| 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 | 61.4 | Low | 85 | Confident | 210 Ų | 210 | 113.7 Ų | 113.7 | 100% | 1.034 | 62% | 0.618 | S | S | * | * | 0 | -34.8 | 0 | -66.2 | -169.6 | -179.5 | 0 | 0 | 113.4 | S3 C4 | M1-S3 VanDerWaalsContact C-N 3.3Å; M1-S3 PolarHBondContact O-N 3.43Å; M1-C4 PolarHBondContact O-N 3.32Å | |||
| 2 | L | 70.4 | Confident | 85.6 | Confident | 146 Ų | 146 | 108.6 Ų | 108.6 | 76% | 0.764 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -57.3 | -39.4 | -180 | -138.7 | 82.9 | 0 | 0 | 0 | 113.5 | C4 R5 L6 | L2-C4 VanDerWaalsContact C-N 3.33Å; L2-C4 PolarHBondContact O-N 3.13Å; L2-R5 PolarHBondContact O-N 3.37Å; L2-L6 PolarHBondContact O-N 3.32Å; L2-L6 VanDerWaalsContact O-N 3.13Å |
| 3 | S | 82.1 | Confident | 85.9 | Confident | 85 Ų | 85 | 108.2 Ų | 108.2 | 59% | 0.594 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -63 | -36.5 | -177.5 | -23.9 | 0 | 0 | 0 | 0 | 113.1 | M1 L6 Q7 | M1-S3 VanDerWaalsContact C-N 3.3Å; M1-S3 PolarHBondContact O-N 3.43Å; S3-L6 PolarHBondContact O-N 3.5Å; S3-Q7 WeakPolarHBondContact O-CB 3.45Å; S3-Q7 VanDerWaalsContact O-CG 3.3Å; S3-Q7 WeakPolarHBondContact O-CG 3.35Å; S3-Q7 PolarHBondContact O-N 2.9Å |
| 4 | C | 87.1 | Confident | 86.1 | Confident | 75 Ų | 75 | 105.2 Ų | 105.2 | 51% | 0.507 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -69.7 | -42.3 | 179.8 | -176.2 | 0 | 0 | 0 | 0 | 111 | M1 L2 L6 Q7 C8 | M1-C4 PolarHBondContact O-N 3.32Å; L2-C4 VanDerWaalsContact C-N 3.33Å; L2-C4 PolarHBondContact O-N 3.13Å; C4-L6 VanDerWaalsContact C-N 3.32Å; C4-L6 PolarHBondContact O-N 3.35Å; C4-Q7 PolarHBondContact O-N 3.2Å; C4-C8 WeakPolarHBondContact O-CB 3.48Å; C4-C8 PolarHBondContact O-N 3.33Å; C4-C8 PolarHBondContact O-SG 2.99Å |
| 5 | R | 89.2 | Confident | 86.1 | Confident | 207 Ų | 207 | 104.8 Ų | 104.8 | 78% | 0.781 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -63 | -40.1 | 175.8 | -68.3 | -161.3 | 173.9 | -164.3 | -0.9 | 112.2 | L2 C8 A9 | L2-R5 PolarHBondContact O-N 3.37Å; R5-C8 PolarHBondContact O-N 2.91Å; R5-A9 WeakPolarHBondContact O-CB 3.3Å; R5-A9 PolarHBondContact O-N 2.95Å |
| 6 | L | 90 | Very high | 86.1 | Confident | 107 Ų | 107 | 104.6 Ų | 104.6 | 56% | 0.56 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -68 | -40.7 | 179.2 | -148.5 | 131 | 0 | 0 | 0 | 111.4 | L2 S3 C4 A9 L10 | L2-L6 PolarHBondContact O-N 3.32Å; L2-L6 VanDerWaalsContact O-N 3.13Å; S3-L6 PolarHBondContact O-N 3.5Å; C4-L6 VanDerWaalsContact C-N 3.32Å; C4-L6 PolarHBondContact O-N 3.35Å; L6-A9 PolarHBondContact O-N 3.43Å; L6-L10 HydrophobicContact CD2-CD1 3.98Å; L6-L10 WeakPolarHBondContact O-CG 3.27Å; L6-L10 PolarHBondContact O-N 3.4Å |
| 7 | Q | 88.6 | Confident | 85.9 | Confident | 133 Ų | 133 | 105.3 Ų | 105.3 | 62% | 0.621 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -63.8 | -43.4 | 172.7 | -75.6 | 173.6 | -15.8 | 0 | 0 | 112.4 | S3 C4 A9 L10 A11 | S3-Q7 WeakPolarHBondContact O-CB 3.45Å; S3-Q7 VanDerWaalsContact O-CG 3.3Å; S3-Q7 WeakPolarHBondContact O-CG 3.35Å; S3-Q7 PolarHBondContact O-N 2.9Å; C4-Q7 PolarHBondContact O-N 3.2Å; Q7-A9 VanDerWaalsContact C-N 3.35Å; Q7-A9 PolarHBondContact O-N 2.9Å; Q7-L10 PolarHBondContact O-N 3.47Å; Q7-A11 WeakPolarHBondContact O-CB 3.39Å; Q7-A11 PolarHBondContact O-N 3.41Å |
| 8 | C | 91.1 | Very high | 85.5 | Confident | 75 Ų | 75 | 102.9 Ų | 102.9 | 51% | 0.507 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -63 | -41 | 175.6 | -68 | 0 | 0 | 0 | 0 | 111.9 | C4 R5 A11 A12 | C4-C8 WeakPolarHBondContact O-CB 3.48Å; C4-C8 PolarHBondContact O-N 3.33Å; C4-C8 PolarHBondContact O-SG 2.99Å; R5-C8 PolarHBondContact O-N 2.91Å; C8-A11 PolarHBondContact O-N 2.89Å; C8-A12 WeakPolarHBondContact O-CB 3.34Å; C8-A12 PolarHBondContact O-N 3.4Å |
| 9 | A | 91.7 | Very high | 85 | Confident | 59 Ų | 59 | 103.5 Ų | 103.5 | 49% | 0.488 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -64.2 | -45 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | R5 L6 Q7 A12 L13 | R5-A9 WeakPolarHBondContact O-CB 3.3Å; R5-A9 PolarHBondContact O-N 2.95Å; L6-A9 PolarHBondContact O-N 3.43Å; Q7-A9 VanDerWaalsContact C-N 3.35Å; Q7-A9 PolarHBondContact O-N 2.9Å; A9-A12 PolarHBondContact O-N 3.39Å; A9-L13 VanDerWaalsContact O-CB 3.27Å; A9-L13 WeakPolarHBondContact O-CB 3.37Å; A9-L13 PolarHBondContact O-N 3.04Å |
| 10 | L | 92 | Very high | 84.1 | Confident | 108 Ų | 108 | 100.2 Ų | 100.2 | 57% | 0.565 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -63.9 | -40.6 | 176 | -72.8 | 173.3 | 0 | 0 | 0 | 112.2 | L6 Q7 L13 S14 | L6-L10 HydrophobicContact CD2-CD1 3.98Å; L6-L10 WeakPolarHBondContact O-CG 3.27Å; L6-L10 PolarHBondContact O-N 3.4Å; Q7-L10 PolarHBondContact O-N 3.47Å; L10-L13 PolarHBondContact O-N 2.69Å; L10-S14 WeakPolarHBondContact O-CB 3.41Å; L10-S14 PolarHBondContact O-N 2.87Å |
| 11 | A | 92 | Very high | 83.1 | Confident | 46 Ų | 46 | 98.1 Ų | 98.1 | 38% | 0.38 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62.4 | -47.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q7 C8 L13 S14 I15 | Q7-A11 WeakPolarHBondContact O-CB 3.39Å; Q7-A11 PolarHBondContact O-N 3.41Å; C8-A11 PolarHBondContact O-N 2.89Å; A11-L13 VanDerWaalsContact C-N 3.34Å; A11-L13 PolarHBondContact O-N 3.28Å; A11-S14 PolarHBondContact O-N 3.44Å; A11-S14 PolarHBondContact O-OG 2.87Å; A11-I15 VanDerWaalsContact O-CG1 3.31Å; A11-I15 WeakPolarHBondContact O-CG1 3.31Å; A11-I15 PolarHBondContact O-N 3.36Å |
| 12 | A | 91.4 | Very high | 83 | Confident | 52 Ų | 52 | 93.2 Ų | 93.2 | 43% | 0.43 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -60 | -44.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | C8 A9 S14 I15 V16 | C8-A12 WeakPolarHBondContact O-CB 3.34Å; C8-A12 PolarHBondContact O-N 3.4Å; A9-A12 PolarHBondContact O-N 3.39Å; A12-S14 VanDerWaalsContact C-N 3.35Å; A12-S14 PolarHBondContact O-N 3.47Å; A12-I15 PolarHBondContact O-N 2.86Å; A12-V16 WeakPolarHBondContact O-CG2 3.35Å; A12-V16 PolarHBondContact O-N 2.95Å |
