| 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 | E | 62.8 | Low | 82.2 | Confident | 201 Ų | 201 | 118 Ų | 118 | 94% | 0.939 | 59% | 0.592 | S | S | * | * | 0 | -37.6 | 0 | -77.8 | 152.7 | 147.7 | 0 | 0 | 115 | R3 N4 | E1-R3 PolarHBondContact O-N 3.37Å; E1-N4 PolarHBondContact O-N 2.96Å | |||
| 2 | Q | 75.2 | Confident | 82.2 | Confident | 157 Ų | 157 | 113.8 Ų | 113.8 | 73% | 0.734 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -47.9 | -35.8 | -178 | -75.2 | -179.3 | -32.9 | 0 | 0 | 116.2 | N4 E5 I6 | Q2-N4 VanDerWaalsContact C-N 3.27Å; Q2-N4 PolarHBondContact O-N 3.32Å; Q2-E5 PolarHBondContact O-N 3Å; Q2-I6 WeakPolarHBondContact O-CG1 3.38Å; Q2-I6 PolarHBondContact O-N 2.71Å; Q2-I6 VanDerWaalsContact O-N 3.14Å |
| 3 | R | 78.3 | Confident | 82.2 | Confident | 193 Ų | 193 | 109.8 Ų | 109.8 | 73% | 0.728 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -58.4 | -37.8 | 177 | -175.5 | -176.5 | 174.3 | -137.1 | 0.3 | 112.4 | E1 L7 | E1-R3 PolarHBondContact O-N 3.37Å; R3-L7 HydrophobicContact CG-CD1 3.96Å; R3-L7 HydrophobicContact CG-CG 4.45Å; R3-L7 WeakPolarHBondContact O-CB 3.17Å; R3-L7 WeakPolarHBondContact O-CG 3.42Å; R3-L7 PolarHBondContact O-N 3.14Å |
| 4 | N | 83.4 | Confident | 82.7 | Confident | 102 Ų | 102 | 108.4 Ų | 108.4 | 55% | 0.545 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -76.1 | -33.1 | -175.9 | -69.1 | -9 | 0 | 0 | 0 | 111.9 | E1 Q2 T8 | E1-N4 PolarHBondContact O-N 2.96Å; Q2-N4 VanDerWaalsContact C-N 3.27Å; Q2-N4 PolarHBondContact O-N 3.32Å; N4-T8 WeakPolarHBondContact O-CB 3.38Å; N4-T8 PolarHBondContact O-N 2.91Å; N4-T8 PolarHBondContact O-OG1 3.15Å |
| 5 | E | 77.8 | Confident | 82.8 | Confident | 131 Ų | 131 | 105.5 Ų | 105.5 | 61% | 0.612 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -67.2 | -45.4 | 174.3 | -67.4 | 171.1 | -174.1 | 0 | 0 | 111.1 | Q2 L7 T8 A9 | Q2-E5 PolarHBondContact O-N 3Å; E5-L7 PolarHBondContact O-N 3.48Å; E5-T8 PolarHBondContact O-N 3.04Å; E5-A9 PolarHBondContact O-N 3.17Å |
| 6 | I | 88.8 | Confident | 82.6 | Confident | 102 Ų | 102 | 102.1 Ų | 102.1 | 52% | 0.523 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62 | -45.1 | 176.2 | -66.1 | 168.6 | 0 | 0 | 0 | 110.5 | Q2 T8 A9 I10 | Q2-I6 WeakPolarHBondContact O-CG1 3.38Å; Q2-I6 PolarHBondContact O-N 2.71Å; Q2-I6 VanDerWaalsContact O-N 3.14Å; I6-T8 VanDerWaalsContact C-N 3.31Å; I6-T8 PolarHBondContact O-N 3.49Å; I6-A9 PolarHBondContact O-N 3.34Å; I6-I10 HydrophobicContact CG2-CD1 3.63Å; I6-I10 HydrophobicContact CG2-CG1 4.4Å; I6-I10 WeakPolarHBondContact O-CB 3.35Å; I6-I10 VanDerWaalsContact O-CG1 3.28Å; I6-I10 WeakPolarHBondContact O-CG1 3.45Å; I6-I10 PolarHBondContact O-N 3.48Å |
| 7 | L | 87.9 | Confident | 82.5 | Confident | 74 Ų | 74 | 104.1 Ų | 104.1 | 39% | 0.387 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.3 | -41.3 | 177.4 | -76.3 | 171.2 | 0 | 0 | 0 | 111.6 | R3 E5 I10 L11 | R3-L7 HydrophobicContact CG-CD1 3.96Å; R3-L7 HydrophobicContact CG-CG 4.45Å; R3-L7 WeakPolarHBondContact O-CB 3.17Å; R3-L7 WeakPolarHBondContact O-CG 3.42Å; R3-L7 PolarHBondContact O-N 3.14Å; E5-L7 PolarHBondContact O-N 3.48Å; L7-I10 PolarHBondContact O-N 3.42Å; L7-L11 WeakPolarHBondContact O-CB 3.18Å; L7-L11 WeakPolarHBondContact O-CD1 3.28Å; L7-L11 WeakPolarHBondContact O-CG 3.37Å; L7-L11 PolarHBondContact O-N 3.44Å |
| 8 | T | 86.8 | Confident | 82.7 | Confident | 96 Ų | 96 | 103.7 Ų | 103.7 | 59% | 0.589 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -65.7 | -43.9 | 179.3 | -56.2 | 0 | 0 | 0 | 0 | 111.7 | N4 E5 I6 I10 L11 A12 | N4-T8 WeakPolarHBondContact O-CB 3.38Å; N4-T8 PolarHBondContact O-N 2.91Å; N4-T8 PolarHBondContact O-OG1 3.15Å; E5-T8 PolarHBondContact O-N 3.04Å; I6-T8 VanDerWaalsContact C-N 3.31Å; I6-T8 PolarHBondContact O-N 3.49Å; T8-I10 PolarHBondContact O-N 2.98Å; T8-L11 PolarHBondContact O-N 3.22Å; T8-A12 PolarHBondContact O-N 3.43Å; T8-A12 VanDerWaalsContact O-N 3.15Å |
| 9 | A | 80.9 | Confident | 82.8 | Confident | 63 Ų | 63 | 102.6 Ų | 102.6 | 52% | 0.521 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.5 | -41 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | E5 I6 S13 | E5-A9 PolarHBondContact O-N 3.17Å; I6-A9 PolarHBondContact O-N 3.34Å; A9-S13 PolarHBondContact O-N 3.41Å; A9-S13 PolarHBondContact O-OG 2.8Å |
| 10 | I | 91.1 | Very high | 82.6 | Confident | 80 Ų | 80 | 101.9 Ų | 101.9 | 41% | 0.41 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -73.1 | -39.2 | 178.6 | -66.3 | 172.8 | 0 | 0 | 0 | 111 | I6 L7 T8 A12 S13 L14 | I6-I10 HydrophobicContact CG2-CD1 3.63Å; I6-I10 HydrophobicContact CG2-CG1 4.4Å; I6-I10 WeakPolarHBondContact O-CB 3.35Å; I6-I10 VanDerWaalsContact O-CG1 3.28Å; I6-I10 WeakPolarHBondContact O-CG1 3.45Å; I6-I10 PolarHBondContact O-N 3.48Å; L7-I10 PolarHBondContact O-N 3.42Å; T8-I10 PolarHBondContact O-N 2.98Å; I10-A12 PolarHBondContact O-N 3.25Å; I10-S13 CarbonylContact O-C 3.56Å; I10-S13 PolarHBondContact O-N 3.48Å; I10-L14 HydrophobicContact CG2-CD1 3.61Å; I10-L14 HydrophobicContact CG2-CG 3.92Å; I10-L14 WeakPolarHBondContact O-CB 3.5Å; I10-L14 WeakPolarHBondContact O-CG 3.32Å; I10-L14 PolarHBondContact O-N 2.95Å |
| 11 | L | 91 | Very high | 82.3 | Confident | 99 Ų | 99 | 105.6 Ų | 105.6 | 52% | 0.518 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -58.9 | -47.4 | 178.1 | -94.3 | 156.4 | 0 | 0 | 0 | 111.4 | L7 T8 S13 L14 T15 | L7-L11 WeakPolarHBondContact O-CB 3.18Å; L7-L11 WeakPolarHBondContact O-CD1 3.28Å; L7-L11 WeakPolarHBondContact O-CG 3.37Å; L7-L11 PolarHBondContact O-N 3.44Å; T8-L11 PolarHBondContact O-N 3.22Å; L11-S13 VanDerWaalsContact C-N 3.28Å; L11-S13 PolarHBondContact O-N 3.39Å; L11-L14 PolarHBondContact O-N 2.97Å; L11-L14 VanDerWaalsContact O-N 3.17Å; L11-T15 WeakPolarHBondContact O-CB 3.42Å; L11-T15 PolarHBondContact O-N 3.26Å; L11-T15 PolarHBondContact O-OG1 2.85Å; L11-T15 VanDerWaalsContact O-OG1 3.04Å |
| 12 | A | 82 | Confident | 83.1 | Confident | 67 Ų | 67 | 103 Ų | 103 | 55% | 0.554 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -57 | -44.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | T8 I10 A16 | T8-A12 PolarHBondContact O-N 3.43Å; T8-A12 VanDerWaalsContact O-N 3.15Å; I10-A12 PolarHBondContact O-N 3.25Å; A12-A16 WeakPolarHBondContact O-CB 3.49Å; A12-A16 PolarHBondContact O-N 3.46Å |
