| 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 | 54.2 | Low | 58.8 | Low | 222 Ų | 222 | 126.1 Ų | 126.1 | 100% | 1.094 | 67% | 0.667 | S | S | * | * | 0 | 15 | 0 | -73.2 | 154.5 | 78.7 | 0 | 0 | 113.8 | |||||
| 2 | N | 54.8 | Low | 58.8 | Low | 138 Ų | 138 | 131.6 Ų | 131.6 | 74% | 0.738 | 67% | 0.672 | S | S | * | * | trans | -103.1 | -7 | -171.1 | -60.3 | -2.5 | 0 | 0 | 0 | 114.6 | ||||
| 3 | S | 57.8 | Low | 58.6 | Low | 93 Ų | 93 | 129.6 Ų | 129.6 | 65% | 0.65 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -80 | -39.2 | -175.4 | -165 | 0 | 0 | 0 | 0 | 113.2 | C5 L6 Q7 | S3-C5 VanDerWaalsContact C-N 3.32Å; S3-C5 PolarHBondContact O-N 3.38Å; S3-L6 PolarHBondContact O-N 3.35Å; S3-Q7 PolarHBondContact O-N 3.07Å |
| 4 | C | 58.3 | Low | 58.4 | Low | 94 Ų | 94 | 125.4 Ų | 125.4 | 64% | 0.635 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -64.9 | -29.8 | -179.6 | -84.8 | 0 | 0 | 0 | 0 | 114.4 | R8 | C4-R8 PolarHBondContact O-N 3.19Å |
| 5 | C | 58.2 | Low | 58.4 | Low | 86 Ų | 86 | 119.8 Ų | 119.8 | 58% | 0.581 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -72.7 | -37.4 | -178.1 | -65.8 | 0 | 0 | 0 | 0 | 112 | S3 V9 | S3-C5 VanDerWaalsContact C-N 3.32Å; S3-C5 PolarHBondContact O-N 3.38Å; C5-V9 WeakPolarHBondContact O-CG2 3.45Å; C5-V9 PolarHBondContact O-N 3.27Å |
| 6 | L | 59.1 | Low | 58.3 | Low | 125 Ų | 125 | 123.7 Ų | 123.7 | 65% | 0.654 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -71.4 | -39.1 | 178.5 | -70.3 | 175.4 | 0 | 0 | 0 | 111.8 | S3 R8 V9 L10 | S3-L6 PolarHBondContact O-N 3.35Å; L6-R8 VanDerWaalsContact C-N 3.31Å; L6-R8 PolarHBondContact O-N 2.75Å; L6-V9 PolarHBondContact O-N 3.49Å; L6-L10 PolarHBondContact O-N 2.78Å |
| 7 | Q | 60.9 | Low | 58.3 | Low | 127 Ų | 127 | 125.3 Ų | 125.3 | 59% | 0.593 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -58.3 | -43.7 | 176.3 | -161.1 | 110 | -16.2 | 0 | 0 | 111.8 | S3 V9 L10 E11 | S3-Q7 PolarHBondContact O-N 3.07Å; Q7-V9 PolarHBondContact O-N 2.98Å; Q7-L10 PolarHBondContact O-N 3.42Å; Q7-E11 PolarHBondContact O-N 3.02Å |
| 8 | R | 60.1 | Low | 58.4 | Low | 160 Ų | 160 | 125.7 Ų | 125.7 | 60% | 0.604 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -70.9 | -30.2 | -178.9 | -161.5 | 178.5 | -70.8 | 166.3 | -3.7 | 113.1 | C4 L6 R12 | C4-R8 PolarHBondContact O-N 3.19Å; L6-R8 VanDerWaalsContact C-N 3.31Å; L6-R8 PolarHBondContact O-N 2.75Å; R8-R12 WeakPolarHBondContact O-CG 3.4Å; R8-R12 PolarHBondContact O-N 3.03Å |
| 9 | V | 62.1 | Low | 58.5 | Low | 82 Ų | 82 | 121.7 Ų | 121.7 | 50% | 0.497 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -71.7 | -40 | 173 | 171.4 | 0 | 0 | 0 | 0 | 110.5 | C5 L6 Q7 R12 L13 | C5-V9 WeakPolarHBondContact O-CG2 3.45Å; C5-V9 PolarHBondContact O-N 3.27Å; L6-V9 PolarHBondContact O-N 3.49Å; Q7-V9 PolarHBondContact O-N 2.98Å; V9-R12 PolarHBondContact O-N 2.92Å; V9-L13 HydrophobicContact CG1-CD1 3.92Å; V9-L13 HydrophobicContact CG1-CG 4.43Å; V9-L13 VanDerWaalsContact O-CG 3.27Å; V9-L13 WeakPolarHBondContact O-CG 3.36Å; V9-L13 PolarHBondContact O-N 2.84Å |
| 10 | L | 60.8 | Low | 59 | Low | 128 Ų | 128 | 118.2 Ų | 118.2 | 67% | 0.67 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -68.2 | -38.9 | -179.9 | -134.5 | 136.7 | 0 | 0 | 0 | 112.3 | L6 Q7 L13 S14 | L6-L10 PolarHBondContact O-N 2.78Å; Q7-L10 PolarHBondContact O-N 3.42Å; L10-L13 PolarHBondContact O-N 3.43Å; L10-S14 WeakPolarHBondContact O-CB 3.39Å; L10-S14 PolarHBondContact O-N 2.98Å |
| 11 | E | 60.3 | Low | 59.6 | Low | 132 Ų | 132 | 118.3 Ų | 118.3 | 62% | 0.617 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -64.6 | -40.6 | 172.5 | -74.7 | -177.6 | 176 | 0 | 0 | 112.6 | Q7 S14 G15 | Q7-E11 PolarHBondContact O-N 3.02Å; E11-S14 PolarHBondContact O-N 2.87Å; E11-G15 PolarHBondContact O-N 2.93Å |
| 12 | R | 59.2 | Low | 60.5 | Low | 192 Ų | 192 | 113 Ų | 113 | 73% | 0.725 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -64.3 | -39.2 | 174.3 | -77.9 | -175.4 | -176.8 | -141.1 | 1.2 | 112.4 | R8 V9 S14 G15 Y16 | R8-R12 WeakPolarHBondContact O-CG 3.4Å; R8-R12 PolarHBondContact O-N 3.03Å; V9-R12 PolarHBondContact O-N 2.92Å; R12-S14 VanDerWaalsContact C-N 3.34Å; R12-G15 PolarHBondContact O-N 2.85Å; R12-Y16 WeakPolarHBondContact O-CB 3.02Å; R12-Y16 PolarHBondContact O-N 2.92Å |
| 13 | L | 56.3 | Low | 61.7 | Low | 106 Ų | 106 | 111.6 Ų | 111.6 | 56% | 0.555 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -68.2 | -34.3 | 176.1 | -70.9 | 169.1 | 0 | 0 | 0 | 112.1 | V9 L10 K17 | V9-L13 HydrophobicContact CG1-CD1 3.92Å; V9-L13 HydrophobicContact CG1-CG 4.43Å; V9-L13 VanDerWaalsContact O-CG 3.27Å; V9-L13 WeakPolarHBondContact O-CG 3.36Å; V9-L13 PolarHBondContact O-N 2.84Å; L10-L13 PolarHBondContact O-N 3.43Å; L13-K17 PolarHBondContact O-N 3.13Å |
| 14 | S | 55.8 | Low | 62.8 | Low | 70 Ų | 70 | 110.3 Ų | 110.3 | 49% | 0.49 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -67.3 | -44.9 | 174.5 | -172 | 0 | 0 | 0 | 0 | 112.1 | L10 E11 R12 Y16 K17 M18 | L10-S14 WeakPolarHBondContact O-CB 3.39Å; L10-S14 PolarHBondContact O-N 2.98Å; E11-S14 PolarHBondContact O-N 2.87Å; R12-S14 VanDerWaalsContact C-N 3.34Å; S14-Y16 VanDerWaalsContact C-N 3.32Å; S14-Y16 PolarHBondContact O-N 2.88Å; S14-K17 PolarHBondContact O-N 2.8Å; S14-M18 PolarHBondContact O-N 3.22Å |
| 15 | G | 58.3 | Low | 64 | Low | 42 Ų | 42 | 111.9 Ų | 111.9 | 43% | 0.433 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -62.6 | -36.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | E11 R12 K17 M18 A19 | E11-G15 PolarHBondContact O-N 2.93Å; R12-G15 PolarHBondContact O-N 2.85Å; G15-K17 VanDerWaalsContact C-N 3.34Å; G15-K17 PolarHBondContact O-N 3.37Å; G15-M18 PolarHBondContact O-N 3.42Å; G15-A19 WeakPolarHBondContact O-CB 3.06Å; G15-A19 PolarHBondContact O-N 3.43Å |
| 16 | Y | 57.2 | Low | 65.3 | Low | 182 Ų | 182 | 115.4 Ų | 115.4 | 71% | 0.714 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -65.4 | -36.3 | 176.6 | -152 | -91.6 | 0 | 0 | 0 | 112.3 | R12 S14 S20 | R12-Y16 WeakPolarHBondContact O-CB 3.02Å; R12-Y16 PolarHBondContact O-N 2.92Å; S14-Y16 VanDerWaalsContact C-N 3.32Å; S14-Y16 PolarHBondContact O-N 2.88Å; Y16-S20 WeakPolarHBondContact O-CB 3.39Å; Y16-S20 PolarHBondContact O-N 2.7Å |
| 17 | K | 58.5 | Low | 66.7 | Low | 151 Ų | 151 | 114 Ų | 114 | 66% | 0.657 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65.6 | -44.5 | 175.2 | -76.4 | -178.7 | 176.6 | -179.2 | 0 | 112.5 | L13 S14 G15 Q21 | L13-K17 PolarHBondContact O-N 3.13Å; S14-K17 PolarHBondContact O-N 2.8Å; G15-K17 VanDerWaalsContact C-N 3.34Å; G15-K17 PolarHBondContact O-N 3.37Å; K17-Q21 WeakPolarHBondContact O-CB 3.14Å; K17-Q21 VanDerWaalsContact O-CG 3.29Å; K17-Q21 WeakPolarHBondContact O-CG 3.39Å; K17-Q21 PolarHBondContact O-N 3.14Å |
| 18 | M | 59.1 | Low | 68 | Low | 133 Ų | 133 | 113.3 Ų | 113.3 | 66% | 0.655 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -67.4 | -42.9 | 179.9 | -66.7 | -86.5 | -111.6 | 0 | 0 | 111.8 | S14 G15 Q21 Q22 | S14-M18 PolarHBondContact O-N 3.22Å; G15-M18 PolarHBondContact O-N 3.42Å; M18-Q21 PolarHBondContact O-N 2.9Å; M18-Q22 PolarHBondContact O-N 3.17Å; M18-Q22 VanDerWaalsContact O-N 3.09Å |
| 19 | A | 61.1 | Low | 69.4 | Low | 49 Ų | 49 | 107.6 Ų | 107.6 | 41% | 0.405 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -67.7 | -40.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | G15 Q22 L23 | G15-A19 WeakPolarHBondContact O-CB 3.06Å; G15-A19 PolarHBondContact O-N 3.43Å; A19-Q22 PolarHBondContact O-N 3.11Å; A19-L23 WeakPolarHBondContact O-CB 3.47Å; A19-L23 VanDerWaalsContact O-CG 3.3Å; A19-L23 WeakPolarHBondContact O-CG 3.09Å; A19-L23 PolarHBondContact O-N 2.87Å |
| 20 | S | 67.6 | Low | 70.7 | Confident | 52 Ų | 52 | 109 Ų | 109 | 36% | 0.364 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.6 | -39.5 | 175.2 | -178.7 | 0 | 0 | 0 | 0 | 111.9 | Y16 L23 C24 | Y16-S20 WeakPolarHBondContact O-CB 3.39Å; Y16-S20 PolarHBondContact O-N 2.7Å; S20-L23 PolarHBondContact O-N 2.93Å; S20-C24 WeakPolarHBondContact O-CB 3.5Å; S20-C24 PolarHBondContact O-N 3.41Å; S20-C24 PolarHBondContact O-SG 3.28Å |
| 21 | Q | 71.1 | Confident | 71.9 | Confident | 120 Ų | 120 | 105.2 Ų | 105.2 | 56% | 0.561 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -64.2 | -43.8 | 175.9 | -79.4 | 176.8 | -20.8 | 0 | 0 | 111.5 | K17 M18 L23 C24 L25 | K17-Q21 WeakPolarHBondContact O-CB 3.14Å; K17-Q21 VanDerWaalsContact O-CG 3.29Å; K17-Q21 WeakPolarHBondContact O-CG 3.39Å; K17-Q21 PolarHBondContact O-N 3.14Å; M18-Q21 PolarHBondContact O-N 2.9Å; Q21-L23 VanDerWaalsContact C-N 3.33Å; Q21-L23 PolarHBondContact O-N 3.25Å; Q21-C24 PolarHBondContact O-N 3.4Å; Q21-L25 WeakPolarHBondContact O-CG 3.49Å; Q21-L25 PolarHBondContact O-N 2.91Å |
| 22 | Q | 73.8 | Confident | 73.1 | Confident | 112 Ų | 112 | 101.3 Ų | 101.3 | 52% | 0.523 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.2 | -38.1 | 177.1 | -166.7 | 176 | 9.6 | 0 | 0 | 112.3 | M18 A19 R26 | M18-Q22 PolarHBondContact O-N 3.17Å; M18-Q22 VanDerWaalsContact O-N 3.09Å; A19-Q22 PolarHBondContact O-N 3.11Å; Q22-R26 WeakPolarHBondContact O-CG 3.25Å; Q22-R26 PolarHBondContact O-N 3.03Å; Q22-R26 VanDerWaalsContact O-N 3.08Å |
| 23 | L | 80.3 | Confident | 74.3 | Confident | 108 Ų | 108 | 97.5 Ų | 97.5 | 57% | 0.565 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -66.2 | -44.7 | 173.3 | -72.9 | 167.4 | 0 | 0 | 0 | 111.7 | A19 S20 Q21 L25 R26 V27 | A19-L23 WeakPolarHBondContact O-CB 3.47Å; A19-L23 VanDerWaalsContact O-CG 3.3Å; A19-L23 WeakPolarHBondContact O-CG 3.09Å; A19-L23 PolarHBondContact O-N 2.87Å; S20-L23 PolarHBondContact O-N 2.93Å; Q21-L23 VanDerWaalsContact C-N 3.33Å; Q21-L23 PolarHBondContact O-N 3.25Å; L23-L25 VanDerWaalsContact C-N 3.35Å; L23-L25 PolarHBondContact O-N 3.04Å; L23-R26 PolarHBondContact O-N 3.4Å; L23-V27 VanDerWaalsContact O-CG2 3.31Å; L23-V27 WeakPolarHBondContact O-CG2 3.34Å; L23-V27 PolarHBondContact O-N 2.84Å |
