| 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 | 62 | Low | 83.9 | Confident | 236 Ų | 236 | 127.6 Ų | 127.6 | 100% | 1.163 | 63% | 0.627 | S | S | * | * | 0 | 3.7 | 0 | -68.2 | 172.5 | 65.5 | 0 | 0 | 114.5 | |||||
| 2 | T | 69.8 | Low | 84.5 | Confident | 112 Ų | 112 | 126.3 Ų | 126.3 | 69% | 0.687 | 62% | 0.618 | S | S | * | * | trans | -98.5 | -8.3 | -164.1 | 2.3 | 0 | 0 | 0 | 0 | 116.3 | G4 | T2-G4 PolarHBondContact O-N 3.3Š| ||
| 3 | R | 72.1 | Confident | 85.1 | Confident | 229 Ų | 229 | 126.2 Ų | 126.2 | 86% | 0.864 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -72.3 | -29.8 | -174.3 | -165.8 | 174.8 | -179.6 | 144 | 0.2 | 113.7 | ||
| 4 | G | 82.1 | Confident | 85.5 | Confident | 54 Ų | 54 | 124.4 Ų | 124.4 | 56% | 0.557 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -69.5 | -38.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113 | T2 Q6 R7 E8 | T2-G4 PolarHBondContact O-N 3.3Å; G4-Q6 PolarHBondContact O-N 2.84Å; G4-R7 PolarHBondContact O-N 2.77Å; G4-E8 PolarHBondContact O-N 2.74Å |
| 5 | N | 86.5 | Confident | 85.6 | Confident | 111 Ų | 111 | 125.1 Ų | 125.1 | 59% | 0.594 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -63.7 | -42.3 | -174.3 | -168.1 | 6 | 0 | 0 | 0 | 112.4 | R7 E8 L9 | N5-R7 VanDerWaalsContact C-N 3.3Å; N5-R7 PolarHBondContact O-N 2.83Å; N5-E8 PolarHBondContact O-N 3.49Å; N5-L9 WeakPolarHBondContact O-CB 3.46Å; N5-L9 PolarHBondContact O-N 2.7Å |
| 6 | Q | 90.1 | Very high | 85.7 | Confident | 147 Ų | 147 | 125.9 Ų | 125.9 | 69% | 0.687 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -61.6 | -38 | 178 | -74 | 179.1 | -12.2 | 0 | 0 | 112.9 | G4 E8 L9 A10 | G4-Q6 PolarHBondContact O-N 2.84Å; Q6-E8 VanDerWaalsContact C-N 3.33Å; Q6-L9 PolarHBondContact O-N 3.47Å; Q6-A10 WeakPolarHBondContact O-CB 3.38Å; Q6-A10 PolarHBondContact O-N 3.48Å |
| 7 | R | 90.6 | Very high | 85.8 | Confident | 169 Ų | 169 | 126.7 Ų | 126.7 | 64% | 0.638 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -65.9 | -41.2 | 178.5 | -166.5 | -177.3 | -161.3 | -148.5 | 6.7 | 110.9 | G4 N5 A10 R11 | G4-R7 PolarHBondContact O-N 2.77Å; N5-R7 VanDerWaalsContact C-N 3.3Å; N5-R7 PolarHBondContact O-N 2.83Å; R7-A10 PolarHBondContact O-N 3.47Å; R7-R11 WeakPolarHBondContact O-CG 3.41Å; R7-R11 PolarHBondContact O-N 3.28Å; R7-R11 VanDerWaalsContact O-N 3.12Å |
| 8 | E | 93.6 | Very high | 85.4 | Confident | 91 Ų | 91 | 127.1 Ų | 127.1 | 43% | 0.425 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -68.6 | -43.4 | 178.5 | -167.5 | 51.7 | -141.1 | 0 | 0 | 111.3 | G4 N5 Q6 A10 R11 Q12 | G4-E8 PolarHBondContact O-N 2.74Å; N5-E8 PolarHBondContact O-N 3.49Å; Q6-E8 VanDerWaalsContact C-N 3.33Å; E8-A10 VanDerWaalsContact C-N 3.31Å; E8-A10 PolarHBondContact O-N 3.06Å; E8-R11 WeakPolarHBondContact O-CB 3.44Å; E8-R11 PolarHBondContact O-N 2.94Å; E8-R11 VanDerWaalsContact O-N 3.1Å; E8-Q12 WeakPolarHBondContact O-CG 3.46Å; E8-Q12 PolarHBondContact O-N 3.21Å |
| 9 | L | 92 | Very high | 85 | Confident | 78 Ų | 78 | 123.8 Ų | 123.8 | 41% | 0.408 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -58.7 | -40.6 | 174.1 | -170.4 | 75.1 | 0 | 0 | 0 | 112.4 | N5 Q6 Q12 K13 | N5-L9 WeakPolarHBondContact O-CB 3.46Å; N5-L9 PolarHBondContact O-N 2.7Å; Q6-L9 PolarHBondContact O-N 3.47Å; L9-Q12 PolarHBondContact O-N 3.21Å; L9-K13 HydrophobicContact CG-CD 4.35Å; L9-K13 WeakPolarHBondContact O-CB 2.93Å; L9-K13 VanDerWaalsContact O-CG 3.28Å; L9-K13 WeakPolarHBondContact O-CG 3.01Å; L9-K13 PolarHBondContact O-N 3.33Å |
| 10 | A | 91.4 | Very high | 84.5 | Confident | 47 Ų | 47 | 122.4 Ų | 122.4 | 39% | 0.388 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -65.1 | -39.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | Q6 R7 E8 N14 | Q6-A10 WeakPolarHBondContact O-CB 3.38Å; Q6-A10 PolarHBondContact O-N 3.48Å; R7-A10 PolarHBondContact O-N 3.47Å; E8-A10 VanDerWaalsContact C-N 3.31Å; E8-A10 PolarHBondContact O-N 3.06Å; A10-N14 WeakPolarHBondContact O-CB 3.36Å; A10-N14 VanDerWaalsContact O-CG 3.29Å; A10-N14 PolarHBondContact O-N 3.43Å; A10-N14 PolarHBondContact O-ND2 2.9Å |
| 11 | R | 92.2 | Very high | 83.7 | Confident | 130 Ų | 130 | 119.4 Ų | 119.4 | 49% | 0.491 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.1 | -46.6 | 174.7 | -72.7 | 175.3 | 177.2 | -141.4 | -4.1 | 111.4 | R7 E8 K13 N14 M15 | R7-R11 WeakPolarHBondContact O-CG 3.41Å; R7-R11 PolarHBondContact O-N 3.28Å; R7-R11 VanDerWaalsContact O-N 3.12Å; E8-R11 WeakPolarHBondContact O-CB 3.44Å; E8-R11 PolarHBondContact O-N 2.94Å; E8-R11 VanDerWaalsContact O-N 3.1Å; R11-K13 PolarHBondContact O-N 2.97Å; R11-N14 PolarHBondContact O-N 3.04Å; R11-M15 WeakPolarHBondContact O-CB 3.44Å; R11-M15 PolarHBondContact O-N 2.68Å |
| 12 | Q | 91.5 | Very high | 84 | Confident | 111 Ų | 111 | 113.1 Ų | 113.1 | 52% | 0.519 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -60.9 | -44.8 | 177 | -69.9 | 179.7 | 13 | 0 | 0 | 112.1 | E8 L9 N14 M15 K16 | E8-Q12 WeakPolarHBondContact O-CG 3.46Å; E8-Q12 PolarHBondContact O-N 3.21Å; L9-Q12 PolarHBondContact O-N 3.21Å; Q12-N14 VanDerWaalsContact C-N 3.34Å; Q12-N14 PolarHBondContact O-N 2.89Å; Q12-M15 PolarHBondContact O-N 3.45Å; Q12-K16 WeakPolarHBondContact O-CB 3.45Å; Q12-K16 PolarHBondContact O-N 3.1Å |
| 13 | K | 92.8 | Very high | 83.6 | Confident | 125 Ų | 125 | 116.6 Ų | 116.6 | 54% | 0.543 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -60.5 | -41.6 | 175.9 | -75.9 | 176.1 | 178.4 | -178.4 | 0 | 112.1 | L9 R11 K17 | L9-K13 HydrophobicContact CG-CD 4.35Å; L9-K13 WeakPolarHBondContact O-CB 2.93Å; L9-K13 VanDerWaalsContact O-CG 3.28Å; L9-K13 WeakPolarHBondContact O-CG 3.01Å; L9-K13 PolarHBondContact O-N 3.33Å; R11-K13 PolarHBondContact O-N 2.97Å; K13-K17 WeakPolarHBondContact O-CG 3.44Å; K13-K17 PolarHBondContact O-N 3.23Å |
| 14 | N | 90.7 | Very high | 83.1 | Confident | 101 Ų | 101 | 109 Ų | 109 | 54% | 0.54 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -69 | -41.2 | 178.2 | -74.4 | -12.8 | 0 | 0 | 0 | 112.1 | A10 R11 Q12 K16 K17 Q18 | A10-N14 WeakPolarHBondContact O-CB 3.36Å; A10-N14 VanDerWaalsContact O-CG 3.29Å; A10-N14 PolarHBondContact O-N 3.43Å; A10-N14 PolarHBondContact O-ND2 2.9Å; R11-N14 PolarHBondContact O-N 3.04Å; Q12-N14 VanDerWaalsContact C-N 3.34Å; Q12-N14 PolarHBondContact O-N 2.89Å; N14-K16 VanDerWaalsContact C-N 3.35Å; N14-K16 PolarHBondContact O-N 3.12Å; N14-K17 PolarHBondContact O-N 3.21Å; N14-Q18 PolarHBondContact O-N 3.2Å |
| 15 | M | 86.3 | Confident | 81.9 | Confident | 135 Ų | 135 | 115.2 Ų | 115.2 | 67% | 0.665 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -62.2 | -42.7 | 175.9 | -166.2 | 178.7 | -62.5 | 0 | 0 | 111.4 | R11 Q12 Q18 S19 | R11-M15 WeakPolarHBondContact O-CB 3.44Å; R11-M15 PolarHBondContact O-N 2.68Å; Q12-M15 PolarHBondContact O-N 3.45Å; M15-Q18 PolarHBondContact O-N 3.26Å; M15-S19 PolarHBondContact O-N 3.49Å; M15-S19 PolarHBondContact O-OG 2.9Å |
