| 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 | 69.7 | Low | 82 | Confident | 195 Ų | 195 | 108.6 Ų | 108.6 | 96% | 0.961 | 55% | 0.553 | S | S | * | * | 0 | -84.9 | 0 | -56.9 | -41.3 | -171.1 | 0 | 0 | 111.1 | L3 L4 T5 | M1-L3 VanDerWaalsContact C-N 3.34Å; M1-L3 PolarHBondContact O-N 3.17Å; M1-L3 VanDerWaalsContact O-N 3.09Å; M1-L4 WeakPolarHBondContact O-CB 3.46Å; M1-L4 PolarHBondContact O-N 3.24Å; M1-T5 PolarHBondContact O-N 3.24Å | |||
| 2 | K | 78.6 | Confident | 82.3 | Confident | 182 Ų | 182 | 107.8 Ų | 107.8 | 79% | 0.791 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -43.4 | -49.7 | -173.7 | -64 | -175.3 | 178.3 | -175.6 | 0 | 115.3 | L4 T5 L6 | K2-L4 VanDerWaalsContact C-N 3.33Å; K2-L4 PolarHBondContact O-N 3.38Å; K2-T5 WeakPolarHBondContact O-CB 3.34Å; K2-T5 PolarHBondContact O-N 3.09Å; K2-L6 PolarHBondContact O-N 2.78Å |
| 3 | L | 77.9 | Confident | 82.3 | Confident | 121 Ų | 121 | 108.2 Ų | 108.2 | 63% | 0.634 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -61.8 | -35.4 | -179.9 | -163.7 | 73 | 0 | 0 | 0 | 113.9 | M1 F7 F181 | M1-L3 VanDerWaalsContact C-N 3.34Å; M1-L3 PolarHBondContact O-N 3.17Å; M1-L3 VanDerWaalsContact O-N 3.09Å; L3-F7 PolarHBondContact O-N 3.31Å; L3-F181 HydrophobicContact CD1-CE1 4.43Å; L3-F181 HydrophobicContact CD1-CZ 4.29Å |
| 4 | L | 83.3 | Confident | 82.2 | Confident | 118 Ų | 118 | 102.4 Ų | 102.4 | 62% | 0.618 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -68.7 | -40.8 | 176.4 | -168.2 | 83.9 | 0 | 0 | 0 | 110.7 | M1 K2 F7 V8 | M1-L4 WeakPolarHBondContact O-CB 3.46Å; M1-L4 PolarHBondContact O-N 3.24Å; K2-L4 VanDerWaalsContact C-N 3.33Å; K2-L4 PolarHBondContact O-N 3.38Å; L4-F7 PolarHBondContact O-N 3.41Å; L4-V8 WeakPolarHBondContact O-CG2 3.46Å; L4-V8 PolarHBondContact O-N 2.91Å |
| 5 | T | 83.1 | Confident | 82.1 | Confident | 88 Ų | 88 | 105.1 Ų | 105.1 | 54% | 0.54 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.4 | -44.7 | 176.8 | -49.9 | 0 | 0 | 0 | 0 | 111.2 | M1 K2 F7 V8 V9 | M1-T5 PolarHBondContact O-N 3.24Å; K2-T5 WeakPolarHBondContact O-CB 3.34Å; K2-T5 PolarHBondContact O-N 3.09Å; T5-F7 PolarHBondContact O-N 3.25Å; T5-V8 PolarHBondContact O-N 2.97Å; T5-V9 WeakPolarHBondContact O-CG2 3.25Å; T5-V9 PolarHBondContact O-N 3.23Å |
| 6 | L | 83.3 | Confident | 81.8 | Confident | 66 Ų | 66 | 104.9 Ų | 104.9 | 35% | 0.346 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.1 | -43.6 | 175.2 | -68.3 | 172.4 | 0 | 0 | 0 | 111.9 | K2 V8 V9 F10 I184 | K2-L6 PolarHBondContact O-N 2.78Å; L6-V8 PolarHBondContact O-N 3.34Å; L6-V9 PolarHBondContact O-N 3.01Å; L6-F10 WeakPolarHBondContact O-CB 3.45Å; L6-F10 PolarHBondContact O-N 3.48Å; L6-I184 HydrophobicContact CD1-CD1 3.71Å |
| 7 | F | 84.9 | Confident | 81.1 | Confident | 129 Ų | 129 | 105.7 Ų | 105.7 | 57% | 0.566 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.1 | -42.4 | 177 | -174 | -99.2 | 0 | 0 | 0 | 112.5 | L3 L4 T5 F10 I11 | L3-F7 PolarHBondContact O-N 3.31Å; L4-F7 PolarHBondContact O-N 3.41Å; T5-F7 PolarHBondContact O-N 3.25Å; F7-F10 PolarHBondContact O-N 3.39Å; F7-I11 HydrophobicContact CD1-CG1 4.26Å; F7-I11 HydrophobicContact CE1-CD1 4.42Å; F7-I11 HydrophobicContact CE1-CG1 3.87Å; F7-I11 HydrophobicContact CE2-CD1 4.45Å; F7-I11 HydrophobicContact CE2-CG1 4.44Å; F7-I11 HydrophobicContact CZ-CD1 4.04Å; F7-I11 HydrophobicContact CZ-CG1 3.97Å; F7-I11 WeakPolarHBondContact O-CG1 3.38Å; F7-I11 PolarHBondContact O-N 3.27Å |
| 8 | V | 86.7 | Confident | 80.4 | Confident | 88 Ų | 88 | 108.7 Ų | 108.7 | 53% | 0.533 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.4 | -41.1 | 177.1 | 172.2 | 0 | 0 | 0 | 0 | 111.7 | L4 T5 L6 F10 L12 | L4-V8 WeakPolarHBondContact O-CG2 3.46Å; L4-V8 PolarHBondContact O-N 2.91Å; T5-V8 PolarHBondContact O-N 2.97Å; L6-V8 PolarHBondContact O-N 3.34Å; V8-F10 VanDerWaalsContact C-N 3.34Å; V8-L12 WeakPolarHBondContact O-CB 3.36Å; V8-L12 PolarHBondContact O-N 2.89Å |
| 9 | V | 86.8 | Confident | 79.2 | Confident | 71 Ų | 71 | 108.2 Ų | 108.2 | 43% | 0.43 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.3 | -41.6 | 175.3 | 170.8 | 0 | 0 | 0 | 0 | 111.1 | T5 L6 L12 Q13 | T5-V9 WeakPolarHBondContact O-CG2 3.25Å; T5-V9 PolarHBondContact O-N 3.23Å; L6-V9 PolarHBondContact O-N 3.01Å; V9-L12 PolarHBondContact O-N 3.09Å; V9-Q13 WeakPolarHBondContact O-CG 3.37Å; V9-Q13 PolarHBondContact O-N 2.98Å |
| 10 | F | 82.6 | Confident | 78.2 | Confident | 50 Ų | 50 | 112.3 Ų | 112.3 | 22% | 0.219 | 55% | 0.545 | C | S | . | . | H | α-helix | trans | -60.6 | -51.5 | 176.8 | -178.5 | -97.8 | 0 | 0 | 0 | 112 | L6 F7 V8 L12 Q13 C14 C173 L177 | L6-F10 WeakPolarHBondContact O-CB 3.45Å; L6-F10 PolarHBondContact O-N 3.48Å; F7-F10 PolarHBondContact O-N 3.39Å; V8-F10 VanDerWaalsContact C-N 3.34Å; F10-L12 VanDerWaalsContact C-N 3.28Å; F10-L12 PolarHBondContact O-N 2.99Å; F10-Q13 PolarHBondContact O-N 3.36Å; F10-Q13 VanDerWaalsContact O-N 3.12Å; F10-C14 PolarHBondContact O-N 3.18Å; F10-C14 PolarHBondContact O-SG 3.36Å; F10-C14 VanDerWaalsContact O-SG 3.36Å; F10-C173 HydrophobicContact CE2-CB 3.65Å; F10-C173 HydrophobicContact CZ-CB 3.82Å; F10-L177 HydrophobicContact CD2-CD1 3.86Å; F10-L177 HydrophobicContact CD2-CD2 4.43Å; F10-L177 HydrophobicContact CD2-CG 4.01Å; F10-L177 HydrophobicContact CE2-CD1 3.37Å; F10-L177 HydrophobicContact CE2-CG 3.91Å; F10-L177 HydrophobicContact CZ-CD1 3.76Å |
| 11 | I | 84.8 | Confident | 77.1 | Confident | 87 Ų | 87 | 111.5 Ų | 111.5 | 45% | 0.446 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -59.9 | -39.3 | 177.1 | -64.8 | -64.2 | 0 | 0 | 0 | 111.3 | F7 Y15 | F7-I11 HydrophobicContact CD1-CG1 4.26Å; F7-I11 HydrophobicContact CE1-CD1 4.42Å; F7-I11 HydrophobicContact CE1-CG1 3.87Å; F7-I11 HydrophobicContact CE2-CD1 4.45Å; F7-I11 HydrophobicContact CE2-CG1 4.44Å; F7-I11 HydrophobicContact CZ-CD1 4.04Å; F7-I11 HydrophobicContact CZ-CG1 3.97Å; F7-I11 WeakPolarHBondContact O-CG1 3.38Å; F7-I11 PolarHBondContact O-N 3.27Å; I11-Y15 WeakPolarHBondContact O-CB 3.38Å; I11-Y15 PolarHBondContact O-N 3.34Å |
| 12 | L | 85.9 | Confident | 76.2 | Confident | 98 Ų | 98 | 108.7 Ų | 108.7 | 51% | 0.513 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -66.3 | -37.7 | 176.4 | -170.3 | 69.2 | 0 | 0 | 0 | 112.2 | V8 V9 F10 L16 | V8-L12 WeakPolarHBondContact O-CB 3.36Å; V8-L12 PolarHBondContact O-N 2.89Å; V9-L12 PolarHBondContact O-N 3.09Å; F10-L12 VanDerWaalsContact C-N 3.28Å; F10-L12 PolarHBondContact O-N 2.99Å; L12-L16 HydrophobicContact CG-CD1 4.11Å; L12-L16 WeakPolarHBondContact O-CB 3.49Å; L12-L16 VanDerWaalsContact O-CG 3.24Å; L12-L16 WeakPolarHBondContact O-CG 3.36Å; L12-L16 PolarHBondContact O-N 2.99Å |
| 13 | Q | 82.8 | Confident | 74.7 | Confident | 113 Ų | 113 | 107.6 Ų | 107.6 | 53% | 0.528 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67 | -45.4 | 175.2 | -78.6 | -178 | -44.2 | 0 | 0 | 112.1 | V9 F10 Y15 L16 F17 | V9-Q13 WeakPolarHBondContact O-CG 3.37Å; V9-Q13 PolarHBondContact O-N 2.98Å; F10-Q13 PolarHBondContact O-N 3.36Å; F10-Q13 VanDerWaalsContact O-N 3.12Å; Q13-Y15 VanDerWaalsContact C-N 3.33Å; Q13-Y15 PolarHBondContact O-N 3.5Å; Q13-L16 PolarHBondContact O-N 3.28Å; Q13-F17 WeakPolarHBondContact O-CB 3.41Å; Q13-F17 PolarHBondContact O-N 3.09Å |
| 14 | C | 80.3 | Confident | 73.5 | Confident | 27 Ų | 27 | 104 Ų | 104 | 18% | 0.182 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -56.7 | -49.6 | 173.3 | -62.5 | 0 | 0 | 0 | 0 | 110.4 | F10 L16 F17 E18 | F10-C14 PolarHBondContact O-N 3.18Å; F10-C14 PolarHBondContact O-SG 3.36Å; F10-C14 VanDerWaalsContact O-SG 3.36Å; C14-L16 PolarHBondContact O-N 3.42Å; C14-F17 PolarHBondContact O-N 3.24Å; C14-F17 VanDerWaalsContact O-N 3.13Å; C14-E18 VanDerWaalsContact O-CB 3.29Å; C14-E18 WeakPolarHBondContact O-CB 3.35Å; C14-E18 PolarHBondContact O-N 3.04Å |