| 24 | C | 81.1 | Confident | 75.6 | Confident | 66 Ų | 66 | 97.8 Ų | 97.8 | 45% | 0.446 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -59.8 | -43.9 | 175.8 | -71.7 | 0 | 0 | 0 | 0 | 111.8 | S20 Q21 R26 V27 I28 | S20-C24 WeakPolarHBondContact O-CB 3.5Å; S20-C24 PolarHBondContact O-N 3.41Å; S20-C24 PolarHBondContact O-SG 3.28Å; Q21-C24 PolarHBondContact O-N 3.4Å; C24-R26 VanDerWaalsContact C-N 3.34Å; C24-R26 PolarHBondContact O-N 3.06Å; C24-V27 PolarHBondContact O-N 3Å; C24-I28 WeakPolarHBondContact O-CB 3.5Å; C24-I28 WeakPolarHBondContact O-CD1 3.37Å; C24-I28 WeakPolarHBondContact O-CG1 3.43Å; C24-I28 PolarHBondContact O-N 3.18Å |
| 25 | L | 83.7 | Confident | 76.7 | Confident | 126 Ų | 126 | 98.4 Ų | 98.4 | 66% | 0.66 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -62.9 | -39.7 | 176.8 | -69.3 | 175.3 | 0 | 0 | 0 | 112 | Q21 L23 G29 | Q21-L25 WeakPolarHBondContact O-CG 3.49Å; Q21-L25 PolarHBondContact O-N 2.91Å; L23-L25 VanDerWaalsContact C-N 3.35Å; L23-L25 PolarHBondContact O-N 3.04Å; L25-G29 PolarHBondContact O-N 2.82Å |
| 26 | R | 85.3 | Confident | 77.5 | Confident | 160 Ų | 160 | 102.7 Ų | 102.7 | 60% | 0.604 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -65.7 | -43.5 | 175.5 | -74.2 | -178.8 | 179.7 | -160.8 | 2.1 | 112.2 | Q22 L23 C24 G29 L30 | Q22-R26 WeakPolarHBondContact O-CG 3.25Å; Q22-R26 PolarHBondContact O-N 3.03Å; Q22-R26 VanDerWaalsContact O-N 3.08Å; L23-R26 PolarHBondContact O-N 3.4Å; C24-R26 VanDerWaalsContact C-N 3.34Å; C24-R26 PolarHBondContact O-N 3.06Å; R26-G29 PolarHBondContact O-N 3.34Å; R26-L30 WeakPolarHBondContact O-CG 3.47Å; R26-L30 PolarHBondContact O-N 3.21Å |
| 27 | V | 88.3 | Confident | 78.3 | Confident | 97 Ų | 97 | 97.9 Ų | 97.9 | 59% | 0.588 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.5 | -42 | 178 | 172.9 | 0 | 0 | 0 | 0 | 111 | L23 C24 L30 A31 | L23-V27 VanDerWaalsContact O-CG2 3.31Å; L23-V27 WeakPolarHBondContact O-CG2 3.34Å; L23-V27 PolarHBondContact O-N 2.84Å; C24-V27 PolarHBondContact O-N 3Å; V27-L30 PolarHBondContact O-N 3.47Å; V27-A31 WeakPolarHBondContact O-CB 3.46Å; V27-A31 PolarHBondContact O-N 2.87Å |
| 28 | I | 88.3 | Confident | 78.8 | Confident | 111 Ų | 111 | 94.7 Ų | 94.7 | 57% | 0.569 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.7 | -43 | 175.4 | -68.4 | 163 | 0 | 0 | 0 | 110.7 | C24 A31 A32 | C24-I28 WeakPolarHBondContact O-CB 3.5Å; C24-I28 WeakPolarHBondContact O-CD1 3.37Å; C24-I28 WeakPolarHBondContact O-CG1 3.43Å; C24-I28 PolarHBondContact O-N 3.18Å; I28-A31 PolarHBondContact O-N 3.39Å; I28-A32 WeakPolarHBondContact O-CB 3.49Å; I28-A32 PolarHBondContact O-N 3.31Å |
| 29 | G | 89.9 | Confident | 78.9 | Confident | 41 Ų | 41 | 95 Ų | 95 | 42% | 0.423 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.9 | -43.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | L25 R26 A32 L33 | L25-G29 PolarHBondContact O-N 2.82Å; R26-G29 PolarHBondContact O-N 3.34Å; G29-A32 PolarHBondContact O-N 3.3Å; G29-L33 PolarHBondContact O-N 3.46Å |
| 30 | L | 88.6 | Confident | 78.7 | Confident | 111 Ų | 111 | 94.6 Ų | 94.6 | 58% | 0.581 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65.6 | -42.2 | 175.8 | -71.4 | 173.5 | 0 | 0 | 0 | 112 | R26 V27 L33 L34 | R26-L30 WeakPolarHBondContact O-CG 3.47Å; R26-L30 PolarHBondContact O-N 3.21Å; V27-L30 PolarHBondContact O-N 3.47Å; L30-L33 PolarHBondContact O-N 2.86Å; L30-L34 WeakPolarHBondContact O-CB 3Å; L30-L34 WeakPolarHBondContact O-CG 3.4Å; L30-L34 PolarHBondContact O-N 3.45Å |
| 31 | A | 85.5 | Confident | 78 | Confident | 49 Ų | 49 | 97.5 Ų | 97.5 | 41% | 0.405 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.5 | -43.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | V27 I28 L33 L34 T35 | V27-A31 WeakPolarHBondContact O-CB 3.46Å; V27-A31 PolarHBondContact O-N 2.87Å; I28-A31 PolarHBondContact O-N 3.39Å; A31-L33 PolarHBondContact O-N 3.18Å; A31-L34 PolarHBondContact O-N 2.92Å; A31-T35 WeakPolarHBondContact O-CG2 3.19Å; A31-T35 PolarHBondContact O-N 3.31Å; A31-T35 PolarHBondContact O-OG1 2.85Å |
| 32 | A | 86.2 | Confident | 77.2 | Confident | 50 Ų | 50 | 96.9 Ų | 96.9 | 41% | 0.413 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -60.9 | -45.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | I28 G29 L34 T35 L36 | I28-A32 WeakPolarHBondContact O-CB 3.49Å; I28-A32 PolarHBondContact O-N 3.31Å; G29-A32 PolarHBondContact O-N 3.3Å; A32-L34 PolarHBondContact O-N 3.48Å; A32-T35 WeakPolarHBondContact CA-OG1 3.32Å; A32-T35 PolarHBondContact O-N 2.67Å; A32-T35 PolarHBondContact O-OG1 3.49Å; A32-L36 PolarHBondContact O-N 3.36Å |
| 33 | L | 84.8 | Confident | 76.1 | Confident | 111 Ų | 111 | 95.3 Ų | 95.3 | 58% | 0.581 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -59.8 | -46.3 | 176.7 | -162.8 | 89.4 | 0 | 0 | 0 | 111.5 | G29 L30 A31 T35 L36 T37 | G29-L33 PolarHBondContact O-N 3.46Å; L30-L33 PolarHBondContact O-N 2.86Å; A31-L33 PolarHBondContact O-N 3.18Å; L33-T35 PolarHBondContact O-N 3.31Å; L33-L36 PolarHBondContact O-N 2.94Å; L33-L36 VanDerWaalsContact O-N 3.17Å; L33-T37 WeakPolarHBondContact O-CG2 3.49Å; L33-T37 PolarHBondContact O-N 3.19Å; L33-T37 PolarHBondContact O-OG1 3.5Å |
| 34 | L | 83.5 | Confident | 74.9 | Confident | 112 Ų | 112 | 92.2 Ų | 92.2 | 59% | 0.586 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.7 | -38.4 | 177.8 | -73.9 | 166.8 | 0 | 0 | 0 | 112.4 | L30 A31 A32 L36 T37 T38 | L30-L34 WeakPolarHBondContact O-CB 3Å; L30-L34 WeakPolarHBondContact O-CG 3.4Å; L30-L34 PolarHBondContact O-N 3.45Å; A31-L34 PolarHBondContact O-N 2.92Å; A32-L34 PolarHBondContact O-N 3.48Å; L34-L36 VanDerWaalsContact C-N 3.33Å; L34-T37 WeakPolarHBondContact CA-OG1 3.37Å; L34-T37 PolarHBondContact O-OG1 2.87Å; L34-T38 WeakPolarHBondContact O-CB 3.27Å; L34-T38 VanDerWaalsContact O-CG2 3.3Å; L34-T38 WeakPolarHBondContact O-CG2 3.32Å; L34-T38 PolarHBondContact O-N 3.31Å; L34-T38 VanDerWaalsContact O-N 3.08Å; L34-T38 PolarHBondContact O-OG1 2.98Å |
| 35 | T | 78.2 | Confident | 73.8 | Confident | 83 Ų | 83 | 95.5 Ų | 95.5 | 51% | 0.509 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66.9 | -36.4 | 173.9 | 56.1 | 0 | 0 | 0 | 0 | 111.7 | A31 A32 L33 T38 L39 | A31-T35 WeakPolarHBondContact O-CG2 3.19Å; A31-T35 PolarHBondContact O-N 3.31Å; A31-T35 PolarHBondContact O-OG1 2.85Å; A32-T35 WeakPolarHBondContact CA-OG1 3.32Å; A32-T35 PolarHBondContact O-N 2.67Å; A32-T35 PolarHBondContact O-OG1 3.49Å; L33-T35 PolarHBondContact O-N 3.31Å; T35-T38 WeakPolarHBondContact CA-OG1 3.31Å; T35-T38 PolarHBondContact O-OG1 2.86Å; T35-L39 VanDerWaalsContact O-CB 3.32Å; T35-L39 WeakPolarHBondContact O-CB 3.44Å; T35-L39 PolarHBondContact O-N 3.29Å |
| 36 | L | 76.1 | Confident | 72.9 | Confident | 133 Ų | 133 | 92.6 Ų | 92.6 | 70% | 0.696 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -69.3 | -39.3 | 178.5 | -136.7 | 73.7 | 0 | 0 | 0 | 112.1 | A32 L33 L34 G40 | A32-L36 PolarHBondContact O-N 3.36Å; L33-L36 PolarHBondContact O-N 2.94Å; L33-L36 VanDerWaalsContact O-N 3.17Å; L34-L36 VanDerWaalsContact C-N 3.33Å; L36-G40 PolarHBondContact O-N 3.06Å |
| 37 | T | 73.4 | Confident | 72 | Confident | 80 Ų | 80 | 89.8 Ų | 89.8 | 49% | 0.491 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -70 | -38.8 | 178.1 | 54.9 | 0 | 0 | 0 | 0 | 111.9 | L33 L34 D41 | L33-T37 WeakPolarHBondContact O-CG2 3.49Å; L33-T37 PolarHBondContact O-N 3.19Å; L33-T37 PolarHBondContact O-OG1 3.5Å; L34-T37 WeakPolarHBondContact CA-OG1 3.37Å; L34-T37 PolarHBondContact O-OG1 2.87Å; T37-D41 PolarHBondContact O-N 3.26Å |
| 38 | T | 69.8 | Low | 70.8 | Confident | 85 Ų | 85 | 89.8 Ų | 89.8 | 52% | 0.521 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -74.5 | -36.8 | 179 | 52.2 | 0 | 0 | 0 | 0 | 113.3 | L34 T35 | L34-T38 WeakPolarHBondContact O-CB 3.27Å; L34-T38 VanDerWaalsContact O-CG2 3.3Å; L34-T38 WeakPolarHBondContact O-CG2 3.32Å; L34-T38 PolarHBondContact O-N 3.31Å; L34-T38 VanDerWaalsContact O-N 3.08Å; L34-T38 PolarHBondContact O-OG1 2.98Å; T35-T38 WeakPolarHBondContact CA-OG1 3.31Å; T35-T38 PolarHBondContact O-OG1 2.86Å |
| 39 | L | 59.8 | Low | 69.8 | Low | 138 Ų | 138 | 90.9 Ų | 90.9 | 72% | 0.723 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -76.3 | -30.4 | 175.7 | -131.6 | 71.3 | 0 | 0 | 0 | 112.5 | T35 S43 | T35-L39 VanDerWaalsContact O-CB 3.32Å; T35-L39 WeakPolarHBondContact O-CB 3.44Å; T35-L39 PolarHBondContact O-N 3.29Å; L39-S43 PolarHBondContact O-N 3.24Å |
| 40 | G | 58.6 | Low | 68.9 | Low | 41 Ų | 41 | 96.2 Ų | 96.2 | 42% | 0.423 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66.1 | -37 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | L36 S44 | L36-G40 PolarHBondContact O-N 3.06Å; G40-S44 PolarHBondContact O-N 3.25Å |
| 41 | D | 51.8 | Low | 68 | Low | 114 Ų | 114 | 94.4 Ų | 94.4 | 61% | 0.61 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -64.6 | -46.1 | 179.2 | -120.6 | -5.4 | 0 | 0 | 0 | 111.5 | T37 S43 S44 | T37-D41 PolarHBondContact O-N 3.26Å; D41-S43 PolarHBondContact O-N 3.47Å; D41-S44 PolarHBondContact O-N 3.48Å; D41-S44 PolarHBondContact O-OG 3.39Å |
| 42 | V | 55.4 | Low | 67.2 | Low | 107 Ų | 107 | 97 Ų | 97 | 65% | 0.648 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -68.1 | -33.2 | -177.7 | 178.7 | 0 | 0 | 0 | 0 | 112.8 | S44 | V42-S44 VanDerWaalsContact C-N 3.34Å |