| 13 | L | 90.4 | Very high | 82.2 | Confident | 104 Ų | 104 | 91.9 Ų | 91.9 | 55% | 0.545 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.7 | -39.1 | 179.2 | -157.3 | 154.1 | 0 | 0 | 0 | 111.3 | A9 L10 A11 I15 V16 L17 | A9-L13 VanDerWaalsContact O-CB 3.27Å; A9-L13 WeakPolarHBondContact O-CB 3.37Å; A9-L13 PolarHBondContact O-N 3.04Å; L10-L13 PolarHBondContact O-N 2.69Å; A11-L13 VanDerWaalsContact C-N 3.34Å; A11-L13 PolarHBondContact O-N 3.28Å; L13-I15 VanDerWaalsContact C-N 3.35Å; L13-I15 PolarHBondContact O-N 3.46Å; L13-V16 PolarHBondContact O-N 2.91Å; L13-L17 HydrophobicContact CD2-CD1 3.41Å; L13-L17 VanDerWaalsContact CD2-CD1 3.41Å; L13-L17 HydrophobicContact CD2-CG 4.15Å; L13-L17 WeakPolarHBondContact O-CB 3.34Å; L13-L17 WeakPolarHBondContact O-CG 3.45Å; L13-L17 PolarHBondContact O-N 3.37Å |
| 14 | S | 87.6 | Confident | 80.8 | Confident | 66 Ų | 66 | 90.3 Ų | 90.3 | 46% | 0.462 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.8 | -37.7 | 174.4 | 75.3 | 0 | 0 | 0 | 0 | 113 | L10 A11 A12 A18 | L10-S14 WeakPolarHBondContact O-CB 3.41Å; L10-S14 PolarHBondContact O-N 2.87Å; A11-S14 PolarHBondContact O-N 3.44Å; A11-S14 PolarHBondContact O-OG 2.87Å; A12-S14 VanDerWaalsContact C-N 3.35Å; A12-S14 PolarHBondContact O-N 3.47Å; S14-A18 WeakPolarHBondContact O-CB 3.48Å; S14-A18 PolarHBondContact O-N 2.92Å |
| 15 | I | 87.2 | Confident | 79.2 | Confident | 99 Ų | 99 | 88 Ų | 88 | 51% | 0.508 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -69.6 | -44.1 | 177.1 | -67.1 | 163.1 | 0 | 0 | 0 | 109.9 | A11 A12 L13 L17 A18 L19 | A11-I15 VanDerWaalsContact O-CG1 3.31Å; A11-I15 WeakPolarHBondContact O-CG1 3.31Å; A11-I15 PolarHBondContact O-N 3.36Å; A12-I15 PolarHBondContact O-N 2.86Å; L13-I15 VanDerWaalsContact C-N 3.35Å; L13-I15 PolarHBondContact O-N 3.46Å; I15-L17 VanDerWaalsContact C-N 3.35Å; I15-L17 PolarHBondContact O-N 3.22Å; I15-A18 PolarHBondContact O-N 3.48Å; I15-L19 HydrophobicContact CG2-CD1 3.75Å; I15-L19 HydrophobicContact CG2-CG 4.27Å; I15-L19 WeakPolarHBondContact O-CB 3.45Å; I15-L19 VanDerWaalsContact O-CG 3.29Å; I15-L19 WeakPolarHBondContact O-CG 3.44Å; I15-L19 PolarHBondContact O-N 3.22Å |
| 16 | V | 85.8 | Confident | 77.6 | Confident | 102 Ų | 102 | 80.9 Ų | 80.9 | 62% | 0.618 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.7 | -43.1 | 176.8 | 171.6 | 0 | 0 | 0 | 0 | 111 | A12 L13 L19 G20 | A12-V16 WeakPolarHBondContact O-CG2 3.35Å; A12-V16 PolarHBondContact O-N 2.95Å; L13-V16 PolarHBondContact O-N 2.91Å; V16-L19 PolarHBondContact O-N 3.38Å; V16-G20 WeakPolarHBondContact O-CA 3.29Å; V16-G20 PolarHBondContact O-N 2.73Å |
| 17 | L | 82.3 | Confident | 76.1 | Confident | 116 Ų | 116 | 81 Ų | 81 | 61% | 0.607 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.3 | -42.2 | 174 | -81.1 | 161.3 | 0 | 0 | 0 | 112.1 | L13 I15 G21 | L13-L17 HydrophobicContact CD2-CD1 3.41Å; L13-L17 VanDerWaalsContact CD2-CD1 3.41Å; L13-L17 HydrophobicContact CD2-CG 4.15Å; L13-L17 WeakPolarHBondContact O-CB 3.34Å; L13-L17 WeakPolarHBondContact O-CG 3.45Å; L13-L17 PolarHBondContact O-N 3.37Å; I15-L17 VanDerWaalsContact C-N 3.35Å; I15-L17 PolarHBondContact O-N 3.22Å; L17-G21 PolarHBondContact O-N 2.76Å |
| 18 | A | 78.8 | Confident | 74.7 | Confident | 63 Ų | 63 | 79.7 Ų | 79.7 | 52% | 0.521 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.7 | -40.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | S14 I15 V22 | S14-A18 WeakPolarHBondContact O-CB 3.48Å; S14-A18 PolarHBondContact O-N 2.92Å; I15-A18 PolarHBondContact O-N 3.48Å; A18-V22 WeakPolarHBondContact O-CG2 3.21Å; A18-V22 PolarHBondContact O-N 3.4Å |
| 19 | L | 76.3 | Confident | 73.4 | Confident | 114 Ų | 114 | 80.8 Ų | 80.8 | 60% | 0.597 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -73.6 | -43.1 | 177.7 | -67.2 | 173.2 | 0 | 0 | 0 | 111.7 | I15 V16 V22 T23 | I15-L19 HydrophobicContact CG2-CD1 3.75Å; I15-L19 HydrophobicContact CG2-CG 4.27Å; I15-L19 WeakPolarHBondContact O-CB 3.45Å; I15-L19 VanDerWaalsContact O-CG 3.29Å; I15-L19 WeakPolarHBondContact O-CG 3.44Å; I15-L19 PolarHBondContact O-N 3.22Å; V16-L19 PolarHBondContact O-N 3.38Å; L19-V22 WeakPolarHBondContact O-CB 3.48Å; L19-V22 PolarHBondContact O-N 2.86Å; L19-V22 VanDerWaalsContact O-N 3.14Å; L19-T23 PolarHBondContact O-N 3.48Å; L19-T23 VanDerWaalsContact O-N 3.12Å; L19-T23 PolarHBondContact O-OG1 3.02Å |
| 20 | G | 67.6 | Low | 72 | Confident | 36 Ų | 36 | 88 Ų | 88 | 37% | 0.371 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -65.7 | -37.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | V16 V22 T23 G24 | V16-G20 WeakPolarHBondContact O-CA 3.29Å; V16-G20 PolarHBondContact O-N 2.73Å; G20-V22 PolarHBondContact O-N 2.87Å; G20-T23 WeakPolarHBondContact CA-OG1 3.39Å; G20-T23 PolarHBondContact O-N 3.21Å; G20-T23 PolarHBondContact O-OG1 3.37Å; G20-G24 PolarHBondContact O-N 2.94Å |
| 21 | G | 61.5 | Low | 70.5 | Confident | 57 Ų | 57 | 87 Ų | 87 | 59% | 0.588 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -66.2 | -25.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | L17 | L17-G21 PolarHBondContact O-N 2.76Å |
| 22 | V | 59.1 | Low | 69.3 | Low | 107 Ų | 107 | 90.8 Ų | 90.8 | 65% | 0.648 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -79.6 | -29.9 | 174.3 | 171.6 | 0 | 0 | 0 | 0 | 111.4 | A18 L19 G20 A25 | A18-V22 WeakPolarHBondContact O-CG2 3.21Å; A18-V22 PolarHBondContact O-N 3.4Å; L19-V22 WeakPolarHBondContact O-CB 3.48Å; L19-V22 PolarHBondContact O-N 2.86Å; L19-V22 VanDerWaalsContact O-N 3.14Å; G20-V22 PolarHBondContact O-N 2.87Å; V22-A25 WeakPolarHBondContact O-CB 3.41Å |
| 23 | T | 54.9 | Low | 68.2 | Low | 118 Ų | 118 | 93.1 Ų | 93.1 | 72% | 0.724 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -82.8 | -23.9 | 177.5 | 53.8 | 0 | 0 | 0 | 0 | 114 | L19 G20 A25 | L19-T23 PolarHBondContact O-N 3.48Å; L19-T23 VanDerWaalsContact O-N 3.12Å; L19-T23 PolarHBondContact O-OG1 3.02Å; G20-T23 WeakPolarHBondContact CA-OG1 3.39Å; G20-T23 PolarHBondContact O-N 3.21Å; G20-T23 PolarHBondContact O-OG1 3.37Å; T23-A25 PolarHBondContact O-N 3.12Å |
| 24 | G | 52 | Low | 67.2 | Low | 53 Ų | 53 | 95.2 Ų | 95.2 | 55% | 0.546 | 55% | 0.552 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80.9 | 6.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | G20 | G20-G24 PolarHBondContact O-N 2.94Š|
| 25 | A | 53.8 | Low | 66.2 | Low | 27 Ų | 27 | 95.6 Ų | 95.6 | 22% | 0.223 | 55% | 0.549 | C | S | . | . | S | Bend | trans | -69.6 | 125 | 179 | 0 | 0 | 0 | 0 | 0 | 109.9 | V22 T23 S27 R32 | V22-A25 WeakPolarHBondContact O-CB 3.41Å; T23-A25 PolarHBondContact O-N 3.12Å; A25-S27 PolarHBondContact O-N 3.14Å; A25-R32 VanDerWaalsContact CB-NH2 3.26Å |
