarHBondContact O-N 3.21Å; S391-F394 PolarHBondContact O-N 2.87Å; F394-I396 PolarHBondContact O-N 3.44Å; F394-A397 WeakPolarHBondContact O-CB 3.38Å; F394-A397 PolarHBondContact O-N 2.87Å; F394-L398 HydrophobicContact CD1-CD1 4.04Å; F394-L398 HydrophobicContact CE1-CD1 3.49Å; F394-L398 VanDerWaalsContact CE1-CD1 3.49Å; F394-L398 HydrophobicContact CE1-CG 4.3Å; F394-L398 HydrophobicContact CE2-CD1 4.48Å; F394-L398 HydrophobicContact CZ-CD1 3.75Å; F394-L398 HydrophobicContact CZ-CG 4.25Å; F394-L398 WeakPolarHBondContact O-CG 3.48Å; F394-L398 PolarHBondContact O-N 3.44Å; F394-V435 HydrophobicContact CB-CG2 4.1Å; F394-V435 HydrophobicContact CD2-CG1 4.33Å |
| 395 | F | 91.6 | Very high | 89.5 | Confident | 2 Ų | 2 | 17.6 Ų | 17.6 | 1% | 0.009 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -72.8 | -27.9 | 178.4 | -77.4 | -67.8 | 0 | 0 | 0 | 113.7 | L109 L120 R121 V124 S391 L398 A399 T453 | L109-F395 HydrophobicContact CD1-CD1 3.82Å; L109-F395 HydrophobicContact CD1-CE1 4.47Å; L120-F395 HydrophobicContact CB-CE1 4.26Å; L120-F395 HydrophobicContact CB-CZ 4.06Å; R121-F395 VanDerWaalsContact CA-CE1 3.48Å; R121-F395 HydrophobicContact CB-CD1 3.78Å; R121-F395 HydrophobicContact CB-CE1 3.68Å; R121-F395 HydrophobicContact CB-CG 4.4Å; R121-F395 HydrophobicContact CB-CZ 4.23Å; R121-F395 HydrophobicContact CG-CD1 4.18Å; R121-F395 HydrophobicContact CG-CG 4.39Å; V124-F395 HydrophobicContact CB-CE2 3.89Å; V124-F395 HydrophobicContact CB-CZ 4.48Å; V124-F395 HydrophobicContact CG1-CE2 4.21Å; V124-F395 HydrophobicContact CG2-CE2 3.98Å; V124-F395 HydrophobicContact CG2-CZ 4.25Å; S391-F395 VanDerWaalsContact O-CD2 3.23Å; S391-F395 WeakPolarHBondContact O-CD2 3.37Å; S391-F395 PolarHBondContact O-N 3.4Å; F395-L398 HydrophobicContact CD1-CD1 4.07Å; F395-L398 HydrophobicContact CE1-CD1 4.28Å; F395-A399 WeakPolarHBondContact O-CB 3.22Å; F395-A399 PolarHBondContact O-N 3.18Å; F395-T453 HydrophobicContact CE2-CG2 4.47Å; F395-T453 HydrophobicContact CZ-CG2 4.21Å |
| 396 | I | 92.1 | Very high | 90 | Very high | 3 Ų | 3 | 18.1 Ų | 18.1 | 2% | 0.015 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -66.9 | -41.5 | 170.1 | -70.1 | 168.9 | 0 | 0 | 0 | 110.5 | Y92 F246 R392 W393 F394 A399 T400 F427 | Y92-I396 HydrophobicContact CE2-CG2 4.28Å; F246-I396 HydrophobicContact CD1-CD1 4.36Å; F246-I396 HydrophobicContact CE1-CD1 4.1Å; R392-I396 HydrophobicContact CG-CD1 3.86Å; R392-I396 WeakPolarHBondContact O-CB 3.47Å; R392-I396 WeakPolarHBondContact O-CD1 3.36Å; R392-I396 WeakPolarHBondContact O-CG1 3.45Å; R392-I396 PolarHBondContact O-N 3.02Å; W393-I396 HydrophobicContact CE3-CD1 4.43Å; W393-I396 PolarHBondContact O-N 3.21Å; F394-I396 PolarHBondContact O-N 3.44Å; I396-A399 PolarHBondContact O-N 3.14Å; I396-T400 WeakPolarHBondContact O-CG2 3.25Å; I396-T400 PolarHBondContact O-N 3.4Å; I396-T400 PolarHBondContact O-OG1 3.4Å; I396-F427 HydrophobicContact CG2-CE1 3.66Å; I396-F427 HydrophobicContact CG2-CZ 3.88Å |
| 397 | A | 93.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 17.9 Ų | 17.9 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -60.7 | -46.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | W393 F394 A399 T400 L401 C431 F432 | W393-A397 WeakPolarHBondContact O-CB 3.49Å; W393-A397 PolarHBondContact O-N 3.39Å; F394-A397 WeakPolarHBondContact O-CB 3.38Å; F394-A397 PolarHBondContact O-N 2.87Å; A397-A399 PolarHBondContact O-N 3.06Å; A397-T400 PolarHBondContact O-N 3.06Å; A397-T400 PolarHBondContact O-OG1 3.06Å; A397-T400 VanDerWaalsContact O-OG1 3.05Å; A397-L401 VanDerWaalsContact O-CB 3.25Å; A397-L401 WeakPolarHBondContact O-CB 3.41Å; A397-L401 PolarHBondContact O-N 3.46Å; A397-C431 HydrophobicContact CB-CB 3.69Å; A397-F432 HydrophobicContact CB-CD1 4.07Å; A397-F432 HydrophobicContact CB-CD2 4.1Å; A397-F432 HydrophobicContact CB-CE1 3.91Å; A397-F432 HydrophobicContact CB-CE2 3.95Å; A397-F432 HydrophobicContact CB-CG 4.15Å; A397-F432 HydrophobicContact CB-CZ 3.85Å |
| 398 | L | 94.8 | Very high | 91 | Very high | 31 Ų | 31 | 26.8 Ų | 26.8 | 16% | 0.162 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -62.8 | -41.2 | 176.4 | -71.1 | -179.6 | 0 | 0 | 0 | 112.9 | L109 L113 F394 F395 T400 L401 G402 | L109-L398 HydrophobicContact CD2-CB 3.81Å; L113-L398 HydrophobicContact CD1-CB 4.22Å; L113-L398 HydrophobicContact CD1-CD2 4.46Å; L113-L398 WeakPolarHBondContact CD1-O 3.25Å; F394-L398 HydrophobicContact CD1-CD1 4.04Å; F394-L398 HydrophobicContact CE1-CD1 3.49Å; F394-L398 VanDerWaalsContact CE1-CD1 3.49Å; F394-L398 HydrophobicContact CE1-CG 4.3Å; F394-L398 HydrophobicContact CE2-CD1 4.48Å; F394-L398 HydrophobicContact CZ-CD1 3.75Å; F394-L398 HydrophobicContact CZ-CG 4.25Å; F394-L398 WeakPolarHBondContact O-CG 3.48Å; F394-L398 PolarHBondContact O-N 3.44Å; F395-L398 HydrophobicContact CD1-CD1 4.07Å; F395-L398 HydrophobicContact CE1-CD1 4.28Å; L398-T400 PolarHBondContact O-N 3.28Å; L398-L401 PolarHBondContact O-N 3.2Å; L398-G402 PolarHBondContact O-N 2.96Å |
| 399 | A | 93.8 | Very high | 91.3 | Very high | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -66.1 | -38.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y92 L109 F395 I396 A397 G402 M403 | Y92-A399 WeakPolarHBondContact OH-CB 3.43Å; L109-A399 HydrophobicContact CD2-CB 4.3Å; F395-A399 WeakPolarHBondContact O-CB 3.22Å; F395-A399 PolarHBondContact O-N 3.18Å; I396-A399 PolarHBondContact O-N 3.14Å; A397-A399 PolarHBondContact O-N 3.06Å; A399-G402 PolarHBondContact O-N 3.37Å; A399-M403 PolarHBondContact O-N 2.95Å |
| 400 | T | 94.3 | Very high | 91.7 | Very high | 1 Ų | 1 | 40 Ų | 40 | 1% | 0.006 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -76.4 | -35.1 | 178.2 | 56.5 | 0 | 0 | 0 | 0 | 112.1 | C91 Y92 I396 A397 L398 G402 M403 L404 F427 T428 | C91-T400 HydrophobicContact CB-CG2 4.33Å; Y92-T400 HydrophobicContact CE2-CG2 4.03Å; I396-T400 WeakPolarHBondContact O-CG2 3.25Å; I396-T400 PolarHBondContact O-N 3.4Å; I396-T400 PolarHBondContact O-OG1 3.4Å; A397-T400 PolarHBondContact O-N 3.06Å; A397-T400 PolarHBondContact O-OG1 3.06Å; A397-T400 VanDerWaalsContact O-OG1 3.05Å; L398-T400 PolarHBondContact O-N 3.28Å; T400-G402 VanDerWaalsContact C-N 3.34Å; T400-M403 VanDerWaalsContact O-CB 3.31Å; T400-M403 WeakPolarHBondContact O-CB 3.37Å; T400-M403 PolarHBondContact O-N 3.34Å; T400-L404 WeakPolarHBondContact O-CG 3.33Å; T400-L404 PolarHBondContact O-N 2.99Å; T400-F427 HydrophobicContact CG2-CD1 3.81Å; T400-F427 HydrophobicContact CG2-CE1 3.84Å; T400-T428 WeakPolarHBondContact CB-OG1 3.43Å; T400-T428 PolarHBondContact OG1-OG1 3.03Å |
| 401 | L | 95.4 | Very high | 91.8 | Very high | 63 Ų | 63 | 43.3 Ų | 43.3 | 33% | 0.33 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -60.5 | -44.9 | 167 | -179 | 63.7 | 0 | 0 | 0 | 111.1 | A397 L398 M403 L404 V405 T428 F432 | A397-L401 VanDerWaalsContact O-CB 3.25Å; A397-L401 WeakPolarHBondContact O-CB 3.41Å; A397-L401 PolarHBondContact O-N 3.46Å; L398-L401 PolarHBondContact O-N 3.2Å; L401-M403 VanDerWaalsContact C-N 3.28Å; L401-M403 PolarHBondContact O-N 3.49Å; L401-L404 WeakPolarHBondContact O-CB 3.41Å; L401-L404 PolarHBondContact O-N 3Å; L401-L404 VanDerWaalsContact O-N 3.08Å; L401-V405 HydrophobicContact CG-CG2 4.49Å; L401-V405 WeakPolarHBondContact O-CG2 3.25Å; L401-V405 PolarHBondContact O-N 2.76Å; L401-T428 HydrophobicContact CB-CG2 4.27Å; L401-F432 HydrophobicContact CD2-CE2 4.37Å; L401-F432 HydrophobicContact CD2-CZ 4.14Å |
| 402 | G | 93.4 | Very high | 91.9 | Very high | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -57.8 | -39.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | T112 L398 A399 T400 V405 H406 | T112-G402 WeakPolarHBondContact CB-O 3.45Å; L398-G402 PolarHBondContact O-N 2.96Å; A399-G402 PolarHBondContact O-N 3.37Å; T400-G402 VanDerWaalsContact C-N 3.34Å; G402-V405 PolarHBondContact O-N 2.84Å; G402-H406 WeakPolarHBondContact O-CB 3.3Å; G402-H406 PolarHBondContact O-N 3.36Å |
| 403 | M | 93.4 | Very high | 91.9 | Very high | 4 Ų | 4 | 53.8 Ų | 53.8 | 2% | 0.02 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -59.5 | -49.4 | 171.1 | -173.1 | -133.2 | -100.9 | 0 | 0 | 111.8 | C91 E94 L95 A399 T400 L401 V405 H406 R407 V419 A424 | C91-M403 VanDerWaalsContact CA-CE 3.45Å; C91-M403 HydrophobicContact CB-CE 3.58Å; C91-M403 WeakPolarHBondContact O-CE 3.44Å; E94-M403 HydrophobicContact CB-CE 3.99Å; E94-M403 HydrophobicContact CG-CE 4.1Å; L95-M403 HydrophobicContact CD1-CB 4.28Å; L95-M403 HydrophobicContact CD2-CB 3.88Å; L95-M403 HydrophobicContact CD2-CG 3.94Å; L95-M403 HydrophobicContact CG-CB 4.22Å; L95-M403 HydrophobicContact CG-CE 4.29Å; L95-M403 HydrophobicContact CG-CG 4.18Å; A399-M403 PolarHBondContact O-N 2.95Å; T400-M403 VanDerWaalsContact O-CB 3.31Å; T400-M403 WeakPolarHBondContact O-CB 3.37Å; T400-M403 PolarHBondContact O-N 3.34Å; L401-M403 VanDerWaalsContact C-N 3.28Å; L401-M403 PolarHBondContact O-N 3.49Å; M403-V405 VanDerWaalsContact C-N 3.35Å; M403-V405 PolarHBondContact O-N 2.77Å; M403-H406 PolarHBondContact O-N 2.85Å; M403-R407 VanDerWaalsContact O-CG 3.3Å; M403-R407 WeakPolarHBondContact O-CG 3.38Å; M403-R407 PolarHBondContact O-N 3.48Å; M403-V419 HydrophobicContact CE-CG2 4.13Å; M403-A424 HydrophobicContact SD-CB 4.13Å |