| 43 | S | 49.5 | Very low | 66.3 | Low | 78 Ų | 78 | 99 Ų | 99 | 55% | 0.545 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -70.6 | -31.6 | 177 | -174.7 | 0 | 0 | 0 | 0 | 112.3 | L39 D41 | L39-S43 PolarHBondContact O-N 3.24Å; D41-S43 PolarHBondContact O-N 3.47Å |
| 44 | S | 56.3 | Low | 65.4 | Low | 43 Ų | 43 | 101.5 Ų | 101.5 | 30% | 0.301 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -73.6 | -35.6 | -175.4 | 79.6 | 0 | 0 | 0 | 0 | 113.3 | G40 D41 V42 S46 L47 L48 | G40-S44 PolarHBondContact O-N 3.25Å; D41-S44 PolarHBondContact O-N 3.48Å; D41-S44 PolarHBondContact O-OG 3.39Å; V42-S44 VanDerWaalsContact C-N 3.34Å; S44-S46 PolarHBondContact O-N 3.47Å; S44-L47 PolarHBondContact O-N 3.2Å; S44-L48 VanDerWaalsContact O-CB 3.31Å; S44-L48 WeakPolarHBondContact O-CB 3.33Å; S44-L48 WeakPolarHBondContact O-CG 3.02Å; S44-L48 PolarHBondContact O-N 2.74Å |
| 45 | E | 57.6 | Low | 64.2 | Low | 136 Ų | 136 | 104.4 Ų | 104.4 | 64% | 0.636 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.1 | -45.4 | -174.7 | -70.4 | -169.4 | 152.5 | 0 | 0 | 112.3 | L47 Q49 | E45-L47 VanDerWaalsContact C-N 3.34Å; E45-L47 PolarHBondContact O-N 3.41Å; E45-Q49 WeakPolarHBondContact O-CB 3.25Å; E45-Q49 PolarHBondContact O-N 3.17Å |
| 46 | S | 63.4 | Low | 63.1 | Low | 65 Ų | 65 | 105 Ų | 105 | 46% | 0.455 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -70.8 | -29 | -178.9 | 75.5 | 0 | 0 | 0 | 0 | 113.6 | S44 K50 | S44-S46 PolarHBondContact O-N 3.47Å; S46-K50 WeakPolarHBondContact O-CB 3.42Å; S46-K50 VanDerWaalsContact O-CG 3.27Å; S46-K50 WeakPolarHBondContact O-CG 3.36Å; S46-K50 PolarHBondContact O-N 2.78Å |
| 47 | L | 67.6 | Low | 62.1 | Low | 100 Ų | 100 | 101.8 Ų | 101.8 | 52% | 0.524 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -81.3 | -40.3 | 179.8 | -150.7 | 156.9 | 0 | 0 | 0 | 110.1 | S44 E45 K50 I51 | S44-L47 PolarHBondContact O-N 3.2Å; E45-L47 VanDerWaalsContact C-N 3.34Å; E45-L47 PolarHBondContact O-N 3.41Å; L47-K50 PolarHBondContact O-N 3.44Å; L47-I51 HydrophobicContact CD2-CD1 3.45Å; L47-I51 VanDerWaalsContact CD2-CD1 3.45Å; L47-I51 HydrophobicContact CD2-CG1 4.08Å; L47-I51 VanDerWaalsContact O-CG1 3.26Å; L47-I51 WeakPolarHBondContact O-CG1 3.36Å; L47-I51 PolarHBondContact O-N 2.93Å |
| 48 | L | 63.1 | Low | 61.1 | Low | 97 Ų | 97 | 101.1 Ų | 101.1 | 51% | 0.508 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -62.6 | -45.5 | 170.8 | -70.7 | 174.6 | 0 | 0 | 0 | 111.5 | S44 K50 I51 L52 | S44-L48 VanDerWaalsContact O-CB 3.31Å; S44-L48 WeakPolarHBondContact O-CB 3.33Å; S44-L48 WeakPolarHBondContact O-CG 3.02Å; S44-L48 PolarHBondContact O-N 2.74Å; L48-K50 VanDerWaalsContact C-N 3.33Å; L48-K50 PolarHBondContact O-N 3Å; L48-I51 PolarHBondContact O-N 2.89Å; L48-L52 WeakPolarHBondContact O-CB 3.36Å; L48-L52 WeakPolarHBondContact O-CG 3.48Å; L48-L52 PolarHBondContact O-N 2.82Å |
| 49 | Q | 67.1 | Low | 60.1 | Low | 134 Ų | 134 | 102.5 Ų | 102.5 | 63% | 0.626 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -59.2 | -44.2 | 173.6 | -109.9 | -178.4 | -4.3 | 0 | 0 | 111.6 | E45 I51 L52 V53 | E45-Q49 WeakPolarHBondContact O-CB 3.25Å; E45-Q49 PolarHBondContact O-N 3.17Å; Q49-I51 VanDerWaalsContact C-N 3.33Å; Q49-I51 PolarHBondContact O-N 3.45Å; Q49-L52 PolarHBondContact O-N 2.91Å; Q49-V53 WeakPolarHBondContact O-CB 3.21Å; Q49-V53 VanDerWaalsContact O-CG2 3.25Å; Q49-V53 WeakPolarHBondContact O-CG2 3.26Å; Q49-V53 PolarHBondContact O-N 2.94Å |
| 50 | K | 69.8 | Low | 59.5 | Low | 154 Ų | 154 | 100 Ų | 100 | 67% | 0.67 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.2 | -37.6 | 175.6 | -80.7 | 175.2 | 176.9 | 177.5 | 0 | 112.4 | S46 L47 L48 K54 | S46-K50 WeakPolarHBondContact O-CB 3.42Å; S46-K50 VanDerWaalsContact O-CG 3.27Å; S46-K50 WeakPolarHBondContact O-CG 3.36Å; S46-K50 PolarHBondContact O-N 2.78Å; L47-K50 PolarHBondContact O-N 3.44Å; L48-K50 VanDerWaalsContact C-N 3.33Å; L48-K50 PolarHBondContact O-N 3Å; K50-K54 WeakPolarHBondContact O-CB 3.37Å; K50-K54 PolarHBondContact O-N 3.32Å |
| 51 | I | 71.4 | Confident | 58.9 | Low | 73 Ų | 73 | 106.6 Ų | 106.6 | 37% | 0.374 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -68.8 | -41.3 | 176 | -70.5 | 168.5 | 0 | 0 | 0 | 111.1 | L47 L48 Q49 R55 | L47-I51 HydrophobicContact CD2-CD1 3.45Å; L47-I51 VanDerWaalsContact CD2-CD1 3.45Å; L47-I51 HydrophobicContact CD2-CG1 4.08Å; L47-I51 VanDerWaalsContact O-CG1 3.26Å; L47-I51 WeakPolarHBondContact O-CG1 3.36Å; L47-I51 PolarHBondContact O-N 2.93Å; L48-I51 PolarHBondContact O-N 2.89Å; Q49-I51 VanDerWaalsContact C-N 3.33Å; Q49-I51 PolarHBondContact O-N 3.45Å; I51-R55 WeakPolarHBondContact O-CB 3.47Å; I51-R55 PolarHBondContact O-N 2.87Å |
| 52 | L | 67.6 | Low | 58.5 | Low | 103 Ų | 103 | 108.6 Ų | 108.6 | 54% | 0.539 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -67.4 | -47.7 | 177.8 | -72.4 | 170.3 | 0 | 0 | 0 | 111.3 | L48 Q49 K54 R55 N56 | L48-L52 WeakPolarHBondContact O-CB 3.36Å; L48-L52 WeakPolarHBondContact O-CG 3.48Å; L48-L52 PolarHBondContact O-N 2.82Å; Q49-L52 PolarHBondContact O-N 2.91Å; L52-K54 VanDerWaalsContact C-N 3.35Å; L52-K54 PolarHBondContact O-N 3.32Å; L52-R55 PolarHBondContact O-N 2.95Å; L52-N56 WeakPolarHBondContact O-CB 3.38Å; L52-N56 PolarHBondContact O-N 3.38Å; L52-N56 PolarHBondContact O-ND2 2.97Å; L52-N56 PolarHBondContact O-OD1 3.41Å |
| 53 | V | 67.3 | Low | 57.8 | Low | 93 Ų | 93 | 107.7 Ų | 107.7 | 56% | 0.564 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -63.5 | -40.8 | 176.1 | 172.7 | 0 | 0 | 0 | 0 | 111.1 | Q49 R55 N56 A57 | Q49-V53 WeakPolarHBondContact O-CB 3.21Å; Q49-V53 VanDerWaalsContact O-CG2 3.25Å; Q49-V53 WeakPolarHBondContact O-CG2 3.26Å; Q49-V53 PolarHBondContact O-N 2.94Å; V53-R55 VanDerWaalsContact C-N 3.32Å; V53-R55 PolarHBondContact O-N 3.49Å; V53-N56 PolarHBondContact O-N 2.91Å; V53-A57 WeakPolarHBondContact O-CB 3.44Å; V53-A57 PolarHBondContact O-N 2.68Å |
| 54 | K | 66.3 | Low | 57.4 | Low | 163 Ų | 163 | 107.8 Ų | 107.8 | 71% | 0.709 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -66 | -33.1 | 175.9 | -176.5 | 172.7 | 177.4 | 179.4 | 0 | 112.5 | K50 L52 A58 | K50-K54 WeakPolarHBondContact O-CB 3.37Å; K50-K54 PolarHBondContact O-N 3.32Å; L52-K54 VanDerWaalsContact C-N 3.35Å; L52-K54 PolarHBondContact O-N 3.32Å; K54-A58 WeakPolarHBondContact O-CB 3.45Å; K54-A58 PolarHBondContact O-N 3.32Å |
| 55 | R | 58.7 | Low | 56.8 | Low | 173 Ų | 173 | 111 Ų | 111 | 65% | 0.653 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -69.4 | -45.4 | 170.8 | -92 | -171.4 | 156.6 | 93.8 | -0.1 | 111.9 | I51 L52 V53 A57 A58 E59 | I51-R55 WeakPolarHBondContact O-CB 3.47Å; I51-R55 PolarHBondContact O-N 2.87Å; L52-R55 PolarHBondContact O-N 2.95Å; V53-R55 VanDerWaalsContact C-N 3.32Å; V53-R55 PolarHBondContact O-N 3.49Å; R55-A57 VanDerWaalsContact C-N 3.3Å; R55-A57 PolarHBondContact O-N 3.04Å; R55-A58 PolarHBondContact O-N 3.11Å; R55-E59 WeakPolarHBondContact O-CB 3.32Å; R55-E59 PolarHBondContact O-N 3.29Å |
| 56 | N | 55.8 | Low | 56.3 | Low | 96 Ų | 96 | 114.5 Ų | 114.5 | 51% | 0.513 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -63.8 | -35.6 | 178.6 | -63.1 | -16.9 | 0 | 0 | 0 | 112.1 | L52 V53 E59 A60 | L52-N56 WeakPolarHBondContact O-CB 3.38Å; L52-N56 PolarHBondContact O-N 3.38Å; L52-N56 PolarHBondContact O-ND2 2.97Å; L52-N56 PolarHBondContact O-OD1 3.41Å; V53-N56 PolarHBondContact O-N 2.91Å; N56-E59 PolarHBondContact O-N 3.45Å; N56-A60 PolarHBondContact O-N 3.38Å |
| 57 | A | 54.2 | Low | 55.5 | Low | 65 Ų | 65 | 115 Ų | 115 | 54% | 0.537 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -71.8 | -35 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | V53 R55 E59 A60 | V53-A57 WeakPolarHBondContact O-CB 3.44Å; V53-A57 PolarHBondContact O-N 2.68Å; R55-A57 VanDerWaalsContact C-N 3.3Å; R55-A57 PolarHBondContact O-N 3.04Å; A57-E59 VanDerWaalsContact C-N 3.29Å; A57-A60 PolarHBondContact O-N 2.88Å |
| 58 | A | 52.3 | Low | 54.7 | Low | 65 Ų | 65 | 116 Ų | 116 | 54% | 0.537 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -72.6 | -22.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | K54 R55 H62 | K54-A58 WeakPolarHBondContact O-CB 3.45Å; K54-A58 PolarHBondContact O-N 3.32Å; R55-A58 PolarHBondContact O-N 3.11Å; A58-H62 PolarHBondContact O-N 2.58Å |
| 59 | E | 48.1 | Very low | 54.3 | Low | 114 Ų | 114 | 116.8 Ų | 116.8 | 53% | 0.533 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -82.2 | -17.6 | 175.8 | -164.7 | 166.5 | -174.1 | 0 | 0 | 112.9 | R55 N56 A57 H62 | R55-E59 WeakPolarHBondContact O-CB 3.32Å; R55-E59 PolarHBondContact O-N 3.29Å; N56-E59 PolarHBondContact O-N 3.45Å; A57-E59 VanDerWaalsContact C-N 3.29Å; E59-H62 CarbonylContact O-C 3.28Å |
| 60 | A | 48.3 | Very low | 54 | Low | 86 Ų | 86 | 114.6 Ų | 114.6 | 71% | 0.711 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -77.4 | -25 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | N56 A57 | N56-A60 PolarHBondContact O-N 3.38Å; A57-A60 PolarHBondContact O-N 2.88Å |
| 61 | E | 45.4 | Very low | 53.7 | Low | 180 Ų | 180 | 111.7 Ų | 111.7 | 84% | 0.841 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -99.3 | -16.6 | 174.8 | -75.6 | -146.5 | 144.9 | 0 | 0 | 114.2 | ||
| 62 | H | 42.8 | Very low | 53.9 | Low | 156 Ų | 156 | 111.9 Ų | 111.9 | 72% | 0.722 | 65% | 0.645 | S | S | * | * | trans | -126.4 | 78.4 | 172.3 | -91.2 | -60.3 | 0 | 0 | 0 | 109.9 | A58 E59 P64 | A58-H62 PolarHBondContact O-N 2.58Å; E59-H62 CarbonylContact O-C 3.28Å; H62-P64 WeakPolarHBondContact O-CD 3.43Å | ||
| 63 | A | 41.3 | Very low | 53.9 | Low | 87 Ų | 87 | 111.2 Ų | 111.2 | 72% | 0.719 | 65% | 0.649 | S | S | * | * | trans | -55.7 | 107.9 | 162.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | S65 | A63-S65 PolarHBondContact O-N 3.26Å; A63-S65 VanDerWaalsContact O-N 3.11Å | ||