| 26 | P | 55.4 | Low | 65.4 | Low | 57 Ų | 57 | 97.6 Ų | 97.6 | 37% | 0.37 | 56% | 0.556 | S | S | . | * | trans | -54.7 | 115.6 | -177.3 | 19.5 | -30.3 | 0 | 0 | 0 | 109.3 | D28 L31 R32 | P26-D28 PolarHBondContact O-N 2.85Å; P26-L31 HydrophobicContact CB-CB 4.49Å; P26-L31 HydrophobicContact CB-CD2 3.78Å; P26-L31 HydrophobicContact CG-CB 4.42Å; P26-L31 HydrophobicContact CG-CD2 3.58Å; P26-R32 PolarHBondContact O-NH1 3.34Å; P26-R32 VanDerWaalsContact O-NH1 3.12Å | ||
| 27 | S | 57.8 | Low | 64.8 | Low | 109 Ų | 109 | 98.8 Ų | 98.8 | 76% | 0.762 | 55% | 0.552 | S | S | * | * | trans | -59.8 | -11.3 | -177.6 | -49.3 | 0 | 0 | 0 | 0 | 112.8 | A25 P29 | A25-S27 PolarHBondContact O-N 3.14Å; S27-P29 VanDerWaalsContact O-CD 3.27Å; S27-P29 WeakPolarHBondContact O-CD 3.48Å | ||
| 28 | D | 60 | Low | 63.9 | Low | 105 Ų | 105 | 95.5 Ų | 95.5 | 56% | 0.561 | 54% | 0.539 | S | S | * | . | trans | -70.3 | 114.2 | 179.2 | -80.2 | -31.8 | 0 | 0 | 0 | 111.7 | P26 R30 L31 R32 | P26-D28 PolarHBondContact O-N 2.85Å; D28-R30 PolarHBondContact O-N 2.97Å; D28-R30 VanDerWaalsContact O-N 3.09Å; D28-L31 HydrophobicContact CB-CB 4.24Å; D28-L31 PolarHBondContact O-N 2.84Å; D28-L31 VanDerWaalsContact O-N 3.11Å; D28-R32 PolarHBondContact O-N 2.87Å | ||
| 29 | P | 64.3 | Low | 63.1 | Low | 98 Ų | 98 | 98.2 Ų | 98.2 | 64% | 0.636 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.2 | -23.4 | 179.1 | 25.9 | -34.2 | 0 | 0 | 0 | 111.9 | S27 Q33 | S27-P29 VanDerWaalsContact O-CD 3.27Å; S27-P29 WeakPolarHBondContact O-CD 3.48Å; P29-Q33 WeakPolarHBondContact O-CB 3.45Å; P29-Q33 PolarHBondContact O-N 3.42Å |
| 30 | R | 62.8 | Low | 62.6 | Low | 211 Ų | 211 | 96.2 Ų | 96.2 | 80% | 0.796 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -70.2 | -40.8 | 176.9 | -57.1 | -168.1 | -154.8 | -162.6 | 7.7 | 112.3 | D28 Q33 F34 | D28-R30 PolarHBondContact O-N 2.97Å; D28-R30 VanDerWaalsContact O-N 3.09Å; R30-Q33 PolarHBondContact O-N 3.46Å; R30-F34 WeakPolarHBondContact O-CB 3.45Å; R30-F34 PolarHBondContact O-N 3.21Å |
| 31 | L | 60.5 | Low | 62.5 | Low | 87 Ų | 87 | 98.4 Ų | 98.4 | 46% | 0.455 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -68.6 | -41.3 | 179.9 | -133.9 | 82.4 | 0 | 0 | 0 | 110.2 | P26 D28 Q33 F34 L35 | P26-L31 HydrophobicContact CB-CB 4.49Å; P26-L31 HydrophobicContact CB-CD2 3.78Å; P26-L31 HydrophobicContact CG-CB 4.42Å; P26-L31 HydrophobicContact CG-CD2 3.58Å; D28-L31 HydrophobicContact CB-CB 4.24Å; D28-L31 PolarHBondContact O-N 2.84Å; D28-L31 VanDerWaalsContact O-N 3.11Å; L31-Q33 VanDerWaalsContact C-N 3.34Å; L31-Q33 PolarHBondContact O-N 3.29Å; L31-F34 PolarHBondContact O-N 3.41Å; L31-L35 WeakPolarHBondContact O-CB 3.27Å; L31-L35 WeakPolarHBondContact O-CG 3.5Å; L31-L35 PolarHBondContact O-N 3.41Å |
| 32 | R | 64.8 | Low | 62.3 | Low | 125 Ų | 125 | 96.3 Ų | 96.3 | 47% | 0.472 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -57.6 | -45 | 171 | -78.7 | -168.4 | 163.4 | 97.8 | -6.5 | 112.3 | A25 P26 D28 F34 L35 Q36 | A25-R32 VanDerWaalsContact CB-NH2 3.26Å; P26-R32 PolarHBondContact O-NH1 3.34Å; P26-R32 VanDerWaalsContact O-NH1 3.12Å; D28-R32 PolarHBondContact O-N 2.87Å; R32-F34 VanDerWaalsContact C-N 3.33Å; R32-F34 PolarHBondContact O-N 2.9Å; R32-L35 PolarHBondContact O-N 3.46Å; R32-Q36 VanDerWaalsContact O-CB 3.26Å; R32-Q36 WeakPolarHBondContact O-CB 3.25Å; R32-Q36 PolarHBondContact O-N 3.02Å |
| 33 | Q | 69.9 | Low | 62.2 | Low | 102 Ų | 102 | 95.3 Ų | 95.3 | 48% | 0.477 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.9 | -36.9 | 178 | -164.6 | -174.6 | 11.2 | 0 | 0 | 112.2 | P29 R30 L31 K37 | P29-Q33 WeakPolarHBondContact O-CB 3.45Å; P29-Q33 PolarHBondContact O-N 3.42Å; R30-Q33 PolarHBondContact O-N 3.46Å; L31-Q33 VanDerWaalsContact C-N 3.34Å; L31-Q33 PolarHBondContact O-N 3.29Å; Q33-K37 HydrophobicContact CG-CD 4.37Å; Q33-K37 WeakPolarHBondContact O-CB 3.29Å; Q33-K37 VanDerWaalsContact O-CG 3.23Å; Q33-K37 WeakPolarHBondContact O-CG 3.48Å; Q33-K37 PolarHBondContact O-N 3.24Å |
| 34 | F | 69.1 | Low | 62.5 | Low | 147 Ų | 147 | 93.2 Ų | 93.2 | 65% | 0.645 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -67.1 | -46 | 176.2 | -172.8 | -97.8 | 0 | 0 | 0 | 111.5 | R30 L31 R32 Q36 K37 S38 | R30-F34 WeakPolarHBondContact O-CB 3.45Å; R30-F34 PolarHBondContact O-N 3.21Å; L31-F34 PolarHBondContact O-N 3.41Å; R32-F34 VanDerWaalsContact C-N 3.33Å; R32-F34 PolarHBondContact O-N 2.9Å; F34-Q36 PolarHBondContact O-N 3.04Å; F34-K37 PolarHBondContact O-N 3.27Å; F34-S38 WeakPolarHBondContact O-CB 3.38Å; F34-S38 PolarHBondContact O-N 3.32Å; F34-S38 PolarHBondContact O-OG 3.42Å |
| 35 | L | 65.4 | Low | 62.8 | Low | 75 Ų | 75 | 97.3 Ų | 97.3 | 39% | 0.393 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.1 | -41.2 | 174.8 | -74.4 | 177.7 | 0 | 0 | 0 | 112.2 | L31 R32 S38 L39 L56 | L31-L35 WeakPolarHBondContact O-CB 3.27Å; L31-L35 WeakPolarHBondContact O-CG 3.5Å; L31-L35 PolarHBondContact O-N 3.41Å; R32-L35 PolarHBondContact O-N 3.46Å; L35-S38 WeakPolarHBondContact CA-OG 3Å; L35-S38 PolarHBondContact O-N 3.45Å; L35-S38 PolarHBondContact O-OG 2.9Å; L35-L39 WeakPolarHBondContact O-CB 3.49Å; L35-L39 PolarHBondContact O-N 2.82Å; L35-L56 HydrophobicContact CD2-CD1 4.47Å |
| 36 | Q | 70.4 | Confident | 63.3 | Low | 140 Ų | 140 | 102.9 Ų | 102.9 | 65% | 0.654 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -66.5 | -39.4 | 177.6 | -170.2 | 178.4 | -7.1 | 0 | 0 | 111.6 | R32 F34 A40 | R32-Q36 VanDerWaalsContact O-CB 3.26Å; R32-Q36 WeakPolarHBondContact O-CB 3.25Å; R32-Q36 PolarHBondContact O-N 3.02Å; F34-Q36 PolarHBondContact O-N 3.04Å; Q36-A40 VanDerWaalsContact O-CB 3.24Å; Q36-A40 WeakPolarHBondContact O-CB 3.31Å; Q36-A40 PolarHBondContact O-N 3.44Å |
| 37 | K | 73.5 | Confident | 63.5 | Low | 127 Ų | 127 | 104.8 Ų | 104.8 | 55% | 0.552 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -67 | -42.3 | 174.5 | -76.1 | 170.4 | -179.4 | 171.2 | 0 | 111.8 | Q33 F34 A40 A41 | Q33-K37 HydrophobicContact CG-CD 4.37Å; Q33-K37 WeakPolarHBondContact O-CB 3.29Å; Q33-K37 VanDerWaalsContact O-CG 3.23Å; Q33-K37 WeakPolarHBondContact O-CG 3.48Å; Q33-K37 PolarHBondContact O-N 3.24Å; F34-K37 PolarHBondContact O-N 3.27Å; K37-A40 PolarHBondContact O-N 3.19Å; K37-A41 WeakPolarHBondContact O-CB 3.08Å; K37-A41 PolarHBondContact O-N 2.9Å |