| 16 | K | 87.6 | Confident | 80.5 | Confident | 138 Ų | 138 | 120.6 Ų | 120.6 | 60% | 0.6 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -61.8 | -47.3 | 175.8 | -176 | 169.1 | -177.5 | 171.3 | 0 | 112.5 | Q12 N14 Q18 S19 D20 | Q12-K16 WeakPolarHBondContact O-CB 3.45Å; Q12-K16 PolarHBondContact O-N 3.1Å; N14-K16 VanDerWaalsContact C-N 3.35Å; N14-K16 PolarHBondContact O-N 3.12Å; K16-Q18 VanDerWaalsContact C-N 3.26Å; K16-Q18 PolarHBondContact O-N 3Å; K16-S19 WeakPolarHBondContact CA-OG 3.41Å; K16-S19 PolarHBondContact O-N 3.22Å; K16-S19 PolarHBondContact O-OG 3.33Å; K16-D20 PolarHBondContact O-N 3.49Å; K16-D20 VanDerWaalsContact O-OD2 3.13Å |
| 17 | K | 87 | Confident | 78.8 | Confident | 140 Ų | 140 | 124.7 Ų | 124.7 | 61% | 0.609 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -57.7 | -41.2 | 175.1 | -73.8 | 177.2 | 179.9 | -177.1 | 0 | 111.8 | K13 N14 S21 | K13-K17 WeakPolarHBondContact O-CG 3.44Å; K13-K17 PolarHBondContact O-N 3.23Å; N14-K17 PolarHBondContact O-N 3.21Å; K17-S21 WeakPolarHBondContact O-CB 3.44Å; K17-S21 PolarHBondContact O-N 3.46Å; K17-S21 VanDerWaalsContact O-N 3.12Å; K17-S21 PolarHBondContact O-OG 2.93Å |
| 18 | Q | 79.6 | Confident | 76.7 | Confident | 134 Ų | 134 | 123.5 Ų | 123.5 | 63% | 0.626 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -69.3 | -42.7 | 179.3 | -166.1 | 173.2 | 4.9 | 0 | 0 | 111.5 | N14 M15 K16 S21 V22 | N14-Q18 PolarHBondContact O-N 3.2Å; M15-Q18 PolarHBondContact O-N 3.26Å; K16-Q18 VanDerWaalsContact C-N 3.26Å; K16-Q18 PolarHBondContact O-N 3Å; Q18-S21 PolarHBondContact O-N 3.49Å; Q18-S21 PolarHBondContact O-OG 3.27Å; Q18-V22 WeakPolarHBondContact O-CG2 3.28Å; Q18-V22 PolarHBondContact O-N 3.45Å; Q18-V22 VanDerWaalsContact O-N 3.1Å |
| 19 | S | 77.8 | Confident | 74.8 | Confident | 64 Ų | 64 | 125 Ų | 125 | 45% | 0.448 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -63.7 | -42.3 | 177.2 | 59.6 | 0 | 0 | 0 | 0 | 112.7 | M15 K16 S21 V22 K23 | M15-S19 PolarHBondContact O-N 3.49Å; M15-S19 PolarHBondContact O-OG 2.9Å; K16-S19 WeakPolarHBondContact CA-OG 3.41Å; K16-S19 PolarHBondContact O-N 3.22Å; K16-S19 PolarHBondContact O-OG 3.33Å; S19-S21 VanDerWaalsContact C-N 3.29Å; S19-S21 PolarHBondContact O-N 2.7Å; S19-V22 PolarHBondContact O-N 2.87Å; S19-K23 PolarHBondContact O-N 3.49Å |
| 20 | D | 73.5 | Confident | 73 | Confident | 95 Ų | 95 | 125.2 Ų | 125.2 | 51% | 0.508 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -63.8 | -38.8 | 178.1 | -64.8 | -28.5 | 0 | 0 | 0 | 110.8 | K16 V22 G24 | K16-D20 PolarHBondContact O-N 3.49Å; K16-D20 VanDerWaalsContact O-OD2 3.13Å; D20-V22 PolarHBondContact O-N 2.9Å; D20-G24 PolarHBondContact O-N 3.02Å; D20-G24 VanDerWaalsContact O-N 3.16Å |
| 21 | S | 68.6 | Low | 71 | Confident | 61 Ų | 61 | 129.9 Ų | 129.9 | 43% | 0.427 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -69.3 | -28.6 | 178.2 | 76.6 | 0 | 0 | 0 | 0 | 114.2 | K17 Q18 S19 K25 | K17-S21 WeakPolarHBondContact O-CB 3.44Å; K17-S21 PolarHBondContact O-N 3.46Å; K17-S21 VanDerWaalsContact O-N 3.12Å; K17-S21 PolarHBondContact O-OG 2.93Å; Q18-S21 PolarHBondContact O-N 3.49Å; Q18-S21 PolarHBondContact O-OG 3.27Å; S19-S21 VanDerWaalsContact C-N 3.29Å; S19-S21 PolarHBondContact O-N 2.7Å; S21-K25 WeakPolarHBondContact O-CG 3.34Å |
| 22 | V | 67.6 | Low | 69 | Low | 104 Ų | 104 | 128 Ų | 128 | 63% | 0.63 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -82.1 | -40.1 | 177.8 | 173.6 | 0 | 0 | 0 | 0 | 110.5 | Q18 S19 D20 G24 | Q18-V22 WeakPolarHBondContact O-CG2 3.28Å; Q18-V22 PolarHBondContact O-N 3.45Å; Q18-V22 VanDerWaalsContact O-N 3.1Å; S19-V22 PolarHBondContact O-N 2.87Å; D20-V22 PolarHBondContact O-N 2.9Å; V22-G24 VanDerWaalsContact C-N 3.34Å; V22-G24 PolarHBondContact O-N 3.34Å |
| 23 | K | 62.9 | Low | 67.2 | Low | 185 Ų | 185 | 126.4 Ų | 126.4 | 80% | 0.804 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -68.8 | -31.9 | -179.5 | -161.7 | 175.9 | -177.3 | -177.3 | 0 | 112.5 | S19 K25 | S19-K23 PolarHBondContact O-N 3.49Å; K23-K25 PolarHBondContact O-N 3.34Å |
| 24 | G | 59.8 | Low | 65.3 | Low | 69 Ų | 69 | 123.9 Ų | 123.9 | 71% | 0.711 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82 | 1.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 116.8 | D20 V22 | D20-G24 PolarHBondContact O-N 3.02Å; D20-G24 VanDerWaalsContact O-N 3.16Å; V22-G24 VanDerWaalsContact C-N 3.34Å; V22-G24 PolarHBondContact O-N 3.34Å |
| 25 | K | 58.8 | Low | 63.5 | Low | 185 Ų | 185 | 121.8 Ų | 121.8 | 80% | 0.804 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.5 | 4.9 | -178.2 | -74.5 | -167 | -175.1 | -164.6 | 0 | 115.1 | S21 K23 | S21-K25 WeakPolarHBondContact O-CG 3.34Å; K23-K25 PolarHBondContact O-N 3.34Å |
| 26 | R | 55.5 | Low | 61.9 | Low | 224 Ų | 224 | 125.2 Ų | 125.2 | 85% | 0.845 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -109.7 | 97 | -177.4 | -130.8 | -179.7 | -177 | -169.3 | 0.4 | 109.4 | ||
| 27 | R | 55.1 | Low | 60.3 | Low | 232 Ų | 232 | 124.7 Ų | 124.7 | 88% | 0.875 | 67% | 0.667 | S | S | * | * | S | Bend | trans | 68.7 | 89.9 | 172.1 | -56.7 | 179.8 | 175.5 | -177.7 | -3.4 | 113.3 | ||
| 28 | D | 47.1 | Very low | 58.6 | Low | 144 Ų | 144 | 126.6 Ų | 126.6 | 77% | 0.77 | 68% | 0.678 | S | S | * | * | 161.5 | 145.8 | 103.6 | -99.9 | -5.8 | 0 | 0 | 0 | 103.2 | |||||
| 29 | D | 53 | Low | 57.2 | Low | 122 Ų | 122 | 131.5 Ų | 131.5 | 65% | 0.652 | 69% | 0.691 | S | S | * | * | cis | -144.3 | 172.8 | 6.5 | -78.8 | -56.3 | 0 | 0 | 0 | 105.4 | L31 | D29-L31 PolarHBondContact O-N 3.43Š| ||
| 30 | G | 54.4 | Low | 55.7 | Low | 84 Ų | 84 | 133.8 Ų | 133.8 | 87% | 0.866 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -56.8 | 21.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 118.1 | S32 | G30-S32 PolarHBondContact O-N 3.4Š|
| 31 | L | 48.5 | Very low | 54.2 | Low | 144 Ų | 144 | 132.4 Ų | 132.4 | 75% | 0.754 | 71% | 0.71 | S | S | * | * | trans | -84.2 | 63.6 | 168.2 | -57.5 | 178.7 | 0 | 0 | 0 | 109.9 | D29 | D29-L31 PolarHBondContact O-N 3.43Š| ||
| 32 | S | 50.3 | Low | 53.2 | Low | 90 Ų | 90 | 135.1 Ų | 135.1 | 63% | 0.629 | 72% | 0.724 | S | S | * | * | trans | -40.2 | 143.4 | 167.9 | 176.6 | 0 | 0 | 0 | 0 | 110.9 | G30 A34 A35 | G30-S32 PolarHBondContact O-N 3.4Å; S32-A34 PolarHBondContact O-N 3.06Å; S32-A35 PolarHBondContact O-N 3.02Å | ||
| 33 | A | 55.4 | Low | 52.1 | Low | 78 Ų | 78 | 134.3 Ų | 134.3 | 65% | 0.645 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -45.9 | -13.1 | -172.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||
| 34 | A | 52.2 | Low | 51.3 | Low | 72 Ų | 72 | 132.8 Ų | 132.8 | 60% | 0.595 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.9 | -39.7 | 170.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | S32 R36 K37 | S32-A34 PolarHBondContact O-N 3.06Å; A34-R36 VanDerWaalsContact C-N 3.3Å; A34-R36 PolarHBondContact O-N 2.93Å; A34-K37 PolarHBondContact O-N 2.99Å |