| 13 | S | 82.1 | Confident | 83.3 | Confident | 62 Ų | 62 | 99.6 Ų | 99.6 | 43% | 0.434 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.5 | -34.1 | 178.2 | -62.8 | 0 | 0 | 0 | 0 | 113.2 | A9 I10 L11 R17 | A9-S13 PolarHBondContact O-N 3.41Å; A9-S13 PolarHBondContact O-OG 2.8Å; I10-S13 CarbonylContact O-C 3.56Å; I10-S13 PolarHBondContact O-N 3.48Å; L11-S13 VanDerWaalsContact C-N 3.28Å; L11-S13 PolarHBondContact O-N 3.39Å; S13-R17 WeakPolarHBondContact O-CB 3.44Å; S13-R17 VanDerWaalsContact O-CG 3.26Å; S13-R17 WeakPolarHBondContact O-CG 3.4Å; S13-R17 PolarHBondContact O-N 3.27Å; S13-R17 PolarHBondContact O-NE 2.98Å |
| 14 | L | 89.3 | Confident | 83.1 | Confident | 90 Ų | 90 | 98.2 Ų | 98.2 | 47% | 0.471 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -72.6 | -43.9 | 177.1 | -75.7 | 174.2 | 0 | 0 | 0 | 111.3 | I10 L11 R17 Q18 | I10-L14 HydrophobicContact CG2-CD1 3.61Å; I10-L14 HydrophobicContact CG2-CG 3.92Å; I10-L14 WeakPolarHBondContact O-CB 3.5Å; I10-L14 WeakPolarHBondContact O-CG 3.32Å; I10-L14 PolarHBondContact O-N 2.95Å; L11-L14 PolarHBondContact O-N 2.97Å; L11-L14 VanDerWaalsContact O-N 3.17Å; L14-R17 PolarHBondContact O-N 3.39Å; L14-Q18 WeakPolarHBondContact O-CB 3.38Å; L14-Q18 PolarHBondContact O-N 3.17Å |
| 15 | T | 84.9 | Confident | 82.7 | Confident | 65 Ų | 65 | 98.5 Ų | 98.5 | 40% | 0.399 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.6 | -44.2 | 177.7 | -58.9 | 0 | 0 | 0 | 0 | 111.3 | L11 R17 Q18 N19 | L11-T15 WeakPolarHBondContact O-CB 3.42Å; L11-T15 PolarHBondContact O-N 3.26Å; L11-T15 PolarHBondContact O-OG1 2.85Å; L11-T15 VanDerWaalsContact O-OG1 3.04Å; T15-R17 PolarHBondContact O-N 3.44Å; T15-Q18 PolarHBondContact O-N 3Å; T15-N19 WeakPolarHBondContact O-CB 3.32Å; T15-N19 VanDerWaalsContact O-CG 3.31Å; T15-N19 PolarHBondContact O-N 2.79Å; T15-N19 PolarHBondContact O-ND2 3.19Å |
| 16 | A | 79.5 | Confident | 82.2 | Confident | 51 Ų | 51 | 93.7 Ų | 93.7 | 42% | 0.421 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60 | -45.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A12 Q18 N19 L20 | A12-A16 WeakPolarHBondContact O-CB 3.49Å; A12-A16 PolarHBondContact O-N 3.46Å; A16-Q18 VanDerWaalsContact C-N 3.34Å; A16-Q18 PolarHBondContact O-N 3.04Å; A16-N19 PolarHBondContact O-N 2.98Å; A16-L20 WeakPolarHBondContact O-CB 3.4Å; A16-L20 VanDerWaalsContact O-CG 3.32Å; A16-L20 WeakPolarHBondContact O-CG 3.26Å; A16-L20 PolarHBondContact O-N 2.87Å |
| 17 | R | 80.4 | Confident | 81.1 | Confident | 136 Ų | 136 | 94.8 Ų | 94.8 | 51% | 0.513 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.6 | -39 | 176.3 | -79.5 | -178.8 | -73.2 | -164.2 | 0.3 | 112.6 | S13 L14 T15 R21 | S13-R17 WeakPolarHBondContact O-CB 3.44Å; S13-R17 VanDerWaalsContact O-CG 3.26Å; S13-R17 WeakPolarHBondContact O-CG 3.4Å; S13-R17 PolarHBondContact O-N 3.27Å; S13-R17 PolarHBondContact O-NE 2.98Å; L14-R17 PolarHBondContact O-N 3.39Å; T15-R17 PolarHBondContact O-N 3.44Å; R17-R21 WeakPolarHBondContact O-CB 3.34Å; R17-R21 VanDerWaalsContact O-CG 3.31Å; R17-R21 WeakPolarHBondContact O-CG 3.48Å; R17-R21 PolarHBondContact O-N 2.88Å |
| 18 | Q | 86.6 | Confident | 80.1 | Confident | 98 Ų | 98 | 93.4 Ų | 93.4 | 46% | 0.458 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -67.6 | -43.1 | 178.8 | -171.4 | 175.9 | 14.2 | 0 | 0 | 111.6 | L14 T15 A16 R21 R22 | L14-Q18 WeakPolarHBondContact O-CB 3.38Å; L14-Q18 PolarHBondContact O-N 3.17Å; T15-Q18 PolarHBondContact O-N 3Å; A16-Q18 VanDerWaalsContact C-N 3.34Å; A16-Q18 PolarHBondContact O-N 3.04Å; Q18-R21 PolarHBondContact O-N 3.48Å; Q18-R22 VanDerWaalsContact NE2-NH2 3.16Å; Q18-R22 WeakPolarHBondContact O-CG 3.38Å; Q18-R22 PolarHBondContact O-N 3.37Å |
| 19 | N | 85.6 | Confident | 79.1 | Confident | 83 Ų | 83 | 95.6 Ų | 95.6 | 44% | 0.444 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.3 | -44.4 | 177.8 | -71 | -16 | 0 | 0 | 0 | 111.4 | T15 A16 R21 R22 E23 | T15-N19 WeakPolarHBondContact O-CB 3.32Å; T15-N19 VanDerWaalsContact O-CG 3.31Å; T15-N19 PolarHBondContact O-N 2.79Å; T15-N19 PolarHBondContact O-ND2 3.19Å; A16-N19 PolarHBondContact O-N 2.98Å; N19-R21 PolarHBondContact O-N 2.89Å; N19-R22 PolarHBondContact O-N 2.94Å; N19-E23 PolarHBondContact O-N 3.36Å |
| 20 | L | 77.3 | Confident | 78.1 | Confident | 88 Ų | 88 | 101.9 Ų | 101.9 | 46% | 0.461 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.1 | -44.4 | 174.7 | -71.4 | 171.5 | 0 | 0 | 0 | 111.6 | A16 R22 E23 W24 | A16-L20 WeakPolarHBondContact O-CB 3.4Å; A16-L20 VanDerWaalsContact O-CG 3.32Å; A16-L20 WeakPolarHBondContact O-CG 3.26Å; A16-L20 PolarHBondContact O-N 2.87Å; L20-R22 VanDerWaalsContact C-N 3.3Å; L20-R22 PolarHBondContact O-N 3.21Å; L20-E23 PolarHBondContact O-N 3.17Å; L20-W24 WeakPolarHBondContact O-CB 3.4Å; L20-W24 PolarHBondContact O-N 3.33Å |
| 21 | R | 77.9 | Confident | 76.4 | Confident | 180 Ų | 180 | 100.6 Ų | 100.6 | 68% | 0.679 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -56.1 | -45.8 | 175.9 | -78.7 | 179.7 | -178 | -147.3 | 2.1 | 111.5 | R17 Q18 N19 W24 H25 | R17-R21 WeakPolarHBondContact O-CB 3.34Å; R17-R21 VanDerWaalsContact O-CG 3.31Å; R17-R21 WeakPolarHBondContact O-CG 3.48Å; R17-R21 PolarHBondContact O-N 2.88Å; Q18-R21 PolarHBondContact O-N 3.48Å; N19-R21 PolarHBondContact O-N 2.89Å; R21-W24 PolarHBondContact O-N 2.98Å; R21-H25 WeakPolarHBondContact O-CB 3.45Å; R21-H25 PolarHBondContact O-CD2 2.9Å; R21-H25 PolarHBondContact O-N 3.39Å |
| 22 | R | 79 | Confident | 74.7 | Confident | 147 Ų | 147 | 100 Ų | 100 | 56% | 0.555 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62.6 | -44.4 | 177.5 | -71.2 | 177.5 | -179.5 | 148.1 | -5.1 | 112.1 | Q18 N19 L20 H25 A26 | Q18-R22 VanDerWaalsContact NE2-NH2 3.16Å; Q18-R22 WeakPolarHBondContact O-CG 3.38Å; Q18-R22 PolarHBondContact O-N 3.37Å; N19-R22 PolarHBondContact O-N 2.94Å; L20-R22 VanDerWaalsContact C-N 3.3Å; L20-R22 PolarHBondContact O-N 3.21Å; R22-H25 PolarHBondContact O-N 3.23Å; R22-A26 WeakPolarHBondContact O-CB 3.27Å; R22-A26 PolarHBondContact O-N 3.06Å |