| 38 | S | 63 | Low | 63.6 | Low | 48 Ų | 48 | 103.3 Ų | 103.3 | 34% | 0.336 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -69.6 | -39.3 | 179.3 | 68.4 | 0 | 0 | 0 | 0 | 111.7 | F34 L35 A41 A42 | F34-S38 WeakPolarHBondContact O-CB 3.38Å; F34-S38 PolarHBondContact O-N 3.32Å; F34-S38 PolarHBondContact O-OG 3.42Å; L35-S38 WeakPolarHBondContact CA-OG 3Å; L35-S38 PolarHBondContact O-N 3.45Å; L35-S38 PolarHBondContact O-OG 2.9Å; S38-A41 PolarHBondContact O-N 3.19Å; S38-A42 WeakPolarHBondContact O-CB 3.47Å; S38-A42 PolarHBondContact O-N 3.42Å |
| 39 | L | 63.4 | Low | 63.9 | Low | 119 Ų | 119 | 100 Ų | 100 | 62% | 0.623 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.4 | -44.2 | 173.7 | -170 | 101.7 | 0 | 0 | 0 | 111.6 | L35 A41 A42 A43 | L35-L39 WeakPolarHBondContact O-CB 3.49Å; L35-L39 PolarHBondContact O-N 2.82Å; L39-A41 VanDerWaalsContact C-N 3.3Å; L39-A41 PolarHBondContact O-N 3.07Å; L39-A42 CarbonylContact O-C 3.53Å; L39-A42 PolarHBondContact O-N 2.91Å; L39-A43 PolarHBondContact O-N 3.37Å |
| 40 | A | 66.3 | Low | 63.9 | Low | 72 Ų | 72 | 100.4 Ų | 100.4 | 60% | 0.595 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63.5 | -36.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q36 K37 | Q36-A40 VanDerWaalsContact O-CB 3.24Å; Q36-A40 WeakPolarHBondContact O-CB 3.31Å; Q36-A40 PolarHBondContact O-N 3.44Å; K37-A40 PolarHBondContact O-N 3.19Å |
| 41 | A | 64.9 | Low | 64.2 | Low | 83 Ų | 83 | 98 Ų | 98 | 69% | 0.686 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -72.9 | -31.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | K37 S38 L39 | K37-A41 WeakPolarHBondContact O-CB 3.08Å; K37-A41 PolarHBondContact O-N 2.9Å; S38-A41 PolarHBondContact O-N 3.19Å; L39-A41 VanDerWaalsContact C-N 3.3Å; L39-A41 PolarHBondContact O-N 3.07Å |
| 42 | A | 57.8 | Low | 64.5 | Low | 12 Ų | 12 | 99.8 Ų | 99.8 | 10% | 0.099 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -84.4 | -10 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | S38 L39 G44 K45 A49 | S38-A42 WeakPolarHBondContact O-CB 3.47Å; S38-A42 PolarHBondContact O-N 3.42Å; L39-A42 CarbonylContact O-C 3.53Å; L39-A42 PolarHBondContact O-N 2.91Å; A42-G44 PolarHBondContact O-N 2.85Å; A42-K45 CarbonylContact O-C 3.57Å; A42-K45 WeakPolarHBondContact O-CA 3.39Å; A42-K45 PolarHBondContact O-N 3.2Å; A42-A49 HydrophobicContact CB-CB 4.36Å |
| 43 | A | 56.9 | Low | 64.9 | Low | 87 Ų | 87 | 98.5 Ų | 98.5 | 72% | 0.719 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.8 | -20.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | L39 | L39-A43 PolarHBondContact O-N 3.37Š|
| 44 | G | 60.1 | Low | 64.9 | Low | 73 Ų | 73 | 96.2 Ų | 96.2 | 75% | 0.753 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.3 | -6.7 | 171.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | A42 | A42-G44 PolarHBondContact O-N 2.85Š|
| 45 | K | 59.7 | Low | 65 | Low | 140 Ų | 140 | 94.7 Ų | 94.7 | 61% | 0.609 | 52% | 0.523 | S | S | * | . | trans | -143.9 | 70.9 | -175.4 | -66.6 | 177.3 | -175.8 | 172.6 | 0 | 109.1 | A42 E47 L48 | A42-K45 CarbonylContact O-C 3.57Å; A42-K45 WeakPolarHBondContact O-CA 3.39Å; A42-K45 PolarHBondContact O-N 3.2Å; K45-E47 PolarHBondContact O-N 3.15Å; K45-L48 HydrophobicContact CB-CD1 4.02Å; K45-L48 HydrophobicContact CB-CG 4.34Å; K45-L48 HydrophobicContact CD-CD1 3.73Å; K45-L48 PolarHBondContact O-N 3.49Å | ||
| 46 | Q | 62.4 | Low | 65.1 | Low | 143 Ų | 143 | 96.3 Ų | 96.3 | 67% | 0.668 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -45.2 | -26.3 | -180 | -170.5 | -179.9 | 4.9 | 0 | 0 | 114.2 | ||
| 47 | E | 60.2 | Low | 64.9 | Low | 98 Ų | 98 | 95.3 Ų | 95.3 | 46% | 0.458 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -69.2 | -39.1 | 176.7 | -63.1 | -54.9 | 119.8 | 0 | 0 | 113.6 | K45 A49 K50 Y51 | K45-E47 PolarHBondContact O-N 3.15Å; E47-A49 VanDerWaalsContact C-N 3.35Å; E47-A49 PolarHBondContact O-N 2.95Å; E47-K50 WeakPolarHBondContact O-CB 3.35Å; E47-K50 PolarHBondContact O-N 3.41Å; E47-K50 IonicContact OE1-NZ 2.73Å; E47-K50 PolarHBondContact OE1-NZ 3.19Å; E47-K50 IonicContact OE2-NZ 3.87Å; E47-Y51 WeakPolarHBondContact O-CD2 3.28Å; E47-Y51 PolarHBondContact O-N 3.4Å |
| 48 | L | 60.6 | Low | 64.5 | Low | 77 Ų | 77 | 93.1 Ų | 93.1 | 40% | 0.403 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.8 | -39.1 | -179.3 | -74.5 | 172.4 | 0 | 0 | 0 | 111.8 | K45 K50 Y51 F52 | K45-L48 HydrophobicContact CB-CD1 4.02Å; K45-L48 HydrophobicContact CB-CG 4.34Å; K45-L48 HydrophobicContact CD-CD1 3.73Å; K45-L48 PolarHBondContact O-N 3.49Å; L48-K50 PolarHBondContact O-N 3.34Å; L48-Y51 PolarHBondContact O-N 3.13Å; L48-F52 HydrophobicContact CB-CE2 4.47Å; L48-F52 WeakPolarHBondContact O-CD2 3.42Å; L48-F52 PolarHBondContact O-N 3.12Å |
| 49 | A | 65.5 | Low | 64.3 | Low | 36 Ų | 36 | 97.8 Ų | 97.8 | 30% | 0.298 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.7 | -35.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | A42 E47 L53 | A42-A49 HydrophobicContact CB-CB 4.36Å; E47-A49 VanDerWaalsContact C-N 3.35Å; E47-A49 PolarHBondContact O-N 2.95Å; A49-L53 VanDerWaalsContact O-CB 3.29Å; A49-L53 WeakPolarHBondContact O-CB 3.39Å; A49-L53 PolarHBondContact O-N 3.03Å |
| 50 | K | 65.6 | Low | 63.9 | Low | 107 Ų | 107 | 95.9 Ų | 95.9 | 47% | 0.465 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -68.5 | -41.7 | 176.9 | -65.3 | 171.7 | -173.9 | 168.2 | 0 | 112.1 | E47 L48 L53 A54 | E47-K50 WeakPolarHBondContact O-CB 3.35Å; E47-K50 PolarHBondContact O-N 3.41Å; E47-K50 IonicContact OE1-NZ 2.73Å; E47-K50 PolarHBondContact OE1-NZ 3.19Å; E47-K50 IonicContact OE2-NZ 3.87Å; L48-K50 PolarHBondContact O-N 3.34Å; K50-L53 PolarHBondContact O-N 2.69Å; K50-A54 WeakPolarHBondContact O-CB 3.44Å; K50-A54 PolarHBondContact O-N 2.85Å |
| 51 | Y | 67.7 | Low | 63.3 | Low | 161 Ų | 161 | 99.5 Ų | 99.5 | 63% | 0.631 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -66.2 | -44 | 177.4 | -72.5 | -73.7 | 0 | 0 | 0 | 111.9 | E47 L48 L53 A54 E55 | E47-Y51 WeakPolarHBondContact O-CD2 3.28Å; E47-Y51 PolarHBondContact O-N 3.4Å; L48-Y51 PolarHBondContact O-N 3.13Å; Y51-L53 VanDerWaalsContact C-N 3.34Å; Y51-L53 PolarHBondContact O-N 2.97Å; Y51-A54 WeakPolarHBondContact O-CB 3.41Å; Y51-A54 PolarHBondContact O-N 3.49Å; Y51-E55 WeakPolarHBondContact O-CB 3.38Å; Y51-E55 PolarHBondContact O-N 2.99Å |