| 15 | Y | 81.2 | Confident | 72 | Confident | 143 Ų | 143 | 102.3 Ų | 102.3 | 56% | 0.561 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.4 | -39.1 | -179.9 | -165.8 | -116 | 0 | 0 | 0 | 112.9 | I11 Q13 L19 | I11-Y15 WeakPolarHBondContact O-CB 3.38Å; I11-Y15 PolarHBondContact O-N 3.34Å; Q13-Y15 VanDerWaalsContact C-N 3.33Å; Q13-Y15 PolarHBondContact O-N 3.5Å; Y15-L19 HydrophobicContact CD1-CD1 3.66Å; Y15-L19 HydrophobicContact CD1-CG 4.47Å; Y15-L19 HydrophobicContact CE1-CD1 3.33Å; Y15-L19 HydrophobicContact CE1-CG 4.28Å; Y15-L19 HydrophobicContact CE2-CD1 4.28Å; Y15-L19 HydrophobicContact CE2-CG 4.4Å; Y15-L19 HydrophobicContact CG-CD1 4.27Å; Y15-L19 WeakPolarHBondContact O-CB 3.45Å; Y15-L19 WeakPolarHBondContact O-CG 3.37Å; Y15-L19 PolarHBondContact O-N 3.48Å |
| 16 | L | 77.5 | Confident | 70.7 | Confident | 102 Ų | 102 | 105.8 Ų | 105.8 | 53% | 0.534 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -72.6 | -24.5 | 175.7 | -74.1 | 173 | 0 | 0 | 0 | 113.9 | L12 Q13 C14 | L12-L16 HydrophobicContact CG-CD1 4.11Å; L12-L16 WeakPolarHBondContact O-CB 3.49Å; L12-L16 VanDerWaalsContact O-CG 3.24Å; L12-L16 WeakPolarHBondContact O-CG 3.36Å; L12-L16 PolarHBondContact O-N 2.99Å; Q13-L16 PolarHBondContact O-N 3.28Å; C14-L16 PolarHBondContact O-N 3.42Å |
| 17 | F | 70.2 | Confident | 69.4 | Low | 119 Ų | 119 | 105.7 Ų | 105.7 | 52% | 0.522 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -81.5 | -43 | 175.2 | -169.6 | -92.7 | 0 | 0 | 0 | 110.9 | Q13 C14 L19 R20 C169 | Q13-F17 WeakPolarHBondContact O-CB 3.41Å; Q13-F17 PolarHBondContact O-N 3.09Å; C14-F17 PolarHBondContact O-N 3.24Å; C14-F17 VanDerWaalsContact O-N 3.13Å; F17-L19 VanDerWaalsContact C-N 3.29Å; F17-L19 PolarHBondContact O-N 3.04Å; F17-R20 WeakPolarHBondContact O-CB 3.45Å; F17-R20 PolarHBondContact O-N 2.97Å; F17-C169 HydrophobicContact CD1-CB 4.28Å; F17-C169 VanDerWaalsContact CD1-SG 3.57Å; F17-C169 HydrophobicContact CE1-CB 4.04Å |
| 18 | E | 67.7 | Low | 68 | Low | 159 Ų | 159 | 104.3 Ų | 104.3 | 74% | 0.743 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -70.1 | -25.4 | 176.7 | -159.5 | 162.7 | -159.9 | 0 | 0 | 112.1 | C14 R20 | C14-E18 VanDerWaalsContact O-CB 3.29Å; C14-E18 WeakPolarHBondContact O-CB 3.35Å; C14-E18 PolarHBondContact O-N 3.04Å; E18-R20 VanDerWaalsContact C-N 3.34Å |
| 19 | L | 57.8 | Low | 66.3 | Low | 99 Ų | 99 | 103.9 Ų | 103.9 | 52% | 0.518 | 51% | 0.506 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.8 | 1.9 | 166.8 | -75.3 | 178 | 0 | 0 | 0 | 114.8 | Y15 F17 P21 | Y15-L19 HydrophobicContact CD1-CD1 3.66Å; Y15-L19 HydrophobicContact CD1-CG 4.47Å; Y15-L19 HydrophobicContact CE1-CD1 3.33Å; Y15-L19 HydrophobicContact CE1-CG 4.28Å; Y15-L19 HydrophobicContact CE2-CD1 4.28Å; Y15-L19 HydrophobicContact CE2-CG 4.4Å; Y15-L19 HydrophobicContact CG-CD1 4.27Å; Y15-L19 WeakPolarHBondContact O-CB 3.45Å; Y15-L19 WeakPolarHBondContact O-CG 3.37Å; Y15-L19 PolarHBondContact O-N 3.48Å; F17-L19 VanDerWaalsContact C-N 3.29Å; F17-L19 PolarHBondContact O-N 3.04Å; L19-P21 WeakPolarHBondContact O-CD 3.45Å |
| 20 | R | 59.8 | Low | 64.9 | Low | 191 Ų | 191 | 104 Ų | 104 | 72% | 0.721 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -87.7 | 98.5 | 159.6 | -70.5 | -174.5 | -167.5 | -167.7 | 2.9 | 107.3 | F17 E18 H22 | F17-R20 WeakPolarHBondContact O-CB 3.45Å; F17-R20 PolarHBondContact O-N 2.97Å; E18-R20 VanDerWaalsContact C-N 3.34Å; R20-H22 PolarHBondContact O-N 3.06Å |
| 21 | P | 53.4 | Low | 63.7 | Low | 96 Ų | 96 | 108.6 Ų | 108.6 | 62% | 0.623 | 53% | 0.526 | S | S | * | . | trans | -57 | 114.3 | 157.8 | 26.6 | -32.4 | 0 | 0 | 0 | 106.1 | L19 Q23 | L19-P21 WeakPolarHBondContact O-CD 3.45Å; P21-Q23 PolarHBondContact O-N 3.37Å | ||
| 22 | H | 51.8 | Low | 62.2 | Low | 135 Ų | 135 | 108.5 Ų | 108.5 | 63% | 0.625 | 53% | 0.526 | S | S | * | . | trans | -67.8 | 96.1 | 169.2 | -161.8 | -64 | 0 | 0 | 0 | 105.4 | R20 M24 | R20-H22 PolarHBondContact O-N 3.06Å; H22-M24 PolarHBondContact O-N 3.33Å | ||
| 23 | Q | 46.5 | Very low | 60.9 | Low | 160 Ų | 160 | 108.6 Ų | 108.6 | 75% | 0.748 | 53% | 0.526 | S | S | * | . | trans | -63.3 | 80.4 | 169.6 | -70.8 | -72.8 | -4.7 | 0 | 0 | 106.9 | P21 N25 | P21-Q23 PolarHBondContact O-N 3.37Å; Q23-N25 PolarHBondContact O-N 2.87Å | ||
| 24 | M | 52.8 | Low | 59.5 | Low | 44 Ų | 44 | 112.2 Ų | 112.2 | 22% | 0.217 | 54% | 0.535 | C | S | . | . | trans | -66.2 | 92 | 162.5 | -72.4 | -170.4 | -63.9 | 0 | 0 | 105.4 | H22 E26 Q29 Y165 | H22-M24 PolarHBondContact O-N 3.33Å; M24-E26 PolarHBondContact O-N 3.37Å; M24-Q29 HydrophobicContact CB-CG 4.16Å; M24-Q29 PolarHBondContact O-NE2 3.43Å; M24-Y165 HydrophobicContact SD-CE2 4.43Å | ||
| 25 | N | 52.5 | Low | 58.2 | Low | 83 Ų | 83 | 117 Ų | 117 | 44% | 0.444 | 56% | 0.555 | S | S | . | * | trans | -34.5 | 133.5 | 162.2 | 49.7 | -0.3 | 0 | 0 | 0 | 110.1 | Q23 S27 E28 | Q23-N25 PolarHBondContact O-N 2.87Å; N25-S27 VanDerWaalsContact CG-OG 3.28Å; N25-S27 PolarHBondContact ND2-OG 3.29Å; N25-S27 PolarHBondContact O-N 3.12Å; N25-E28 PolarHBondContact O-N 2.95Å; N25-E28 WeakPolarHBondContact OD1-CB 3.24Å; N25-E28 VanDerWaalsContact OD1-CG 3.3Å; N25-E28 WeakPolarHBondContact OD1-CG 3.34Å | ||
| 26 | E | 55.4 | Low | 56.8 | Low | 161 Ų | 161 | 117.7 Ų | 117.7 | 75% | 0.752 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -58.1 | -21.5 | -174.6 | -59.7 | 177.8 | 123.9 | 0 | 0 | 112.1 | M24 Q29 T30 | M24-E26 PolarHBondContact O-N 3.37Å; E26-Q29 PolarHBondContact O-N 3.36Å; E26-T30 VanDerWaalsContact O-CB 3.29Å; E26-T30 WeakPolarHBondContact O-CB 3.33Å; E26-T30 PolarHBondContact O-N 3.34Å; E26-T30 PolarHBondContact O-OG1 3Å |
| 27 | S | 55.3 | Low | 55.5 | Low | 64 Ų | 64 | 122 Ų | 122 | 45% | 0.448 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62 | -35.1 | 171.6 | 56.4 | 0 | 0 | 0 | 0 | 114.7 | N25 K31 | N25-S27 VanDerWaalsContact CG-OG 3.28Å; N25-S27 PolarHBondContact ND2-OG 3.29Å; N25-S27 PolarHBondContact O-N 3.12Å; S27-K31 WeakPolarHBondContact O-CG 3.24Å; S27-K31 PolarHBondContact O-N 2.89Å |
| 28 | E | 55.8 | Low | 54.6 | Low | 101 Ų | 101 | 120.5 Ų | 120.5 | 47% | 0.472 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -80.8 | -38 | 174.5 | -74.9 | -164.3 | 163.2 | 0 | 0 | 112.2 | N25 T30 K31 L32 | N25-E28 PolarHBondContact O-N 2.95Å; N25-E28 WeakPolarHBondContact OD1-CB 3.24Å; N25-E28 VanDerWaalsContact OD1-CG 3.3Å; N25-E28 WeakPolarHBondContact OD1-CG 3.34Å; E28-T30 VanDerWaalsContact C-N 3.31Å; E28-T30 PolarHBondContact O-N 3.32Å; E28-K31 PolarHBondContact O-N 3.38Å; E28-L32 PolarHBondContact O-N 3.35Å; E28-L32 VanDerWaalsContact O-N 3.15Å |
| 29 | Q | 52.1 | Low | 54 | Low | 79 Ų | 79 | 119.1 Ų | 119.1 | 37% | 0.369 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -60 | -43.1 | 173.3 | -62.6 | -162.6 | 57.2 | 0 | 0 | 111.3 | M24 E26 K31 L32 I33 | M24-Q29 HydrophobicContact CB-CG 4.16Å; M24-Q29 PolarHBondContact O-NE2 3.43Å; E26-Q29 PolarHBondContact O-N 3.36Å; Q29-K31 PolarHBondContact O-N 2.91Å; Q29-L32 PolarHBondContact O-N 2.94Å; Q29-I33 WeakPolarHBondContact O-CD1 3.24Å; Q29-I33 VanDerWaalsContact O-CG1 3.26Å; Q29-I33 WeakPolarHBondContact O-CG1 3.47Å; Q29-I33 PolarHBondContact O-N 3.45Å |
| 30 | T | 56 | Low | 53.7 | Low | 72 Ų | 72 | 121.1 Ų | 121.1 | 44% | 0.442 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65.8 | -36.2 | 179.2 | -57 | 0 | 0 | 0 | 0 | 112.5 | E26 E28 I33 R34 | E26-T30 VanDerWaalsContact O-CB 3.29Å; E26-T30 WeakPolarHBondContact O-CB 3.33Å; E26-T30 PolarHBondContact O-N 3.34Å; E26-T30 PolarHBondContact O-OG1 3Å; E28-T30 VanDerWaalsContact C-N 3.31Å; E28-T30 PolarHBondContact O-N 3.32Å; T30-I33 PolarHBondContact O-N 3.32Å; T30-R34 PolarHBondContact O-N 3.41Å |