| 404 | L | 94.2 | Very high | 91.8 | Very high | 33 Ų | 33 | 58.1 Ų | 58.1 | 17% | 0.173 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60.6 | -43.7 | 179 | -66.5 | 173.2 | 0 | 0 | 0 | 111.7 | T400 L401 R407 Y408 L421 A424 V425 T428 | T400-L404 WeakPolarHBondContact O-CG 3.33Å; T400-L404 PolarHBondContact O-N 2.99Å; L401-L404 WeakPolarHBondContact O-CB 3.41Å; L401-L404 PolarHBondContact O-N 3Å; L401-L404 VanDerWaalsContact O-N 3.08Å; L404-R407 WeakPolarHBondContact O-CB 3.46Å; L404-R407 PolarHBondContact O-N 3.06Å; L404-Y408 PolarHBondContact O-N 2.98Å; L404-L421 HydrophobicContact CD2-CD1 3.55Å; L404-A424 HydrophobicContact CD2-CB 3.8Å; L404-V425 HydrophobicContact CD1-CG2 4.21Å; L404-V425 HydrophobicContact CD2-CG2 4.07Å; L404-T428 HydrophobicContact CD1-CG2 4.37Å |
| 405 | V | 93.5 | Very high | 91.7 | Very high | 61 Ų | 61 | 57.6 Ų | 57.6 | 37% | 0.37 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -63.1 | -44.9 | 176.2 | 172.5 | 0 | 0 | 0 | 0 | 111 | L401 G402 M403 R407 Y408 R409 | L401-V405 HydrophobicContact CG-CG2 4.49Å; L401-V405 WeakPolarHBondContact O-CG2 3.25Å; L401-V405 PolarHBondContact O-N 2.76Å; G402-V405 PolarHBondContact O-N 2.84Å; M403-V405 VanDerWaalsContact C-N 3.35Å; M403-V405 PolarHBondContact O-N 2.77Å; V405-R407 VanDerWaalsContact C-N 3.29Å; V405-R407 PolarHBondContact O-N 3.34Å; V405-Y408 PolarHBondContact O-N 3.19Å; V405-R409 WeakPolarHBondContact O-CB 3.46Å; V405-R409 PolarHBondContact O-N 3.19Å |
| 406 | H | 92.4 | Very high | 91.5 | Very high | 16 Ų | 16 | 61 Ų | 61 | 7% | 0.074 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -63.5 | -35.9 | 177.2 | -176 | -91.5 | 0 | 0 | 0 | 111.8 | F99 T112 G402 M403 Y408 R409 F410 | F99-H406 AromaticContact CZ-CD2 3.9Å; F99-H406 AromaticContact CZ-CE1 3.83Å; F99-H406 AromaticContact CZ-NE2 3.65Å; T112-H406 HydrophobicContact CG2-CB 3.75Å; G402-H406 WeakPolarHBondContact O-CB 3.3Å; G402-H406 PolarHBondContact O-N 3.36Å; M403-H406 PolarHBondContact O-N 2.85Å; H406-Y408 VanDerWaalsContact C-N 3.3Å; H406-Y408 PolarHBondContact O-N 2.86Å; H406-R409 PolarHBondContact O-N 2.79Å; H406-F410 AromaticContact CD2-CD2 3.52Å; H406-F410 AromaticContact NE2-CD2 3.66Å; H406-F410 PolarHBondContact O-N 3.13Å |
| 407 | R | 91.1 | Very high | 91.4 | Very high | 26 Ų | 26 | 63.3 Ų | 63.3 | 10% | 0.098 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -60.3 | -41.1 | 174.3 | -75.7 | -178 | 156.2 | -156.4 | -7.3 | 112.6 | E94 M403 L404 V405 V419 | E94-R407 IonicContact OE1-CZ 3.21Å; E94-R407 IonicContact OE1-NE 2.84Å; E94-R407 PolarHBondContact OE1-NE 3.26Å; E94-R407 IonicContact OE1-NH2 2.77Å; E94-R407 PolarHBondContact OE1-NH2 3.43Å; E94-R407 IonicContact OE2-CZ 3.53Å; E94-R407 IonicContact OE2-NE 3.88Å; E94-R407 IonicContact OE2-NH2 2.6Å; E94-R407 PolarHBondContact OE2-NH2 2.96Å; M403-R407 VanDerWaalsContact O-CG 3.3Å; M403-R407 WeakPolarHBondContact O-CG 3.38Å; M403-R407 PolarHBondContact O-N 3.48Å; L404-R407 WeakPolarHBondContact O-CB 3.46Å; L404-R407 PolarHBondContact O-N 3.06Å; V405-R407 VanDerWaalsContact C-N 3.29Å; V405-R407 PolarHBondContact O-N 3.34Å; R407-V419 PolarHBondContact NH1-O 3.13Å; R407-V419 VanDerWaalsContact NH1-O 3.09Å; R407-V419 PolarHBondContact NH2-O 3.36Å |
| 408 | Y | 90.9 | Very high | 91.3 | Very high | 212 Ų | 212 | 70 Ų | 70 | 83% | 0.831 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -73.4 | -44.2 | 178.5 | -175.6 | -101.5 | 0 | 0 | 0 | 112.1 | L404 V405 H406 | L404-Y408 PolarHBondContact O-N 2.98Å; V405-Y408 PolarHBondContact O-N 3.19Å; H406-Y408 VanDerWaalsContact C-N 3.3Å; H406-Y408 PolarHBondContact O-N 2.86Å |
| 409 | R | 91 | Very high | 91.2 | Very high | 179 Ų | 179 | 68.8 Ų | 68.8 | 68% | 0.675 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -75.5 | -35.6 | -175.4 | -167.6 | 173.4 | -176.9 | 172.4 | 1.6 | 113.7 | V405 H406 | V405-R409 WeakPolarHBondContact O-CB 3.46Å; V405-R409 PolarHBondContact O-N 3.19Å; H406-R409 PolarHBondContact O-N 2.79Å |
| 410 | F | 90.3 | Very high | 91.2 | Very high | 99 Ų | 99 | 72.6 Ų | 72.6 | 43% | 0.434 | 35% | 0.352 | S | S | . | . | trans | -127.9 | 72.7 | -176.2 | -59.5 | -74.3 | 0 | 0 | 0 | 111.6 | H406 H412 H413 R415 | H406-F410 AromaticContact CD2-CD2 3.52Å; H406-F410 AromaticContact NE2-CD2 3.66Å; H406-F410 PolarHBondContact O-N 3.13Å; F410-H412 VanDerWaalsContact C-N 3.32Å; F410-H412 PolarHBondContact O-N 3.41Å; F410-H413 HydrophobicContact CB-CB 4.41Å; F410-H413 PolarHBondContact O-N 3.35Å; F410-R415 PolarHBondContact O-NH2 2.95Å | ||
| 411 | P | 87.9 | Confident | 91.1 | Very high | 81 Ų | 81 | 77.2 Ų | 77.2 | 53% | 0.526 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.9 | -28.9 | -175.1 | 26.1 | -34.1 | 0 | 0 | 0 | 113.7 | ||
| 412 | H | 88.4 | Confident | 91.1 | Very high | 181 Ų | 181 | 79 Ų | 79 | 84% | 0.838 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.3 | -2.1 | -176.3 | -60.7 | -63.6 | 0 | 0 | 0 | 114.8 | F410 | F410-H412 VanDerWaalsContact C-N 3.32Å; F410-H412 PolarHBondContact O-N 3.41Å |
| 413 | H | 87.3 | Confident | 91.1 | Very high | 71 Ų | 71 | 80.6 Ų | 80.6 | 33% | 0.329 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -62.9 | 130.6 | 177.1 | -168.1 | -74.1 | 0 | 0 | 0 | 109.9 | T98 F410 R415 | T98-H413 WeakPolarHBondContact CG2-ND1 3.38Å; F410-H413 HydrophobicContact CB-CB 4.41Å; F410-H413 PolarHBondContact O-N 3.35Å; H413-R415 PolarHBondContact O-N 3.34Å |
| 414 | P | 86.7 | Confident | 91.1 | Very high | 100 Ų | 100 | 80.4 Ų | 80.4 | 65% | 0.649 | 40% | 0.397 | S | S | * | . | trans | -62.3 | 131.4 | -179.7 | 25.5 | -33.7 | 0 | 0 | 0 | 110.3 | ||||
| 415 | R | 88.9 | Confident | 91.2 | Very high | 46 Ų | 46 | 81.9 Ų | 81.9 | 17% | 0.174 | 41% | 0.407 | C | S | . | . | trans | -128.5 | 98.3 | 178.1 | -64.8 | 179.5 | -162.6 | 138.6 | 11.5 | 108.6 | E94 T98 F410 H413 F417 | E94-R415 WeakPolarHBondContact OE1-CD 3.4Å; T98-R415 HydrophobicContact CG2-CG 4.36Å; F410-R415 PolarHBondContact O-NH2 2.95Å; H413-R415 PolarHBondContact O-N 3.34Å; R415-F417 PolarHBondContact O-N 2.82Å | ||
| 416 | P | 88.4 | Confident | 91.2 | Very high | 75 Ų | 75 | 82.4 Ų | 82.4 | 49% | 0.487 | 41% | 0.407 | S | S | . | . | S | Bend | trans | -60.7 | -33.8 | -179.4 | -24.7 | 34.8 | 0 | 0 | 0 | 112.9 | N259 | N259-P416 HydrophobicContact CB-CB 4.05Š|
| 417 | F | 89.9 | Confident | 91.3 | Very high | 50 Ų | 50 | 81.8 Ų | 81.8 | 22% | 0.219 | 40% | 0.404 | C | S | . | . | S | Bend | trans | -123.5 | 129.5 | 173.9 | -176.3 | -99.8 | 0 | 0 | 0 | 109.4 | L90 A93 E94 T97 P263 R415 V419 | L90-F417 HydrophobicContact CD2-CE1 4.23Å; L90-F417 HydrophobicContact CD2-CZ 3.85Å; A93-F417 HydrophobicContact CB-CD1 3.95Å; A93-F417 HydrophobicContact CB-CE1 3.86Å; E94-F417 HydrophobicContact CB-CD1 4.17Å; E94-F417 WeakPolarHBondContact CG-O 3.42Å; T97-F417 HydrophobicContact CG2-CB 4.2Å; P263-F417 HydrophobicContact CB-CD1 4.5Å; P263-F417 HydrophobicContact CB-CD2 3.8Å; P263-F417 HydrophobicContact CB-CE2 3.87Å; P263-F417 HydrophobicContact CB-CG 4.14Å; P263-F417 HydrophobicContact CB-CZ 4.24Å; P263-F417 HydrophobicContact CG-CB 4.01Å; P263-F417 HydrophobicContact CG-CD1 4.31Å; P263-F417 HydrophobicContact CG-CD2 3.85Å; P263-F417 HydrophobicContact CG-CE2 4.4Å; P263-F417 HydrophobicContact CG-CG 3.79Å; R415-F417 PolarHBondContact O-N 2.82Å; F417-V419 HydrophobicContact CD1-CG1 4.32Å; F417-V419 HydrophobicContact CE1-CG1 3.6Å; F417-V419 HydrophobicContact CZ-CG1 4.33Å |
| 418 | K | 91.2 | Very high | 91.5 | Very high | 142 Ų | 142 | 80.9 Ų | 80.9 | 62% | 0.617 | 40% | 0.402 | S | S | * | . | trans | -132 | 119.7 | -174.8 | -172.7 | -178.9 | 177.7 | -179.7 | 0 | 110.5 | E94 | E94-K418 WeakPolarHBondContact OE2-CA 3.41Š| ||
| 419 | V | 93.3 | Very high | 91.7 | Very high | 5 Ų | 5 | 75.2 Ų | 75.2 | 3% | 0.03 | 39% | 0.389 | C | S | . | . | trans | -84.8 | 147.7 | 175.4 | -57.8 | 0 | 0 | 0 | 0 | 111.9 | L90 E94 M403 R407 F417 L421 A424 | L90-V419 HydrophobicContact CB-CG1 3.77Å; L90-V419 VanDerWaalsContact O-CG1 3.28Å; L90-V419 WeakPolarHBondContact O-CG1 3.38Å; E94-V419 HydrophobicContact CB-CG1 4.48Å; E94-V419 VanDerWaalsContact OE2-CG2 3.25Å; E94-V419 WeakPolarHBondContact OE2-CG2 3.24Å; E94-V419 PolarHBondContact OE2-N 3.32Å; M403-V419 HydrophobicContact CE-CG2 4.13Å; R407-V419 PolarHBondContact NH1-O 3.13Å; R407-V419 VanDerWaalsContact NH1-O 3.09Å; R407-V419 PolarHBondContact NH2-O 3.36Å; F417-V419 HydrophobicContact CD1-CG1 4.32Å; F417-V419 HydrophobicContact CE1-CG1 3.6Å; F417-V419 HydrophobicContact CZ-CG1 4.33Å; V419-L421 PolarHBondContact O-N 3.44Å; V419-A424 HydrophobicContact CG2-CB 4.35Å | ||