| 64 | P | 40.6 | Very low | 54.3 | Low | 80 Ų | 80 | 110.1 Ų | 110.1 | 52% | 0.519 | 65% | 0.646 | S | S | . | * | trans | -79 | 105.7 | 171.9 | 19.3 | -3.1 | 0 | 0 | 0 | 105.2 | H62 K66 | H62-P64 WeakPolarHBondContact O-CD 3.43Å; P64-K66 PolarHBondContact O-N 2.99Å | ||
| 65 | S | 43.4 | Very low | 54.9 | Low | 111 Ų | 111 | 107.5 Ų | 107.5 | 78% | 0.776 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -37.3 | 105 | 163.7 | 42.3 | 0 | 0 | 0 | 0 | 110.4 | A63 S67 | A63-S65 PolarHBondContact O-N 3.26Å; A63-S65 VanDerWaalsContact O-N 3.11Å; S65-S67 VanDerWaalsContact C-N 3.3Å; S65-S67 PolarHBondContact O-N 3.07Å |
| 66 | K | 48.4 | Very low | 55.7 | Low | 210 Ų | 210 | 101 Ų | 101 | 91% | 0.913 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 26.4 | 65.5 | 165.4 | -65.7 | 177.2 | -179.1 | 172.4 | 0 | 112.1 | P64 S68 | P64-K66 PolarHBondContact O-N 2.99Å; K66-S68 PolarHBondContact O-N 3.45Å |
| 67 | S | 45 | Very low | 56.4 | Low | 76 Ų | 76 | 102.5 Ų | 102.5 | 53% | 0.531 | 62% | 0.622 | S | S | . | * | trans | -66.1 | 110.4 | 178.2 | 72.7 | 0 | 0 | 0 | 0 | 107.6 | S65 V69 | S65-S67 VanDerWaalsContact C-N 3.3Å; S65-S67 PolarHBondContact O-N 3.07Å; S67-V69 PolarHBondContact O-N 3.39Å; S67-V69 WeakPolarHBondContact OG-CG2 3.32Å | ||
| 68 | S | 51.8 | Low | 57.6 | Low | 121 Ų | 121 | 105.5 Ų | 105.5 | 85% | 0.846 | 62% | 0.624 | S | S | * | * | trans | -48.2 | 70.7 | 156.4 | 168.7 | 0 | 0 | 0 | 0 | 110.5 | K66 | K66-S68 PolarHBondContact O-N 3.45Š| ||
| 69 | V | 55.2 | Low | 58.7 | Low | 113 Ų | 113 | 108 Ų | 108 | 69% | 0.685 | 62% | 0.624 | S | S | * | * | trans | -102.9 | -15.7 | 176.2 | 171.3 | 0 | 0 | 0 | 0 | 110.4 | S67 I71 | S67-V69 PolarHBondContact O-N 3.39Å; S67-V69 WeakPolarHBondContact OG-CG2 3.32Å; V69-I71 PolarHBondContact O-N 2.81Å; V69-I71 VanDerWaalsContact O-N 3.14Å | ||
| 70 | A | 60.6 | Low | 59.6 | Low | 88 Ų | 88 | 108.3 Ų | 108.3 | 73% | 0.727 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -74.1 | 104.3 | 168 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||
| 71 | I | 62.9 | Low | 60.3 | Low | 92 Ų | 92 | 107.2 Ų | 107.2 | 47% | 0.472 | 62% | 0.619 | S | S | . | * | trans | -51.9 | 128.6 | 165.6 | -62 | 172.6 | 0 | 0 | 0 | 107.2 | V69 S73 K75 A76 F79 | V69-I71 PolarHBondContact O-N 2.81Å; V69-I71 VanDerWaalsContact O-N 3.14Å; I71-S73 PolarHBondContact O-N 3.24Å; I71-K75 HydrophobicContact CG2-CB 3.61Å; I71-K75 HydrophobicContact CG2-CD 4.1Å; I71-K75 HydrophobicContact CG2-CG 3.73Å; I71-A76 HydrophobicContact CG2-CB 4.37Å; I71-F79 HydrophobicContact CD1-CE2 4.36Å | ||
| 72 | P | 75.1 | Confident | 61.2 | Low | 78 Ų | 78 | 107.9 Ų | 107.9 | 51% | 0.506 | 62% | 0.619 | S | S | . | * | trans | -58.2 | 139.9 | 178.7 | 22.4 | -31.4 | 0 | 0 | 0 | 109.7 | S74 K75 A76 | P72-S74 PolarHBondContact O-N 2.86Å; P72-K75 HydrophobicContact CG-CB 3.94Å; P72-K75 WeakPolarHBondContact O-CA 3.4Å; P72-K75 WeakPolarHBondContact O-CB 3.42Å; P72-K75 PolarHBondContact O-N 3.42Å; P72-A76 PolarHBondContact O-N 2.94Å | ||
| 73 | S | 69.4 | Low | 61.8 | Low | 88 Ų | 88 | 107.2 Ų | 107.2 | 62% | 0.615 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -51.2 | -32.7 | -173.5 | -174.9 | 0 | 0 | 0 | 0 | 113.5 | I71 A76 Q77 | I71-S73 PolarHBondContact O-N 3.24Å; S73-A76 PolarHBondContact O-N 3.33Å; S73-Q77 WeakPolarHBondContact O-CB 3.48Å; S73-Q77 PolarHBondContact O-N 2.91Å |
| 74 | S | 75.6 | Confident | 62.5 | Low | 71 Ų | 71 | 107.4 Ų | 107.4 | 50% | 0.497 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -60.8 | -46.9 | 174.2 | 50.6 | 0 | 0 | 0 | 0 | 112.4 | P72 Q77 E78 | P72-S74 PolarHBondContact O-N 2.86Å; S74-Q77 WeakPolarHBondContact O-CB 3.47Å; S74-Q77 PolarHBondContact O-N 3.16Å; S74-E78 WeakPolarHBondContact O-CG 3.23Å; S74-E78 PolarHBondContact O-N 2.97Å |
| 75 | K | 78.1 | Confident | 63.3 | Low | 108 Ų | 108 | 113.6 Ų | 113.6 | 47% | 0.47 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -70.7 | -32.1 | 177.8 | -171.8 | 168.4 | -174.3 | 171.8 | 0 | 112 | I71 P72 E78 F79 | I71-K75 HydrophobicContact CG2-CB 3.61Å; I71-K75 HydrophobicContact CG2-CD 4.1Å; I71-K75 HydrophobicContact CG2-CG 3.73Å; P72-K75 HydrophobicContact CG-CB 3.94Å; P72-K75 WeakPolarHBondContact O-CA 3.4Å; P72-K75 WeakPolarHBondContact O-CB 3.42Å; P72-K75 PolarHBondContact O-N 3.42Å; K75-E78 PolarHBondContact O-N 2.92Å; K75-F79 HydrophobicContact CG-CE2 3.96Å; K75-F79 WeakPolarHBondContact O-CD2 3.37Å; K75-F79 PolarHBondContact O-N 2.8Å |
| 76 | A | 76.1 | Confident | 64 | Low | 37 Ų | 37 | 112.8 Ų | 112.8 | 31% | 0.306 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -66.4 | -40.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112 | I71 P72 S73 E78 F79 L80 | I71-A76 HydrophobicContact CG2-CB 4.37Å; P72-A76 PolarHBondContact O-N 2.94Å; S73-A76 PolarHBondContact O-N 3.33Å; A76-E78 VanDerWaalsContact C-N 3.33Å; A76-E78 PolarHBondContact O-N 3.39Å; A76-F79 WeakPolarHBondContact O-CB 3.48Å; A76-F79 PolarHBondContact O-N 3.16Å; A76-L80 WeakPolarHBondContact O-CG 3.23Å; A76-L80 PolarHBondContact O-N 3.41Å |
| 77 | Q | 70.1 | Confident | 64.5 | Low | 126 Ų | 126 | 110.9 Ų | 110.9 | 59% | 0.589 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -64.1 | -35.4 | 173.2 | -85.2 | 179.3 | -18.2 | 0 | 0 | 112.4 | S73 S74 F79 L80 A81 | S73-Q77 WeakPolarHBondContact O-CB 3.48Å; S73-Q77 PolarHBondContact O-N 2.91Å; S74-Q77 WeakPolarHBondContact O-CB 3.47Å; S74-Q77 PolarHBondContact O-N 3.16Å; Q77-F79 VanDerWaalsContact C-N 3.33Å; Q77-F79 PolarHBondContact O-N 2.99Å; Q77-L80 PolarHBondContact O-N 3.08Å; Q77-A81 WeakPolarHBondContact O-CB 3.36Å; Q77-A81 PolarHBondContact O-N 3.27Å |
| 78 | E | 79.2 | Confident | 65.4 | Low | 128 Ų | 128 | 115.5 Ų | 115.5 | 60% | 0.598 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -62.3 | -39 | 173.3 | -71.9 | 169.4 | -168 | 0 | 0 | 112.3 | S74 K75 A76 K82 | S74-E78 WeakPolarHBondContact O-CG 3.23Å; S74-E78 PolarHBondContact O-N 2.97Å; K75-E78 PolarHBondContact O-N 2.92Å; A76-E78 VanDerWaalsContact C-N 3.33Å; A76-E78 PolarHBondContact O-N 3.39Å; E78-K82 VanDerWaalsContact O-CB 3.32Å; E78-K82 WeakPolarHBondContact O-CB 3.3Å; E78-K82 PolarHBondContact O-N 3.13Å |
| 79 | F | 74.5 | Confident | 66.2 | Low | 118 Ų | 118 | 114.9 Ų | 114.9 | 52% | 0.518 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -64.7 | -43.4 | 173.2 | -73.2 | -67.7 | 0 | 0 | 0 | 111.9 | I71 K75 A76 Q77 L83 | I71-F79 HydrophobicContact CD1-CE2 4.36Å; K75-F79 HydrophobicContact CG-CE2 3.96Å; K75-F79 WeakPolarHBondContact O-CD2 3.37Å; K75-F79 PolarHBondContact O-N 2.8Å; A76-F79 WeakPolarHBondContact O-CB 3.48Å; A76-F79 PolarHBondContact O-N 3.16Å; Q77-F79 VanDerWaalsContact C-N 3.33Å; Q77-F79 PolarHBondContact O-N 2.99Å; F79-L83 WeakPolarHBondContact O-CB 3.31Å; F79-L83 PolarHBondContact O-N 3.39Å |
| 80 | L | 68.4 | Low | 66.9 | Low | 121 Ų | 121 | 113.9 Ų | 113.9 | 63% | 0.634 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -70.3 | -35 | 177.9 | -65.6 | 176.9 | 0 | 0 | 0 | 112.6 | A76 Q77 L83 S84 | A76-L80 WeakPolarHBondContact O-CG 3.23Å; A76-L80 PolarHBondContact O-N 3.41Å; Q77-L80 PolarHBondContact O-N 3.08Å; L80-L83 CarbonylContact O-C 3.58Å; L80-L83 VanDerWaalsContact O-C 3.28Å; L80-L83 PolarHBondContact O-N 3.03Å; L80-S84 PolarHBondContact O-N 3.33Å |
| 81 | A | 63.5 | Low | 67.6 | Low | 63 Ų | 63 | 117.6 Ų | 117.6 | 52% | 0.521 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -67.1 | -42.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q77 L83 S84 | Q77-A81 WeakPolarHBondContact O-CB 3.36Å; Q77-A81 PolarHBondContact O-N 3.27Å; A81-L83 VanDerWaalsContact C-N 3.26Å; A81-L83 PolarHBondContact O-N 2.98Å; A81-S84 WeakPolarHBondContact O-CB 3.39Å; A81-S84 PolarHBondContact O-N 3.36Å; A81-S84 PolarHBondContact O-OG 3.05Å |
| 82 | K | 63.4 | Low | 68.5 | Low | 194 Ų | 194 | 116.5 Ų | 116.5 | 84% | 0.843 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -67 | -28.2 | 174.6 | -164 | 174.8 | -175.7 | 178.8 | 0 | 112.5 | E78 | E78-K82 VanDerWaalsContact O-CB 3.32Å; E78-K82 WeakPolarHBondContact O-CB 3.3Å; E78-K82 PolarHBondContact O-N 3.13Å |
| 83 | L | 55.7 | Low | 68.5 | Low | 142 Ų | 142 | 117.9 Ų | 117.9 | 74% | 0.743 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.1 | 12.1 | 175.6 | -140.3 | 96.5 | 0 | 0 | 0 | 113.4 | F79 L80 A81 R85 | F79-L83 WeakPolarHBondContact O-CB 3.31Å; F79-L83 PolarHBondContact O-N 3.39Å; L80-L83 CarbonylContact O-C 3.58Å; L80-L83 VanDerWaalsContact O-C 3.28Å; L80-L83 PolarHBondContact O-N 3.03Å; A81-L83 VanDerWaalsContact C-N 3.26Å; A81-L83 PolarHBondContact O-N 2.98Å; L83-R85 PolarHBondContact O-N 3.19Å |
| 84 | S | 55.4 | Low | 69.2 | Low | 91 Ų | 91 | 118.3 Ų | 118.3 | 64% | 0.636 | 59% | 0.587 | S | S | * | * | trans | -66.7 | 86.9 | 172.8 | 66.7 | 0 | 0 | 0 | 0 | 107.2 | L80 A81 T86 | L80-S84 PolarHBondContact O-N 3.33Å; A81-S84 WeakPolarHBondContact O-CB 3.39Å; A81-S84 PolarHBondContact O-N 3.36Å; A81-S84 PolarHBondContact O-OG 3.05Å; S84-T86 PolarHBondContact O-N 3.46Å | ||
| 85 | R | 57.6 | Low | 69.6 | Low | 209 Ų | 209 | 119.1 Ų | 119.1 | 79% | 0.789 | 58% | 0.579 | S | S | * | * | trans | -53 | 116.3 | 178.2 | -165 | -179.9 | -166.1 | -168.1 | 3.1 | 104.6 | L83 K87 | L83-R85 PolarHBondContact O-N 3.19Å; R85-K87 PolarHBondContact O-N 3.49Å; R85-K87 VanDerWaalsContact O-N 3.11Å | ||
| 86 | T | 58.6 | Low | 70.1 | Confident | 95 Ų | 95 | 118.5 Ų | 118.5 | 58% | 0.583 | 59% | 0.586 | S | S | * | * | trans | -43.3 | 128.7 | 169.9 | -14.2 | 0 | 0 | 0 | 0 | 105.6 | S84 R88 | S84-T86 PolarHBondContact O-N 3.46Å; T86-R88 WeakPolarHBondContact O-CG 3.38Å; T86-R88 PolarHBondContact O-N 3.42Å | ||