| 31 | K | 57.5 | Low | 53.5 | Low | 147 Ų | 147 | 120 Ų | 120 | 64% | 0.639 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -63.3 | -49.1 | 174.9 | -78.9 | 174.8 | 179.6 | 179.4 | 0 | 111.4 | S27 E28 Q29 I33 R34 Q35 | S27-K31 WeakPolarHBondContact O-CG 3.24Å; S27-K31 PolarHBondContact O-N 2.89Å; E28-K31 PolarHBondContact O-N 3.38Å; Q29-K31 PolarHBondContact O-N 2.91Å; K31-I33 VanDerWaalsContact C-N 3.32Å; K31-I33 PolarHBondContact O-N 2.98Å; K31-R34 PolarHBondContact O-N 3.4Å; K31-Q35 WeakPolarHBondContact O-CB 3.34Å; K31-Q35 PolarHBondContact O-N 2.99Å |
| 32 | L | 54.8 | Low | 53.3 | Low | 86 Ų | 86 | 123.3 Ų | 123.3 | 45% | 0.45 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -61.9 | -36.1 | 177.2 | -91.4 | 158 | 0 | 0 | 0 | 113.1 | E28 Q29 R36 | E28-L32 PolarHBondContact O-N 3.35Å; E28-L32 VanDerWaalsContact O-N 3.15Å; Q29-L32 PolarHBondContact O-N 2.94Å; L32-R36 WeakPolarHBondContact O-CG 3.4Å; L32-R36 PolarHBondContact O-N 3.47Å |
| 33 | I | 57.2 | Low | 53.3 | Low | 99 Ų | 99 | 125.1 Ų | 125.1 | 51% | 0.508 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -72.4 | -37.3 | 178.2 | -68.3 | 164.9 | 0 | 0 | 0 | 112.1 | Q29 T30 K31 | Q29-I33 WeakPolarHBondContact O-CD1 3.24Å; Q29-I33 VanDerWaalsContact O-CG1 3.26Å; Q29-I33 WeakPolarHBondContact O-CG1 3.47Å; Q29-I33 PolarHBondContact O-N 3.45Å; T30-I33 PolarHBondContact O-N 3.32Å; K31-I33 VanDerWaalsContact C-N 3.32Å; K31-I33 PolarHBondContact O-N 2.98Å |
| 34 | R | 54.9 | Low | 53.2 | Low | 189 Ų | 189 | 121.2 Ų | 121.2 | 71% | 0.713 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -64.6 | -45.6 | 171.6 | -80.9 | -169.6 | -174.4 | 175.4 | 4.3 | 111.3 | T30 K31 R36 R37 S38 | T30-R34 PolarHBondContact O-N 3.41Å; K31-R34 PolarHBondContact O-N 3.4Å; R34-R36 PolarHBondContact O-N 3.02Å; R34-R37 PolarHBondContact O-N 2.98Å; R34-S38 PolarHBondContact O-OG 3.04Å |
| 35 | Q | 51.8 | Low | 53.1 | Low | 129 Ų | 129 | 127.1 Ų | 127.1 | 60% | 0.603 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -58.8 | -47.3 | -177 | -160.1 | 164.5 | 5.1 | 0 | 0 | 111.3 | K31 R37 S38 | K31-Q35 WeakPolarHBondContact O-CB 3.34Å; K31-Q35 PolarHBondContact O-N 2.99Å; Q35-R37 PolarHBondContact O-N 3.17Å; Q35-R37 VanDerWaalsContact O-N 3.16Å; Q35-S38 PolarHBondContact O-N 2.84Å |
| 36 | R | 51.3 | Low | 52.8 | Low | 157 Ų | 157 | 131 Ų | 131 | 59% | 0.592 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.2 | -13.2 | 176.5 | -68.3 | -171.9 | -171.5 | -168.6 | 7.7 | 115.8 | L32 R34 | L32-R36 WeakPolarHBondContact O-CG 3.4Å; L32-R36 PolarHBondContact O-N 3.47Å; R34-R36 PolarHBondContact O-N 3.02Å |
| 37 | R | 52.2 | Low | 52.2 | Low | 192 Ų | 192 | 127.1 Ų | 127.1 | 73% | 0.725 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.4 | -7.5 | 176.6 | -79.1 | -171.9 | 177.4 | -168.6 | 2.4 | 113.5 | R34 Q35 | R34-R37 PolarHBondContact O-N 2.98Å; Q35-R37 PolarHBondContact O-N 3.17Å; Q35-R37 VanDerWaalsContact O-N 3.16Å |
| 38 | S | 50.2 | Low | 51.2 | Low | 88 Ų | 88 | 128 Ų | 128 | 62% | 0.615 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.4 | -26.6 | -177.2 | -56 | 0 | 0 | 0 | 0 | 112.8 | R34 Q35 D40 | R34-S38 PolarHBondContact O-OG 3.04Å; Q35-S38 PolarHBondContact O-N 2.84Å; S38-D40 VanDerWaalsContact C-N 3.33Å; S38-D40 PolarHBondContact O-N 2.93Å |
| 39 | D | 54.2 | Low | 50.8 | Low | 129 Ų | 129 | 131 Ų | 131 | 69% | 0.69 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | -0.3 | -169.4 | -54.4 | -36.2 | 0 | 0 | 0 | 114.4 | ||
| 40 | D | 51.9 | Low | 50.5 | Low | 141 Ų | 141 | 136.3 Ų | 136.3 | 75% | 0.754 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.8 | 26.8 | -171.9 | -77.7 | -42.3 | 0 | 0 | 0 | 114 | S38 | S38-D40 VanDerWaalsContact C-N 3.33Å; S38-D40 PolarHBondContact O-N 2.93Å |
| 41 | K | 55.3 | Low | 49.6 | Very low | 169 Ų | 169 | 136.9 Ų | 136.9 | 74% | 0.735 | 75% | 0.749 | S | S | * | * | trans | -144.6 | 61.2 | 175.7 | -67.1 | -168 | -162 | 64.5 | 0 | 114.7 | ||||
| 42 | D | 50.9 | Low | 48.5 | Very low | 164 Ų | 164 | 133.4 Ų | 133.4 | 88% | 0.877 | 75% | 0.754 | S | S | * | * | trans | -143.2 | 60.1 | 166.7 | -92.9 | -44.7 | 0 | 0 | 0 | 112.1 | ||||
| 43 | D | 51.9 | Low | 47.7 | Very low | 173 Ų | 173 | 137 Ų | 137 | 93% | 0.925 | 77% | 0.774 | S | S | * | * | trans | -120.1 | 110.9 | 154 | -66.6 | -53.9 | 0 | 0 | 0 | 105.3 | ||||
| 44 | G | 44.1 | Very low | 46.9 | Very low | 78 Ų | 78 | 140.7 Ų | 140.7 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | cis | 107.6 | 83.3 | 24.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 45 | D | 49.4 | Very low | 46 | Very low | 168 Ų | 168 | 135.8 Ų | 135.8 | 90% | 0.898 | 80% | 0.797 | S | S | * | * | trans | -153.5 | 137.6 | 157.7 | -154 | 7.1 | 0 | 0 | 0 | 112.1 | ||||
| 46 | D | 47.3 | Very low | 45.3 | Very low | 165 Ų | 165 | 133.2 Ų | 133.2 | 88% | 0.882 | 81% | 0.805 | S | S | * | * | trans | -83 | 144.2 | -175.8 | -88.1 | -57.8 | 0 | 0 | 0 | 111.8 | ||||
| 47 | G | 41.5 | Very low | 44.7 | Very low | 79 Ų | 79 | 133 Ų | 133 | 81% | 0.814 | 82% | 0.816 | S | S | * | * | trans | -163.6 | 44.4 | -175 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 48 | G | 35.9 | Very low | 44 | Very low | 84 Ų | 84 | 132.8 Ų | 132.8 | 87% | 0.866 | 82% | 0.823 | S | S | * | * | trans | -79 | 133 | 168.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 49 | D | 47.3 | Very low | 43.1 | Very low | 164 Ų | 164 | 132.8 Ų | 132.8 | 88% | 0.877 | 84% | 0.837 | S | S | * | * | trans | -147.6 | 150.3 | 156.5 | -156.8 | 2 | 0 | 0 | 0 | 110.5 | ||||
| 50 | E | 45.4 | Very low | 42.2 | Very low | 190 Ų | 190 | 130.5 Ų | 130.5 | 89% | 0.888 | 84% | 0.844 | S | S | * | * | trans | -96.3 | 146.6 | -169.2 | -63.1 | -179.4 | 151.7 | 0 | 0 | 113 | ||||
| 51 | G | 37.4 | Very low | 41.4 | Very low | 84 Ų | 84 | 131.1 Ų | 131.1 | 87% | 0.866 | 85% | 0.848 | S | S | * | * | trans | 98.4 | 145.7 | 167.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 52 | G | 33.1 | Very low | 40.4 | Very low | 73 Ų | 73 | 132.1 Ų | 132.1 | 75% | 0.753 | 86% | 0.855 | S | S | * | * | cis | 152.9 | 143.5 | 1.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 53 | D | 38.4 | Very low | 39.5 | Very low | 163 Ų | 163 | 128.3 Ų | 128.3 | 87% | 0.872 | 86% | 0.855 | S | S | * | * | trans | 79.3 | 154.1 | 166.7 | -124.8 | -27.8 | 0 | 0 | 0 | 119.7 | ||||
| 54 | E | 40 | Very low | 38.3 | Very low | 175 Ų | 175 | 123.5 Ų | 123.5 | 82% | 0.818 | 85% | 0.846 | S | S | * | * | trans | 72 | 79.8 | 162.4 | -59.7 | -174.1 | -165.8 | 0 | 0 | 122 | ||||
| 55 | G | 37.4 | Very low | 38.1 | Very low | 86 Ų | 86 | 128.9 Ų | 128.9 | 89% | 0.887 | 85% | 0.85 | S | S | * | * | 96.1 | 145.6 | 112.5 | 0 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 56 | G | 36 | Very low | 37.6 | Very low | 75 Ų | 75 | 130 Ų | 130 | 77% | 0.773 | 85% | 0.85 | S | S | * | * | trans | 111.6 | 74 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 57 | D | 38.6 | Very low | 37.3 | Very low | 154 Ų | 154 | 127.9 Ų | 127.9 | 82% | 0.824 | 85% | 0.845 | S | S | * | * | 66.4 | 113 | 72.2 | -129.8 | 10.9 | 0 | 0 | 0 | 114 | |||||
| 58 | E | 37.7 | Very low | 37 | Very low | 186 Ų | 186 | 131.2 Ų | 131.2 | 87% | 0.869 | 84% | 0.844 | S | S | * | * | trans | 58.3 | 109.4 | 162 | -56 | -171 | 153.9 | 0 | 0 | 121.6 | ||||
| 59 | G | 32.5 | Very low | 36.8 | Very low | 88 Ų | 88 | 135.5 Ų | 135.5 | 91% | 0.907 | 84% | 0.842 | S | S | * | * | trans | 115.2 | 105.9 | 139.5 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 60 | G | 34.5 | Very low | 36.3 | Very low | 82 Ų | 82 | 135.4 Ų | 135.4 | 85% | 0.845 | 84% | 0.841 | S | S | * | * | trans | 171.5 | 75.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 61 | D | 35 | Very low | 35.8 | Very low | 154 Ų | 154 | 132.7 Ų | 132.7 | 82% | 0.824 | 83% | 0.833 | S | S | * | * | trans | -68.7 | 149.7 | 171.3 | -80.5 | -52.1 | 0 | 0 | 0 | 112 | ||||
| 62 | E | 34.6 | Very low | 35.5 | Very low | 189 Ų | 189 | 134.5 Ų | 134.5 | 88% | 0.883 | 82% | 0.822 | S | S | * | * | trans | 66.3 | 116.1 | 152 | -67.8 | 170.9 | -176 | 0 | 0 | 120.4 | ||||