| 23 | E | 78.1 | Confident | 73.1 | Confident | 84 Ų | 84 | 100.5 Ų | 100.5 | 39% | 0.393 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.9 | -45 | 179.1 | -172.2 | -177.2 | 173.7 | 0 | 0 | 111.8 | N19 L20 A26 R27 | N19-E23 PolarHBondContact O-N 3.36Å; L20-E23 PolarHBondContact O-N 3.17Å; E23-A26 PolarHBondContact O-N 2.92Å; E23-R27 WeakPolarHBondContact O-CB 3.31Å; E23-R27 WeakPolarHBondContact O-CG 3.49Å; E23-R27 PolarHBondContact O-N 3.46Å; E23-R27 IonicContact OE1-CZ 3.13Å; E23-R27 IonicContact OE1-NE 3.71Å; E23-R27 IonicContact OE1-NH1 3.69Å; E23-R27 IonicContact OE1-NH2 2.63Å; E23-R27 PolarHBondContact OE1-NH2 3.43Å |
| 24 | W | 75 | Confident | 71.5 | Confident | 164 Ų | 164 | 101.7 Ų | 101.7 | 62% | 0.621 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -65.5 | -40.5 | 176.5 | -78 | 109.7 | 0 | 0 | 0 | 112.5 | L20 R21 R27 A28 | L20-W24 WeakPolarHBondContact O-CB 3.4Å; L20-W24 PolarHBondContact O-N 3.33Å; R21-W24 PolarHBondContact O-N 2.98Å; W24-R27 PolarHBondContact O-N 2.63Å; W24-A28 WeakPolarHBondContact O-CB 3.45Å; W24-A28 PolarHBondContact O-N 3Å |
| 25 | H | 74.3 | Confident | 69.4 | Low | 109 Ų | 109 | 99.8 Ų | 99.8 | 51% | 0.505 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.5 | -47.3 | 173.6 | -90.1 | -73.4 | 0 | 0 | 0 | 111.6 | R21 R22 R27 A28 E29 | R21-H25 WeakPolarHBondContact O-CB 3.45Å; R21-H25 PolarHBondContact O-CD2 2.9Å; R21-H25 PolarHBondContact O-N 3.39Å; R22-H25 PolarHBondContact O-N 3.23Å; H25-R27 VanDerWaalsContact C-N 3.31Å; H25-R27 PolarHBondContact O-N 3.28Å; H25-A28 WeakPolarHBondContact O-CB 3.43Å; H25-A28 PolarHBondContact O-N 3.43Å; H25-E29 WeakPolarHBondContact O-CG 3.38Å; H25-E29 PolarHBondContact O-N 3.13Å |
| 26 | A | 67.6 | Low | 67.5 | Low | 30 Ų | 30 | 106.1 Ų | 106.1 | 25% | 0.248 | 53% | 0.534 | C | S | . | . | H | α-helix | trans | -64.7 | -34.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | R22 E23 R30 | R22-A26 WeakPolarHBondContact O-CB 3.27Å; R22-A26 PolarHBondContact O-N 3.06Å; E23-A26 PolarHBondContact O-N 2.92Å; A26-R30 WeakPolarHBondContact O-CB 3.48Å; A26-R30 VanDerWaalsContact O-CG 3.27Å; A26-R30 WeakPolarHBondContact O-CG 3.39Å; A26-R30 PolarHBondContact O-N 2.87Å |
| 27 | R | 65.8 | Low | 66 | Low | 125 Ų | 125 | 112 Ų | 112 | 47% | 0.472 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -67.3 | -43 | 172.4 | -77.5 | -180 | 179.3 | 168 | 4.6 | 111.8 | E23 W24 H25 R30 S31 | E23-R27 WeakPolarHBondContact O-CB 3.31Å; E23-R27 WeakPolarHBondContact O-CG 3.49Å; E23-R27 PolarHBondContact O-N 3.46Å; E23-R27 IonicContact OE1-CZ 3.13Å; E23-R27 IonicContact OE1-NE 3.71Å; E23-R27 IonicContact OE1-NH1 3.69Å; E23-R27 IonicContact OE1-NH2 2.63Å; E23-R27 PolarHBondContact OE1-NH2 3.43Å; W24-R27 PolarHBondContact O-N 2.63Å; H25-R27 VanDerWaalsContact C-N 3.31Å; H25-R27 PolarHBondContact O-N 3.28Å; R27-R30 PolarHBondContact O-N 3.39Å; R27-S31 WeakPolarHBondContact O-CB 3.37Å; R27-S31 PolarHBondContact O-N 3.43Å; R27-S31 PolarHBondContact O-OG 3.42Å; R27-S31 VanDerWaalsContact O-OG 3.13Å |
| 28 | A | 68 | Low | 64.6 | Low | 45 Ų | 45 | 109.3 Ų | 109.3 | 37% | 0.372 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -60.8 | -49.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | W24 H25 R30 S31 V32 | W24-A28 WeakPolarHBondContact O-CB 3.45Å; W24-A28 PolarHBondContact O-N 3Å; H25-A28 WeakPolarHBondContact O-CB 3.43Å; H25-A28 PolarHBondContact O-N 3.43Å; A28-R30 PolarHBondContact O-N 3.37Å; A28-S31 WeakPolarHBondContact CA-OG 3.17Å; A28-S31 CarbonylContact O-C 3.58Å; A28-S31 PolarHBondContact O-N 3.41Å; A28-S31 VanDerWaalsContact O-N 3.11Å; A28-S31 PolarHBondContact O-OG 3.28Å; A28-V32 WeakPolarHBondContact O-CG2 3.35Å; A28-V32 PolarHBondContact O-N 3.04Å |
| 29 | E | 65.1 | Low | 62.8 | Low | 141 Ų | 141 | 108.4 Ų | 108.4 | 66% | 0.659 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -60.9 | -42.9 | 177.6 | -72.6 | 173.3 | -177.5 | 0 | 0 | 112.5 | H25 S31 V32 G33 | H25-E29 WeakPolarHBondContact O-CG 3.38Å; H25-E29 PolarHBondContact O-N 3.13Å; E29-S31 VanDerWaalsContact C-N 3.31Å; E29-S31 PolarHBondContact O-N 2.9Å; E29-V32 PolarHBondContact O-N 2.88Å; E29-G33 PolarHBondContact O-N 3.18Å |
| 30 | R | 60.1 | Low | 61.1 | Low | 195 Ų | 195 | 111.9 Ų | 111.9 | 74% | 0.736 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -64.8 | -33.9 | 174.2 | -74.7 | -177.2 | -172 | 120.5 | -1.8 | 113 | A26 R27 A28 | A26-R30 WeakPolarHBondContact O-CB 3.48Å; A26-R30 VanDerWaalsContact O-CG 3.27Å; A26-R30 WeakPolarHBondContact O-CG 3.39Å; A26-R30 PolarHBondContact O-N 2.87Å; R27-R30 PolarHBondContact O-N 3.39Å; A28-R30 PolarHBondContact O-N 3.37Å |
| 31 | S | 55.3 | Low | 59.7 | Low | 54 Ų | 54 | 112.4 Ų | 112.4 | 38% | 0.378 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -76 | -28 | 175.7 | 64.8 | 0 | 0 | 0 | 0 | 113.3 | R27 A28 E29 G33 A34 S35 | R27-S31 WeakPolarHBondContact O-CB 3.37Å; R27-S31 PolarHBondContact O-N 3.43Å; R27-S31 PolarHBondContact O-OG 3.42Å; R27-S31 VanDerWaalsContact O-OG 3.13Å; A28-S31 WeakPolarHBondContact CA-OG 3.17Å; A28-S31 CarbonylContact O-C 3.58Å; A28-S31 PolarHBondContact O-N 3.41Å; A28-S31 VanDerWaalsContact O-N 3.11Å; A28-S31 PolarHBondContact O-OG 3.28Å; E29-S31 VanDerWaalsContact C-N 3.31Å; E29-S31 PolarHBondContact O-N 2.9Å; S31-G33 VanDerWaalsContact C-N 3.27Å; S31-G33 PolarHBondContact O-N 3.22Å; S31-A34 CarbonylContact O-C 3.57Å; S31-A34 PolarHBondContact O-N 3.11Å; S31-S35 PolarHBondContact O-N 3.49Å |
| 32 | V | 54.9 | Low | 58.3 | Low | 87 Ų | 87 | 110.6 Ų | 110.6 | 53% | 0.527 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -68.9 | -26.7 | 177.6 | 169.3 | 0 | 0 | 0 | 0 | 111.4 | A28 E29 A34 S35 L38 | A28-V32 WeakPolarHBondContact O-CG2 3.35Å; A28-V32 PolarHBondContact O-N 3.04Å; E29-V32 PolarHBondContact O-N 2.88Å; V32-A34 PolarHBondContact O-N 2.85Å; V32-S35 PolarHBondContact O-N 2.7Å; V32-L38 HydrophobicContact CG2-CD1 4.12Å |