| 35 | A | 53 | Low | 50.7 | Low | 58 Ų | 58 | 134.9 Ų | 134.9 | 48% | 0.479 | 71% | 0.71 | S | S | . | * | G | 310 helix | trans | -71.3 | -23.4 | -172.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | S32 K37 | S32-A35 PolarHBondContact O-N 3.02Å; A35-K37 VanDerWaalsContact C-N 3.27Å; A35-K37 PolarHBondContact O-N 3.07Å |
| 36 | R | 53.1 | Low | 50.1 | Low | 206 Ų | 206 | 133.4 Ų | 133.4 | 78% | 0.777 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -81 | -1.5 | 179.7 | -133.5 | -179.3 | -168.7 | -155.9 | 3.5 | 113.7 | A34 Q43 | A34-R36 VanDerWaalsContact C-N 3.3Å; A34-R36 PolarHBondContact O-N 2.93Å; R36-Q43 PolarHBondContact O-NE2 3.11Å |
| 37 | K | 53.9 | Low | 50 | Low | 128 Ų | 128 | 126.2 Ų | 126.2 | 56% | 0.557 | 70% | 0.699 | S | S | * | * | G | 310 helix | trans | -80.8 | -16.6 | 175.9 | -78.6 | -172.3 | 176.5 | -176 | 0 | 113.4 | A34 A35 Q43 | A34-K37 PolarHBondContact O-N 2.99Å; A35-K37 VanDerWaalsContact C-N 3.27Å; A35-K37 PolarHBondContact O-N 3.07Å; K37-Q43 HydrophobicContact CG-CB 4.08Å; K37-Q43 HydrophobicContact CG-CG 3.81Å; K37-Q43 VanDerWaalsContact CG-NE2 3.29Å |
| 38 | Q | 51.1 | Low | 49.7 | Very low | 180 Ų | 180 | 123.5 Ų | 123.5 | 84% | 0.841 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -98.8 | -5.6 | -172.5 | -68.4 | -171.8 | -8 | 0 | 0 | 115 | ||
| 39 | R | 49.6 | Very low | 50.1 | Low | 237 Ų | 237 | 121.1 Ų | 121.1 | 89% | 0.894 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -112 | -6 | 179.1 | -73.3 | -169.2 | -179.9 | -120.4 | 2.3 | 116.2 | ||
| 40 | V | 45.9 | Very low | 50.5 | Low | 111 Ų | 111 | 117.3 Ų | 117.3 | 67% | 0.673 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -144.9 | 105.9 | 164.3 | -136.9 | 0 | 0 | 0 | 0 | 105.6 | V42 | V40-V42 PolarHBondContact O-N 3.35Š|
| 41 | G | 42.4 | Very low | 51.1 | Low | 66 Ų | 66 | 118.7 Ų | 118.7 | 68% | 0.68 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -51.4 | 137.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||
| 42 | V | 47.1 | Very low | 52.2 | Low | 119 Ų | 119 | 117.8 Ų | 117.8 | 72% | 0.721 | 66% | 0.655 | S | S | * | * | trans | 85.5 | 69.9 | -176.8 | -160.3 | 0 | 0 | 0 | 0 | 114.6 | V40 Q44 | V40-V42 PolarHBondContact O-N 3.35Å; V42-Q44 VanDerWaalsContact C-N 3.29Å; V42-Q44 HydrophobicContact CG1-CB 4.3Å; V42-Q44 HydrophobicContact CG1-CG 3.6Å; V42-Q44 PolarHBondContact O-N 3.19Å | ||
| 43 | Q | 45.9 | Very low | 53.5 | Low | 87 Ų | 87 | 118 Ų | 118 | 41% | 0.407 | 65% | 0.646 | S | S | . | * | trans | -77 | 85.8 | 147.9 | -78.9 | -168.8 | 15.3 | 0 | 0 | 108.8 | R36 K37 | R36-Q43 PolarHBondContact O-NE2 3.11Å; K37-Q43 HydrophobicContact CG-CB 4.08Å; K37-Q43 HydrophobicContact CG-CG 3.81Å; K37-Q43 VanDerWaalsContact CG-NE2 3.29Å | ||
| 44 | Q | 45.6 | Very low | 54.6 | Low | 152 Ų | 152 | 120.6 Ų | 120.6 | 71% | 0.71 | 64% | 0.643 | S | S | * | * | trans | -71.3 | 126.8 | 162.5 | -86.8 | 179.1 | 15.1 | 0 | 0 | 108.8 | V42 N46 | V42-Q44 VanDerWaalsContact C-N 3.29Å; V42-Q44 HydrophobicContact CG1-CB 4.3Å; V42-Q44 HydrophobicContact CG1-CG 3.6Å; V42-Q44 PolarHBondContact O-N 3.19Å; Q44-N46 PolarHBondContact O-N 3.15Å | ||
| 45 | P | 46.5 | Very low | 55.9 | Low | 113 Ų | 113 | 123.2 Ų | 123.2 | 73% | 0.734 | 64% | 0.642 | S | S | * | * | trans | -64.1 | 101.9 | 168.5 | 27.6 | -31.8 | 0 | 0 | 0 | 107.6 | A47 | P45-A47 PolarHBondContact O-N 3.45Š| ||
| 46 | N | 45.9 | Very low | 57.3 | Low | 154 Ų | 154 | 125.8 Ų | 125.8 | 82% | 0.824 | 65% | 0.647 | S | S | * | * | trans | -74.2 | 33.6 | 170.2 | -128.3 | -10.6 | 0 | 0 | 0 | 111.2 | Q44 E48 | Q44-N46 PolarHBondContact O-N 3.15Å; N46-E48 VanDerWaalsContact C-N 3.34Å; N46-E48 PolarHBondContact O-N 3.2Å | ||
| 47 | A | 54.4 | Low | 58.8 | Low | 73 Ų | 73 | 119.7 Ų | 119.7 | 60% | 0.603 | 63% | 0.629 | S | S | * | * | S | Bend | trans | -73 | 104.3 | 153.8 | 0 | 0 | 0 | 0 | 0 | 103 | P45 L49 | P45-A47 PolarHBondContact O-N 3.45Å; A47-L49 PolarHBondContact O-N 2.88Å |
| 48 | E | 47.6 | Very low | 60 | Low | 175 Ų | 175 | 117.8 Ų | 117.8 | 82% | 0.818 | 63% | 0.625 | S | S | * | * | trans | -44.8 | 93.1 | 176.8 | -70.2 | -144.7 | 171.7 | 0 | 0 | 109.4 | N46 S50 | N46-E48 VanDerWaalsContact C-N 3.34Å; N46-E48 PolarHBondContact O-N 3.2Å; E48-S50 PolarHBondContact O-N 3.41Å | ||
| 49 | L | 55.4 | Low | 61.1 | Low | 94 Ų | 94 | 112.7 Ų | 112.7 | 49% | 0.492 | 61% | 0.608 | S | S | . | * | trans | -77.1 | 83.3 | 173.9 | -157.5 | 77.3 | 0 | 0 | 0 | 101.2 | A47 H53 I57 | A47-L49 PolarHBondContact O-N 2.88Å; L49-H53 HydrophobicContact CD1-CB 3.63Å; L49-H53 HydrophobicContact CD2-CB 3.99Å; L49-H53 HydrophobicContact CG-CB 3.39Å; L49-I57 HydrophobicContact CD2-CD1 3.92Å | ||
| 50 | S | 62 | Low | 62.4 | Low | 42 Ų | 42 | 105.6 Ų | 105.6 | 29% | 0.294 | 60% | 0.6 | S | S | . | * | trans | -39.2 | 145.3 | -179.4 | 55.7 | 0 | 0 | 0 | 0 | 108.3 | E48 I52 H53 | E48-S50 PolarHBondContact O-N 3.41Å; S50-I52 CarbonylContact O-C 3.49Å; S50-I52 PolarHBondContact O-N 3.39Å; S50-H53 PolarHBondContact O-N 3.33Å | ||
| 51 | P | 66.9 | Low | 63.8 | Low | 113 Ų | 113 | 106.4 Ų | 106.4 | 73% | 0.734 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -46.2 | -27.7 | -179.5 | -27.7 | 32.5 | 0 | 0 | 0 | 113.3 | F54 H55 | P51-F54 PolarHBondContact O-N 2.99Å; P51-H55 WeakPolarHBondContact O-CB 3.48Å; P51-H55 PolarHBondContact O-N 3.26Å |
| 52 | I | 72.2 | Confident | 65.2 | Low | 126 Ų | 126 | 108.6 Ų | 108.6 | 65% | 0.646 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -55.4 | -48.2 | 171.7 | -52.3 | 174.8 | 0 | 0 | 0 | 113.5 | S50 H55 L56 | S50-I52 CarbonylContact O-C 3.49Å; S50-I52 PolarHBondContact O-N 3.39Å; I52-H55 PolarHBondContact O-N 3.48Å; I52-L56 WeakPolarHBondContact O-CB 3.46Å; I52-L56 PolarHBondContact O-N 3.45Å |
| 53 | H | 77.3 | Confident | 65.7 | Low | 95 Ų | 95 | 107.4 Ų | 107.4 | 44% | 0.44 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -71.7 | -36.5 | -179.8 | -105.2 | 85.3 | 0 | 0 | 0 | 112.1 | L49 S50 H55 L56 I57 | L49-H53 HydrophobicContact CD1-CB 3.63Å; L49-H53 HydrophobicContact CD2-CB 3.99Å; L49-H53 HydrophobicContact CG-CB 3.39Å; S50-H53 PolarHBondContact O-N 3.33Å; H53-H55 VanDerWaalsContact C-N 3.31Å; H53-H55 PolarHBondContact O-N 3.03Å; H53-L56 WeakPolarHBondContact O-CB 3.45Å; H53-L56 PolarHBondContact O-N 2.77Å; H53-I57 VanDerWaalsContact O-CG1 3.31Å; H53-I57 WeakPolarHBondContact O-CG1 3.36Å; H53-I57 PolarHBondContact O-N 2.95Å |
| 54 | F | 79.1 | Confident | 66.4 | Low | 132 Ų | 132 | 109.1 Ų | 109.1 | 58% | 0.579 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -61 | -45.2 | 174 | -174.6 | -97 | 0 | 0 | 0 | 110.4 | P51 L56 I57 L58 | P51-F54 PolarHBondContact O-N 2.99Å; F54-L56 VanDerWaalsContact C-N 3.33Å; F54-L56 PolarHBondContact O-N 3.24Å; F54-I57 PolarHBondContact O-N 3Å; F54-L58 HydrophobicContact CD1-CD1 4.36Å; F54-L58 HydrophobicContact CE1-CD1 3.72Å; F54-L58 HydrophobicContact CE1-CD2 4.41Å; F54-L58 HydrophobicContact CE2-CD1 4.41Å; F54-L58 HydrophobicContact CZ-CD1 3.76Å; F54-L58 PolarHBondContact O-N 3.42Å |