| 63 | G | 30.8 | Very low | 35.8 | Very low | 85 Ų | 85 | 137.2 Ų | 137.2 | 88% | 0.876 | 82% | 0.82 | S | S | * | * | trans | 105.2 | 129.8 | 163.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 64 | G | 28 | Very low | 35.5 | Very low | 71 Ų | 71 | 136.8 Ų | 136.8 | 73% | 0.732 | 82% | 0.818 | S | S | * | * | cis | 168.6 | 135.9 | -3.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 65 | E | 39 | Very low | 35.3 | Very low | 192 Ų | 192 | 136.7 Ų | 136.7 | 90% | 0.897 | 81% | 0.814 | S | S | * | * | trans | 57.1 | 102.2 | 157.4 | -61.4 | 178.3 | -161.4 | 0 | 0 | 119.2 | ||||
| 66 | E | 38.6 | Very low | 35.2 | Very low | 192 Ų | 192 | 139.7 Ų | 139.7 | 90% | 0.897 | 81% | 0.81 | S | S | * | * | trans | -63.8 | 145 | 142.3 | -62.1 | 174.1 | 168.2 | 0 | 0 | 109.4 | ||||
| 67 | P | 41.4 | Very low | 35.3 | Very low | 120 Ų | 120 | 143.6 Ų | 143.6 | 78% | 0.779 | 81% | 0.813 | S | S | * | * | trans | -129.7 | 100.4 | 140.1 | 33 | -21.4 | 0 | 0 | 0 | 111.8 | ||||
| 68 | N | 35.6 | Very low | 35.2 | Very low | 148 Ų | 148 | 140 Ų | 140 | 79% | 0.791 | 81% | 0.812 | S | S | * | * | 44.3 | 121.9 | 127.8 | -149 | 24.1 | 0 | 0 | 0 | 119.3 | |||||
| 69 | E | 32.6 | Very low | 35.1 | Very low | 175 Ų | 175 | 139.1 Ų | 139.1 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | trans | -52.3 | 143.8 | 163.1 | -55.9 | 171.3 | 170.7 | 0 | 0 | 111.3 | ||||
| 70 | N | 36.5 | Very low | 35.4 | Very low | 161 Ų | 161 | 142.9 Ų | 142.9 | 86% | 0.861 | 81% | 0.813 | S | S | * | * | trans | -146.2 | 76.6 | 156.1 | -131.7 | 18.9 | 0 | 0 | 0 | 110.8 | ||||
| 71 | N | 33.1 | Very low | 35.4 | Very low | 134 Ų | 134 | 142.5 Ų | 142.5 | 72% | 0.717 | 81% | 0.809 | S | S | * | * | trans | -93.5 | 144.6 | 163 | -174.4 | 22.6 | 0 | 0 | 0 | 108.1 | ||||
| 72 | N | 32.4 | Very low | 35.1 | Very low | 121 Ų | 121 | 138.8 Ų | 138.8 | 65% | 0.647 | 81% | 0.807 | S | S | * | * | trans | 61.9 | 142.3 | 175.3 | -71.8 | -7.8 | 0 | 0 | 0 | 115.6 | ||||
| 73 | D | 39.1 | Very low | 35.1 | Very low | 131 Ų | 131 | 136.9 Ų | 136.9 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | cis | -153.7 | 147 | 34.8 | -105 | -36.8 | 0 | 0 | 0 | 112 | K75 | D73-K75 PolarHBondContact O-N 3.48Š| ||
| 74 | N | 31 | Very low | 35.2 | Very low | 154 Ų | 154 | 141.8 Ų | 141.8 | 82% | 0.824 | 80% | 0.803 | S | S | * | * | trans | -77.9 | 114.5 | 172.2 | -154.5 | 49.1 | 0 | 0 | 0 | 109.6 | ||||
| 75 | K | 37.6 | Very low | 35.3 | Very low | 172 Ų | 172 | 142.6 Ų | 142.6 | 75% | 0.748 | 81% | 0.811 | S | S | * | * | trans | -135.3 | 105.7 | 166.8 | -76.9 | -174.7 | -177.5 | 164.3 | 0 | 111.7 | D73 | D73-K75 PolarHBondContact O-N 3.48Š| ||
| 76 | D | 34.3 | Very low | 34.9 | Very low | 149 Ų | 149 | 136.8 Ų | 136.8 | 80% | 0.797 | 80% | 0.803 | S | S | * | * | trans | -55 | 132.9 | 148.2 | -70.1 | -62.3 | 0 | 0 | 0 | 108.9 | ||||
| 77 | D | 38.3 | Very low | 34.5 | Very low | 158 Ų | 158 | 135.5 Ų | 135.5 | 85% | 0.845 | 80% | 0.802 | S | S | * | * | trans | -156.2 | 102.2 | 147.3 | -91.8 | -41.6 | 0 | 0 | 0 | 107.3 | ||||
| 78 | G | 36.8 | Very low | 34.5 | Very low | 77 Ų | 77 | 139.4 Ų | 139.4 | 79% | 0.794 | 81% | 0.81 | S | S | * | * | trans | -85.5 | 142.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | D80 | G78-D80 PolarHBondContact O-N 3.39Š| ||
| 79 | D | 34.9 | Very low | 34.2 | Very low | 168 Ų | 168 | 136.4 Ų | 136.4 | 90% | 0.898 | 81% | 0.814 | S | S | * | * | trans | -43.4 | 123.1 | -179.6 | -98.1 | -50.6 | 0 | 0 | 0 | 114.7 | ||||
| 80 | D | 38.5 | Very low | 34.1 | Very low | 168 Ų | 168 | 132 Ų | 132 | 90% | 0.898 | 82% | 0.815 | S | S | * | * | trans | -161.8 | 84.7 | 143.6 | -121.3 | -17.6 | 0 | 0 | 0 | 112.2 | G78 | G78-D80 PolarHBondContact O-N 3.39Š| ||
| 81 | G | 34.4 | Very low | 34 | Very low | 74 Ų | 74 | 134.1 Ų | 134.1 | 76% | 0.763 | 82% | 0.82 | S | S | * | * | trans | 96.6 | 114.2 | 144 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 82 | G | 28.8 | Very low | 34 | Very low | 75 Ų | 75 | 131.4 Ų | 131.4 | 77% | 0.773 | 82% | 0.824 | S | S | * | * | 100 | 144 | 123.3 | 0 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 83 | D | 34.2 | Very low | 33.7 | Very low | 150 Ų | 150 | 129.1 Ų | 129.1 | 80% | 0.802 | 83% | 0.829 | S | S | * | * | trans | 59.3 | 103.9 | 165 | -64.1 | -7.6 | 0 | 0 | 0 | 117.5 | ||||
| 84 | E | 33.8 | Very low | 33.6 | Very low | 188 Ų | 188 | 131.8 Ų | 131.8 | 88% | 0.879 | 84% | 0.837 | S | S | * | * | 92.3 | 104 | 76.6 | -87.1 | -163.2 | 179.8 | 0 | 0 | 113.7 | |||||
| 85 | G | 30.8 | Very low | 33.9 | Very low | 87 Ų | 87 | 133 Ų | 133 | 90% | 0.897 | 84% | 0.838 | S | S | * | * | trans | 85.1 | 144 | 160.1 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 86 | G | 29.4 | Very low | 33.9 | Very low | 71 Ų | 71 | 130.1 Ų | 130.1 | 73% | 0.732 | 84% | 0.837 | S | S | * | * | cis | 164.6 | 145 | -5.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 87 | D | 31.6 | Very low | 34 | Very low | 164 Ų | 164 | 130.9 Ų | 130.9 | 88% | 0.877 | 84% | 0.841 | S | S | * | * | trans | 57 | 157.3 | 161.5 | -70.6 | -39.4 | 0 | 0 | 0 | 121.7 | ||||
| 88 | E | 39.7 | Very low | 34 | Very low | 202 Ų | 202 | 130.8 Ų | 130.8 | 94% | 0.944 | 84% | 0.835 | S | S | * | * | trans | 72.4 | 114.9 | 178.7 | -53 | -176.4 | -172.5 | 0 | 0 | 115.5 | ||||
| 89 | G | 29.6 | Very low | 33.8 | Very low | 85 Ų | 85 | 135 Ų | 135 | 88% | 0.876 | 84% | 0.839 | S | S | * | * | cis | 156.3 | 119.6 | -2.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 90 | G | 32.1 | Very low | 33.9 | Very low | 82 Ų | 82 | 131.9 Ų | 131.9 | 85% | 0.845 | 82% | 0.823 | S | S | * | * | trans | 177.3 | 122.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 91 | E | 34.1 | Very low | 33.7 | Very low | 206 Ų | 206 | 131 Ų | 131 | 96% | 0.963 | 82% | 0.818 | S | S | * | * | trans | -96.5 | 151.9 | -172.1 | -60.4 | 176.7 | 146.4 | 0 | 0 | 112.7 | ||||
| 92 | G | 32.1 | Very low | 33.9 | Very low | 77 Ų | 77 | 131.5 Ų | 131.5 | 79% | 0.794 | 80% | 0.803 | S | S | * | * | trans | 103.8 | 114.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 93 | G | 27.3 | Very low | 34.2 | Very low | 73 Ų | 73 | 134.1 Ų | 134.1 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | cis | 82.4 | 132.3 | 30.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 94 | E | 36.4 | Very low | 34.2 | Very low | 188 Ų | 188 | 133.2 Ų | 133.2 | 88% | 0.879 | 79% | 0.789 | S | S | * | * | cis | -156.8 | 137.5 | 7.4 | -81.8 | 160 | -171.1 | 0 | 0 | 105.8 | ||||
| 95 | E | 37.9 | Very low | 34.4 | Very low | 179 Ų | 179 | 131.2 Ų | 131.2 | 84% | 0.836 | 78% | 0.784 | S | S | * | * | cis | -152 | 164.5 | -3.5 | -88.8 | -176.4 | 126.9 | 0 | 0 | 108.7 | N97 | E95-N97 PolarHBondContact O-N 3.33Š| ||
| 96 | P | 36.7 | Very low | 34.7 | Very low | 112 Ų | 112 | 133.1 Ų | 133.1 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | -76.2 | 111 | -177.5 | 31 | -33.4 | 0 | 0 | 0 | 111.9 | E98 | P96-E98 PolarHBondContact O-N 2.9Å; P96-E98 VanDerWaalsContact O-N 3.07Å | ||
| 97 | N | 36.4 | Very low | 34.7 | Very low | 164 Ų | 164 | 133.2 Ų | 133.2 | 88% | 0.877 | 78% | 0.775 | S | S | * | * | trans | -79.4 | 96.5 | 171.5 | -162.1 | 0.6 | 0 | 0 | 0 | 110.2 | E95 N99 | E95-N97 PolarHBondContact O-N 3.33Å; N97-N99 PolarHBondContact O-N 3.13Å; N97-N99 VanDerWaalsContact O-N 3.16Å | ||
| 98 | E | 37.6 | Very low | 34.9 | Very low | 157 Ų | 157 | 132.7 Ų | 132.7 | 73% | 0.734 | 77% | 0.772 | S | S | * | * | trans | -59.7 | 108.1 | 176.9 | -62.1 | 172 | 169 | 0 | 0 | 110.7 | P96 N100 | P96-E98 PolarHBondContact O-N 2.9Å; P96-E98 VanDerWaalsContact O-N 3.07Å; E98-N100 VanDerWaalsContact C-N 3.31Å | ||
| 99 | N | 34.4 | Very low | 34.6 | Very low | 164 Ų | 164 | 131.6 Ų | 131.6 | 88% | 0.877 | 77% | 0.773 | S | S | * | * | trans | -106.8 | 59.3 | 149 | -131.2 | 12 | 0 | 0 | 0 | 108.3 | N97 N101 | N97-N99 PolarHBondContact O-N 3.13Å; N97-N99 VanDerWaalsContact O-N 3.16Å; N99-N101 PolarHBondContact O-N 2.95Å | ||