| 420 | P | 94.1 | Very high | 91.8 | Very high | 79 Ų | 79 | 68.3 Ų | 68.3 | 51% | 0.513 | 37% | 0.367 | S | S | . | . | trans | -51.5 | 136.2 | 168.1 | -26.9 | 33.6 | 0 | 0 | 0 | 111.9 | V422 I423 A424 | P420-V422 PolarHBondContact O-N 2.95Å; P420-I423 HydrophobicContact CB-CD1 4.25Å; P420-I423 HydrophobicContact CB-CG1 4.25Å; P420-I423 HydrophobicContact CG-CD1 3.98Å; P420-I423 PolarHBondContact O-N 2.81Å; P420-I423 VanDerWaalsContact O-N 3.15Å; P420-A424 PolarHBondContact O-N 2.72Å | ||
| 421 | L | 92.3 | Very high | 91.8 | Very high | 99 Ų | 99 | 63.6 Ų | 63.6 | 52% | 0.518 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -59 | -36.6 | -178.9 | -171.9 | 71 | 0 | 0 | 0 | 111.9 | L404 V419 I423 A424 V425 | L404-L421 HydrophobicContact CD2-CD1 3.55Å; V419-L421 PolarHBondContact O-N 3.44Å; L421-I423 VanDerWaalsContact C-N 3.29Å; L421-I423 PolarHBondContact O-N 3.48Å; L421-A424 PolarHBondContact O-N 3.44Å; L421-V425 HydrophobicContact CG-CG2 4.23Å; L421-V425 WeakPolarHBondContact O-CG2 3.28Å; L421-V425 PolarHBondContact O-N 3.24Å |
| 422 | V | 94.3 | Very high | 92.1 | Very high | 100 Ų | 100 | 63.8 Ų | 63.8 | 61% | 0.606 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -55.4 | -43.9 | 177.7 | -172.5 | 0 | 0 | 0 | 0 | 111.3 | P420 V425 I426 | P420-V422 PolarHBondContact O-N 2.95Å; V422-V425 PolarHBondContact O-N 3.43Å; V422-I426 HydrophobicContact CG1-CD1 3.75Å; V422-I426 HydrophobicContact CG1-CG1 4.37Å; V422-I426 WeakPolarHBondContact O-CB 3.24Å; V422-I426 VanDerWaalsContact O-CG1 3.24Å; V422-I426 WeakPolarHBondContact O-CG1 3.35Å; V422-I426 PolarHBondContact O-N 3.43Å |
| 423 | I | 94.1 | Very high | 92.2 | Very high | 33 Ų | 33 | 61.1 Ų | 61.1 | 17% | 0.169 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.7 | -45.6 | 179.8 | -68.3 | 179.7 | 0 | 0 | 0 | 110.8 | F87 P420 L421 F427 | F87-I423 HydrophobicContact CB-CG2 3.63Å; F87-I423 HydrophobicContact CD1-CD1 4.38Å; F87-I423 HydrophobicContact CD1-CG1 4.44Å; F87-I423 HydrophobicContact CD1-CG2 3.75Å; F87-I423 HydrophobicContact CD2-CG2 4.36Å; F87-I423 HydrophobicContact CE1-CD1 4.29Å; F87-I423 HydrophobicContact CE1-CG1 4.39Å; F87-I423 HydrophobicContact CE1-CG2 4.5Å; F87-I423 HydrophobicContact CG-CG2 3.67Å; P420-I423 HydrophobicContact CB-CD1 4.25Å; P420-I423 HydrophobicContact CB-CG1 4.25Å; P420-I423 HydrophobicContact CG-CD1 3.98Å; P420-I423 PolarHBondContact O-N 2.81Å; P420-I423 VanDerWaalsContact O-N 3.15Å; L421-I423 VanDerWaalsContact C-N 3.29Å; L421-I423 PolarHBondContact O-N 3.48Å; I423-F427 WeakPolarHBondContact O-CB 3.44Å; I423-F427 PolarHBondContact O-N 3.47Å |
| 424 | A | 93.6 | Very high | 92.2 | Very high | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.7 | -43.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | M403 L404 V419 P420 L421 F427 T428 | M403-A424 HydrophobicContact SD-CB 4.13Å; L404-A424 HydrophobicContact CD2-CB 3.8Å; V419-A424 HydrophobicContact CG2-CB 4.35Å; P420-A424 PolarHBondContact O-N 2.72Å; L421-A424 PolarHBondContact O-N 3.44Å; A424-F427 PolarHBondContact O-N 3.25Å; A424-T428 WeakPolarHBondContact O-CB 3.3Å; A424-T428 PolarHBondContact O-N 2.94Å; A424-T428 PolarHBondContact O-OG1 3.26Å |
| 425 | V | 95.3 | Very high | 92.3 | Very high | 64 Ų | 64 | 53.9 Ų | 53.9 | 39% | 0.388 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -64.1 | -48.2 | 177.9 | 173.3 | 0 | 0 | 0 | 0 | 111.3 | L404 L421 V422 F427 T428 V429 | L404-V425 HydrophobicContact CD1-CG2 4.21Å; L404-V425 HydrophobicContact CD2-CG2 4.07Å; L421-V425 HydrophobicContact CG-CG2 4.23Å; L421-V425 WeakPolarHBondContact O-CG2 3.28Å; L421-V425 PolarHBondContact O-N 3.24Å; V422-V425 PolarHBondContact O-N 3.43Å; V425-F427 VanDerWaalsContact C-N 3.32Å; V425-F427 PolarHBondContact O-N 3.38Å; V425-T428 PolarHBondContact O-N 3.25Å; V425-V429 HydrophobicContact CG1-CG2 4.41Å; V425-V429 WeakPolarHBondContact O-CG2 3.41Å; V425-V429 PolarHBondContact O-N 3.42Å |
| 426 | I | 94.8 | Very high | 92.2 | Very high | 73 Ų | 73 | 53.5 Ų | 53.5 | 37% | 0.374 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -56.4 | -49.2 | 177.5 | -71.2 | 169.8 | 0 | 0 | 0 | 110 | F87 V422 V429 V430 | F87-I426 HydrophobicContact CD2-CG2 4.44Å; V422-I426 HydrophobicContact CG1-CD1 3.75Å; V422-I426 HydrophobicContact CG1-CG1 4.37Å; V422-I426 WeakPolarHBondContact O-CB 3.24Å; V422-I426 VanDerWaalsContact O-CG1 3.24Å; V422-I426 WeakPolarHBondContact O-CG1 3.35Å; V422-I426 PolarHBondContact O-N 3.43Å; I426-V429 PolarHBondContact O-N 3.11Å; I426-V430 HydrophobicContact CG2-CG2 4.42Å; I426-V430 WeakPolarHBondContact O-CB 3.43Å; I426-V430 VanDerWaalsContact O-CG2 3.28Å; I426-V430 WeakPolarHBondContact O-CG2 3.48Å; I426-V430 PolarHBondContact O-N 3.06Å |
| 427 | F | 94.5 | Very high | 91.9 | Very high | 2 Ų | 2 | 50.9 Ų | 50.9 | 1% | 0.009 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -64.9 | -42.6 | -178.3 | -176 | -103.5 | 0 | 0 | 0 | 112.5 | L84 F87 W245 W393 I396 T400 I423 A424 V425 V429 V430 C431 | L84-F427 VanDerWaalsContact O-CD2 3.29Å; L84-F427 WeakPolarHBondContact O-CD2 3.36Å; L84-F427 WeakPolarHBondContact O-CE2 3.38Å; F87-F427 HydrophobicContact CB-CB 4.24Å; F87-F427 HydrophobicContact CB-CD2 4.31Å; W245-F427 HydrophobicContact CH2-CE1 4.45Å; W245-F427 HydrophobicContact CH2-CZ 4.16Å; W245-F427 AromaticContact CZ2-CZ 3.89Å; W245-F427 HydrophobicContact CZ2-CZ 3.89Å; W393-F427 HydrophobicContact CZ3-CE2 4.49Å; W393-F427 HydrophobicContact CZ3-CZ 4.25Å; I396-F427 HydrophobicContact CG2-CE1 3.66Å; I396-F427 HydrophobicContact CG2-CZ 3.88Å; T400-F427 HydrophobicContact CG2-CD1 3.81Å; T400-F427 HydrophobicContact CG2-CE1 3.84Å; I423-F427 WeakPolarHBondContact O-CB 3.44Å; I423-F427 PolarHBondContact O-N 3.47Å; A424-F427 PolarHBondContact O-N 3.25Å; V425-F427 VanDerWaalsContact C-N 3.32Å; V425-F427 PolarHBondContact O-N 3.38Å; F427-V429 PolarHBondContact O-N 2.99Å; F427-V430 PolarHBondContact O-N 3.12Å; F427-C431 WeakPolarHBondContact CE1-SG 3.26Å; F427-C431 WeakPolarHBondContact CZ-SG 3.23Å; F427-C431 PolarHBondContact O-N 3.25Å; F427-C431 PolarHBondContact O-SG 2.91Å |
| 428 | T | 94.9 | Very high | 91.5 | Very high | 8 Ų | 8 | 48.6 Ų | 48.6 | 5% | 0.049 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.7 | -44.2 | 176 | -62.6 | 0 | 0 | 0 | 0 | 111.8 | T400 L401 L404 A424 V425 C431 F432 | T400-T428 WeakPolarHBondContact CB-OG1 3.43Å; T400-T428 PolarHBondContact OG1-OG1 3.03Å; L401-T428 HydrophobicContact CB-CG2 4.27Å; L404-T428 HydrophobicContact CD1-CG2 4.37Å; A424-T428 WeakPolarHBondContact O-CB 3.3Å; A424-T428 PolarHBondContact O-N 2.94Å; A424-T428 PolarHBondContact O-OG1 3.26Å; V425-T428 PolarHBondContact O-N 3.25Å; T428-C431 PolarHBondContact O-N 2.75Å; T428-F432 HydrophobicContact CG2-CD2 3.87Å; T428-F432 HydrophobicContact CG2-CE2 3.71Å; T428-F432 VanDerWaalsContact O-CD2 3.3Å; T428-F432 WeakPolarHBondContact O-CD2 3.45Å; T428-F432 PolarHBondContact O-N 2.88Å; T428-F432 VanDerWaalsContact O-N 3.07Å |
| 429 | V | 94.9 | Very high | 91.2 | Very high | 93 Ų | 93 | 45.6 Ų | 45.6 | 56% | 0.564 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -61.4 | -45.6 | 176.5 | 171.5 | 0 | 0 | 0 | 0 | 110.9 | V425 I426 F427 C431 F432 F433 | V425-V429 HydrophobicContact CG1-CG2 4.41Å; V425-V429 WeakPolarHBondContact O-CG2 3.41Å; V425-V429 PolarHBondContact O-N 3.42Å; I426-V429 PolarHBondContact O-N 3.11Å; F427-V429 PolarHBondContact O-N 2.99Å; V429-C431 VanDerWaalsContact C-N 3.35Å; V429-C431 PolarHBondContact O-N 3.19Å; V429-F432 PolarHBondContact O-N 2.87Å; V429-F433 WeakPolarHBondContact O-CB 3.25Å; V429-F433 PolarHBondContact O-N 2.91Å |
| 430 | V | 92.2 | Very high | 90.6 | Very high | 34 Ų | 34 | 54.3 Ų | 54.3 | 21% | 0.206 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61.6 | -41.5 | 177.1 | 169.3 | 0 | 0 | 0 | 0 | 111.4 | L84 I426 F427 F433 I434 | L84-V430 HydrophobicContact CD1-CG1 4.23Å; L84-V430 HydrophobicContact CD2-CG1 4.31Å; L84-V430 HydrophobicContact CD2-CG2 4.09Å; I426-V430 HydrophobicContact CG2-CG2 4.42Å; I426-V430 WeakPolarHBondContact O-CB 3.43Å; I426-V430 VanDerWaalsContact O-CG2 3.28Å; I426-V430 WeakPolarHBondContact O-CG2 3.48Å; I426-V430 PolarHBondContact O-N 3.06Å; F427-V430 PolarHBondContact O-N 3.12Å; V430-F433 WeakPolarHBondContact O-CB 3.32Å; V430-F433 PolarHBondContact O-N 2.96Å; V430-I434 HydrophobicContact CG1-CD1 3.75Å; V430-I434 HydrophobicContact CG1-CG1 4.42Å; V430-I434 WeakPolarHBondContact O-CD1 3.39Å; V430-I434 VanDerWaalsContact O-CG1 3.26Å; V430-I434 WeakPolarHBondContact O-CG1 3.28Å; V430-I434 PolarHBondContact O-N 3.25Å |