| 52 | F | 68.3 | Low | 62.6 | Low | 124 Ų | 124 | 104.3 Ų | 104.3 | 54% | 0.544 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -64.4 | -38.3 | 175.6 | -77.6 | -66.7 | 0 | 0 | 0 | 112.7 | L48 E55 L56 | L48-F52 HydrophobicContact CB-CE2 4.47Å; L48-F52 WeakPolarHBondContact O-CD2 3.42Å; L48-F52 PolarHBondContact O-N 3.12Å; F52-E55 PolarHBondContact O-N 2.97Å; F52-L56 WeakPolarHBondContact O-CB 3.26Å; F52-L56 VanDerWaalsContact O-CG 3.28Å; F52-L56 WeakPolarHBondContact O-CG 3.14Å; F52-L56 PolarHBondContact O-N 2.85Å |
| 53 | L | 71.6 | Confident | 62.2 | Low | 98 Ų | 98 | 109.7 Ų | 109.7 | 51% | 0.513 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -64 | -43.9 | 174.1 | -152.3 | -174.4 | 0 | 0 | 0 | 110.1 | A49 K50 Y51 E55 L56 L57 | A49-L53 VanDerWaalsContact O-CB 3.29Å; A49-L53 WeakPolarHBondContact O-CB 3.39Å; A49-L53 PolarHBondContact O-N 3.03Å; K50-L53 PolarHBondContact O-N 2.69Å; Y51-L53 VanDerWaalsContact C-N 3.34Å; Y51-L53 PolarHBondContact O-N 2.97Å; L53-E55 VanDerWaalsContact C-N 3.29Å; L53-E55 PolarHBondContact O-N 3.5Å; L53-L56 PolarHBondContact O-N 2.89Å; L53-L57 HydrophobicContact CD2-CD1 3.33Å; L53-L57 HydrophobicContact CD2-CD2 4.24Å; L53-L57 HydrophobicContact CD2-CG 3.46Å; L53-L57 VanDerWaalsContact CD2-CG 3.46Å; L53-L57 VanDerWaalsContact O-CB 3.31Å; L53-L57 WeakPolarHBondContact O-CB 3.45Å; L53-L57 VanDerWaalsContact O-CG 3.25Å; L53-L57 WeakPolarHBondContact O-CG 3.24Å; L53-L57 PolarHBondContact O-N 3.4Å |
| 54 | A | 70.5 | Confident | 61.9 | Low | 54 Ų | 54 | 113.4 Ų | 113.4 | 45% | 0.446 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -61.6 | -37.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | K50 Y51 L57 S58 | K50-A54 WeakPolarHBondContact O-CB 3.44Å; K50-A54 PolarHBondContact O-N 2.85Å; Y51-A54 WeakPolarHBondContact O-CB 3.41Å; Y51-A54 PolarHBondContact O-N 3.49Å; A54-L57 CarbonylContact O-C 3.14Å; A54-L57 PolarHBondContact O-N 2.8Å; A54-S58 VanDerWaalsContact O-CB 3.27Å; A54-S58 WeakPolarHBondContact O-CB 3.32Å; A54-S58 PolarHBondContact O-N 2.95Å; A54-S58 PolarHBondContact O-OG 3.29Å |
| 55 | E | 72.1 | Confident | 61.4 | Low | 115 Ų | 115 | 115 Ų | 115 | 54% | 0.537 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -69.1 | -47.3 | 177.1 | -165.9 | 139 | -157.3 | 0 | 0 | 111.5 | Y51 F52 L53 L57 S58 E59 | Y51-E55 WeakPolarHBondContact O-CB 3.38Å; Y51-E55 PolarHBondContact O-N 2.99Å; F52-E55 PolarHBondContact O-N 2.97Å; L53-E55 VanDerWaalsContact C-N 3.29Å; L53-E55 PolarHBondContact O-N 3.5Å; E55-L57 VanDerWaalsContact C-N 3.26Å; E55-L57 PolarHBondContact O-N 3.33Å; E55-S58 WeakPolarHBondContact CA-OG 3.36Å; E55-S58 WeakPolarHBondContact O-CA 3.16Å; E55-S58 PolarHBondContact O-N 3.48Å; E55-S58 PolarHBondContact O-OG 3.28Å; E55-E59 PolarHBondContact O-N 3.28Å |
| 56 | L | 67.8 | Low | 61.1 | Low | 108 Ų | 108 | 116.3 Ų | 116.3 | 57% | 0.565 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -60.5 | -32.6 | 172.7 | -71.1 | 172.8 | 0 | 0 | 0 | 113.1 | L35 F52 L53 P60 | L35-L56 HydrophobicContact CD2-CD1 4.47Å; F52-L56 WeakPolarHBondContact O-CB 3.26Å; F52-L56 VanDerWaalsContact O-CG 3.28Å; F52-L56 WeakPolarHBondContact O-CG 3.14Å; F52-L56 PolarHBondContact O-N 2.85Å; L53-L56 PolarHBondContact O-N 2.89Å; L56-P60 WeakPolarHBondContact O-CD 3.26Å |
| 57 | L | 66.2 | Low | 60.6 | Low | 120 Ų | 120 | 113.7 Ų | 113.7 | 63% | 0.628 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -80.6 | -18.5 | 173.5 | -73.2 | -179.3 | 0 | 0 | 0 | 113.4 | L53 A54 E55 P60 | L53-L57 HydrophobicContact CD2-CD1 3.33Å; L53-L57 HydrophobicContact CD2-CD2 4.24Å; L53-L57 HydrophobicContact CD2-CG 3.46Å; L53-L57 VanDerWaalsContact CD2-CG 3.46Å; L53-L57 VanDerWaalsContact O-CB 3.31Å; L53-L57 WeakPolarHBondContact O-CB 3.45Å; L53-L57 VanDerWaalsContact O-CG 3.25Å; L53-L57 WeakPolarHBondContact O-CG 3.24Å; L53-L57 PolarHBondContact O-N 3.4Å; A54-L57 CarbonylContact O-C 3.14Å; A54-L57 PolarHBondContact O-N 2.8Å; E55-L57 VanDerWaalsContact C-N 3.26Å; E55-L57 PolarHBondContact O-N 3.33Å; L57-P60 WeakPolarHBondContact O-CD 3.2Å; L57-P60 WeakPolarHBondContact O-CG 3.42Å |
| 58 | S | 64.3 | Low | 60 | Low | 80 Ų | 80 | 114.2 Ų | 114.2 | 56% | 0.559 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -83.9 | -26.4 | 175.7 | 73.3 | 0 | 0 | 0 | 0 | 112.3 | A54 E55 | A54-S58 VanDerWaalsContact O-CB 3.27Å; A54-S58 WeakPolarHBondContact O-CB 3.32Å; A54-S58 PolarHBondContact O-N 2.95Å; A54-S58 PolarHBondContact O-OG 3.29Å; E55-S58 WeakPolarHBondContact CA-OG 3.36Å; E55-S58 WeakPolarHBondContact O-CA 3.16Å; E55-S58 PolarHBondContact O-N 3.48Å; E55-S58 PolarHBondContact O-OG 3.28Å |
| 59 | E | 57.7 | Low | 59.4 | Low | 147 Ų | 147 | 117.9 Ų | 117.9 | 69% | 0.687 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -84.6 | -9 | -178.6 | -141 | 161.6 | 99.6 | 0 | 0 | 117.6 | E55 N61 | E55-E59 PolarHBondContact O-N 3.28Å; E59-N61 PolarHBondContact O-N 2.93Å; E59-N61 VanDerWaalsContact O-N 3.13Å |
| 60 | P | 55.7 | Low | 58.8 | Low | 79 Ų | 79 | 120.5 Ų | 120.5 | 51% | 0.513 | 64% | 0.636 | S | S | . | * | trans | -92.3 | 81 | -177 | 36.4 | -27.2 | 0 | 0 | 0 | 110.1 | L56 L57 | L56-P60 WeakPolarHBondContact O-CD 3.26Å; L57-P60 WeakPolarHBondContact O-CD 3.2Å; L57-P60 WeakPolarHBondContact O-CG 3.42Å | ||
| 61 | N | 52.9 | Low | 58.3 | Low | 147 Ų | 147 | 123.2 Ų | 123.2 | 79% | 0.786 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -140.7 | 7.9 | 169.4 | -90.3 | -48.4 | 0 | 0 | 0 | 115.3 | E59 | E59-N61 PolarHBondContact O-N 2.93Å; E59-N61 VanDerWaalsContact O-N 3.13Å |
| 62 | Q | 51.1 | Low | 57.6 | Low | 184 Ų | 184 | 120.1 Ų | 120.1 | 86% | 0.86 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -135.6 | -4.9 | -170.3 | -69.5 | -164.9 | -1.3 | 0 | 0 | 119.3 | ||
| 63 | T | 50.2 | Low | 56.9 | Low | 125 Ų | 125 | 120 Ų | 120 | 77% | 0.767 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -125.5 | -10.9 | -163.8 | 44.4 | 0 | 0 | 0 | 0 | 120.3 | ||
| 64 | E | 50.8 | Low | 56.1 | Low | 166 Ų | 166 | 119.3 Ų | 119.3 | 78% | 0.776 | 65% | 0.652 | S | S | * | * | trans | -149.3 | 43 | -168.7 | -59 | -174.6 | 138.4 | 0 | 0 | 115.5 | ||||
| 65 | N | 49.6 | Very low | 55.6 | Low | 105 Ų | 105 | 122.7 Ų | 122.7 | 56% | 0.561 | 66% | 0.659 | S | S | * | * | trans | -104.2 | 65.7 | 167.1 | -158.6 | -13 | 0 | 0 | 0 | 111.3 | A67 L68 | N65-A67 PolarHBondContact O-N 2.99Å; N65-A67 PolarHBondContact OD1-N 3.34Å; N65-L68 HydrophobicContact CB-CD1 4.25Å; N65-L68 WeakPolarHBondContact ND2-CD1 3.44Å; N65-L68 PolarHBondContact OD1-N 3.01Å | ||
