| 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 | 35.4 | Very low | 69.7 | Low | 237 Ų | 237 | 114.1 Ų | 114.1 | 100% | 1.167 | 59% | 0.594 | S | S | * | * | 0 | 95.7 | 0 | -71 | 173.8 | 167.6 | 0 | 0 | 108 | F3 | M1-F3 PolarHBondContact O-N 3.32Š| |||
| 2 | S | 43.9 | Very low | 71.5 | Confident | 112 Ų | 112 | 110.5 Ų | 110.5 | 78% | 0.783 | 57% | 0.57 | S | S | * | * | trans | -71.1 | 119 | 166.2 | 45 | 0 | 0 | 0 | 0 | 106.9 | V4 | S2-V4 PolarHBondContact O-N 3.38Š| ||
| 3 | F | 42.3 | Very low | 73.1 | Confident | 201 Ų | 201 | 108.7 Ų | 108.7 | 88% | 0.882 | 57% | 0.573 | S | S | * | * | trans | -52.3 | 117.8 | 170.7 | -68.8 | -87 | 0 | 0 | 0 | 107.7 | M1 Q5 | M1-F3 PolarHBondContact O-N 3.32Å; F3-Q5 PolarHBondContact O-N 3.4Å | ||
| 4 | V | 56.1 | Low | 74.6 | Confident | 121 Ų | 121 | 110.6 Ų | 110.6 | 73% | 0.733 | 57% | 0.569 | S | S | * | * | trans | -68 | 82.8 | 171.1 | -179.9 | 0 | 0 | 0 | 0 | 105.8 | S2 Y6 | S2-V4 PolarHBondContact O-N 3.38Å; V4-Y6 PolarHBondContact O-N 3.23Å; V4-Y6 VanDerWaalsContact O-N 3.1Å | ||
| 5 | Q | 69.8 | Low | 75.8 | Confident | 133 Ų | 133 | 103.2 Ų | 103.2 | 62% | 0.621 | 53% | 0.531 | S | S | * | . | trans | -76.8 | 102.4 | -179.8 | -170 | 160.8 | 27.6 | 0 | 0 | 107.2 | F3 L10 | F3-Q5 PolarHBondContact O-N 3.4Å; Q5-L10 HydrophobicContact CG-CD2 3.85Å | ||
| 6 | Y | 80.4 | Confident | 76.8 | Confident | 164 Ų | 164 | 100.6 Ų | 100.6 | 64% | 0.643 | 51% | 0.514 | S | S | * | . | trans | -50.9 | 125.5 | 178.2 | -70.2 | -79.7 | 0 | 0 | 0 | 110.4 | V4 A8 H9 | V4-Y6 PolarHBondContact O-N 3.23Å; V4-Y6 VanDerWaalsContact O-N 3.1Å; Y6-A8 PolarHBondContact O-N 3.03Å; Y6-H9 PolarHBondContact O-N 3.06Å | ||
| 7 | P | 82.1 | Confident | 77.7 | Confident | 7 Ų | 7 | 98.8 Ų | 98.8 | 5% | 0.045 | 51% | 0.513 | C | S | . | . | G | 310 helix | trans | -62.1 | -19.5 | -172.4 | 21 | -31.6 | 0 | 0 | 0 | 113.3 | H9 L10 L15 V37 H40 L41 | P7-H9 PolarHBondContact O-N 3.48Å; P7-L10 HydrophobicContact CB-CD1 4.39Å; P7-L10 WeakPolarHBondContact O-CB 3.49Å; P7-L10 PolarHBondContact O-N 3.31Å; P7-L15 HydrophobicContact CB-CD2 3.96Å; P7-V37 HydrophobicContact CB-CG1 4.32Å; P7-V37 HydrophobicContact CG-CG1 4.36Å; P7-H40 HydrophobicContact CB-CB 4.36Å; P7-L41 HydrophobicContact CG-CD2 3.45Å; P7-L41 VanDerWaalsContact CG-CD2 3.45Å; P7-L41 HydrophobicContact CG-CG 3.74Å |
| 8 | A | 86.3 | Confident | 78.5 | Confident | 58 Ų | 58 | 94.7 Ų | 94.7 | 48% | 0.479 | 49% | 0.491 | S | S | . | . | G | 310 helix | trans | -58.8 | -31.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y6 K33 | Y6-A8 PolarHBondContact O-N 3.03Å; A8-K33 WeakPolarHBondContact O-CE 3.38Å; A8-K33 PolarHBondContact O-NZ 2.81Å |
| 9 | H | 88.3 | Confident | 79.2 | Confident | 146 Ų | 146 | 89.7 Ų | 89.7 | 68% | 0.676 | 47% | 0.466 | S | S | * | . | G | 310 helix | trans | -83.3 | -15.4 | -179.1 | -66.6 | -98.5 | 0 | 0 | 0 | 112.9 | Y6 P7 | Y6-H9 PolarHBondContact O-N 3.06Å; P7-H9 PolarHBondContact O-N 3.48Å |
| 10 | L | 89 | Confident | 79.9 | Confident | 16 Ų | 16 | 89.4 Ų | 89.4 | 8% | 0.084 | 47% | 0.468 | C | S | . | . | S | Bend | trans | -71.5 | 148.6 | -179.9 | -59.4 | 179.4 | 0 | 0 | 0 | 111.2 | Q5 P7 R14 L15 K33 | Q5-L10 HydrophobicContact CG-CD2 3.85Å; P7-L10 HydrophobicContact CB-CD1 4.39Å; P7-L10 WeakPolarHBondContact O-CB 3.49Å; P7-L10 PolarHBondContact O-N 3.31Å; L10-R14 HydrophobicContact CB-CB 4.36Å; L10-R14 HydrophobicContact CB-CG 4.29Å; L10-R14 HydrophobicContact CD1-CG 4.38Å; L10-R14 HydrophobicContact CD2-CG 4.13Å; L10-L15 HydrophobicContact CB-CD2 4.01Å; L10-L15 HydrophobicContact CB-CG 3.86Å; L10-L15 HydrophobicContact CD1-CD2 4Å; L10-K33 WeakPolarHBondContact O-CE 3.29Å; L10-K33 PolarHBondContact O-NZ 3.48Å |
| 11 | S | 93.3 | Very high | 80.4 | Confident | 60 Ų | 60 | 88.5 Ų | 88.5 | 42% | 0.42 | 47% | 0.473 | S | S | . | . | trans | -69.7 | 155.7 | 173.3 | 69.4 | 0 | 0 | 0 | 0 | 110.7 | S13 R14 L15 | S11-S13 PolarHBondContact O-N 3.29Å; S11-S13 PolarHBondContact OG-OG 3.28Å; S11-S13 VanDerWaalsContact OG-OG 3.1Å; S11-R14 PolarHBondContact O-N 3.19Å; S11-R14 VanDerWaalsContact OG-CB 3.32Å; S11-R14 WeakPolarHBondContact OG-CB 3.47Å; S11-R14 PolarHBondContact OG-N 3.45Å; S11-L15 WeakPolarHBondContact O-CG 3.37Å; S11-L15 PolarHBondContact O-N 3.38Å | ||
| 12 | K | 91.8 | Very high | 82.8 | Confident | 71 Ų | 71 | 80.8 Ų | 80.8 | 31% | 0.309 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -58.9 | -32.6 | 178 | -177.1 | 174.6 | 170.2 | 176.5 | 0 | 112.3 | K16 S31 K33 Y36 | K12-K16 VanDerWaalsContact O-CG 3.26Å; K12-K16 WeakPolarHBondContact O-CG 2.94Å; K12-K16 PolarHBondContact O-N 3.13Å; K12-S31 PolarHBondContact NZ-O 2.98Å; K12-K33 HydrophobicContact CB-CG 4.48Å; K12-Y36 HydrophobicContact CD-CE2 4.33Å; K12-Y36 VanDerWaalsContact CE-CE2 3.42Å; K12-Y36 HydrophobicContact CG-CD2 4.31Å; K12-Y36 HydrophobicContact CG-CE2 4.38Å |
| 13 | S | 92.1 | Very high | 85 | Confident | 87 Ų | 87 | 82.8 Ų | 82.8 | 61% | 0.608 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -71.3 | -39.3 | 174.6 | 51.3 | 0 | 0 | 0 | 0 | 112.3 | S11 K16 S17 | S11-S13 PolarHBondContact O-N 3.29Å; S11-S13 PolarHBondContact OG-OG 3.28Å; S11-S13 VanDerWaalsContact OG-OG 3.1Å; S13-K16 PolarHBondContact O-N 3.07Å; S13-S17 PolarHBondContact O-N 3.3Å |
| 14 | R | 93.3 | Very high | 87.2 | Confident | 135 Ų | 135 | 74.1 Ų | 74.1 | 51% | 0.509 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.7 | -47.4 | 176.6 | -176.6 | 60.3 | -173.7 | -156.1 | -0.6 | 111.6 | L10 S11 K16 S17 D18 | L10-R14 HydrophobicContact CB-CB 4.36Å; L10-R14 HydrophobicContact CB-CG 4.29Å; L10-R14 HydrophobicContact CD1-CG 4.38Å; L10-R14 HydrophobicContact CD2-CG 4.13Å; S11-R14 PolarHBondContact O-N 3.19Å; S11-R14 VanDerWaalsContact OG-CB 3.32Å; S11-R14 WeakPolarHBondContact OG-CB 3.47Å; S11-R14 PolarHBondContact OG-N 3.45Å; R14-K16 VanDerWaalsContact C-N 3.27Å; R14-K16 PolarHBondContact O-N 3.37Å; R14-S17 WeakPolarHBondContact O-CB 3.15Å; R14-S17 PolarHBondContact O-N 3.34Å; R14-S17 VanDerWaalsContact O-N 3.08Å; R14-D18 IonicContact CZ-OD1 3.63Å; R14-D18 IonicContact NE-OD1 3.51Å; R14-D18 PolarHBondContact NE-OD1 3.24Å; R14-D18 VanDerWaalsContact NE-OD1 3.12Å; R14-D18 IonicContact NE-OD2 3.39Å; R14-D18 PolarHBondContact NE-OD2 3.25Å; R14-D18 VanDerWaalsContact NE-OD2 3.09Å; R14-D18 IonicContact NH2-OD1 3.09Å; R14-D18 VanDerWaalsContact O-CG 3.32Å; R14-D18 PolarHBondContact O-N 3.21Å |
| 15 | L | 92.9 | Very high | 88.8 | Confident | 0 Ų | 0 | 76.7 Ų | 76.7 | 0% | 0 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -55.5 | -41.1 | 174.4 | -71.4 | 164.8 | 0 | 0 | 0 | 112.5 | P7 L10 S11 L19 K33 V37 H40 | P7-L15 HydrophobicContact CB-CD2 3.96Å; L10-L15 HydrophobicContact CB-CD2 4.01Å; L10-L15 HydrophobicContact CB-CG 3.86Å; L10-L15 HydrophobicContact CD1-CD2 4Å; S11-L15 WeakPolarHBondContact O-CG 3.37Å; S11-L15 PolarHBondContact O-N 3.38Å; L15-L19 WeakPolarHBondContact O-CB 3.42Å; L15-L19 WeakPolarHBondContact O-CD1 3.49Å; L15-L19 WeakPolarHBondContact O-CG 3.37Å; L15-L19 PolarHBondContact O-N 3.25Å; L15-K33 HydrophobicContact CD1-CG 4.08Å; L15-V37 HydrophobicContact CD1-CG2 3.49Å; L15-V37 VanDerWaalsContact CD1-CG2 3.49Å; L15-V37 HydrophobicContact CD2-CG2 4.38Å; L15-H40 HydrophobicContact CD2-CB 4.05Å |
| 16 | K | 92.1 | Very high | 89.7 | Confident | 62 Ų | 62 | 74.2 Ų | 74.2 | 27% | 0.27 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -64.6 | -45.2 | 175.4 | -76.5 | 175.3 | 175.9 | -164.6 | 0 | 112.6 | K12 S13 R14 D18 L19 V20 L26 Y36 | K12-K16 VanDerWaalsContact O-CG 3.26Å; K12-K16 WeakPolarHBondContact O-CG 2.94Å; K12-K16 PolarHBondContact O-N 3.13Å; S13-K16 PolarHBondContact O-N 3.07Å; R14-K16 VanDerWaalsContact C-N 3.27Å; R14-K16 PolarHBondContact O-N 3.37Å; K16-D18 VanDerWaalsContact C-N 3.32Å; K16-L19 PolarHBondContact O-N 3.04Å; K16-V20 VanDerWaalsContact O-CG2 3.31Å; K16-V20 WeakPolarHBondContact O-CG2 3.23Å; K16-V20 PolarHBondContact O-N 3.34Å; K16-L26 HydrophobicContact CB-CD2 4.28Å; K16-L26 HydrophobicContact CG-CD2 4.22Å; K16-Y36 HydrophobicContact CD-CE1 4.04Å; K16-Y36 WeakPolarHBondContact CE-OH 3.35Å; K16-Y36 HydrophobicContact CG-CD1 3.67Å; K16-Y36 HydrophobicContact CG-CE1 3.45Å; K16-Y36 VanDerWaalsContact CG-CE1 3.45Å |
| 17 | S | 92.4 | Very high | 90.1 | Very high | 69 Ų | 69 | 67.6 Ų | 67.6 | 48% | 0.483 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -60 | -45.7 | 178 | -173.3 | 0 | 0 | 0 | 0 | 110.9 | S13 R14 V20 A21 | S13-S17 PolarHBondContact O-N 3.3Å; R14-S17 WeakPolarHBondContact O-CB 3.15Å; R14-S17 PolarHBondContact O-N 3.34Å; R14-S17 VanDerWaalsContact O-N 3.08Å; S17-V20 PolarHBondContact O-N 3.25Å; S17-A21 WeakPolarHBondContact O-CB 3.4Å; S17-A21 PolarHBondContact O-N 3.2Å |
| 18 | D | 91.3 | Very high | 90.4 | Very high | 25 Ų | 25 | 72.3 Ų | 72.3 | 13% | 0.134 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -67.7 | -43 | -178.2 | -64.1 | -15.8 | 0 | 0 | 0 | 110.3 | R14 K16 V20 A21 H22 | R14-D18 IonicContact CZ-OD1 3.63Å; R14-D18 IonicContact NE-OD1 3.51Å; R14-D18 PolarHBondContact NE-OD1 3.24Å; R14-D18 VanDerWaalsContact NE-OD1 3.12Å; R14-D18 IonicContact NE-OD2 3.39Å; R14-D18 PolarHBondContact NE-OD2 3.25Å; R14-D18 VanDerWaalsContact NE-OD2 3.09Å; R14-D18 IonicContact NH2-OD1 3.09Å; R14-D18 VanDerWaalsContact O-CG 3.32Å; R14-D18 PolarHBondContact O-N 3.21Å; K16-D18 VanDerWaalsContact C-N 3.32Å; D18-V20 VanDerWaalsContact C-N 3.35Å; D18-V20 PolarHBondContact O-N 3.2Å; D18-A21 WeakPolarHBondContact O-CB 3.38Å; D18-A21 PolarHBondContact O-N 2.98Å; D18-A21 VanDerWaalsContact O-N 3.17Å; D18-H22 PolarHBondContact O-CD2 3.13Å; D18-H22 VanDerWaalsContact O-CD2 3.27Å; D18-H22 PolarHBondContact O-N 3.2Å |
| 19 | L | 92.3 | Very high | 90.1 | Very high | 0 Ų | 0 | 73.8 Ų | 73.8 | 0% | 0 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -58.5 | -42.5 | 173.4 | -74.9 | 165.7 | 0 | 0 | 0 | 113 | L15 K16 H22 N23 V24 L26 Y36 L39 H40 | L15-L19 WeakPolarHBondContact O-CB 3.42Å; L15-L19 WeakPolarHBondContact O-CD1 3.49Å; L15-L19 WeakPolarHBondContact O-CG 3.37Å; L15-L19 PolarHBondContact O-N 3.25Å; K16-L19 PolarHBondContact O-N 3.04Å; L19-H22 CarbonylContact O-C 3.58Å; L19-H22 PolarHBondContact O-N 3.01Å; L19-N23 PolarHBondContact O-N 3.27Å; L19-V24 HydrophobicContact CB-CB 4.33Å; L19-V24 HydrophobicContact CD2-CB 3.91Å; L19-V24 HydrophobicContact CD2-CG1 3.89Å; L19-V24 HydrophobicContact CD2-CG2 4.25Å; L19-V24 WeakPolarHBondContact O-CB 3.44Å; L19-V24 PolarHBondContact O-N 2.86Å; L19-L26 HydrophobicContact CB-CD2 3.85Å; L19-L26 HydrophobicContact CD1-CD2 4.16Å; L19-Y36 HydrophobicContact CD1-CD1 3.94Å; L19-L39 HydrophobicContact CD1-CB 4.41Å; L19-L39 HydrophobicContact CD1-CD2 4.08Å; L19-L39 HydrophobicContact CD2-CB 4.11Å; L19-L39 HydrophobicContact CD2-CD2 3.92Å; L19-L39 HydrophobicContact CD2-CG 3.9Å; L19-H40 HydrophobicContact CD2-CB 4.37Å |
| 20 | V | 92.1 | Very high | 90 | Very high | 84 Ų | 84 | 70.5 Ų | 70.5 | 51% | 0.509 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -66.7 | -39.1 | 176.5 | 170.6 | 0 | 0 | 0 | 0 | 111.4 | K16 S17 D18 H22 N23 L26 | K16-V20 VanDerWaalsContact O-CG2 3.31Å; K16-V20 WeakPolarHBondContact O-CG2 3.23Å; K16-V20 PolarHBondContact O-N 3.34Å; S17-V20 PolarHBondContact O-N 3.25Å; D18-V20 VanDerWaalsContact C-N 3.35Å; D18-V20 PolarHBondContact O-N 3.2Å; V20-H22 VanDerWaalsContact C-N 3.26Å; V20-H22 PolarHBondContact O-N 2.81Å; V20-N23 PolarHBondContact O-N 2.7Å; V20-L26 HydrophobicContact CG2-CD1 3.88Å; V20-L26 HydrophobicContact CG2-CD2 4.07Å; V20-L26 HydrophobicContact CG2-CG 4.01Å |
| 21 | A | 90.8 | Very high | 90 | Very high | 71 Ų | 71 | 70.8 Ų | 70.8 | 59% | 0.587 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -63.3 | -34 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | S17 D18 N23 | S17-A21 WeakPolarHBondContact O-CB 3.4Å; S17-A21 PolarHBondContact O-N 3.2Å; D18-A21 WeakPolarHBondContact O-CB 3.38Å; D18-A21 PolarHBondContact O-N 2.98Å; D18-A21 VanDerWaalsContact O-N 3.17Å; A21-N23 PolarHBondContact O-N 3.34Å |
| 22 | H | 86.9 | Confident | 90 | Very high | 74 Ų | 74 | 75.5 Ų | 75.5 | 34% | 0.343 | 44% | 0.436 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.8 | 15.2 | 173.2 | -74.2 | -90.9 | 0 | 0 | 0 | 113.5 | D18 L19 V20 V24 V44 | D18-H22 PolarHBondContact O-CD2 3.13Å; D18-H22 VanDerWaalsContact O-CD2 3.27Å; D18-H22 PolarHBondContact O-N 3.2Å; L19-H22 CarbonylContact O-C 3.58Å; L19-H22 PolarHBondContact O-N 3.01Å; V20-H22 VanDerWaalsContact C-N 3.26Å; V20-H22 PolarHBondContact O-N 2.81Å; H22-V24 HydrophobicContact CB-CG2 4.03Å; H22-V24 WeakPolarHBondContact O-CG2 3.39Å; H22-V24 PolarHBondContact O-N 3.27Å; H22-V44 HydrophobicContact CB-CG2 4.14Å |
| 23 | N | 88.7 | Confident | 90.1 | Very high | 154 Ų | 154 | 76.1 Ų | 76.1 | 82% | 0.824 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.5 | 31.2 | 178.8 | -59.6 | 98.7 | 0 | 0 | 0 | 114.3 | L19 V20 A21 | L19-N23 PolarHBondContact O-N 3.27Å; V20-N23 PolarHBondContact O-N 2.7Å; A21-N23 PolarHBondContact O-N 3.34Å |
| 24 | V | 90.1 | Very high | 90.1 | Very high | 20 Ų | 20 | 78.9 Ų | 78.9 | 12% | 0.121 | 44% | 0.442 | C | S | . | . | P | Polyproline II helix | trans | -95.1 | 132 | 179.4 | -171.2 | 0 | 0 | 0 | 0 | 110.6 | L19 H22 L26 L39 H43 | L19-V24 HydrophobicContact CB-CB 4.33Å; L19-V24 HydrophobicContact CD2-CB 3.91Å; L19-V24 HydrophobicContact CD2-CG1 3.89Å; L19-V24 HydrophobicContact CD2-CG2 4.25Å; L19-V24 WeakPolarHBondContact O-CB 3.44Å; L19-V24 PolarHBondContact O-N 2.86Å; H22-V24 HydrophobicContact CB-CG2 4.03Å; H22-V24 WeakPolarHBondContact O-CG2 3.39Å; H22-V24 PolarHBondContact O-N 3.27Å; V24-L26 PolarHBondContact O-N 3.28Å; V24-L39 HydrophobicContact CG1-CD1 4.39Å; V24-L39 HydrophobicContact CG1-CD2 3.69Å; V24-L39 HydrophobicContact CG1-CG 3.86Å; V24-H43 HydrophobicContact CG1-CB 4.36Å; V24-H43 HydrophobicContact CG2-CB 3.55Å |
| 25 | E | 88.9 | Confident | 90.1 | Very high | 175 Ų | 175 | 74.4 Ų | 74.4 | 82% | 0.818 | 43% | 0.434 | S | S | * | . | P | Polyproline II helix | trans | -62.8 | 133.8 | 177.6 | -68.2 | -174.2 | 174.8 | 0 | 0 | 112.1 | L39 | E25-L39 VanDerWaalsContact O-CD2 3.27Å; E25-L39 WeakPolarHBondContact O-CD2 3.43Å |
| 26 | L | 89.1 | Confident | 90.1 | Very high | 81 Ų | 81 | 74.5 Ų | 74.5 | 42% | 0.424 | 43% | 0.434 | S | S | . | . | P | Polyproline II helix | trans | -76.6 | 137 | -178.5 | -65.8 | -179.2 | 0 | 0 | 0 | 111.3 | K16 L19 V20 V24 Y36 | K16-L26 HydrophobicContact CB-CD2 4.28Å; K16-L26 HydrophobicContact CG-CD2 4.22Å; L19-L26 HydrophobicContact CB-CD2 3.85Å; L19-L26 HydrophobicContact CD1-CD2 4.16Å; V20-L26 HydrophobicContact CG2-CD1 3.88Å; V20-L26 HydrophobicContact CG2-CD2 4.07Å; V20-L26 HydrophobicContact CG2-CG 4.01Å; V24-L26 PolarHBondContact O-N 3.28Å; L26-Y36 HydrophobicContact CD2-CE1 4.43Å |
| 27 | P | 87.9 | Confident | 90.1 | Very high | 25 Ų | 25 | 72.5 Ų | 72.5 | 16% | 0.162 | 43% | 0.427 | C | S | . | . | P | Polyproline II helix | trans | -55.9 | 159.9 | 168 | -24.8 | 34 | 0 | 0 | 0 | 111.9 | A29 S31 Y36 L39 | P27-A29 PolarHBondContact O-N 2.71Å; P27-S31 WeakPolarHBondContact CB-OG 3.32Å; P27-Y36 HydrophobicContact CB-CE1 4.41Å; P27-Y36 HydrophobicContact CG-CD1 4.17Å; P27-Y36 HydrophobicContact CG-CE1 4.16Å; P27-L39 HydrophobicContact CG-CD2 3.89Å |
| 28 | P | 89.1 | Confident | 90.1 | Very high | 106 Ų | 106 | 72 Ų | 72 | 69% | 0.688 | 43% | 0.428 | S | S | * | . | P | Polyproline II helix | trans | -48 | 142.7 | 178.6 | -27.5 | 33.5 | 0 | 0 | 0 | 112.6 | G30 S31 Y36 | P28-G30 PolarHBondContact O-N 3.04Å; P28-S31 VanDerWaalsContact O-CB 3.29Å; P28-S31 WeakPolarHBondContact O-CB 3.41Å; P28-S31 PolarHBondContact O-N 2.94Å; P28-S31 PolarHBondContact O-OG 2.96Å; P28-Y36 PolarHBondContact O-OH 3.23Å |