| 87 | K | 59.6 | Low | 70.7 | Confident | 170 Ų | 170 | 120.9 Ų | 120.9 | 74% | 0.739 | 59% | 0.594 | S | S | * | * | trans | -59.5 | 80.9 | 179.5 | -173.4 | 176.5 | -176.3 | 169.6 | 0 | 107.3 | R85 N89 D130 | R85-K87 PolarHBondContact O-N 3.49Å; R85-K87 VanDerWaalsContact O-N 3.11Å; K87-N89 PolarHBondContact O-N 2.92Å; K87-D130 IonicContact NZ-OD2 3.18Å; K87-D130 PolarHBondContact NZ-OD2 3.24Å | ||
| 88 | R | 63.2 | Low | 71.6 | Confident | 172 Ų | 172 | 115.7 Ų | 115.7 | 65% | 0.649 | 57% | 0.571 | S | S | * | * | trans | -84.5 | 107.8 | -175 | -80.1 | 177.5 | -169.2 | 161.3 | 3.9 | 103.8 | T86 V90 | T86-R88 WeakPolarHBondContact O-CG 3.38Å; T86-R88 PolarHBondContact O-N 3.42Å; R88-V90 VanDerWaalsContact C-N 3.34Å; R88-V90 PolarHBondContact O-N 2.73Å | ||
| 89 | N | 68.1 | Low | 72.1 | Confident | 109 Ų | 109 | 113.5 Ų | 113.5 | 58% | 0.583 | 56% | 0.561 | S | S | * | * | trans | -59 | 104.8 | 167.1 | -69.4 | -24.6 | 0 | 0 | 0 | 106.5 | K87 W91 D92 | K87-N89 PolarHBondContact O-N 2.92Å; N89-W91 PolarHBondContact O-N 3.27Å; N89-W91 VanDerWaalsContact O-N 3.13Å; N89-D92 HydrophobicContact CB-CB 4.44Å; N89-D92 WeakPolarHBondContact O-CB 3.35Å; N89-D92 PolarHBondContact O-N 3.08Å; N89-D92 VanDerWaalsContact O-N 3.16Å | ||
| 90 | V | 70.4 | Confident | 72.9 | Confident | 91 Ų | 91 | 113.7 Ų | 113.7 | 55% | 0.552 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.5 | -27.3 | -178.1 | 177.5 | 0 | 0 | 0 | 0 | 110.4 | R88 V98 | R88-V90 VanDerWaalsContact C-N 3.34Å; R88-V90 PolarHBondContact O-N 2.73Å; V90-V98 WeakPolarHBondContact O-CG2 3.44Å |
| 91 | W | 74.3 | Confident | 73.8 | Confident | 167 Ų | 167 | 117.8 Ų | 117.8 | 63% | 0.633 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | 18.9 | -178.3 | -58.5 | 112.4 | 0 | 0 | 0 | 115 | N89 R93 L119 | N89-W91 PolarHBondContact O-N 3.27Å; N89-W91 VanDerWaalsContact O-N 3.13Å; W91-R93 PolarHBondContact O-N 2.74Å; W91-L119 HydrophobicContact CB-CD2 4.24Å; W91-L119 HydrophobicContact CD2-CD2 3.7Å; W91-L119 HydrophobicContact CE3-CD2 3.83Å; W91-L119 HydrophobicContact CG-CD2 3.89Å; W91-L119 HydrophobicContact CZ3-CD2 4.41Å |
| 92 | D | 81.4 | Confident | 75 | Confident | 68 Ų | 68 | 116.2 Ų | 116.2 | 36% | 0.364 | 55% | 0.553 | S | S | . | * | trans | -67.8 | 113.1 | 178.4 | -176.2 | -1.3 | 0 | 0 | 0 | 112.1 | N89 S94 R95 V98 | N89-D92 HydrophobicContact CB-CB 4.44Å; N89-D92 WeakPolarHBondContact O-CB 3.35Å; N89-D92 PolarHBondContact O-N 3.08Å; N89-D92 VanDerWaalsContact O-N 3.16Å; D92-S94 PolarHBondContact O-N 2.96Å; D92-S94 WeakPolarHBondContact OD1-CB 3.33Å; D92-S94 PolarHBondContact OD1-N 3.28Å; D92-S94 PolarHBondContact OD1-OG 2.97Å; D92-S94 PolarHBondContact OD2-OG 2.77Å; D92-R95 HydrophobicContact CB-CG 4.19Å; D92-R95 WeakPolarHBondContact O-CB 3.32Å; D92-R95 PolarHBondContact O-N 3.2Å; D92-R95 VanDerWaalsContact O-N 3.12Å; D92-V98 WeakPolarHBondContact O-CB 3.48Å; D92-V98 VanDerWaalsContact O-CG2 3.31Å; D92-V98 WeakPolarHBondContact O-CG2 3.37Å | ||
| 93 | R | 76.4 | Confident | 76.2 | Confident | 107 Ų | 107 | 111.5 Ų | 111.5 | 40% | 0.404 | 54% | 0.535 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.7 | -18.5 | -179.4 | -69.9 | -176 | 171.2 | 175.4 | -5.9 | 113.9 | W91 R95 Q99 I102 E116 | W91-R93 PolarHBondContact O-N 2.74Å; R93-R95 PolarHBondContact O-N 2.79Å; R93-Q99 WeakPolarHBondContact O-CG 3.37Å; R93-Q99 PolarHBondContact O-NE2 2.96Å; R93-I102 HydrophobicContact CG-CD1 4.34Å; R93-E116 IonicContact CZ-OE1 3.72Å; R93-E116 IonicContact NH1-OE1 2.74Å; R93-E116 PolarHBondContact NH1-OE1 3.4Å; R93-E116 IonicContact NH2-OE1 2.79Å; R93-E116 PolarHBondContact NH2-OE1 3.36Å |
| 94 | S | 83.3 | Confident | 77.9 | Confident | 97 Ų | 97 | 109.6 Ų | 109.6 | 68% | 0.678 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.7 | -14.9 | 174.2 | 70.9 | 0 | 0 | 0 | 0 | 112.4 | D92 | D92-S94 PolarHBondContact O-N 2.96Å; D92-S94 WeakPolarHBondContact OD1-CB 3.33Å; D92-S94 PolarHBondContact OD1-N 3.28Å; D92-S94 PolarHBondContact OD1-OG 2.97Å; D92-S94 PolarHBondContact OD2-OG 2.77Å |
| 95 | R | 84.2 | Confident | 79.4 | Confident | 88 Ų | 88 | 107.8 Ų | 107.8 | 33% | 0.332 | 50% | 0.503 | S | S | . | . | S | Bend | trans | -83 | 135.5 | -178.5 | -66.9 | -179.4 | 60.8 | -152.2 | -8.3 | 111.5 | D92 R93 D97 V98 Q99 | D92-R95 HydrophobicContact CB-CG 4.19Å; D92-R95 WeakPolarHBondContact O-CB 3.32Å; D92-R95 PolarHBondContact O-N 3.2Å; D92-R95 VanDerWaalsContact O-N 3.12Å; R93-R95 PolarHBondContact O-N 2.79Å; R95-D97 IonicContact CZ-OD2 2.88Å; R95-D97 IonicContact NH2-OD2 2.73Å; R95-D97 PolarHBondContact NH2-OD2 3.12Å; R95-D97 PolarHBondContact O-N 3.17Å; R95-V98 HydrophobicContact CB-CB 4.49Å; R95-V98 HydrophobicContact CB-CG2 4.16Å; R95-V98 PolarHBondContact O-N 3.48Å; R95-Q99 PolarHBondContact O-N 2.89Å |
| 96 | P | 88.4 | Confident | 80.8 | Confident | 95 Ų | 95 | 101.4 Ų | 101.4 | 62% | 0.617 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.1 | -35.1 | 179.4 | 25.4 | -34.2 | 0 | 0 | 0 | 112 | V98 Q99 Q100 | P96-V98 PolarHBondContact O-N 3.29Å; P96-Q99 PolarHBondContact O-N 3.47Å; P96-Q100 WeakPolarHBondContact O-CG 3.28Å; P96-Q100 PolarHBondContact O-N 2.96Å |
| 97 | D | 89.8 | Confident | 82.2 | Confident | 88 Ų | 88 | 103.3 Ų | 103.3 | 47% | 0.471 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.5 | -45.8 | 178.7 | -49 | -34.4 | 0 | 0 | 0 | 111.6 | R95 Q99 Q100 W101 | R95-D97 IonicContact CZ-OD2 2.88Å; R95-D97 IonicContact NH2-OD2 2.73Å; R95-D97 PolarHBondContact NH2-OD2 3.12Å; R95-D97 PolarHBondContact O-N 3.17Å; D97-Q99 VanDerWaalsContact C-N 3.3Å; D97-Q99 PolarHBondContact O-N 3.33Å; D97-Q100 PolarHBondContact O-N 2.94Å; D97-W101 PolarHBondContact O-N 3.29Å; D97-W101 VanDerWaalsContact O-N 3.11Å |
| 98 | V | 87.7 | Confident | 83.7 | Confident | 17 Ų | 17 | 100.4 Ų | 100.4 | 10% | 0.103 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -66.1 | -38.9 | -178.4 | 177.3 | 0 | 0 | 0 | 0 | 110 | V90 D92 R95 P96 W101 I102 | V90-V98 WeakPolarHBondContact O-CG2 3.44Å; D92-V98 WeakPolarHBondContact O-CB 3.48Å; D92-V98 VanDerWaalsContact O-CG2 3.31Å; D92-V98 WeakPolarHBondContact O-CG2 3.37Å; R95-V98 HydrophobicContact CB-CB 4.49Å; R95-V98 HydrophobicContact CB-CG2 4.16Å; R95-V98 PolarHBondContact O-N 3.48Å; P96-V98 PolarHBondContact O-N 3.29Å; V98-W101 PolarHBondContact O-N 2.96Å; V98-I102 HydrophobicContact CG1-CD1 3.9Å; V98-I102 HydrophobicContact CG1-CG1 4.48Å; V98-I102 VanDerWaalsContact O-CG1 3.28Å; V98-I102 WeakPolarHBondContact O-CG1 3.41Å; V98-I102 PolarHBondContact O-N 3.21Å |
| 99 | Q | 89.8 | Confident | 84.9 | Confident | 82 Ų | 82 | 95.3 Ų | 95.3 | 38% | 0.383 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.7 | -43.6 | 174.7 | -69.5 | -65.8 | -28.5 | 0 | 0 | 112.4 | R93 R95 P96 D97 W101 I102 M103 | R93-Q99 WeakPolarHBondContact O-CG 3.37Å; R93-Q99 PolarHBondContact O-NE2 2.96Å; R95-Q99 PolarHBondContact O-N 2.89Å; P96-Q99 PolarHBondContact O-N 3.47Å; D97-Q99 VanDerWaalsContact C-N 3.3Å; D97-Q99 PolarHBondContact O-N 3.33Å; Q99-W101 VanDerWaalsContact C-N 3.31Å; Q99-W101 PolarHBondContact O-N 3.33Å; Q99-I102 PolarHBondContact O-N 3.44Å; Q99-M103 WeakPolarHBondContact O-CG 3.39Å; Q99-M103 PolarHBondContact O-N 3.47Å |
| 100 | Q | 91.3 | Very high | 85.7 | Confident | 121 Ų | 121 | 95.1 Ų | 95.1 | 57% | 0.565 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -61.6 | -40.6 | 176.8 | -70.6 | -61.9 | -54.1 | 0 | 0 | 112.1 | P96 D97 M103 Q104 | P96-Q100 WeakPolarHBondContact O-CG 3.28Å; P96-Q100 PolarHBondContact O-N 2.96Å; D97-Q100 PolarHBondContact O-N 2.94Å; Q100-M103 PolarHBondContact O-N 3.46Å; Q100-Q104 PolarHBondContact O-N 3.26Å |
| 101 | W | 88.4 | Confident | 86.5 | Confident | 207 Ų | 207 | 96.4 Ų | 96.4 | 78% | 0.784 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -67.5 | -40.5 | 177.4 | -81 | 63.2 | 0 | 0 | 0 | 112.3 | D97 V98 Q99 M103 Q104 F105 | D97-W101 PolarHBondContact O-N 3.29Å; D97-W101 VanDerWaalsContact O-N 3.11Å; V98-W101 PolarHBondContact O-N 2.96Å; Q99-W101 VanDerWaalsContact C-N 3.31Å; Q99-W101 PolarHBondContact O-N 3.33Å; W101-M103 VanDerWaalsContact C-N 3.35Å; W101-Q104 PolarHBondContact O-N 3.27Å; W101-F105 WeakPolarHBondContact O-CB 3.37Å; W101-F105 PolarHBondContact O-N 2.74Å |
| 102 | I | 88.1 | Confident | 86.9 | Confident | 30 Ų | 30 | 93.5 Ų | 93.5 | 15% | 0.154 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -61.5 | -45.8 | 173.9 | -67.9 | 166.1 | 0 | 0 | 0 | 109.8 | R93 V98 Q99 Q104 F105 M106 L115 | R93-I102 HydrophobicContact CG-CD1 4.34Å; V98-I102 HydrophobicContact CG1-CD1 3.9Å; V98-I102 HydrophobicContact CG1-CG1 4.48Å; V98-I102 VanDerWaalsContact O-CG1 3.28Å; V98-I102 WeakPolarHBondContact O-CG1 3.41Å; V98-I102 PolarHBondContact O-N 3.21Å; Q99-I102 PolarHBondContact O-N 3.44Å; I102-Q104 PolarHBondContact O-N 2.79Å; I102-F105 WeakPolarHBondContact O-CB 3.48Å; I102-F105 PolarHBondContact O-N 3.25Å; I102-F105 VanDerWaalsContact O-N 3.12Å; I102-M106 HydrophobicContact CG2-CG 4.48Å; I102-M106 WeakPolarHBondContact O-CG 3.37Å; I102-M106 PolarHBondContact O-N 3.33Å; I102-L115 HydrophobicContact CG1-CD2 4.42Å |
| 103 | M | 89.2 | Confident | 87.2 | Confident | 95 Ų | 95 | 98.2 Ų | 98.2 | 47% | 0.468 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -58.5 | -45.2 | 176.6 | -73.2 | 178.8 | 62.6 | 0 | 0 | 112.4 | Q99 Q100 W101 F105 M106 Q107 | Q99-M103 WeakPolarHBondContact O-CG 3.39Å; Q99-M103 PolarHBondContact O-N 3.47Å; Q100-M103 PolarHBondContact O-N 3.46Å; W101-M103 VanDerWaalsContact C-N 3.35Å; M103-F105 VanDerWaalsContact C-N 3.28Å; M103-F105 PolarHBondContact O-N 3.37Å; M103-M106 PolarHBondContact O-N 3.36Å; M103-Q107 WeakPolarHBondContact O-CG 3.35Å; M103-Q107 PolarHBondContact O-N 3.21Å |