| 431 | C | 92.1 | Very high | 89.8 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.7 | -45.1 | 176.1 | -70 | 0 | 0 | 0 | 0 | 112.3 | W393 A397 F427 T428 V429 F433 I434 V435 | W393-C431 HydrophobicContact CE3-CB 4.46Å; A397-C431 HydrophobicContact CB-CB 3.69Å; F427-C431 WeakPolarHBondContact CE1-SG 3.26Å; F427-C431 WeakPolarHBondContact CZ-SG 3.23Å; F427-C431 PolarHBondContact O-N 3.25Å; F427-C431 PolarHBondContact O-SG 2.91Å; T428-C431 PolarHBondContact O-N 2.75Å; V429-C431 VanDerWaalsContact C-N 3.35Å; V429-C431 PolarHBondContact O-N 3.19Å; C431-F433 VanDerWaalsContact C-N 3.33Å; C431-F433 PolarHBondContact O-N 3.42Å; C431-I434 PolarHBondContact O-N 3.35Å; C431-V435 VanDerWaalsContact O-CG2 3.31Å; C431-V435 WeakPolarHBondContact O-CG2 3.4Å; C431-V435 PolarHBondContact O-N 3.47Å |
| 432 | F | 92.3 | Very high | 89.2 | Confident | 84 Ų | 84 | 49.6 Ų | 49.6 | 37% | 0.368 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -64.8 | -37.5 | 175.9 | -81.1 | -65.4 | 0 | 0 | 0 | 112.5 | A397 L401 T428 V429 V435 G436 | A397-F432 HydrophobicContact CB-CD1 4.07Å; A397-F432 HydrophobicContact CB-CD2 4.1Å; A397-F432 HydrophobicContact CB-CE1 3.91Å; A397-F432 HydrophobicContact CB-CE2 3.95Å; A397-F432 HydrophobicContact CB-CG 4.15Å; A397-F432 HydrophobicContact CB-CZ 3.85Å; L401-F432 HydrophobicContact CD2-CE2 4.37Å; L401-F432 HydrophobicContact CD2-CZ 4.14Å; T428-F432 HydrophobicContact CG2-CD2 3.87Å; T428-F432 HydrophobicContact CG2-CE2 3.71Å; T428-F432 VanDerWaalsContact O-CD2 3.3Å; T428-F432 WeakPolarHBondContact O-CD2 3.45Å; T428-F432 PolarHBondContact O-N 2.88Å; T428-F432 VanDerWaalsContact O-N 3.07Å; V429-F432 PolarHBondContact O-N 2.87Å; F432-V435 WeakPolarHBondContact O-CB 3.37Å; F432-V435 PolarHBondContact O-N 3.3Å; F432-G436 PolarHBondContact O-N 3.22Å |
| 433 | F | 90.6 | Very high | 88.8 | Confident | 126 Ų | 126 | 49 Ų | 49 | 55% | 0.553 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -60.7 | -44.5 | 173.7 | 178.8 | -102.5 | 0 | 0 | 0 | 111.8 | P232 V429 V430 C431 V435 G436 L437 | P232-F433 HydrophobicContact CB-CE1 4.15Å; P232-F433 HydrophobicContact CB-CZ 4.28Å; P232-F433 HydrophobicContact CG-CZ 4.25Å; V429-F433 WeakPolarHBondContact O-CB 3.25Å; V429-F433 PolarHBondContact O-N 2.91Å; V430-F433 WeakPolarHBondContact O-CB 3.32Å; V430-F433 PolarHBondContact O-N 2.96Å; C431-F433 VanDerWaalsContact C-N 3.33Å; C431-F433 PolarHBondContact O-N 3.42Å; F433-V435 VanDerWaalsContact C-N 3.32Å; F433-V435 PolarHBondContact O-N 3.5Å; F433-G436 PolarHBondContact O-N 3.3Å; F433-L437 PolarHBondContact O-N 3.04Å |
| 434 | I | 87.6 | Confident | 88.5 | Confident | 5 Ų | 5 | 56.2 Ų | 56.2 | 3% | 0.026 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -64 | -37.4 | 176.7 | -67.4 | 160.1 | 0 | 0 | 0 | 111.8 | Y236 L239 W393 V430 C431 L437 S438 | Y236-I434 HydrophobicContact CD2-CG2 4.01Å; L239-I434 HydrophobicContact CD1-CD1 3.24Å; L239-I434 HydrophobicContact CD1-CG1 4.25Å; W393-I434 HydrophobicContact CB-CG2 4.24Å; W393-I434 HydrophobicContact CD2-CD1 4.36Å; W393-I434 HydrophobicContact CD2-CG2 3.99Å; W393-I434 HydrophobicContact CE3-CD1 4.19Å; W393-I434 HydrophobicContact CG-CG2 3.7Å; W393-I434 HydrophobicContact CH2-CD1 4.4Å; W393-I434 HydrophobicContact CZ3-CD1 4.19Å; V430-I434 HydrophobicContact CG1-CD1 3.75Å; V430-I434 HydrophobicContact CG1-CG1 4.42Å; V430-I434 WeakPolarHBondContact O-CD1 3.39Å; V430-I434 VanDerWaalsContact O-CG1 3.26Å; V430-I434 WeakPolarHBondContact O-CG1 3.28Å; V430-I434 PolarHBondContact O-N 3.25Å; C431-I434 PolarHBondContact O-N 3.35Å; I434-L437 PolarHBondContact O-N 3.21Å; I434-S438 PolarHBondContact O-N 3.14Å; I434-S438 PolarHBondContact O-OG 2.91Å |
| 435 | V | 89 | Confident | 88 | Confident | 13 Ų | 13 | 57.4 Ų | 57.4 | 8% | 0.079 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -61.8 | -46 | 174 | 172 | 0 | 0 | 0 | 0 | 110.6 | F390 W393 F394 C431 F432 F433 L437 S438 L439 | F390-V435 HydrophobicContact CD2-CG1 3.98Å; F390-V435 HydrophobicContact CE2-CG1 3.66Å; W393-V435 HydrophobicContact CB-CG2 3.82Å; F394-V435 HydrophobicContact CB-CG2 4.1Å; F394-V435 HydrophobicContact CD2-CG1 4.33Å; C431-V435 VanDerWaalsContact O-CG2 3.31Å; C431-V435 WeakPolarHBondContact O-CG2 3.4Å; C431-V435 PolarHBondContact O-N 3.47Å; F432-V435 WeakPolarHBondContact O-CB 3.37Å; F432-V435 PolarHBondContact O-N 3.3Å; F433-V435 VanDerWaalsContact C-N 3.32Å; F433-V435 PolarHBondContact O-N 3.5Å; V435-L437 VanDerWaalsContact C-N 3.32Å; V435-L437 PolarHBondContact O-N 3.33Å; V435-S438 WeakPolarHBondContact O-CB 3.48Å; V435-S438 PolarHBondContact O-N 2.9Å; V435-L439 PolarHBondContact O-N 3.27Å |
| 436 | G | 86.9 | Confident | 87.4 | Confident | 39 Ų | 39 | 54.4 Ų | 54.4 | 40% | 0.402 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60.1 | -42.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | F432 F433 S438 L439 Y440 | F432-G436 PolarHBondContact O-N 3.22Å; F433-G436 PolarHBondContact O-N 3.3Å; G436-S438 VanDerWaalsContact C-N 3.34Å; G436-S438 PolarHBondContact O-N 3.41Å; G436-L439 WeakPolarHBondContact O-CB 3.42Å; G436-L439 PolarHBondContact O-N 2.85Å; G436-Y440 PolarHBondContact O-N 2.92Å |
| 437 | L | 82.8 | Confident | 87 | Confident | 19 Ų | 19 | 52.4 Ų | 52.4 | 10% | 0.099 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -65 | -36.8 | 176.1 | -175 | 71.9 | 0 | 0 | 0 | 112.9 | P232 L233 F433 I434 V435 L439 Y440 S441 | P232-L437 HydrophobicContact CB-CD1 3.54Å; P232-L437 HydrophobicContact CB-CD2 3.38Å; P232-L437 HydrophobicContact CB-CG 4.05Å; P232-L437 HydrophobicContact CG-CD1 4.42Å; P232-L437 WeakPolarHBondContact O-CD2 3.26Å; L233-L437 HydrophobicContact CD2-CD1 4.26Å; L233-L437 HydrophobicContact CD2-CD2 4.23Å; L233-L437 HydrophobicContact CD2-CG 4.2Å; F433-L437 PolarHBondContact O-N 3.04Å; I434-L437 PolarHBondContact O-N 3.21Å; V435-L437 VanDerWaalsContact C-N 3.32Å; V435-L437 PolarHBondContact O-N 3.33Å; L437-L439 PolarHBondContact O-N 2.92Å; L437-Y440 HydrophobicContact CD1-CD1 4.28Å; L437-Y440 PolarHBondContact O-N 3.37Å; L437-Y440 VanDerWaalsContact O-N 3.09Å; L437-S441 WeakPolarHBondContact O-CB 3.46Å; L437-S441 PolarHBondContact O-N 3.33Å |
| 438 | S | 81.4 | Confident | 86.6 | Confident | 2 Ų | 2 | 58.8 Ų | 58.8 | 1% | 0.014 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -62 | -35.1 | 177.3 | -55.3 | 0 | 0 | 0 | 0 | 111.3 | Y236 I434 V435 G436 D442 T446 | Y236-S438 WeakPolarHBondContact CE2-OG 3.25Å; I434-S438 PolarHBondContact O-N 3.14Å; I434-S438 PolarHBondContact O-OG 2.91Å; V435-S438 WeakPolarHBondContact O-CB 3.48Å; V435-S438 PolarHBondContact O-N 2.9Å; G436-S438 VanDerWaalsContact C-N 3.34Å; G436-S438 PolarHBondContact O-N 3.41Å; S438-D442 PolarHBondContact O-N 3.2Å; S438-T446 PolarHBondContact O-OG1 2.93Å |
| 439 | L | 83.4 | Confident | 86.1 | Confident | 79 Ų | 79 | 58.6 Ų | 58.6 | 41% | 0.414 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -68.6 | -37.8 | 173.6 | -72.5 | 161.6 | 0 | 0 | 0 | 112 | F390 V435 G436 L437 P443 T446 | F390-L439 HydrophobicContact CE2-CG 4.44Å; V435-L439 PolarHBondContact O-N 3.27Å; G436-L439 WeakPolarHBondContact O-CB 3.42Å; G436-L439 PolarHBondContact O-N 2.85Å; L437-L439 PolarHBondContact O-N 2.92Å; L439-P443 VanDerWaalsContact O-CA 3.3Å; L439-P443 WeakPolarHBondContact O-CA 3.23Å; L439-P443 WeakPolarHBondContact O-CB 3.27Å; L439-T446 HydrophobicContact CB-CG2 4.43Å; L439-T446 HydrophobicContact CD2-CG2 3.4Å; L439-T446 VanDerWaalsContact CD2-CG2 3.4Å; L439-T446 HydrophobicContact CG-CG2 3.74Å |
| 440 | Y | 82.4 | Confident | 85.8 | Confident | 189 Ų | 189 | 56.3 Ų | 56.3 | 74% | 0.741 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -71.3 | -43.3 | 177.6 | 177.3 | -102.5 | 0 | 0 | 0 | 112.7 | G436 L437 | G436-Y440 PolarHBondContact O-N 2.92Å; L437-Y440 HydrophobicContact CD1-CD1 4.28Å; L437-Y440 PolarHBondContact O-N 3.37Å; L437-Y440 VanDerWaalsContact O-N 3.09Å |
| 441 | S | 77 | Confident | 85.6 | Confident | 50 Ų | 50 | 57.2 Ų | 57.2 | 35% | 0.35 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -68.2 | -41.1 | -174.2 | -174.2 | 0 | 0 | 0 | 0 | 113.6 | L233 L437 | L233-S441 VanDerWaalsContact CD2-CB 3.49Å; L233-S441 VanDerWaalsContact CD2-OG 3.28Å; L233-S441 WeakPolarHBondContact CD2-OG 3.47Å; L437-S441 WeakPolarHBondContact O-CB 3.46Å; L437-S441 PolarHBondContact O-N 3.33Å |
| 442 | D | 79.9 | Confident | 85.3 | Confident | 29 Ų | 29 | 59.4 Ų | 59.4 | 16% | 0.155 | 31% | 0.307 | C | S | . | . | trans | -149.5 | 75.2 | -174.7 | -170.1 | -14.5 | 0 | 0 | 0 | 109.3 | N386 S438 W444 N445 T446 | N386-D442 PolarHBondContact ND2-OD2 3.42Å; S438-D442 PolarHBondContact O-N 3.2Å; D442-W444 PolarHBondContact O-N 3.28Å; D442-N445 PolarHBondContact OD1-N 3.41Å; D442-N445 PolarHBondContact OD1-ND2 3.45Å; D442-N445 PolarHBondContact OD2-ND2 2.93Å; D442-T446 WeakPolarHBondContact O-CB 3.45Å; D442-T446 PolarHBondContact O-N 3.46Å; D442-T446 PolarHBondContact O-OG1 3.36Å; D442-T446 VanDerWaalsContact O-OG1 3.05Å | ||