| 29 | A | 80.7 | Confident | 90.1 | Very high | 88 Ų | 88 | 72.6 Ų | 72.6 | 73% | 0.727 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | -27.5 | -169.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | P27 | P27-A29 PolarHBondContact O-N 2.71Š|
| 30 | G | 84.5 | Confident | 90 | Very high | 77 Ų | 77 | 73.2 Ų | 73.2 | 79% | 0.794 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.4 | 1.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | P28 | P28-G30 PolarHBondContact O-N 3.04Š|
| 31 | S | 89.9 | Confident | 89.9 | Confident | 22 Ų | 22 | 73.2 Ų | 73.2 | 15% | 0.154 | 43% | 0.43 | C | S | . | . | trans | -67.5 | 149 | -177.4 | 53 | 0 | 0 | 0 | 0 | 113.1 | K12 P27 P28 Y36 | K12-S31 PolarHBondContact NZ-O 2.98Å; P27-S31 WeakPolarHBondContact CB-OG 3.32Å; P28-S31 VanDerWaalsContact O-CB 3.29Å; P28-S31 WeakPolarHBondContact O-CB 3.41Å; P28-S31 PolarHBondContact O-N 2.94Å; P28-S31 PolarHBondContact O-OG 2.96Å; S31-Y36 WeakPolarHBondContact OG-CE2 3.49Å; S31-Y36 VanDerWaalsContact OG-CZ 3.24Å; S31-Y36 PolarHBondContact OG-OH 3.39Å; S31-Y36 VanDerWaalsContact OG-OH 3.08Å | ||
| 32 | K | 93.6 | Very high | 89.6 | Confident | 160 Ų | 160 | 77.1 Ų | 77.1 | 70% | 0.696 | 43% | 0.43 | S | S | * | . | trans | -68.2 | 156.2 | 177.8 | -63.5 | 179.9 | -178.8 | 177.3 | 0 | 110.8 | E34 A35 Y36 | K32-E34 PolarHBondContact O-N 3.34Å; K32-A35 WeakPolarHBondContact O-CB 3.42Å; K32-A35 PolarHBondContact O-N 3.13Å; K32-A35 VanDerWaalsContact O-N 3.08Å; K32-Y36 WeakPolarHBondContact O-CD2 3.04Å | ||
| 33 | K | 93 | Very high | 89.4 | Confident | 83 Ų | 83 | 76.4 Ų | 76.4 | 36% | 0.361 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -52.1 | -39 | 179.6 | -179.6 | -175.7 | 166.9 | -177.1 | 0 | 112 | A8 L10 K12 L15 A35 Y36 V37 | A8-K33 WeakPolarHBondContact O-CE 3.38Å; A8-K33 PolarHBondContact O-NZ 2.81Å; L10-K33 WeakPolarHBondContact O-CE 3.29Å; L10-K33 PolarHBondContact O-NZ 3.48Å; K12-K33 HydrophobicContact CB-CG 4.48Å; L15-K33 HydrophobicContact CD1-CG 4.08Å; K33-A35 VanDerWaalsContact C-N 3.27Å; K33-A35 PolarHBondContact O-N 3.26Å; K33-Y36 WeakPolarHBondContact O-CB 3.24Å; K33-Y36 PolarHBondContact O-N 3.07Å; K33-V37 HydrophobicContact CG-CG2 4.27Å; K33-V37 PolarHBondContact O-N 2.85Å; K33-V37 VanDerWaalsContact O-N 3.08Å |
| 34 | E | 91.8 | Very high | 89 | Confident | 146 Ų | 146 | 69.3 Ų | 69.3 | 68% | 0.682 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -54.8 | -37.9 | 178.7 | -67.2 | 164.7 | -164.9 | 0 | 0 | 113.5 | K32 Y36 V37 A38 | K32-E34 PolarHBondContact O-N 3.34Å; E34-Y36 VanDerWaalsContact C-N 3.28Å; E34-Y36 PolarHBondContact O-N 2.84Å; E34-V37 PolarHBondContact O-N 3.2Å; E34-A38 WeakPolarHBondContact O-CB 3.35Å; E34-A38 PolarHBondContact O-N 2.95Å |
| 35 | A | 93.4 | Very high | 88 | Confident | 41 Ų | 41 | 71.5 Ų | 71.5 | 34% | 0.339 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.1 | -34.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | K32 K33 L39 | K32-A35 WeakPolarHBondContact O-CB 3.42Å; K32-A35 PolarHBondContact O-N 3.13Å; K32-A35 VanDerWaalsContact O-N 3.08Å; K33-A35 VanDerWaalsContact C-N 3.27Å; K33-A35 PolarHBondContact O-N 3.26Å; A35-L39 WeakPolarHBondContact O-CB 3.26Å; A35-L39 PolarHBondContact O-N 3.2Å |
| 36 | Y | 93.1 | Very high | 87 | Confident | 1 Ų | 1 | 69 Ų | 69 | 0% | 0.004 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -75.4 | -37.9 | 175.3 | -61.6 | -94.5 | 0 | 0 | 0 | 111.6 | K12 K16 L19 L26 P27 P28 S31 K32 K33 E34 L39 H40 | K12-Y36 HydrophobicContact CD-CE2 4.33Å; K12-Y36 VanDerWaalsContact CE-CE2 3.42Å; K12-Y36 HydrophobicContact CG-CD2 4.31Å; K12-Y36 HydrophobicContact CG-CE2 4.38Å; K16-Y36 HydrophobicContact CD-CE1 4.04Å; K16-Y36 WeakPolarHBondContact CE-OH 3.35Å; K16-Y36 HydrophobicContact CG-CD1 3.67Å; K16-Y36 HydrophobicContact CG-CE1 3.45Å; K16-Y36 VanDerWaalsContact CG-CE1 3.45Å; L19-Y36 HydrophobicContact CD1-CD1 3.94Å; L26-Y36 HydrophobicContact CD2-CE1 4.43Å; P27-Y36 HydrophobicContact CB-CE1 4.41Å; P27-Y36 HydrophobicContact CG-CD1 4.17Å; P27-Y36 HydrophobicContact CG-CE1 4.16Å; P28-Y36 PolarHBondContact O-OH 3.23Å; S31-Y36 WeakPolarHBondContact OG-CE2 3.49Å; S31-Y36 VanDerWaalsContact OG-CZ 3.24Å; S31-Y36 PolarHBondContact OG-OH 3.39Å; S31-Y36 VanDerWaalsContact OG-OH 3.08Å; K32-Y36 WeakPolarHBondContact O-CD2 3.04Å; K33-Y36 WeakPolarHBondContact O-CB 3.24Å; K33-Y36 PolarHBondContact O-N 3.07Å; E34-Y36 VanDerWaalsContact C-N 3.28Å; E34-Y36 PolarHBondContact O-N 2.84Å; Y36-L39 PolarHBondContact O-N 2.81Å; Y36-H40 WeakPolarHBondContact O-CB 3.46Å; Y36-H40 PolarHBondContact O-N 3.13Å |
| 37 | V | 93.6 | Very high | 85.7 | Confident | 20 Ų | 20 | 67.6 Ų | 67.6 | 12% | 0.121 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.2 | -47.7 | 176.1 | 176.6 | 0 | 0 | 0 | 0 | 110.6 | P7 L15 K33 E34 L39 H40 L41 | P7-V37 HydrophobicContact CB-CG1 4.32Å; P7-V37 HydrophobicContact CG-CG1 4.36Å; L15-V37 HydrophobicContact CD1-CG2 3.49Å; L15-V37 VanDerWaalsContact CD1-CG2 3.49Å; L15-V37 HydrophobicContact CD2-CG2 4.38Å; K33-V37 HydrophobicContact CG-CG2 4.27Å; K33-V37 PolarHBondContact O-N 2.85Å; K33-V37 VanDerWaalsContact O-N 3.08Å; E34-V37 PolarHBondContact O-N 3.2Å; V37-L39 VanDerWaalsContact C-N 3.29Å; V37-L39 PolarHBondContact O-N 2.85Å; V37-H40 PolarHBondContact O-N 2.95Å; V37-L41 HydrophobicContact CG1-CD1 4.05Å; V37-L41 HydrophobicContact CG1-CG 4.49Å; V37-L41 WeakPolarHBondContact O-CG 3.29Å; V37-L41 PolarHBondContact O-N 2.7Å |
| 38 | A | 90.8 | Very high | 84.6 | Confident | 60 Ų | 60 | 70.6 Ų | 70.6 | 50% | 0.496 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -60.4 | -40 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | E34 R42 | E34-A38 WeakPolarHBondContact O-CB 3.35Å; E34-A38 PolarHBondContact O-N 2.95Å; A38-R42 WeakPolarHBondContact O-CB 3.2Å; A38-R42 PolarHBondContact O-N 3.17Å; A38-R42 VanDerWaalsContact O-N 3.14Å |
| 39 | L | 91.4 | Very high | 83.2 | Confident | 36 Ų | 36 | 69.2 Ų | 69.2 | 19% | 0.188 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -68.7 | -37.7 | 177.6 | -161.5 | 71.3 | 0 | 0 | 0 | 112.3 | L19 V24 E25 P27 A35 Y36 V37 R42 H43 | L19-L39 HydrophobicContact CD1-CB 4.41Å; L19-L39 HydrophobicContact CD1-CD2 4.08Å; L19-L39 HydrophobicContact CD2-CB 4.11Å; L19-L39 HydrophobicContact CD2-CD2 3.92Å; L19-L39 HydrophobicContact CD2-CG 3.9Å; V24-L39 HydrophobicContact CG1-CD1 4.39Å; V24-L39 HydrophobicContact CG1-CD2 3.69Å; V24-L39 HydrophobicContact CG1-CG 3.86Å; E25-L39 VanDerWaalsContact O-CD2 3.27Å; E25-L39 WeakPolarHBondContact O-CD2 3.43Å; P27-L39 HydrophobicContact CG-CD2 3.89Å; A35-L39 WeakPolarHBondContact O-CB 3.26Å; A35-L39 PolarHBondContact O-N 3.2Å; Y36-L39 PolarHBondContact O-N 2.81Å; V37-L39 VanDerWaalsContact C-N 3.29Å; V37-L39 PolarHBondContact O-N 2.85Å; L39-R42 PolarHBondContact O-N 3.34Å; L39-H43 WeakPolarHBondContact CD1-CE1 3.37Å; L39-H43 PolarHBondContact O-N 2.86Å; L39-H43 PolarHBondContact O-ND1 3.41Å |
| 40 | H | 90.6 | Very high | 82 | Confident | 13 Ų | 13 | 68.1 Ų | 68.1 | 6% | 0.06 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -65.4 | -47.5 | 176.9 | -173.3 | -72.1 | 0 | 0 | 0 | 111.5 | P7 L15 L19 Y36 V37 R42 H43 V44 | P7-H40 HydrophobicContact CB-CB 4.36Å; L15-H40 HydrophobicContact CD2-CB 4.05Å; L19-H40 HydrophobicContact CD2-CB 4.37Å; Y36-H40 WeakPolarHBondContact O-CB 3.46Å; Y36-H40 PolarHBondContact O-N 3.13Å; V37-H40 PolarHBondContact O-N 2.95Å; H40-R42 PolarHBondContact O-N 3.39Å; H40-H43 PolarHBondContact O-N 2.95Å; H40-V44 WeakPolarHBondContact O-CB 3.45Å; H40-V44 PolarHBondContact O-N 2.73Å |
| 41 | L | 89.6 | Confident | 80.6 | Confident | 84 Ų | 84 | 70.5 Ų | 70.5 | 44% | 0.44 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -56.3 | -39.2 | 174.4 | -71.3 | 165 | 0 | 0 | 0 | 111.4 | P7 V37 D45 | P7-L41 HydrophobicContact CG-CD2 3.45Å; P7-L41 VanDerWaalsContact CG-CD2 3.45Å; P7-L41 HydrophobicContact CG-CG 3.74Å; V37-L41 HydrophobicContact CG1-CD1 4.05Å; V37-L41 HydrophobicContact CG1-CG 4.49Å; V37-L41 WeakPolarHBondContact O-CG 3.29Å; V37-L41 PolarHBondContact O-N 2.7Å; L41-D45 VanDerWaalsContact CD2-OD2 3.29Å; L41-D45 WeakPolarHBondContact CD2-OD2 3.44Å |
| 42 | R | 86 | Confident | 78.7 | Confident | 154 Ų | 154 | 78.6 Ų | 78.6 | 58% | 0.581 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -72.1 | -38.4 | -179.2 | -176.1 | 176.6 | 175.4 | -167.7 | -0.6 | 113.5 | A38 L39 H40 Q46 | A38-R42 WeakPolarHBondContact O-CB 3.2Å; A38-R42 PolarHBondContact O-N 3.17Å; A38-R42 VanDerWaalsContact O-N 3.14Å; L39-R42 PolarHBondContact O-N 3.34Å; H40-R42 PolarHBondContact O-N 3.39Å; R42-Q46 VanDerWaalsContact O-CB 3.31Å; R42-Q46 WeakPolarHBondContact O-CB 3.44Å; R42-Q46 WeakPolarHBondContact O-CG 3.44Å; R42-Q46 PolarHBondContact O-NE2 3.26Å; R42-Q46 PolarHBondContact O-OE1 3.45Å |
| 43 | H | 82.1 | Confident | 76.5 | Confident | 58 Ų | 58 | 75.9 Ų | 75.9 | 27% | 0.269 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -107.7 | -38.6 | -170 | -61.6 | 85 | 0 | 0 | 0 | 113 | V24 L39 H40 T47 | V24-H43 HydrophobicContact CG1-CB 4.36Å; V24-H43 HydrophobicContact CG2-CB 3.55Å; L39-H43 WeakPolarHBondContact CD1-CE1 3.37Å; L39-H43 PolarHBondContact O-N 2.86Å; L39-H43 PolarHBondContact O-ND1 3.41Å; H40-H43 PolarHBondContact O-N 2.95Å; H43-T47 VanDerWaalsContact O-CB 3.26Å; H43-T47 WeakPolarHBondContact O-CB 3.49Å; H43-T47 WeakPolarHBondContact O-CG2 3.31Å; H43-T47 PolarHBondContact O-N 3.09Å; H43-T47 VanDerWaalsContact O-N 3.11Å; H43-T47 PolarHBondContact O-OG1 3.25Å |
| 44 | V | 79.6 | Confident | 74.6 | Confident | 5 Ų | 5 | 77.1 Ų | 77.1 | 3% | 0.03 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -80.3 | -45.5 | -176.6 | -179.4 | 0 | 0 | 0 | 0 | 110.7 | H22 H40 Q46 T47 N48 | H22-V44 HydrophobicContact CB-CG2 4.14Å; H40-V44 WeakPolarHBondContact O-CB 3.45Å; H40-V44 PolarHBondContact O-N 2.73Å; V44-Q46 PolarHBondContact O-N 3.19Å; V44-T47 WeakPolarHBondContact CA-OG1 3.27Å; V44-T47 PolarHBondContact O-N 3.14Å; V44-T47 PolarHBondContact O-OG1 2.98Å; V44-T47 VanDerWaalsContact O-OG1 3.04Å; V44-N48 VanDerWaalsContact O-CB 3.31Å; V44-N48 WeakPolarHBondContact O-CB 3.4Å; V44-N48 PolarHBondContact O-N 2.88Å; V44-N48 PolarHBondContact O-ND2 3.2Å |
| 45 | D | 69.6 | Low | 72.7 | Confident | 67 Ų | 67 | 77.2 Ų | 77.2 | 36% | 0.358 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -72.6 | -32.4 | -179.4 | -59.9 | -25.2 | 0 | 0 | 0 | 112 | L41 A49 | L41-D45 VanDerWaalsContact CD2-OD2 3.29Å; L41-D45 WeakPolarHBondContact CD2-OD2 3.44Å; D45-A49 WeakPolarHBondContact O-CB 3.47Å; D45-A49 PolarHBondContact O-N 2.62Å |
| 46 | Q | 66.9 | Low | 70.6 | Confident | 122 Ų | 122 | 82.1 Ų | 82.1 | 57% | 0.57 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -69.3 | -41.5 | 172.7 | -68 | -179.1 | 12.8 | 0 | 0 | 112.2 | R42 V44 A49 A50 | R42-Q46 VanDerWaalsContact O-CB 3.31Å; R42-Q46 WeakPolarHBondContact O-CB 3.44Å; R42-Q46 WeakPolarHBondContact O-CG 3.44Å; R42-Q46 PolarHBondContact O-NE2 3.26Å; R42-Q46 PolarHBondContact O-OE1 3.45Å; V44-Q46 PolarHBondContact O-N 3.19Å; Q46-A49 PolarHBondContact O-N 3.15Å; Q46-A50 WeakPolarHBondContact O-CB 3.45Å; Q46-A50 PolarHBondContact O-N 3.38Å |
| 47 | T | 62.6 | Low | 68.3 | Low | 52 Ų | 52 | 88.4 Ų | 88.4 | 32% | 0.319 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -69.8 | -33.2 | 176.1 | 53.4 | 0 | 0 | 0 | 0 | 112 | H43 V44 A50 N51 | H43-T47 VanDerWaalsContact O-CB 3.26Å; H43-T47 WeakPolarHBondContact O-CB 3.49Å; H43-T47 WeakPolarHBondContact O-CG2 3.31Å; H43-T47 PolarHBondContact O-N 3.09Å; H43-T47 VanDerWaalsContact O-N 3.11Å; H43-T47 PolarHBondContact O-OG1 3.25Å; V44-T47 WeakPolarHBondContact CA-OG1 3.27Å; V44-T47 PolarHBondContact O-N 3.14Å; V44-T47 PolarHBondContact O-OG1 2.98Å; V44-T47 VanDerWaalsContact O-OG1 3.04Å; T47-A50 PolarHBondContact O-N 3.4Å; T47-N51 VanDerWaalsContact O-CB 3.29Å; T47-N51 WeakPolarHBondContact O-CB 3.39Å; T47-N51 PolarHBondContact O-N 3.43Å; T47-N51 PolarHBondContact O-ND2 3.14Å |
| 48 | N | 65.1 | Low | 66.2 | Low | 88 Ų | 88 | 94.3 Ų | 94.3 | 47% | 0.471 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -70.2 | -34.3 | 173.8 | -69.6 | -21.5 | 0 | 0 | 0 | 112.4 | V44 | V44-N48 VanDerWaalsContact O-CB 3.31Å; V44-N48 WeakPolarHBondContact O-CB 3.4Å; V44-N48 PolarHBondContact O-N 2.88Å; V44-N48 PolarHBondContact O-ND2 3.2Å |
| 49 | A | 59.5 | Low | 63.9 | Low | 77 Ų | 77 | 100 Ų | 100 | 64% | 0.636 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -74.1 | -34 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | D45 Q46 | D45-A49 WeakPolarHBondContact O-CB 3.47Å; D45-A49 PolarHBondContact O-N 2.62Å; Q46-A49 PolarHBondContact O-N 3.15Å |
| 50 | A | 56.1 | Low | 61.7 | Low | 65 Ų | 65 | 106.5 Ų | 106.5 | 54% | 0.537 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -84 | -23 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | Q46 T47 F52 S53 | Q46-A50 WeakPolarHBondContact O-CB 3.45Å; Q46-A50 PolarHBondContact O-N 3.38Å; T47-A50 PolarHBondContact O-N 3.4Å; A50-F52 PolarHBondContact O-N 3.21Å; A50-S53 PolarHBondContact O-N 2.83Å |
| 51 | N | 55.3 | Low | 59.3 | Low | 126 Ų | 126 | 113.3 Ų | 113.3 | 67% | 0.674 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.4 | 11.5 | 178.4 | -81.8 | -55 | 0 | 0 | 0 | 114.5 | T47 | T47-N51 VanDerWaalsContact O-CB 3.29Å; T47-N51 WeakPolarHBondContact O-CB 3.39Å; T47-N51 PolarHBondContact O-N 3.43Å; T47-N51 PolarHBondContact O-ND2 3.14Å |
| 52 | F | 48.3 | Very low | 57.6 | Low | 192 Ų | 192 | 115.3 Ų | 115.3 | 84% | 0.842 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133.6 | 20.1 | 170.1 | -82.1 | -80.5 | 0 | 0 | 0 | 113.2 | A50 S54 | A50-F52 PolarHBondContact O-N 3.21Å; F52-S54 VanDerWaalsContact C-N 3.3Å; F52-S54 PolarHBondContact O-N 2.87Å |
| 53 | S | 48.9 | Very low | 55.4 | Low | 104 Ų | 104 | 114.9 Ų | 114.9 | 73% | 0.727 | 64% | 0.636 | S | S | * | * | trans | -88.8 | 78.5 | 162 | -169.7 | 0 | 0 | 0 | 0 | 108 | A50 D55 | A50-S53 PolarHBondContact O-N 2.83Å; S53-D55 PolarHBondContact O-N 3.04Å | ||
| 54 | S | 52.1 | Low | 53.6 | Low | 108 Ų | 108 | 116.5 Ų | 116.5 | 76% | 0.755 | 66% | 0.66 | S | S | * | * | trans | -65.3 | 113.1 | 172.1 | -160.9 | 0 | 0 | 0 | 0 | 108.7 | F52 | F52-S54 VanDerWaalsContact C-N 3.3Å; F52-S54 PolarHBondContact O-N 2.87Å | ||
| 55 | D | 53.2 | Low | 51.8 | Low | 148 Ų | 148 | 120.3 Ų | 120.3 | 79% | 0.791 | 70% | 0.7 | S | S | * | * | trans | -76.9 | 101.7 | 166.6 | -177.2 | 52.5 | 0 | 0 | 0 | 107.6 | S53 | S53-D55 PolarHBondContact O-N 3.04Š| ||
| 56 | D | 47.8 | Very low | 50 | Low | 145 Ų | 145 | 120.9 Ų | 120.9 | 78% | 0.775 | 72% | 0.722 | S | S | * | * | trans | -155.6 | 126.2 | 159.9 | -105.1 | -60.7 | 0 | 0 | 0 | 107 | ||||
| 57 | D | 46 | Very low | 48.7 | Very low | 132 Ų | 132 | 122.6 Ų | 122.6 | 71% | 0.706 | 74% | 0.735 | S | S | * | * | trans | -60.9 | 143.3 | -158.6 | -61.1 | -96.1 | 0 | 0 | 0 | 117.5 | ||||
| 58 | D | 49.8 | Very low | 48.3 | Very low | 145 Ų | 145 | 125.6 Ų | 125.6 | 78% | 0.775 | 76% | 0.755 | S | S | * | * | trans | 26.2 | 106.3 | 133.6 | -55.2 | -36.2 | 0 | 0 | 0 | 119.5 | ||||
| 59 | Q | 42.2 | Very low | 47 | Very low | 180 Ų | 180 | 130.4 Ų | 130.4 | 84% | 0.841 | 78% | 0.775 | S | S | * | * | -144.8 | 94.5 | 129.1 | -167.7 | 121.2 | 63.9 | 0 | 0 | 108.9 | D61 | Q59-D61 PolarHBondContact O-N 2.94Š| |||
| 60 | E | 44.6 | Very low | 46.1 | Very low | 171 Ų | 171 | 131.4 Ų | 131.4 | 80% | 0.799 | 78% | 0.777 | S | S | * | * | trans | -56.9 | 116.3 | 156.3 | 46.7 | -175.3 | -179.1 | 0 | 0 | 109.3 | ||||
| 61 | D | 39.4 | Very low | 45.9 | Very low | 157 Ų | 157 | 133.4 Ų | 133.4 | 84% | 0.84 | 79% | 0.794 | S | S | * | * | trans | -133.4 | 130.1 | 149.7 | -116.9 | -26.2 | 0 | 0 | 0 | 109.5 | Q59 | Q59-D61 PolarHBondContact O-N 2.94Š| ||