| 104 | Q | 90.5 | Very high | 87.7 | Confident | 102 Ų | 102 | 101.6 Ų | 101.6 | 48% | 0.477 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.3 | -38.6 | 176.4 | -175.8 | 61.7 | 38.8 | 0 | 0 | 111.8 | Q100 W101 I102 Q107 M108 | Q100-Q104 PolarHBondContact O-N 3.26Å; W101-Q104 PolarHBondContact O-N 3.27Å; I102-Q104 PolarHBondContact O-N 2.79Å; Q104-Q107 WeakPolarHBondContact O-CB 3.31Å; Q104-Q107 PolarHBondContact O-N 3.3Å; Q104-M108 HydrophobicContact CG-CE 4.48Å; Q104-M108 WeakPolarHBondContact O-CG 3.49Å; Q104-M108 PolarHBondContact O-N 2.96Å |
| 105 | F | 87.1 | Confident | 87.8 | Confident | 54 Ų | 54 | 98.6 Ų | 98.6 | 24% | 0.237 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -63.3 | -43.9 | 177 | -171.1 | -98.2 | 0 | 0 | 0 | 111.8 | W101 I102 M103 Q107 M108 F110 L115 | W101-F105 WeakPolarHBondContact O-CB 3.37Å; W101-F105 PolarHBondContact O-N 2.74Å; I102-F105 WeakPolarHBondContact O-CB 3.48Å; I102-F105 PolarHBondContact O-N 3.25Å; I102-F105 VanDerWaalsContact O-N 3.12Å; M103-F105 VanDerWaalsContact C-N 3.28Å; M103-F105 PolarHBondContact O-N 3.37Å; F105-Q107 VanDerWaalsContact C-N 3.31Å; F105-Q107 PolarHBondContact O-N 2.89Å; F105-M108 HydrophobicContact CB-CE 4.46Å; F105-M108 HydrophobicContact CD2-CE 4.12Å; F105-M108 PolarHBondContact O-N 2.88Å; F105-F110 HydrophobicContact CD1-CB 3.56Å; F105-F110 HydrophobicContact CD1-CD2 4.31Å; F105-F110 HydrophobicContact CD1-CG 4.22Å; F105-F110 HydrophobicContact CD2-CB 4.46Å; F105-F110 AromaticContact CD2-CD2 3.75Å; F105-F110 HydrophobicContact CD2-CD2 3.75Å; F105-F110 HydrophobicContact CD2-CE2 4.28Å; F105-F110 HydrophobicContact CD2-CG 4.24Å; F105-F110 HydrophobicContact CE1-CB 3.05Å; F105-F110 HydrophobicContact CE1-CD1 4.4Å; F105-F110 HydrophobicContact CE1-CD2 4.11Å; F105-F110 AromaticContact CE1-CG 3.65Å; F105-F110 HydrophobicContact CE1-CG 3.65Å; F105-F110 HydrophobicContact CE2-CB 4.03Å; F105-F110 HydrophobicContact CE2-CD1 4.2Å; F105-F110 AromaticContact CE2-CD2 3.5Å; F105-F110 HydrophobicContact CE2-CD2 3.5Å; F105-F110 VanDerWaalsContact CE2-CD2 3.5Å; F105-F110 AromaticContact CE2-CE2 3.94Å; F105-F110 HydrophobicContact CE2-CE2 3.94Å; F105-F110 AromaticContact CE2-CG 3.66Å; F105-F110 HydrophobicContact CE2-CG 3.66Å; F105-F110 HydrophobicContact CE2-CZ 4.45Å; F105-F110 HydrophobicContact CG-CB 4.26Å; F105-F110 HydrophobicContact CG-CD2 4.16Å; F105-F110 HydrophobicContact CZ-CB 3.32Å; F105-F110 AromaticContact CZ-CD1 3.79Å; F105-F110 HydrophobicContact CZ-CD1 3.79Å; F105-F110 AromaticContact CZ-CD2 3.71Å; F105-F110 HydrophobicContact CZ-CD2 3.71Å; F105-F110 HydrophobicContact CZ-CE2 4.45Å; F105-F110 AromaticContact CZ-CG 3.34Å; F105-F110 HydrophobicContact CZ-CG 3.34Å; F105-L115 HydrophobicContact CD1-CB 4.31Å; F105-L115 HydrophobicContact CD1-CD1 4.16Å; F105-L115 HydrophobicContact CD1-CD2 3.72Å; F105-L115 HydrophobicContact CD1-CG 4.27Å; F105-L115 HydrophobicContact CE1-CB 3.74Å; F105-L115 HydrophobicContact CE1-CD1 3.79Å; F105-L115 HydrophobicContact CE1-CD2 3.99Å; F105-L115 HydrophobicContact CE1-CG 4.03Å; F105-L115 HydrophobicContact CE2-CD1 4.49Å; F105-L115 HydrophobicContact CG-CD2 4.42Å; F105-L115 HydrophobicContact CZ-CB 4.49Å; F105-L115 HydrophobicContact CZ-CD1 3.97Å |
| 106 | M | 87.2 | Confident | 87.8 | Confident | 75 Ų | 75 | 96.9 Ų | 96.9 | 37% | 0.369 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.6 | -37.6 | 174.1 | -62 | -52.3 | -66.7 | 0 | 0 | 112.1 | I102 M103 M108 G109 E112 | I102-M106 HydrophobicContact CG2-CG 4.48Å; I102-M106 WeakPolarHBondContact O-CG 3.37Å; I102-M106 PolarHBondContact O-N 3.33Å; M103-M106 PolarHBondContact O-N 3.36Å; M106-M108 PolarHBondContact O-N 3.49Å; M106-G109 PolarHBondContact O-N 2.99Å; M106-E112 HydrophobicContact CE-CB 3.76Å; M106-E112 HydrophobicContact SD-CB 3.9Å |
| 107 | Q | 88.7 | Confident | 87.9 | Confident | 134 Ų | 134 | 94.8 Ų | 94.8 | 63% | 0.626 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -65.1 | -25.2 | 176.9 | -72.1 | 173.3 | 24.7 | 0 | 0 | 113.5 | M103 Q104 F105 G109 | M103-Q107 WeakPolarHBondContact O-CG 3.35Å; M103-Q107 PolarHBondContact O-N 3.21Å; Q104-Q107 WeakPolarHBondContact O-CB 3.31Å; Q104-Q107 PolarHBondContact O-N 3.3Å; F105-Q107 VanDerWaalsContact C-N 3.31Å; F105-Q107 PolarHBondContact O-N 2.89Å; Q107-G109 PolarHBondContact O-N 3.42Å |
| 108 | M | 90.1 | Very high | 87.8 | Confident | 110 Ų | 110 | 94.4 Ų | 94.4 | 54% | 0.542 | 46% | 0.461 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79 | 0.5 | 174.4 | -66.8 | -176.1 | -68.8 | 0 | 0 | 113.1 | Q104 F105 M106 F110 | Q104-M108 HydrophobicContact CG-CE 4.48Å; Q104-M108 WeakPolarHBondContact O-CG 3.49Å; Q104-M108 PolarHBondContact O-N 2.96Å; F105-M108 HydrophobicContact CB-CE 4.46Å; F105-M108 HydrophobicContact CD2-CE 4.12Å; F105-M108 PolarHBondContact O-N 2.88Å; M106-M108 PolarHBondContact O-N 3.49Å; M108-F110 HydrophobicContact CB-CD2 3.72Å; M108-F110 HydrophobicContact CB-CE2 3.72Å; M108-F110 HydrophobicContact CE-CD2 4.44Å; M108-F110 HydrophobicContact CE-CE2 4.2Å; M108-F110 HydrophobicContact SD-CE2 4.5Å |
| 109 | G | 88 | Confident | 87.6 | Confident | 65 Ų | 65 | 94.9 Ų | 94.9 | 67% | 0.67 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.9 | 19.1 | 176 | 0 | 0 | 0 | 0 | 0 | 114.3 | M106 Q107 | M106-G109 PolarHBondContact O-N 2.99Å; Q107-G109 PolarHBondContact O-N 3.42Å |
| 110 | F | 84.9 | Confident | 87.3 | Confident | 104 Ų | 104 | 95.9 Ų | 95.9 | 46% | 0.456 | 47% | 0.467 | S | S | . | . | trans | -85.4 | 144 | 173.4 | -65.2 | -78.9 | 0 | 0 | 0 | 111.5 | F105 M108 | F105-F110 HydrophobicContact CD1-CB 3.56Å; F105-F110 HydrophobicContact CD1-CD2 4.31Å; F105-F110 HydrophobicContact CD1-CG 4.22Å; F105-F110 HydrophobicContact CD2-CB 4.46Å; F105-F110 AromaticContact CD2-CD2 3.75Å; F105-F110 HydrophobicContact CD2-CD2 3.75Å; F105-F110 HydrophobicContact CD2-CE2 4.28Å; F105-F110 HydrophobicContact CD2-CG 4.24Å; F105-F110 HydrophobicContact CE1-CB 3.05Å; F105-F110 HydrophobicContact CE1-CD1 4.4Å; F105-F110 HydrophobicContact CE1-CD2 4.11Å; F105-F110 AromaticContact CE1-CG 3.65Å; F105-F110 HydrophobicContact CE1-CG 3.65Å; F105-F110 HydrophobicContact CE2-CB 4.03Å; F105-F110 HydrophobicContact CE2-CD1 4.2Å; F105-F110 AromaticContact CE2-CD2 3.5Å; F105-F110 HydrophobicContact CE2-CD2 3.5Å; F105-F110 VanDerWaalsContact CE2-CD2 3.5Å; F105-F110 AromaticContact CE2-CE2 3.94Å; F105-F110 HydrophobicContact CE2-CE2 3.94Å; F105-F110 AromaticContact CE2-CG 3.66Å; F105-F110 HydrophobicContact CE2-CG 3.66Å; F105-F110 HydrophobicContact CE2-CZ 4.45Å; F105-F110 HydrophobicContact CG-CB 4.26Å; F105-F110 HydrophobicContact CG-CD2 4.16Å; F105-F110 HydrophobicContact CZ-CB 3.32Å; F105-F110 AromaticContact CZ-CD1 3.79Å; F105-F110 HydrophobicContact CZ-CD1 3.79Å; F105-F110 AromaticContact CZ-CD2 3.71Å; F105-F110 HydrophobicContact CZ-CD2 3.71Å; F105-F110 HydrophobicContact CZ-CE2 4.45Å; F105-F110 AromaticContact CZ-CG 3.34Å; F105-F110 HydrophobicContact CZ-CG 3.34Å; M108-F110 HydrophobicContact CB-CD2 3.72Å; M108-F110 HydrophobicContact CB-CE2 3.72Å; M108-F110 HydrophobicContact CE-CD2 4.44Å; M108-F110 HydrophobicContact CE-CE2 4.2Å; M108-F110 HydrophobicContact SD-CE2 4.5Å | ||
| 111 | D | 86.9 | Confident | 87.2 | Confident | 118 Ų | 118 | 96.6 Ų | 96.6 | 63% | 0.631 | 47% | 0.466 | S | S | * | . | trans | -76.6 | 135.7 | 179.6 | -64.2 | -40.2 | 0 | 0 | 0 | 112 | Q113 R114 L115 | D111-Q113 PolarHBondContact O-N 3.37Å; D111-R114 HydrophobicContact CB-CB 4.35Å; D111-R114 PolarHBondContact O-N 2.94Å; D111-L115 PolarHBondContact O-N 3.43Å | ||
| 112 | E | 84.4 | Confident | 86.9 | Confident | 107 Ų | 107 | 94.6 Ų | 94.6 | 50% | 0.5 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -59 | -48.5 | 177.8 | -176.6 | 171.8 | -166 | 0 | 0 | 111.1 | M106 R114 L115 E116 | M106-E112 HydrophobicContact CE-CB 3.76Å; M106-E112 HydrophobicContact SD-CB 3.9Å; E112-R114 PolarHBondContact O-N 3.41Å; E112-L115 WeakPolarHBondContact O-CB 3.34Å; E112-L115 PolarHBondContact O-N 3.12Å; E112-L115 VanDerWaalsContact O-N 3.08Å; E112-E116 HydrophobicContact CG-CG 4.23Å; E112-E116 VanDerWaalsContact O-CG 3.23Å; E112-E116 WeakPolarHBondContact O-CG 3.35Å; E112-E116 PolarHBondContact O-N 2.93Å |
| 113 | Q | 87.1 | Confident | 86.6 | Confident | 166 Ų | 166 | 96.5 Ų | 96.5 | 78% | 0.776 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -59.2 | -35.9 | -176.2 | -65.1 | -168.5 | -12.1 | 0 | 0 | 113 | D111 E116 A117 | D111-Q113 PolarHBondContact O-N 3.37Å; Q113-E116 PolarHBondContact O-N 3.03Å; Q113-A117 WeakPolarHBondContact O-CB 3.34Å; Q113-A117 PolarHBondContact O-N 3.31Å |
| 114 | R | 86.1 | Confident | 86.4 | Confident | 179 Ų | 179 | 96.4 Ų | 96.4 | 68% | 0.675 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -72 | -40.4 | 178.6 | -172 | 163.3 | -176.8 | 162.1 | 1 | 111.5 | D111 E112 E116 A117 D118 | D111-R114 HydrophobicContact CB-CB 4.35Å; D111-R114 PolarHBondContact O-N 2.94Å; E112-R114 PolarHBondContact O-N 3.41Å; R114-E116 VanDerWaalsContact C-N 3.32Å; R114-E116 PolarHBondContact O-N 3.27Å; R114-A117 PolarHBondContact O-N 2.97Å; R114-D118 WeakPolarHBondContact O-CB 3.39Å; R114-D118 PolarHBondContact O-N 3.41Å |