| 33 | G | 47.9 | Very low | 57.1 | Low | 77 Ų | 77 | 109.3 Ų | 109.3 | 79% | 0.794 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68 | -12.3 | 169.5 | 0 | 0 | 0 | 0 | 0 | 115 | E29 S31 | E29-G33 PolarHBondContact O-N 3.18Å; S31-G33 VanDerWaalsContact C-N 3.27Å; S31-G33 PolarHBondContact O-N 3.22Å |
| 34 | A | 48.2 | Very low | 55.9 | Low | 86 Ų | 86 | 108.5 Ų | 108.5 | 71% | 0.711 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.2 | 7.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | S31 V32 | S31-A34 CarbonylContact O-C 3.57Å; S31-A34 PolarHBondContact O-N 3.11Å; V32-A34 PolarHBondContact O-N 2.85Å |
| 35 | S | 45.2 | Very low | 54.8 | Low | 50 Ų | 50 | 105.5 Ų | 105.5 | 35% | 0.35 | 56% | 0.555 | S | S | . | * | trans | -143.7 | 80.3 | -176.3 | -64.3 | 0 | 0 | 0 | 0 | 110.4 | S31 V32 E37 | S31-S35 PolarHBondContact O-N 3.49Å; V32-S35 PolarHBondContact O-N 2.7Å; S35-E37 PolarHBondContact O-N 3.25Å | ||
| 36 | H | 45.5 | Very low | 53.6 | Low | 199 Ų | 199 | 110.2 Ų | 110.2 | 92% | 0.921 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -67.2 | 9.8 | 160.9 | -147 | -82.8 | 0 | 0 | 0 | 112.6 | ||
| 37 | E | 48.8 | Very low | 52.6 | Low | 175 Ų | 175 | 112 Ų | 112 | 82% | 0.818 | 58% | 0.579 | S | S | * | * | trans | -142.8 | 65.9 | 176.3 | -62.9 | -169.4 | -178.8 | 0 | 0 | 109.6 | S35 P39 | S35-E37 PolarHBondContact O-N 3.25Å; E37-P39 WeakPolarHBondContact O-CD 3.21Å | ||
| 38 | L | 49.5 | Very low | 52 | Low | 78 Ų | 78 | 115.3 Ų | 115.3 | 41% | 0.408 | 60% | 0.6 | S | S | . | * | trans | -84.8 | 114.8 | 157.8 | -82.1 | 166.9 | 0 | 0 | 0 | 107.1 | V32 E40 Y42 | V32-L38 HydrophobicContact CG2-CD1 4.12Å; L38-E40 PolarHBondContact O-N 3.07Å; L38-Y42 HydrophobicContact CD2-CD2 3.86Å; L38-Y42 HydrophobicContact CD2-CE2 3.72Å | ||
| 39 | P | 49 | Very low | 51.2 | Low | 79 Ų | 79 | 120.3 Ų | 120.3 | 51% | 0.513 | 62% | 0.62 | S | S | . | * | trans | -58.6 | 135.4 | 178.3 | -20 | 31.4 | 0 | 0 | 0 | 109.1 | E37 H41 Y42 | E37-P39 WeakPolarHBondContact O-CD 3.21Å; P39-H41 WeakPolarHBondContact O-CA 3.44Å; P39-H41 PolarHBondContact O-N 3.31Å; P39-Y42 PolarHBondContact O-N 3.49Å; P39-Y42 VanDerWaalsContact O-N 3.09Å | ||
| 40 | E | 49.7 | Very low | 50.8 | Low | 156 Ų | 156 | 115.3 Ų | 115.3 | 73% | 0.729 | 60% | 0.6 | S | S | * | * | G | 310 helix | trans | -35 | -17 | 171.6 | -71.2 | -75.7 | 144 | 0 | 0 | 115.8 | L38 Y42 L43 | L38-E40 PolarHBondContact O-N 3.07Å; E40-Y42 VanDerWaalsContact C-N 3.27Å; E40-Y42 PolarHBondContact O-N 3.04Å; E40-L43 PolarHBondContact O-N 3.1Å |
| 41 | H | 49.8 | Very low | 50.7 | Low | 100 Ų | 100 | 108.3 Ų | 108.3 | 46% | 0.463 | 59% | 0.588 | S | S | . | * | G | 310 helix | trans | -58 | -24.4 | 170.2 | -77.3 | -74.1 | 0 | 0 | 0 | 115.9 | P39 L43 L44 | P39-H41 WeakPolarHBondContact O-CA 3.44Å; P39-H41 PolarHBondContact O-N 3.31Å; H41-L43 VanDerWaalsContact C-N 3.33Å; H41-L44 PolarHBondContact O-N 3.44Å |
| 42 | Y | 48.5 | Very low | 50.7 | Low | 141 Ų | 141 | 113 Ų | 113 | 55% | 0.553 | 60% | 0.604 | S | S | * | * | G | 310 helix | trans | -73.2 | -24.6 | 177.6 | -86.7 | -87.9 | 0 | 0 | 0 | 113.4 | L38 P39 E40 L44 | L38-Y42 HydrophobicContact CD2-CD2 3.86Å; L38-Y42 HydrophobicContact CD2-CE2 3.72Å; P39-Y42 PolarHBondContact O-N 3.49Å; P39-Y42 VanDerWaalsContact O-N 3.09Å; E40-Y42 VanDerWaalsContact C-N 3.27Å; E40-Y42 PolarHBondContact O-N 3.04Å; Y42-L44 VanDerWaalsContact C-N 3.33Å |
| 43 | L | 53 | Low | 50.7 | Low | 121 Ų | 121 | 114.6 Ų | 114.6 | 63% | 0.634 | 61% | 0.614 | S | S | * | * | G | 310 helix | trans | -76 | -22.4 | 177.7 | -67.8 | 172.8 | 0 | 0 | 0 | 112.7 | E40 H41 I45 R46 | E40-L43 PolarHBondContact O-N 3.1Å; H41-L43 VanDerWaalsContact C-N 3.33Å; L43-I45 PolarHBondContact O-N 3.23Å; L43-R46 PolarHBondContact O-N 2.9Å |
| 44 | L | 53.5 | Low | 51.1 | Low | 67 Ų | 67 | 111.6 Ų | 111.6 | 35% | 0.351 | 58% | 0.583 | S | S | . | * | G | 310 helix | trans | -65.5 | -22.3 | 176.7 | -95.3 | 154.4 | 0 | 0 | 0 | 113.7 | H41 Y42 R46 M57 | H41-L44 PolarHBondContact O-N 3.44Å; Y42-L44 VanDerWaalsContact C-N 3.33Å; L44-R46 VanDerWaalsContact C-N 3.31Å; L44-M57 HydrophobicContact CD1-CE 4.12Å |
| 45 | I | 51.6 | Low | 51.7 | Low | 101 Ų | 101 | 113.6 Ų | 113.6 | 52% | 0.518 | 58% | 0.576 | S | S | . | * | G | 310 helix | trans | -78.3 | -18.2 | -178.3 | -58.7 | 175.7 | 0 | 0 | 0 | 111.5 | L43 M58 | L43-I45 PolarHBondContact O-N 3.23Å; I45-M58 HydrophobicContact CG1-SD 4.17Å |
| 46 | R | 48.5 | Very low | 52.3 | Low | 207 Ų | 207 | 120 Ų | 120 | 78% | 0.781 | 59% | 0.592 | S | S | * | * | G | 310 helix | trans | -89.8 | -6.9 | -175.2 | -141.3 | -179.9 | -177.2 | 173.7 | 0.5 | 114.6 | L43 L44 Q48 | L43-R46 PolarHBondContact O-N 2.9Å; L44-R46 VanDerWaalsContact C-N 3.31Å; R46-Q48 PolarHBondContact O-N 3.05Å |
| 47 | S | 46.4 | Very low | 53.1 | Low | 68 Ų | 68 | 115.1 Ų | 115.1 | 48% | 0.476 | 57% | 0.571 | S | S | . | * | trans | -91.2 | 106.2 | -178 | -166.2 | 0 | 0 | 0 | 0 | 111.1 | N49 V50 | S47-N49 PolarHBondContact O-N 3.12Å; S47-V50 WeakPolarHBondContact O-CG2 3.33Å | ||
| 48 | Q | 53.8 | Low | 53.9 | Low | 194 Ų | 194 | 109.2 Ų | 109.2 | 91% | 0.907 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.7 | 7.2 | -179.2 | -67.5 | -177.2 | 8.6 | 0 | 0 | 114.4 | R46 | R46-Q48 PolarHBondContact O-N 3.05Š|
| 49 | N | 51.6 | Low | 54.6 | Low | 150 Ų | 150 | 111 Ų | 111 | 80% | 0.802 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.9 | 26.2 | -175.6 | -70.2 | -27.3 | 0 | 0 | 0 | 114.3 | S47 G51 | S47-N49 PolarHBondContact O-N 3.12Å; N49-G51 PolarHBondContact O-N 2.82Å |
| 50 | V | 56.1 | Low | 55.3 | Low | 37 Ų | 37 | 115.9 Ų | 115.9 | 22% | 0.224 | 56% | 0.562 | C | S | . | * | trans | -79.1 | 109.3 | 171.9 | -109.3 | 0 | 0 | 0 | 0 | 109.4 | S47 M58 | S47-V50 WeakPolarHBondContact O-CG2 3.33Å; V50-M58 HydrophobicContact CG2-CE 3.66Å | ||
| 51 | G | 56.9 | Low | 55.7 | Low | 48 Ų | 48 | 110 Ų | 110 | 50% | 0.495 | 54% | 0.538 | S | S | . | . | trans | -54.7 | 177.5 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | N49 T53 G54 K55 | N49-G51 PolarHBondContact O-N 2.82Å; G51-T53 PolarHBondContact O-N 3.38Å; G51-G54 PolarHBondContact O-N 3.14Å; G51-K55 PolarHBondContact O-N 3.13Å | ||