| 443 | P | 86.1 | Confident | 85.1 | Confident | 88 Ų | 88 | 55.8 Ų | 55.8 | 57% | 0.571 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -62.8 | -27.1 | -172.7 | 23 | -33.2 | 0 | 0 | 0 | 112.5 | L439 G447 | L439-P443 VanDerWaalsContact O-CA 3.3Å; L439-P443 WeakPolarHBondContact O-CA 3.23Å; L439-P443 WeakPolarHBondContact O-CB 3.27Å; P443-G447 VanDerWaalsContact O-CA 3.3Å; P443-G447 WeakPolarHBondContact O-CA 3.27Å; P443-G447 PolarHBondContact O-N 2.86Å |
| 444 | W | 86.3 | Confident | 85 | Confident | 184 Ų | 184 | 54.9 Ų | 54.9 | 70% | 0.697 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -73.8 | -54.5 | -178.6 | -172.5 | -109.8 | 0 | 0 | 0 | 111.9 | D442 G447 R448 | D442-W444 PolarHBondContact O-N 3.28Å; W444-G447 PolarHBondContact O-N 3.49Å; W444-R448 VanDerWaalsContact O-CG 3.31Å; W444-R448 WeakPolarHBondContact O-CG 3.37Å; W444-R448 PolarHBondContact O-N 2.96Å |
| 445 | N | 82.7 | Confident | 85.2 | Confident | 24 Ų | 24 | 57.1 Ų | 57.1 | 13% | 0.128 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -67.2 | -40.9 | 179.9 | -70.3 | -40 | 0 | 0 | 0 | 110.9 | F387 D442 R448 S449 | F387-N445 HydrophobicContact CD2-CB 4.48Å; F387-N445 VanDerWaalsContact CD2-O 3.29Å; F387-N445 WeakPolarHBondContact CD2-O 3.5Å; D442-N445 PolarHBondContact OD1-N 3.41Å; D442-N445 PolarHBondContact OD1-ND2 3.45Å; D442-N445 PolarHBondContact OD2-ND2 2.93Å; N445-R448 PolarHBondContact O-N 2.95Å; N445-S449 PolarHBondContact O-N 3.28Å |
| 446 | T | 83.1 | Confident | 85.1 | Confident | 1 Ų | 1 | 56.5 Ų | 56.5 | 1% | 0.006 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -65 | -42.4 | 175.7 | -61.6 | 0 | 0 | 0 | 0 | 111.9 | F390 S438 L439 D442 R448 S449 C450 | F390-T446 HydrophobicContact CB-CG2 3.74Å; F390-T446 HydrophobicContact CD1-CG2 4.35Å; F390-T446 HydrophobicContact CD2-CG2 3.31Å; F390-T446 HydrophobicContact CE2-CG2 3.97Å; F390-T446 HydrophobicContact CG-CG2 3.53Å; S438-T446 PolarHBondContact O-OG1 2.93Å; L439-T446 HydrophobicContact CB-CG2 4.43Å; L439-T446 HydrophobicContact CD2-CG2 3.4Å; L439-T446 VanDerWaalsContact CD2-CG2 3.4Å; L439-T446 HydrophobicContact CG-CG2 3.74Å; D442-T446 WeakPolarHBondContact O-CB 3.45Å; D442-T446 PolarHBondContact O-N 3.46Å; D442-T446 PolarHBondContact O-OG1 3.36Å; D442-T446 VanDerWaalsContact O-OG1 3.05Å; T446-R448 VanDerWaalsContact C-N 3.34Å; T446-R448 PolarHBondContact O-N 2.97Å; T446-S449 WeakPolarHBondContact O-CB 3.32Å; T446-S449 PolarHBondContact O-N 3.29Å; T446-S449 VanDerWaalsContact O-N 3.11Å; T446-C450 PolarHBondContact O-N 3.3Å |
| 447 | G | 86.3 | Confident | 85.3 | Confident | 32 Ų | 32 | 56.7 Ų | 56.7 | 33% | 0.33 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.2 | -41.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | P443 W444 C450 A451 | P443-G447 VanDerWaalsContact O-CA 3.3Å; P443-G447 WeakPolarHBondContact O-CA 3.27Å; P443-G447 PolarHBondContact O-N 2.86Å; W444-G447 PolarHBondContact O-N 3.49Å; G447-C450 PolarHBondContact O-N 3.12Å; G447-A451 WeakPolarHBondContact O-CB 3.45Å; G447-A451 PolarHBondContact O-N 2.92Å |
| 448 | R | 86.1 | Confident | 85.6 | Confident | 136 Ų | 136 | 59.4 Ų | 59.4 | 51% | 0.513 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -61.4 | -44.3 | 172.1 | -68.4 | 173.3 | 89.2 | 173.7 | 8.8 | 111.3 | F387 W444 N445 T446 C450 A451 L452 | F387-R448 HydrophobicContact CE2-CB 3.96Å; W444-R448 VanDerWaalsContact O-CG 3.31Å; W444-R448 WeakPolarHBondContact O-CG 3.37Å; W444-R448 PolarHBondContact O-N 2.96Å; N445-R448 PolarHBondContact O-N 2.95Å; T446-R448 VanDerWaalsContact C-N 3.34Å; T446-R448 PolarHBondContact O-N 2.97Å; R448-C450 VanDerWaalsContact C-N 3.32Å; R448-C450 PolarHBondContact O-N 3.19Å; R448-A451 PolarHBondContact O-N 3.5Å; R448-L452 WeakPolarHBondContact O-CB 3.45Å; R448-L452 WeakPolarHBondContact O-CD1 3.29Å; R448-L452 WeakPolarHBondContact O-CG 3.49Å; R448-L452 PolarHBondContact O-N 2.97Å |
| 449 | S | 85.1 | Confident | 85.8 | Confident | 3 Ų | 3 | 61.4 Ų | 61.4 | 2% | 0.021 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -61.2 | -41.2 | 177.8 | -163.4 | 0 | 0 | 0 | 0 | 111.6 | F387 N445 T446 T453 | F387-S449 PolarHBondContact O-OG 3.29Å; F387-S449 VanDerWaalsContact O-OG 3.04Å; N445-S449 PolarHBondContact O-N 3.28Å; T446-S449 WeakPolarHBondContact O-CB 3.32Å; T446-S449 PolarHBondContact O-N 3.29Å; T446-S449 VanDerWaalsContact O-N 3.11Å; S449-T453 PolarHBondContact O-N 3.06Å; S449-T453 PolarHBondContact O-OG1 3.28Å |
| 450 | C | 87.8 | Confident | 86 | Confident | 45 Ų | 45 | 58.5 Ų | 58.5 | 30% | 0.304 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -66.4 | -49.3 | 175.2 | -174.8 | 0 | 0 | 0 | 0 | 112.5 | F390 T446 G447 R448 L452 T453 L454 | F390-C450 HydrophobicContact CE1-CB 3.81Å; F390-C450 HydrophobicContact CZ-CB 3.88Å; T446-C450 PolarHBondContact O-N 3.3Å; G447-C450 PolarHBondContact O-N 3.12Å; R448-C450 VanDerWaalsContact C-N 3.32Å; R448-C450 PolarHBondContact O-N 3.19Å; C450-L452 VanDerWaalsContact C-N 3.28Å; C450-L452 PolarHBondContact O-N 3.45Å; C450-T453 WeakPolarHBondContact O-CA 3.32Å; C450-T453 VanDerWaalsContact O-CB 3.3Å; C450-T453 WeakPolarHBondContact O-CB 3.45Å; C450-T453 PolarHBondContact O-N 3.05Å; C450-L454 WeakPolarHBondContact O-CG 2.96Å; C450-L454 PolarHBondContact O-N 3.34Å |
| 451 | A | 88.2 | Confident | 86.2 | Confident | 53 Ų | 53 | 54 Ų | 54 | 44% | 0.438 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -57.6 | -42.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | G447 R448 T453 L454 T455 | G447-A451 WeakPolarHBondContact O-CB 3.45Å; G447-A451 PolarHBondContact O-N 2.92Å; R448-A451 PolarHBondContact O-N 3.5Å; A451-T453 VanDerWaalsContact C-N 3.31Å; A451-T453 PolarHBondContact O-N 3.4Å; A451-L454 PolarHBondContact O-N 3.09Å; A451-L454 VanDerWaalsContact O-N 3.16Å; A451-T455 WeakPolarHBondContact O-CG2 3.26Å; A451-T455 PolarHBondContact O-N 2.92Å; A451-T455 VanDerWaalsContact O-N 3.11Å |
| 452 | L | 86.1 | Confident | 86.5 | Confident | 46 Ų | 46 | 55.4 Ų | 55.4 | 24% | 0.241 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -70.4 | -27 | 177.1 | -64.8 | 167.9 | 0 | 0 | 0 | 113 | F128 I129 F387 R448 C450 T455 | F128-L452 HydrophobicContact CB-CB 4.09Å; F128-L452 HydrophobicContact CD1-CB 3.58Å; F128-L452 HydrophobicContact CD1-CD1 4.04Å; F128-L452 HydrophobicContact CD1-CD2 3.35Å; F128-L452 HydrophobicContact CD1-CG 3.8Å; F128-L452 HydrophobicContact CE1-CB 4.29Å; F128-L452 HydrophobicContact CE1-CD2 3.36Å; F128-L452 HydrophobicContact CE1-CG 4.3Å; F128-L452 HydrophobicContact CG-CB 4Å; I129-L452 HydrophobicContact CD1-CD1 3.58Å; F387-L452 HydrophobicContact CE2-CD1 4.36Å; F387-L452 HydrophobicContact CZ-CD1 3.77Å; R448-L452 WeakPolarHBondContact O-CB 3.45Å; R448-L452 WeakPolarHBondContact O-CD1 3.29Å; R448-L452 WeakPolarHBondContact O-CG 3.49Å; R448-L452 PolarHBondContact O-N 2.97Å; C450-L452 VanDerWaalsContact C-N 3.28Å; C450-L452 PolarHBondContact O-N 3.45Å; L452-T455 PolarHBondContact O-OG1 3.05Å |
| 453 | T | 88.1 | Confident | 86.4 | Confident | 9 Ų | 9 | 56.2 Ų | 56.2 | 6% | 0.055 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65.9 | -42.9 | 168.9 | -58.5 | 0 | 0 | 0 | 0 | 110.5 | L120 V124 F395 S449 C450 A451 T455 G456 | L120-T453 WeakPolarHBondContact CD2-O 3.36Å; V124-T453 HydrophobicContact CG2-CG2 3.67Å; V124-T453 VanDerWaalsContact CG2-OG1 3.31Å; V124-T453 WeakPolarHBondContact CG2-OG1 3.35Å; F395-T453 HydrophobicContact CE2-CG2 4.47Å; F395-T453 HydrophobicContact CZ-CG2 4.21Å; S449-T453 PolarHBondContact O-N 3.06Å; S449-T453 PolarHBondContact O-OG1 3.28Å; C450-T453 WeakPolarHBondContact O-CA 3.32Å; C450-T453 VanDerWaalsContact O-CB 3.3Å; C450-T453 WeakPolarHBondContact O-CB 3.45Å; C450-T453 PolarHBondContact O-N 3.05Å; A451-T453 VanDerWaalsContact C-N 3.31Å; A451-T453 PolarHBondContact O-N 3.4Å; T453-T455 VanDerWaalsContact C-N 3.32Å; T453-T455 PolarHBondContact O-N 3.12Å; T453-G456 PolarHBondContact O-N 3.06Å |
| 454 | L | 89.9 | Confident | 86 | Confident | 106 Ų | 106 | 53.9 Ų | 53.9 | 56% | 0.555 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -68.6 | -26.3 | -179.7 | -66.7 | 172.9 | 0 | 0 | 0 | 113.4 | C450 A451 G456 V457 P458 | C450-L454 WeakPolarHBondContact O-CG 2.96Å; C450-L454 PolarHBondContact O-N 3.34Å; A451-L454 PolarHBondContact O-N 3.09Å; A451-L454 VanDerWaalsContact O-N 3.16Å; L454-G456 PolarHBondContact O-N 3.24Å; L454-G456 VanDerWaalsContact O-N 3.15Å; L454-V457 WeakPolarHBondContact O-CB 3.35Å; L454-V457 PolarHBondContact O-N 2.67Å; L454-P458 VanDerWaalsContact O-CD 3.27Å; L454-P458 WeakPolarHBondContact O-CD 3.4Å |