| 100 | N | 36.1 | Very low | 34.8 | Very low | 103 Ų | 103 | 130 Ų | 130 | 55% | 0.551 | 76% | 0.756 | S | S | * | * | trans | -68.8 | 97.9 | 173 | -168.1 | 26.6 | 0 | 0 | 0 | 107.3 | E98 D102 | E98-N100 VanDerWaalsContact C-N 3.31Å; N100-D102 PolarHBondContact ND2-OD1 2.96Å; N100-D102 PolarHBondContact ND2-OD2 2.88Å; N100-D102 PolarHBondContact O-N 3.47Å; N100-D102 PolarHBondContact OD1-OD1 2.86Å | ||
| 101 | N | 35 | Very low | 34.9 | Very low | 151 Ų | 151 | 129.9 Ų | 129.9 | 81% | 0.807 | 76% | 0.755 | S | S | * | * | trans | -75.8 | 63.3 | 169.9 | -140.2 | 40.9 | 0 | 0 | 0 | 107.9 | N99 N103 | N99-N101 PolarHBondContact O-N 2.95Å; N101-N103 PolarHBondContact O-N 3.5Å | ||
| 102 | D | 38.7 | Very low | 34.8 | Very low | 84 Ų | 84 | 127.7 Ų | 127.7 | 45% | 0.449 | 75% | 0.75 | S | S | . | * | trans | -59 | 87.7 | 167.9 | -108.4 | 9.2 | 0 | 0 | 0 | 106.1 | N100 K104 | N100-D102 PolarHBondContact ND2-OD1 2.96Å; N100-D102 PolarHBondContact ND2-OD2 2.88Å; N100-D102 PolarHBondContact O-N 3.47Å; N100-D102 PolarHBondContact OD1-OD1 2.86Å; D102-K104 HydrophobicContact CB-CD 4.35Å; D102-K104 HydrophobicContact CB-CG 4.46Å; D102-K104 PolarHBondContact O-N 3.47Å; D102-K104 WeakPolarHBondContact OD2-CE 3.29Å; D102-K104 IonicContact OD2-NZ 2.73Å; D102-K104 PolarHBondContact OD2-NZ 3.25Å | ||
| 103 | N | 34.9 | Very low | 35.2 | Very low | 129 Ų | 129 | 132.7 Ų | 132.7 | 69% | 0.69 | 75% | 0.752 | S | S | * | * | trans | -74 | 65.7 | 166.6 | -155.4 | 86.5 | 0 | 0 | 0 | 107.6 | N101 D105 | N101-N103 PolarHBondContact O-N 3.5Å; N103-D105 VanDerWaalsContact C-N 3.26Å; N103-D105 PolarHBondContact ND2-OD2 2.98Å; N103-D105 PolarHBondContact O-N 3.47Å | ||
| 104 | K | 34.5 | Very low | 35.4 | Very low | 132 Ų | 132 | 133.5 Ų | 133.5 | 57% | 0.574 | 76% | 0.761 | S | S | * | * | trans | -68.9 | 89.3 | 171.6 | -93.4 | 166.1 | 169.7 | 143.2 | 0 | 107.9 | D102 D106 | D102-K104 HydrophobicContact CB-CD 4.35Å; D102-K104 HydrophobicContact CB-CG 4.46Å; D102-K104 PolarHBondContact O-N 3.47Å; D102-K104 WeakPolarHBondContact OD2-CE 3.29Å; D102-K104 IonicContact OD2-NZ 2.73Å; D102-K104 PolarHBondContact OD2-NZ 3.25Å; K104-D106 HydrophobicContact CB-CB 4.4Å; K104-D106 WeakPolarHBondContact CD-OD2 3.32Å; K104-D106 PolarHBondContact O-N 3.3Å | ||
| 105 | D | 36.8 | Very low | 35.3 | Very low | 146 Ų | 146 | 128.3 Ų | 128.3 | 78% | 0.781 | 76% | 0.758 | S | S | * | * | trans | -63.6 | 60.2 | 146.7 | -68.8 | -57.3 | 0 | 0 | 0 | 108.9 | N103 G107 | N103-D105 VanDerWaalsContact C-N 3.26Å; N103-D105 PolarHBondContact ND2-OD2 2.98Å; N103-D105 PolarHBondContact O-N 3.47Å; D105-G107 PolarHBondContact O-N 3.36Å | ||
| 106 | D | 37.4 | Very low | 35 | Very low | 126 Ų | 126 | 127.1 Ų | 127.1 | 67% | 0.674 | 76% | 0.757 | S | S | * | * | trans | -72.8 | 103.9 | 167.7 | -85.5 | -30.9 | 0 | 0 | 0 | 106.5 | K104 D108 | K104-D106 HydrophobicContact CB-CB 4.4Å; K104-D106 WeakPolarHBondContact CD-OD2 3.32Å; K104-D106 PolarHBondContact O-N 3.3Å; D106-D108 PolarHBondContact O-N 3.43Å | ||
| 107 | G | 30.6 | Very low | 35 | Very low | 74 Ų | 74 | 130.9 Ų | 130.9 | 76% | 0.763 | 77% | 0.765 | S | S | * | * | trans | -67.8 | 130.5 | -166.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | D105 D109 | D105-G107 PolarHBondContact O-N 3.36Å; G107-D109 VanDerWaalsContact C-N 3.33Å; G107-D109 PolarHBondContact O-N 2.97Å | ||
| 108 | D | 35.1 | Very low | 34.8 | Very low | 152 Ų | 152 | 127.1 Ų | 127.1 | 81% | 0.813 | 77% | 0.766 | S | S | * | * | trans | -93.2 | 68 | 168.2 | -153.7 | 2.7 | 0 | 0 | 0 | 110.6 | D106 G110 | D106-D108 PolarHBondContact O-N 3.43Å; D108-G110 PolarHBondContact O-N 2.73Å | ||
| 109 | D | 34.1 | Very low | 34.5 | Very low | 180 Ų | 180 | 123.2 Ų | 123.2 | 96% | 0.963 | 77% | 0.767 | S | S | * | * | trans | -90.6 | 52.4 | 160.9 | -116.2 | -19.7 | 0 | 0 | 0 | 108.4 | G107 | G107-D109 VanDerWaalsContact C-N 3.33Å; G107-D109 PolarHBondContact O-N 2.97Å | ||
| 110 | G | 33.8 | Very low | 34.5 | Very low | 52 Ų | 52 | 123 Ų | 123 | 54% | 0.536 | 77% | 0.766 | S | S | . | * | trans | -118.5 | 126 | 170.7 | 0 | 0 | 0 | 0 | 0 | 109 | D108 | D108-G110 PolarHBondContact O-N 2.73Š| ||
| 111 | G | 32.9 | Very low | 34.6 | Very low | 79 Ų | 79 | 127.4 Ų | 127.4 | 81% | 0.814 | 78% | 0.783 | S | S | * | * | 113.2 | 85.2 | 64.6 | 0 | 0 | 0 | 0 | 0 | 107.4 | |||||
| 112 | D | 31.9 | Very low | 34.4 | Very low | 159 Ų | 159 | 124 Ų | 124 | 85% | 0.85 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -59.8 | 160.7 | 173.1 | -154.2 | -11 | 0 | 0 | 0 | 110.7 | ||
| 113 | E | 40.1 | Very low | 33.9 | Very low | 182 Ų | 182 | 123.7 Ų | 123.7 | 85% | 0.85 | 80% | 0.8 | S | S | * | * | trans | 75.4 | 105.2 | 177.8 | -50.9 | -172.3 | -179.9 | 0 | 0 | 117.4 | ||||
| 114 | G | 32.9 | Very low | 33.9 | Very low | 91 Ų | 91 | 127 Ų | 127 | 94% | 0.938 | 81% | 0.811 | S | S | * | * | trans | -80.9 | -171.8 | -173.6 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 115 | G | 33 | Very low | 33.8 | Very low | 79 Ų | 79 | 129.5 Ų | 129.5 | 81% | 0.814 | 83% | 0.825 | S | S | * | * | trans | 172 | 118.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 116 | D | 33.2 | Very low | 34 | Very low | 154 Ų | 154 | 128.7 Ų | 128.7 | 82% | 0.824 | 83% | 0.828 | S | S | * | * | trans | -47.4 | 164.4 | -179.8 | -77.9 | -60.4 | 0 | 0 | 0 | 119.4 | ||||
| 117 | E | 36.2 | Very low | 33.9 | Very low | 190 Ų | 190 | 130 Ų | 130 | 89% | 0.888 | 84% | 0.835 | S | S | * | * | trans | 83 | 109.9 | 147.5 | -80.7 | 170.4 | -157.8 | 0 | 0 | 121.6 | ||||
| 118 | G | 32.2 | Very low | 33.9 | Very low | 86 Ų | 86 | 134.8 Ų | 134.8 | 89% | 0.887 | 84% | 0.837 | S | S | * | * | trans | 106.6 | 128.8 | 150.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 119 | G | 31.2 | Very low | 33.8 | Very low | 74 Ų | 74 | 135.6 Ų | 135.6 | 76% | 0.763 | 84% | 0.841 | S | S | * | * | cis | -175.1 | 166.5 | -2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 120 | D | 34.5 | Very low | 33.7 | Very low | 159 Ų | 159 | 132.2 Ų | 132.2 | 85% | 0.85 | 82% | 0.823 | S | S | * | * | trans | -64.5 | 157.3 | -177.7 | -55.3 | -84.7 | 0 | 0 | 0 | 114.7 | ||||
| 121 | E | 38 | Very low | 33.6 | Very low | 197 Ų | 197 | 137.5 Ų | 137.5 | 92% | 0.921 | 84% | 0.84 | S | S | * | * | 164.5 | 132.5 | 110.1 | -86.9 | -178.8 | -171.4 | 0 | 0 | 113.7 | |||||
| 122 | G | 31.2 | Very low | 33.7 | Very low | 80 Ų | 80 | 138.1 Ų | 138.1 | 83% | 0.825 | 82% | 0.824 | S | S | * | * | trans | 88.1 | 129.5 | 169.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 123 | G | 27.7 | Very low | 33.8 | Very low | 76 Ų | 76 | 137.6 Ų | 137.6 | 78% | 0.784 | 82% | 0.821 | S | S | * | * | cis | 91.9 | 128 | 20.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 124 | E | 35.9 | Very low | 33.5 | Very low | 199 Ų | 199 | 136.1 Ų | 136.1 | 93% | 0.93 | 81% | 0.812 | S | S | * | * | cis | -145 | -177.4 | 8.6 | -65.7 | -176.2 | 155.4 | 0 | 0 | 111.6 | ||||
| 125 | E | 31.3 | Very low | 33.7 | Very low | 185 Ų | 185 | 138.9 Ų | 138.9 | 86% | 0.864 | 81% | 0.805 | S | S | * | * | trans | -69.7 | 145.3 | -161.8 | -58.6 | 155.2 | 176.3 | 0 | 0 | 117.1 | ||||
| 126 | P | 41.7 | Very low | 34.1 | Very low | 128 Ų | 128 | 141.1 Ų | 141.1 | 83% | 0.831 | 80% | 0.799 | S | S | * | * | trans | -100.8 | 89.3 | 157.8 | 35 | -28.1 | 0 | 0 | 0 | 112.4 | ||||
| 127 | N | 33.8 | Very low | 34.1 | Very low | 153 Ų | 153 | 137.7 Ų | 137.7 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | 49.4 | 106.9 | 142.9 | -156.2 | 17.9 | 0 | 0 | 0 | 119.3 | N129 | N127-N129 PolarHBondContact O-N 3.31Å; N127-N129 VanDerWaalsContact O-N 3.11Å | ||
| 128 | E | 30.9 | Very low | 34.2 | Very low | 176 Ų | 176 | 136 Ų | 136 | 82% | 0.822 | 80% | 0.796 | S | S | * | * | trans | -57.1 | 107.6 | 172.7 | -59.5 | 176.1 | 161.5 | 0 | 0 | 112.8 | ||||