| 62 | V | 54 | Low | 45.6 | Very low | 126 Ų | 126 | 135.4 Ų | 135.4 | 76% | 0.764 | 80% | 0.799 | S | S | * | * | trans | -93.2 | 103.6 | -158.8 | -175.8 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 63 | V | 40.2 | Very low | 46.1 | Very low | 144 Ų | 144 | 135.5 Ų | 135.5 | 87% | 0.873 | 80% | 0.802 | S | S | * | * | trans | -145.9 | 134.4 | 157.2 | -169.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 64 | A | 43.5 | Very low | 46.8 | Very low | 93 Ų | 93 | 135.4 Ų | 135.4 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | trans | -57 | 151.8 | -176.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 65 | G | 42.3 | Very low | 47.6 | Very low | 85 Ų | 85 | 134.7 Ų | 134.7 | 88% | 0.876 | 78% | 0.781 | S | S | * | * | trans | 37.8 | 119.8 | 136.5 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 66 | G | 32.4 | Very low | 48.4 | Very low | 79 Ų | 79 | 128.1 Ų | 128.1 | 81% | 0.814 | 75% | 0.746 | S | S | * | * | trans | -177.8 | 99.7 | 159.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 67 | D | 39.8 | Very low | 49.7 | Very low | 158 Ų | 158 | 123.7 Ų | 123.7 | 85% | 0.845 | 73% | 0.726 | S | S | * | * | trans | -67.9 | 166.5 | 160.1 | -125.1 | -7.9 | 0 | 0 | 0 | 109.4 | E69 | D67-E69 PolarHBondContact O-N 3.31Š| ||
| 68 | P | 53 | Low | 51.4 | Low | 115 Ų | 115 | 121.6 Ų | 121.6 | 75% | 0.747 | 73% | 0.727 | S | S | * | * | trans | -82 | 115.5 | -145.3 | 32.2 | -38 | 0 | 0 | 0 | 114.5 | ||||
| 69 | E | 38.9 | Very low | 53 | Low | 188 Ų | 188 | 115.6 Ų | 115.6 | 88% | 0.879 | 70% | 0.695 | S | S | * | * | trans | -101.6 | 109.2 | 161.5 | -66.4 | -168.7 | 156.8 | 0 | 0 | 107.7 | D67 | D67-E69 PolarHBondContact O-N 3.31Š| ||
| 70 | S | 39.9 | Very low | 55.4 | Low | 99 Ų | 99 | 110.3 Ų | 110.3 | 69% | 0.692 | 68% | 0.675 | S | S | * | * | 64.6 | 91.6 | 91 | -180 | 0 | 0 | 0 | 0 | 112 | E72 | S70-E72 PolarHBondContact O-N 3.42Š| |||
| 71 | A | 51.5 | Low | 57.8 | Low | 107 Ų | 107 | 104.7 Ų | 104.7 | 88% | 0.884 | 65% | 0.651 | S | S | * | * | trans | 43.7 | 43.3 | 146.6 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 72 | E | 50.4 | Low | 60.3 | Low | 167 Ų | 167 | 103.2 Ų | 103.2 | 78% | 0.78 | 64% | 0.643 | S | S | * | * | trans | -89.3 | 132 | 163.7 | -76.8 | -156.3 | 154.5 | 0 | 0 | 111.3 | S70 L74 | S70-E72 PolarHBondContact O-N 3.42Å; E72-L74 PolarHBondContact O-N 3.19Å | ||
| 73 | E | 58.8 | Low | 62.1 | Low | 194 Ų | 194 | 100.8 Ų | 100.8 | 91% | 0.907 | 63% | 0.626 | S | S | * | * | trans | -60.8 | 73.9 | 177.4 | -163.7 | -176.8 | 178.7 | 0 | 0 | 110.9 | D75 | E73-D75 PolarHBondContact O-N 2.94Š| ||
| 74 | L | 63 | Low | 64.6 | Low | 102 Ų | 102 | 94 Ų | 94 | 53% | 0.534 | 58% | 0.584 | S | S | . | * | trans | -68.8 | 112.6 | 176.6 | -72.4 | 159.8 | 0 | 0 | 0 | 109 | E72 P76 | E72-L74 PolarHBondContact O-N 3.19Å; L74-P76 VanDerWaalsContact O-CD 3.24Å; L74-P76 WeakPolarHBondContact O-CD 3.37Å | ||
| 75 | D | 68.3 | Low | 67 | Low | 94 Ų | 94 | 93.8 Ų | 93.8 | 50% | 0.503 | 57% | 0.566 | S | S | . | * | trans | -54.7 | 116.5 | 171.3 | 175.6 | 14.8 | 0 | 0 | 0 | 108.4 | E73 S77 A78 R111 | E73-D75 PolarHBondContact O-N 2.94Å; D75-S77 PolarHBondContact O-N 3.06Å; D75-S77 PolarHBondContact OD1-N 3.11Å; D75-S77 PolarHBondContact OD1-OG 3.02Å; D75-S77 VanDerWaalsContact OD1-OG 3.13Å; D75-A78 PolarHBondContact O-N 3.44Å; D75-R111 IonicContact OD1-NH2 3.94Å; D75-R111 PolarHBondContact OD1-NH2 3.24Å | ||
| 76 | P | 70.1 | Confident | 69.4 | Low | 10 Ų | 10 | 92.6 Ų | 92.6 | 7% | 0.065 | 55% | 0.548 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.2 | -11.4 | -170.8 | 17.5 | -25.2 | 0 | 0 | 0 | 113.5 | L74 E107 L110 R111 | L74-P76 VanDerWaalsContact O-CD 3.24Å; L74-P76 WeakPolarHBondContact O-CD 3.37Å; P76-E107 HydrophobicContact CB-CB 4.2Å; P76-E107 HydrophobicContact CB-CG 4.48Å; P76-E107 WeakPolarHBondContact O-CG 3.04Å; P76-L110 HydrophobicContact CB-CD2 4.31Å; P76-R111 HydrophobicContact CB-CG 4.47Å; P76-R111 HydrophobicContact CG-CG 3.32Å |
| 77 | S | 76.2 | Confident | 72.3 | Confident | 52 Ų | 52 | 90.6 Ų | 90.6 | 36% | 0.364 | 52% | 0.519 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.1 | -29.2 | 175.5 | -37.5 | 0 | 0 | 0 | 0 | 113.4 | D75 L79 R103 R111 | D75-S77 PolarHBondContact O-N 3.06Å; D75-S77 PolarHBondContact OD1-N 3.11Å; D75-S77 PolarHBondContact OD1-OG 3.02Å; D75-S77 VanDerWaalsContact OD1-OG 3.13Å; S77-L79 VanDerWaalsContact C-N 3.28Å; S77-R103 PolarHBondContact O-NH2 3.11Å; S77-R111 PolarHBondContact OG-NH2 3.32Å |
| 78 | A | 81.5 | Confident | 74.9 | Confident | 88 Ų | 88 | 83.1 Ų | 83.1 | 73% | 0.727 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.8 | -12.1 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113 | D75 | D75-A78 PolarHBondContact O-N 3.44Š|
| 79 | L | 83.8 | Confident | 76.8 | Confident | 19 Ų | 19 | 84 Ų | 84 | 10% | 0.099 | 47% | 0.471 | C | S | . | . | S | Bend | trans | -78.3 | 142.4 | -172 | -165.2 | 61.5 | 0 | 0 | 0 | 112.1 | S77 D83 L84 L87 R103 L110 | S77-L79 VanDerWaalsContact C-N 3.28Å; L79-D83 HydrophobicContact CD1-CB 3.28Å; L79-D83 HydrophobicContact CD2-CB 4.33Å; L79-D83 HydrophobicContact CG-CB 3.62Å; L79-L84 HydrophobicContact CD2-CB 3.84Å; L79-L84 HydrophobicContact CD2-CD1 4.08Å; L79-L84 HydrophobicContact CG-CB 4.22Å; L79-L87 HydrophobicContact CD1-CD1 3.98Å; L79-L87 HydrophobicContact CD2-CD1 3.32Å; L79-L87 HydrophobicContact CG-CD1 4.27Å; L79-R103 PolarHBondContact O-NH2 3.16Å; L79-L110 HydrophobicContact CD2-CD2 4.12Å |
| 80 | T | 91.4 | Very high | 79.4 | Confident | 69 Ų | 69 | 83 Ų | 83 | 42% | 0.423 | 46% | 0.463 | S | S | . | . | trans | -72.4 | 159.2 | 174.6 | 78.7 | 0 | 0 | 0 | 0 | 111.1 | N82 D83 L84 | T80-N82 PolarHBondContact O-N 3.41Å; T80-D83 PolarHBondContact O-N 3.02Å; T80-D83 VanDerWaalsContact O-N 3.14Å; T80-D83 PolarHBondContact OG1-N 3.4Å; T80-D83 PolarHBondContact OG1-OD2 2.82Å; T80-L84 WeakPolarHBondContact O-CB 3.48Å; T80-L84 PolarHBondContact O-N 3.22Å | ||
| 81 | D | 94.4 | Very high | 82 | Confident | 52 Ų | 52 | 82.4 Ų | 82.4 | 28% | 0.278 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -59.5 | -33.1 | -178.2 | -71 | -7.8 | 0 | 0 | 0 | 112.5 | K85 I98 R103 | D81-K85 WeakPolarHBondContact O-CB 3.11Å; D81-K85 PolarHBondContact O-N 3.48Å; D81-I98 HydrophobicContact CB-CB 4.12Å; D81-I98 HydrophobicContact CB-CG2 4.15Å; D81-I98 WeakPolarHBondContact O-CD1 3.31Å; D81-R103 VanDerWaalsContact OD1-CD 3.23Å; D81-R103 WeakPolarHBondContact OD1-CD 3.45Å; D81-R103 IonicContact OD1-CZ 2.84Å; D81-R103 IonicContact OD1-NE 3.12Å; D81-R103 IonicContact OD1-NH1 3.01Å; D81-R103 PolarHBondContact OD1-NH1 3Å |
| 82 | N | 92.1 | Very high | 84 | Confident | 126 Ų | 126 | 80.2 Ų | 80.2 | 67% | 0.674 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -73.1 | -42.6 | 177.1 | -69 | -49.9 | 0 | 0 | 0 | 111.5 | T80 K85 A86 | T80-N82 PolarHBondContact O-N 3.41Å; N82-K85 WeakPolarHBondContact O-CB 3.49Å; N82-K85 PolarHBondContact O-N 3.38Å; N82-A86 PolarHBondContact O-N 3.34Å |
| 83 | D | 92.3 | Very high | 86 | Confident | 76 Ų | 76 | 73.1 Ų | 73.1 | 41% | 0.406 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -69.5 | -37.8 | 179.8 | -55.1 | -32.3 | 0 | 0 | 0 | 110.9 | L79 T80 K85 A86 L87 | L79-D83 HydrophobicContact CD1-CB 3.28Å; L79-D83 HydrophobicContact CD2-CB 4.33Å; L79-D83 HydrophobicContact CG-CB 3.62Å; T80-D83 PolarHBondContact O-N 3.02Å; T80-D83 VanDerWaalsContact O-N 3.14Å; T80-D83 PolarHBondContact OG1-N 3.4Å; T80-D83 PolarHBondContact OG1-OD2 2.82Å; D83-K85 VanDerWaalsContact C-N 3.29Å; D83-K85 PolarHBondContact O-N 3.04Å; D83-A86 PolarHBondContact O-N 3.2Å; D83-A86 VanDerWaalsContact O-N 3.17Å; D83-L87 WeakPolarHBondContact O-CB 3.31Å; D83-L87 PolarHBondContact O-N 3.11Å |
| 84 | L | 93.3 | Very high | 87.6 | Confident | 0 Ų | 0 | 72.5 Ų | 72.5 | 0% | 0 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -59.2 | -42.1 | 172.9 | -179.6 | 62.6 | 0 | 0 | 0 | 111.2 | L79 T80 L88 I98 R103 E107 L110 | L79-L84 HydrophobicContact CD2-CB 3.84Å; L79-L84 HydrophobicContact CD2-CD1 4.08Å; L79-L84 HydrophobicContact CG-CB 4.22Å; T80-L84 WeakPolarHBondContact O-CB 3.48Å; T80-L84 PolarHBondContact O-N 3.22Å; L84-L88 HydrophobicContact CD1-CD1 4.35Å; L84-L88 HydrophobicContact CG-CD1 4.24Å; L84-L88 WeakPolarHBondContact O-CB 3.43Å; L84-L88 WeakPolarHBondContact O-CD1 3.49Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.45Å; L84-L88 PolarHBondContact O-N 2.87Å; L84-I98 HydrophobicContact CB-CD1 4.09Å; L84-I98 HydrophobicContact CD2-CD1 3.89Å; L84-I98 HydrophobicContact CD2-CG2 4.49Å; L84-I98 HydrophobicContact CG-CD1 3.89Å; L84-R103 HydrophobicContact CD2-CG 4.06Å; L84-E107 HydrophobicContact CD1-CG 4.24Å; L84-E107 HydrophobicContact CD2-CG 3.71Å; L84-L110 HydrophobicContact CD1-CB 4.2Å; L84-L110 HydrophobicContact CD1-CD2 3.72Å |
| 85 | K | 93.6 | Very high | 88.9 | Confident | 89 Ų | 89 | 68.3 Ų | 68.3 | 39% | 0.387 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -66.9 | -41.4 | 175 | -175 | -179.5 | 177.5 | -173.2 | 0 | 112.1 | D81 N82 D83 F89 A95 I98 | D81-K85 WeakPolarHBondContact O-CB 3.11Å; D81-K85 PolarHBondContact O-N 3.48Å; N82-K85 WeakPolarHBondContact O-CB 3.49Å; N82-K85 PolarHBondContact O-N 3.38Å; D83-K85 VanDerWaalsContact C-N 3.29Å; D83-K85 PolarHBondContact O-N 3.04Å; K85-F89 WeakPolarHBondContact O-CB 3.26Å; K85-F89 PolarHBondContact O-N 3.14Å; K85-A95 WeakPolarHBondContact CE-O 3.33Å; K85-A95 HydrophobicContact CG-CB 4.39Å; K85-I98 HydrophobicContact CB-CD1 3.83Å; K85-I98 HydrophobicContact CB-CG1 4.32Å |
| 86 | A | 93.1 | Very high | 89.9 | Confident | 60 Ų | 60 | 65.3 Ų | 65.3 | 50% | 0.496 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -65.3 | -44.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | N82 D83 F89 K90 | N82-A86 PolarHBondContact O-N 3.34Å; D83-A86 PolarHBondContact O-N 3.2Å; D83-A86 VanDerWaalsContact O-N 3.17Å; A86-F89 WeakPolarHBondContact O-CB 3.37Å; A86-F89 PolarHBondContact O-N 2.88Å; A86-K90 PolarHBondContact O-N 3.17Å |
| 87 | L | 93.2 | Very high | 91 | Very high | 38 Ų | 38 | 69.9 Ų | 69.9 | 20% | 0.199 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62.3 | -48.5 | 174.9 | -87.1 | 152.6 | 0 | 0 | 0 | 111.3 | L79 D83 F89 K90 Y91 L110 | L79-L87 HydrophobicContact CD1-CD1 3.98Å; L79-L87 HydrophobicContact CD2-CD1 3.32Å; L79-L87 HydrophobicContact CG-CD1 4.27Å; D83-L87 WeakPolarHBondContact O-CB 3.31Å; D83-L87 PolarHBondContact O-N 3.11Å; L87-F89 PolarHBondContact O-N 3.18Å; L87-K90 WeakPolarHBondContact O-CA 3.33Å; L87-K90 VanDerWaalsContact O-CB 3.27Å; L87-K90 WeakPolarHBondContact O-CB 3.34Å; L87-K90 PolarHBondContact O-N 2.91Å; L87-Y91 HydrophobicContact CD2-CE2 4.21Å; L87-Y91 WeakPolarHBondContact O-CD2 3.37Å; L87-Y91 PolarHBondContact O-N 3.4Å; L87-Y91 VanDerWaalsContact O-N 3.14Å; L87-L110 HydrophobicContact CB-CD1 4.15Å; L87-L110 HydrophobicContact CB-CD2 3.94Å; L87-L110 HydrophobicContact CD1-CD2 4.38Å |
| 88 | L | 93.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 68.5 Ų | 68.5 | 0% | 0 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -57.2 | -40.2 | 174.5 | -77.2 | 167.9 | 0 | 0 | 0 | 112.4 | L84 K90 Y91 G92 V93 A95 Y106 K109 L110 L113 | L84-L88 HydrophobicContact CD1-CD1 4.35Å; L84-L88 HydrophobicContact CG-CD1 4.24Å; L84-L88 WeakPolarHBondContact O-CB 3.43Å; L84-L88 WeakPolarHBondContact O-CD1 3.49Å; L84-L88 VanDerWaalsContact O-CG 3.26Å; L84-L88 WeakPolarHBondContact O-CG 3.45Å; L84-L88 PolarHBondContact O-N 2.87Å; L88-K90 VanDerWaalsContact C-N 3.34Å; L88-K90 PolarHBondContact O-N 3.27Å; L88-Y91 CarbonylContact O-C 3.25Å; L88-Y91 PolarHBondContact O-N 2.87Å; L88-G92 PolarHBondContact O-N 3.03Å; L88-V93 CarbonylContact C-O 3.54Å; L88-V93 VanDerWaalsContact C-O 3.25Å; L88-V93 HydrophobicContact CB-CB 4.17Å; L88-V93 HydrophobicContact CB-CG1 4.38Å; L88-V93 HydrophobicContact CD2-CB 4.17Å; L88-V93 HydrophobicContact CD2-CG1 4.17Å; L88-V93 WeakPolarHBondContact O-CA 3.35Å; L88-V93 WeakPolarHBondContact O-CB 3.5Å; L88-V93 PolarHBondContact O-N 2.93Å; L88-A95 HydrophobicContact CD1-CB 4.2Å; L88-Y106 HydrophobicContact CD1-CD1 3.54Å; L88-Y106 HydrophobicContact CD1-CG 3.86Å; L88-K109 HydrophobicContact CD2-CB 4.31Å; L88-K109 HydrophobicContact CD2-CG 4.26Å; L88-L110 HydrophobicContact CD2-CB 4.04Å; L88-L110 HydrophobicContact CD2-CD1 4.41Å; L88-L110 HydrophobicContact CG-CB 4.44Å; L88-L113 HydrophobicContact CD2-CD1 3.95Å |
| 89 | F | 94 | Very high | 92.5 | Very high | 135 Ų | 135 | 69.4 Ų | 69.4 | 59% | 0.592 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -64.5 | -37.6 | 176.2 | -171.3 | -95.2 | 0 | 0 | 0 | 112.3 | K85 A86 L87 Y91 G92 V93 K94 | K85-F89 WeakPolarHBondContact O-CB 3.26Å; K85-F89 PolarHBondContact O-N 3.14Å; A86-F89 WeakPolarHBondContact O-CB 3.37Å; A86-F89 PolarHBondContact O-N 2.88Å; L87-F89 PolarHBondContact O-N 3.18Å; F89-Y91 VanDerWaalsContact C-N 3.3Å; F89-Y91 PolarHBondContact O-N 3.25Å; F89-G92 WeakPolarHBondContact O-CA 3.27Å; F89-G92 PolarHBondContact O-N 3.01Å; F89-V93 WeakPolarHBondContact CA-O 3.36Å; F89-V93 PolarHBondContact N-O 2.79Å; F89-K94 HydrophobicContact CD2-CG 4.42Å; F89-K94 HydrophobicContact CE2-CG 4.34Å |
| 90 | K | 93.6 | Very high | 92.9 | Very high | 165 Ų | 165 | 73 Ų | 73 | 72% | 0.717 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -59.3 | -39.6 | 174.3 | -171.1 | -177.4 | 178.2 | -175 | 0 | 111.9 | A86 L87 L88 G92 | A86-K90 PolarHBondContact O-N 3.17Å; L87-K90 WeakPolarHBondContact O-CA 3.33Å; L87-K90 VanDerWaalsContact O-CB 3.27Å; L87-K90 WeakPolarHBondContact O-CB 3.34Å; L87-K90 PolarHBondContact O-N 2.91Å; L88-K90 VanDerWaalsContact C-N 3.34Å; L88-K90 PolarHBondContact O-N 3.27Å; K90-G92 PolarHBondContact O-N 2.84Å |
| 91 | Y | 92.9 | Very high | 92.9 | Very high | 88 Ų | 88 | 74.5 Ų | 74.5 | 35% | 0.345 | 42% | 0.424 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.3 | 14.9 | 173.8 | -64.9 | -80.4 | 0 | 0 | 0 | 113.5 | L87 L88 F89 V93 L110 L113 L114 | L87-Y91 HydrophobicContact CD2-CE2 4.21Å; L87-Y91 WeakPolarHBondContact O-CD2 3.37Å; L87-Y91 PolarHBondContact O-N 3.4Å; L87-Y91 VanDerWaalsContact O-N 3.14Å; L88-Y91 CarbonylContact O-C 3.25Å; L88-Y91 PolarHBondContact O-N 2.87Å; F89-Y91 VanDerWaalsContact C-N 3.3Å; F89-Y91 PolarHBondContact O-N 3.25Å; Y91-V93 VanDerWaalsContact C-N 3.31Å; Y91-V93 PolarHBondContact O-N 2.91Å; Y91-L110 HydrophobicContact CD2-CD1 3.75Å; Y91-L110 HydrophobicContact CE2-CD1 3.9Å; Y91-L113 HydrophobicContact CD1-CB 4.39Å; Y91-L113 HydrophobicContact CG-CB 4.25Å; Y91-L113 HydrophobicContact CG-CD1 4.34Å; Y91-L114 HydrophobicContact CE1-CD2 4.4Å; Y91-L114 HydrophobicContact CE2-CD2 4.06Å; Y91-L114 WeakPolarHBondContact OH-CD2 3.15Å |
| 92 | G | 93.4 | Very high | 92.9 | Very high | 61 Ų | 61 | 74 Ų | 74 | 63% | 0.629 | 42% | 0.423 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.9 | 5.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | L88 F89 K90 | L88-G92 PolarHBondContact O-N 3.03Å; F89-G92 WeakPolarHBondContact O-CA 3.27Å; F89-G92 PolarHBondContact O-N 3.01Å; K90-G92 PolarHBondContact O-N 2.84Å |
| 93 | V | 93.4 | Very high | 93 | Very high | 18 Ų | 18 | 71.2 Ų | 71.2 | 11% | 0.109 | 40% | 0.403 | C | S | . | . | trans | -91.4 | 110.5 | 178.1 | 177.2 | 0 | 0 | 0 | 0 | 110.8 | L88 F89 Y91 A95 K109 L113 | L88-V93 CarbonylContact C-O 3.54Å; L88-V93 VanDerWaalsContact C-O 3.25Å; L88-V93 HydrophobicContact CB-CB 4.17Å; L88-V93 HydrophobicContact CB-CG1 4.38Å; L88-V93 HydrophobicContact CD2-CB 4.17Å; L88-V93 HydrophobicContact CD2-CG1 4.17Å; L88-V93 WeakPolarHBondContact O-CA 3.35Å; L88-V93 WeakPolarHBondContact O-CB 3.5Å; L88-V93 PolarHBondContact O-N 2.93Å; F89-V93 WeakPolarHBondContact CA-O 3.36Å; F89-V93 PolarHBondContact N-O 2.79Å; Y91-V93 VanDerWaalsContact C-N 3.31Å; Y91-V93 PolarHBondContact O-N 2.91Å; V93-A95 PolarHBondContact O-N 3.48Å; V93-A95 VanDerWaalsContact O-N 3.14Å; V93-K109 HydrophobicContact CG1-CD 3.91Å; V93-L113 HydrophobicContact CB-CD1 4.48Å; V93-L113 HydrophobicContact CG2-CD1 3.62Å | ||