| 455 | T | 90.9 | Very high | 85.4 | Confident | 52 Ų | 52 | 51 Ų | 51 | 32% | 0.319 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.5 | -18.8 | 173.7 | 66.8 | 0 | 0 | 0 | 0 | 113.2 | W123 A451 L452 T453 V457 P458 V459 | W123-T455 PolarHBondContact NE1-OG1 2.79Å; A451-T455 WeakPolarHBondContact O-CG2 3.26Å; A451-T455 PolarHBondContact O-N 2.92Å; A451-T455 VanDerWaalsContact O-N 3.11Å; L452-T455 PolarHBondContact O-OG1 3.05Å; T453-T455 VanDerWaalsContact C-N 3.32Å; T453-T455 PolarHBondContact O-N 3.12Å; T455-V457 VanDerWaalsContact C-N 3.29Å; T455-V457 PolarHBondContact O-N 3.45Å; T455-P458 VanDerWaalsContact O-CD 3.24Å; T455-P458 WeakPolarHBondContact O-CD 3Å; T455-P458 VanDerWaalsContact O-CG 3.26Å; T455-P458 WeakPolarHBondContact O-CG 3.46Å; T455-V459 WeakPolarHBondContact O-CG2 3.39Å |
| 456 | G | 87.1 | Confident | 84.4 | Confident | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -69.6 | -25.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | F119 W123 T453 L454 V459 Y460 | F119-G456 WeakPolarHBondContact CE1-O 3.43Å; W123-G456 VanDerWaalsContact CD1-CA 3.41Å; W123-G456 VanDerWaalsContact NE1-CA 3.28Å; W123-G456 VanDerWaalsContact NE1-N 3.19Å; T453-G456 PolarHBondContact O-N 3.06Å; L454-G456 PolarHBondContact O-N 3.24Å; L454-G456 VanDerWaalsContact O-N 3.15Å; G456-V459 PolarHBondContact O-N 2.59Å; G456-Y460 WeakPolarHBondContact O-CB 3.39Å; G456-Y460 PolarHBondContact O-N 3.49Å |
| 457 | V | 90 | Very high | 83.5 | Confident | 43 Ų | 43 | 64.6 Ų | 64.6 | 26% | 0.261 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63.9 | -54.8 | -179.8 | -179.4 | 0 | 0 | 0 | 0 | 112.2 | L120 L454 T455 V459 Y460 F461 | L120-V457 HydrophobicContact CD1-CG2 4.17Å; L120-V457 HydrophobicContact CD2-CG2 3.88Å; L454-V457 WeakPolarHBondContact O-CB 3.35Å; L454-V457 PolarHBondContact O-N 2.67Å; T455-V457 VanDerWaalsContact C-N 3.29Å; T455-V457 PolarHBondContact O-N 3.45Å; V457-V459 VanDerWaalsContact C-N 3.26Å; V457-V459 PolarHBondContact O-N 3.02Å; V457-Y460 WeakPolarHBondContact O-CB 3.17Å; V457-Y460 PolarHBondContact O-N 3.38Å; V457-F461 HydrophobicContact CG1-CD2 3.95Å; V457-F461 HydrophobicContact CG1-CE2 3.76Å; V457-F461 VanDerWaalsContact O-CD2 3.26Å; V457-F461 WeakPolarHBondContact O-CD2 3.5Å; V457-F461 PolarHBondContact O-N 3.24Å |
| 458 | P | 89.5 | Confident | 82.2 | Confident | 76 Ų | 76 | 71.5 Ų | 71.5 | 49% | 0.494 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61.8 | -37 | 178.5 | 23.9 | -34.1 | 0 | 0 | 0 | 111.7 | L454 T455 F461 V462 | L454-P458 VanDerWaalsContact O-CD 3.27Å; L454-P458 WeakPolarHBondContact O-CD 3.4Å; T455-P458 VanDerWaalsContact O-CD 3.24Å; T455-P458 WeakPolarHBondContact O-CD 3Å; T455-P458 VanDerWaalsContact O-CG 3.26Å; T455-P458 WeakPolarHBondContact O-CG 3.46Å; P458-F461 PolarHBondContact O-N 3.28Å; P458-V462 WeakPolarHBondContact O-CG2 3.43Å; P458-V462 PolarHBondContact O-N 3.31Å; P458-V462 VanDerWaalsContact O-N 3.11Å |
| 459 | V | 86.4 | Confident | 81.3 | Confident | 44 Ų | 44 | 67.2 Ų | 67.2 | 27% | 0.267 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -65.3 | -44.8 | 178.6 | -179.1 | 0 | 0 | 0 | 0 | 110.9 | F119 W123 T455 G456 V457 F461 V462 T463 | F119-V459 HydrophobicContact CZ-CG1 4.16Å; W123-V459 HydrophobicContact CE3-CG1 4.37Å; W123-V459 HydrophobicContact CH2-CB 3.8Å; W123-V459 HydrophobicContact CH2-CG1 3.62Å; W123-V459 HydrophobicContact CH2-CG2 3.56Å; W123-V459 HydrophobicContact CZ2-CB 4.15Å; W123-V459 HydrophobicContact CZ2-CG1 4.46Å; W123-V459 HydrophobicContact CZ2-CG2 3.73Å; W123-V459 HydrophobicContact CZ3-CB 4.02Å; W123-V459 HydrophobicContact CZ3-CG1 3.52Å; W123-V459 HydrophobicContact CZ3-CG2 4.29Å; T455-V459 WeakPolarHBondContact O-CG2 3.39Å; G456-V459 PolarHBondContact O-N 2.59Å; V457-V459 VanDerWaalsContact C-N 3.26Å; V457-V459 PolarHBondContact O-N 3.02Å; V459-F461 VanDerWaalsContact C-N 3.3Å; V459-F461 PolarHBondContact O-N 2.94Å; V459-V462 PolarHBondContact O-N 2.95Å; V459-V462 VanDerWaalsContact O-N 3.12Å; V459-T463 HydrophobicContact CG1-CG2 3.85Å; V459-T463 PolarHBondContact O-N 3.03Å; V459-T463 PolarHBondContact O-OG1 3.39Å |
| 460 | Y | 86.6 | Confident | 81 | Confident | 19 Ų | 19 | 71.1 Ų | 71.1 | 8% | 0.075 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -54.2 | -45.5 | 175 | 176.4 | -101.6 | 0 | 0 | 0 | 112.6 | P115 L116 F119 G456 V457 V462 V464 H465 | P115-Y460 HydrophobicContact CB-CE2 4.47Å; P115-Y460 WeakPolarHBondContact CB-OH 3.46Å; P115-Y460 WeakPolarHBondContact CG-OH 3.42Å; L116-Y460 HydrophobicContact CB-CD1 4.4Å; L116-Y460 HydrophobicContact CB-CE1 4.03Å; L116-Y460 HydrophobicContact CD1-CD1 3.41Å; L116-Y460 VanDerWaalsContact CD1-CD1 3.41Å; L116-Y460 HydrophobicContact CD1-CE1 3.91Å; L116-Y460 HydrophobicContact CD1-CG 3.77Å; F119-Y460 HydrophobicContact CB-CD2 3.49Å; F119-Y460 VanDerWaalsContact CB-CD2 3.49Å; F119-Y460 HydrophobicContact CB-CE2 3.93Å; F119-Y460 HydrophobicContact CB-CG 4.41Å; F119-Y460 AromaticContact CD1-CD2 3.86Å; F119-Y460 HydrophobicContact CD1-CD2 3.86Å; F119-Y460 HydrophobicContact CD1-CG 4.17Å; F119-Y460 AromaticContact CD2-CD2 3.87Å; F119-Y460 HydrophobicContact CD2-CD2 3.87Å; F119-Y460 AromaticContact CG-CD2 3.46Å; F119-Y460 HydrophobicContact CG-CD2 3.46Å; F119-Y460 VanDerWaalsContact CG-CD2 3.46Å; F119-Y460 HydrophobicContact CG-CE2 4.32Å; F119-Y460 HydrophobicContact CG-CG 4.22Å; G456-Y460 WeakPolarHBondContact O-CB 3.39Å; G456-Y460 PolarHBondContact O-N 3.49Å; V457-Y460 WeakPolarHBondContact O-CB 3.17Å; V457-Y460 PolarHBondContact O-N 3.38Å; Y460-V462 VanDerWaalsContact C-N 3.33Å; Y460-V462 PolarHBondContact O-N 3.4Å; Y460-V464 HydrophobicContact CD2-CB 3.78Å; Y460-V464 HydrophobicContact CD2-CG1 4.26Å; Y460-V464 HydrophobicContact CD2-CG2 3.87Å; Y460-V464 HydrophobicContact CE2-CB 3.71Å; Y460-V464 HydrophobicContact CE2-CG1 3.67Å; Y460-V464 HydrophobicContact CE2-CG2 4.1Å; Y460-V464 WeakPolarHBondContact O-CA 3.43Å; Y460-V464 WeakPolarHBondContact O-CB 3.48Å; Y460-V464 PolarHBondContact O-N 2.91Å; Y460-H465 HydrophobicContact CE1-CB 4.45Å; Y460-H465 PolarHBondContact O-N 3.44Å; Y460-H465 VanDerWaalsContact O-N 3.09Å |
| 461 | F | 86.7 | Confident | 80.3 | Confident | 94 Ų | 94 | 76.5 Ų | 76.5 | 41% | 0.412 | 39% | 0.39 | S | S | . | . | I | π-helix | trans | -67.3 | -34.3 | 179.8 | -79.8 | -69 | 0 | 0 | 0 | 112.9 | V457 P458 V459 H465 R466 | V457-F461 HydrophobicContact CG1-CD2 3.95Å; V457-F461 HydrophobicContact CG1-CE2 3.76Å; V457-F461 VanDerWaalsContact O-CD2 3.26Å; V457-F461 WeakPolarHBondContact O-CD2 3.5Å; V457-F461 PolarHBondContact O-N 3.24Å; P458-F461 PolarHBondContact O-N 3.28Å; V459-F461 VanDerWaalsContact C-N 3.3Å; V459-F461 PolarHBondContact O-N 2.94Å; F461-H465 HydrophobicContact CD1-CB 3.92Å; F461-H465 AromaticContact CD1-CD2 3.85Å; F461-R466 WeakPolarHBondContact O-CB 3.09Å; F461-R466 PolarHBondContact O-N 3.21Å |
| 462 | V | 83.8 | Confident | 79.9 | Confident | 79 Ų | 79 | 84.4 Ų | 84.4 | 48% | 0.479 | 41% | 0.408 | S | S | . | . | I | π-helix | trans | -75.5 | -45.2 | 178.6 | 172.2 | 0 | 0 | 0 | 0 | 111.9 | P458 V459 Y460 F467 R468 | P458-V462 WeakPolarHBondContact O-CG2 3.43Å; P458-V462 PolarHBondContact O-N 3.31Å; P458-V462 VanDerWaalsContact O-N 3.11Å; V459-V462 PolarHBondContact O-N 2.95Å; V459-V462 VanDerWaalsContact O-N 3.12Å; Y460-V462 VanDerWaalsContact C-N 3.33Å; Y460-V462 PolarHBondContact O-N 3.4Å; V462-F467 PolarHBondContact O-N 2.96Å; V462-R468 PolarHBondContact O-N 3.43Å |
| 463 | T | 78.1 | Confident | 79.5 | Confident | 46 Ų | 46 | 87.6 Ų | 87.6 | 28% | 0.282 | 43% | 0.425 | S | S | . | . | I | π-helix | trans | -91.1 | -42.1 | -170.5 | 60.9 | 0 | 0 | 0 | 0 | 113.2 | V459 F467 | V459-T463 HydrophobicContact CG1-CG2 3.85Å; V459-T463 PolarHBondContact O-N 3.03Å; V459-T463 PolarHBondContact O-OG1 3.39Å; T463-F467 WeakPolarHBondContact O-CD2 3.38Å; T463-F467 WeakPolarHBondContact O-CE2 3.38Å |
| 464 | V | 77.4 | Confident | 78.9 | Confident | 40 Ų | 40 | 89.3 Ų | 89.3 | 24% | 0.242 | 44% | 0.436 | C | S | . | . | I | π-helix | trans | -98.7 | -49.7 | -174 | -176.7 | 0 | 0 | 0 | 0 | 111.4 | F119 Y460 | F119-V464 HydrophobicContact CD2-CG2 4Å; F119-V464 HydrophobicContact CE2-CG2 4.03Å; Y460-V464 HydrophobicContact CD2-CB 3.78Å; Y460-V464 HydrophobicContact CD2-CG1 4.26Å; Y460-V464 HydrophobicContact CD2-CG2 3.87Å; Y460-V464 HydrophobicContact CE2-CB 3.71Å; Y460-V464 HydrophobicContact CE2-CG1 3.67Å; Y460-V464 HydrophobicContact CE2-CG2 4.1Å; Y460-V464 WeakPolarHBondContact O-CA 3.43Å; Y460-V464 WeakPolarHBondContact O-CB 3.48Å; Y460-V464 PolarHBondContact O-N 2.91Å |
| 465 | H | 74.6 | Confident | 78.5 | Confident | 122 Ų | 122 | 90.1 Ų | 90.1 | 57% | 0.565 | 44% | 0.436 | S | S | * | . | I | π-helix | trans | -80.2 | -38.1 | -171.6 | -168.5 | 66.3 | 0 | 0 | 0 | 114.2 | Y460 F461 | Y460-H465 HydrophobicContact CE1-CB 4.45Å; Y460-H465 PolarHBondContact O-N 3.44Å; Y460-H465 VanDerWaalsContact O-N 3.09Å; F461-H465 HydrophobicContact CD1-CB 3.92Å; F461-H465 AromaticContact CD1-CD2 3.85Å |