| 52 | H | 55.8 | Low | 56.5 | Low | 152 Ų | 152 | 109.8 Ų | 109.8 | 70% | 0.704 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -49.7 | -32.8 | -174.3 | -88.3 | -80.7 | 0 | 0 | 0 | 114.4 | R56 | H52-R56 WeakPolarHBondContact O-CG 3.43Å; H52-R56 PolarHBondContact O-N 3.04Å; H52-R56 VanDerWaalsContact O-N 3.1Å |
| 53 | T | 54.8 | Low | 57.2 | Low | 120 Ų | 120 | 106.2 Ų | 106.2 | 74% | 0.736 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -65.2 | -42.4 | 176.3 | -14.3 | 0 | 0 | 0 | 0 | 112.5 | G51 R56 M57 | G51-T53 PolarHBondContact O-N 3.38Å; T53-R56 PolarHBondContact O-N 2.61Å; T53-M57 PolarHBondContact O-N 2.88Å |
| 54 | G | 56.6 | Low | 57.5 | Low | 15 Ų | 15 | 108.8 Ų | 108.8 | 16% | 0.155 | 54% | 0.535 | C | S | . | . | H | α-helix | trans | -71.9 | -36.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | G51 R56 M57 M58 | G51-G54 PolarHBondContact O-N 3.14Å; G54-R56 VanDerWaalsContact C-N 3.35Å; G54-R56 PolarHBondContact O-N 3.01Å; G54-M57 PolarHBondContact O-N 2.88Å; G54-M58 PolarHBondContact O-N 3.16Å |
| 55 | K | 60.4 | Low | 57.6 | Low | 127 Ų | 127 | 109.4 Ų | 109.4 | 55% | 0.552 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.1 | -41.1 | 171.5 | -65.7 | -179.8 | -176.2 | 176.8 | 0 | 111.8 | G51 M58 L59 | G51-K55 PolarHBondContact O-N 3.13Å; K55-M58 PolarHBondContact O-N 3.47Å; K55-L59 WeakPolarHBondContact O-CB 3.37Å; K55-L59 PolarHBondContact O-N 3.34Å |
| 56 | R | 58.2 | Low | 57.7 | Low | 185 Ų | 185 | 108.1 Ų | 108.1 | 70% | 0.698 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65.4 | -38.1 | 174.5 | -79.4 | -178.2 | 178.1 | 176.6 | 1.5 | 112.5 | H52 T53 G54 L59 R60 | H52-R56 WeakPolarHBondContact O-CG 3.43Å; H52-R56 PolarHBondContact O-N 3.04Å; H52-R56 VanDerWaalsContact O-N 3.1Å; T53-R56 PolarHBondContact O-N 2.61Å; G54-R56 VanDerWaalsContact C-N 3.35Å; G54-R56 PolarHBondContact O-N 3.01Å; R56-L59 PolarHBondContact O-N 2.66Å; R56-R60 WeakPolarHBondContact O-CB 3.39Å; R56-R60 WeakPolarHBondContact O-CG 3.28Å; R56-R60 PolarHBondContact O-N 3.09Å |
| 57 | M | 63.4 | Low | 57.9 | Low | 96 Ų | 96 | 101.3 Ų | 101.3 | 47% | 0.473 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -69.3 | -40.6 | 177.8 | -147.4 | -179.5 | 83.4 | 0 | 0 | 111.4 | L44 T53 G54 R60 C61 | L44-M57 HydrophobicContact CD1-CE 4.12Å; T53-M57 PolarHBondContact O-N 2.88Å; G54-M57 PolarHBondContact O-N 2.88Å; M57-R60 PolarHBondContact O-N 3.35Å; M57-C61 PolarHBondContact O-N 3.5Å; M57-C61 PolarHBondContact O-SG 2.78Å |
| 58 | M | 65.4 | Low | 57.8 | Low | 52 Ų | 52 | 104 Ų | 104 | 26% | 0.256 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.1 | -47.6 | 170.6 | -97.3 | -168.9 | -66.1 | 0 | 0 | 111.8 | I45 V50 G54 K55 R60 C61 L62 | I45-M58 HydrophobicContact CG1-SD 4.17Å; V50-M58 HydrophobicContact CG2-CE 3.66Å; G54-M58 PolarHBondContact O-N 3.16Å; K55-M58 PolarHBondContact O-N 3.47Å; M58-R60 VanDerWaalsContact C-N 3.28Å; M58-R60 PolarHBondContact O-N 3.34Å; M58-C61 PolarHBondContact O-N 3.3Å; M58-C61 VanDerWaalsContact O-N 3.1Å; M58-L62 WeakPolarHBondContact O-CB 3.21Å; M58-L62 PolarHBondContact O-N 3.45Å |
| 59 | L | 64.4 | Low | 57.4 | Low | 116 Ų | 116 | 98.8 Ų | 98.8 | 61% | 0.607 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -59.2 | -42 | 177.7 | -160.9 | 81.6 | 0 | 0 | 0 | 111 | K55 R56 L62 C63 | K55-L59 WeakPolarHBondContact O-CB 3.37Å; K55-L59 PolarHBondContact O-N 3.34Å; R56-L59 PolarHBondContact O-N 2.66Å; L59-L62 PolarHBondContact O-N 3.48Å; L59-C63 VanDerWaalsContact O-CB 3.28Å; L59-C63 WeakPolarHBondContact O-CB 3.44Å; L59-C63 PolarHBondContact O-N 2.85Å; L59-C63 PolarHBondContact O-SG 3.1Å |
| 60 | R | 62.9 | Low | 56.7 | Low | 181 Ų | 181 | 94.5 Ų | 94.5 | 68% | 0.683 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -64.2 | -39.4 | 174.8 | -77.7 | -178.5 | 178.2 | -170 | 0.3 | 112.8 | R56 M57 M58 R64 | R56-R60 WeakPolarHBondContact O-CB 3.39Å; R56-R60 WeakPolarHBondContact O-CG 3.28Å; R56-R60 PolarHBondContact O-N 3.09Å; M57-R60 PolarHBondContact O-N 3.35Å; M58-R60 VanDerWaalsContact C-N 3.28Å; M58-R60 PolarHBondContact O-N 3.34Å; R60-R64 WeakPolarHBondContact O-CB 3.5Å; R60-R64 WeakPolarHBondContact O-CG 3.35Å; R60-R64 PolarHBondContact O-N 2.89Å |
| 61 | C | 59.3 | Low | 55.6 | Low | 33 Ų | 33 | 98.6 Ų | 98.6 | 22% | 0.223 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -68.8 | -44.6 | 176.8 | -68.2 | 0 | 0 | 0 | 0 | 111.1 | M57 M58 C63 R64 L65 | M57-C61 PolarHBondContact O-N 3.5Å; M57-C61 PolarHBondContact O-SG 2.78Å; M58-C61 PolarHBondContact O-N 3.3Å; M58-C61 VanDerWaalsContact O-N 3.1Å; C61-C63 PolarHBondContact O-N 3.29Å; C61-R64 PolarHBondContact O-N 3.28Å; C61-L65 WeakPolarHBondContact O-CB 3.36Å; C61-L65 WeakPolarHBondContact O-CG 3.47Å; C61-L65 PolarHBondContact O-N 3.25Å |
| 62 | L | 64.7 | Low | 54.7 | Low | 94 Ų | 94 | 104 Ų | 104 | 49% | 0.492 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.2 | -47.2 | 175.7 | -131.7 | 101.4 | 0 | 0 | 0 | 110.5 | M58 L59 R64 L65 T66 | M58-L62 WeakPolarHBondContact O-CB 3.21Å; M58-L62 PolarHBondContact O-N 3.45Å; L59-L62 PolarHBondContact O-N 3.48Å; L62-R64 VanDerWaalsContact C-N 3.29Å; L62-R64 PolarHBondContact O-N 3.35Å; L62-L65 PolarHBondContact O-N 2.9Å; L62-T66 WeakPolarHBondContact O-CG2 3.45Å; L62-T66 PolarHBondContact O-N 2.88Å; L62-T66 PolarHBondContact O-OG1 3.25Å; L62-T66 VanDerWaalsContact O-OG1 3.12Å |
| 63 | C | 63.3 | Low | 53.7 | Low | 66 Ų | 66 | 102.9 Ų | 102.9 | 45% | 0.446 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.7 | -34.8 | 176.4 | -71.5 | 0 | 0 | 0 | 0 | 112.7 | L59 C61 T66 S67 | L59-C63 VanDerWaalsContact O-CB 3.28Å; L59-C63 WeakPolarHBondContact O-CB 3.44Å; L59-C63 PolarHBondContact O-N 2.85Å; L59-C63 PolarHBondContact O-SG 3.1Å; C61-C63 PolarHBondContact O-N 3.29Å; C63-T66 WeakPolarHBondContact CA-OG1 3.35Å; C63-T66 PolarHBondContact O-OG1 3.49Å; C63-T66 VanDerWaalsContact O-OG1 3.05Å; C63-S67 WeakPolarHBondContact O-CB 3.37Å; C63-S67 PolarHBondContact O-N 3.4Å; C63-S67 PolarHBondContact O-OG 3.17Å |