| 94 | K | 92.4 | Very high | 93.1 | Very high | 180 Ų | 180 | 70.1 Ų | 70.1 | 78% | 0.783 | 41% | 0.405 | S | S | * | . | trans | -79.1 | 96.5 | 174.1 | -63 | 177.3 | -175.7 | 175.4 | 0 | 110.3 | F89 | F89-K94 HydrophobicContact CD2-CG 4.42Å; F89-K94 HydrophobicContact CE2-CG 4.34Å | ||
| 95 | A | 90.2 | Very high | 93.1 | Very high | 15 Ų | 15 | 74.8 Ų | 74.8 | 12% | 0.124 | 43% | 0.433 | C | S | . | . | trans | -87.1 | 143.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | K85 L88 V93 Y106 | K85-A95 WeakPolarHBondContact CE-O 3.33Å; K85-A95 HydrophobicContact CG-CB 4.39Å; L88-A95 HydrophobicContact CD1-CB 4.2Å; V93-A95 PolarHBondContact O-N 3.48Å; V93-A95 VanDerWaalsContact O-N 3.14Å; A95-Y106 HydrophobicContact CB-CD1 3.9Å; A95-Y106 HydrophobicContact CB-CE1 3.46Å; A95-Y106 VanDerWaalsContact CB-CE1 3.46Å; A95-Y106 HydrophobicContact CB-CE2 4.31Å | ||
| 96 | G | 89.8 | Confident | 93.2 | Very high | 31 Ų | 31 | 72.9 Ų | 72.9 | 32% | 0.32 | 42% | 0.424 | S | S | . | . | trans | -74.9 | -160.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | I98 | G96-I98 PolarHBondContact O-N 2.85Š| ||
| 97 | P | 92.8 | Very high | 93.3 | Very high | 106 Ų | 106 | 71.1 Ų | 71.1 | 69% | 0.688 | 41% | 0.405 | S | S | * | . | trans | -57.9 | 123.2 | 166.9 | -18.1 | 31.2 | 0 | 0 | 0 | 109.3 | L99 | P97-L99 PolarHBondContact O-N 3.2Š| ||
| 98 | I | 94.9 | Very high | 93.3 | Very high | 22 Ų | 22 | 73.2 Ų | 73.2 | 11% | 0.113 | 42% | 0.417 | C | S | . | . | trans | -81.7 | 119.4 | 176.1 | -57.1 | -165.3 | 0 | 0 | 0 | 107.1 | D81 L84 K85 G96 R103 Y106 | D81-I98 HydrophobicContact CB-CB 4.12Å; D81-I98 HydrophobicContact CB-CG2 4.15Å; D81-I98 WeakPolarHBondContact O-CD1 3.31Å; L84-I98 HydrophobicContact CB-CD1 4.09Å; L84-I98 HydrophobicContact CD2-CD1 3.89Å; L84-I98 HydrophobicContact CD2-CG2 4.49Å; L84-I98 HydrophobicContact CG-CD1 3.89Å; K85-I98 HydrophobicContact CB-CD1 3.83Å; K85-I98 HydrophobicContact CB-CG1 4.32Å; G96-I98 PolarHBondContact O-N 2.85Å; I98-R103 HydrophobicContact CG2-CB 3.98Å; I98-R103 HydrophobicContact CG2-CG 4.19Å; I98-Y106 HydrophobicContact CD1-CD2 4.14Å; I98-Y106 HydrophobicContact CD1-CG 4.34Å; I98-Y106 HydrophobicContact CG1-CD2 4.05Å; I98-Y106 HydrophobicContact CG1-CE2 4.34Å; I98-Y106 HydrophobicContact CG2-CD2 4.42Å | ||
| 99 | L | 94.5 | Very high | 93.3 | Very high | 107 Ų | 107 | 77.6 Ų | 77.6 | 56% | 0.56 | 44% | 0.435 | S | S | * | . | trans | -110.7 | 156.8 | 174.7 | -66.8 | 142.3 | 0 | 0 | 0 | 108.3 | P97 S101 T102 R103 | P97-L99 PolarHBondContact O-N 3.2Å; L99-S101 PolarHBondContact O-N 3.41Å; L99-T102 PolarHBondContact N-OG1 3.03Å; L99-T102 CarbonylContact O-C 3.52Å; L99-T102 WeakPolarHBondContact O-CA 3.42Å; L99-T102 PolarHBondContact O-N 3.35Å; L99-T102 PolarHBondContact O-OG1 3.37Å; L99-R103 PolarHBondContact O-N 3.36Å | ||
| 100 | A | 91.1 | Very high | 93.3 | Very high | 95 Ų | 95 | 71.3 Ų | 71.3 | 79% | 0.785 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -50.2 | -37.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | T102 | A100-T102 VanDerWaalsContact C-N 3.29Å; A100-T102 PolarHBondContact O-N 3.02Å |
| 101 | S | 92.6 | Very high | 93.2 | Very high | 101 Ų | 101 | 67 Ų | 67 | 71% | 0.706 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -69.6 | -24.3 | 177.4 | 57.4 | 0 | 0 | 0 | 0 | 114.2 | L99 | L99-S101 PolarHBondContact O-N 3.41Å |
| 102 | T | 93.3 | Very high | 93.2 | Very high | 41 Ų | 41 | 69.8 Ų | 69.8 | 25% | 0.252 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -104.1 | -15.9 | -177.8 | 59.8 | 0 | 0 | 0 | 0 | 113.2 | L99 A100 A104 V105 Y106 | L99-T102 PolarHBondContact N-OG1 3.03Å; L99-T102 CarbonylContact O-C 3.52Å; L99-T102 WeakPolarHBondContact O-CA 3.42Å; L99-T102 PolarHBondContact O-N 3.35Å; L99-T102 PolarHBondContact O-OG1 3.37Å; A100-T102 VanDerWaalsContact C-N 3.29Å; A100-T102 PolarHBondContact O-N 3.02Å; T102-A104 PolarHBondContact O-N 2.76Å; T102-V105 WeakPolarHBondContact O-CB 3.36Å; T102-V105 PolarHBondContact O-N 3.06Å; T102-V105 VanDerWaalsContact O-N 3.09Å; T102-Y106 VanDerWaalsContact O-CD2 3.29Å; T102-Y106 WeakPolarHBondContact O-CD2 3.4Å; T102-Y106 PolarHBondContact O-N 3.17Å |
| 103 | R | 94.5 | Very high | 93.1 | Very high | 68 Ų | 68 | 68.8 Ų | 68.8 | 26% | 0.257 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -55.5 | -51.9 | -175.9 | -172.4 | -175 | 167.5 | 137.8 | -10 | 111.8 | S77 L79 D81 L84 I98 L99 V105 Y106 E107 | S77-R103 PolarHBondContact O-NH2 3.11Å; L79-R103 PolarHBondContact O-NH2 3.16Å; D81-R103 VanDerWaalsContact OD1-CD 3.23Å; D81-R103 WeakPolarHBondContact OD1-CD 3.45Å; D81-R103 IonicContact OD1-CZ 2.84Å; D81-R103 IonicContact OD1-NE 3.12Å; D81-R103 IonicContact OD1-NH1 3.01Å; D81-R103 PolarHBondContact OD1-NH1 3Å; L84-R103 HydrophobicContact CD2-CG 4.06Å; I98-R103 HydrophobicContact CG2-CB 3.98Å; I98-R103 HydrophobicContact CG2-CG 4.19Å; L99-R103 PolarHBondContact O-N 3.36Å; R103-V105 PolarHBondContact O-N 2.84Å; R103-V105 VanDerWaalsContact O-N 3.15Å; R103-Y106 WeakPolarHBondContact O-CA 3.37Å; R103-Y106 PolarHBondContact O-N 2.95Å; R103-E107 WeakPolarHBondContact CD-OE1 3.4Å; R103-E107 HydrophobicContact CG-CG 4.32Å; R103-E107 VanDerWaalsContact CG-OE1 3.32Å; R103-E107 WeakPolarHBondContact CG-OE1 3.3Å; R103-E107 IonicContact CZ-OE1 3.93Å; R103-E107 IonicContact NE-OE1 3.83Å; R103-E107 PolarHBondContact NE-OE1 3Å; R103-E107 IonicContact NH2-OE1 2.71Å; R103-E107 WeakPolarHBondContact O-CG 3.18Å; R103-E107 PolarHBondContact O-N 3.27Å |
| 104 | A | 93.9 | Very high | 92.8 | Very high | 53 Ų | 53 | 70.5 Ų | 70.5 | 44% | 0.438 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -59.4 | -30.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114 | T102 N108 | T102-A104 PolarHBondContact O-N 2.76Å; A104-N108 WeakPolarHBondContact O-CB 3.39Å; A104-N108 PolarHBondContact O-N 2.89Å; A104-N108 VanDerWaalsContact O-N 3.14Å; A104-N108 PolarHBondContact O-ND2 3.34Å |
| 105 | V | 94.8 | Very high | 92.6 | Very high | 97 Ų | 97 | 67.3 Ų | 67.3 | 59% | 0.588 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -69.3 | -40.8 | 176.2 | -179.4 | 0 | 0 | 0 | 0 | 110.3 | T102 R103 K109 | T102-V105 WeakPolarHBondContact O-CB 3.36Å; T102-V105 PolarHBondContact O-N 3.06Å; T102-V105 VanDerWaalsContact O-N 3.09Å; R103-V105 PolarHBondContact O-N 2.84Å; R103-V105 VanDerWaalsContact O-N 3.15Å; V105-K109 WeakPolarHBondContact O-CB 3.44Å; V105-K109 PolarHBondContact O-N 3.3Å |
| 106 | Y | 94.9 | Very high | 92.1 | Very high | 50 Ų | 50 | 69.9 Ų | 69.9 | 20% | 0.196 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -74.6 | -37.9 | 179.6 | -77.1 | -54.9 | 0 | 0 | 0 | 112.8 | L88 A95 I98 T102 R103 K109 L110 | L88-Y106 HydrophobicContact CD1-CD1 3.54Å; L88-Y106 HydrophobicContact CD1-CG 3.86Å; A95-Y106 HydrophobicContact CB-CD1 3.9Å; A95-Y106 HydrophobicContact CB-CE1 3.46Å; A95-Y106 VanDerWaalsContact CB-CE1 3.46Å; A95-Y106 HydrophobicContact CB-CE2 4.31Å; I98-Y106 HydrophobicContact CD1-CD2 4.14Å; I98-Y106 HydrophobicContact CD1-CG 4.34Å; I98-Y106 HydrophobicContact CG1-CD2 4.05Å; I98-Y106 HydrophobicContact CG1-CE2 4.34Å; I98-Y106 HydrophobicContact CG2-CD2 4.42Å; T102-Y106 VanDerWaalsContact O-CD2 3.29Å; T102-Y106 WeakPolarHBondContact O-CD2 3.4Å; T102-Y106 PolarHBondContact O-N 3.17Å; R103-Y106 WeakPolarHBondContact O-CA 3.37Å; R103-Y106 PolarHBondContact O-N 2.95Å; Y106-K109 WeakPolarHBondContact O-CB 3.39Å; Y106-K109 PolarHBondContact O-N 3.02Å; Y106-L110 PolarHBondContact O-N 2.89Å |
| 107 | E | 94.4 | Very high | 91.2 | Very high | 23 Ų | 23 | 70.6 Ų | 70.6 | 11% | 0.107 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -58.9 | -49.7 | 171.5 | -68.1 | 173.6 | 179.8 | 0 | 0 | 111.1 | P76 L84 R103 K109 L110 R111 | P76-E107 HydrophobicContact CB-CB 4.2Å; P76-E107 HydrophobicContact CB-CG 4.48Å; P76-E107 WeakPolarHBondContact O-CG 3.04Å; L84-E107 HydrophobicContact CD1-CG 4.24Å; L84-E107 HydrophobicContact CD2-CG 3.71Å; R103-E107 WeakPolarHBondContact CD-OE1 3.4Å; R103-E107 HydrophobicContact CG-CG 4.32Å; R103-E107 VanDerWaalsContact CG-OE1 3.32Å; R103-E107 WeakPolarHBondContact CG-OE1 3.3Å; R103-E107 IonicContact CZ-OE1 3.93Å; R103-E107 IonicContact NE-OE1 3.83Å; R103-E107 PolarHBondContact NE-OE1 3Å; R103-E107 IonicContact NH2-OE1 2.71Å; R103-E107 WeakPolarHBondContact O-CG 3.18Å; R103-E107 PolarHBondContact O-N 3.27Å; E107-K109 VanDerWaalsContact C-N 3.26Å; E107-K109 PolarHBondContact O-N 3.33Å; E107-L110 PolarHBondContact O-N 3.04Å; E107-L110 VanDerWaalsContact O-N 3.14Å; E107-R111 WeakPolarHBondContact O-CG 3.18Å; E107-R111 PolarHBondContact O-N 3.14Å |
| 108 | N | 93.5 | Very high | 89.6 | Confident | 82 Ų | 82 | 72.3 Ų | 72.3 | 44% | 0.439 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -63.8 | -32.5 | 176.1 | -77.5 | -19.2 | 0 | 0 | 0 | 112.7 | A104 R111 K112 | A104-N108 WeakPolarHBondContact O-CB 3.39Å; A104-N108 PolarHBondContact O-N 2.89Å; A104-N108 VanDerWaalsContact O-N 3.14Å; A104-N108 PolarHBondContact O-ND2 3.34Å; N108-R111 PolarHBondContact OD1-NH1 2.94Å; N108-K112 WeakPolarHBondContact O-CG 3.41Å; N108-K112 PolarHBondContact O-N 2.67Å |
| 109 | K | 94.3 | Very high | 87.3 | Confident | 91 Ų | 91 | 78.1 Ų | 78.1 | 40% | 0.396 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -68.1 | -39.7 | 174.7 | -168.7 | 170.4 | -175.5 | -178.3 | 0 | 111.2 | L88 V93 V105 Y106 E107 K112 L113 | L88-K109 HydrophobicContact CD2-CB 4.31Å; L88-K109 HydrophobicContact CD2-CG 4.26Å; V93-K109 HydrophobicContact CG1-CD 3.91Å; V105-K109 WeakPolarHBondContact O-CB 3.44Å; V105-K109 PolarHBondContact O-N 3.3Å; Y106-K109 WeakPolarHBondContact O-CB 3.39Å; Y106-K109 PolarHBondContact O-N 3.02Å; E107-K109 VanDerWaalsContact C-N 3.26Å; E107-K109 PolarHBondContact O-N 3.33Å; K109-K112 PolarHBondContact O-N 3.17Å; K109-L113 WeakPolarHBondContact O-CG 3.49Å; K109-L113 PolarHBondContact O-N 2.8Å; K109-L113 VanDerWaalsContact O-N 3.17Å |
| 110 | L | 93.5 | Very high | 85.1 | Confident | 4 Ų | 4 | 76 Ų | 76 | 2% | 0.021 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -65.5 | -44.6 | 175.2 | -175.6 | 59.5 | 0 | 0 | 0 | 111.2 | P76 L79 L84 L87 L88 Y91 Y106 E107 K112 L113 L114 | P76-L110 HydrophobicContact CB-CD2 4.31Å; L79-L110 HydrophobicContact CD2-CD2 4.12Å; L84-L110 HydrophobicContact CD1-CB 4.2Å; L84-L110 HydrophobicContact CD1-CD2 3.72Å; L87-L110 HydrophobicContact CB-CD1 4.15Å; L87-L110 HydrophobicContact CB-CD2 3.94Å; L87-L110 HydrophobicContact CD1-CD2 4.38Å; L88-L110 HydrophobicContact CD2-CB 4.04Å; L88-L110 HydrophobicContact CD2-CD1 4.41Å; L88-L110 HydrophobicContact CG-CB 4.44Å; Y91-L110 HydrophobicContact CD2-CD1 3.75Å; Y91-L110 HydrophobicContact CE2-CD1 3.9Å; Y106-L110 PolarHBondContact O-N 2.89Å; E107-L110 PolarHBondContact O-N 3.04Å; E107-L110 VanDerWaalsContact O-N 3.14Å; L110-K112 VanDerWaalsContact C-N 3.27Å; L110-K112 PolarHBondContact O-N 3.49Å; L110-L113 PolarHBondContact O-N 3.33Å; L110-L114 HydrophobicContact CD1-CG 4.46Å; L110-L114 HydrophobicContact CG-CD1 4.24Å; L110-L114 WeakPolarHBondContact O-CG 3.35Å; L110-L114 PolarHBondContact O-N 2.99Å |
| 111 | R | 92.8 | Very high | 82.9 | Confident | 74 Ų | 74 | 80.2 Ų | 80.2 | 28% | 0.279 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -51.1 | -46.5 | 173.1 | -70.5 | -175.8 | 178.8 | 110.9 | 8 | 112.1 | D75 P76 S77 E107 N108 L113 L114 Q115 | D75-R111 IonicContact OD1-NH2 3.94Å; D75-R111 PolarHBondContact OD1-NH2 3.24Å; P76-R111 HydrophobicContact CB-CG 4.47Å; P76-R111 HydrophobicContact CG-CG 3.32Å; S77-R111 PolarHBondContact OG-NH2 3.32Å; E107-R111 WeakPolarHBondContact O-CG 3.18Å; E107-R111 PolarHBondContact O-N 3.14Å; N108-R111 PolarHBondContact OD1-NH1 2.94Å; R111-L113 PolarHBondContact O-N 3.28Å; R111-L114 PolarHBondContact O-N 2.94Å; R111-Q115 VanDerWaalsContact O-CG 3.3Å; R111-Q115 WeakPolarHBondContact O-CG 3.29Å; R111-Q115 PolarHBondContact O-N 3.17Å |
| 112 | K | 92.2 | Very high | 80.5 | Confident | 147 Ų | 147 | 79.2 Ų | 79.2 | 64% | 0.639 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -65.1 | -37.6 | 179.5 | -73.6 | -179.1 | 178.4 | -168.6 | 0 | 113.1 | N108 K109 L110 S116 | N108-K112 WeakPolarHBondContact O-CG 3.41Å; N108-K112 PolarHBondContact O-N 2.67Å; K109-K112 PolarHBondContact O-N 3.17Å; L110-K112 VanDerWaalsContact C-N 3.27Å; L110-K112 PolarHBondContact O-N 3.49Å; K112-S116 WeakPolarHBondContact O-CB 3.39Å; K112-S116 PolarHBondContact O-N 3.27Å; K112-S116 PolarHBondContact O-OG 3.36Å; K112-S116 VanDerWaalsContact O-OG 3.05Å |
| 113 | L | 91.3 | Very high | 77.9 | Confident | 40 Ų | 40 | 84.2 Ų | 84.2 | 21% | 0.209 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -69 | -38.9 | 178.3 | -66.6 | 167.6 | 0 | 0 | 0 | 111.1 | L88 Y91 V93 K109 L110 R111 S116 A117 | L88-L113 HydrophobicContact CD2-CD1 3.95Å; Y91-L113 HydrophobicContact CD1-CB 4.39Å; Y91-L113 HydrophobicContact CG-CB 4.25Å; Y91-L113 HydrophobicContact CG-CD1 4.34Å; V93-L113 HydrophobicContact CB-CD1 4.48Å; V93-L113 HydrophobicContact CG2-CD1 3.62Å; K109-L113 WeakPolarHBondContact O-CG 3.49Å; K109-L113 PolarHBondContact O-N 2.8Å; K109-L113 VanDerWaalsContact O-N 3.17Å; L110-L113 PolarHBondContact O-N 3.33Å; R111-L113 PolarHBondContact O-N 3.28Å; L113-S116 WeakPolarHBondContact CA-OG 3.29Å; L113-S116 PolarHBondContact O-OG 3.27Å; L113-A117 WeakPolarHBondContact O-CB 3.21Å; L113-A117 PolarHBondContact O-N 3.49Å |
| 114 | L | 88.4 | Confident | 75.6 | Confident | 53 Ų | 53 | 90.3 Ų | 90.3 | 28% | 0.277 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.9 | -48.9 | 174.6 | -66.1 | 173.1 | 0 | 0 | 0 | 111.1 | Y91 L110 R111 S116 A117 E118 | Y91-L114 HydrophobicContact CE1-CD2 4.4Å; Y91-L114 HydrophobicContact CE2-CD2 4.06Å; Y91-L114 WeakPolarHBondContact OH-CD2 3.15Å; L110-L114 HydrophobicContact CD1-CG 4.46Å; L110-L114 HydrophobicContact CG-CD1 4.24Å; L110-L114 WeakPolarHBondContact O-CG 3.35Å; L110-L114 PolarHBondContact O-N 2.99Å; R111-L114 PolarHBondContact O-N 2.94Å; L114-S116 PolarHBondContact O-N 3.14Å; L114-A117 PolarHBondContact O-N 3.03Å; L114-A117 VanDerWaalsContact O-N 3.13Å; L114-E118 WeakPolarHBondContact O-CB 3.18Å; L114-E118 PolarHBondContact O-N 3.06Å |
| 115 | Q | 87.2 | Confident | 73.3 | Confident | 114 Ų | 114 | 91.9 Ų | 91.9 | 53% | 0.533 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.7 | -44.6 | 176 | -72.5 | 169.5 | -4.9 | 0 | 0 | 112.4 | R111 A117 E118 E119 | R111-Q115 VanDerWaalsContact O-CG 3.3Å; R111-Q115 WeakPolarHBondContact O-CG 3.29Å; R111-Q115 PolarHBondContact O-N 3.17Å; Q115-A117 VanDerWaalsContact C-N 3.31Å; Q115-A117 PolarHBondContact O-N 3.4Å; Q115-E118 PolarHBondContact O-N 3.48Å; Q115-E119 WeakPolarHBondContact O-CG 3.44Å; Q115-E119 PolarHBondContact O-N 2.99Å |
| 116 | S | 80 | Confident | 71.2 | Confident | 68 Ų | 68 | 95.8 Ų | 95.8 | 48% | 0.476 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -71.9 | -23.5 | 177.9 | 64.7 | 0 | 0 | 0 | 0 | 114.2 | K112 L113 L114 | K112-S116 WeakPolarHBondContact O-CB 3.39Å; K112-S116 PolarHBondContact O-N 3.27Å; K112-S116 PolarHBondContact O-OG 3.36Å; K112-S116 VanDerWaalsContact O-OG 3.05Å; L113-S116 WeakPolarHBondContact CA-OG 3.29Å; L113-S116 PolarHBondContact O-OG 3.27Å; L114-S116 PolarHBondContact O-N 3.14Å |
| 117 | A | 70.3 | Confident | 68.6 | Low | 47 Ų | 47 | 101.6 Ų | 101.6 | 39% | 0.388 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -79.5 | -37.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | L113 L114 Q115 G120 | L113-A117 WeakPolarHBondContact O-CB 3.21Å; L113-A117 PolarHBondContact O-N 3.49Å; L114-A117 PolarHBondContact O-N 3.03Å; L114-A117 VanDerWaalsContact O-N 3.13Å; Q115-A117 VanDerWaalsContact C-N 3.31Å; Q115-A117 PolarHBondContact O-N 3.4Å; A117-G120 PolarHBondContact O-N 3.05Å |
| 118 | E | 59 | Low | 66.6 | Low | 142 Ų | 142 | 104.9 Ų | 104.9 | 66% | 0.664 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -69.2 | -38.1 | 175.4 | -165.4 | 176 | 175.2 | 0 | 0 | 111.9 | L114 Q115 G120 E121 | L114-E118 WeakPolarHBondContact O-CB 3.18Å; L114-E118 PolarHBondContact O-N 3.06Å; Q115-E118 PolarHBondContact O-N 3.48Å; E118-G120 PolarHBondContact O-N 2.94Å; E118-G120 VanDerWaalsContact O-N 3.1Å; E118-E121 PolarHBondContact O-N 3.37Å |