| 466 | R | 61.6 | Low | 78.1 | Confident | 160 Ų | 160 | 91.8 Ų | 91.8 | 60% | 0.604 | 45% | 0.446 | S | S | * | . | S | Bend | trans | -112 | -2.8 | -178.3 | -75.7 | -168.9 | 171.4 | 175.7 | -0.6 | 115.5 | F461 R468 | F461-R466 WeakPolarHBondContact O-CB 3.09Å; F461-R466 PolarHBondContact O-N 3.21Å; R466-R468 HydrophobicContact CB-CG 4.41Å; R466-R468 WeakPolarHBondContact O-CG 3.48Å; R466-R468 PolarHBondContact O-N 3.2Å |
| 467 | F | 63.3 | Low | 77.9 | Confident | 151 Ų | 151 | 95.8 Ų | 95.8 | 66% | 0.662 | 46% | 0.464 | S | S | * | . | trans | 28.5 | 52.7 | -177.9 | -138.3 | -85.6 | 0 | 0 | 0 | 114.2 | V462 T463 V469 | V462-F467 PolarHBondContact O-N 2.96Å; T463-F467 WeakPolarHBondContact O-CD2 3.38Å; T463-F467 WeakPolarHBondContact O-CE2 3.38Å; F467-V469 PolarHBondContact O-N 3.45Å | ||
| 468 | R | 59.7 | Low | 77.5 | Confident | 177 Ų | 177 | 98.3 Ų | 98.3 | 67% | 0.668 | 48% | 0.476 | S | S | * | . | trans | -100 | 51.8 | -179.6 | -76.1 | -173.2 | -165.1 | 177.2 | 1.1 | 110.8 | V462 R466 | V462-R468 PolarHBondContact O-N 3.43Å; R466-R468 HydrophobicContact CB-CG 4.41Å; R466-R468 WeakPolarHBondContact O-CG 3.48Å; R466-R468 PolarHBondContact O-N 3.2Å | ||
| 469 | V | 66.8 | Low | 77.3 | Confident | 47 Ų | 47 | 101.4 Ų | 101.4 | 29% | 0.285 | 48% | 0.479 | S | S | . | . | trans | -84 | 126.4 | 175 | -172.6 | 0 | 0 | 0 | 0 | 108.7 | F467 H471 L473 | F467-V469 PolarHBondContact O-N 3.45Å; V469-H471 PolarHBondContact O-N 3.42Å; V469-L473 HydrophobicContact CG1-CB 4Å; V469-L473 HydrophobicContact CG1-CD2 3.78Å; V469-L473 HydrophobicContact CG1-CG 4.49Å | ||
| 470 | P | 77.8 | Confident | 77.3 | Confident | 85 Ų | 85 | 102.3 Ų | 102.3 | 55% | 0.552 | 49% | 0.486 | S | S | * | . | trans | -57.5 | 137.7 | 179.2 | -22.4 | 31.1 | 0 | 0 | 0 | 111.6 | R472 L473 T474 | P470-R472 PolarHBondContact O-N 2.97Å; P470-R472 VanDerWaalsContact O-N 3.07Å; P470-L473 HydrophobicContact CB-CB 4.49Å; P470-L473 WeakPolarHBondContact O-CB 3.26Å; P470-L473 PolarHBondContact O-N 3.36Å; P470-T474 PolarHBondContact O-N 3.02Å; P470-T474 VanDerWaalsContact O-N 3.12Å; P470-T474 PolarHBondContact O-OG1 3.15Å | ||
| 471 | H | 73.6 | Confident | 77.1 | Confident | 157 Ų | 157 | 101.9 Ų | 101.9 | 73% | 0.727 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -52.7 | -36.4 | -176.9 | -173.6 | -74.7 | 0 | 0 | 0 | 113.5 | V469 T474 H475 | V469-H471 PolarHBondContact O-N 3.42Å; H471-T474 PolarHBondContact O-N 3.23Å; H471-H475 WeakPolarHBondContact O-CB 3.25Å; H471-H475 PolarHBondContact O-N 3.04Å |
| 472 | R | 79.5 | Confident | 77 | Confident | 220 Ų | 220 | 103.5 Ų | 103.5 | 83% | 0.83 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62 | -44.1 | 175.7 | -69.4 | -171.9 | 178.4 | 179.9 | 0.1 | 112.2 | P470 H475 T476 | P470-R472 PolarHBondContact O-N 2.97Å; P470-R472 VanDerWaalsContact O-N 3.07Å; R472-H475 PolarHBondContact O-N 3.32Å; R472-T476 PolarHBondContact O-N 2.94Å; R472-T476 PolarHBondContact O-OG1 3.26Å; R472-T476 VanDerWaalsContact O-OG1 3.06Å |
| 473 | L | 77.3 | Confident | 77.1 | Confident | 112 Ų | 112 | 104 Ų | 104 | 59% | 0.586 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -66.3 | -42.3 | -179.9 | -150.7 | 90.3 | 0 | 0 | 0 | 110.6 | V469 P470 H475 T476 F477 | V469-L473 HydrophobicContact CG1-CB 4Å; V469-L473 HydrophobicContact CG1-CD2 3.78Å; V469-L473 HydrophobicContact CG1-CG 4.49Å; P470-L473 HydrophobicContact CB-CB 4.49Å; P470-L473 WeakPolarHBondContact O-CB 3.26Å; P470-L473 PolarHBondContact O-N 3.36Å; L473-H475 VanDerWaalsContact C-N 3.35Å; L473-H475 PolarHBondContact O-N 3.19Å; L473-T476 PolarHBondContact O-N 3.43Å; L473-F477 WeakPolarHBondContact O-CB 3.35Å; L473-F477 PolarHBondContact O-N 2.89Å |
| 474 | T | 77.1 | Confident | 77.5 | Confident | 46 Ų | 46 | 105.5 Ų | 105.5 | 28% | 0.282 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.7 | -41.2 | 175.8 | -46.1 | 0 | 0 | 0 | 0 | 111.5 | P470 H471 F477 N478 | P470-T474 PolarHBondContact O-N 3.02Å; P470-T474 VanDerWaalsContact O-N 3.12Å; P470-T474 PolarHBondContact O-OG1 3.15Å; H471-T474 PolarHBondContact O-N 3.23Å; T474-F477 PolarHBondContact O-N 3.45Å; T474-N478 VanDerWaalsContact O-CB 3.3Å; T474-N478 WeakPolarHBondContact O-CB 3.32Å; T474-N478 PolarHBondContact O-N 2.99Å; T474-N478 PolarHBondContact O-ND2 3.41Å |
| 475 | H | 79.9 | Confident | 77.8 | Confident | 123 Ų | 123 | 106.6 Ų | 106.6 | 57% | 0.569 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.8 | -46.1 | 177.5 | -170.7 | -84 | 0 | 0 | 0 | 112.1 | H471 R472 L473 F477 N478 Y479 | H471-H475 WeakPolarHBondContact O-CB 3.25Å; H471-H475 PolarHBondContact O-N 3.04Å; R472-H475 PolarHBondContact O-N 3.32Å; L473-H475 VanDerWaalsContact C-N 3.35Å; L473-H475 PolarHBondContact O-N 3.19Å; H475-F477 VanDerWaalsContact C-N 3.34Å; H475-F477 PolarHBondContact O-N 3.05Å; H475-N478 PolarHBondContact O-N 3.1Å; H475-Y479 WeakPolarHBondContact O-CB 3.42Å; H475-Y479 PolarHBondContact O-N 3.23Å |
| 476 | T | 82.7 | Confident | 78.3 | Confident | 86 Ų | 86 | 106 Ų | 106 | 53% | 0.528 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.7 | -43.7 | 174.9 | -55.1 | 0 | 0 | 0 | 0 | 111.2 | R472 L473 N478 Y479 C480 | R472-T476 PolarHBondContact O-N 2.94Å; R472-T476 PolarHBondContact O-OG1 3.26Å; R472-T476 VanDerWaalsContact O-OG1 3.06Å; L473-T476 PolarHBondContact O-N 3.43Å; T476-N478 PolarHBondContact O-N 3.42Å; T476-Y479 PolarHBondContact O-N 3.44Å; T476-C480 PolarHBondContact O-N 3.03Å; T476-C480 PolarHBondContact O-SG 3.25Å; T476-C480 VanDerWaalsContact O-SG 3.38Å |
| 477 | F | 82.6 | Confident | 79.5 | Confident | 85 Ų | 85 | 105 Ų | 105 | 37% | 0.373 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.6 | -43.7 | 178.2 | -174.2 | -91.7 | 0 | 0 | 0 | 112.2 | P348 I350 L473 T474 H475 C480 S481 | P348-F477 HydrophobicContact CB-CE1 3.6Å; P348-F477 HydrophobicContact CB-CE2 4.28Å; P348-F477 HydrophobicContact CB-CZ 3.24Å; P348-F477 HydrophobicContact CG-CE1 4.25Å; P348-F477 HydrophobicContact CG-CE2 4.23Å; P348-F477 HydrophobicContact CG-CZ 3.63Å; I350-F477 HydrophobicContact CG2-CZ 4.5Å; L473-F477 WeakPolarHBondContact O-CB 3.35Å; L473-F477 PolarHBondContact O-N 2.89Å; T474-F477 PolarHBondContact O-N 3.45Å; H475-F477 VanDerWaalsContact C-N 3.34Å; H475-F477 PolarHBondContact O-N 3.05Å; F477-C480 PolarHBondContact O-N 3.3Å; F477-S481 WeakPolarHBondContact CE1-OG 3.49Å; F477-S481 VanDerWaalsContact O-CB 3.26Å; F477-S481 WeakPolarHBondContact O-CB 3.49Å; F477-S481 PolarHBondContact O-N 2.88Å; F477-S481 PolarHBondContact O-OG 2.81Å |
| 478 | N | 82.9 | Confident | 80.5 | Confident | 96 Ų | 96 | 98.9 Ų | 98.9 | 51% | 0.513 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65.7 | -39.6 | 176.8 | -72.8 | -12.7 | 0 | 0 | 0 | 111.6 | T474 H475 T476 S481 K482 | T474-N478 VanDerWaalsContact O-CB 3.3Å; T474-N478 WeakPolarHBondContact O-CB 3.32Å; T474-N478 PolarHBondContact O-N 2.99Å; T474-N478 PolarHBondContact O-ND2 3.41Å; H475-N478 PolarHBondContact O-N 3.1Å; T476-N478 PolarHBondContact O-N 3.42Å; N478-S481 PolarHBondContact O-N 3.18Å; N478-K482 WeakPolarHBondContact O-CB 3.47Å; N478-K482 PolarHBondContact O-N 3.3Å |
| 479 | Y | 85.4 | Confident | 81.7 | Confident | 141 Ų | 141 | 94.5 Ų | 94.5 | 55% | 0.553 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -61.9 | -51.7 | 174.5 | 179.4 | -93.4 | 0 | 0 | 0 | 111.6 | H475 T476 S481 K482 Q483 | H475-Y479 WeakPolarHBondContact O-CB 3.42Å; H475-Y479 PolarHBondContact O-N 3.23Å; T476-Y479 PolarHBondContact O-N 3.44Å; Y479-S481 VanDerWaalsContact C-N 3.3Å; Y479-S481 PolarHBondContact O-N 3.47Å; Y479-K482 PolarHBondContact O-N 2.97Å; Y479-Q483 HydrophobicContact CD1-CG 4.35Å; Y479-Q483 HydrophobicContact CE1-CG 3.95Å; Y479-Q483 WeakPolarHBondContact O-CG 3.08Å; Y479-Q483 PolarHBondContact O-N 3.07Å |
| 480 | C | 85.4 | Confident | 82.5 | Confident | 62 Ų | 62 | 92.9 Ų | 92.9 | 42% | 0.419 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -59.5 | -41.3 | 176.1 | -70 | 0 | 0 | 0 | 0 | 111.8 | T476 F477 K482 Q483 L484 | T476-C480 PolarHBondContact O-N 3.03Å; T476-C480 PolarHBondContact O-SG 3.25Å; T476-C480 VanDerWaalsContact O-SG 3.38Å; F477-C480 PolarHBondContact O-N 3.3Å; C480-K482 VanDerWaalsContact C-N 3.34Å; C480-K482 PolarHBondContact O-N 3.2Å; C480-Q483 PolarHBondContact O-N 3.45Å; C480-L484 WeakPolarHBondContact O-CB 3.34Å; C480-L484 PolarHBondContact O-N 3.49Å |
| 481 | S | 83.4 | Confident | 82.6 | Confident | 10 Ų | 10 | 91.1 Ų | 91.1 | 7% | 0.07 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -62.6 | -41.4 | 177.8 | -63.9 | 0 | 0 | 0 | 0 | 111.7 | F477 N478 Y479 L484 Q485 | F477-S481 WeakPolarHBondContact CE1-OG 3.49Å; F477-S481 VanDerWaalsContact O-CB 3.26Å; F477-S481 WeakPolarHBondContact O-CB 3.49Å; F477-S481 PolarHBondContact O-N 2.88Å; F477-S481 PolarHBondContact O-OG 2.81Å; N478-S481 PolarHBondContact O-N 3.18Å; Y479-S481 VanDerWaalsContact C-N 3.3Å; Y479-S481 PolarHBondContact O-N 3.47Å; S481-L484 PolarHBondContact O-N 3.23Å; S481-Q485 WeakPolarHBondContact O-CB 3.37Å; S481-Q485 WeakPolarHBondContact O-CG 3.49Å; S481-Q485 PolarHBondContact O-N 2.67Å |