| 129 | N | 32.7 | Very low | 34.4 | Very low | 168 Ų | 168 | 140 Ų | 140 | 90% | 0.898 | 80% | 0.798 | S | S | * | * | trans | -117.4 | 61.4 | 156 | -133.6 | 13.4 | 0 | 0 | 0 | 108.6 | N127 N131 | N127-N129 PolarHBondContact O-N 3.31Å; N127-N129 VanDerWaalsContact O-N 3.11Å; N129-N131 PolarHBondContact O-N 2.81Å; N129-N131 VanDerWaalsContact O-N 3.08Å | ||
| 130 | N | 31.9 | Very low | 34.5 | Very low | 109 Ų | 109 | 139.8 Ų | 139.8 | 58% | 0.583 | 80% | 0.795 | S | S | * | * | trans | -75.3 | 94.1 | -170.8 | -166.6 | 30.3 | 0 | 0 | 0 | 110.4 | D132 | N130-D132 PolarHBondContact ND2-OD1 2.84Å; N130-D132 PolarHBondContact ND2-OD2 2.78Å; N130-D132 PolarHBondContact O-N 3.49Å; N130-D132 VanDerWaalsContact O-N 3.16Å | ||
| 131 | N | 33.2 | Very low | 34.4 | Very low | 164 Ų | 164 | 136.1 Ų | 136.1 | 88% | 0.877 | 80% | 0.795 | S | S | * | * | trans | -84 | 80.3 | 163.5 | -148.1 | 50.2 | 0 | 0 | 0 | 107 | N129 N133 | N129-N131 PolarHBondContact O-N 2.81Å; N129-N131 VanDerWaalsContact O-N 3.08Å; N131-N133 PolarHBondContact O-N 3.47Å; N131-N133 VanDerWaalsContact O-N 3.07Å | ||
| 132 | D | 33.6 | Very low | 34.1 | Very low | 92 Ų | 92 | 134.4 Ų | 134.4 | 49% | 0.492 | 79% | 0.792 | S | S | . | * | trans | -49.8 | 110.5 | -177 | -78.9 | -74.3 | 0 | 0 | 0 | 111.5 | N130 | N130-D132 PolarHBondContact ND2-OD1 2.84Å; N130-D132 PolarHBondContact ND2-OD2 2.78Å; N130-D132 PolarHBondContact O-N 3.49Å; N130-D132 VanDerWaalsContact O-N 3.16Å | ||
| 133 | N | 35.8 | Very low | 34.4 | Very low | 147 Ų | 147 | 139.1 Ų | 139.1 | 79% | 0.786 | 79% | 0.793 | S | S | * | * | trans | -127.2 | 77.8 | 153.8 | -134.5 | 63.5 | 0 | 0 | 0 | 108.2 | N131 D135 | N131-N133 PolarHBondContact O-N 3.47Å; N131-N133 VanDerWaalsContact O-N 3.07Å; N133-D135 PolarHBondContact O-N 3.46Å; N133-D135 VanDerWaalsContact O-N 3.13Å | ||
| 134 | K | 32.4 | Very low | 34.7 | Very low | 152 Ų | 152 | 139.7 Ų | 139.7 | 66% | 0.661 | 80% | 0.798 | S | S | * | * | trans | -70.6 | 97.5 | 170.6 | -68.5 | 178 | 179.5 | -178.2 | 0 | 109.4 | D136 | K134-D136 PolarHBondContact O-N 3.01Š| ||
| 135 | D | 37.9 | Very low | 34.6 | Very low | 149 Ų | 149 | 134.1 Ų | 134.1 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | trans | -92.8 | 68.4 | 147.9 | -77.4 | -48.5 | 0 | 0 | 0 | 108 | N133 G137 | N133-D135 PolarHBondContact O-N 3.46Å; N133-D135 VanDerWaalsContact O-N 3.13Å; D135-G137 PolarHBondContact O-N 2.93Å; D135-G137 VanDerWaalsContact O-N 3.13Å | ||
| 136 | D | 40 | Very low | 34.8 | Very low | 126 Ų | 126 | 132.8 Ų | 132.8 | 67% | 0.674 | 79% | 0.793 | S | S | * | * | trans | -60.7 | 110.3 | 162.6 | -80.3 | -50 | 0 | 0 | 0 | 107.1 | K134 D138 | K134-D136 PolarHBondContact O-N 3.01Å; D136-D138 VanDerWaalsContact C-N 3.33Å; D136-D138 PolarHBondContact O-N 3.5Å | ||
| 137 | G | 34.2 | Very low | 34.4 | Very low | 81 Ų | 81 | 135.4 Ų | 135.4 | 84% | 0.835 | 79% | 0.794 | S | S | * | * | trans | -69.4 | 86 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | D135 D139 | D135-G137 PolarHBondContact O-N 2.93Å; D135-G137 VanDerWaalsContact O-N 3.13Å; G137-D139 PolarHBondContact O-N 3.4Å | ||
| 138 | D | 38.3 | Very low | 34.5 | Very low | 154 Ų | 154 | 132.1 Ų | 132.1 | 82% | 0.824 | 80% | 0.796 | S | S | * | * | trans | -91.1 | 89.4 | 179.6 | -155.2 | 6.8 | 0 | 0 | 0 | 111.5 | D136 G140 | D136-D138 VanDerWaalsContact C-N 3.33Å; D136-D138 PolarHBondContact O-N 3.5Å; D138-G140 VanDerWaalsContact C-N 3.33Å; D138-G140 PolarHBondContact O-N 2.92Å | ||
| 139 | D | 35.9 | Very low | 34.5 | Very low | 172 Ų | 172 | 127.5 Ų | 127.5 | 92% | 0.92 | 80% | 0.796 | S | S | * | * | trans | -79.3 | 76.7 | 179.3 | -138.4 | -7.9 | 0 | 0 | 0 | 110.5 | G137 | G137-D139 PolarHBondContact O-N 3.4Š| ||
| 140 | G | 32.7 | Very low | 34.8 | Very low | 68 Ų | 68 | 127.2 Ų | 127.2 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | trans | 127.9 | 111.2 | 155.2 | 0 | 0 | 0 | 0 | 0 | 118.2 | D138 | D138-G140 VanDerWaalsContact C-N 3.33Å; D138-G140 PolarHBondContact O-N 2.92Å | ||
| 141 | G | 33.1 | Very low | 34.9 | Very low | 82 Ų | 82 | 131.4 Ų | 131.4 | 85% | 0.845 | 81% | 0.81 | S | S | * | * | trans | -166.3 | 113.9 | 166.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 142 | D | 32.2 | Very low | 34.9 | Very low | 162 Ų | 162 | 127.2 Ų | 127.2 | 87% | 0.866 | 81% | 0.806 | S | S | * | * | trans | -79.5 | 167.8 | 177.9 | -155.8 | -12.6 | 0 | 0 | 0 | 111.6 | ||||
| 143 | E | 37.4 | Very low | 34.7 | Very low | 179 Ų | 179 | 126.7 Ų | 126.7 | 84% | 0.836 | 82% | 0.823 | S | S | * | * | trans | 79.5 | 76.7 | 167.8 | -53.2 | -168.3 | -172.6 | 0 | 0 | 120.6 | ||||
| 144 | G | 33.8 | Very low | 35.1 | Very low | 87 Ų | 87 | 128.7 Ų | 128.7 | 90% | 0.897 | 83% | 0.827 | S | S | * | * | 91.9 | 144.3 | 118.7 | 0 | 0 | 0 | 0 | 0 | 121 | |||||
| 145 | G | 34.1 | Very low | 35.6 | Very low | 82 Ų | 82 | 130.4 Ų | 130.4 | 85% | 0.845 | 84% | 0.838 | S | S | * | * | trans | 146.6 | 89.5 | 168.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 146 | D | 34.6 | Very low | 36.1 | Very low | 158 Ų | 158 | 129 Ų | 129 | 85% | 0.845 | 84% | 0.837 | S | S | * | * | trans | -61.3 | 173.8 | 179.6 | -144.5 | -25.9 | 0 | 0 | 0 | 115.4 | ||||
| 147 | E | 34.9 | Very low | 36.3 | Very low | 183 Ų | 183 | 129.8 Ų | 129.8 | 86% | 0.855 | 84% | 0.841 | S | S | * | * | trans | 81.6 | 99.4 | 165.4 | -57.1 | -178.9 | -163.8 | 0 | 0 | 120.9 | ||||
| 148 | G | 34 | Very low | 37.2 | Very low | 83 Ų | 83 | 134.5 Ų | 134.5 | 86% | 0.856 | 84% | 0.841 | S | S | * | * | 127.8 | 112 | 113.3 | 0 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 149 | G | 32.6 | Very low | 37.8 | Very low | 80 Ų | 80 | 130.7 Ų | 130.7 | 83% | 0.825 | 82% | 0.821 | S | S | * | * | trans | 85.7 | 150 | 151.9 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 150 | D | 38.7 | Very low | 38.8 | Very low | 162 Ų | 162 | 127.7 Ų | 127.7 | 87% | 0.866 | 81% | 0.805 | S | S | * | * | cis | -150.3 | 157.1 | -9.2 | -156.6 | -4.9 | 0 | 0 | 0 | 109.5 | G152 | D150-G152 PolarHBondContact O-N 3.18Š| ||
| 151 | E | 34.3 | Very low | 39.9 | Very low | 196 Ų | 196 | 125.9 Ų | 125.9 | 92% | 0.916 | 78% | 0.779 | S | S | * | * | trans | -77 | 111.2 | -170.9 | -66.4 | -179 | 165 | 0 | 0 | 112.2 | ||||
| 152 | G | 32.2 | Very low | 40.8 | Very low | 77 Ų | 77 | 127.4 Ų | 127.4 | 79% | 0.794 | 77% | 0.768 | S | S | * | * | trans | -137.3 | 54.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | D150 | D150-G152 PolarHBondContact O-N 3.18Š| ||
| 153 | G | 29.7 | Very low | 41.8 | Very low | 81 Ų | 81 | 126.1 Ų | 126.1 | 84% | 0.835 | 76% | 0.758 | S | S | * | * | trans | -83.6 | 113.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 154 | E | 44 | Very low | 42.5 | Very low | 189 Ų | 189 | 123.7 Ų | 123.7 | 88% | 0.883 | 75% | 0.747 | S | S | * | * | trans | -99.8 | 128.3 | 154.2 | -65.5 | -165.9 | 167.8 | 0 | 0 | 108.5 | ||||
| 155 | E | 43.4 | Very low | 43.6 | Very low | 187 Ų | 187 | 125 Ų | 125 | 87% | 0.874 | 73% | 0.726 | S | S | * | * | trans | -65.5 | 134.1 | -178.8 | -65.6 | -178.2 | 158.6 | 0 | 0 | 110.3 | N157 | E155-N157 PolarHBondContact O-N 3.04Š| ||
| 156 | P | 47.4 | Very low | 44.7 | Very low | 121 Ų | 121 | 124 Ų | 124 | 79% | 0.786 | 71% | 0.706 | S | S | * | * | trans | -65.8 | 114.6 | 178.4 | 26.6 | -33.1 | 0 | 0 | 0 | 109.7 | E158 | P156-E158 PolarHBondContact O-N 3.29Š| ||
| 157 | N | 45.7 | Very low | 45.7 | Very low | 142 Ų | 142 | 120.1 Ų | 120.1 | 76% | 0.759 | 69% | 0.69 | S | S | * | * | trans | -51.3 | 110.7 | 172 | 178.8 | 18.4 | 0 | 0 | 0 | 110 | E155 N159 | E155-N157 PolarHBondContact O-N 3.04Å; N157-N159 PolarHBondContact O-N 3.17Å | ||