| 64 | R | 60.3 | Low | 52.9 | Low | 176 Ų | 176 | 100.1 Ų | 100.1 | 66% | 0.664 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -70.6 | -42.8 | 173.9 | -79.6 | -176.3 | -163.9 | -163.6 | 4.4 | 111.9 | R60 C61 L62 S67 Q68 | R60-R64 WeakPolarHBondContact O-CB 3.5Å; R60-R64 WeakPolarHBondContact O-CG 3.35Å; R60-R64 PolarHBondContact O-N 2.89Å; C61-R64 PolarHBondContact O-N 3.28Å; L62-R64 VanDerWaalsContact C-N 3.29Å; L62-R64 PolarHBondContact O-N 3.35Å; R64-S67 CarbonylContact O-C 3.58Å; R64-S67 PolarHBondContact O-N 3.1Å; R64-Q68 WeakPolarHBondContact O-CB 3.5Å; R64-Q68 WeakPolarHBondContact O-CG 3.49Å; R64-Q68 PolarHBondContact O-N 3.19Å |
| 65 | L | 54.8 | Low | 51.8 | Low | 79 Ų | 79 | 103.6 Ų | 103.6 | 41% | 0.414 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.9 | -46 | 176.8 | -74 | 164.1 | 0 | 0 | 0 | 110.8 | C61 L62 S67 Q68 T69 | C61-L65 WeakPolarHBondContact O-CB 3.36Å; C61-L65 WeakPolarHBondContact O-CG 3.47Å; C61-L65 PolarHBondContact O-N 3.25Å; L62-L65 PolarHBondContact O-N 2.9Å; L65-S67 VanDerWaalsContact C-N 3.28Å; L65-S67 PolarHBondContact O-N 3.45Å; L65-Q68 PolarHBondContact O-N 3.45Å; L65-Q68 VanDerWaalsContact O-N 3.14Å; L65-T69 WeakPolarHBondContact O-CG2 3.22Å; L65-T69 PolarHBondContact O-N 2.85Å; L65-T69 PolarHBondContact O-OG1 2.96Å |
| 66 | T | 55.3 | Low | 50.9 | Low | 74 Ų | 74 | 102.7 Ų | 102.7 | 45% | 0.454 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.6 | -32.3 | 175 | 58.2 | 0 | 0 | 0 | 0 | 112.4 | L62 C63 T69 S70 | L62-T66 WeakPolarHBondContact O-CG2 3.45Å; L62-T66 PolarHBondContact O-N 2.88Å; L62-T66 PolarHBondContact O-OG1 3.25Å; L62-T66 VanDerWaalsContact O-OG1 3.12Å; C63-T66 WeakPolarHBondContact CA-OG1 3.35Å; C63-T66 PolarHBondContact O-OG1 3.49Å; C63-T66 VanDerWaalsContact O-OG1 3.05Å; T66-T69 WeakPolarHBondContact CA-OG1 3.28Å; T66-T69 PolarHBondContact O-OG1 3.21Å; T66-T69 VanDerWaalsContact O-OG1 3.1Å; T66-S70 WeakPolarHBondContact O-CB 3.38Å; T66-S70 PolarHBondContact O-N 3.36Å; T66-S70 PolarHBondContact O-OG 2.63Å; T66-S70 VanDerWaalsContact O-OG 3.04Å |
| 67 | S | 51.4 | Low | 50 | Low | 65 Ų | 65 | 97.9 Ų | 97.9 | 46% | 0.455 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -71.5 | -31.2 | 174.3 | -60.5 | 0 | 0 | 0 | 0 | 112.2 | C63 R64 L65 S70 F71 | C63-S67 WeakPolarHBondContact O-CB 3.37Å; C63-S67 PolarHBondContact O-N 3.4Å; C63-S67 PolarHBondContact O-OG 3.17Å; R64-S67 CarbonylContact O-C 3.58Å; R64-S67 PolarHBondContact O-N 3.1Å; L65-S67 VanDerWaalsContact C-N 3.28Å; L65-S67 PolarHBondContact O-N 3.45Å; S67-S70 WeakPolarHBondContact CA-OG 3.36Å; S67-S70 PolarHBondContact O-OG 3.17Å; S67-S70 VanDerWaalsContact O-OG 3.13Å; S67-F71 VanDerWaalsContact O-CB 3.3Å; S67-F71 WeakPolarHBondContact O-CB 3.3Å; S67-F71 PolarHBondContact O-N 2.85Å |
| 68 | Q | 44.6 | Very low | 48.5 | Very low | 124 Ų | 124 | 101.2 Ų | 101.2 | 58% | 0.579 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -76 | -38.6 | 174.9 | -75.3 | 175.6 | -7 | 0 | 0 | 111.7 | R64 L65 S70 F71 Q72 | R64-Q68 WeakPolarHBondContact O-CB 3.5Å; R64-Q68 WeakPolarHBondContact O-CG 3.49Å; R64-Q68 PolarHBondContact O-N 3.19Å; L65-Q68 PolarHBondContact O-N 3.45Å; L65-Q68 VanDerWaalsContact O-N 3.14Å; Q68-S70 VanDerWaalsContact C-N 3.33Å; Q68-F71 PolarHBondContact O-N 3.33Å; Q68-Q72 PolarHBondContact O-N 3.2Å |
| 69 | T | 44.4 | Very low | 46.9 | Very low | 85 Ų | 85 | 105.4 Ų | 105.4 | 52% | 0.521 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -72.9 | -25.7 | 173.2 | 59.9 | 0 | 0 | 0 | 0 | 112.6 | L65 T66 N73 | L65-T69 WeakPolarHBondContact O-CG2 3.22Å; L65-T69 PolarHBondContact O-N 2.85Å; L65-T69 PolarHBondContact O-OG1 2.96Å; T66-T69 WeakPolarHBondContact CA-OG1 3.28Å; T66-T69 PolarHBondContact O-OG1 3.21Å; T66-T69 VanDerWaalsContact O-OG1 3.1Å; T69-N73 PolarHBondContact O-N 3.22Å; T69-N73 PolarHBondContact O-ND2 2.96Å |
| 70 | S | 37.7 | Very low | 45.9 | Very low | 59 Ų | 59 | 108.5 Ų | 108.5 | 41% | 0.413 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -83 | -24.4 | 170.4 | 72.4 | 0 | 0 | 0 | 0 | 112.7 | T66 S67 Q68 S74 | T66-S70 WeakPolarHBondContact O-CB 3.38Å; T66-S70 PolarHBondContact O-N 3.36Å; T66-S70 PolarHBondContact O-OG 2.63Å; T66-S70 VanDerWaalsContact O-OG 3.04Å; S67-S70 WeakPolarHBondContact CA-OG 3.36Å; S67-S70 PolarHBondContact O-OG 3.17Å; S67-S70 VanDerWaalsContact O-OG 3.13Å; Q68-S70 VanDerWaalsContact C-N 3.33Å; S70-S74 VanDerWaalsContact O-CB 3.28Å; S70-S74 WeakPolarHBondContact O-CB 3.33Å; S70-S74 PolarHBondContact O-N 3.3Å; S70-S74 PolarHBondContact O-OG 2.99Å |
| 71 | F | 33.8 | Very low | 44.9 | Very low | 124 Ų | 124 | 107.7 Ų | 107.7 | 54% | 0.544 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -66 | -41.3 | 170.8 | -141.4 | -99 | 0 | 0 | 0 | 111.3 | S67 Q68 E75 | S67-F71 VanDerWaalsContact O-CB 3.3Å; S67-F71 WeakPolarHBondContact O-CB 3.3Å; S67-F71 PolarHBondContact O-N 2.85Å; Q68-F71 PolarHBondContact O-N 3.33Å; F71-E75 HydrophobicContact CE1-CG 4.39Å; F71-E75 WeakPolarHBondContact CE1-OE1 3.47Å; F71-E75 WeakPolarHBondContact CE1-OE2 3.4Å; F71-E75 WeakPolarHBondContact CZ-OE1 3.5Å |
| 72 | Q | 37.5 | Very low | 43.6 | Very low | 161 Ų | 161 | 112 Ų | 112 | 75% | 0.752 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -75.2 | -25.2 | 177.8 | -72.1 | -165.3 | -22 | 0 | 0 | 114.3 | Q68 | Q68-Q72 PolarHBondContact O-N 3.2Å |
| 73 | N | 35.7 | Very low | 42.4 | Very low | 128 Ų | 128 | 113.2 Ų | 113.2 | 68% | 0.684 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -101.5 | -8.8 | -177.5 | -72.1 | -34.2 | 0 | 0 | 0 | 115.2 | T69 | T69-N73 PolarHBondContact O-N 3.22Å; T69-N73 PolarHBondContact O-ND2 2.96Å |
| 74 | S | 38 | Very low | 41.4 | Very low | 63 Ų | 63 | 121.2 Ų | 121.2 | 44% | 0.441 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -109.1 | -19 | 178.2 | 67.4 | 0 | 0 | 0 | 0 | 114.8 | S70 F78 | S70-S74 VanDerWaalsContact O-CB 3.28Å; S70-S74 WeakPolarHBondContact O-CB 3.33Å; S70-S74 PolarHBondContact O-N 3.3Å; S70-S74 PolarHBondContact O-OG 2.99Å; S74-F78 WeakPolarHBondContact O-CB 3.41Å; S74-F78 PolarHBondContact O-N 3.23Å; S74-F78 VanDerWaalsContact O-N 3.16Å |