| 55 | H | 78.1 | Confident | 66.8 | Low | 126 Ų | 126 | 106.6 Ų | 106.6 | 58% | 0.583 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -62.4 | -38.9 | 173.9 | -165.4 | -47.5 | 0 | 0 | 0 | 112.4 | P51 I52 H53 I57 L58 C59 | P51-H55 WeakPolarHBondContact O-CB 3.48Å; P51-H55 PolarHBondContact O-N 3.26Å; I52-H55 PolarHBondContact O-N 3.48Å; H53-H55 VanDerWaalsContact C-N 3.31Å; H53-H55 PolarHBondContact O-N 3.03Å; H55-I57 VanDerWaalsContact C-N 3.35Å; H55-L58 PolarHBondContact O-N 3.5Å; H55-C59 PolarHBondContact CE1-SG 3.1Å; H55-C59 PolarHBondContact ND1-SG 3.25Å; H55-C59 WeakPolarHBondContact O-CB 3.38Å; H55-C59 PolarHBondContact O-N 2.73Å; H55-C59 PolarHBondContact O-SG 2.75Å; H55-C59 VanDerWaalsContact O-SG 3.39Å |
| 56 | L | 83.4 | Confident | 67.3 | Low | 112 Ų | 112 | 105.3 Ų | 105.3 | 59% | 0.586 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -63.6 | -41.4 | 178 | -157.2 | 88.7 | 0 | 0 | 0 | 111.7 | I52 H53 F54 A60 | I52-L56 WeakPolarHBondContact O-CB 3.46Å; I52-L56 PolarHBondContact O-N 3.45Å; H53-L56 WeakPolarHBondContact O-CB 3.45Å; H53-L56 PolarHBondContact O-N 2.77Å; F54-L56 VanDerWaalsContact C-N 3.33Å; F54-L56 PolarHBondContact O-N 3.24Å; L56-A60 PolarHBondContact O-N 3.31Å; L56-A60 VanDerWaalsContact O-N 3.16Å |
| 57 | I | 83.7 | Confident | 67.4 | Low | 78 Ų | 78 | 100.4 Ų | 100.4 | 40% | 0.4 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -67.6 | -44.4 | 177.2 | -68.1 | 166.3 | 0 | 0 | 0 | 110.4 | L49 H53 F54 H55 C59 A60 L61 | L49-I57 HydrophobicContact CD2-CD1 3.92Å; H53-I57 VanDerWaalsContact O-CG1 3.31Å; H53-I57 WeakPolarHBondContact O-CG1 3.36Å; H53-I57 PolarHBondContact O-N 2.95Å; F54-I57 PolarHBondContact O-N 3Å; H55-I57 VanDerWaalsContact C-N 3.35Å; I57-C59 VanDerWaalsContact C-N 3.32Å; I57-C59 PolarHBondContact O-N 3.27Å; I57-A60 PolarHBondContact O-N 3.32Å; I57-A60 VanDerWaalsContact O-N 3.17Å; I57-L61 HydrophobicContact CG2-CD1 3.75Å; I57-L61 PolarHBondContact O-N 2.84Å |
| 58 | L | 79.2 | Confident | 67.5 | Low | 89 Ų | 89 | 102.9 Ų | 102.9 | 47% | 0.466 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -58.3 | -44.4 | 176.6 | -123.3 | 76.4 | 0 | 0 | 0 | 111.8 | F54 H55 A60 L61 H62 | F54-L58 HydrophobicContact CD1-CD1 4.36Å; F54-L58 HydrophobicContact CE1-CD1 3.72Å; F54-L58 HydrophobicContact CE1-CD2 4.41Å; F54-L58 HydrophobicContact CE2-CD1 4.41Å; F54-L58 HydrophobicContact CZ-CD1 3.76Å; F54-L58 PolarHBondContact O-N 3.42Å; H55-L58 PolarHBondContact O-N 3.5Å; L58-A60 VanDerWaalsContact C-N 3.3Å; L58-A60 PolarHBondContact O-N 3.12Å; L58-L61 PolarHBondContact O-N 2.78Å; L58-H62 PolarHBondContact O-N 3.17Å |
| 59 | C | 74.7 | Confident | 67.8 | Low | 73 Ų | 73 | 104 Ų | 104 | 49% | 0.493 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -67.8 | -26.3 | 178.2 | -75.3 | 0 | 0 | 0 | 0 | 114 | H55 I57 | H55-C59 PolarHBondContact CE1-SG 3.1Å; H55-C59 PolarHBondContact ND1-SG 3.25Å; H55-C59 WeakPolarHBondContact O-CB 3.38Å; H55-C59 PolarHBondContact O-N 2.73Å; H55-C59 PolarHBondContact O-SG 2.75Å; H55-C59 VanDerWaalsContact O-SG 3.39Å; I57-C59 VanDerWaalsContact C-N 3.32Å; I57-C59 PolarHBondContact O-N 3.27Å |
| 60 | A | 76.4 | Confident | 67.2 | Low | 88 Ų | 88 | 103.5 Ų | 103.5 | 73% | 0.727 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -78.2 | -28.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L56 I57 L58 | L56-A60 PolarHBondContact O-N 3.31Å; L56-A60 VanDerWaalsContact O-N 3.16Å; I57-A60 PolarHBondContact O-N 3.32Å; I57-A60 VanDerWaalsContact O-N 3.17Å; L58-A60 VanDerWaalsContact C-N 3.3Å; L58-A60 PolarHBondContact O-N 3.12Å |
| 61 | L | 75.5 | Confident | 66.3 | Low | 128 Ų | 128 | 106.4 Ų | 106.4 | 67% | 0.67 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -92.9 | -26.3 | -176.9 | -77.7 | 155.4 | 0 | 0 | 0 | 113.7 | I57 L58 | I57-L61 HydrophobicContact CG2-CD1 3.75Å; I57-L61 PolarHBondContact O-N 2.84Å; L58-L61 PolarHBondContact O-N 2.78Å |
| 62 | H | 71.5 | Confident | 65.3 | Low | 111 Ų | 111 | 109 Ų | 109 | 51% | 0.514 | 62% | 0.622 | S | S | . | * | S | Bend | trans | -115.2 | 110 | 175.3 | -79.9 | 92.5 | 0 | 0 | 0 | 110.8 | L58 | L58-H62 PolarHBondContact O-N 3.17Š|
| 63 | P | 58.3 | Low | 64.4 | Low | 95 Ų | 95 | 108.3 Ų | 108.3 | 62% | 0.617 | 62% | 0.624 | S | S | * | * | trans | -56.5 | 146.8 | 168.7 | -19.7 | 31 | 0 | 0 | 0 | 110.5 | A65 | P63-A65 PolarHBondContact O-N 3.16Š| ||
| 64 | P | 61 | Low | 62.9 | Low | 122 Ų | 122 | 108 Ų | 108 | 79% | 0.792 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.6 | 25.9 | -162.9 | 31.8 | -37.5 | 0 | 0 | 0 | 115.5 | ||
| 65 | A | 54.6 | Low | 61.4 | Low | 100 Ų | 100 | 108.2 Ų | 108.2 | 83% | 0.826 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90 | -7.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114 | P63 | P63-A65 PolarHBondContact O-N 3.16Š|
| 66 | S | 55.6 | Low | 59.6 | Low | 86 Ų | 86 | 106.7 Ų | 106.7 | 60% | 0.601 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -145.4 | 35 | -175.3 | 48.8 | 0 | 0 | 0 | 0 | 114.4 | P68 | S66-P68 WeakPolarHBondContact O-CD 3.43Š|
| 67 | C | 47.6 | Very low | 58 | Low | 50 Ų | 50 | 105 Ų | 105 | 34% | 0.338 | 65% | 0.651 | S | S | . | * | trans | -90 | 102.2 | 170.3 | -63.9 | 0 | 0 | 0 | 0 | 110.7 | F69 C70 | C67-F69 PolarHBondContact O-N 3.42Å; C67-F69 VanDerWaalsContact O-N 3.15Å; C67-C70 PolarHBondContact O-N 2.97Å | ||
| 68 | P | 57 | Low | 56.5 | Low | 125 Ų | 125 | 107.9 Ų | 107.9 | 81% | 0.812 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.5 | -6.9 | 173.2 | 28.5 | -35.7 | 0 | 0 | 0 | 113.5 | S66 | S66-P68 WeakPolarHBondContact O-CD 3.43Š|
| 69 | F | 53.3 | Low | 54.9 | Low | 200 Ų | 200 | 108.2 Ų | 108.2 | 88% | 0.877 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.2 | 0.8 | 174.3 | -94.8 | -81.1 | 0 | 0 | 0 | 114.4 | C67 P71 | C67-F69 PolarHBondContact O-N 3.42Å; C67-F69 VanDerWaalsContact O-N 3.15Å; F69-P71 WeakPolarHBondContact O-CD 3.06Å |
| 70 | C | 43.1 | Very low | 53.8 | Low | 83 Ų | 83 | 110.3 Ų | 110.3 | 56% | 0.561 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -77.4 | 101.8 | 155.1 | -70.7 | 0 | 0 | 0 | 0 | 105.2 | C67 L72 | C67-C70 PolarHBondContact O-N 2.97Å; C70-L72 VanDerWaalsContact C-N 3.33Å; C70-L72 PolarHBondContact O-N 3.41Å |
| 71 | P | 43.6 | Very low | 52.3 | Low | 102 Ų | 102 | 113.1 Ų | 113.1 | 66% | 0.662 | 70% | 0.702 | S | S | * | * | trans | -54.6 | 116.1 | 160 | 25.9 | -31.5 | 0 | 0 | 0 | 104.1 | F69 V73 | F69-P71 WeakPolarHBondContact O-CD 3.06Å; P71-V73 HydrophobicContact CG-CG2 4.42Å; P71-V73 WeakPolarHBondContact O-CG2 3.31Å; P71-V73 PolarHBondContact O-N 3.32Å | ||
| 72 | L | 46.4 | Very low | 51 | Low | 167 Ų | 167 | 112.4 Ų | 112.4 | 87% | 0.874 | 71% | 0.705 | S | S | * | * | trans | -56.1 | 89 | 163.6 | -166.4 | 75.6 | 0 | 0 | 0 | 103.4 | C70 P74 | C70-L72 VanDerWaalsContact C-N 3.33Å; C70-L72 PolarHBondContact O-N 3.41Å; L72-P74 WeakPolarHBondContact O-CD 3.38Å | ||
| 73 | V | 51.9 | Low | 50.2 | Low | 112 Ų | 112 | 114 Ų | 114 | 68% | 0.679 | 73% | 0.725 | S | S | * | * | trans | -63 | 107.1 | -177.7 | 175.1 | 0 | 0 | 0 | 0 | 103.6 | P71 | P71-V73 HydrophobicContact CG-CG2 4.42Å; P71-V73 WeakPolarHBondContact O-CG2 3.31Å; P71-V73 PolarHBondContact O-N 3.32Å | ||