| 66 | D | 52.5 | Low | 55 | Low | 168 Ų | 168 | 119.7 Ų | 119.7 | 90% | 0.898 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.9 | 11.6 | 167.2 | -79.4 | -45.9 | 0 | 0 | 0 | 112.5 | ||
| 67 | A | 52.8 | Low | 54.6 | Low | 88 Ų | 88 | 117.3 Ų | 117.3 | 73% | 0.727 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.9 | 5.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | N65 | N65-A67 PolarHBondContact O-N 2.99Å; N65-A67 PolarHBondContact OD1-N 3.34Å |
| 68 | L | 47.6 | Very low | 54.5 | Low | 110 Ų | 110 | 118 Ų | 118 | 58% | 0.576 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -91.1 | 111.2 | 165.9 | -75.5 | 163.3 | 0 | 0 | 0 | 107.9 | N65 | N65-L68 HydrophobicContact CB-CD1 4.25Å; N65-L68 WeakPolarHBondContact ND2-CD1 3.44Å; N65-L68 PolarHBondContact OD1-N 3.01Å |
| 69 | E | 47.7 | Very low | 54.7 | Low | 154 Ų | 154 | 120.9 Ų | 120.9 | 72% | 0.72 | 65% | 0.654 | S | S | * | * | trans | -44.7 | 139 | 174.8 | -72.9 | -77.5 | 102 | 0 | 0 | 111.1 | E71 | E69-E71 PolarHBondContact O-N 3.43Š| ||
| 70 | P | 53.2 | Low | 55.3 | Low | 91 Ų | 91 | 118 Ų | 118 | 59% | 0.591 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | 7.4 | -170.5 | 28.1 | -36.1 | 0 | 0 | 0 | 115.4 | L73 | P70-L73 HydrophobicContact CB-CD1 3.87Š|
| 71 | E | 53.7 | Low | 56 | Low | 163 Ų | 163 | 120.6 Ų | 120.6 | 76% | 0.762 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | -26.6 | 176.9 | -73.6 | -151.3 | 91 | 0 | 0 | 113.2 | E69 L73 S74 | E69-E71 PolarHBondContact O-N 3.43Å; E71-L73 VanDerWaalsContact C-N 3.3Å; E71-L73 PolarHBondContact O-N 3.38Å; E71-S74 PolarHBondContact O-OG 2.9Å |
| 72 | D | 52.8 | Low | 56.8 | Low | 97 Ų | 97 | 119.8 Ų | 119.8 | 52% | 0.519 | 64% | 0.642 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81 | -7.4 | 178.2 | -72.2 | -29.7 | 0 | 0 | 0 | 113.7 | S74 Q75 A76 | D72-S74 PolarHBondContact O-N 2.86Å; D72-Q75 PolarHBondContact O-N 2.91Å; D72-A76 PolarHBondContact O-N 2.7Å; D72-A76 VanDerWaalsContact O-N 3.15Å |
| 73 | L | 55 | Low | 58 | Low | 121 Ų | 121 | 119.1 Ų | 119.1 | 63% | 0.634 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -69 | -23.5 | 176.7 | -66.6 | 172.9 | 0 | 0 | 0 | 112.7 | P70 E71 A77 | P70-L73 HydrophobicContact CB-CD1 3.87Å; E71-L73 VanDerWaalsContact C-N 3.3Å; E71-L73 PolarHBondContact O-N 3.38Å; L73-A77 PolarHBondContact O-N 3.34Å |
| 74 | S | 54.9 | Low | 59.1 | Low | 84 Ų | 84 | 116.6 Ų | 116.6 | 59% | 0.587 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -67.2 | -39.5 | 172.2 | 61.2 | 0 | 0 | 0 | 0 | 111.4 | E71 D72 A77 E78 | E71-S74 PolarHBondContact O-OG 2.9Å; D72-S74 PolarHBondContact O-N 2.86Å; S74-A77 PolarHBondContact O-N 3.48Å; S74-E78 PolarHBondContact O-N 3.37Å |
| 75 | Q | 59.2 | Low | 60.2 | Low | 125 Ų | 125 | 115 Ų | 115 | 58% | 0.584 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -75 | -32.6 | 179.2 | -164.7 | 167.8 | 29.5 | 0 | 0 | 112.4 | D72 E78 Q79 | D72-Q75 PolarHBondContact O-N 2.91Å; Q75-E78 PolarHBondContact O-N 3.49Å; Q75-Q79 WeakPolarHBondContact O-CB 3.36Å; Q75-Q79 PolarHBondContact O-N 2.82Å |
| 76 | A | 58.8 | Low | 61.4 | Low | 51 Ų | 51 | 116 Ų | 116 | 42% | 0.421 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -65.6 | -36.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | D72 Q79 D80 | D72-A76 PolarHBondContact O-N 2.7Å; D72-A76 VanDerWaalsContact O-N 3.15Å; A76-Q79 PolarHBondContact O-N 3.16Å; A76-D80 PolarHBondContact O-N 2.84Å |
| 77 | A | 61.1 | Low | 62.3 | Low | 58 Ų | 58 | 113.3 Ų | 113.3 | 48% | 0.479 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -66.4 | -43 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | L73 S74 Q79 D80 E81 | L73-A77 PolarHBondContact O-N 3.34Å; S74-A77 PolarHBondContact O-N 3.48Å; A77-Q79 VanDerWaalsContact C-N 3.3Å; A77-Q79 PolarHBondContact O-N 3.35Å; A77-D80 PolarHBondContact O-N 3.24Å; A77-E81 PolarHBondContact O-N 2.93Å |
| 78 | E | 63.5 | Low | 63.2 | Low | 135 Ų | 135 | 117.6 Ų | 117.6 | 63% | 0.631 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -63.5 | -36.4 | 174 | -69.4 | -167.7 | 153.3 | 0 | 0 | 112.1 | S74 Q75 M82 | S74-E78 PolarHBondContact O-N 3.37Å; Q75-E78 PolarHBondContact O-N 3.49Å; E78-M82 WeakPolarHBondContact O-CB 3.28Å; E78-M82 PolarHBondContact O-N 3.45Å |
| 79 | Q | 67.5 | Low | 64.1 | Low | 141 Ų | 141 | 115.3 Ų | 115.3 | 66% | 0.659 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -70.6 | -34.6 | 178.9 | -150.7 | 178.6 | 27.4 | 0 | 0 | 112.3 | Q75 A76 A77 R83 | Q75-Q79 WeakPolarHBondContact O-CB 3.36Å; Q75-Q79 PolarHBondContact O-N 2.82Å; A76-Q79 PolarHBondContact O-N 3.16Å; A77-Q79 VanDerWaalsContact C-N 3.3Å; A77-Q79 PolarHBondContact O-N 3.35Å; Q79-R83 WeakPolarHBondContact O-CB 3.23Å; Q79-R83 PolarHBondContact O-N 3.46Å |
| 80 | D | 70.9 | Confident | 64.8 | Low | 87 Ų | 87 | 110.8 Ų | 110.8 | 47% | 0.465 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -74.4 | -37.2 | 175.2 | -161.4 | 38.1 | 0 | 0 | 0 | 112 | A76 A77 R83 L84 | A76-D80 PolarHBondContact O-N 2.84Å; A77-D80 PolarHBondContact O-N 3.24Å; D80-R83 WeakPolarHBondContact O-CB 3.27Å; D80-R83 PolarHBondContact O-N 2.98Å; D80-L84 WeakPolarHBondContact O-CB 3.48Å; D80-L84 VanDerWaalsContact O-CG 3.28Å; D80-L84 WeakPolarHBondContact O-CG 3.35Å; D80-L84 PolarHBondContact O-N 3.31Å |
| 81 | E | 71.4 | Confident | 65.1 | Low | 133 Ų | 133 | 113 Ų | 113 | 62% | 0.621 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -60.4 | -46.5 | 169.3 | -76.8 | -168.6 | 163.5 | 0 | 0 | 111.3 | A77 R83 L84 E85 | A77-E81 PolarHBondContact O-N 2.93Å; E81-R83 VanDerWaalsContact C-N 3.29Å; E81-R83 PolarHBondContact O-N 2.83Å; E81-L84 PolarHBondContact O-N 3.12Å; E81-L84 VanDerWaalsContact O-N 3.16Å; E81-E85 WeakPolarHBondContact O-CG 3.49Å; E81-E85 PolarHBondContact O-N 3.11Å |
| 82 | M | 69.4 | Low | 65.4 | Low | 129 Ų | 129 | 109.3 Ų | 109.3 | 64% | 0.635 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -61.5 | -37.4 | 175.9 | -166.6 | -171.9 | -58.3 | 0 | 0 | 111.8 | E78 E85 L86 | E78-M82 WeakPolarHBondContact O-CB 3.28Å; E78-M82 PolarHBondContact O-N 3.45Å; M82-E85 PolarHBondContact O-N 2.67Å; M82-L86 WeakPolarHBondContact O-CB 3.41Å; M82-L86 PolarHBondContact O-N 3.44Å |