| 119 | E | 48 | Very low | 64.2 | Low | 143 Ų | 143 | 106.9 Ų | 106.9 | 67% | 0.668 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.1 | -7.1 | 172.3 | -75.4 | 178.7 | 169.1 | 0 | 0 | 114 | Q115 | Q115-E119 WeakPolarHBondContact O-CG 3.44Å; Q115-E119 PolarHBondContact O-N 2.99Å |
| 120 | G | 48.3 | Very low | 61.8 | Low | 63 Ų | 63 | 109.1 Ų | 109.1 | 65% | 0.649 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.5 | -9.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | A117 E118 | A117-G120 PolarHBondContact O-N 3.05Å; E118-G120 PolarHBondContact O-N 2.94Å; E118-G120 VanDerWaalsContact O-N 3.1Å |
| 121 | E | 44.6 | Very low | 59.3 | Low | 183 Ų | 183 | 119.4 Ų | 119.4 | 86% | 0.855 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -120 | 4.4 | -176.6 | -78.3 | 179.8 | 116.3 | 0 | 0 | 114.4 | E118 | E118-E121 PolarHBondContact O-N 3.37Š|
| 122 | S | 41.8 | Very low | 56.9 | Low | 81 Ų | 81 | 121.4 Ų | 121.4 | 57% | 0.566 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -135.2 | 66.9 | 173.6 | 69.9 | 0 | 0 | 0 | 0 | 112.6 | ||
| 123 | N | 38.3 | Very low | 54.8 | Low | 145 Ų | 145 | 121.8 Ų | 121.8 | 78% | 0.775 | 68% | 0.676 | S | S | * | * | trans | -149.7 | 59.1 | 159 | -76.2 | -56 | 0 | 0 | 0 | 110 | ||||
| 124 | E | 46.9 | Very low | 52.5 | Low | 196 Ų | 196 | 123.9 Ų | 123.9 | 92% | 0.916 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -99.9 | 115.9 | 153.9 | -168.8 | 166.2 | -176.2 | 0 | 0 | 106.8 | ||
| 125 | A | 44.8 | Very low | 50.3 | Low | 87 Ų | 87 | 128.8 Ų | 128.8 | 72% | 0.719 | 72% | 0.72 | S | S | * | * | S | Bend | trans | 89.1 | 124.1 | -177 | 0 | 0 | 0 | 0 | 0 | 118 | ||
| 126 | E | 51 | Low | 48 | Very low | 179 Ų | 179 | 131.8 Ų | 131.8 | 84% | 0.836 | 73% | 0.734 | S | S | * | * | trans | 70.1 | 75 | 160.8 | 69.3 | 174.9 | -147.4 | 0 | 0 | 121 | ||||
| 127 | N | 40.6 | Very low | 46 | Very low | 172 Ų | 172 | 137.9 Ų | 137.9 | 92% | 0.92 | 76% | 0.755 | S | S | * | * | -158.6 | 71.9 | 126.9 | -112.3 | -13.3 | 0 | 0 | 0 | 110.5 | |||||
| 128 | A | 51.3 | Low | 44.3 | Very low | 92 Ų | 92 | 143.5 Ų | 143.5 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | trans | -79.4 | 120.9 | 155.1 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 129 | V | 44.4 | Very low | 43.2 | Very low | 124 Ų | 124 | 143.3 Ų | 143.3 | 75% | 0.752 | 79% | 0.787 | S | S | * | * | trans | 155.8 | 103.9 | 150.8 | 162.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 130 | L | 44 | Very low | 42.4 | Very low | 138 Ų | 138 | 141.1 Ų | 141.1 | 72% | 0.723 | 79% | 0.787 | S | S | * | * | trans | 68.2 | 120.5 | 144.4 | -54.4 | 170.6 | 0 | 0 | 0 | 118.2 | ||||
| 131 | Y | 39.5 | Very low | 41.8 | Very low | 220 Ų | 220 | 146.3 Ų | 146.3 | 86% | 0.863 | 79% | 0.794 | S | S | * | * | cis | -146.6 | 120 | 48.6 | -92.9 | -101.5 | 0 | 0 | 0 | 112.1 | ||||
| 132 | S | 43 | Very low | 41.3 | Very low | 115 Ų | 115 | 145.8 Ų | 145.8 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | trans | -101.8 | 117.3 | 158.6 | -139.2 | 0 | 0 | 0 | 0 | 106.5 | S134 | S132-S134 PolarHBondContact O-N 2.96Š| ||
| 133 | D | 49.2 | Very low | 40.8 | Very low | 156 Ų | 156 | 149.3 Ų | 149.3 | 83% | 0.834 | 81% | 0.805 | S | S | * | * | trans | -89.6 | 95.4 | 170.9 | -170.9 | 16.1 | 0 | 0 | 0 | 107.1 | ||||
| 134 | S | 42.2 | Very low | 40.8 | Very low | 83 Ų | 83 | 150.3 Ų | 150.3 | 58% | 0.58 | 81% | 0.805 | S | S | * | * | trans | -136.1 | 103.6 | 177.5 | -161.4 | 0 | 0 | 0 | 0 | 107.7 | S132 E136 | S132-S134 PolarHBondContact O-N 2.96Å; S134-E136 PolarHBondContact O-N 3.13Å | ||
| 135 | D | 41.5 | Very low | 40.1 | Very low | 157 Ų | 157 | 147.4 Ų | 147.4 | 84% | 0.84 | 80% | 0.796 | S | S | * | * | trans | -61.6 | 124 | 170.8 | -72.2 | -56.6 | 0 | 0 | 0 | 110 | ||||
| 136 | E | 38.8 | Very low | 39.9 | Very low | 176 Ų | 176 | 150.5 Ų | 150.5 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | -138.2 | 127 | 166.7 | 42.5 | -151.6 | 162.7 | 0 | 0 | 111.3 | S134 | S134-E136 PolarHBondContact O-N 3.13Š| ||
| 137 | E | 37.8 | Very low | 39.2 | Very low | 196 Ų | 196 | 148.9 Ų | 148.9 | 92% | 0.916 | 79% | 0.788 | S | S | * | * | trans | -76.2 | 149.5 | -175.3 | -66.9 | -173.9 | 157.9 | 0 | 0 | 112.5 | ||||
| 138 | D | 34.8 | Very low | 39.1 | Very low | 165 Ų | 165 | 149.9 Ų | 149.9 | 88% | 0.882 | 78% | 0.784 | S | S | * | * | trans | -45.8 | 133.5 | 177.2 | -75.8 | -57 | 0 | 0 | 0 | 115.5 | ||||
| 139 | V | 36.2 | Very low | 38.1 | Very low | 139 Ų | 139 | 154.4 Ų | 154.4 | 84% | 0.842 | 79% | 0.789 | S | S | * | * | trans | -139.2 | 125 | 145.3 | -161.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 140 | S | 31.3 | Very low | 37.7 | Very low | 97 Ų | 97 | 156.1 Ų | 156.1 | 68% | 0.678 | 79% | 0.793 | S | S | * | * | trans | -55.3 | 150.3 | 175.9 | 48.7 | 0 | 0 | 0 | 0 | 116 | ||||
| 141 | E | 36.3 | Very low | 37 | Very low | 171 Ų | 171 | 156.5 Ų | 156.5 | 80% | 0.799 | 80% | 0.801 | S | S | * | * | 178.7 | 105.2 | 124.6 | -94.4 | 170 | -148.6 | 0 | 0 | 107.7 | |||||
| 142 | E | 33.7 | Very low | 36.5 | Very low | 172 Ų | 172 | 149.1 Ų | 149.1 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | 60.6 | 112.4 | 104.1 | -76.6 | -171.9 | 173.5 | 0 | 0 | 114 | |||||
| 143 | N | 31.9 | Very low | 35.8 | Very low | 156 Ų | 156 | 148.2 Ų | 148.2 | 83% | 0.834 | 79% | 0.791 | S | S | * | * | trans | -167.7 | 107.4 | 135.7 | -82.6 | -51.4 | 0 | 0 | 0 | 109.6 | ||||
| 144 | E | 37.3 | Very low | 35.1 | Very low | 166 Ų | 166 | 149 Ų | 149 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | 21.7 | 114.8 | 133.6 | -57.7 | -179.2 | 172.1 | 0 | 0 | 118.3 | ||||
| 145 | D | 32.1 | Very low | 34.7 | Very low | 135 Ų | 135 | 151.6 Ų | 151.6 | 72% | 0.722 | 79% | 0.793 | S | S | * | * | 167.4 | 135.7 | 95.9 | -90.3 | -32.3 | 0 | 0 | 0 | 114.5 | |||||
| 146 | E | 40.6 | Very low | 34.4 | Very low | 152 Ų | 152 | 151.4 Ų | 151.4 | 71% | 0.71 | 79% | 0.785 | S | S | * | * | trans | 71.9 | 106 | 145.5 | -64 | -174.8 | 179.4 | 0 | 0 | 123 | ||||
| 147 | E | 37.8 | Very low | 33.9 | Very low | 145 Ų | 145 | 152.6 Ų | 152.6 | 68% | 0.678 | 79% | 0.787 | S | S | * | * | 77 | 108.8 | 125.7 | -58 | -176.9 | -147 | 0 | 0 | 121.3 | |||||
| 148 | K | 37.9 | Very low | 33.8 | Very low | 193 Ų | 193 | 147 Ų | 147 | 84% | 0.839 | 77% | 0.774 | S | S | * | * | 176.6 | 108.4 | 104.8 | -90 | 160.2 | -156.7 | -174 | 0 | 113.7 | |||||
| 149 | E | 29 | Very low | 33.6 | Very low | 187 Ų | 187 | 147.3 Ų | 147.3 | 87% | 0.874 | 77% | 0.77 | S | S | * | * | trans | 19.3 | 123.6 | 144.4 | -135.2 | -177.5 | 162.6 | 0 | 0 | 121.8 | ||||
| 150 | L | 37.6 | Very low | 33.3 | Very low | 159 Ų | 159 | 144.7 Ų | 144.7 | 83% | 0.832 | 76% | 0.764 | S | S | * | * | trans | -70.7 | 157.9 | 157.3 | -71.7 | 154.9 | 0 | 0 | 0 | 112.4 | ||||
| 151 | V | 28.4 | Very low | 33.3 | Very low | 146 Ų | 146 | 148.1 Ų | 148.1 | 89% | 0.885 | 77% | 0.774 | S | S | * | * | trans | -145 | 128 | 136.5 | -169.1 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 152 | G | 28.3 | Very low | 33.1 | Very low | 65 Ų | 65 | 148 Ų | 148 | 67% | 0.67 | 77% | 0.773 | S | S | * | * | cis | 152 | 152.9 | 7.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 153 | A | 29.8 | Very low | 33.6 | Very low | 97 Ų | 97 | 144.6 Ų | 144.6 | 80% | 0.802 | 77% | 0.766 | S | S | * | * | trans | 128.9 | 91 | 162.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 154 | Q | 33.8 | Very low | 33.6 | Very low | 173 Ų | 173 | 143.7 Ų | 143.7 | 81% | 0.808 | 76% | 0.761 | S | S | * | * | 47.6 | 129.9 | 86.6 | -72.2 | -162.2 | -13.8 | 0 | 0 | 112.8 | |||||
| 155 | E | 34.8 | Very low | 33.3 | Very low | 137 Ų | 137 | 143.4 Ų | 143.4 | 64% | 0.64 | 76% | 0.76 | S | S | * | * | cis | -171.2 | 136.1 | 49.5 | -159.7 | 175.6 | 166 | 0 | 0 | 113.2 | ||||
| 156 | K | 34.2 | Very low | 33.3 | Very low | 153 Ų | 153 | 144.3 Ų | 144.3 | 67% | 0.665 | 76% | 0.76 | S | S | * | * | trans | 51.5 | 123.8 | 140.2 | -63.7 | 174.6 | -159.1 | 157.3 | 0 | 121.5 | ||||
| 157 | K | 29.1 | Very low | 33.2 | Very low | 200 Ų | 200 | 145.5 Ų | 145.5 | 87% | 0.87 | 77% | 0.765 | S | S | * | * | 75.4 | 134.9 | 71.5 | -171.7 | -175.6 | -178.9 | -177 | 0 | 111.6 | |||||
| 158 | A | 35.3 | Very low | 32.8 | Very low | 78 Ų | 78 | 143.6 Ų | 143.6 | 65% | 0.645 | 77% | 0.768 | S | S | * | * | cis | -153.4 | 176.8 | -1.5 | 0 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 159 | E | 29.7 | Very low | 32.5 | Very low | 172 Ų | 172 | 141.8 Ų | 141.8 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | 173.6 | 114.2 | 57.2 | -174.1 | 171.8 | 149.4 | 0 | 0 | 106.1 | |||||
| 160 | A | 30.7 | Very low | 32.7 | Very low | 85 Ų | 85 | 140.3 Ų | 140.3 | 70% | 0.702 | 76% | 0.76 | S | S | * | * | 55.2 | 118.4 | 108.5 | 0 | 0 | 0 | 0 | 0 | 117.7 | |||||
| 161 | L | 30 | Very low | 32.5 | Very low | 169 Ų | 169 | 140.1 Ų | 140.1 | 89% | 0.885 | 75% | 0.753 | S | S | * | * | 161.1 | 116.5 | 121.6 | -85.1 | 158.3 | 0 | 0 | 0 | 111.4 | |||||
| 162 | E | 32.4 | Very low | 32.6 | Very low | 168 Ų | 168 | 139.5 Ų | 139.5 | 79% | 0.785 | 75% | 0.745 | S | S | * | * | trans | -59.5 | 177.2 | 164.1 | -91.1 | -99 | 107.7 | 0 | 0 | 112.6 | ||||
| 163 | P | 44.9 | Very low | 32.9 | Very low | 101 Ų | 101 | 142.5 Ų | 142.5 | 66% | 0.656 | 75% | 0.749 | S | S | * | * | cis | -138.1 | 164.3 | 2.3 | 18.7 | 8.1 | 0 | 0 | 0 | 116.4 | ||||
| 164 | N | 31.6 | Very low | 33.4 | Very low | 137 Ų | 137 | 143.4 Ų | 143.4 | 73% | 0.733 | 75% | 0.747 | S | S | * | * | trans | 47.2 | 126.3 | 135 | -148.3 | -42.8 | 0 | 0 | 0 | 121.2 | ||||
| 165 | Q | 31.1 | Very low | 33.4 | Very low | 160 Ų | 160 | 139.5 Ų | 139.5 | 75% | 0.748 | 74% | 0.744 | S | S | * | * | 179.9 | 144.5 | 130 | -97 | -169.1 | 71.9 | 0 | 0 | 114.7 | |||||
| 166 | Q | 33.2 | Very low | 33.5 | Very low | 154 Ų | 154 | 142.7 Ų | 142.7 | 72% | 0.72 | 76% | 0.759 | S | S | * | * | trans | 65.7 | 113.8 | 145.8 | -98.8 | 80.5 | -36 | 0 | 0 | 124.2 | ||||
| 167 | Q | 38.1 | Very low | 33.5 | Very low | 177 Ų | 177 | 143.2 Ų | 143.2 | 83% | 0.827 | 76% | 0.762 | S | S | * | * | trans | -54.7 | 144.7 | 150.2 | -164.6 | 177.8 | 20.8 | 0 | 0 | 115.1 | ||||
| 168 | S | 28 | Very low | 33.7 | Very low | 105 Ų | 105 | 137.3 Ų | 137.3 | 73% | 0.734 | 76% | 0.757 | S | S | * | * | trans | 166.7 | 113.9 | 140 | 44.4 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 169 | N | 32.5 | Very low | 34.1 | Very low | 155 Ų | 155 | 139.3 Ų | 139.3 | 83% | 0.829 | 76% | 0.757 | S | S | * | * | 63 | 119.6 | 101.8 | -68.6 | -15.2 | 0 | 0 | 0 | 116.3 | |||||
| 170 | E | 32.5 | Very low | 34.6 | Very low | 156 Ų | 156 | 141.5 Ų | 141.5 | 73% | 0.729 | 76% | 0.764 | S | S | * | * | 171.7 | 130.8 | 95.4 | -143.6 | -177.2 | 134.5 | 0 | 0 | 114.1 | |||||
| 171 | K | 33.6 | Very low | 35 | Very low | 154 Ų | 154 | 143 Ų | 143 | 67% | 0.67 | 77% | 0.77 | S | S | * | * | trans | 32.6 | 131.5 | 145.7 | -75.1 | -174.2 | -161 | 128.2 | 0 | 124.3 | ||||
| 172 | N | 30.1 | Very low | 35.5 | Very low | 134 Ų | 134 | 145 Ų | 145 | 72% | 0.717 | 77% | 0.767 | S | S | * | * | 164.9 | 110.9 | 91.7 | -93.1 | -48.8 | 0 | 0 | 0 | 114.2 | |||||
| 173 | V | 36.3 | Very low | 36.3 | Very low | 127 Ų | 127 | 141.8 Ų | 141.8 | 77% | 0.77 | 76% | 0.761 | S | S | * | * | 26.7 | 140 | 122.7 | -168.2 | 0 | 0 | 0 | 0 | 118.7 | |||||
| 174 | P | 39.9 | Very low | 36.2 | Very low | 117 Ų | 117 | 144.4 Ų | 144.4 | 76% | 0.76 | 76% | 0.764 | S | S | * | * | -148.8 | 150.8 | 52.2 | 37.2 | -14 | 0 | 0 | 0 | 122.6 | |||||
| 175 | A | 33 | Very low | 36.8 | Very low | 90 Ų | 90 | 142.4 Ų | 142.4 | 74% | 0.744 | 76% | 0.76 | S | S | * | * | trans | 38.5 | 129 | 136.3 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 176 | Q | 36.9 | Very low | 37.5 | Very low | 205 Ų | 205 | 143.8 Ų | 143.8 | 96% | 0.958 | 76% | 0.764 | S | S | * | * | -166 | 159.3 | 108 | -101.9 | -175.1 | 35.2 | 0 | 0 | 112.9 | |||||
| 177 | K | 34.3 | Very low | 37.8 | Very low | 164 Ų | 164 | 144.3 Ų | 144.3 | 71% | 0.713 | 76% | 0.764 | S | S | * | * | trans | -109.7 | 145.3 | -154.3 | -170.2 | -179.5 | -173.5 | -67.7 | 0 | 110.2 | D179 | K177-D179 VanDerWaalsContact NZ-CG 3.34Å; K177-D179 IonicContact NZ-OD1 2.73Å; K177-D179 PolarHBondContact NZ-OD1 3.4Å; K177-D179 IonicContact NZ-OD2 2.85Å; K177-D179 PolarHBondContact NZ-OD2 2.95Å | ||
| 178 | G | 34.3 | Very low | 37.9 | Very low | 75 Ų | 75 | 143.5 Ų | 143.5 | 77% | 0.773 | 76% | 0.764 | S | S | * | * | trans | -152.6 | 107 | 170.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 179 | D | 43.6 | Very low | 38.4 | Very low | 121 Ų | 121 | 143.5 Ų | 143.5 | 65% | 0.647 | 77% | 0.765 | S | S | * | * | trans | -76 | 138.7 | -176 | -62.5 | -48.3 | 0 | 0 | 0 | 111.6 | K177 | K177-D179 VanDerWaalsContact NZ-CG 3.34Å; K177-D179 IonicContact NZ-OD1 2.73Å; K177-D179 PolarHBondContact NZ-OD1 3.4Å; K177-D179 IonicContact NZ-OD2 2.85Å; K177-D179 PolarHBondContact NZ-OD2 2.95Å | ||
| 180 | F | 40 | Very low | 39.1 | Very low | 217 Ų | 217 | 142 Ų | 142 | 95% | 0.952 | 77% | 0.767 | S | S | * | * | trans | -131.6 | 112.7 | 154.5 | -100.6 | -88.1 | 0 | 0 | 0 | 109.7 | ||||
| 181 | S | 39.1 | Very low | 39.8 | Very low | 117 Ų | 117 | 145.1 Ų | 145.1 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | trans | -86.9 | 122.8 | 177.3 | -172.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 182 | Y | 40.3 | Very low | 40.2 | Very low | 211 Ų | 211 | 146.4 Ų | 146.4 | 83% | 0.827 | 79% | 0.785 | S | S | * | * | trans | -93.6 | 132.3 | 172.5 | -152 | -90.4 | 0 | 0 | 0 | 108.9 | Q184 | Y182-Q184 PolarHBondContact O-N 3.45Š| ||
| 183 | P | 48.3 | Very low | 40.7 | Very low | 101 Ų | 101 | 151.2 Ų | 151.2 | 66% | 0.656 | 79% | 0.793 | S | S | * | * | trans | -73.4 | 104.2 | 177.6 | 29 | -30.5 | 0 | 0 | 0 | 109.3 | C185 | P183-C185 PolarHBondContact O-N 2.96Å; P183-C185 VanDerWaalsContact O-N 3.11Å | ||
| 184 | Q | 44 | Very low | 40.6 | Very low | 156 Ų | 156 | 151 Ų | 151 | 73% | 0.729 | 79% | 0.794 | S | S | * | * | trans | -78.6 | 84.3 | 170.8 | -168.8 | 163.3 | 35.3 | 0 | 0 | 109.2 | Y182 F187 | Y182-Q184 PolarHBondContact O-N 3.45Å; Q184-F187 HydrophobicContact CG-CD2 4.34Å; Q184-F187 HydrophobicContact CG-CE2 4.15Å; Q184-F187 VanDerWaalsContact NE2-CE2 3.32Å | ||
| 185 | C | 44 | Very low | 40.5 | Very low | 95 Ų | 95 | 151.4 Ų | 151.4 | 64% | 0.642 | 80% | 0.798 | S | S | * | * | trans | -92.7 | 132.1 | 169.9 | -67.3 | 0 | 0 | 0 | 0 | 109.8 | P183 | P183-C185 PolarHBondContact O-N 2.96Å; P183-C185 VanDerWaalsContact O-N 3.11Å | ||
| 186 | F | 44.4 | Very low | 41.1 | Very low | 189 Ų | 189 | 152.6 Ų | 152.6 | 83% | 0.829 | 80% | 0.798 | S | S | * | * | trans | 92.9 | 64.1 | 178.1 | -48.8 | -69.4 | 0 | 0 | 0 | 117.9 | ||||
| 187 | F | 41.2 | Very low | 41.2 | Very low | 165 Ų | 165 | 148.9 Ų | 148.9 | 72% | 0.724 | 79% | 0.792 | S | S | * | * | trans | -102.1 | 117.8 | 137.8 | -76.8 | -71.5 | 0 | 0 | 0 | 109.1 | Q184 S189 | Q184-F187 HydrophobicContact CG-CD2 4.34Å; Q184-F187 HydrophobicContact CG-CE2 4.15Å; Q184-F187 VanDerWaalsContact NE2-CE2 3.32Å; F187-S189 PolarHBondContact O-N 3.49Å | ||
| 188 | L | 40.3 | Very low | 41.3 | Very low | 159 Ų | 159 | 151.8 Ų | 151.8 | 83% | 0.832 | 80% | 0.799 | S | S | * | * | trans | -62.9 | 105 | 166 | -98.1 | 69.2 | 0 | 0 | 0 | 108.5 | S190 | L188-S190 PolarHBondContact O-N 3.48Š| ||
| 189 | S | 38.3 | Very low | 41.6 | Very low | 106 Ų | 106 | 155.4 Ų | 155.4 | 74% | 0.741 | 80% | 0.8 | S | S | * | * | trans | -65.5 | 118.7 | 168.5 | -90.7 | 0 | 0 | 0 | 0 | 110.2 | F187 R191 | F187-S189 PolarHBondContact O-N 3.49Å; S189-R191 VanDerWaalsContact C-N 3.32Å; S189-R191 PolarHBondContact O-N 2.97Å | ||