| 74 | P | 46.4 | Very low | 49.5 | Very low | 88 Ų | 88 | 112.1 Ų | 112.1 | 57% | 0.571 | 72% | 0.723 | S | S | * | * | trans | -62.1 | 143.9 | 177.8 | 28.2 | -31.8 | 0 | 0 | 0 | 106.7 | L72 S76 | L72-P74 WeakPolarHBondContact O-CD 3.38Å; P74-S76 VanDerWaalsContact C-N 3.28Å; P74-S76 PolarHBondContact O-N 2.61Å; P74-S76 PolarHBondContact O-OG 2.9Å | ||
| 75 | P | 48.5 | Very low | 48.8 | Very low | 137 Ų | 137 | 112.7 Ų | 112.7 | 89% | 0.89 | 73% | 0.725 | S | S | * | * | trans | -58.8 | 96.7 | -178.7 | 24.9 | -33.2 | 0 | 0 | 0 | 108.4 | A77 | P75-A77 PolarHBondContact O-N 2.94Š| ||
| 76 | S | 39.8 | Very low | 48.7 | Very low | 94 Ų | 94 | 119.8 Ų | 119.8 | 66% | 0.657 | 73% | 0.73 | S | S | * | * | trans | -81.4 | 121.8 | 177.8 | -54.1 | 0 | 0 | 0 | 0 | 105.4 | P74 | P74-S76 VanDerWaalsContact C-N 3.28Å; P74-S76 PolarHBondContact O-N 2.61Å; P74-S76 PolarHBondContact O-OG 2.9Å | ||
| 77 | A | 49.3 | Very low | 48.2 | Very low | 78 Ų | 78 | 126.6 Ų | 126.6 | 65% | 0.645 | 74% | 0.743 | S | S | * | * | trans | -39 | 151.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | P75 S79 | P75-A77 PolarHBondContact O-N 2.94Å; A77-S79 VanDerWaalsContact C-N 3.31Å; A77-S79 PolarHBondContact O-N 3.43Å | ||
| 78 | P | 52.4 | Low | 48.1 | Very low | 137 Ų | 137 | 128.2 Ų | 128.2 | 89% | 0.89 | 75% | 0.754 | S | S | * | * | trans | -68.4 | 87.4 | -172.1 | 29.6 | -34.8 | 0 | 0 | 0 | 110.6 | S80 | P78-S80 PolarHBondContact O-N 2.72Š| ||
| 79 | S | 46.7 | Very low | 47.7 | Very low | 97 Ų | 97 | 127.1 Ų | 127.1 | 68% | 0.678 | 75% | 0.749 | S | S | * | * | trans | -80.1 | 107.3 | 167 | 46.7 | 0 | 0 | 0 | 0 | 108 | A77 L81 | A77-S79 VanDerWaalsContact C-N 3.31Å; A77-S79 PolarHBondContact O-N 3.43Å; S79-L81 PolarHBondContact O-N 3.46Å | ||
| 80 | S | 51.4 | Low | 47.8 | Very low | 116 Ų | 116 | 121.6 Ų | 121.6 | 81% | 0.811 | 74% | 0.735 | S | S | * | * | trans | -27.1 | 86.5 | 162.4 | 54.2 | 0 | 0 | 0 | 0 | 114.2 | P78 | P78-S80 PolarHBondContact O-N 2.72Š| ||
| 81 | L | 44.8 | Very low | 48.2 | Very low | 147 Ų | 147 | 128.3 Ų | 128.3 | 77% | 0.77 | 75% | 0.749 | S | S | * | * | trans | -112.9 | 128.7 | 157.5 | -72 | 175.9 | 0 | 0 | 0 | 107.7 | S79 | S79-L81 PolarHBondContact O-N 3.46Š| ||
| 82 | P | 47.7 | Very low | 48.7 | Very low | 114 Ų | 114 | 127.6 Ų | 127.6 | 74% | 0.74 | 75% | 0.746 | S | S | * | * | trans | -59.4 | 139.7 | -178.6 | 21.9 | -31.1 | 0 | 0 | 0 | 110.3 | G84 | P82-G84 PolarHBondContact O-N 3.47Š| ||
| 83 | P | 54.8 | Low | 48.9 | Very low | 143 Ų | 143 | 129.2 Ų | 129.2 | 93% | 0.929 | 74% | 0.74 | S | S | * | * | trans | -64.7 | 71 | 176.2 | -22.3 | 33.9 | 0 | 0 | 0 | 113 | ||||
| 84 | G | 43.2 | Very low | 49.2 | Very low | 57 Ų | 57 | 131.6 Ų | 131.6 | 59% | 0.588 | 74% | 0.742 | S | S | * | * | trans | -102.9 | 93.9 | -175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | P82 | P82-G84 PolarHBondContact O-N 3.47Š| ||
| 85 | T | 47.9 | Very low | 49.5 | Very low | 134 Ų | 134 | 137.6 Ų | 137.6 | 82% | 0.822 | 75% | 0.753 | S | S | * | * | trans | 69.8 | 55.7 | 163.8 | 71.4 | 0 | 0 | 0 | 0 | 117.7 | R87 | T85-R87 PolarHBondContact O-N 3.46Š| ||
| 86 | R | 50.6 | Low | 49.7 | Very low | 249 Ų | 249 | 138.8 Ų | 138.8 | 94% | 0.94 | 75% | 0.746 | S | S | * | * | trans | -63.8 | 78.7 | 140 | -80.7 | -171.6 | -175.9 | -101.9 | 1.8 | 107.8 | S88 | R86-S88 VanDerWaalsContact C-N 3.28Å; R86-S88 PolarHBondContact O-N 3.16Å | ||
| 87 | R | 46.7 | Very low | 50.5 | Low | 228 Ų | 228 | 139.5 Ų | 139.5 | 86% | 0.86 | 75% | 0.747 | S | S | * | * | trans | -64.3 | 96.4 | 171.6 | -161.4 | 178.4 | -163 | -157.7 | 6.4 | 106 | T85 C89 | T85-R87 PolarHBondContact O-N 3.46Å; R87-C89 PolarHBondContact O-N 3.35Å | ||
| 88 | S | 44.2 | Very low | 50.7 | Low | 84 Ų | 84 | 146.3 Ų | 146.3 | 59% | 0.587 | 76% | 0.756 | S | S | * | * | trans | -48.7 | 110.5 | -177.5 | -170.5 | 0 | 0 | 0 | 0 | 110.2 | R86 S90 | R86-S88 VanDerWaalsContact C-N 3.28Å; R86-S88 PolarHBondContact O-N 3.16Å; S88-S90 PolarHBondContact O-N 3.21Å; S88-S90 PolarHBondContact OG-OG 3.34Å; S88-S90 VanDerWaalsContact OG-OG 3.06Å | ||
| 89 | C | 48.4 | Very low | 50.5 | Low | 103 Ų | 103 | 150.8 Ų | 150.8 | 70% | 0.696 | 76% | 0.755 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | -0.5 | 176.7 | -70.3 | 0 | 0 | 0 | 0 | 113.1 | R87 R91 S92 | R87-C89 PolarHBondContact O-N 3.35Å; C89-R91 PolarHBondContact O-N 3.05Å; C89-S92 PolarHBondContact O-N 3.18Å |
| 90 | S | 56.6 | Low | 50.8 | Low | 84 Ų | 84 | 157 Ų | 157 | 59% | 0.587 | 76% | 0.764 | S | S | * | * | H | α-helix | trans | -62.7 | -24.9 | 177.3 | -53.4 | 0 | 0 | 0 | 0 | 113.5 | S88 | S88-S90 PolarHBondContact O-N 3.21Å; S88-S90 PolarHBondContact OG-OG 3.34Å; S88-S90 VanDerWaalsContact OG-OG 3.06Å |
| 91 | R | 50.3 | Low | 50.8 | Low | 224 Ų | 224 | 162.9 Ų | 162.9 | 85% | 0.845 | 77% | 0.768 | S | S | * | * | H | α-helix | trans | -76.8 | -27.8 | -178.2 | -117 | 177.5 | -178.2 | 176.3 | 0.6 | 114.3 | C89 K94 | C89-R91 PolarHBondContact O-N 3.05Å; R91-K94 PolarHBondContact O-N 2.9Å |
| 92 | S | 54.4 | Low | 50.8 | Low | 87 Ų | 87 | 161.9 Ų | 161.9 | 61% | 0.608 | 76% | 0.764 | S | S | * | * | H | α-helix | trans | -71.7 | -39.1 | -177.1 | -164.2 | 0 | 0 | 0 | 0 | 112.1 | C89 K94 R95 | C89-S92 PolarHBondContact O-N 3.18Å; S92-K94 PolarHBondContact O-N 3.06Å; S92-R95 PolarHBondContact O-N 3.3Å |
| 93 | R | 51.9 | Low | 51.3 | Low | 200 Ų | 200 | 161.1 Ų | 161.1 | 76% | 0.755 | 76% | 0.759 | S | S | * | * | H | α-helix | trans | -60.9 | -30.6 | 178.1 | -60.1 | -173.4 | -160.3 | -172.4 | 4.9 | 112.7 | ||
| 94 | K | 58 | Low | 51.2 | Low | 162 Ų | 162 | 158.8 Ų | 158.8 | 70% | 0.704 | 75% | 0.746 | S | S | * | * | H | α-helix | trans | -79.4 | -19.4 | -178.1 | -156.9 | 142.9 | -175.6 | 174.9 | 0 | 114.2 | R91 S92 | R91-K94 PolarHBondContact O-N 2.9Å; S92-K94 PolarHBondContact O-N 3.06Å |
| 95 | R | 51.2 | Low | 51.8 | Low | 215 Ų | 215 | 160.7 Ų | 160.7 | 81% | 0.811 | 75% | 0.751 | S | S | * | * | H | α-helix | trans | -80.8 | -29.2 | 173.1 | -85.9 | -172.7 | 172.3 | -147.7 | -1.5 | 112.7 | S92 | S92-R95 PolarHBondContact O-N 3.3Å |
| 96 | Q | 53.3 | Low | 52.2 | Low | 161 Ų | 161 | 162.8 Ų | 162.8 | 75% | 0.752 | 75% | 0.748 | S | S | * | * | H | α-helix | trans | -78.6 | -30.3 | -175.8 | -158.2 | 160.8 | 6.4 | 0 | 0 | 113.1 | ||
| 97 | T | 55.9 | Low | 52.2 | Low | 110 Ų | 110 | 157.4 Ų | 157.4 | 68% | 0.675 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -79.1 | -19 | 180 | 54.2 | 0 | 0 | 0 | 0 | 114.3 | R99 | T97-R99 VanDerWaalsContact C-N 3.33Å; T97-R99 PolarHBondContact O-N 3.06Å |
| 98 | R | 53.5 | Low | 52.3 | Low | 221 Ų | 221 | 150.8 Ų | 150.8 | 83% | 0.834 | 74% | 0.737 | S | S | * | * | G | 310 helix | trans | -75.4 | -14.8 | 178.1 | -90.8 | -165.7 | 174 | -159.2 | -0.6 | 114.6 | ||