| 83 | R | 75.7 | Confident | 65.5 | Low | 170 Ų | 170 | 109 Ų | 109 | 64% | 0.642 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -66 | -42.2 | 174.4 | -179.4 | -174.9 | 166.8 | 85.5 | 1.3 | 111.8 | Q79 D80 E81 L86 Q87 | Q79-R83 WeakPolarHBondContact O-CB 3.23Å; Q79-R83 PolarHBondContact O-N 3.46Å; D80-R83 WeakPolarHBondContact O-CB 3.27Å; D80-R83 PolarHBondContact O-N 2.98Å; E81-R83 VanDerWaalsContact C-N 3.29Å; E81-R83 PolarHBondContact O-N 2.83Å; R83-L86 PolarHBondContact O-N 3.48Å; R83-Q87 WeakPolarHBondContact O-CB 3.25Å; R83-Q87 PolarHBondContact O-N 2.93Å |
| 84 | L | 73.7 | Confident | 65.7 | Low | 73 Ų | 73 | 108.5 Ų | 108.5 | 38% | 0.382 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -67.7 | -37.2 | 176.7 | -73.6 | 166.8 | 0 | 0 | 0 | 111.8 | D80 E81 Q87 R88 | D80-L84 WeakPolarHBondContact O-CB 3.48Å; D80-L84 VanDerWaalsContact O-CG 3.28Å; D80-L84 WeakPolarHBondContact O-CG 3.35Å; D80-L84 PolarHBondContact O-N 3.31Å; E81-L84 PolarHBondContact O-N 3.12Å; E81-L84 VanDerWaalsContact O-N 3.16Å; L84-Q87 PolarHBondContact O-N 3.11Å; L84-R88 PolarHBondContact O-N 3.05Å |
| 85 | E | 74.2 | Confident | 66 | Low | 133 Ų | 133 | 108.2 Ų | 108.2 | 62% | 0.621 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -66.5 | -40.6 | 172 | -72.6 | -161.3 | 160.6 | 0 | 0 | 111.9 | E81 M82 Q87 R88 S89 | E81-E85 WeakPolarHBondContact O-CG 3.49Å; E81-E85 PolarHBondContact O-N 3.11Å; M82-E85 PolarHBondContact O-N 2.67Å; E85-Q87 VanDerWaalsContact C-N 3.32Å; E85-Q87 PolarHBondContact O-N 3.09Å; E85-R88 PolarHBondContact O-N 2.86Å; E85-S89 WeakPolarHBondContact O-CB 3.45Å; E85-S89 PolarHBondContact O-N 3.43Å; E85-S89 PolarHBondContact O-OG 3.21Å |
| 86 | L | 74.6 | Confident | 65.8 | Low | 125 Ų | 125 | 110.5 Ų | 110.5 | 65% | 0.654 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -64 | -38.3 | 174.4 | -151.9 | 84.1 | 0 | 0 | 0 | 111.6 | M82 R83 S89 A90 | M82-L86 WeakPolarHBondContact O-CB 3.41Å; M82-L86 PolarHBondContact O-N 3.44Å; R83-L86 PolarHBondContact O-N 3.48Å; L86-S89 VanDerWaalsContact CA-OG 3.26Å; L86-S89 WeakPolarHBondContact CA-OG 3.23Å; L86-S89 PolarHBondContact O-N 2.91Å; L86-S89 PolarHBondContact O-OG 3.07Å; L86-S89 VanDerWaalsContact O-OG 3.12Å; L86-A90 VanDerWaalsContact O-CB 3.23Å; L86-A90 WeakPolarHBondContact O-CB 3.38Å; L86-A90 PolarHBondContact O-N 3.25Å |
| 87 | Q | 70.8 | Confident | 65.7 | Low | 111 Ų | 111 | 111 Ų | 111 | 52% | 0.519 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -71 | -37.1 | 176.8 | -167.4 | 166.3 | 46.6 | 0 | 0 | 112.2 | R83 L84 E85 N91 | R83-Q87 WeakPolarHBondContact O-CB 3.25Å; R83-Q87 PolarHBondContact O-N 2.93Å; L84-Q87 PolarHBondContact O-N 3.11Å; E85-Q87 VanDerWaalsContact C-N 3.32Å; E85-Q87 PolarHBondContact O-N 3.09Å; Q87-N91 PolarHBondContact O-N 3.29Å; Q87-N91 VanDerWaalsContact O-N 3.1Å; Q87-N91 PolarHBondContact O-ND2 2.84Å |
| 88 | R | 70.9 | Confident | 65.8 | Low | 179 Ų | 179 | 114.4 Ų | 114.4 | 68% | 0.675 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -64 | -44.6 | 170.9 | -102.4 | -174 | -150.3 | 91.1 | 1.4 | 112 | L84 E85 N91 S92 | L84-R88 PolarHBondContact O-N 3.05Å; E85-R88 PolarHBondContact O-N 2.86Å; R88-N91 PolarHBondContact O-N 3.3Å; R88-S92 PolarHBondContact O-N 3.43Å; R88-S92 VanDerWaalsContact O-N 3.07Å |
| 89 | S | 66.6 | Low | 65.7 | Low | 61 Ų | 61 | 113.6 Ų | 113.6 | 43% | 0.427 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -71.1 | -33.6 | -179.7 | 46.1 | 0 | 0 | 0 | 0 | 111.9 | E85 L86 N91 S92 | E85-S89 WeakPolarHBondContact O-CB 3.45Å; E85-S89 PolarHBondContact O-N 3.43Å; E85-S89 PolarHBondContact O-OG 3.21Å; L86-S89 VanDerWaalsContact CA-OG 3.26Å; L86-S89 WeakPolarHBondContact CA-OG 3.23Å; L86-S89 PolarHBondContact O-N 2.91Å; L86-S89 PolarHBondContact O-OG 3.07Å; L86-S89 VanDerWaalsContact O-OG 3.12Å; S89-N91 VanDerWaalsContact C-N 3.32Å; S89-N91 PolarHBondContact O-N 3Å; S89-S92 WeakPolarHBondContact CA-OG 3.41Å; S89-S92 PolarHBondContact O-N 2.92Å; S89-S92 VanDerWaalsContact O-N 3.11Å; S89-S92 PolarHBondContact O-OG 3.42Å |
| 90 | A | 63.9 | Low | 65.5 | Low | 59 Ų | 59 | 115.7 Ų | 115.7 | 49% | 0.488 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -63.4 | -34.9 | 169.6 | 0 | 0 | 0 | 0 | 0 | 113 | L86 S92 N93 | L86-A90 VanDerWaalsContact O-CB 3.23Å; L86-A90 WeakPolarHBondContact O-CB 3.38Å; L86-A90 PolarHBondContact O-N 3.25Å; A90-S92 VanDerWaalsContact C-N 3.3Å; A90-N93 VanDerWaalsContact O-CB 3.25Å; A90-N93 WeakPolarHBondContact O-CB 3.18Å; A90-N93 PolarHBondContact O-N 3.1Å |
| 91 | N | 59.5 | Low | 65 | Low | 139 Ų | 139 | 118.7 Ų | 118.7 | 74% | 0.743 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -76.8 | -16.2 | 173.8 | -72.5 | -18.7 | 0 | 0 | 0 | 113.3 | Q87 R88 S89 | Q87-N91 PolarHBondContact O-N 3.29Å; Q87-N91 VanDerWaalsContact O-N 3.1Å; Q87-N91 PolarHBondContact O-ND2 2.84Å; R88-N91 PolarHBondContact O-N 3.3Å; S89-N91 VanDerWaalsContact C-N 3.32Å; S89-N91 PolarHBondContact O-N 3Å |
| 92 | S | 58.8 | Low | 64.5 | Low | 85 Ų | 85 | 119.7 Ų | 119.7 | 59% | 0.594 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.3 | 5.7 | 171.4 | 76.6 | 0 | 0 | 0 | 0 | 113.6 | R88 S89 A90 P94 | R88-S92 PolarHBondContact O-N 3.43Å; R88-S92 VanDerWaalsContact O-N 3.07Å; S89-S92 WeakPolarHBondContact CA-OG 3.41Å; S89-S92 PolarHBondContact O-N 2.92Å; S89-S92 VanDerWaalsContact O-N 3.11Å; S89-S92 PolarHBondContact O-OG 3.42Å; A90-S92 VanDerWaalsContact C-N 3.3Å; S92-P94 WeakPolarHBondContact O-CD 3.41Å; S92-P94 VanDerWaalsContact O-N 3.08Å |
| 93 | N | 56.2 | Low | 64.3 | Low | 89 Ų | 89 | 119 Ų | 119 | 48% | 0.476 | 63% | 0.632 | S | S | . | * | trans | -63.7 | 112.5 | -178.5 | -152.1 | -32.1 | 0 | 0 | 0 | 109.5 | A90 A95 M96 | A90-N93 VanDerWaalsContact O-CB 3.25Å; A90-N93 WeakPolarHBondContact O-CB 3.18Å; A90-N93 PolarHBondContact O-N 3.1Å; N93-A95 PolarHBondContact O-N 3.44Å; N93-M96 PolarHBondContact O-N 2.99Å | ||
| 94 | P | 58.3 | Low | 63.9 | Low | 111 Ų | 111 | 114.6 Ų | 114.6 | 72% | 0.721 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.3 | -10.7 | -175.4 | 24.9 | -33 | 0 | 0 | 0 | 112.7 | S92 M96 | S92-P94 WeakPolarHBondContact O-CD 3.41Å; S92-P94 VanDerWaalsContact O-N 3.08Å; P94-M96 VanDerWaalsContact C-N 3.28Å; P94-M96 PolarHBondContact O-N 3.37Å |
| 95 | A | 60.5 | Low | 63.2 | Low | 78 Ų | 78 | 112.7 Ų | 112.7 | 65% | 0.645 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | -20.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | N93 | N93-A95 PolarHBondContact O-N 3.44Š|