| 190 | S | 46.8 | Very low | 41.2 | Very low | 124 Ų | 124 | 155.4 Ų | 155.4 | 87% | 0.867 | 80% | 0.8 | S | S | * | * | trans | -68.4 | 84.6 | 169.8 | -34.2 | 0 | 0 | 0 | 0 | 109.9 | L188 | L188-S190 PolarHBondContact O-N 3.48Š| ||
| 191 | R | 46.9 | Very low | 41.1 | Very low | 220 Ų | 220 | 153.7 Ų | 153.7 | 83% | 0.83 | 80% | 0.795 | S | S | * | * | trans | -141.2 | 72.1 | 169.7 | -72.2 | -165 | -167.9 | -106.3 | 2.9 | 112 | S189 | S189-R191 VanDerWaalsContact C-N 3.32Å; S189-R191 PolarHBondContact O-N 2.97Å | ||
| 192 | L | 41.4 | Very low | 40.8 | Very low | 181 Ų | 181 | 159.9 Ų | 159.9 | 95% | 0.948 | 80% | 0.8 | S | S | * | * | trans | -153.7 | 91.9 | 147.7 | -74.1 | -175.5 | 0 | 0 | 0 | 108.6 | ||||
| 193 | R | 41.6 | Very low | 41 | Very low | 235 Ų | 235 | 155.1 Ų | 155.1 | 89% | 0.887 | 80% | 0.798 | S | S | * | * | trans | -133.5 | 128.1 | 156.8 | -141 | -173.2 | -65.2 | -147.2 | 3.4 | 108.2 | ||||
| 194 | P | 35.1 | Very low | 40.6 | Very low | 122 Ų | 122 | 156 Ų | 156 | 79% | 0.792 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 140 | -176.7 | -16.6 | 29.8 | 0 | 0 | 0 | 112.2 | ||
| 195 | C | 37.2 | Very low | 40.4 | Very low | 127 Ų | 127 | 156.7 Ų | 156.7 | 86% | 0.858 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -76 | 131 | 167 | -61.6 | 0 | 0 | 0 | 0 | 110.3 | ||
| 196 | P | 45.4 | Very low | 40 | Very low | 114 Ų | 114 | 161.5 Ų | 161.5 | 74% | 0.74 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 153.6 | 158.5 | 33.4 | -27.9 | 0 | 0 | 0 | 110.2 | ||
| 197 | P | 38.6 | Very low | 39.6 | Very low | 127 Ų | 127 | 158.7 Ų | 158.7 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 146.9 | -174.5 | 31.1 | -32.8 | 0 | 0 | 0 | 112.2 | ||
| 198 | R | 36.9 | Very low | 39.7 | Very low | 226 Ų | 226 | 155.5 Ų | 155.5 | 85% | 0.853 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 122.9 | 176.7 | -172.6 | -179.9 | 102 | -177.8 | 7.4 | 110.3 | ||
| 199 | N | 39.9 | Very low | 39.7 | Very low | 151 Ų | 151 | 156.2 Ų | 156.2 | 81% | 0.807 | 80% | 0.8 | S | S | * | * | trans | -133.2 | 115.7 | 152.1 | 63.7 | -9.7 | 0 | 0 | 0 | 112.2 | ||||
| 200 | N | 35.7 | Very low | 39.9 | Very low | 120 Ų | 120 | 158.2 Ų | 158.2 | 64% | 0.642 | 80% | 0.802 | S | S | * | * | trans | -5.7 | 125.1 | 165.5 | -52.4 | -15.2 | 0 | 0 | 0 | 120.2 | ||||
| 201 | E | 37 | Very low | 39.2 | Very low | 182 Ų | 182 | 156.3 Ų | 156.3 | 85% | 0.85 | 79% | 0.794 | S | S | * | * | trans | 38.8 | 117.5 | 131.7 | -67.3 | 178.6 | 134.3 | 0 | 0 | 120.2 | ||||
| 202 | R | 34.3 | Very low | 38.7 | Very low | 246 Ų | 246 | 153.4 Ų | 153.4 | 93% | 0.928 | 79% | 0.794 | S | S | * | * | -163.6 | 128 | 105.8 | -106.5 | 172 | -172.3 | -173.7 | 2.4 | 111.7 | |||||
| 203 | S | 43.8 | Very low | 38.4 | Very low | 112 Ų | 112 | 153.6 Ų | 153.6 | 78% | 0.783 | 79% | 0.787 | S | S | * | * | trans | -54.9 | 142.8 | 166.5 | 54.5 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 204 | S | 40.8 | Very low | 38 | Very low | 118 Ų | 118 | 147.6 Ų | 147.6 | 83% | 0.825 | 78% | 0.782 | S | S | * | * | -173.6 | 132.8 | 118.9 | 59.6 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 205 | K | 39.1 | Very low | 37.9 | Very low | 172 Ų | 172 | 148.2 Ų | 148.2 | 75% | 0.748 | 79% | 0.789 | S | S | * | * | trans | -31.9 | 149.4 | 163.8 | -88.5 | 166.1 | 172.6 | 166.6 | 0 | 117.6 | ||||
| 206 | R | 35.2 | Very low | 37.7 | Very low | 195 Ų | 195 | 151 Ų | 151 | 74% | 0.736 | 79% | 0.789 | S | S | * | * | trans | 87.8 | 132.5 | 130.4 | -88.1 | -178.8 | -165.7 | 166.8 | 1.2 | 120.6 | ||||
| 207 | N | 37.1 | Very low | 37.3 | Very low | 131 Ų | 131 | 156.2 Ų | 156.2 | 70% | 0.701 | 79% | 0.794 | S | S | * | * | trans | 83.1 | 114.6 | 141.2 | -57.5 | -10.5 | 0 | 0 | 0 | 116.4 | ||||
| 208 | S | 42 | Very low | 36.9 | Very low | 97 Ų | 97 | 156.1 Ų | 156.1 | 68% | 0.678 | 79% | 0.791 | S | S | * | * | 82 | 131.4 | 75.3 | 88.6 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 209 | K | 40.3 | Very low | 37 | Very low | 174 Ų | 174 | 156.4 Ų | 156.4 | 76% | 0.757 | 79% | 0.792 | S | S | * | * | trans | 77.8 | 113.3 | 157.5 | -63.2 | 178.8 | -178.6 | 179 | 0 | 119.8 | ||||
| 210 | N | 42.1 | Very low | 37.4 | Very low | 148 Ų | 148 | 154.9 Ų | 154.9 | 79% | 0.791 | 79% | 0.791 | S | S | * | * | 70.7 | 137.8 | 122.4 | -48.4 | -6.6 | 0 | 0 | 0 | 121.4 | |||||
| 211 | A | 33.5 | Very low | 37.4 | Very low | 84 Ų | 84 | 158.5 Ų | 158.5 | 69% | 0.694 | 80% | 0.803 | S | S | * | * | trans | 93.1 | 109 | 136 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 212 | L | 36.3 | Very low | 37.1 | Very low | 160 Ų | 160 | 160.6 Ų | 160.6 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | 90.6 | 137.3 | 125.9 | -74.4 | 168.3 | 0 | 0 | 0 | 121.7 | |||||
| 213 | K | 34.1 | Very low | 37.3 | Very low | 184 Ų | 184 | 153.7 Ų | 153.7 | 80% | 0.8 | 79% | 0.793 | S | S | * | * | trans | 87.8 | 97.4 | 158.5 | -72.6 | 169.9 | 178.7 | -177.5 | 0 | 116.2 | ||||
| 214 | S | 33 | Very low | 37.1 | Very low | 110 Ų | 110 | 156.9 Ų | 156.9 | 77% | 0.769 | 80% | 0.795 | S | S | * | * | 77 | 115.1 | 80.9 | 69.8 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 215 | S | 33.5 | Very low | 37 | Very low | 134 Ų | 134 | 158.1 Ų | 158.1 | 94% | 0.937 | 79% | 0.791 | S | S | * | * | trans | -149.6 | 134.5 | 147.5 | -166.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 216 | E | 33.6 | Very low | 37.6 | Very low | 185 Ų | 185 | 156.1 Ų | 156.1 | 86% | 0.864 | 80% | 0.796 | S | S | * | * | trans | -100.5 | 158.3 | -159.5 | -159 | 170.2 | 176.6 | 0 | 0 | 110.9 | ||||
| 217 | R | 37.4 | Very low | 37.5 | Very low | 225 Ų | 225 | 151.7 Ų | 151.7 | 85% | 0.849 | 80% | 0.801 | S | S | * | * | trans | -61.1 | 159.8 | 174.1 | -174.1 | 176.2 | 177.8 | 162 | -1.6 | 111.6 | ||||
| 218 | T | 29.7 | Very low | 37.4 | Very low | 124 Ų | 124 | 148.5 Ų | 148.5 | 76% | 0.761 | 80% | 0.799 | S | S | * | * | 134.3 | 126.2 | 127.7 | -29.7 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 219 | R | 37.7 | Very low | 37.2 | Very low | 232 Ų | 232 | 151.4 Ų | 151.4 | 88% | 0.875 | 81% | 0.805 | S | S | * | * | trans | -63 | -180 | 161.2 | -70.3 | -179.6 | 177.7 | 171.2 | -1.3 | 110.6 | ||||
| 220 | P | 49.5 | Very low | 36.9 | Very low | 120 Ų | 120 | 153.8 Ų | 153.8 | 78% | 0.779 | 81% | 0.81 | S | S | * | * | cis | -154.4 | -172.9 | 26.8 | 40.6 | -14.7 | 0 | 0 | 0 | 119.7 | ||||
| 221 | H | 34.7 | Very low | 36.6 | Very low | 195 Ų | 195 | 155.3 Ų | 155.3 | 90% | 0.903 | 81% | 0.809 | S | S | * | * | trans | -13.3 | 146 | 166.4 | -81 | -69.7 | 0 | 0 | 0 | 122.9 | ||||
| 222 | R | 32.4 | Very low | 36.6 | Very low | 226 Ų | 226 | 156.8 Ų | 156.8 | 85% | 0.853 | 81% | 0.81 | S | S | * | * | trans | -150.5 | 131.8 | 143.9 | -161.8 | 173.5 | -176.8 | -145.6 | 0.9 | 112.5 | ||||
| 223 | S | 37.5 | Very low | 36.6 | Very low | 101 Ų | 101 | 154.1 Ų | 154.1 | 71% | 0.706 | 80% | 0.804 | S | S | * | * | trans | -86.9 | 158.9 | 178.9 | 46.9 | 0 | 0 | 0 | 0 | 113 | ||||
| 224 | Q | 38.7 | Very low | 36.6 | Very low | 179 Ų | 179 | 150.1 Ų | 150.1 | 84% | 0.836 | 80% | 0.799 | S | S | * | * | trans | -153.2 | 137.4 | 142.7 | -69.6 | -156.1 | 47.2 | 0 | 0 | 111.4 | ||||
| 225 | I | 40.1 | Very low | 36.8 | Very low | 145 Ų | 145 | 151.5 Ų | 151.5 | 74% | 0.744 | 80% | 0.803 | S | S | * | * | trans | -99.3 | 169.4 | 175.8 | -47.3 | 168.6 | 0 | 0 | 0 | 107.8 | ||||
| 226 | P | 50.7 | Low | 36.8 | Very low | 129 Ų | 129 | 149.4 Ų | 149.4 | 84% | 0.838 | 79% | 0.794 | S | S | * | * | -145.6 | 161.8 | 98.8 | 33.7 | -14.7 | 0 | 0 | 0 | 115.9 | |||||
| 227 | A | 34.4 | Very low | 37.2 | Very low | 102 Ų | 102 | 149.2 Ų | 149.2 | 84% | 0.843 | 79% | 0.793 | S | S | * | * | trans | -79.6 | 162.7 | -174.9 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 228 | G | 33.8 | Very low | 37.3 | Very low | 65 Ų | 65 | 147.6 Ų | 147.6 | 67% | 0.67 | 79% | 0.794 | S | S | * | * | trans | 169.1 | 99.6 | 157.7 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 229 | I | 38.6 | Very low | 37.6 | Very low | 157 Ų | 157 | 147.1 Ų | 147.1 | 81% | 0.805 | 80% | 0.797 | S | S | * | * | trans | 75 | 131.2 | 132.6 | -8.1 | -177.2 | 0 | 0 | 0 | 124 | ||||
| 230 | R | 33.3 | Very low | 37.5 | Very low | 225 Ų | 225 | 139.2 Ų | 139.2 | 85% | 0.849 | 79% | 0.787 | S | S | * | * | trans | 87.5 | 146.5 | 150.3 | -59.5 | -169.3 | -175.9 | -172.7 | 1.2 | 117.8 | ||||
| 231 | K | 36.4 | Very low | 37 | Very low | 179 Ų | 179 | 141.8 Ų | 141.8 | 78% | 0.778 | 79% | 0.793 | S | S | * | * | cis | 178.4 | 130.8 | -15.1 | -174.1 | 165.4 | -177.8 | -178.7 | 0 | 106 | ||||
| 232 | V | 32.6 | Very low | 36.9 | Very low | 116 Ų | 116 | 144 Ų | 144 | 70% | 0.703 | 79% | 0.793 | S | S | * | * | trans | 73.5 | 137.5 | 142.7 | 173.4 | 0 | 0 | 0 | 0 | 123 | ||||
| 233 | S | 36.4 | Very low | 36.9 | Very low | 104 Ų | 104 | 139 Ų | 139 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | trans | 73.5 | 152.5 | 151.5 | 71 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 234 | S | 35.3 | Very low | 36.6 | Very low | 99 Ų | 99 | 137.2 Ų | 137.2 | 69% | 0.692 | 79% | 0.791 | S | S | * | * | cis | -177.9 | 152.4 | -17.5 | 50.8 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 235 | V | 37.4 | Very low | 36.7 | Very low | 139 Ų | 139 | 135.2 Ų | 135.2 | 84% | 0.842 | 79% | 0.79 | S | S | * | * | trans | 37.6 | 116.2 | 140.6 | 166.5 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 236 | A | 33.4 | Very low | 37.1 | Very low | 91 Ų | 91 | 134.4 Ų | 134.4 | 75% | 0.752 | 80% | 0.795 | S | S | * | * | 170.7 | 126.6 | 108.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 237 | Q | 42 | Very low | 36.4 | Very low | 181 Ų | 181 | 134 Ų | 134 | 85% | 0.846 | 80% | 0.795 | S | S | * | * | trans | -66.7 | 149.3 | 160.6 | -60.7 | -171 | -24.4 | 0 | 0 | 109.5 | ||||
| 238 | H | 39.1 | Very low | 36.3 | Very low | 190 Ų | 190 | 132.4 Ų | 132.4 | 88% | 0.88 | 79% | 0.789 | S | S | * | * | trans | -159.9 | 129.2 | 132.5 | -96.3 | -69.6 | 0 | 0 | 0 | 110.3 | ||||
| 239 | S | 35.9 | Very low | 36.3 | Very low | 115 Ų | 115 | 134.4 Ų | 134.4 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | trans | -34.7 | 147 | 160.8 | -36.3 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 240 | G | 34.3 | Very low | 36.1 | Very low | 65 Ų | 65 | 134.9 Ų | 134.9 | 67% | 0.67 | 80% | 0.796 | S | S | * | * | 123.8 | 162.9 | 53.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | |||||
| 241 | L | 40.8 | Very low | 36 | Very low | 175 Ų | 175 | 129 Ų | 129 | 92% | 0.916 | 79% | 0.789 | S | S | * | * | trans | 84.9 | 101.3 | 175.6 | -49.7 | 169.6 | 0 | 0 | 0 | 113.8 | ||||
| 242 | R | 32.3 | Very low | 35.8 | Very low | 240 Ų | 240 | 127.4 Ų | 127.4 | 91% | 0.906 | 79% | 0.794 | S | S | * | * | 70.1 | 131.2 | 55 | -159.7 | -177.4 | -170.1 | -143 | 3.9 | 113.8 | |||||
| 243 | S | 31.7 | Very low | 35.9 | Very low | 123 Ų | 123 | 127.9 Ų | 127.9 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | trans | 85 | 136.1 | 164.3 | -158.9 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 244 | G | 31.1 | Very low | 35.6 | Very low | 63 Ų | 63 | 128.1 Ų | 128.1 | 65% | 0.649 | 80% | 0.798 | S | S | * | * | cis | 174.2 | 161.5 | 9.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 245 | V | 41.9 | Very low | 35.4 | Very low | 136 Ų | 136 | 129 Ų | 129 | 82% | 0.824 | 81% | 0.805 | S | S | * | * | trans | -52.4 | 162.8 | 178.3 | -176.5 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 246 | P | 48.1 | Very low | 35.3 | Very low | 128 Ų | 128 | 128.3 Ų | 128.3 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | trans | -132.3 | 154.7 | 134.6 | 36.1 | -24.2 | 0 | 0 | 0 | 114.5 | ||||
| 247 | S | 35.9 | Very low | 35.1 | Very low | 122 Ų | 122 | 130.3 Ų | 130.3 | 85% | 0.853 | 81% | 0.813 | S | S | * | * | trans | -130.6 | 145.2 | 177.1 | -170 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 248 | G | 31.3 | Very low | 34.8 | Very low | 68 Ų | 68 | 126.3 Ų | 126.3 | 70% | 0.701 | 81% | 0.805 | S | S | * | * | trans | 86.2 | 148.4 | 166.9 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 249 | S | 34.9 | Very low | 34.8 | Very low | 107 Ų | 107 | 123.1 Ų | 123.1 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | cis | 179.9 | 171.1 | -5.4 | 35 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 250 | L | 34.9 | Very low | 34.8 | Very low | 167 Ų | 167 | 126.9 Ų | 126.9 | 87% | 0.874 | 81% | 0.806 | S | S | * | * | trans | 83.1 | 146.6 | 168.5 | -49.7 | 170.5 | 0 | 0 | 0 | 116.4 | ||||
| 251 | S | 30.6 | Very low | 35.1 | Very low | 102 Ų | 102 | 128.8 Ų | 128.8 | 71% | 0.713 | 81% | 0.807 | S | S | * | * | cis | -176.4 | 162.5 | -21.2 | 60.3 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 252 | V | 31.5 | Very low | 35 | Very low | 144 Ų | 144 | 126.2 Ų | 126.2 | 87% | 0.873 | 80% | 0.804 | S | S | * | * | trans | 139.7 | 135.7 | 155.1 | 171.7 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 253 | V | 34.2 | Very low | 35.8 | Very low | 126 Ų | 126 | 123.3 Ų | 123.3 | 76% | 0.764 | 80% | 0.8 | S | S | * | * | trans | -100.8 | 158.4 | -161.9 | 141.5 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 254 | S | 31.4 | Very low | 36.9 | Very low | 109 Ų | 109 | 122 Ų | 122 | 76% | 0.762 | 80% | 0.796 | S | S | * | * | trans | 107.9 | 130.4 | 162.8 | -53.9 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 255 | S | 31.1 | Very low | 37.8 | Very low | 119 Ų | 119 | 127 Ų | 127 | 83% | 0.832 | 80% | 0.801 | S | S | * | * | cis | -159.9 | 151.1 | 29.5 | 40.9 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 256 | S | 35.4 | Very low | 39.1 | Very low | 124 Ų | 124 | 123.6 Ų | 123.6 | 87% | 0.867 | 78% | 0.783 | S | S | * | * | trans | -50.4 | 141.5 | -179.6 | -40.1 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 257 | C | 29.7 | Very low | 40.1 | Very low | 133 Ų | 133 | 123.4 Ų | 123.4 | 90% | 0.899 | 77% | 0.774 | S | S | * | * | -157.8 | 143.7 | 118.3 | 71.4 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 258 | S | 34.8 | Very low | 41.8 | Very low | 96 Ų | 96 | 122.3 Ų | 122.3 | 67% | 0.671 | 76% | 0.762 | S | S | * | * | trans | -91.7 | 144.9 | -160.6 | 49.3 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 259 | S | 38 | Very low | 43.5 | Very low | 123 Ų | 123 | 125.9 Ų | 125.9 | 86% | 0.86 | 76% | 0.761 | S | S | * | * | trans | -158.4 | 140.2 | 137.4 | -80 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 260 | F | 36 | Very low | 45.3 | Very low | 194 Ų | 194 | 125.4 Ų | 125.4 | 85% | 0.851 | 75% | 0.747 | S | S | * | * | trans | -74.7 | 168.2 | -154.1 | -79.8 | -88.1 | 0 | 0 | 0 | 117.1 | ||||
| 261 | P | 42.2 | Very low | 47.1 | Very low | 106 Ų | 106 | 120.1 Ų | 120.1 | 69% | 0.688 | 72% | 0.722 | S | S | * | * | trans | -104.1 | 152.5 | -142.9 | 38.8 | -34.3 | 0 | 0 | 0 | 114.6 | ||||
| 262 | S | 37.5 | Very low | 49 | Very low | 121 Ų | 121 | 121.5 Ų | 121.5 | 85% | 0.846 | 72% | 0.717 | S | S | * | * | trans | -79.4 | 112.2 | 153.6 | -55.1 | 0 | 0 | 0 | 0 | 108.3 | A264 | S262-A264 PolarHBondContact O-N 3Š| ||
| 263 | Q | 50.3 | Low | 50.7 | Low | 178 Ų | 178 | 120.9 Ų | 120.9 | 83% | 0.832 | 70% | 0.703 | S | S | * | * | trans | -68.9 | 97 | 179.8 | -174.2 | 175.2 | 22.1 | 0 | 0 | 110.2 | ||||
| 264 | A | 53.9 | Low | 52.2 | Low | 95 Ų | 95 | 119.2 Ų | 119.2 | 79% | 0.785 | 69% | 0.688 | S | S | * | * | trans | -77.1 | 122.3 | 170 | 0 | 0 | 0 | 0 | 0 | 109.5 | S262 S266 | S262-A264 PolarHBondContact O-N 3Å; A264-S266 PolarHBondContact O-N 3.08Å | ||
| 265 | F | 49.7 | Very low | 53.8 | Low | 169 Ų | 169 | 120.6 Ų | 120.6 | 74% | 0.741 | 68% | 0.682 | S | S | * | * | trans | -79.9 | 105.7 | 179 | -141.4 | -90.9 | 0 | 0 | 0 | 108.8 | M270 | F265-M270 HydrophobicContact CE1-SD 4.37Š| ||