| 99 | R | 50.2 | Low | 52.3 | Low | 231 Ų | 231 | 151.5 Ų | 151.5 | 87% | 0.872 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | -94.8 | 2.2 | -173.1 | -76.7 | -163.2 | 173.3 | -165.7 | -1.7 | 115.9 | T97 | T97-R99 VanDerWaalsContact C-N 3.33Å; T97-R99 PolarHBondContact O-N 3.06Å |
| 100 | R | 52 | Low | 52.2 | Low | 228 Ų | 228 | 151.2 Ų | 151.2 | 86% | 0.86 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -132.1 | 63.2 | -179 | -74.1 | -166.8 | 175.7 | -115.1 | 2.3 | 113.1 | ||
| 101 | R | 51.7 | Low | 51.8 | Low | 238 Ų | 238 | 152.8 Ų | 152.8 | 90% | 0.898 | 75% | 0.748 | S | S | * | * | trans | -148.9 | 103.9 | 149.3 | -64.4 | -168.4 | -174.7 | 171.2 | 0.3 | 108.2 | ||||
| 102 | N | 44.4 | Very low | 51.6 | Low | 126 Ų | 126 | 148.3 Ų | 148.3 | 67% | 0.674 | 75% | 0.746 | S | S | * | * | trans | -95.5 | 111.7 | 157 | -172.9 | -21.3 | 0 | 0 | 0 | 106.2 | S104 | N102-S104 PolarHBondContact O-N 3.31Å; N102-S104 WeakPolarHBondContact OD1-CB 3.47Å; N102-S104 PolarHBondContact OD1-N 2.67Å; N102-S104 VanDerWaalsContact OD1-N 3.07Å; N102-S104 PolarHBondContact OD1-OG 2.99Å | ||
| 103 | P | 57.5 | Low | 51.2 | Low | 99 Ų | 99 | 151.2 Ų | 151.2 | 64% | 0.643 | 75% | 0.754 | S | S | * | * | trans | -81.8 | 12.5 | -177.4 | 34.3 | -34.6 | 0 | 0 | 0 | 113.6 | S105 F106 | P103-S105 PolarHBondContact O-N 3.05Å; P103-F106 PolarHBondContact O-N 3.31Å; P103-F106 VanDerWaalsContact O-N 3.11Å | ||
| 104 | S | 53.9 | Low | 51 | Low | 94 Ų | 94 | 148 Ų | 148 | 66% | 0.657 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | 0.5 | 175.5 | 71.2 | 0 | 0 | 0 | 0 | 114.4 | N102 | N102-S104 PolarHBondContact O-N 3.31Å; N102-S104 WeakPolarHBondContact OD1-CB 3.47Å; N102-S104 PolarHBondContact OD1-N 2.67Å; N102-S104 VanDerWaalsContact OD1-N 3.07Å; N102-S104 PolarHBondContact OD1-OG 2.99Å |
| 105 | S | 55.3 | Low | 50.8 | Low | 97 Ų | 97 | 145.5 Ų | 145.5 | 68% | 0.678 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -4.7 | 171.9 | 67 | 0 | 0 | 0 | 0 | 113.7 | P103 | P103-S105 PolarHBondContact O-N 3.05Š|
| 106 | F | 55.9 | Low | 50.3 | Low | 177 Ų | 177 | 143.9 Ų | 143.9 | 78% | 0.776 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -84.4 | -5.5 | -174.3 | -133.5 | -91.4 | 0 | 0 | 0 | 114.8 | P103 | P103-F106 PolarHBondContact O-N 3.31Å; P103-F106 VanDerWaalsContact O-N 3.11Å |
| 107 | V | 50 | Low | 50.1 | Low | 137 Ų | 137 | 141 Ų | 141 | 83% | 0.83 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -147 | 69.7 | 174.4 | -167.1 | 0 | 0 | 0 | 0 | 111 | ||
| 108 | A | 50.7 | Low | 49.7 | Very low | 89 Ų | 89 | 141.4 Ų | 141.4 | 74% | 0.736 | 76% | 0.76 | S | S | * | * | trans | -147.3 | 10.3 | 155.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | C110 | A108-C110 PolarHBondContact O-N 2.96Š| ||
| 109 | S | 43.8 | Very low | 49.4 | Very low | 99 Ų | 99 | 136.7 Ų | 136.7 | 69% | 0.692 | 76% | 0.756 | S | S | * | * | trans | -67.8 | 115.6 | 161.6 | 55.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 110 | C | 45.2 | Very low | 49.3 | Very low | 96 Ų | 96 | 132.1 Ų | 132.1 | 65% | 0.649 | 76% | 0.756 | S | S | * | * | trans | 78 | 117.9 | 170.7 | -68.9 | 0 | 0 | 0 | 0 | 116.4 | A108 | A108-C110 PolarHBondContact O-N 2.96Š| ||
| 111 | P | 48.8 | Very low | 48.6 | Very low | 118 Ų | 118 | 124.4 Ų | 124.4 | 77% | 0.766 | 75% | 0.747 | S | S | * | * | S | Bend | -148.1 | 107.6 | 82 | 35.3 | -15.8 | 0 | 0 | 0 | 113.4 | |||
| 112 | T | 46.8 | Very low | 48 | Very low | 129 Ų | 129 | 117.7 Ų | 117.7 | 79% | 0.791 | 74% | 0.743 | S | S | * | * | trans | -169.1 | 41.2 | 150.3 | 11.5 | 0 | 0 | 0 | 0 | 110.6 | L114 | T112-L114 PolarHBondContact O-N 2.65Š| ||
| 113 | L | 45.6 | Very low | 47.8 | Very low | 148 Ų | 148 | 116.3 Ų | 116.3 | 78% | 0.775 | 74% | 0.743 | S | S | * | * | trans | -74.7 | 72.8 | 149.2 | -71.4 | 174.2 | 0 | 0 | 0 | 107.3 | P115 | L113-P115 VanDerWaalsContact O-CD 3.32Å; L113-P115 WeakPolarHBondContact O-CD 3.49Å | ||
| 114 | L | 47.7 | Very low | 47.5 | Very low | 133 Ų | 133 | 117.7 Ų | 117.7 | 70% | 0.696 | 75% | 0.752 | S | S | * | * | trans | -106.1 | 75.4 | 154 | -83 | 166.8 | 0 | 0 | 0 | 107.2 | T112 F116 | T112-L114 PolarHBondContact O-N 2.65Å; L114-F116 HydrophobicContact CD2-CD2 4.17Å; L114-F116 PolarHBondContact O-N 3.37Å | ||
| 115 | P | 52.9 | Low | 47.5 | Very low | 109 Ų | 109 | 118.6 Ų | 118.6 | 71% | 0.708 | 75% | 0.754 | S | S | * | * | trans | -81 | 68.5 | 162.9 | 36.1 | -31.6 | 0 | 0 | 0 | 107.5 | L113 | L113-P115 VanDerWaalsContact O-CD 3.32Å; L113-P115 WeakPolarHBondContact O-CD 3.49Å | ||
| 116 | F | 41.6 | Very low | 47.1 | Very low | 181 Ų | 181 | 120 Ų | 120 | 79% | 0.794 | 76% | 0.758 | S | S | * | * | trans | -104.1 | 100.2 | 164.5 | -89.3 | -75.7 | 0 | 0 | 0 | 108.7 | L114 C118 | L114-F116 HydrophobicContact CD2-CD2 4.17Å; L114-F116 PolarHBondContact O-N 3.37Å; F116-C118 PolarHBondContact O-N 3.41Å | ||
| 117 | A | 48.2 | Very low | 46.9 | Very low | 100 Ų | 100 | 118.3 Ų | 118.3 | 83% | 0.826 | 76% | 0.757 | S | S | * | * | trans | -8 | 116.7 | 153.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 118 | C | 47.4 | Very low | 46.8 | Very low | 120 Ų | 120 | 116 Ų | 116 | 81% | 0.811 | 75% | 0.752 | S | S | * | * | trans | -147.2 | 88.8 | 156.3 | -159.9 | 0 | 0 | 0 | 0 | 111 | F116 | F116-C118 PolarHBondContact O-N 3.41Š| ||
| 119 | V | 47.6 | Very low | 47.2 | Very low | 121 Ų | 121 | 120.6 Ų | 120.6 | 73% | 0.733 | 76% | 0.756 | S | S | * | * | trans | 49.6 | 111 | 142.6 | -170.2 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 120 | P | 47.9 | Very low | 47.3 | Very low | 135 Ų | 135 | 120.9 Ų | 120.9 | 88% | 0.877 | 76% | 0.755 | S | S | * | * | trans | -76.5 | 119.4 | 158.6 | 3.3 | 14.6 | 0 | 0 | 0 | 109.6 | ||||
| 121 | G | 37.8 | Very low | 47.9 | Very low | 66 Ų | 66 | 121.9 Ų | 121.9 | 68% | 0.68 | 76% | 0.76 | S | S | * | * | trans | -157 | 107.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 122 | A | 39.6 | Very low | 48.2 | Very low | 98 Ų | 98 | 122 Ų | 122 | 81% | 0.81 | 76% | 0.759 | S | S | * | * | S | Bend | trans | 64.6 | 101.4 | 156.7 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||
| 123 | S | 39 | Very low | 48.5 | Very low | 96 Ų | 96 | 121.2 Ų | 121.2 | 67% | 0.671 | 75% | 0.753 | S | S | * | * | 143 | 103.6 | 115.7 | -60.6 | 0 | 0 | 0 | 0 | 111.8 | T125 | S123-T125 PolarHBondContact O-N 3.45Š| |||
| 124 | P | 51.7 | Low | 48.6 | Very low | 128 Ų | 128 | 121.6 Ų | 121.6 | 83% | 0.831 | 76% | 0.755 | S | S | * | * | trans | -71.8 | 95.7 | 169.5 | 29.5 | -30.4 | 0 | 0 | 0 | 108.7 | T126 | P124-T126 PolarHBondContact O-N 2.92Å; P124-T126 VanDerWaalsContact O-N 3.07Å | ||
| 125 | T | 54.9 | Low | 48.7 | Very low | 113 Ų | 113 | 121.4 Ų | 121.4 | 69% | 0.693 | 76% | 0.76 | S | S | * | * | trans | -75.1 | 99 | 168 | -54.2 | 0 | 0 | 0 | 0 | 107.3 | S123 L127 | S123-T125 PolarHBondContact O-N 3.45Å; T125-L127 VanDerWaalsContact C-N 3.26Å; T125-L127 HydrophobicContact CG2-CG 4.41Å; T125-L127 PolarHBondContact O-N 3.04Å | ||