| 96 | M | 56.1 | Low | 62.9 | Low | 174 Ų | 174 | 115.8 Ų | 115.8 | 86% | 0.857 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -111.6 | 0.7 | 178.4 | -78.3 | -171.9 | 174.8 | 0 | 0 | 114.3 | N93 P94 | N93-M96 PolarHBondContact O-N 2.99Å; P94-M96 VanDerWaalsContact C-N 3.28Å; P94-M96 PolarHBondContact O-N 3.37Å |
| 97 | A | 57.5 | Low | 62.4 | Low | 61 Ų | 61 | 114.6 Ų | 114.6 | 50% | 0.504 | 64% | 0.638 | S | S | . | * | S | Bend | trans | -59.9 | 134.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110 | R99 | A97-R99 PolarHBondContact O-N 2.99Š|
| 98 | P | 61.8 | Low | 61.8 | Low | 129 Ų | 129 | 116.8 Ų | 116.8 | 84% | 0.838 | 65% | 0.646 | S | S | * | * | trans | -53.1 | 104.3 | 173.8 | -25.1 | 33.7 | 0 | 0 | 0 | 109.5 | E100 | P98-E100 PolarHBondContact O-N 3.07Š| ||
| 99 | R | 61.4 | Low | 61.2 | Low | 118 Ų | 118 | 115 Ų | 115 | 45% | 0.445 | 64% | 0.643 | S | S | . | * | P | Polyproline II helix | trans | -61.7 | 117.8 | -174.7 | -167 | 176.9 | -165.2 | -157.7 | 1 | 108.7 | A97 R101 T114 | A97-R99 PolarHBondContact O-N 2.99Å; R99-R101 PolarHBondContact O-N 2.89Å; R99-T114 PolarHBondContact NH1-OG1 3.33Å; R99-T114 PolarHBondContact NH2-OG1 3.25Å |
| 100 | E | 63.4 | Low | 60.8 | Low | 186 Ų | 186 | 122.9 Ų | 122.9 | 87% | 0.869 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -53 | 123.1 | 179.8 | -143.5 | -179.7 | -154.4 | 0 | 0 | 109.6 | P98 | P98-E100 PolarHBondContact O-N 3.07Š|
| 101 | R | 61.3 | Low | 60.7 | Low | 150 Ų | 150 | 128 Ų | 128 | 57% | 0.566 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 128.2 | 171.6 | -69 | -170.3 | 135.2 | 86.7 | 12.1 | 108.2 | R99 A103 F108 | R99-R101 PolarHBondContact O-N 2.89Å; R101-A103 PolarHBondContact O-N 3.05Å; R101-F108 VanDerWaalsContact CZ-CD2 3.45Å; R101-F108 VanDerWaalsContact CZ-CE1 3.44Å |
| 102 | K | 60.3 | Low | 60.6 | Low | 154 Ų | 154 | 125.5 Ų | 125.5 | 67% | 0.67 | 67% | 0.665 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 125.1 | 165.9 | -70.2 | -167.7 | 178.1 | -159.1 | 0 | 109 | G104 C105 | K102-G104 PolarHBondContact O-N 3.4Å; K102-C105 PolarHBondContact O-N 2.84Å |
| 103 | A | 65.9 | Low | 60.4 | Low | 113 Ų | 113 | 129 Ų | 129 | 93% | 0.934 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.3 | 120 | 172.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | R101 | R101-A103 PolarHBondContact O-N 3.05Š|
| 104 | G | 66.4 | Low | 60.2 | Low | 78 Ų | 78 | 129.6 Ų | 129.6 | 80% | 0.804 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 118 | -12 | -179.1 | 0 | 0 | 0 | 0 | 0 | 116 | K102 K106 | K102-G104 PolarHBondContact O-N 3.4Å; G104-K106 PolarHBondContact O-N 2.82Å |
| 105 | C | 59.1 | Low | 60 | Low | 33 Ų | 33 | 128.3 Ų | 128.3 | 22% | 0.223 | 67% | 0.67 | C | S | . | * | trans | -83 | 112 | 178.6 | -172.3 | 0 | 0 | 0 | 0 | 112.3 | K102 S115 C116 | K102-C105 PolarHBondContact O-N 2.84Å; C105-S115 PolarHBondContact SG-O 3.18Å; C105-C116 WeakPolarHBondContact CA-OXT 2.93Å; C105-C116 VanDerWaalsContact CB-C 3.49Å; C105-C116 WeakPolarHBondContact CB-OXT 3.12Å; C105-C116 PolarHBondContact SG-O 3.33Å; C105-C116 PolarHBondContact SG-OXT 3.43Å | ||
| 106 | K | 67.7 | Low | 59.7 | Low | 198 Ų | 198 | 130 Ų | 130 | 86% | 0.861 | 68% | 0.676 | S | S | * | * | trans | -89.5 | -1.8 | -178.9 | -164 | 164.1 | 176.3 | 177.3 | 0 | 114.1 | G104 | G104-K106 PolarHBondContact O-N 2.82Š| ||
| 107 | N | 63.7 | Low | 59.8 | Low | 101 Ų | 101 | 127.8 Ų | 127.8 | 54% | 0.54 | 67% | 0.667 | S | S | . | * | trans | -106.6 | 102.5 | -173.2 | -68.4 | -36 | 0 | 0 | 0 | 112 | F109 | N107-F109 HydrophobicContact CB-CD2 4.13Å; N107-F109 HydrophobicContact CB-CE2 4.38Å; N107-F109 PolarHBondContact O-N 3.22Å | ||
| 108 | F | 57.7 | Low | 60 | Low | 156 Ų | 156 | 131.3 Ų | 131.3 | 68% | 0.684 | 68% | 0.676 | S | S | * | * | trans | -84.9 | 88.1 | 166.3 | -112.9 | -95.7 | 0 | 0 | 0 | 108.9 | R101 | R101-F108 VanDerWaalsContact CZ-CD2 3.45Å; R101-F108 VanDerWaalsContact CZ-CE1 3.44Å | ||
| 109 | F | 58.7 | Low | 59.9 | Low | 141 Ų | 141 | 131.4 Ų | 131.4 | 62% | 0.618 | 67% | 0.667 | S | S | * | * | trans | -99.6 | 108.2 | 164.4 | -81.4 | -87.8 | 0 | 0 | 0 | 109.2 | N107 K111 T112 | N107-F109 HydrophobicContact CB-CD2 4.13Å; N107-F109 HydrophobicContact CB-CE2 4.38Å; N107-F109 PolarHBondContact O-N 3.22Å; F109-K111 PolarHBondContact O-N 3.24Å; F109-T112 PolarHBondContact O-N 3.12Å | ||
| 110 | W | 58.6 | Low | 59.8 | Low | 227 Ų | 227 | 132.2 Ų | 132.2 | 86% | 0.86 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.8 | -3.8 | 174.9 | 62.3 | -64.1 | 0 | 0 | 0 | 115.5 | ||
| 111 | K | 62.1 | Low | 59.6 | Low | 166 Ų | 166 | 128.9 Ų | 128.9 | 72% | 0.722 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.6 | -0.4 | -169.3 | -125.1 | 178.8 | -171.3 | 178.3 | 0 | 115.4 | F109 | F109-K111 PolarHBondContact O-N 3.24Š|
| 112 | T | 56.8 | Low | 59.4 | Low | 87 Ų | 87 | 127.5 Ų | 127.5 | 53% | 0.534 | 68% | 0.675 | S | S | . | * | trans | -144 | 116.2 | 179.6 | 51.9 | 0 | 0 | 0 | 0 | 111.3 | F109 T114 | F109-T112 PolarHBondContact O-N 3.12Å; T112-T114 PolarHBondContact O-N 3.17Å | ||
| 113 | F | 54.7 | Low | 59.4 | Low | 160 Ų | 160 | 125.6 Ų | 125.6 | 70% | 0.702 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -50.8 | 114.1 | 156.9 | -116.5 | -121.2 | 0 | 0 | 0 | 106.6 | ||
| 114 | T | 53 | Low | 58.9 | Low | 101 Ų | 101 | 126.5 Ų | 126.5 | 62% | 0.62 | 66% | 0.655 | S | S | * | * | trans | 67.3 | 109 | 169.1 | 27.7 | 0 | 0 | 0 | 0 | 118.4 | R99 T112 | R99-T114 PolarHBondContact NH1-OG1 3.33Å; R99-T114 PolarHBondContact NH2-OG1 3.25Å; T112-T114 PolarHBondContact O-N 3.17Å | ||
| 115 | S | 53.7 | Low | 58.2 | Low | 83 Ų | 83 | 130.6 Ų | 130.6 | 58% | 0.58 | 64% | 0.643 | S | S | * | * | trans | -150.3 | 140.1 | 133 | 61.2 | 0 | 0 | 0 | 0 | 108.2 | C105 | C105-S115 PolarHBondContact SG-O 3.18Š| ||
| 116 | C | 53.2 | Low | 58.2 | Low | 114 Ų | 114 | 139.5 Ų | 139.5 | 77% | 0.77 | 68% | 0.681 | S | S | * | * | trans | -59 | 0 | -167.4 | -59.7 | 0 | 0 | 0 | 0 | 117 | C105 | C105-C116 WeakPolarHBondContact CA-OXT 2.93Å; C105-C116 VanDerWaalsContact CB-C 3.49Å; C105-C116 WeakPolarHBondContact CB-OXT 3.12Å; C105-C116 PolarHBondContact SG-O 3.33Å; C105-C116 PolarHBondContact SG-OXT 3.43Å |
Retrieved 116 of 116 residues in 56.3 ms
(Link to these results)