| 75 | E | 33 | Very low | 40.6 | Very low | 88 Ų | 88 | 123.6 Ų | 123.6 | 41% | 0.411 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -75 | -26.7 | 175 | -74.6 | -163.5 | 141.2 | 0 | 0 | 113.6 | F71 S77 | F71-E75 HydrophobicContact CE1-CG 4.39Å; F71-E75 WeakPolarHBondContact CE1-OE1 3.47Å; F71-E75 WeakPolarHBondContact CE1-OE2 3.4Å; F71-E75 WeakPolarHBondContact CZ-OE1 3.5Å; E75-S77 PolarHBondContact O-N 3.32Å |
| 76 | V | 40.4 | Very low | 39.7 | Very low | 107 Ų | 107 | 123.8 Ų | 123.8 | 65% | 0.648 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -70.5 | -22.3 | 177.9 | -178.2 | 0 | 0 | 0 | 0 | 112.3 | ||
| 77 | S | 39.1 | Very low | 39.1 | Very low | 84 Ų | 84 | 126.6 Ų | 126.6 | 59% | 0.587 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -111.5 | -28.7 | -172.8 | -53.1 | 0 | 0 | 0 | 0 | 114.1 | E75 | E75-S77 PolarHBondContact O-N 3.32Å |
| 78 | F | 32.7 | Very low | 38.5 | Very low | 166 Ų | 166 | 128.1 Ų | 128.1 | 73% | 0.728 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -86.2 | -37.1 | -177.6 | -169.8 | -102.9 | 0 | 0 | 0 | 113.4 | S74 K80 | S74-F78 WeakPolarHBondContact O-CB 3.41Å; S74-F78 PolarHBondContact O-N 3.23Å; S74-F78 VanDerWaalsContact O-N 3.16Å; F78-K80 VanDerWaalsContact C-N 3.25Å; F78-K80 PolarHBondContact O-N 3.02Å |
| 79 | W | 31.9 | Very low | 38.5 | Very low | 140 Ų | 140 | 129.6 Ų | 129.6 | 53% | 0.53 | 66% | 0.661 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -75.5 | -12.1 | 180 | -74.7 | 108.3 | 0 | 0 | 0 | 114.1 | Q81 | W79-Q81 VanDerWaalsContact C-N 3.32Å; W79-Q81 PolarHBondContact O-N 2.84Å |
| 80 | K | 43.2 | Very low | 38.3 | Very low | 182 Ų | 182 | 137.4 Ų | 137.4 | 79% | 0.791 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | -12 | -179.6 | -133.3 | 174.4 | -175.7 | 179.8 | 0 | 114 | F78 | F78-K80 VanDerWaalsContact C-N 3.25Å; F78-K80 PolarHBondContact O-N 3.02Å |
| 81 | Q | 41 | Very low | 38.3 | Very low | 163 Ų | 163 | 146 Ų | 146 | 76% | 0.762 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -116 | -4.9 | -171.2 | -83.2 | -176.5 | 8.4 | 0 | 0 | 117 | W79 | W79-Q81 VanDerWaalsContact C-N 3.32Å; W79-Q81 PolarHBondContact O-N 2.84Å |
| 82 | N | 32.3 | Very low | 38.6 | Very low | 123 Ų | 123 | 150.6 Ų | 150.6 | 66% | 0.658 | 72% | 0.718 | S | S | * | * | trans | -158.8 | 93.1 | 177.4 | -106 | -53 | 0 | 0 | 0 | 115 | R84 | N82-R84 VanDerWaalsContact C-N 3.29Å; N82-R84 PolarHBondContact O-N 2.93Å | ||
| 83 | P | 40.5 | Very low | 39 | Very low | 121 Ų | 121 | 154.6 Ų | 154.6 | 79% | 0.786 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | -5.3 | 179.9 | -9.6 | 24.4 | 0 | 0 | 0 | 115 | ||
| 84 | R | 42.6 | Very low | 39.1 | Very low | 233 Ų | 233 | 158.4 Ų | 158.4 | 88% | 0.879 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.6 | 22.9 | -163.7 | -68.2 | -167.9 | -179.1 | -145.7 | 2.5 | 117 | N82 | N82-R84 VanDerWaalsContact C-N 3.29Å; N82-R84 PolarHBondContact O-N 2.93Å |
| 85 | R | 43 | Very low | 39.3 | Very low | 227 Ų | 227 | 166.1 Ų | 166.1 | 86% | 0.857 | 76% | 0.756 | S | S | * | * | trans | -127.9 | 7.1 | 175.9 | -102.3 | -176.3 | -179.4 | -168.7 | 1.4 | 116.7 | T87 | R85-T87 PolarHBondContact O-N 3.28Š| ||
| 86 | S | 36.6 | Very low | 39.4 | Very low | 82 Ų | 82 | 169.6 Ų | 169.6 | 57% | 0.573 | 78% | 0.777 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | 41.6 | -171.9 | -169.5 | 0 | 0 | 0 | 0 | 115.4 | ||
| 87 | T | 40.9 | Very low | 39.3 | Very low | 134 Ų | 134 | 176.2 Ų | 176.2 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128 | -6.1 | 174.6 | 53.3 | 0 | 0 | 0 | 0 | 116.1 | R85 | R85-T87 PolarHBondContact O-N 3.28Š|
| 88 | S | 40.7 | Very low | 39.4 | Very low | 97 Ų | 97 | 179.6 Ų | 179.6 | 68% | 0.678 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -95.8 | -18 | -176.8 | 66.4 | 0 | 0 | 0 | 0 | 115.9 | ||
| 89 | L | 42.6 | Very low | 39.3 | Very low | 155 Ų | 155 | 181.6 Ų | 181.6 | 81% | 0.812 | 81% | 0.81 | S | S | * | * | G | 310 helix | trans | -94.9 | -5.6 | -175.3 | -89.7 | 158.4 | 0 | 0 | 0 | 115.4 | R91 | L89-R91 VanDerWaalsContact C-N 3.3Å; L89-R91 PolarHBondContact O-N 3.44Å |
| 90 | R | 40.1 | Very low | 39.2 | Very low | 248 Ų | 248 | 180.2 Ų | 180.2 | 94% | 0.936 | 82% | 0.822 | S | S | * | * | G | 310 helix | trans | -79.8 | -4.4 | 176.3 | -108.1 | -176.5 | -176.9 | -167.9 | 2 | 114.6 | ||
| 91 | R | 38.1 | Very low | 38.8 | Very low | 239 Ų | 239 | 177 Ų | 177 | 90% | 0.902 | 82% | 0.823 | S | S | * | * | G | 310 helix | trans | -99 | 4.1 | -178.3 | -88.5 | -169.8 | 174.7 | -169.6 | -0 | 116.1 | L89 | L89-R91 VanDerWaalsContact C-N 3.3Å; L89-R91 PolarHBondContact O-N 3.44Å |
| 92 | R | 41.5 | Very low | 38.2 | Very low | 222 Ų | 222 | 176.5 Ų | 176.5 | 84% | 0.838 | 83% | 0.825 | S | S | * | * | S | Bend | trans | -110.6 | 16.8 | -174.2 | -133.7 | -179.7 | -174.7 | -173.4 | 1.5 | 116.5 | ||
| 93 | R | 45.6 | Very low | 38.3 | Very low | 245 Ų | 245 | 176.6 Ų | 176.6 | 93% | 0.925 | 83% | 0.83 | S | S | * | * | S | Bend | trans | -126.9 | 31.2 | 174.7 | -70.5 | -170.1 | 178.9 | 179.7 | 1.1 | 114 | ||
| 94 | K | 38.3 | Very low | 37.7 | Very low | 208 Ų | 208 | 177 Ų | 177 | 90% | 0.904 | 83% | 0.83 | S | S | * | * | S | Bend | trans | -133.3 | 8.3 | 176.4 | -115.4 | -171.9 | -177.5 | -174 | 0 | 115.3 | ||
| 95 | R | 41.1 | Very low | 37.1 | Very low | 225 Ų | 225 | 174.4 Ų | 174.4 | 85% | 0.849 | 83% | 0.83 | S | S | * | * | S | Bend | trans | -115.1 | 152.4 | 160.2 | -74.4 | -179.8 | -167.4 | 165.3 | 2.6 | 106.4 | ||
| 96 | D | 35.8 | Very low | 36.3 | Very low | 161 Ų | 161 | 166.7 Ų | 166.7 | 86% | 0.861 | 82% | 0.82 | S | S | * | * | S | Bend | trans | 94.9 | 26.2 | -175.8 | -42.5 | -15 | 0 | 0 | 0 | 115 | ||
| 97 | R | 38.4 | Very low | 36.1 | Very low | 246 Ų | 246 | 171.4 Ų | 171.4 | 93% | 0.928 | 84% | 0.838 | S | S | * | * | S | Bend | trans | -114.5 | 16.9 | 164.5 | -117 | -169.4 | -157.1 | -172.8 | 5.6 | 114.8 | ||
| 98 | L | 40.9 | Very low | 35.5 | Very low | 154 Ų | 154 | 169.4 Ų | 169.4 | 81% | 0.806 | 83% | 0.83 | S | S | * | * | S | Bend | trans | -144 | 136.5 | 172.2 | -65.7 | 171.4 | 0 | 0 | 0 | 107.2 | ||
| 99 | F | 31.2 | Very low | 35 | Very low | 208 Ų | 208 | 174 Ų | 174 | 91% | 0.912 | 84% | 0.838 | S | S | * | * | trans | 81.9 | 118.4 | -162.6 | -65.1 | -86.3 | 0 | 0 | 0 | 113.2 | ||||