| 126 | T | 45.4 | Very low | 48.4 | Very low | 127 Ų | 127 | 118.8 Ų | 118.8 | 78% | 0.779 | 75% | 0.752 | S | S | * | * | trans | -61 | 87 | 169.3 | -51.5 | 0 | 0 | 0 | 0 | 108.8 | P124 A128 | P124-T126 PolarHBondContact O-N 2.92Å; P124-T126 VanDerWaalsContact O-N 3.07Å; T126-A128 PolarHBondContact O-N 3.34Å; T126-A128 VanDerWaalsContact O-N 3.15Å | ||
| 127 | L | 53.4 | Low | 48.7 | Very low | 142 Ų | 142 | 116.2 Ų | 116.2 | 74% | 0.743 | 75% | 0.754 | S | S | * | * | trans | -78 | 97.4 | 163.7 | -82.1 | 174.2 | 0 | 0 | 0 | 107.6 | T125 F129 | T125-L127 VanDerWaalsContact C-N 3.26Å; T125-L127 HydrophobicContact CG2-CG 4.41Å; T125-L127 PolarHBondContact O-N 3.04Å; L127-F129 PolarHBondContact O-N 3.5Å; L127-F129 VanDerWaalsContact O-N 3.17Å | ||
| 128 | A | 46.8 | Very low | 48.6 | Very low | 87 Ų | 87 | 117.3 Ų | 117.3 | 72% | 0.719 | 76% | 0.755 | S | S | * | * | trans | -57.8 | 109.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | T126 | T126-A128 PolarHBondContact O-N 3.34Å; T126-A128 VanDerWaalsContact O-N 3.15Å | ||
| 129 | F | 58.2 | Low | 48.8 | Very low | 187 Ų | 187 | 117.2 Ų | 117.2 | 82% | 0.82 | 75% | 0.751 | S | S | * | * | trans | -74.8 | 123.1 | 162.2 | -70.1 | -83.3 | 0 | 0 | 0 | 107.8 | L127 | L127-F129 PolarHBondContact O-N 3.5Å; L127-F129 VanDerWaalsContact O-N 3.17Å | ||
| 130 | P | 47.7 | Very low | 49.3 | Very low | 105 Ų | 105 | 118.9 Ų | 118.9 | 68% | 0.682 | 76% | 0.756 | S | S | * | * | trans | -63.5 | 140 | 175.3 | 26 | -32.1 | 0 | 0 | 0 | 109.5 | V132 | P130-V132 PolarHBondContact O-N 3.15Š| ||
| 131 | P | 56.6 | Low | 49.3 | Very low | 116 Ų | 116 | 116 Ų | 116 | 75% | 0.753 | 75% | 0.751 | S | S | * | * | trans | -65.1 | 112.7 | -178.4 | 26.5 | -33 | 0 | 0 | 0 | 109.4 | V133 | P131-V133 VanDerWaalsContact C-N 3.3Å; P131-V133 PolarHBondContact O-N 3.44Å | ||
| 132 | V | 56.4 | Low | 50.2 | Low | 122 Ų | 122 | 119.5 Ų | 119.5 | 74% | 0.739 | 75% | 0.753 | S | S | * | * | trans | -67.9 | 95.9 | 165.1 | 177.7 | 0 | 0 | 0 | 0 | 106.4 | P130 L134 | P130-V132 PolarHBondContact O-N 3.15Å; V132-L134 VanDerWaalsContact C-N 3.29Å; V132-L134 HydrophobicContact CG1-CD1 4.15Å; V132-L134 PolarHBondContact O-N 2.98Å | ||
| 133 | V | 51.4 | Low | 50.5 | Low | 111 Ų | 111 | 120.7 Ų | 120.7 | 67% | 0.673 | 75% | 0.752 | S | S | * | * | trans | -68.9 | 93.5 | 170.2 | -174.2 | 0 | 0 | 0 | 0 | 106.6 | P131 T135 | P131-V133 VanDerWaalsContact C-N 3.3Å; P131-V133 PolarHBondContact O-N 3.44Å; V133-T135 HydrophobicContact CG1-CG2 3.73Å; V133-T135 PolarHBondContact O-N 3.01Å | ||
| 134 | L | 48.7 | Very low | 51 | Low | 157 Ų | 157 | 124.1 Ų | 124.1 | 82% | 0.822 | 76% | 0.756 | S | S | * | * | trans | -68.8 | 84.5 | 164.9 | -98.5 | 121.9 | 0 | 0 | 0 | 108 | V132 G136 | V132-L134 VanDerWaalsContact C-N 3.29Å; V132-L134 HydrophobicContact CG1-CD1 4.15Å; V132-L134 PolarHBondContact O-N 2.98Å; L134-G136 PolarHBondContact O-N 3.39Å | ||
| 135 | T | 49.3 | Very low | 51 | Low | 128 Ų | 128 | 122.1 Ų | 122.1 | 79% | 0.785 | 75% | 0.749 | S | S | * | * | trans | -71.5 | 80.8 | 162 | 51.2 | 0 | 0 | 0 | 0 | 108.4 | V133 | V133-T135 HydrophobicContact CG1-CG2 3.73Å; V133-T135 PolarHBondContact O-N 3.01Å | ||
| 136 | G | 46.3 | Very low | 50.5 | Low | 54 Ų | 54 | 122.1 Ų | 122.1 | 56% | 0.557 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 141.5 | 164.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | L134 | L134-G136 PolarHBondContact O-N 3.39Š|
| 137 | P | 47.6 | Very low | 50.8 | Low | 127 Ų | 127 | 120.9 Ų | 120.9 | 83% | 0.825 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 133.6 | -172 | 29.2 | -32.8 | 0 | 0 | 0 | 111.6 | T139 | P137-T139 PolarHBondContact O-N 2.85Š|
| 138 | S | 46.6 | Very low | 50.5 | Low | 123 Ų | 123 | 122.3 Ų | 122.3 | 86% | 0.86 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 120.4 | 169.7 | -63.4 | 0 | 0 | 0 | 0 | 111.7 | ||
| 139 | T | 51.6 | Low | 50.8 | Low | 118 Ų | 118 | 125.8 Ų | 125.8 | 72% | 0.724 | 75% | 0.75 | S | S | * | * | trans | -131.5 | 121.4 | 147.9 | 45.5 | 0 | 0 | 0 | 0 | 107 | P137 | P137-T139 PolarHBondContact O-N 2.85Š| ||
| 140 | D | 58.7 | Low | 50.4 | Low | 156 Ų | 156 | 128.7 Ų | 128.7 | 83% | 0.834 | 76% | 0.756 | S | S | * | * | S | Bend | trans | 80.9 | 100.9 | 170.4 | -48.4 | -53.8 | 0 | 0 | 0 | 115.9 | I142 | D140-I142 PolarHBondContact O-N 3.17Š|
| 141 | G | 46.7 | Very low | 50.8 | Low | 75 Ų | 75 | 129 Ų | 129 | 77% | 0.773 | 76% | 0.755 | S | S | * | * | trans | -57.5 | 124.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 142 | I | 57.2 | Low | 50.7 | Low | 139 Ų | 139 | 128.8 Ų | 128.8 | 71% | 0.713 | 75% | 0.754 | S | S | * | * | -174.1 | 118.4 | 115.6 | -82.2 | 148.3 | 0 | 0 | 0 | 104.3 | D140 F144 | D140-I142 PolarHBondContact O-N 3.17Å; I142-F144 HydrophobicContact CG2-CD2 4.14Å; I142-F144 PolarHBondContact O-N 3.16Å | |||
| 143 | P | 46.9 | Very low | 51 | Low | 123 Ų | 123 | 130.9 Ų | 130.9 | 80% | 0.799 | 75% | 0.753 | S | S | * | * | trans | -73.3 | 93.3 | 174.6 | 30.6 | -31.2 | 0 | 0 | 0 | 107.7 | A145 | P143-A145 PolarHBondContact O-N 3.07Š| ||
| 144 | F | 49.7 | Very low | 51.2 | Low | 169 Ų | 169 | 131.8 Ų | 131.8 | 74% | 0.741 | 76% | 0.759 | S | S | * | * | trans | -76.3 | 67.7 | 168.2 | -133 | -95.4 | 0 | 0 | 0 | 109 | I142 L146 | I142-F144 HydrophobicContact CG2-CD2 4.14Å; I142-F144 PolarHBondContact O-N 3.16Å; F144-L146 HydrophobicContact CD1-CB 4.07Å; F144-L146 HydrophobicContact CD1-CD1 4.33Å; F144-L146 HydrophobicContact CD1-CG 4.35Å; F144-L146 HydrophobicContact CE1-CB 4.1Å; F144-L146 HydrophobicContact CE1-CD1 3.65Å; F144-L146 HydrophobicContact CE1-CG 4.16Å; F144-L146 HydrophobicContact CZ-CD1 4.04Å; F144-L146 PolarHBondContact O-N 2.8Å | ||
| 145 | A | 50.9 | Low | 51.6 | Low | 85 Ų | 85 | 130.7 Ų | 130.7 | 70% | 0.702 | 75% | 0.753 | S | S | * | * | trans | -71.3 | 75.2 | 161.1 | 0 | 0 | 0 | 0 | 0 | 107.9 | P143 | P143-A145 PolarHBondContact O-N 3.07Š| ||
| 146 | L | 45.3 | Very low | 51.7 | Low | 114 Ų | 114 | 129.6 Ų | 129.6 | 60% | 0.597 | 75% | 0.748 | S | S | * | * | trans | -129.8 | 90.1 | 160.5 | -71.8 | -178 | 0 | 0 | 0 | 108.3 | F144 L148 | F144-L146 HydrophobicContact CD1-CB 4.07Å; F144-L146 HydrophobicContact CD1-CD1 4.33Å; F144-L146 HydrophobicContact CD1-CG 4.35Å; F144-L146 HydrophobicContact CE1-CB 4.1Å; F144-L146 HydrophobicContact CE1-CD1 3.65Å; F144-L146 HydrophobicContact CE1-CG 4.16Å; F144-L146 HydrophobicContact CZ-CD1 4.04Å; F144-L146 PolarHBondContact O-N 2.8Å; L146-L148 PolarHBondContact O-N 3.02Å | ||
| 147 | S | 50.4 | Low | 51.7 | Low | 100 Ų | 100 | 132 Ų | 132 | 70% | 0.699 | 76% | 0.756 | S | S | * | * | 35.5 | 66.9 | 120 | -55.4 | 0 | 0 | 0 | 0 | 114.7 | Q149 | S147-Q149 PolarHBondContact O-N 3.15Š| |||
| 148 | L | 48.3 | Very low | 52.3 | Low | 173 Ų | 173 | 131.4 Ų | 131.4 | 91% | 0.906 | 75% | 0.752 | S | S | * | * | trans | -71.2 | 75.8 | 153.4 | -68.3 | 179.6 | 0 | 0 | 0 | 107 | L146 R150 | L146-L148 PolarHBondContact O-N 3.02Å; L148-R150 PolarHBondContact O-N 2.95Å | ||