| 158 | E | 52 | Low | 46.9 | Very low | 180 Ų | 180 | 115.6 Ų | 115.6 | 84% | 0.841 | 68% | 0.675 | S | S | * | * | trans | -57.6 | 98.2 | 178.7 | -72.4 | -173.2 | 170.5 | 0 | 0 | 109.6 | P156 N160 | P156-E158 PolarHBondContact O-N 3.29Å; E158-N160 PolarHBondContact O-N 2.8Å | ||
| 159 | N | 51.9 | Low | 48.1 | Very low | 73 Ų | 73 | 113 Ų | 113 | 39% | 0.39 | 64% | 0.643 | S | S | . | * | trans | -73.2 | 125.9 | -167.3 | -149.6 | -9.6 | 0 | 0 | 0 | 108.1 | N157 N161 D162 | N157-N159 PolarHBondContact O-N 3.17Å; N159-N161 PolarHBondContact O-N 3.01Å; N159-D162 PolarHBondContact O-N 2.85Å; N159-D162 VanDerWaalsContact O-N 3.1Å | ||
| 160 | N | 56.5 | Low | 49.5 | Very low | 110 Ų | 110 | 113.1 Ų | 113.1 | 59% | 0.588 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | 0.7 | -170.2 | -147.1 | 11.9 | 0 | 0 | 0 | 114.4 | E158 | E158-N160 PolarHBondContact O-N 2.8Š|
| 161 | N | 55.7 | Low | 50.7 | Low | 29 Ų | 29 | 108.5 Ų | 108.5 | 16% | 0.155 | 61% | 0.607 | C | S | . | * | H | α-helix | trans | -69.9 | -31 | 172.9 | -60.3 | -15.8 | 0 | 0 | 0 | 112.4 | N159 M163 Q164 Y165 | N159-N161 PolarHBondContact O-N 3.01Å; N161-M163 VanDerWaalsContact C-N 3.27Å; N161-M163 PolarHBondContact O-N 3.33Å; N161-Q164 CarbonylContact O-C 3.59Å; N161-Q164 WeakPolarHBondContact O-CA 3.44Å; N161-Q164 PolarHBondContact O-N 2.9Å; N161-Y165 HydrophobicContact CB-CD2 4.13Å; N161-Y165 HydrophobicContact CB-CE2 3.96Å; N161-Y165 VanDerWaalsContact O-CD2 3.24Å; N161-Y165 WeakPolarHBondContact O-CD2 3.5Å; N161-Y165 PolarHBondContact O-N 3.1Å |
| 162 | D | 52.2 | Low | 52.2 | Low | 114 Ų | 114 | 103 Ų | 103 | 61% | 0.61 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -62.5 | -35.9 | 179.3 | -68.5 | -20.8 | 0 | 0 | 0 | 111.7 | N159 S166 | N159-D162 PolarHBondContact O-N 2.85Å; N159-D162 VanDerWaalsContact O-N 3.1Å; D162-S166 WeakPolarHBondContact O-CB 3.27Å; D162-S166 PolarHBondContact O-N 2.76Å; D162-S166 PolarHBondContact O-OG 2.72Å |
| 163 | M | 52.4 | Low | 53.7 | Low | 135 Ų | 135 | 100.5 Ų | 100.5 | 67% | 0.665 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -70 | -28.3 | 171 | -103.1 | -162 | -79.4 | 0 | 0 | 113.3 | N161 S166 C167 | N161-M163 VanDerWaalsContact C-N 3.27Å; N161-M163 PolarHBondContact O-N 3.33Å; M163-S166 WeakPolarHBondContact CA-OG 3.44Å; M163-S166 PolarHBondContact O-OG 3.07Å; M163-C167 WeakPolarHBondContact O-CB 3.43Å; M163-C167 PolarHBondContact O-N 3.16Å |
| 164 | Q | 53.3 | Low | 55.6 | Low | 129 Ų | 129 | 100.8 Ų | 100.8 | 60% | 0.603 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -76 | -45.8 | 174.9 | -63 | -157.5 | 17.2 | 0 | 0 | 111.7 | N161 C167 V168 | N161-Q164 CarbonylContact O-C 3.59Å; N161-Q164 WeakPolarHBondContact O-CA 3.44Å; N161-Q164 PolarHBondContact O-N 2.9Å; Q164-C167 WeakPolarHBondContact O-CB 3.28Å; Q164-C167 PolarHBondContact O-N 2.96Å; Q164-V168 WeakPolarHBondContact O-CG2 3Å; Q164-V168 PolarHBondContact O-N 2.85Å |
| 165 | Y | 55.2 | Low | 56.6 | Low | 114 Ų | 114 | 96.4 Ų | 96.4 | 45% | 0.447 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.5 | -38.2 | 179.3 | -71.6 | -60.1 | 0 | 0 | 0 | 112.8 | M24 N161 C167 V168 C169 | M24-Y165 HydrophobicContact SD-CE2 4.43Å; N161-Y165 HydrophobicContact CB-CD2 4.13Å; N161-Y165 HydrophobicContact CB-CE2 3.96Å; N161-Y165 VanDerWaalsContact O-CD2 3.24Å; N161-Y165 WeakPolarHBondContact O-CD2 3.5Å; N161-Y165 PolarHBondContact O-N 3.1Å; Y165-C167 VanDerWaalsContact C-N 3.34Å; Y165-C167 PolarHBondContact O-N 2.92Å; Y165-V168 PolarHBondContact O-N 3.32Å; Y165-C169 VanDerWaalsContact O-CB 3.27Å; Y165-C169 WeakPolarHBondContact O-CB 3.16Å; Y165-C169 PolarHBondContact O-N 3.5Å |
| 166 | S | 58.1 | Low | 57.5 | Low | 61 Ų | 61 | 93.6 Ų | 93.6 | 43% | 0.427 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63 | -39.2 | 171.1 | 54.1 | 0 | 0 | 0 | 0 | 112.2 | D162 M163 C169 V170 | D162-S166 WeakPolarHBondContact O-CB 3.27Å; D162-S166 PolarHBondContact O-N 2.76Å; D162-S166 PolarHBondContact O-OG 2.72Å; M163-S166 WeakPolarHBondContact CA-OG 3.44Å; M163-S166 PolarHBondContact O-OG 3.07Å; S166-C169 PolarHBondContact O-N 2.9Å; S166-V170 WeakPolarHBondContact O-CB 3.2Å; S166-V170 VanDerWaalsContact O-CG2 3.28Å; S166-V170 WeakPolarHBondContact O-CG2 3.42Å; S166-V170 PolarHBondContact O-N 3.38Å |
| 167 | C | 55 | Low | 58.2 | Low | 76 Ų | 76 | 90.8 Ų | 90.8 | 51% | 0.514 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.8 | -46.2 | 174.7 | -165.4 | 0 | 0 | 0 | 0 | 112.2 | M163 Q164 Y165 C169 V170 C171 | M163-C167 WeakPolarHBondContact O-CB 3.43Å; M163-C167 PolarHBondContact O-N 3.16Å; Q164-C167 WeakPolarHBondContact O-CB 3.28Å; Q164-C167 PolarHBondContact O-N 2.96Å; Y165-C167 VanDerWaalsContact C-N 3.34Å; Y165-C167 PolarHBondContact O-N 2.92Å; C167-C169 PolarHBondContact O-N 3.35Å; C167-V170 PolarHBondContact O-N 2.71Å; C167-C171 PolarHBondContact O-N 2.94Å; C167-C171 PolarHBondContact O-SG 3.13Å; C167-C171 VanDerWaalsContact O-SG 3.36Å |
| 168 | V | 60.7 | Low | 59 | Low | 88 Ų | 88 | 87.1 Ų | 87.1 | 53% | 0.533 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.2 | -43.6 | 176.4 | 173.4 | 0 | 0 | 0 | 0 | 111.3 | Q164 Y165 V170 C171 V172 | Q164-V168 WeakPolarHBondContact O-CG2 3Å; Q164-V168 PolarHBondContact O-N 2.85Å; Y165-V168 PolarHBondContact O-N 3.32Å; V168-V170 PolarHBondContact O-N 3.42Å; V168-C171 PolarHBondContact O-N 3.34Å; V168-V172 HydrophobicContact CG1-CG2 4.44Å; V168-V172 WeakPolarHBondContact O-CG2 3.42Å; V168-V172 PolarHBondContact O-N 3.03Å |
| 169 | C | 58.9 | Low | 59.5 | Low | 28 Ų | 28 | 84.8 Ų | 84.8 | 19% | 0.189 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -57.7 | -48 | 175.4 | -176.6 | 0 | 0 | 0 | 0 | 111.2 | F17 Y165 S166 C167 C171 V172 C173 | F17-C169 HydrophobicContact CD1-CB 4.28Å; F17-C169 VanDerWaalsContact CD1-SG 3.57Å; F17-C169 HydrophobicContact CE1-CB 4.04Å; Y165-C169 VanDerWaalsContact O-CB 3.27Å; Y165-C169 WeakPolarHBondContact O-CB 3.16Å; Y165-C169 PolarHBondContact O-N 3.5Å; S166-C169 PolarHBondContact O-N 2.9Å; C167-C169 PolarHBondContact O-N 3.35Å; C169-C171 PolarHBondContact O-N 3.15Å; C169-V172 PolarHBondContact O-N 2.87Å; C169-C173 VanDerWaalsContact O-CB 3.24Å; C169-C173 WeakPolarHBondContact O-CB 3.34Å; C169-C173 PolarHBondContact O-N 3.45Å; C169-C173 PolarHBondContact O-SG 3.42Å; C169-C173 VanDerWaalsContact O-SG 3.35Å |
| 170 | V | 63.1 | Low | 59.8 | Low | 84 Ų | 84 | 83.5 Ų | 83.5 | 51% | 0.509 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -60.2 | -42.9 | 176.6 | 168.9 | 0 | 0 | 0 | 0 | 111.7 | S166 C167 V168 C173 I174 | S166-V170 WeakPolarHBondContact O-CB 3.2Å; S166-V170 VanDerWaalsContact O-CG2 3.28Å; S166-V170 WeakPolarHBondContact O-CG2 3.42Å; S166-V170 PolarHBondContact O-N 3.38Å; C167-V170 PolarHBondContact O-N 2.71Å; V168-V170 PolarHBondContact O-N 3.42Å; V170-C173 PolarHBondContact O-N 3.29Å; V170-I174 HydrophobicContact CG1-CD1 3.74Å; V170-I174 WeakPolarHBondContact O-CD1 3.24Å; V170-I174 VanDerWaalsContact O-CG1 3.24Å; V170-I174 WeakPolarHBondContact O-CG1 3.3Å; V170-I174 PolarHBondContact O-N 2.91Å |
| 171 | C | 63.6 | Low | 59.8 | Low | 64 Ų | 64 | 83.3 Ų | 83.3 | 43% | 0.432 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -61.1 | -52.4 | 176.5 | -71.3 | 0 | 0 | 0 | 0 | 112.3 | C167 V168 C169 C173 I174 D175 | C167-C171 PolarHBondContact O-N 2.94Å; C167-C171 PolarHBondContact O-SG 3.13Å; C167-C171 VanDerWaalsContact O-SG 3.36Å; V168-C171 PolarHBondContact O-N 3.34Å; C169-C171 PolarHBondContact O-N 3.15Å; C171-C173 VanDerWaalsContact C-N 3.28Å; C171-C173 PolarHBondContact O-N 2.71Å; C171-I174 PolarHBondContact O-N 3.32Å; C171-D175 PolarHBondContact O-N 3.33Å |
| 172 | V | 65.6 | Low | 59.9 | Low | 81 Ų | 81 | 88.1 Ų | 88.1 | 49% | 0.491 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.7 | -38.7 | 179.2 | 174.7 | 0 | 0 | 0 | 0 | 111.5 | V168 C169 D175 Q176 | V168-V172 HydrophobicContact CG1-CG2 4.44Å; V168-V172 WeakPolarHBondContact O-CG2 3.42Å; V168-V172 PolarHBondContact O-N 3.03Å; C169-V172 PolarHBondContact O-N 2.87Å; V172-D175 PolarHBondContact O-N 3.29Å; V172-Q176 WeakPolarHBondContact O-CG 3.44Å; V172-Q176 PolarHBondContact O-N 3.28Å |