| 266 | S | 70.2 | Confident | 54.9 | Low | 64 Ų | 64 | 120.2 Ų | 120.2 | 45% | 0.448 | 68% | 0.675 | S | S | . | * | trans | -97.5 | 114.8 | 176 | -158.6 | 0 | 0 | 0 | 0 | 110 | A264 T268 Q269 | A264-S266 PolarHBondContact O-N 3.08Å; S266-T268 PolarHBondContact O-N 3.07Å; S266-T268 PolarHBondContact OG-OG1 3.12Å; S266-Q269 PolarHBondContact O-N 3.41Å; S266-Q269 VanDerWaalsContact O-N 3.13Å | ||
| 267 | I | 69 | Low | 55.5 | Low | 124 Ų | 124 | 124.5 Ų | 124.5 | 64% | 0.636 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -58.7 | -34 | -178.4 | -63.1 | 168.5 | 0 | 0 | 0 | 111.1 | Q269 M270 V271 | I267-Q269 VanDerWaalsContact C-N 3.32Å; I267-Q269 PolarHBondContact O-N 3.23Å; I267-M270 PolarHBondContact O-N 3.29Å; I267-V271 PolarHBondContact O-N 2.91Å |
| 268 | T | 71.4 | Confident | 56.5 | Low | 100 Ų | 100 | 122.8 Ų | 122.8 | 61% | 0.613 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -61.8 | -36.5 | 177.9 | 46.6 | 0 | 0 | 0 | 0 | 113.1 | S266 M270 V271 E272 | S266-T268 PolarHBondContact O-N 3.07Å; S266-T268 PolarHBondContact OG-OG1 3.12Å; T268-M270 VanDerWaalsContact C-N 3.31Å; T268-M270 PolarHBondContact O-N 3.38Å; T268-V271 PolarHBondContact O-N 2.94Å; T268-E272 WeakPolarHBondContact O-CB 3.47Å; T268-E272 PolarHBondContact O-N 3.2Å; T268-E272 VanDerWaalsContact O-N 3.07Å |
| 269 | Q | 66.6 | Low | 56.7 | Low | 143 Ų | 143 | 122.2 Ų | 122.2 | 67% | 0.668 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -71.1 | -28.9 | 178.5 | -171 | 179.4 | 70.1 | 0 | 0 | 112.3 | S266 I267 K273 | S266-Q269 PolarHBondContact O-N 3.41Å; S266-Q269 VanDerWaalsContact O-N 3.13Å; I267-Q269 VanDerWaalsContact C-N 3.32Å; I267-Q269 PolarHBondContact O-N 3.23Å; Q269-K273 WeakPolarHBondContact O-CB 3.46Å; Q269-K273 PolarHBondContact O-N 3.14Å |
| 270 | M | 73.9 | Confident | 56.9 | Low | 96 Ų | 96 | 122.5 Ų | 122.5 | 47% | 0.473 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -73.3 | -40.1 | 176 | -167.6 | 175.6 | 62.7 | 0 | 0 | 110.9 | F265 I267 T268 K273 M274 | F265-M270 HydrophobicContact CE1-SD 4.37Å; I267-M270 PolarHBondContact O-N 3.29Å; T268-M270 VanDerWaalsContact C-N 3.31Å; T268-M270 PolarHBondContact O-N 3.38Å; M270-K273 PolarHBondContact O-N 3.44Å; M270-M274 HydrophobicContact CB-CE 4.41Å; M270-M274 HydrophobicContact CE-CE 4.07Å; M270-M274 HydrophobicContact CG-CE 3.99Å; M270-M274 WeakPolarHBondContact O-CG 3.48Å; M270-M274 PolarHBondContact O-N 2.95Å |
| 271 | V | 72.4 | Confident | 56.8 | Low | 57 Ų | 57 | 119.1 Ų | 119.1 | 35% | 0.345 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -65.1 | -45.8 | 178.1 | 176.3 | 0 | 0 | 0 | 0 | 111.3 | I267 T268 K273 M274 E275 | I267-V271 PolarHBondContact O-N 2.91Å; T268-V271 PolarHBondContact O-N 2.94Å; V271-K273 VanDerWaalsContact C-N 3.25Å; V271-K273 PolarHBondContact O-N 3.06Å; V271-M274 VanDerWaalsContact CA-CE 3.49Å; V271-M274 HydrophobicContact CB-CE 4.14Å; V271-M274 HydrophobicContact CG2-CE 3.62Å; V271-M274 HydrophobicContact CG2-SD 4.42Å; V271-M274 WeakPolarHBondContact O-CG 2.99Å; V271-M274 PolarHBondContact O-N 3.39Å; V271-M274 VanDerWaalsContact O-N 3.13Å; V271-E275 PolarHBondContact O-N 2.96Å |
| 272 | E | 70.5 | Confident | 56.3 | Low | 130 Ų | 130 | 118.2 Ų | 118.2 | 61% | 0.607 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -60.6 | -36.7 | 176 | -168.1 | 173.6 | -172.6 | 0 | 0 | 111.8 | T268 M274 E275 T276 | T268-E272 WeakPolarHBondContact O-CB 3.47Å; T268-E272 PolarHBondContact O-N 3.2Å; T268-E272 VanDerWaalsContact O-N 3.07Å; E272-M274 PolarHBondContact O-N 3.42Å; E272-E275 PolarHBondContact O-N 3.32Å; E272-T276 PolarHBondContact O-N 2.98Å; E272-T276 PolarHBondContact O-OG1 2.92Å |
| 273 | K | 67 | Low | 55.9 | Low | 132 Ų | 132 | 118.4 Ų | 118.4 | 57% | 0.574 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -68.2 | -31.6 | 177.3 | -173 | 170 | 176.1 | 162 | 0 | 113.5 | Q269 M270 V271 T276 | Q269-K273 WeakPolarHBondContact O-CB 3.46Å; Q269-K273 PolarHBondContact O-N 3.14Å; M270-K273 PolarHBondContact O-N 3.44Å; V271-K273 VanDerWaalsContact C-N 3.25Å; V271-K273 PolarHBondContact O-N 3.06Å; K273-T276 WeakPolarHBondContact CA-OG1 3.37Å; K273-T276 PolarHBondContact O-OG1 3.23Å; K273-T276 VanDerWaalsContact O-OG1 3.06Å |
| 274 | M | 65.1 | Low | 54.9 | Low | 91 Ų | 91 | 115.5 Ų | 115.5 | 45% | 0.448 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -72.8 | -37.7 | 176.3 | -16.9 | 166 | 174.5 | 0 | 0 | 111.4 | M270 V271 E272 W277 S278 | M270-M274 HydrophobicContact CB-CE 4.41Å; M270-M274 HydrophobicContact CE-CE 4.07Å; M270-M274 HydrophobicContact CG-CE 3.99Å; M270-M274 WeakPolarHBondContact O-CG 3.48Å; M270-M274 PolarHBondContact O-N 2.95Å; V271-M274 VanDerWaalsContact CA-CE 3.49Å; V271-M274 HydrophobicContact CB-CE 4.14Å; V271-M274 HydrophobicContact CG2-CE 3.62Å; V271-M274 HydrophobicContact CG2-SD 4.42Å; V271-M274 WeakPolarHBondContact O-CG 2.99Å; V271-M274 PolarHBondContact O-N 3.39Å; V271-M274 VanDerWaalsContact O-N 3.13Å; E272-M274 PolarHBondContact O-N 3.42Å; M274-W277 PolarHBondContact O-N 2.96Å; M274-S278 PolarHBondContact O-OG 3.48Å |
| 275 | E | 64.7 | Low | 54.1 | Low | 138 Ų | 138 | 121.7 Ų | 121.7 | 65% | 0.645 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -69.5 | -34.7 | -178.3 | -71.5 | 179.7 | 158.4 | 0 | 0 | 111.7 | V271 E272 W277 S278 | V271-E275 PolarHBondContact O-N 2.96Å; E272-E275 PolarHBondContact O-N 3.32Å; E275-W277 VanDerWaalsContact C-N 3.27Å; E275-W277 PolarHBondContact O-N 3.24Å; E275-S278 PolarHBondContact O-N 3.1Å |
| 276 | T | 55.6 | Low | 53.4 | Low | 110 Ų | 110 | 118.5 Ų | 118.5 | 68% | 0.675 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.6 | -19 | 173.1 | 27.8 | 0 | 0 | 0 | 0 | 115.4 | E272 K273 | E272-T276 PolarHBondContact O-N 2.98Å; E272-T276 PolarHBondContact O-OG1 2.92Å; K273-T276 WeakPolarHBondContact CA-OG1 3.37Å; K273-T276 PolarHBondContact O-OG1 3.23Å; K273-T276 VanDerWaalsContact O-OG1 3.06Å |
| 277 | W | 48 | Very low | 51.8 | Low | 214 Ų | 214 | 123.6 Ų | 123.6 | 81% | 0.811 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.6 | -1 | 177.3 | -91.1 | -21.3 | 0 | 0 | 0 | 114.5 | M274 E275 | M274-W277 PolarHBondContact O-N 2.96Å; E275-W277 VanDerWaalsContact C-N 3.27Å; E275-W277 PolarHBondContact O-N 3.24Å |
| 278 | S | 49.5 | Very low | 50.2 | Low | 97 Ų | 97 | 123.6 Ų | 123.6 | 68% | 0.678 | 69% | 0.689 | S | S | * | * | trans | -111.8 | 15.7 | -171 | -58.9 | 0 | 0 | 0 | 0 | 115.4 | M274 E275 | M274-S278 PolarHBondContact O-OG 3.48Å; E275-S278 PolarHBondContact O-N 3.1Å | ||
| 279 | A | 38.6 | Very low | 48.3 | Very low | 85 Ų | 85 | 126.7 Ų | 126.7 | 70% | 0.702 | 70% | 0.696 | S | S | * | * | trans | -95.7 | 119.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | S281 | A279-S281 PolarHBondContact O-N 2.64Š| ||
| 280 | P | 42.7 | Very low | 46.5 | Very low | 128 Ų | 128 | 127.4 Ų | 127.4 | 83% | 0.831 | 70% | 0.699 | S | S | * | * | trans | -79.5 | 114.1 | 174.1 | 30.7 | -28.4 | 0 | 0 | 0 | 109.7 | ||||
| 281 | S | 33.6 | Very low | 44.3 | Very low | 124 Ų | 124 | 134.7 Ų | 134.7 | 87% | 0.867 | 72% | 0.722 | S | S | * | * | trans | -75.8 | 125.2 | 170.1 | -174 | 0 | 0 | 0 | 0 | 110.1 | A279 | A279-S281 PolarHBondContact O-N 2.64Š| ||
| 282 | A | 33 | Very low | 42.4 | Very low | 87 Ų | 87 | 135.1 Ų | 135.1 | 72% | 0.719 | 73% | 0.727 | S | S | * | * | trans | -74.8 | 155.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 283 | C | 28.2 | Very low | 40.4 | Very low | 125 Ų | 125 | 140.6 Ų | 140.6 | 85% | 0.845 | 74% | 0.742 | S | S | * | * | trans | 70.5 | 114.9 | 165.3 | -79.4 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 284 | S | 30.1 | Very low | 38.6 | Very low | 116 Ų | 116 | 140 Ų | 140 | 81% | 0.811 | 76% | 0.755 | S | S | * | * | 179.9 | 148.8 | 84.8 | 47.3 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 285 | Y | 35.5 | Very low | 37.2 | Very low | 226 Ų | 226 | 141.4 Ų | 141.4 | 89% | 0.886 | 77% | 0.774 | S | S | * | * | trans | -74.6 | 122.7 | 179.3 | -171.8 | -91.7 | 0 | 0 | 0 | 110.8 | ||||
| 286 | S | 35.4 | Very low | 35.5 | Very low | 102 Ų | 102 | 144.8 Ų | 144.8 | 71% | 0.713 | 78% | 0.78 | S | S | * | * | trans | -162.4 | 116.9 | 152 | 53.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 287 | K | 38 | Very low | 34.6 | Very low | 171 Ų | 171 | 148 Ų | 148 | 74% | 0.743 | 79% | 0.793 | S | S | * | * | trans | -64.1 | 148 | 164 | -158 | 179.3 | -170.8 | -175.7 | 0 | 109 | ||||
| 288 | P | 34.8 | Very low | 33.9 | Very low | 124 Ų | 124 | 142.8 Ų | 142.8 | 81% | 0.805 | 78% | 0.78 | S | S | * | * | -143.8 | 164.3 | 125.3 | 27.2 | -7.3 | 0 | 0 | 0 | 115.1 | |||||
| 289 | E | 30.9 | Very low | 33.3 | Very low | 164 Ų | 164 | 146.3 Ų | 146.3 | 77% | 0.766 | 79% | 0.792 | S | S | * | * | trans | -84.7 | 162.1 | -164.4 | -58.9 | -178.1 | 141.5 | 0 | 0 | 114.7 | ||||
| 290 | H | 30.1 | Very low | 33.2 | Very low | 159 Ų | 159 | 149.8 Ų | 149.8 | 74% | 0.736 | 80% | 0.798 | S | S | * | * | trans | -27.8 | 125.5 | 153.7 | 179.4 | -94.8 | 0 | 0 | 0 | 115.9 | S292 | H290-S292 PolarHBondContact NE2-OG 2.88Š| ||
| 291 | W | 26.3 | Very low | 32.8 | Very low | 249 Ų | 249 | 148.7 Ų | 148.7 | 94% | 0.943 | 80% | 0.8 | S | S | * | * | trans | -139.9 | 121.8 | 147.1 | -156.4 | -70 | 0 | 0 | 0 | 110.6 | ||||
| 292 | S | 33 | Very low | 33.1 | Very low | 66 Ų | 66 | 152.5 Ų | 152.5 | 46% | 0.462 | 80% | 0.804 | S | S | . | * | trans | -87.9 | 152.8 | 175.5 | -78.3 | 0 | 0 | 0 | 0 | 112 | H290 | H290-S292 PolarHBondContact NE2-OG 2.88Š| ||
| 293 | R | 29.1 | Very low | 33 | Very low | 244 Ų | 244 | 152.2 Ų | 152.2 | 92% | 0.921 | 81% | 0.81 | S | S | * | * | trans | 70.2 | 120.6 | 151.7 | -81.6 | 177.5 | 141.1 | 167.4 | -4.9 | 118.9 | ||||
| 294 | S | 29.6 | Very low | 33.6 | Very low | 121 Ų | 121 | 155.2 Ų | 155.2 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | -154.5 | 116.9 | 128.3 | -174 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 295 | S | 34.8 | Very low | 33.8 | Very low | 120 Ų | 120 | 156.3 Ų | 156.3 | 84% | 0.839 | 81% | 0.805 | S | S | * | * | trans | -161.8 | 89.5 | 140.4 | 62.8 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 296 | R | 28.7 | Very low | 33.8 | Very low | 208 Ų | 208 | 153.1 Ų | 153.1 | 79% | 0.785 | 80% | 0.802 | S | S | * | * | trans | -94.8 | 127.5 | 160.8 | -75.5 | -170.8 | 179.4 | -148.7 | 3.2 | 107.7 | D298 | R296-D298 IonicContact NH1-OD2 3.52Š| ||
| 297 | L | 37.6 | Very low | 33.6 | Very low | 179 Ų | 179 | 156 Ų | 156 | 94% | 0.937 | 81% | 0.806 | S | S | * | * | trans | -126.6 | 111.9 | 143.7 | -82.3 | 175.1 | 0 | 0 | 0 | 105.7 | ||||
| 298 | D | 33.3 | Very low | 33.4 | Very low | 103 Ų | 103 | 153 Ų | 153 | 55% | 0.551 | 80% | 0.802 | S | S | * | * | trans | -80.6 | 150.3 | 168.6 | -69.5 | -57 | 0 | 0 | 0 | 109.1 | R296 | R296-D298 IonicContact NH1-OD2 3.52Š| ||
| 299 | N | 36.2 | Very low | 33.3 | Very low | 172 Ų | 172 | 153.6 Ų | 153.6 | 92% | 0.92 | 80% | 0.799 | S | S | * | * | trans | -161.9 | 121.3 | 142.4 | -89.4 | -37 | 0 | 0 | 0 | 109 | ||||
| 300 | D | 35.6 | Very low | 33.3 | Very low | 157 Ų | 157 | 154.4 Ų | 154.4 | 84% | 0.84 | 80% | 0.802 | S | S | * | * | trans | -74.3 | 153.7 | -179.5 | -60.7 | -77.2 | 0 | 0 | 0 | 113.8 | ||||
| 301 | A | 34.7 | Very low | 33.2 | Very low | 105 Ų | 105 | 150.7 Ų | 150.7 | 87% | 0.868 | 80% | 0.799 | S | S | * | * | trans | -160.4 | 127.1 | 147.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 302 | E | 39.4 | Very low | 33.4 | Very low | 205 Ų | 205 | 146.2 Ų | 146.2 | 96% | 0.958 | 79% | 0.794 | S | S | * | * | trans | -59.5 | 161.2 | 174.1 | -73.2 | 175.8 | 110.6 | 0 | 0 | 114.9 | ||||
| 303 | G | 32.8 | Very low | 33.4 | Very low | 81 Ų | 81 | 149.1 Ų | 149.1 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | trans | 169.4 | 115.3 | 154.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 304 | K | 40.7 | Very low | 33.8 | Very low | 188 Ų | 188 | 142.9 Ų | 142.9 | 82% | 0.817 | 80% | 0.8 | S | S | * | * | trans | -83.8 | 154.1 | -178.8 | -86.1 | 173.5 | 175.5 | 167.6 | 0 | 114.5 | ||||
| 305 | D | 34.1 | Very low | 33.8 | Very low | 139 Ų | 139 | 146.3 Ų | 146.3 | 74% | 0.743 | 80% | 0.799 | S | S | * | * | trans | 67.3 | 146.8 | 143.1 | -56.7 | -26.5 | 0 | 0 | 0 | 123.2 | ||||
| 306 | I | 35.6 | Very low | 33.5 | Very low | 159 Ų | 159 | 147.8 Ų | 147.8 | 82% | 0.815 | 80% | 0.798 | S | S | * | * | trans | 123.8 | 101.5 | 145.7 | -57.6 | 176.7 | 0 | 0 | 0 | 117 | ||||
| 307 | M | 31.4 | Very low | 33.8 | Very low | 161 Ų | 161 | 143.1 Ų | 143.1 | 79% | 0.793 | 80% | 0.797 | S | S | * | * | 33.3 | 128.3 | 128 | -78.7 | 168.3 | 56.3 | 0 | 0 | 124.8 | |||||
| 308 | V | 33.1 | Very low | 33.5 | Very low | 109 Ų | 109 | 140.7 Ų | 140.7 | 66% | 0.661 | 79% | 0.79 | S | S | * | * | 79.8 | 142.3 | 119.3 | 178.5 | 0 | 0 | 0 | 0 | 122.1 | |||||
| 309 | D | 31.6 | Very low | 33.3 | Very low | 137 Ų | 137 | 141.3 Ų | 141.3 | 73% | 0.733 | 80% | 0.801 | S | S | * | * | trans | 78.5 | 117 | 166.4 | -70.6 | -20 | 0 | 0 | 0 | 118.5 | ||||
| 310 | Q | 32.3 | Very low | 33.2 | Very low | 181 Ų | 181 | 140.7 Ų | 140.7 | 85% | 0.846 | 80% | 0.797 | S | S | * | * | 88.9 | 137.9 | 55.3 | -167.2 | 162.1 | 57.5 | 0 | 0 | 112.7 | |||||
| 311 | A | 27.6 | Very low | 33.8 | Very low | 81 Ų | 81 | 138.9 Ų | 138.9 | 67% | 0.669 | 79% | 0.794 | S | S | * | * | trans | 88.6 | 126.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 312 | D | 30.6 | Very low | 34.2 | Very low | 155 Ų | 155 | 137 Ų | 137 | 83% | 0.829 | 79% | 0.785 | S | S | * | * | cis | -150.2 | 148.7 | 26.7 | -83.2 | -56.7 | 0 | 0 | 0 | 112 | ||||
| 313 | T | 33.5 | Very low | 34.5 | Very low | 127 Ų | 127 | 138.3 Ų | 138.3 | 78% | 0.779 | 78% | 0.781 | S | S | * | * | trans | -111.2 | 148.5 | 153.8 | 53.4 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 314 | P | 36.7 | Very low | 35.5 | Very low | 112 Ų | 112 | 138 Ų | 138 | 73% | 0.727 | 76% | 0.76 | S | S | * | * | -138.1 | 134.5 | 107.1 | 24.2 | -5.1 | 0 | 0 | 0 | 111.9 | |||||
| 315 | K | 30.5 | Very low | 36.3 | Very low | 194 Ų | 194 | 135.7 Ų | 135.7 | 84% | 0.843 | 76% | 0.756 | S | S | * | * | 45.1 | 120.1 | 104 | -62.5 | -178.4 | -179.6 | 172 | 0 | 111.9 | |||||
| 316 | D | 27.9 | Very low | 37.4 | Very low | 150 Ų | 150 | 133.5 Ų | 133.5 | 80% | 0.802 | 74% | 0.743 | S | S | * | * | cis | -179.4 | 137.3 | 48.9 | -165 | 5.9 | 0 | 0 | 0 | 107.9 | ||||
| 317 | S | 34 | Very low | 38.2 | Very low | 110 Ų | 110 | 131.2 Ų | 131.2 | 77% | 0.769 | 73% | 0.727 | S | S | * | * | trans | 166.4 | 100.4 | 139.6 | 69.6 | 0 | 0 | 0 | 0 | 109.6 | C319 | S317-C319 PolarHBondContact O-N 3.43Š| ||
| 318 | T | 31.8 | Very low | 39.4 | Very low | 128 Ų | 128 | 130.7 Ų | 130.7 | 79% | 0.785 | 73% | 0.728 | S | S | * | * | trans | -49 | 128.4 | 154.1 | -59.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 319 | C | 29.1 | Very low | 40.6 | Very low | 116 Ų | 116 | 131.9 Ų | 131.9 | 78% | 0.784 | 73% | 0.73 | S | S | * | * | 170.1 | 128.4 | 128.3 | -86.1 | 0 | 0 | 0 | 0 | 112.7 | S317 | S317-C319 PolarHBondContact O-N 3.43Š| |||
| 320 | D | 34.1 | Very low | 41.6 | Very low | 159 Ų | 159 | 130 Ų | 130 | 85% | 0.85 | 72% | 0.719 | S | S | * | * | trans | 77.7 | 125.9 | 156 | -93.6 | -29.9 | 0 | 0 | 0 | 122.8 | ||||
| 321 | P | 49.1 | Very low | 42.5 | Very low | 119 Ų | 119 | 126.9 Ų | 126.9 | 77% | 0.773 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -83.2 | 143.3 | 169.2 | 35.5 | -28.3 | 0 | 0 | 0 | 109.9 | ||
| 322 | G | 42.6 | Very low | 43.5 | Very low | 65 Ų | 65 | 130.3 Ų | 130.3 | 67% | 0.67 | 72% | 0.722 | S | S | * | * | trans | 101.3 | 75.5 | 162.4 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 323 | R | 46.1 | Very low | 44.7 | Very low | 234 Ų | 234 | 125.3 Ų | 125.3 | 88% | 0.883 | 70% | 0.697 | S | S | * | * | trans | -136 | 84.5 | 145.3 | -57.8 | -167.5 | -66.5 | -176.8 | -0.2 | 106.9 | I325 | R323-I325 PolarHBondContact O-N 3.34Š| ||