| 149 | Q | 51.6 | Low | 52.3 | Low | 160 Ų | 160 | 134.6 Ų | 134.6 | 75% | 0.748 | 75% | 0.754 | S | S | * | * | trans | -43.7 | 122.9 | 155.7 | -80.3 | 175.2 | -1.4 | 0 | 0 | 106.6 | S147 V151 | S147-Q149 PolarHBondContact O-N 3.15Å; Q149-V151 VanDerWaalsContact C-N 3.26Å; Q149-V151 PolarHBondContact O-N 3.05Å | ||
| 150 | R | 49.6 | Very low | 52.4 | Low | 248 Ų | 248 | 135.3 Ų | 135.3 | 94% | 0.936 | 76% | 0.758 | S | S | * | * | trans | -53.5 | 96.6 | 164.2 | -83.7 | 175.2 | 169.2 | 149.6 | -3.6 | 107.5 | L148 P152 | L148-R150 PolarHBondContact O-N 2.95Å; R150-P152 VanDerWaalsContact O-CD 3.28Å; R150-P152 WeakPolarHBondContact O-CD 3.32Å | ||
| 151 | V | 57.6 | Low | 52 | Low | 111 Ų | 111 | 132 Ų | 132 | 67% | 0.673 | 75% | 0.752 | S | S | * | * | trans | -90 | 108.5 | 163.6 | -178 | 0 | 0 | 0 | 0 | 105.7 | Q149 F153 | Q149-V151 VanDerWaalsContact C-N 3.26Å; Q149-V151 PolarHBondContact O-N 3.05Å; V151-F153 PolarHBondContact O-N 2.94Å | ||
| 152 | P | 53.1 | Low | 52 | Low | 111 Ų | 111 | 134.2 Ų | 134.2 | 72% | 0.721 | 76% | 0.756 | S | S | * | * | trans | -67.5 | 105.7 | 174.5 | 26.4 | -30.7 | 0 | 0 | 0 | 108.4 | R150 V154 | R150-P152 VanDerWaalsContact O-CD 3.28Å; R150-P152 WeakPolarHBondContact O-CD 3.32Å; P152-V154 PolarHBondContact O-N 2.97Å; P152-V154 VanDerWaalsContact O-N 3.16Å | ||
| 153 | F | 63.9 | Low | 51.5 | Low | 167 Ų | 167 | 135.1 Ų | 135.1 | 73% | 0.732 | 76% | 0.761 | S | S | * | * | trans | -79.7 | 97.4 | 176.8 | -161.6 | -113.7 | 0 | 0 | 0 | 109.1 | V151 L155 | V151-F153 PolarHBondContact O-N 2.94Å; F153-L155 HydrophobicContact CD1-CB 4.43Å; F153-L155 HydrophobicContact CD1-CD1 3.58Å; F153-L155 HydrophobicContact CD1-CG 3.9Å; F153-L155 HydrophobicContact CE1-CB 4.42Å; F153-L155 HydrophobicContact CE1-CD1 3.4Å; F153-L155 VanDerWaalsContact CE1-CD1 3.4Å; F153-L155 HydrophobicContact CE1-CG 3.5Å; F153-L155 VanDerWaalsContact CE1-CG 3.5Å; F153-L155 HydrophobicContact CZ-CG 4.49Å; F153-L155 PolarHBondContact O-N 2.93Å | ||
| 154 | V | 55 | Low | 51.6 | Low | 130 Ų | 130 | 134.5 Ų | 134.5 | 79% | 0.788 | 76% | 0.757 | S | S | * | * | trans | -78.7 | 105 | 166.6 | 178.9 | 0 | 0 | 0 | 0 | 107.1 | P152 | P152-V154 PolarHBondContact O-N 2.97Å; P152-V154 VanDerWaalsContact O-N 3.16Å | ||
| 155 | L | 57.7 | Low | 51.6 | Low | 133 Ų | 133 | 133.2 Ų | 133.2 | 70% | 0.696 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -81.4 | 126.8 | 178.6 | -125.1 | 141.8 | 0 | 0 | 0 | 109.6 | F153 | F153-L155 HydrophobicContact CD1-CB 4.43Å; F153-L155 HydrophobicContact CD1-CD1 3.58Å; F153-L155 HydrophobicContact CD1-CG 3.9Å; F153-L155 HydrophobicContact CE1-CB 4.42Å; F153-L155 HydrophobicContact CE1-CD1 3.4Å; F153-L155 VanDerWaalsContact CE1-CD1 3.4Å; F153-L155 HydrophobicContact CE1-CG 3.5Å; F153-L155 VanDerWaalsContact CE1-CG 3.5Å; F153-L155 HydrophobicContact CZ-CG 4.49Å; F153-L155 PolarHBondContact O-N 2.93Å |
| 156 | P | 50.6 | Low | 51.5 | Low | 105 Ų | 105 | 132.8 Ų | 132.8 | 68% | 0.682 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 140.6 | -170.5 | 21.5 | -23.6 | 0 | 0 | 0 | 113.1 | ||
| 157 | S | 46.7 | Very low | 51.8 | Low | 104 Ų | 104 | 134.9 Ų | 134.9 | 73% | 0.727 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 127.1 | 178 | -63.4 | 0 | 0 | 0 | 0 | 112 | Q159 | S157-Q159 PolarHBondContact O-N 3.19Š|
| 158 | P | 60.9 | Low | 52 | Low | 115 Ų | 115 | 135.4 Ų | 135.4 | 75% | 0.747 | 77% | 0.771 | S | S | * | * | trans | -69.6 | 102.1 | 170.7 | 26 | -30.2 | 0 | 0 | 0 | 109.7 | V160 | P158-V160 VanDerWaalsContact C-N 3.35Å; P158-V160 PolarHBondContact O-N 3.35Å; P158-V160 VanDerWaalsContact O-N 3.15Å | ||
| 159 | Q | 47 | Very low | 51.8 | Low | 190 Ų | 190 | 139 Ų | 139 | 89% | 0.888 | 77% | 0.773 | S | S | * | * | trans | -74.9 | 86.6 | 163.1 | -63.2 | 173.7 | 0.1 | 0 | 0 | 107.9 | S157 A161 | S157-Q159 PolarHBondContact O-N 3.19Å; Q159-A161 PolarHBondContact O-N 2.81Å | ||
| 160 | V | 52 | Low | 51.9 | Low | 133 Ų | 133 | 138.8 Ų | 138.8 | 81% | 0.806 | 81% | 0.813 | S | S | * | * | trans | -95.1 | 92.4 | 170.2 | -78.1 | 0 | 0 | 0 | 0 | 109.8 | P158 | P158-V160 VanDerWaalsContact C-N 3.35Å; P158-V160 PolarHBondContact O-N 3.35Å; P158-V160 VanDerWaalsContact O-N 3.15Å | ||
| 161 | A | 51 | Low | 52 | Low | 88 Ų | 88 | 133.4 Ų | 133.4 | 73% | 0.727 | 81% | 0.807 | S | S | * | * | trans | 13 | 102.6 | 150.6 | 0 | 0 | 0 | 0 | 0 | 117.5 | Q159 L163 | Q159-A161 PolarHBondContact O-N 2.81Å; A161-L163 PolarHBondContact O-N 2.98Å | ||
| 162 | S | 45.8 | Very low | 51.7 | Low | 121 Ų | 121 | 134.5 Ų | 134.5 | 85% | 0.846 | 81% | 0.814 | S | S | * | * | trans | -65.5 | 109.8 | 153.9 | -42.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 163 | L | 46.9 | Very low | 51.6 | Low | 157 Ų | 157 | 135.8 Ų | 135.8 | 82% | 0.822 | 82% | 0.82 | S | S | * | * | trans | -151.8 | 146.6 | 166.9 | -124.1 | 100.1 | 0 | 0 | 0 | 110.2 | A161 | A161-L163 PolarHBondContact O-N 2.98Š| ||
| 164 | P | 50.7 | Low | 50.9 | Low | 111 Ų | 111 | 134 Ų | 134 | 72% | 0.721 | 83% | 0.825 | S | S | * | * | -114.1 | 154.4 | -75.8 | 31.3 | -20.4 | 0 | 0 | 0 | 111.1 | G166 | P164-G166 PolarHBondContact O-N 2.97Š| |||
| 165 | L | 49.7 | Very low | 50.6 | Low | 142 Ų | 142 | 134.3 Ų | 134.3 | 74% | 0.743 | 83% | 0.827 | S | S | * | * | trans | -63.1 | 93.6 | 172.6 | -170.3 | 62.6 | 0 | 0 | 0 | 109.2 | H167 | L165-H167 VanDerWaalsContact CD2-CE1 3.49Å; L165-H167 WeakPolarHBondContact CD2-CE1 3.28Å; L165-H167 PolarHBondContact O-CD2 2.93Å; L165-H167 PolarHBondContact O-N 2.82Å; L165-H167 PolarHBondContact O-NE2 3.34Å | ||
| 166 | G | 47.2 | Very low | 50.2 | Low | 75 Ų | 75 | 134.3 Ų | 134.3 | 77% | 0.773 | 84% | 0.836 | S | S | * | * | trans | -80.3 | 98 | 172.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | P164 | P164-G166 PolarHBondContact O-N 2.97Š| ||
| 167 | H | 51.4 | Low | 50.1 | Low | 158 Ų | 158 | 136.4 Ų | 136.4 | 73% | 0.731 | 85% | 0.847 | S | S | * | * | trans | -71.6 | 127.3 | 170.3 | -52.4 | -97.9 | 0 | 0 | 0 | 109.4 | L165 | L165-H167 VanDerWaalsContact CD2-CE1 3.49Å; L165-H167 WeakPolarHBondContact CD2-CE1 3.28Å; L165-H167 PolarHBondContact O-CD2 2.93Å; L165-H167 PolarHBondContact O-N 2.82Å; L165-H167 PolarHBondContact O-NE2 3.34Å | ||
| 168 | S | 55.4 | Low | 50.4 | Low | 112 Ų | 112 | 138.9 Ų | 138.9 | 78% | 0.783 | 86% | 0.856 | S | S | * | * | trans | -151.9 | 98.3 | 160.8 | -166.2 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 169 | R | 44.2 | Very low | 49.5 | Very low | 249 Ų | 249 | 140.9 Ų | 140.9 | 94% | 0.94 | 87% | 0.865 | S | S | * | * | trans | 42.9 | 103.9 | 143.2 | -68.4 | -175.4 | 168.3 | 178.7 | -3.2 | 119.3 | ||||
| 170 | G | 52.9 | Low | 49.7 | Very low | 155 Ų | 155 | 136.5 Ų | 136.5 | 100% | 1.598 | 86% | 0.863 | S | S | * | * | trans | -116.5 | 0 | 134.9 | 0 | 0 | 0 | 0 | 0 | 107.8 |
Retrieved 170 of 170 residues in 74.4 ms
(Link to these results)