| 115 | L | 85.4 | Confident | 86 | Confident | 33 Ų | 33 | 95.1 Ų | 95.1 | 17% | 0.173 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -60.7 | -42.2 | 172.6 | -179.6 | 69.6 | 0 | 0 | 0 | 111.5 | I102 F105 D111 E112 L119 | I102-L115 HydrophobicContact CG1-CD2 4.42Å; F105-L115 HydrophobicContact CD1-CB 4.31Å; F105-L115 HydrophobicContact CD1-CD1 4.16Å; F105-L115 HydrophobicContact CD1-CD2 3.72Å; F105-L115 HydrophobicContact CD1-CG 4.27Å; F105-L115 HydrophobicContact CE1-CB 3.74Å; F105-L115 HydrophobicContact CE1-CD1 3.79Å; F105-L115 HydrophobicContact CE1-CD2 3.99Å; F105-L115 HydrophobicContact CE1-CG 4.03Å; F105-L115 HydrophobicContact CE2-CD1 4.49Å; F105-L115 HydrophobicContact CG-CD2 4.42Å; F105-L115 HydrophobicContact CZ-CB 4.49Å; F105-L115 HydrophobicContact CZ-CD1 3.97Å; D111-L115 PolarHBondContact O-N 3.43Å; E112-L115 WeakPolarHBondContact O-CB 3.34Å; E112-L115 PolarHBondContact O-N 3.12Å; E112-L115 VanDerWaalsContact O-N 3.08Å; L115-L119 HydrophobicContact CD1-CD1 4.2Å; L115-L119 HydrophobicContact CG-CD1 3.99Å; L115-L119 WeakPolarHBondContact O-CB 3.4Å; L115-L119 PolarHBondContact O-N 3.32Å |
| 116 | E | 85.3 | Confident | 85.5 | Confident | 53 Ų | 53 | 95.4 Ų | 95.4 | 25% | 0.248 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -63.9 | -45.3 | 178.5 | -56.1 | -149.6 | 120.3 | 0 | 0 | 112 | R93 E112 Q113 R114 L119 Q120 | R93-E116 IonicContact CZ-OE1 3.72Å; R93-E116 IonicContact NH1-OE1 2.74Å; R93-E116 PolarHBondContact NH1-OE1 3.4Å; R93-E116 IonicContact NH2-OE1 2.79Å; R93-E116 PolarHBondContact NH2-OE1 3.36Å; E112-E116 HydrophobicContact CG-CG 4.23Å; E112-E116 VanDerWaalsContact O-CG 3.23Å; E112-E116 WeakPolarHBondContact O-CG 3.35Å; E112-E116 PolarHBondContact O-N 2.93Å; Q113-E116 PolarHBondContact O-N 3.03Å; R114-E116 VanDerWaalsContact C-N 3.32Å; R114-E116 PolarHBondContact O-N 3.27Å; E116-L119 PolarHBondContact O-N 3.11Å; E116-Q120 WeakPolarHBondContact O-CB 3.41Å; E116-Q120 VanDerWaalsContact O-CG 3.23Å; E116-Q120 WeakPolarHBondContact O-CG 3.32Å; E116-Q120 PolarHBondContact O-N 3.37Å |
| 117 | A | 89.6 | Confident | 84.8 | Confident | 50 Ų | 50 | 99.1 Ų | 99.1 | 41% | 0.413 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.4 | -45.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q113 R114 Q120 Y121 | Q113-A117 WeakPolarHBondContact O-CB 3.34Å; Q113-A117 PolarHBondContact O-N 3.31Å; R114-A117 PolarHBondContact O-N 2.97Å; A117-Q120 PolarHBondContact O-N 3.02Å; A117-Y121 WeakPolarHBondContact O-CB 3.4Å; A117-Y121 PolarHBondContact O-N 2.9Å |
| 118 | D | 88.1 | Confident | 84.1 | Confident | 81 Ų | 81 | 95.5 Ų | 95.5 | 43% | 0.433 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.9 | -43.4 | 178 | -73.1 | -15.3 | 0 | 0 | 0 | 110.8 | R114 Y121 W122 | R114-D118 WeakPolarHBondContact O-CB 3.39Å; R114-D118 PolarHBondContact O-N 3.41Å; D118-Y121 WeakPolarHBondContact O-CB 3.12Å; D118-Y121 PolarHBondContact O-N 3.01Å; D118-W122 PolarHBondContact O-N 3.33Å |
| 119 | L | 82.9 | Confident | 83 | Confident | 27 Ų | 27 | 96.7 Ų | 96.7 | 14% | 0.141 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -61.9 | -45.5 | 176.7 | -93.5 | 160.9 | 0 | 0 | 0 | 112.8 | W91 L115 E116 Y121 W122 M123 | W91-L119 HydrophobicContact CB-CD2 4.24Å; W91-L119 HydrophobicContact CD2-CD2 3.7Å; W91-L119 HydrophobicContact CE3-CD2 3.83Å; W91-L119 HydrophobicContact CG-CD2 3.89Å; W91-L119 HydrophobicContact CZ3-CD2 4.41Å; L115-L119 HydrophobicContact CD1-CD1 4.2Å; L115-L119 HydrophobicContact CG-CD1 3.99Å; L115-L119 WeakPolarHBondContact O-CB 3.4Å; L115-L119 PolarHBondContact O-N 3.32Å; E116-L119 PolarHBondContact O-N 3.11Å; L119-Y121 VanDerWaalsContact C-N 3.34Å; L119-W122 PolarHBondContact O-N 2.89Å; L119-M123 WeakPolarHBondContact O-CB 3.18Å; L119-M123 VanDerWaalsContact O-CG 3.32Å; L119-M123 WeakPolarHBondContact O-CG 3.48Å; L119-M123 PolarHBondContact O-N 3.21Å |
| 120 | Q | 83.8 | Confident | 81.8 | Confident | 102 Ų | 102 | 98.2 Ų | 98.2 | 48% | 0.477 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61.8 | -45.2 | 177.7 | -73.9 | 163.2 | -1 | 0 | 0 | 110.7 | E116 A117 W122 M123 D124 | E116-Q120 WeakPolarHBondContact O-CB 3.41Å; E116-Q120 VanDerWaalsContact O-CG 3.23Å; E116-Q120 WeakPolarHBondContact O-CG 3.32Å; E116-Q120 PolarHBondContact O-N 3.37Å; A117-Q120 PolarHBondContact O-N 3.02Å; Q120-W122 PolarHBondContact O-N 3.45Å; Q120-M123 HydrophobicContact CG-CE 4.22Å; Q120-M123 PolarHBondContact O-N 3.08Å; Q120-D124 WeakPolarHBondContact O-CB 3.36Å; Q120-D124 PolarHBondContact O-N 3.28Å |
| 121 | Y | 88.5 | Confident | 80.5 | Confident | 137 Ų | 137 | 98.7 Ų | 98.7 | 54% | 0.537 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -55.6 | -50.8 | 174.8 | 173 | -97.5 | 0 | 0 | 0 | 111.9 | A117 D118 L119 M123 D124 H125 | A117-Y121 WeakPolarHBondContact O-CB 3.4Å; A117-Y121 PolarHBondContact O-N 2.9Å; D118-Y121 WeakPolarHBondContact O-CB 3.12Å; D118-Y121 PolarHBondContact O-N 3.01Å; L119-Y121 VanDerWaalsContact C-N 3.34Å; Y121-M123 PolarHBondContact O-N 2.88Å; Y121-D124 PolarHBondContact O-N 2.86Å; Y121-H125 VanDerWaalsContact O-CB 3.25Å; Y121-H125 WeakPolarHBondContact O-CB 3.44Å; Y121-H125 PolarHBondContact O-N 3.35Å |
| 122 | W | 83.2 | Confident | 79 | Confident | 165 Ų | 165 | 96.6 Ų | 96.6 | 63% | 0.625 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -67.5 | -36 | -179.8 | -76.1 | 110.5 | 0 | 0 | 0 | 113.1 | D118 L119 Q120 A126 | D118-W122 PolarHBondContact O-N 3.33Å; L119-W122 PolarHBondContact O-N 2.89Å; Q120-W122 PolarHBondContact O-N 3.45Å; W122-A126 WeakPolarHBondContact O-CB 3.3Å; W122-A126 PolarHBondContact O-N 3.17Å |
| 123 | M | 82.4 | Confident | 77.4 | Confident | 70 Ų | 70 | 102 Ų | 102 | 35% | 0.345 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64 | -45.6 | 174.9 | -78.1 | -168.8 | -64.6 | 0 | 0 | 111.9 | L119 Q120 Y121 A126 R127 | L119-M123 WeakPolarHBondContact O-CB 3.18Å; L119-M123 VanDerWaalsContact O-CG 3.32Å; L119-M123 WeakPolarHBondContact O-CG 3.48Å; L119-M123 PolarHBondContact O-N 3.21Å; Q120-M123 HydrophobicContact CG-CE 4.22Å; Q120-M123 PolarHBondContact O-N 3.08Å; Y121-M123 PolarHBondContact O-N 2.88Å; M123-A126 PolarHBondContact O-N 3.21Å; M123-R127 WeakPolarHBondContact O-CG 3.32Å; M123-R127 PolarHBondContact O-N 3.17Å |
| 124 | D | 83.6 | Confident | 76 | Confident | 93 Ų | 93 | 100.5 Ų | 100.5 | 50% | 0.497 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -71.2 | -36 | 180 | -71.9 | -13.5 | 0 | 0 | 0 | 111.3 | Q120 Y121 A126 R127 S128 | Q120-D124 WeakPolarHBondContact O-CB 3.36Å; Q120-D124 PolarHBondContact O-N 3.28Å; Y121-D124 PolarHBondContact O-N 2.86Å; D124-A126 PolarHBondContact O-N 3.3Å; D124-R127 PolarHBondContact O-N 3.44Å; D124-R127 IonicContact OD1-NH1 3.47Å; D124-R127 PolarHBondContact OD1-NH1 2.95Å; D124-S128 WeakPolarHBondContact O-CB 3.49Å; D124-S128 PolarHBondContact O-N 3.44Å |
| 125 | H | 82.6 | Confident | 74.6 | Confident | 75 Ų | 75 | 99.1 Ų | 99.1 | 35% | 0.347 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.3 | -45.2 | 170.9 | -168.8 | 84 | 0 | 0 | 0 | 111.9 | Y121 R127 S128 H129 | Y121-H125 VanDerWaalsContact O-CB 3.25Å; Y121-H125 WeakPolarHBondContact O-CB 3.44Å; Y121-H125 PolarHBondContact O-N 3.35Å; H125-R127 PolarHBondContact O-N 2.96Å; H125-S128 PolarHBondContact O-N 3.4Å; H125-S128 PolarHBondContact O-OG 2.93Å; H125-H129 AromaticContact CD2-ND1 3.99Å; H125-H129 AromaticContact CE1-CE1 3.55Å; H125-H129 AromaticContact CE1-ND1 3.91Å; H125-H129 AromaticContact NE2-CE1 3.48Å; H125-H129 PolarHBondContact NE2-CE1 3.09Å; H125-H129 AromaticContact NE2-ND1 3.66Å; H125-H129 PolarHBondContact O-N 2.98Å; H125-H129 PolarHBondContact O-ND1 3.45Å |
| 126 | A | 76.4 | Confident | 73.2 | Confident | 60 Ų | 60 | 105.9 Ų | 105.9 | 50% | 0.496 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.5 | -39.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | W122 M123 D124 H129 D130 | W122-A126 WeakPolarHBondContact O-CB 3.3Å; W122-A126 PolarHBondContact O-N 3.17Å; M123-A126 PolarHBondContact O-N 3.21Å; D124-A126 PolarHBondContact O-N 3.3Å; A126-H129 PolarHBondContact O-N 3.39Å; A126-D130 PolarHBondContact O-N 3.49Å |
| 127 | R | 73.6 | Confident | 71.8 | Confident | 153 Ų | 153 | 112.4 Ų | 112.4 | 58% | 0.577 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -67.1 | -36.9 | 174.6 | -72 | 176.8 | -172.8 | 126 | 1.3 | 112.6 | M123 D124 H125 H129 D130 | M123-R127 WeakPolarHBondContact O-CG 3.32Å; M123-R127 PolarHBondContact O-N 3.17Å; D124-R127 PolarHBondContact O-N 3.44Å; D124-R127 IonicContact OD1-NH1 3.47Å; D124-R127 PolarHBondContact OD1-NH1 2.95Å; H125-R127 PolarHBondContact O-N 2.96Å; R127-H129 VanDerWaalsContact C-N 3.25Å; R127-H129 PolarHBondContact O-N 2.9Å; R127-D130 PolarHBondContact O-N 3.04Å |
| 128 | S | 73 | Confident | 70.4 | Confident | 57 Ų | 57 | 114.2 Ų | 114.2 | 40% | 0.399 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.3 | -30.3 | 177.1 | 75.8 | 0 | 0 | 0 | 0 | 112.6 | D124 H125 Q131 | D124-S128 WeakPolarHBondContact O-CB 3.49Å; D124-S128 PolarHBondContact O-N 3.44Å; H125-S128 PolarHBondContact O-N 3.4Å; H125-S128 PolarHBondContact O-OG 2.93Å; S128-Q131 WeakPolarHBondContact O-CG 3.29Å; S128-Q131 PolarHBondContact O-NE2 3.25Å |
| 129 | H | 66.3 | Low | 69.1 | Low | 136 Ų | 136 | 119 Ų | 119 | 63% | 0.63 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -89.6 | -13.6 | 175.7 | -80.9 | 77.2 | 0 | 0 | 0 | 113.6 | H125 A126 R127 Q131 | H125-H129 AromaticContact CD2-ND1 3.99Å; H125-H129 AromaticContact CE1-CE1 3.55Å; H125-H129 AromaticContact CE1-ND1 3.91Å; H125-H129 AromaticContact NE2-CE1 3.48Å; H125-H129 PolarHBondContact NE2-CE1 3.09Å; H125-H129 AromaticContact NE2-ND1 3.66Å; H125-H129 PolarHBondContact O-N 2.98Å; H125-H129 PolarHBondContact O-ND1 3.45Å; A126-H129 PolarHBondContact O-N 3.39Å; R127-H129 VanDerWaalsContact C-N 3.25Å; R127-H129 PolarHBondContact O-N 2.9Å; H129-Q131 PolarHBondContact O-N 3.47Å |
| 130 | D | 64.6 | Low | 68 | Low | 96 Ų | 96 | 124.4 Ų | 124.4 | 51% | 0.513 | 60% | 0.596 | S | S | . | * | trans | -75.9 | 36.2 | 171.8 | -161.5 | 13.4 | 0 | 0 | 0 | 111.9 | K87 A126 R127 G132 | K87-D130 IonicContact NZ-OD2 3.18Å; K87-D130 PolarHBondContact NZ-OD2 3.24Å; A126-D130 PolarHBondContact O-N 3.49Å; R127-D130 PolarHBondContact O-N 3.04Å; D130-G132 PolarHBondContact O-N 3.24Å; D130-G132 VanDerWaalsContact O-N 3.17Å | ||