| 100 | S | 30 | Very low | 34.3 | Very low | 112 Ų | 112 | 171.4 Ų | 171.4 | 78% | 0.783 | 83% | 0.832 | S | S | * | * | cis | -156.4 | 141.8 | 12.9 | -159 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 101 | S | 32.9 | Very low | 33.9 | Very low | 115 Ų | 115 | 165 Ų | 165 | 80% | 0.804 | 83% | 0.826 | S | S | * | * | trans | -60.4 | 151.4 | -179.6 | -65.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 102 | N | 30.1 | Very low | 33.5 | Very low | 151 Ų | 151 | 156.6 Ų | 156.6 | 81% | 0.807 | 81% | 0.813 | S | S | * | * | trans | -55.8 | 132 | 161.1 | -77.7 | -32.1 | 0 | 0 | 0 | 111.5 | ||||
| 103 | V | 32.9 | Very low | 33 | Very low | 125 Ų | 125 | 153.8 Ų | 153.8 | 76% | 0.758 | 82% | 0.815 | S | S | * | * | 52.5 | 122 | 126.8 | -172.1 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 104 | V | 28.8 | Very low | 32.3 | Very low | 130 Ų | 130 | 151.6 Ų | 151.6 | 79% | 0.788 | 81% | 0.812 | S | S | * | * | -176.6 | 142.1 | 123.9 | 148.5 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 105 | M | 29.6 | Very low | 31.8 | Very low | 179 Ų | 179 | 146.7 Ų | 146.7 | 88% | 0.882 | 80% | 0.804 | S | S | * | * | trans | 88 | 97.4 | 172.2 | -66.1 | -76.2 | -91.3 | 0 | 0 | 119.2 | ||||
| 106 | G | 25.5 | Very low | 31.6 | Very low | 64 Ų | 64 | 147.1 Ų | 147.1 | 66% | 0.66 | 81% | 0.806 | S | S | * | * | 120 | 116.9 | 110.3 | 0 | 0 | 0 | 0 | 0 | 118 | |||||
| 107 | L | 32.4 | Very low | 31.6 | Very low | 181 Ų | 181 | 144.1 Ų | 144.1 | 95% | 0.948 | 80% | 0.796 | S | S | * | * | trans | 79 | 139.5 | 154.6 | -48 | 167.8 | 0 | 0 | 0 | 116.2 | ||||
| 108 | S | 28.5 | Very low | 31.3 | Very low | 92 Ų | 92 | 139.6 Ų | 139.6 | 64% | 0.643 | 79% | 0.789 | S | S | * | * | cis | 176.6 | 147.1 | -15.8 | 179.3 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 109 | K | 31 | Very low | 30.7 | Very low | 195 Ų | 195 | 138.9 Ų | 138.9 | 85% | 0.848 | 79% | 0.786 | S | S | * | * | trans | 69.6 | 138.4 | 167.6 | -70.3 | 161.6 | 172.2 | 179 | 0 | 116.2 | ||||
| 110 | S | 27.9 | Very low | 30.5 | Very low | 99 Ų | 99 | 134.7 Ų | 134.7 | 69% | 0.692 | 78% | 0.781 | S | S | * | * | cis | -173.2 | 153 | 8.2 | 40.7 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 111 | S | 32.2 | Very low | 30.5 | Very low | 114 Ų | 114 | 134.8 Ų | 134.8 | 80% | 0.797 | 78% | 0.782 | S | S | * | * | trans | 37.7 | 119.6 | 146.9 | 60.2 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 112 | G | 29.6 | Very low | 30.6 | Very low | 63 Ų | 63 | 135.4 Ų | 135.4 | 65% | 0.649 | 78% | 0.781 | S | S | * | * | 127.8 | 139.9 | 58.7 | 0 | 0 | 0 | 0 | 0 | 107.9 | |||||
| 113 | D | 29.9 | Very low | 30.7 | Very low | 163 Ų | 163 | 139.1 Ų | 139.1 | 87% | 0.872 | 78% | 0.783 | S | S | * | * | trans | 73.6 | 108.4 | 150.8 | -50.6 | -28.3 | 0 | 0 | 0 | 121.7 | ||||
| 114 | F | 31.6 | Very low | 30.8 | Very low | 198 Ų | 198 | 139.3 Ų | 139.3 | 87% | 0.868 | 79% | 0.785 | S | S | * | * | trans | -15.6 | 124.5 | 140.1 | -118.9 | -102.5 | 0 | 0 | 0 | 115.5 | ||||
| 115 | S | 27.6 | Very low | 31.4 | Very low | 105 Ų | 105 | 137.8 Ų | 137.8 | 73% | 0.734 | 78% | 0.778 | S | S | * | * | trans | -165.7 | 122.7 | 143.5 | -152.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 116 | W | 36.4 | Very low | 31.7 | Very low | 235 Ų | 235 | 136.1 Ų | 136.1 | 89% | 0.89 | 77% | 0.771 | S | S | * | * | trans | -89.2 | 134.6 | 156.6 | -73 | 93.5 | 0 | 0 | 0 | 107.1 | ||||
| 117 | P | 37.3 | Very low | 32.1 | Very low | 98 Ų | 98 | 142.4 Ų | 142.4 | 64% | 0.636 | 78% | 0.783 | S | S | * | * | -146.1 | 140.8 | 128.9 | 28.4 | -8.7 | 0 | 0 | 0 | 114.7 | |||||
| 118 | L | 31.9 | Very low | 32.3 | Very low | 151 Ų | 151 | 141.1 Ų | 141.1 | 79% | 0.791 | 78% | 0.777 | S | S | * | * | 47.5 | 142 | 128 | -67.5 | 157.6 | 0 | 0 | 0 | 122 | |||||
| 119 | D | 27.8 | Very low | 32.6 | Very low | 138 Ų | 138 | 146 Ų | 146 | 74% | 0.738 | 81% | 0.811 | S | S | * | * | trans | 79.9 | 103.1 | 149.2 | -65.3 | -23.8 | 0 | 0 | 0 | 120.7 | ||||
| 120 | C | 26.9 | Very low | 32.7 | Very low | 121 Ų | 121 | 143.5 Ų | 143.5 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | 18.8 | 129.1 | 127.5 | -62.8 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 121 | S | 30.4 | Very low | 32.9 | Very low | 114 Ų | 114 | 145.8 Ų | 145.8 | 80% | 0.797 | 82% | 0.815 | S | S | * | * | trans | 105 | 139.8 | 133.3 | -145.4 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 122 | T | 35.6 | Very low | 33 | Very low | 127 Ų | 127 | 147.6 Ų | 147.6 | 78% | 0.779 | 82% | 0.816 | S | S | * | * | trans | 91 | 82 | 159.8 | -16.8 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 123 | R | 31.6 | Very low | 33.2 | Very low | 229 Ų | 229 | 152.6 Ų | 152.6 | 86% | 0.864 | 83% | 0.826 | S | S | * | * | 8.1 | 133.1 | 123.8 | -145.3 | -173.6 | -113.2 | -148.3 | -1.2 | 118.2 | |||||
| 124 | V | 34.1 | Very low | 33.4 | Very low | 130 Ų | 130 | 151.9 Ų | 151.9 | 79% | 0.788 | 82% | 0.823 | S | S | * | * | trans | 131.6 | 141 | 135.4 | 178.4 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 125 | P | 42.8 | Very low | 33.5 | Very low | 98 Ų | 98 | 148.9 Ų | 148.9 | 64% | 0.636 | 82% | 0.82 | S | S | * | * | trans | -114.3 | 171.3 | -150.3 | 42.6 | -30.4 | 0 | 0 | 0 | 115.7 | ||||
| 126 | I | 35.8 | Very low | 33.9 | Very low | 143 Ų | 143 | 152 Ų | 152 | 73% | 0.733 | 83% | 0.826 | S | S | * | * | trans | 56.4 | 123.5 | 155 | -59.6 | 153.7 | 0 | 0 | 0 | 117.7 | ||||
| 127 | Q | 34.2 | Very low | 33.7 | Very low | 196 Ų | 196 | 145.6 Ų | 145.6 | 92% | 0.916 | 82% | 0.821 | S | S | * | * | -155.8 | 133.9 | 125.9 | -110.2 | 177.3 | 15 | 0 | 0 | 112.1 | |||||
| 128 | N | 35.7 | Very low | 33.5 | Very low | 154 Ų | 154 | 149.6 Ų | 149.6 | 82% | 0.824 | 84% | 0.837 | S | S | * | * | trans | -73.4 | 152.1 | 175.4 | -63.1 | -31.1 | 0 | 0 | 0 | 110.8 | ||||
| 129 | S | 34.8 | Very low | 33.6 | Very low | 194 Ų | 194 | 149.5 Ų | 149.5 | 100% | 1.357 | 84% | 0.841 | S | S | * | * | trans | -146.5 | 0 | 147.2 | 62.9 | 0 | 0 | 0 | 0 | 108.8 |
Retrieved 129 of 129 residues in 33.3 ms
(Link to these results)