| 173 | C | 63.7 | Low | 60.1 | Low | 24 Ų | 24 | 87.2 Ų | 87.2 | 16% | 0.162 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -61.8 | -39.5 | 173.8 | -83 | 0 | 0 | 0 | 0 | 113 | F10 C169 V170 C171 L177 | F10-C173 HydrophobicContact CE2-CB 3.65Å; F10-C173 HydrophobicContact CZ-CB 3.82Å; C169-C173 VanDerWaalsContact O-CB 3.24Å; C169-C173 WeakPolarHBondContact O-CB 3.34Å; C169-C173 PolarHBondContact O-N 3.45Å; C169-C173 PolarHBondContact O-SG 3.42Å; C169-C173 VanDerWaalsContact O-SG 3.35Å; V170-C173 PolarHBondContact O-N 3.29Å; C171-C173 VanDerWaalsContact C-N 3.28Å; C171-C173 PolarHBondContact O-N 2.71Å; C173-L177 WeakPolarHBondContact O-CB 3.38Å; C173-L177 WeakPolarHBondContact O-CG 3.43Å; C173-L177 PolarHBondContact O-N 3.32Å; C173-L177 VanDerWaalsContact O-N 3.09Å |
| 174 | I | 69.5 | Low | 60.4 | Low | 87 Ų | 87 | 85.6 Ų | 85.6 | 45% | 0.446 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -69 | -41.7 | 176.7 | -70.7 | 164.4 | 0 | 0 | 0 | 111 | V170 C171 L177 T178 | V170-I174 HydrophobicContact CG1-CD1 3.74Å; V170-I174 WeakPolarHBondContact O-CD1 3.24Å; V170-I174 VanDerWaalsContact O-CG1 3.24Å; V170-I174 WeakPolarHBondContact O-CG1 3.3Å; V170-I174 PolarHBondContact O-N 2.91Å; C171-I174 PolarHBondContact O-N 3.32Å; I174-L177 WeakPolarHBondContact O-CB 3.36Å; I174-L177 PolarHBondContact O-N 3.39Å; I174-T178 HydrophobicContact CG2-CG2 4.38Å; I174-T178 WeakPolarHBondContact O-CG2 3.48Å; I174-T178 PolarHBondContact O-N 3.03Å; I174-T178 PolarHBondContact O-OG1 3.46Å |
| 175 | D | 65.2 | Low | 60.4 | Low | 97 Ų | 97 | 85.1 Ų | 85.1 | 52% | 0.519 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.5 | -43.7 | 178.3 | -71.6 | -28.8 | 0 | 0 | 0 | 111.7 | C171 V172 L177 T178 H179 | C171-D175 PolarHBondContact O-N 3.33Å; V172-D175 PolarHBondContact O-N 3.29Å; D175-L177 VanDerWaalsContact C-N 3.34Å; D175-L177 PolarHBondContact O-N 3.02Å; D175-T178 PolarHBondContact O-N 3.07Å; D175-T178 PolarHBondContact O-OG1 3.42Å; D175-H179 PolarHBondContact O-CD2 3.19Å; D175-H179 PolarHBondContact O-N 3.02Å |
| 176 | Q | 61.6 | Low | 60.1 | Low | 128 Ų | 128 | 90 Ų | 90 | 60% | 0.598 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -59.3 | -42.5 | 172.4 | -73.7 | -75 | -5.2 | 0 | 0 | 112.3 | V172 S180 | V172-Q176 WeakPolarHBondContact O-CG 3.44Å; V172-Q176 PolarHBondContact O-N 3.28Å; Q176-S180 WeakPolarHBondContact O-CB 3.29Å; Q176-S180 PolarHBondContact O-N 3.16Å |
| 177 | L | 61.6 | Low | 60.2 | Low | 62 Ų | 62 | 91.5 Ų | 91.5 | 33% | 0.325 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.6 | -47.7 | 175.1 | -88.5 | 162.1 | 0 | 0 | 0 | 111.8 | F10 C173 I174 D175 S180 F181 | F10-L177 HydrophobicContact CD2-CD1 3.86Å; F10-L177 HydrophobicContact CD2-CD2 4.43Å; F10-L177 HydrophobicContact CD2-CG 4.01Å; F10-L177 HydrophobicContact CE2-CD1 3.37Å; F10-L177 HydrophobicContact CE2-CG 3.91Å; F10-L177 HydrophobicContact CZ-CD1 3.76Å; C173-L177 WeakPolarHBondContact O-CB 3.38Å; C173-L177 WeakPolarHBondContact O-CG 3.43Å; C173-L177 PolarHBondContact O-N 3.32Å; C173-L177 VanDerWaalsContact O-N 3.09Å; I174-L177 WeakPolarHBondContact O-CB 3.36Å; I174-L177 PolarHBondContact O-N 3.39Å; D175-L177 VanDerWaalsContact C-N 3.34Å; D175-L177 PolarHBondContact O-N 3.02Å; L177-S180 PolarHBondContact O-N 3.18Å; L177-F181 HydrophobicContact CD2-CD2 4.5Å; L177-F181 HydrophobicContact CD2-CE2 4.02Å; L177-F181 VanDerWaalsContact O-CD2 3.25Å; L177-F181 WeakPolarHBondContact O-CD2 3.36Å; L177-F181 PolarHBondContact O-N 3.05Å |
| 178 | T | 64.4 | Low | 60.5 | Low | 65 Ų | 65 | 92.3 Ų | 92.3 | 40% | 0.399 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.9 | -40.7 | -178.3 | 59.1 | 0 | 0 | 0 | 0 | 112.1 | I174 D175 S180 F181 Q182 | I174-T178 HydrophobicContact CG2-CG2 4.38Å; I174-T178 WeakPolarHBondContact O-CG2 3.48Å; I174-T178 PolarHBondContact O-N 3.03Å; I174-T178 PolarHBondContact O-OG1 3.46Å; D175-T178 PolarHBondContact O-N 3.07Å; D175-T178 PolarHBondContact O-OG1 3.42Å; T178-S180 PolarHBondContact O-N 2.82Å; T178-F181 PolarHBondContact O-N 3.07Å; T178-Q182 WeakPolarHBondContact O-CG 3.46Å; T178-Q182 PolarHBondContact O-N 3.07Å |
| 179 | H | 61.6 | Low | 60.5 | Low | 132 Ų | 132 | 92.5 Ų | 92.5 | 61% | 0.611 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -59.9 | -43.1 | 171.4 | -90.3 | -85.3 | 0 | 0 | 0 | 112.3 | D175 Q182 S183 | D175-H179 PolarHBondContact O-CD2 3.19Å; D175-H179 PolarHBondContact O-N 3.02Å; H179-Q182 PolarHBondContact O-N 3.38Å; H179-S183 PolarHBondContact O-N 2.81Å; H179-S183 VanDerWaalsContact O-N 3.09Å |
| 180 | S | 57.5 | Low | 60.6 | Low | 46 Ų | 46 | 96.3 Ų | 96.3 | 32% | 0.322 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.3 | -41.2 | 177.2 | -160.1 | 0 | 0 | 0 | 0 | 112.2 | Q176 L177 T178 S183 I184 | Q176-S180 WeakPolarHBondContact O-CB 3.29Å; Q176-S180 PolarHBondContact O-N 3.16Å; L177-S180 PolarHBondContact O-N 3.18Å; T178-S180 PolarHBondContact O-N 2.82Å; S180-S183 PolarHBondContact O-N 3.08Å; S180-I184 WeakPolarHBondContact O-CD1 3.48Å; S180-I184 WeakPolarHBondContact O-CG1 3.26Å; S180-I184 PolarHBondContact O-N 3.16Å |
| 181 | F | 57.5 | Low | 60.4 | Low | 105 Ų | 105 | 97.1 Ų | 97.1 | 46% | 0.461 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.5 | -38.9 | 175.7 | -86.3 | -69.9 | 0 | 0 | 0 | 113.1 | L3 L177 T178 S183 I184 T185 | L3-F181 HydrophobicContact CD1-CE1 4.43Å; L3-F181 HydrophobicContact CD1-CZ 4.29Å; L177-F181 HydrophobicContact CD2-CD2 4.5Å; L177-F181 HydrophobicContact CD2-CE2 4.02Å; L177-F181 VanDerWaalsContact O-CD2 3.25Å; L177-F181 WeakPolarHBondContact O-CD2 3.36Å; L177-F181 PolarHBondContact O-N 3.05Å; T178-F181 PolarHBondContact O-N 3.07Å; F181-S183 VanDerWaalsContact C-N 3.34Å; F181-I184 PolarHBondContact O-N 3.3Å; F181-T185 PolarHBondContact O-N 3.13Å; F181-T185 PolarHBondContact O-OG1 3.5Å |
| 182 | Q | 58 | Low | 60.2 | Low | 130 Ų | 130 | 99.3 Ų | 99.3 | 61% | 0.607 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -62.3 | -42 | 174.2 | -72.6 | -174.2 | 11.9 | 0 | 0 | 111.7 | T178 H179 I184 T185 | T178-Q182 WeakPolarHBondContact O-CG 3.46Å; T178-Q182 PolarHBondContact O-N 3.07Å; H179-Q182 PolarHBondContact O-N 3.38Å; Q182-I184 PolarHBondContact O-N 3.11Å; Q182-T185 PolarHBondContact O-N 2.99Å; Q182-T185 VanDerWaalsContact O-N 3.17Å |
| 183 | S | 56.5 | Low | 59.8 | Low | 96 Ų | 96 | 100.6 Ų | 100.6 | 67% | 0.671 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -66.4 | -18 | 177.6 | -161.1 | 0 | 0 | 0 | 0 | 114.1 | H179 S180 F181 | H179-S183 PolarHBondContact O-N 2.81Å; H179-S183 VanDerWaalsContact O-N 3.09Å; S180-S183 PolarHBondContact O-N 3.08Å; F181-S183 VanDerWaalsContact C-N 3.34Å |
| 184 | I | 57.1 | Low | 59.5 | Low | 101 Ų | 101 | 106.5 Ų | 106.5 | 52% | 0.518 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -95.2 | -11 | 177.4 | -68.3 | 166.5 | 0 | 0 | 0 | 112.5 | L6 S180 F181 Q182 | L6-I184 HydrophobicContact CD1-CD1 3.71Å; S180-I184 WeakPolarHBondContact O-CD1 3.48Å; S180-I184 WeakPolarHBondContact O-CG1 3.26Å; S180-I184 PolarHBondContact O-N 3.16Å; F181-I184 PolarHBondContact O-N 3.3Å; Q182-I184 PolarHBondContact O-N 3.11Å |
| 185 | T | 54.8 | Low | 58.7 | Low | 118 Ų | 118 | 108.1 Ų | 108.1 | 72% | 0.724 | 57% | 0.574 | S | S | * | * | trans | -104.9 | 2.7 | -174.2 | -47 | 0 | 0 | 0 | 0 | 113.3 | F181 Q182 | F181-T185 PolarHBondContact O-N 3.13Å; F181-T185 PolarHBondContact O-OG1 3.5Å; Q182-T185 PolarHBondContact O-N 2.99Å; Q182-T185 VanDerWaalsContact O-N 3.17Å | ||
| 186 | L | 48.2 | Very low | 58.1 | Low | 217 Ų | 217 | 109.1 Ų | 109.1 | 100% | 1.136 | 58% | 0.579 | S | S | * | * | trans | -109.7 | 0 | 172.2 | -86.5 | 151.2 | 0 | 0 | 0 | 111 |
Retrieved 186 of 186 residues in 130.1 ms
(Link to these results)