| 131 | Q | 57.6 | Low | 66.7 | Low | 114 Ų | 114 | 121.8 Ų | 121.8 | 53% | 0.533 | 59% | 0.592 | S | S | . | * | G | 310 helix | trans | -70.1 | 4.3 | 169.3 | -78.6 | 177.9 | 37.8 | 0 | 0 | 111.9 | S128 H129 R133 Q134 | S128-Q131 WeakPolarHBondContact O-CG 3.29Å; S128-Q131 PolarHBondContact O-NE2 3.25Å; H129-Q131 PolarHBondContact O-N 3.47Å; Q131-R133 PolarHBondContact O-N 3.4Å; Q131-R133 VanDerWaalsContact O-N 3.13Å; Q131-Q134 HydrophobicContact CB-CG 4.21Å; Q131-Q134 WeakPolarHBondContact O-CB 3.43Å; Q131-Q134 WeakPolarHBondContact O-CG 3.27Å; Q131-Q134 PolarHBondContact O-N 3.42Å |
| 132 | G | 54.3 | Low | 65.1 | Low | 74 Ų | 74 | 121.4 Ų | 121.4 | 76% | 0.763 | 61% | 0.606 | S | S | * | * | G | 310 helix | trans | -71.2 | -0.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | D130 | D130-G132 PolarHBondContact O-N 3.24Å; D130-G132 VanDerWaalsContact O-N 3.17Å |
| 133 | R | 50.9 | Low | 63.6 | Low | 222 Ų | 222 | 119.7 Ų | 119.7 | 84% | 0.838 | 61% | 0.608 | S | S | * | * | G | 310 helix | trans | -104 | 27.1 | 159.2 | -80.9 | -165.5 | 179.8 | 166.3 | -0.2 | 112.2 | Q131 H135 | Q131-R133 PolarHBondContact O-N 3.4Å; Q131-R133 VanDerWaalsContact O-N 3.13Å; R133-H135 VanDerWaalsContact C-N 3.3Å; R133-H135 PolarHBondContact O-CD2 3.26Å; R133-H135 PolarHBondContact O-N 3.25Å |
| 134 | Q | 58.8 | Low | 62.5 | Low | 134 Ų | 134 | 118.8 Ų | 118.8 | 63% | 0.626 | 62% | 0.616 | S | S | * | * | trans | -56.8 | 103.2 | 159.2 | -85 | 174.3 | 5.6 | 0 | 0 | 107.1 | Q131 H136 | Q131-Q134 HydrophobicContact CB-CG 4.21Å; Q131-Q134 WeakPolarHBondContact O-CB 3.43Å; Q131-Q134 WeakPolarHBondContact O-CG 3.27Å; Q131-Q134 PolarHBondContact O-N 3.42Å; Q134-H136 VanDerWaalsContact C-N 3.33Å; Q134-H136 PolarHBondContact O-N 3.04Å | ||
| 135 | H | 56.7 | Low | 60.9 | Low | 149 Ų | 149 | 121 Ų | 121 | 69% | 0.69 | 64% | 0.636 | S | S | * | * | trans | -50.6 | 102.2 | 170.4 | -68.1 | -85.7 | 0 | 0 | 0 | 107.2 | R133 Y137 | R133-H135 VanDerWaalsContact C-N 3.3Å; R133-H135 PolarHBondContact O-CD2 3.26Å; R133-H135 PolarHBondContact O-N 3.25Å; H135-Y137 HydrophobicContact CB-CD2 4.25Å; H135-Y137 HydrophobicContact CB-CE2 4.01Å; H135-Y137 PolarHBondContact O-N 3.48Å | ||
| 136 | H | 55.9 | Low | 59.3 | Low | 175 Ų | 175 | 127.9 Ų | 127.9 | 81% | 0.81 | 66% | 0.659 | S | S | * | * | trans | -64.4 | 91.8 | 160 | -164.2 | 76.5 | 0 | 0 | 0 | 104.3 | Q134 D138 | Q134-H136 VanDerWaalsContact C-N 3.33Å; Q134-H136 PolarHBondContact O-N 3.04Å; H136-D138 PolarHBondContact O-N 2.96Å | ||
| 137 | Y | 54.1 | Low | 58.3 | Low | 190 Ų | 190 | 130.2 Ų | 130.2 | 75% | 0.745 | 67% | 0.672 | S | S | * | * | trans | -62.6 | 101.4 | 162.8 | -72.8 | -79.2 | 0 | 0 | 0 | 104.5 | H135 E139 | H135-Y137 HydrophobicContact CB-CD2 4.25Å; H135-Y137 HydrophobicContact CB-CE2 4.01Å; H135-Y137 PolarHBondContact O-N 3.48Å; Y137-E139 VanDerWaalsContact C-N 3.26Å; Y137-E139 PolarHBondContact O-N 3.36Å | ||
| 138 | D | 60.8 | Low | 57.6 | Low | 88 Ų | 88 | 127.4 Ų | 127.4 | 47% | 0.471 | 68% | 0.675 | S | S | . | * | trans | -60.5 | 98.6 | 162.7 | 174.7 | 13.7 | 0 | 0 | 0 | 106 | H136 N140 A141 | H136-D138 PolarHBondContact O-N 2.96Å; D138-N140 PolarHBondContact O-N 3.02Å; D138-N140 WeakPolarHBondContact OD1-CA 3.36Å; D138-N140 WeakPolarHBondContact OD1-CB 3.49Å; D138-N140 PolarHBondContact OD1-N 3.33Å; D138-A141 HydrophobicContact CB-CB 4.15Å; D138-A141 WeakPolarHBondContact O-CB 3.39Å; D138-A141 PolarHBondContact O-N 2.96Å; D138-A141 PolarHBondContact OD1-N 3.27Å; D138-A141 PolarHBondContact OD2-N 3.29Å | ||
| 139 | E | 60.9 | Low | 56.4 | Low | 181 Ų | 181 | 134 Ų | 134 | 85% | 0.846 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.9 | -8.2 | 176.8 | -69.9 | -151.4 | 153.1 | 0 | 0 | 112.6 | Y137 | Y137-E139 VanDerWaalsContact C-N 3.26Å; Y137-E139 PolarHBondContact O-N 3.36Å |
| 140 | N | 59.2 | Low | 55.7 | Low | 142 Ų | 142 | 139.4 Ų | 139.4 | 76% | 0.759 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.9 | 5.2 | 174.2 | -60.3 | -61.3 | 0 | 0 | 0 | 113.9 | D138 | D138-N140 PolarHBondContact O-N 3.02Å; D138-N140 WeakPolarHBondContact OD1-CA 3.36Å; D138-N140 WeakPolarHBondContact OD1-CB 3.49Å; D138-N140 PolarHBondContact OD1-N 3.33Å |
| 141 | A | 58.3 | Low | 55 | Low | 46 Ų | 46 | 142.9 Ų | 142.9 | 38% | 0.38 | 72% | 0.72 | S | S | . | * | S | Bend | trans | -60.7 | 128.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | D138 I143 | D138-A141 HydrophobicContact CB-CB 4.15Å; D138-A141 WeakPolarHBondContact O-CB 3.39Å; D138-A141 PolarHBondContact O-N 2.96Å; D138-A141 PolarHBondContact OD1-N 3.27Å; D138-A141 PolarHBondContact OD2-N 3.29Å; A141-I143 PolarHBondContact O-N 3Å |
| 142 | P | 54.6 | Low | 54.7 | Low | 129 Ų | 129 | 140.5 Ų | 140.5 | 84% | 0.838 | 73% | 0.726 | S | S | * | * | trans | -60.2 | 102.8 | -177.1 | 19.5 | -29.1 | 0 | 0 | 0 | 109.6 | G144 | P142-G144 PolarHBondContact O-N 2.98Š| ||
| 143 | I | 51.5 | Low | 54.8 | Low | 129 Ų | 129 | 141.9 Ų | 141.9 | 66% | 0.662 | 73% | 0.731 | S | S | * | * | trans | -59.7 | 111 | 177.1 | -70.3 | 157.7 | 0 | 0 | 0 | 106.7 | A141 R146 | A141-I143 PolarHBondContact O-N 3Å; I143-R146 HydrophobicContact CG2-CB 4.39Å; I143-R146 VanDerWaalsContact CG2-CD 3.45Å; I143-R146 HydrophobicContact CG2-CG 3.64Å | ||
| 144 | G | 58 | Low | 55.1 | Low | 51 Ų | 51 | 138.6 Ų | 138.6 | 53% | 0.526 | 73% | 0.73 | S | S | . | * | trans | -50.9 | 158 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111 | P142 R146 | P142-G144 PolarHBondContact O-N 2.98Å; G144-R146 PolarHBondContact O-N 3.3Å | ||
| 145 | P | 49.8 | Very low | 54.9 | Low | 140 Ų | 140 | 137.7 Ų | 137.7 | 91% | 0.909 | 73% | 0.733 | S | S | * | * | trans | -60.4 | 94.7 | -157.2 | 24.8 | -34 | 0 | 0 | 0 | 112.1 | S147 | P145-S147 PolarHBondContact O-N 3.3Š| ||
| 146 | R | 51 | Low | 54.9 | Low | 220 Ų | 220 | 136 Ų | 136 | 83% | 0.83 | 73% | 0.729 | S | S | * | * | trans | -82.8 | 99.9 | 169.4 | -66.1 | -175.2 | 92.9 | 101.1 | -2.1 | 107.1 | I143 G144 | I143-R146 HydrophobicContact CG2-CB 4.39Å; I143-R146 VanDerWaalsContact CG2-CD 3.45Å; I143-R146 HydrophobicContact CG2-CG 3.64Å; G144-R146 PolarHBondContact O-N 3.3Å | ||
| 147 | S | 55.2 | Low | 54.9 | Low | 109 Ų | 109 | 137.9 Ų | 137.9 | 76% | 0.762 | 73% | 0.731 | S | S | * | * | trans | -54.5 | 137.7 | 158.7 | 173.4 | 0 | 0 | 0 | 0 | 109.4 | P145 | P145-S147 PolarHBondContact O-N 3.3Š| ||
| 148 | S | 57.2 | Low | 55.6 | Low | 93 Ų | 93 | 134 Ų | 134 | 65% | 0.65 | 72% | 0.723 | S | S | * | * | S | Bend | trans | 94.4 | 116 | 154.1 | 83.1 | 0 | 0 | 0 | 0 | 118.5 | ||
| 149 | Y | 48 | Very low | 54.9 | Low | 197 Ų | 197 | 139.8 Ų | 139.8 | 77% | 0.773 | 74% | 0.74 | S | S | * | * | trans | 71.6 | 74.1 | 158.7 | -62.7 | -79.6 | 0 | 0 | 0 | 118.6 | H151 | Y149-H151 AromaticContact CD1-CE1 3.78Å; Y149-H151 PolarHBondContact O-N 3.38Å | ||
| 150 | R | 52 | Low | 54.6 | Low | 248 Ų | 248 | 145.2 Ų | 145.2 | 94% | 0.936 | 76% | 0.755 | S | S | * | * | trans | -62.3 | 105.7 | 138.8 | -74.3 | -170.7 | 172.7 | -170.9 | -1.8 | 108.1 | G152 | R150-G152 PolarHBondContact O-N 3.36Å; R150-G152 VanDerWaalsContact O-N 3.07Å | ||
| 151 | H | 50 | Low | 54.4 | Low | 169 Ų | 169 | 145.4 Ų | 145.4 | 78% | 0.782 | 75% | 0.754 | S | S | * | * | trans | -76.6 | 83.8 | 156.2 | -76.8 | -0.5 | 0 | 0 | 0 | 107.6 | Y149 | Y149-H151 AromaticContact CD1-CE1 3.78Å; Y149-H151 PolarHBondContact O-N 3.38Å | ||
| 152 | G | 51.8 | Low | 54.2 | Low | 64 Ų | 64 | 150.6 Ų | 150.6 | 66% | 0.66 | 77% | 0.774 | S | S | * | * | trans | -68.2 | 130.7 | 160.5 | 0 | 0 | 0 | 0 | 0 | 109 | R150 | R150-G152 PolarHBondContact O-N 3.36Å; R150-G152 VanDerWaalsContact O-N 3.07Å | ||
| 153 | A | 55.3 | Low | 54.2 | Low | 104 Ų | 104 | 151.8 Ų | 151.8 | 86% | 0.86 | 77% | 0.771 | S | S | * | * | trans | 35.3 | 97.4 | 150.6 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 154 | N | 58.9 | Low | 54.3 | Low | 153 Ų | 153 | 153.2 Ų | 153.2 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | -147.5 | 80.3 | 141.3 | -169.7 | 17.8 | 0 | 0 | 0 | 110.3 | ||||
| 155 | V | 54.6 | Low | 54.1 | Low | 114 Ų | 114 | 159.6 Ų | 159.6 | 69% | 0.691 | 79% | 0.793 | S | S | * | * | trans | -124.7 | 116.3 | 155.2 | -72.3 | 0 | 0 | 0 | 0 | 108 | ||||
| 156 | N | 54.9 | Low | 54.4 | Low | 114 Ų | 114 | 160.9 Ų | 160.9 | 61% | 0.61 | 79% | 0.785 | S | S | * | * | trans | -70.4 | 118 | 179.4 | -175.4 | 33.3 | 0 | 0 | 0 | 109.7 | D158 | N156-D158 VanDerWaalsContact C-N 3.29Å; N156-D158 PolarHBondContact O-N 3.39Å; N156-D158 PolarHBondContact OD1-OD2 3.42Å | ||
| 157 | Y | 57.1 | Low | 54.6 | Low | 214 Ų | 214 | 156.6 Ų | 156.6 | 84% | 0.839 | 78% | 0.782 | S | S | * | * | trans | -93.4 | 66.3 | 167.8 | -71.1 | -77 | 0 | 0 | 0 | 109.4 | ||||
| 158 | D | 68 | Low | 54.6 | Low | 110 Ų | 110 | 160.3 Ų | 160.3 | 59% | 0.588 | 78% | 0.783 | S | S | * | * | trans | -122 | 128 | 159.7 | -71.8 | -36.5 | 0 | 0 | 0 | 106.9 | N156 | N156-D158 VanDerWaalsContact C-N 3.29Å; N156-D158 PolarHBondContact O-N 3.39Å; N156-D158 PolarHBondContact OD1-OD2 3.42Å | ||
| 159 | Y | 46.6 | Very low | 54.4 | Low | 209 Ų | 209 | 165.9 Ų | 165.9 | 82% | 0.82 | 79% | 0.794 | S | S | * | * | trans | 103.4 | 105.4 | 173.8 | -65.3 | -83.3 | 0 | 0 | 0 | 118.1 | ||||
| 160 | Y | 55 | Low | 54.9 | Low | 295 Ų | 295 | 163.1 Ų | 163.1 | 100% | 1.157 | 80% | 0.796 | S | S | * | * | trans | 89.1 | 0 | 164.5 | -65.2 | -77.5 | 0 | 0 | 0 | 118.3 |
Retrieved 160 of 160 residues in 38.6 ms
(Link to these results)