| 482 | K | 84.1 | Confident | 82.6 | Confident | 129 Ų | 129 | 89.4 Ų | 89.4 | 56% | 0.561 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -65.5 | -39.7 | 176.2 | -170.3 | 175.7 | -179.5 | 178.3 | 0 | 112.1 | N478 Y479 C480 Q485 I486 | N478-K482 WeakPolarHBondContact O-CB 3.47Å; N478-K482 PolarHBondContact O-N 3.3Å; Y479-K482 PolarHBondContact O-N 2.97Å; C480-K482 VanDerWaalsContact C-N 3.34Å; C480-K482 PolarHBondContact O-N 3.2Å; K482-Q485 WeakPolarHBondContact O-CB 3.45Å; K482-Q485 PolarHBondContact O-N 3Å; K482-I486 HydrophobicContact CG-CD1 4.36Å; K482-I486 WeakPolarHBondContact O-CG1 3.35Å; K482-I486 PolarHBondContact O-N 3.01Å; K482-I486 VanDerWaalsContact O-N 3.12Å |
| 483 | Q | 86.8 | Confident | 82 | Confident | 90 Ų | 90 | 80.5 Ų | 80.5 | 42% | 0.421 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -64.8 | -44.3 | 175.2 | -67.5 | -60.5 | -24 | 0 | 0 | 111.9 | Y479 C480 Q485 I486 L487 | Y479-Q483 HydrophobicContact CD1-CG 4.35Å; Y479-Q483 HydrophobicContact CE1-CG 3.95Å; Y479-Q483 WeakPolarHBondContact O-CG 3.08Å; Y479-Q483 PolarHBondContact O-N 3.07Å; C480-Q483 PolarHBondContact O-N 3.45Å; Q483-Q485 VanDerWaalsContact C-N 3.31Å; Q483-Q485 PolarHBondContact O-N 3.18Å; Q483-I486 PolarHBondContact O-N 2.89Å; Q483-L487 WeakPolarHBondContact O-CB 3.47Å; Q483-L487 PolarHBondContact O-N 3.34Å |
| 484 | L | 85.1 | Confident | 80.9 | Confident | 77 Ų | 77 | 80.5 Ų | 80.5 | 40% | 0.403 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -63.5 | -36.6 | 175 | -81.3 | 155.4 | 0 | 0 | 0 | 112.2 | I350 C480 S481 L487 L488 | I350-L484 HydrophobicContact CD1-CB 3.45Å; I350-L484 VanDerWaalsContact CD1-CB 3.45Å; I350-L484 HydrophobicContact CD1-CD1 3.91Å; I350-L484 HydrophobicContact CD1-CG 4.28Å; C480-L484 WeakPolarHBondContact O-CB 3.34Å; C480-L484 PolarHBondContact O-N 3.49Å; S481-L484 PolarHBondContact O-N 3.23Å; L484-L487 PolarHBondContact O-N 3.46Å; L484-L488 HydrophobicContact CD2-CD1 4.19Å; L484-L488 VanDerWaalsContact O-CB 3.24Å; L484-L488 WeakPolarHBondContact O-CB 3.47Å; L484-L488 VanDerWaalsContact O-CG 3.26Å; L484-L488 WeakPolarHBondContact O-CG 3.41Å; L484-L488 PolarHBondContact O-N 3.49Å |
| 485 | Q | 85.1 | Confident | 79.5 | Confident | 62 Ų | 62 | 84.7 Ų | 84.7 | 29% | 0.29 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -60.7 | -46.6 | 175.1 | -78.8 | 163.6 | 17.7 | 0 | 0 | 112.3 | M353 S481 K482 Q483 E489 V490 | M353-Q485 HydrophobicContact CE-CG 4.22Å; M353-Q485 HydrophobicContact SD-CG 3.47Å; M353-Q485 WeakPolarHBondContact SD-CG 3.37Å; M353-Q485 PolarHBondContact SD-NE2 3.21Å; M353-Q485 VanDerWaalsContact SD-NE2 3.42Å; S481-Q485 WeakPolarHBondContact O-CB 3.37Å; S481-Q485 WeakPolarHBondContact O-CG 3.49Å; S481-Q485 PolarHBondContact O-N 2.67Å; K482-Q485 WeakPolarHBondContact O-CB 3.45Å; K482-Q485 PolarHBondContact O-N 3Å; Q483-Q485 VanDerWaalsContact C-N 3.31Å; Q483-Q485 PolarHBondContact O-N 3.18Å; Q485-E489 PolarHBondContact O-N 3.1Å; Q485-E489 VanDerWaalsContact O-N 3.09Å; Q485-V490 HydrophobicContact CB-CG2 4.33Å; Q485-V490 HydrophobicContact CG-CG2 4.09Å; Q485-V490 PolarHBondContact O-N 3.2Å |
| 486 | I | 84.9 | Confident | 79.4 | Confident | 111 Ų | 111 | 82.8 Ų | 82.8 | 57% | 0.569 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -65.8 | -45.9 | 178.4 | -64.7 | 165 | 0 | 0 | 0 | 110 | K482 Q483 L488 E489 | K482-I486 HydrophobicContact CG-CD1 4.36Å; K482-I486 WeakPolarHBondContact O-CG1 3.35Å; K482-I486 PolarHBondContact O-N 3.01Å; K482-I486 VanDerWaalsContact O-N 3.12Å; Q483-I486 PolarHBondContact O-N 2.89Å; I486-L488 VanDerWaalsContact C-N 3.35Å; I486-L488 PolarHBondContact O-N 3.48Å; I486-E489 PolarHBondContact O-N 2.93Å |
| 487 | L | 87.2 | Confident | 79.3 | Confident | 137 Ų | 137 | 82.6 Ų | 82.6 | 72% | 0.717 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -62.8 | -39.8 | -179 | -177.4 | 68.1 | 0 | 0 | 0 | 112.8 | Q483 L484 | Q483-L487 WeakPolarHBondContact O-CB 3.47Å; Q483-L487 PolarHBondContact O-N 3.34Å; L484-L487 PolarHBondContact O-N 3.46Å |
| 488 | L | 84 | Confident | 79.1 | Confident | 24 Ų | 24 | 82.4 Ų | 82.4 | 13% | 0.126 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -94.1 | -0.6 | -174.2 | -61.4 | 176.2 | 0 | 0 | 0 | 113.4 | H355 L362 P363 L366 L484 I486 V490 | H355-L488 PolarHBondContact CD2-O 2.93Å; L362-L488 HydrophobicContact CD2-CB 4.19Å; L362-L488 HydrophobicContact CD2-CD2 3.86Å; L362-L488 HydrophobicContact CG-CD2 4.45Å; P363-L488 HydrophobicContact CB-CD1 4.33Å; P363-L488 HydrophobicContact CG-CD1 4.01Å; L366-L488 HydrophobicContact CD1-CD1 4.23Å; L366-L488 HydrophobicContact CD1-CD2 3.64Å; L484-L488 HydrophobicContact CD2-CD1 4.19Å; L484-L488 VanDerWaalsContact O-CB 3.24Å; L484-L488 WeakPolarHBondContact O-CB 3.47Å; L484-L488 VanDerWaalsContact O-CG 3.26Å; L484-L488 WeakPolarHBondContact O-CG 3.41Å; L484-L488 PolarHBondContact O-N 3.49Å; I486-L488 VanDerWaalsContact C-N 3.35Å; I486-L488 PolarHBondContact O-N 3.48Å; L488-V490 VanDerWaalsContact C-N 3.27Å; L488-V490 HydrophobicContact CB-CG1 3.79Å; L488-V490 HydrophobicContact CB-CG2 4.22Å; L488-V490 WeakPolarHBondContact O-CG1 3.38Å; L488-V490 PolarHBondContact O-N 3.22Å |
| 489 | E | 84.6 | Confident | 78.9 | Confident | 85 Ų | 85 | 81.6 Ų | 81.6 | 40% | 0.397 | 42% | 0.415 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 45.6 | 49.8 | -172.3 | -63.9 | -170.6 | 174.4 | 0 | 0 | 112.4 | V356 R357 Q485 I486 | V356-E489 WeakPolarHBondContact CG2-O 3.41Å; V356-E489 PolarHBondContact N-O 3.28Å; R357-E489 IonicContact CZ-OE2 3.35Å; R357-E489 IonicContact NE-OE2 3.47Å; R357-E489 PolarHBondContact NE-OE2 2.97Å; R357-E489 IonicContact NH2-OE1 2.67Å; R357-E489 IonicContact NH2-OE2 3.24Å; Q485-E489 PolarHBondContact O-N 3.1Å; Q485-E489 VanDerWaalsContact O-N 3.09Å; I486-E489 PolarHBondContact O-N 2.93Å |
| 490 | V | 83.6 | Confident | 78.4 | Confident | 13 Ų | 13 | 77.9 Ų | 77.9 | 8% | 0.079 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.8 | 141.4 | -177.8 | -63.7 | 0 | 0 | 0 | 0 | 112.5 | M353 I354 H355 P363 Q485 L488 | M353-V490 HydrophobicContact CB-CB 3.85Å; M353-V490 HydrophobicContact CB-CG2 3.92Å; M353-V490 HydrophobicContact SD-CG2 4.09Å; I354-V490 CarbonylContact O-C 3.51Å; I354-V490 VanDerWaalsContact O-CA 3.31Å; I354-V490 WeakPolarHBondContact O-CA 3.46Å; H355-V490 HydrophobicContact CB-CG1 4.32Å; P363-V490 HydrophobicContact CG-CB 4.49Å; P363-V490 HydrophobicContact CG-CG1 3.91Å; P363-V490 HydrophobicContact CG-CG2 4.23Å; Q485-V490 HydrophobicContact CB-CG2 4.33Å; Q485-V490 HydrophobicContact CG-CG2 4.09Å; Q485-V490 PolarHBondContact O-N 3.2Å; L488-V490 VanDerWaalsContact C-N 3.27Å; L488-V490 HydrophobicContact CB-CG1 3.79Å; L488-V490 HydrophobicContact CB-CG2 4.22Å; L488-V490 WeakPolarHBondContact O-CG1 3.38Å; L488-V490 PolarHBondContact O-N 3.22Å |
| 491 | A | 79.1 | Confident | 78 | Confident | 47 Ų | 47 | 79 Ų | 79 | 39% | 0.388 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.5 | 155.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | M353 I354 V356 | M353-A491 CarbonylContact C-O 3.25Å; M353-A491 VanDerWaalsContact CA-O 3.31Å; M353-A491 WeakPolarHBondContact CA-O 3.46Å; M353-A491 WeakPolarHBondContact CB-O 3.47Å; I354-A491 PolarHBondContact N-O 3.18Å; I354-A491 PolarHBondContact O-N 3.11Å; V356-A491 HydrophobicContact CG2-CB 3.93Å |
| 492 | Q | 74.1 | Confident | 77.6 | Confident | 122 Ų | 122 | 83.9 Ų | 83.9 | 57% | 0.57 | 43% | 0.429 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -69.4 | 146.6 | 170.3 | -77.8 | -173.3 | -30.8 | 0 | 0 | 110.4 | M353 | M353-Q492 HydrophobicContact CE-CG 3.68Å; M353-Q492 HydrophobicContact CG-CG 3.96Å; M353-Q492 HydrophobicContact SD-CG 4.49Å |
| 493 | Q | 66.1 | Low | 77.1 | Confident | 33 Ų | 33 | 80.5 Ų | 80.5 | 15% | 0.154 | 42% | 0.419 | C | S | . | . | P | Polyproline II helix | trans | -69.6 | 129.8 | 173.5 | -162.2 | -174.6 | -7.2 | 0 | 0 | 109.9 | V33 F339 I354 V495 | V33-Q493 WeakPolarHBondContact O-CG 3.37Å; V33-Q493 PolarHBondContact O-NE2 2.89Å; V33-Q493 VanDerWaalsContact O-NE2 3.1Å; F339-Q493 HydrophobicContact CZ-CB 4.1Å; I354-Q493 HydrophobicContact CD1-CB 4.12Å; I354-Q493 HydrophobicContact CD1-CG 4.06Å; Q493-V495 PolarHBondContact O-N 2.78Å |
| 494 | E | 55.5 | Low | 76.3 | Confident | 111 Ų | 111 | 79.7 Ų | 79.7 | 52% | 0.519 | 42% | 0.419 | S | S | . | . | P | Polyproline II helix | trans | -67.6 | 120.3 | 169.7 | -65.1 | -175.7 | 174 | 0 | 0 | 108.9 | A32 | A32-E494 WeakPolarHBondContact CA-OE2 3.36Š|
| 495 | V | 46.2 | Very low | 75.5 | Confident | 134 Ų | 134 | 79.9 Ų | 79.9 | 81% | 0.812 | 42% | 0.42 | S | S | * | . | trans | -80.9 | 0 | -176.3 | 171.6 | 0 | 0 | 0 | 0 | 110.6 | R34 Q493 | R34-V495 PolarHBondContact NH2-OXT 3.41Å; Q493-V495 PolarHBondContact O-N 2.78Å |
Retrieved 495 of 495 residues in 178.2 ms
(Link to these results)