| 324 | D | 54 | Low | 45.7 | Very low | 73 Ų | 73 | 128.9 Ų | 128.9 | 39% | 0.39 | 70% | 0.702 | S | S | . | * | trans | -60.2 | 104.6 | 169.3 | -60.6 | -47.1 | 0 | 0 | 0 | 106.7 | L326 K327 | D324-L326 PolarHBondContact O-N 3.27Å; D324-K327 HydrophobicContact CB-CB 4.37Å; D324-K327 HydrophobicContact CB-CD 3.93Å; D324-K327 HydrophobicContact CB-CG 3.89Å; D324-K327 WeakPolarHBondContact O-CB 3.32Å; D324-K327 PolarHBondContact O-N 3.45Å; D324-K327 WeakPolarHBondContact OD2-CE 3.26Å; D324-K327 IonicContact OD2-NZ 3.42Å; D324-K327 PolarHBondContact OD2-NZ 3.42Å | ||
| 325 | I | 57.1 | Low | 46.7 | Very low | 141 Ų | 141 | 128.7 Ų | 128.7 | 72% | 0.723 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -54.2 | -21.2 | 177.1 | -61.9 | 169.3 | 0 | 0 | 0 | 111 | R323 | R323-I325 PolarHBondContact O-N 3.34Å |
| 326 | L | 56.7 | Low | 47.5 | Very low | 93 Ų | 93 | 122.7 Ų | 122.7 | 49% | 0.487 | 68% | 0.681 | S | S | . | * | H | α-helix | trans | -73.1 | -20 | 173.7 | -81.2 | 158.5 | 0 | 0 | 0 | 115 | D324 Y341 | D324-L326 PolarHBondContact O-N 3.27Å; L326-Y341 HydrophobicContact CB-CE1 4.25Å; L326-Y341 HydrophobicContact CD1-CD2 4.49Å; L326-Y341 HydrophobicContact CD1-CE1 4.41Å; L326-Y341 HydrophobicContact CD1-CE2 4.06Å |
| 327 | K | 53.4 | Low | 48.7 | Very low | 110 Ų | 110 | 121.9 Ų | 121.9 | 48% | 0.478 | 68% | 0.684 | S | S | . | * | H | α-helix | trans | -79.4 | -27.3 | 177.2 | -75.1 | 177.3 | 176.5 | 154.8 | 0 | 113 | D324 | D324-K327 HydrophobicContact CB-CB 4.37Å; D324-K327 HydrophobicContact CB-CD 3.93Å; D324-K327 HydrophobicContact CB-CG 3.89Å; D324-K327 WeakPolarHBondContact O-CB 3.32Å; D324-K327 PolarHBondContact O-N 3.45Å; D324-K327 WeakPolarHBondContact OD2-CE 3.26Å; D324-K327 IonicContact OD2-NZ 3.42Å; D324-K327 PolarHBondContact OD2-NZ 3.42Å |
| 328 | D | 54.7 | Low | 49.8 | Very low | 151 Ų | 151 | 121.8 Ų | 121.8 | 81% | 0.807 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -78.2 | -21.7 | 179.2 | -87.5 | -5.9 | 0 | 0 | 0 | 113.3 | ||
| 329 | L | 59.1 | Low | 50.9 | Low | 133 Ų | 133 | 118.6 Ų | 118.6 | 70% | 0.696 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -84.8 | -22.3 | -179.9 | -77.8 | 154.8 | 0 | 0 | 0 | 113.1 | ||
| 330 | L | 53.1 | Low | 52.3 | Low | 97 Ų | 97 | 119.1 Ų | 119.1 | 51% | 0.508 | 67% | 0.665 | S | S | . | * | trans | -149.9 | 89.8 | -175 | -71.7 | 156.4 | 0 | 0 | 0 | 110.1 | D332 T333 | L330-D332 PolarHBondContact O-N 3.44Å; L330-T333 HydrophobicContact CB-CG2 4.13Å | ||
| 331 | P | 50.1 | Low | 53.4 | Low | 117 Ų | 117 | 117.9 Ų | 117.9 | 76% | 0.76 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.2 | -5.9 | -172 | 23 | -32.1 | 0 | 0 | 0 | 115.7 | ||
| 332 | D | 49.2 | Very low | 54 | Low | 153 Ų | 153 | 115.7 Ų | 115.7 | 82% | 0.818 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114 | 12.8 | -172 | -69.5 | -30.2 | 0 | 0 | 0 | 115.8 | L330 K334 | L330-D332 PolarHBondContact O-N 3.44Å; D332-K334 PolarHBondContact O-N 3.01Å |
| 333 | T | 56.5 | Low | 54.9 | Low | 50 Ų | 50 | 116.8 Ų | 116.8 | 31% | 0.307 | 64% | 0.639 | S | S | . | * | trans | -89.6 | 98.7 | 178.1 | 61 | 0 | 0 | 0 | 0 | 112 | L330 T335 | L330-T333 HydrophobicContact CB-CG2 4.13Å; T333-T335 PolarHBondContact O-N 3.02Å | ||
| 334 | K | 55 | Low | 55.7 | Low | 202 Ų | 202 | 111.2 Ų | 111.2 | 88% | 0.878 | 63% | 0.633 | S | S | * | * | trans | -62.1 | 126.4 | 167.6 | 60.5 | 174.4 | -176.2 | 149.6 | 0 | 110.9 | D332 S336 | D332-K334 PolarHBondContact O-N 3.01Å; K334-S336 PolarHBondContact O-N 3.08Å | ||
| 335 | T | 56.5 | Low | 56 | Low | 107 Ų | 107 | 118.6 Ų | 118.6 | 66% | 0.656 | 66% | 0.656 | S | S | * | * | trans | -63.4 | 114.4 | 179.8 | -44.2 | 0 | 0 | 0 | 0 | 110.6 | T333 | T333-T335 PolarHBondContact O-N 3.02Š| ||
| 336 | S | 47.3 | Very low | 56.5 | Low | 68 Ų | 68 | 123 Ų | 123 | 48% | 0.476 | 66% | 0.663 | S | S | . | * | trans | -78.5 | 136.5 | 168.6 | -176.9 | 0 | 0 | 0 | 0 | 109.1 | K334 T338 G339 | K334-S336 PolarHBondContact O-N 3.08Å; S336-T338 PolarHBondContact O-N 2.71Å; S336-G339 PolarHBondContact O-N 3.35Å | ||
| 337 | P | 52.8 | Low | 56.8 | Low | 133 Ų | 133 | 124 Ų | 124 | 86% | 0.864 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | 10.3 | -170.6 | 26.6 | -34.2 | 0 | 0 | 0 | 115.5 | ||
| 338 | T | 57.3 | Low | 57.3 | Low | 108 Ų | 108 | 126 Ų | 126 | 66% | 0.663 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.4 | 7.1 | -179.8 | -33.4 | 0 | 0 | 0 | 0 | 113.1 | S336 I340 | S336-T338 PolarHBondContact O-N 2.71Å; T338-I340 PolarHBondContact O-N 3.24Å |
| 339 | G | 54.8 | Low | 57.2 | Low | 62 Ų | 62 | 127.8 Ų | 127.8 | 64% | 0.639 | 69% | 0.691 | S | S | * | * | trans | 70.8 | 11.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | S336 | S336-G339 PolarHBondContact O-N 3.35Š| ||
| 340 | I | 59.5 | Low | 57.3 | Low | 126 Ų | 126 | 124.4 Ų | 124.4 | 65% | 0.646 | 69% | 0.687 | S | S | * | * | trans | -94.2 | 110.4 | 178.1 | -52.3 | -175.7 | 0 | 0 | 0 | 109.3 | T338 A342 | T338-I340 PolarHBondContact O-N 3.24Å; I340-A342 PolarHBondContact O-N 3.28Å | ||
| 341 | Y | 56.3 | Low | 57.5 | Low | 133 Ų | 133 | 124.1 Ų | 124.1 | 52% | 0.522 | 70% | 0.699 | S | S | . | * | trans | -76.2 | 99 | 168 | -73.3 | -90 | 0 | 0 | 0 | 109.1 | L326 | L326-Y341 HydrophobicContact CB-CE1 4.25Å; L326-Y341 HydrophobicContact CD1-CD2 4.49Å; L326-Y341 HydrophobicContact CD1-CE1 4.41Å; L326-Y341 HydrophobicContact CD1-CE2 4.06Å | ||
| 342 | A | 61.4 | Low | 57.6 | Low | 74 Ų | 74 | 121.9 Ų | 121.9 | 61% | 0.612 | 69% | 0.691 | S | S | * | * | trans | -118.3 | 117.4 | 167.6 | 0 | 0 | 0 | 0 | 0 | 108 | I340 P344 | I340-A342 PolarHBondContact O-N 3.28Å; A342-P344 WeakPolarHBondContact O-CD 3.46Å | ||
| 343 | S | 61.5 | Low | 57.8 | Low | 87 Ų | 87 | 124.5 Ų | 124.5 | 61% | 0.608 | 70% | 0.698 | S | S | * | * | trans | -67 | 123.7 | 167.8 | 68.8 | 0 | 0 | 0 | 0 | 107.6 | R345 | S343-R345 PolarHBondContact O-N 2.95Š| ||
| 344 | P | 62.6 | Low | 57.8 | Low | 117 Ų | 117 | 132.2 Ų | 132.2 | 76% | 0.76 | 72% | 0.722 | S | S | * | * | trans | -61.9 | 113.1 | 174.2 | -17.5 | 30.1 | 0 | 0 | 0 | 107.4 | A342 R346 | A342-P344 WeakPolarHBondContact O-CD 3.46Å; P344-R346 PolarHBondContact O-N 3.06Å | ||
| 345 | R | 60.6 | Low | 57.6 | Low | 229 Ų | 229 | 128.8 Ų | 128.8 | 86% | 0.864 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 131 | 165.7 | -68.6 | -175.4 | 176.9 | -165.5 | -0.9 | 106.7 | S343 | S343-R345 PolarHBondContact O-N 2.95Š|
| 346 | R | 67.8 | Low | 57.4 | Low | 232 Ų | 232 | 127.7 Ų | 127.7 | 88% | 0.875 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -50.2 | 132.7 | 175.8 | -68.2 | -179.8 | -179.7 | -175.5 | -0.9 | 108.2 | P344 I348 | P344-R346 PolarHBondContact O-N 3.06Å; R346-I348 PolarHBondContact O-N 3.19Å |
| 347 | P | 62.4 | Low | 57.5 | Low | 116 Ų | 116 | 133.7 Ų | 133.7 | 75% | 0.753 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -51 | 132.4 | 174 | -23.3 | 31 | 0 | 0 | 0 | 109.1 | K349 | P347-K349 VanDerWaalsContact C-N 3.34Å; P347-K349 PolarHBondContact O-N 3.09Å |
| 348 | I | 64.2 | Low | 57.5 | Low | 152 Ų | 152 | 135.6 Ų | 135.6 | 78% | 0.779 | 72% | 0.721 | S | S | * | * | trans | -65.2 | 100.2 | 177.5 | -55.5 | 172.7 | 0 | 0 | 0 | 106.5 | R346 G350 | R346-I348 PolarHBondContact O-N 3.19Å; I348-G350 PolarHBondContact O-N 3.37Å | ||
| 349 | K | 53.9 | Low | 57.2 | Low | 188 Ų | 188 | 135.2 Ų | 135.2 | 82% | 0.817 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | 126.1 | 175.6 | -68.3 | -177.5 | 177.2 | -174.9 | 0 | 107.7 | P347 | P347-K349 VanDerWaalsContact C-N 3.34Å; P347-K349 PolarHBondContact O-N 3.09Å |
| 350 | G | 61 | Low | 56.4 | Low | 61 Ų | 61 | 140.3 Ų | 140.3 | 63% | 0.629 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 107.9 | -4.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 117.5 | I348 | I348-G350 PolarHBondContact O-N 3.37Š|
| 351 | A | 56.3 | Low | 55.9 | Low | 92 Ų | 92 | 139.2 Ų | 139.2 | 76% | 0.76 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -89.5 | -23.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 352 | A | 52.8 | Low | 55.5 | Low | 70 Ų | 70 | 141.1 Ų | 141.1 | 58% | 0.579 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -111.4 | 130.3 | 171.1 | 0 | 0 | 0 | 0 | 0 | 108 | R354 | A352-R354 PolarHBondContact O-N 3.08Š|
| 353 | Q | 52.6 | Low | 54.9 | Low | 207 Ų | 207 | 142 Ų | 142 | 97% | 0.967 | 75% | 0.747 | S | S | * | * | trans | -66.6 | 50.9 | -175.6 | -151.5 | 151.4 | -11.3 | 0 | 0 | 113.1 | ||||
| 354 | R | 56.1 | Low | 54.4 | Low | 213 Ų | 213 | 143.6 Ų | 143.6 | 80% | 0.804 | 76% | 0.756 | S | S | * | * | trans | -91.5 | 130.6 | 167.6 | -73 | -170.2 | 178.3 | -167.9 | -0.4 | 108.2 | A352 I356 | A352-R354 PolarHBondContact O-N 3.08Å; R354-I356 PolarHBondContact O-N 3.26Å | ||
| 355 | P | 51.5 | Low | 53.6 | Low | 129 Ų | 129 | 143.2 Ų | 143.2 | 84% | 0.838 | 75% | 0.751 | S | S | * | * | trans | -59.4 | 116.1 | 179.2 | 23 | -30.6 | 0 | 0 | 0 | 109.2 | Q357 | P355-Q357 PolarHBondContact O-N 3.18Å; P355-Q357 VanDerWaalsContact O-N 3.13Å | ||
| 356 | I | 51.8 | Low | 52.5 | Low | 85 Ų | 85 | 136 Ų | 136 | 44% | 0.436 | 74% | 0.736 | S | S | . | * | trans | -67.6 | 108.9 | 172.3 | -64.6 | 169.8 | 0 | 0 | 0 | 105.7 | R354 Y358 | R354-I356 PolarHBondContact O-N 3.26Å; I356-Y358 VanDerWaalsContact C-N 3.34Å; I356-Y358 HydrophobicContact CB-CD2 4.31Å; I356-Y358 HydrophobicContact CB-CE2 4.1Å; I356-Y358 HydrophobicContact CG2-CD2 3.83Å; I356-Y358 HydrophobicContact CG2-CE2 3.69Å; I356-Y358 HydrophobicContact CG2-CG 4.48Å; I356-Y358 PolarHBondContact O-N 3.08Å | ||
| 357 | Q | 49.6 | Very low | 51.5 | Low | 193 Ų | 193 | 130.3 Ų | 130.3 | 90% | 0.902 | 73% | 0.729 | S | S | * | * | trans | -64.4 | 100.3 | 164.8 | -88.9 | -175.3 | -3.1 | 0 | 0 | 107.6 | P355 A359 | P355-Q357 PolarHBondContact O-N 3.18Å; P355-Q357 VanDerWaalsContact O-N 3.13Å; Q357-A359 PolarHBondContact O-N 3.23Å | ||
| 358 | Y | 53.8 | Low | 50.6 | Low | 174 Ų | 174 | 130.2 Ų | 130.2 | 68% | 0.682 | 73% | 0.727 | S | S | * | * | trans | -73 | 104.9 | 162.3 | -79.9 | -91.7 | 0 | 0 | 0 | 106.9 | I356 Y360 | I356-Y358 VanDerWaalsContact C-N 3.34Å; I356-Y358 HydrophobicContact CB-CD2 4.31Å; I356-Y358 HydrophobicContact CB-CE2 4.1Å; I356-Y358 HydrophobicContact CG2-CD2 3.83Å; I356-Y358 HydrophobicContact CG2-CE2 3.69Å; I356-Y358 HydrophobicContact CG2-CG 4.48Å; I356-Y358 PolarHBondContact O-N 3.08Å; Y358-Y360 PolarHBondContact O-N 3.36Å | ||
| 359 | A | 49.5 | Very low | 49.9 | Very low | 100 Ų | 100 | 126.1 Ų | 126.1 | 83% | 0.826 | 71% | 0.709 | S | S | * | * | trans | -67.8 | 91.5 | 156.7 | 0 | 0 | 0 | 0 | 0 | 106.6 | Q357 | Q357-A359 PolarHBondContact O-N 3.23Š| ||
| 360 | Y | 39 | Very low | 49.4 | Very low | 169 Ų | 169 | 122.2 Ų | 122.2 | 66% | 0.663 | 70% | 0.696 | S | S | * | * | trans | -69.3 | 129.5 | 164.2 | -107 | -92.6 | 0 | 0 | 0 | 106.9 | Y358 D362 T363 | Y358-Y360 PolarHBondContact O-N 3.36Å; Y360-D362 PolarHBondContact O-N 3.01Å; Y360-T363 WeakPolarHBondContact CD1-OG1 3.45Å | ||
| 361 | P | 48 | Very low | 48.7 | Very low | 102 Ų | 102 | 126.6 Ų | 126.6 | 66% | 0.662 | 70% | 0.7 | S | S | * | * | trans | -60.3 | 133.7 | 156.5 | 28 | -30.3 | 0 | 0 | 0 | 106.6 | T363 | P361-T363 PolarHBondContact O-N 2.89Å; P361-T363 PolarHBondContact O-OG1 3Å | ||
| 362 | D | 49.6 | Very low | 48.5 | Very low | 174 Ų | 174 | 131.8 Ų | 131.8 | 93% | 0.93 | 70% | 0.7 | S | S | * | * | trans | -46.7 | 100.8 | 178.6 | -69.1 | -50.2 | 0 | 0 | 0 | 109.6 | Y360 | Y360-D362 PolarHBondContact O-N 3.01Š| ||
| 363 | T | 48.3 | Very low | 48.3 | Very low | 91 Ų | 91 | 137.2 Ų | 137.2 | 56% | 0.558 | 71% | 0.706 | S | S | * | * | trans | -98.1 | 136.3 | 178.7 | 18.6 | 0 | 0 | 0 | 0 | 107.1 | Y360 P361 V365 | Y360-T363 WeakPolarHBondContact CD1-OG1 3.45Å; P361-T363 PolarHBondContact O-N 2.89Å; P361-T363 PolarHBondContact O-OG1 3Å; T363-V365 PolarHBondContact O-N 3.29Å; T363-V365 VanDerWaalsContact O-N 3.16Å | ||
| 364 | P | 50.7 | Low | 48.1 | Very low | 122 Ų | 122 | 133 Ų | 133 | 79% | 0.792 | 69% | 0.686 | S | S | * | * | trans | -65.3 | 122.3 | -166.4 | 26.3 | -33.5 | 0 | 0 | 0 | 110 | ||||
| 365 | V | 45.4 | Very low | 47.8 | Very low | 108 Ų | 108 | 127.8 Ų | 127.8 | 66% | 0.655 | 68% | 0.677 | S | S | * | * | trans | -5.3 | 123.9 | 156.7 | -162 | 0 | 0 | 0 | 0 | 114.9 | T363 T369 | T363-V365 PolarHBondContact O-N 3.29Å; T363-V365 VanDerWaalsContact O-N 3.16Å; V365-T369 HydrophobicContact CG1-CG2 3.43Å; V365-T369 VanDerWaalsContact CG1-CG2 3.43Å; V365-T369 WeakPolarHBondContact CG1-OG1 3.42Å | ||
| 366 | S | 38.1 | Very low | 47.5 | Very low | 79 Ų | 79 | 127.6 Ų | 127.6 | 55% | 0.552 | 67% | 0.666 | S | S | * | * | trans | -37.4 | 145.9 | 171.7 | -47.8 | 0 | 0 | 0 | 0 | 114.6 | T368 T369 | S366-T368 PolarHBondContact O-N 3.4Å; S366-T369 PolarHBondContact O-N 3.1Å; S366-T369 VanDerWaalsContact O-N 3.11Å; S366-T369 PolarHBondContact O-OG1 2.76Å | ||
| 367 | P | 46.1 | Very low | 47.5 | Very low | 112 Ų | 112 | 134 Ų | 134 | 73% | 0.727 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.3 | 3.4 | -174.7 | 30.1 | -35.8 | 0 | 0 | 0 | 114.5 | T369 | P367-T369 VanDerWaalsContact C-N 3.33Š|
| 368 | T | 44.3 | Very low | 47.8 | Very low | 114 Ų | 114 | 136 Ų | 136 | 70% | 0.699 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.7 | -11.2 | 171.4 | 50.9 | 0 | 0 | 0 | 0 | 113.1 | S366 | S366-T368 PolarHBondContact O-N 3.4Š|
| 369 | T | 48.5 | Very low | 48 | Very low | 66 Ų | 66 | 133.2 Ų | 133.2 | 41% | 0.405 | 68% | 0.68 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -92 | -20.2 | 172.2 | 61.5 | 0 | 0 | 0 | 0 | 113.4 | V365 S366 P367 R372 R373 | V365-T369 HydrophobicContact CG1-CG2 3.43Å; V365-T369 VanDerWaalsContact CG1-CG2 3.43Å; V365-T369 WeakPolarHBondContact CG1-OG1 3.42Å; S366-T369 PolarHBondContact O-N 3.1Å; S366-T369 VanDerWaalsContact O-N 3.11Å; S366-T369 PolarHBondContact O-OG1 2.76Å; P367-T369 VanDerWaalsContact C-N 3.33Å; T369-R372 PolarHBondContact O-N 3.33Å; T369-R373 WeakPolarHBondContact O-CB 3.48Å; T369-R373 PolarHBondContact O-N 3.03Å |
| 370 | L | 44.6 | Very low | 48.9 | Very low | 105 Ų | 105 | 132.7 Ų | 132.7 | 55% | 0.55 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -73.6 | -41.6 | -179 | -157.2 | 161.2 | 0 | 0 | 0 | 111.2 | R372 R373 E374 | L370-R372 VanDerWaalsContact C-N 3.28Å; L370-R372 PolarHBondContact O-N 3.37Å; L370-R373 CarbonylContact O-C 3.52Å; L370-R373 WeakPolarHBondContact O-CA 3.5Å; L370-R373 WeakPolarHBondContact O-CB 2.96Å; L370-R373 PolarHBondContact O-N 3.1Å; L370-E374 PolarHBondContact O-N 2.76Å |
| 371 | E | 46.9 | Very low | 50.9 | Low | 153 Ų | 153 | 127 Ų | 127 | 72% | 0.715 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -62 | -35.1 | 172.3 | -100.2 | -159.1 | 147.4 | 0 | 0 | 112.4 | R373 E374 V375 | E371-R373 VanDerWaalsContact C-N 3.28Å; E371-R373 PolarHBondContact O-N 3.38Å; E371-E374 PolarHBondContact O-N 3.13Å; E371-V375 WeakPolarHBondContact O-CG2 3.44Å; E371-V375 PolarHBondContact O-N 3.23Å |
| 372 | R | 50.2 | Low | 52.5 | Low | 202 Ų | 202 | 127.1 Ų | 127.1 | 76% | 0.762 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -71 | -25.9 | 174.8 | -153.8 | 176.8 | -156.4 | -130.9 | 3.2 | 112.5 | T369 L370 Q376 | T369-R372 PolarHBondContact O-N 3.33Å; L370-R372 VanDerWaalsContact C-N 3.28Å; L370-R372 PolarHBondContact O-N 3.37Å; R372-Q376 PolarHBondContact O-N 2.89Å |
| 373 | R | 49.8 | Very low | 54 | Low | 183 Ų | 183 | 126.7 Ų | 126.7 | 69% | 0.691 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -82.4 | -22.5 | 177.8 | -140.5 | 173.6 | -172 | 173.2 | 1.7 | 112.9 | T369 L370 E371 | T369-R373 WeakPolarHBondContact O-CB 3.48Å; T369-R373 PolarHBondContact O-N 3.03Å; L370-R373 CarbonylContact O-C 3.52Å; L370-R373 WeakPolarHBondContact O-CA 3.5Å; L370-R373 WeakPolarHBondContact O-CB 2.96Å; L370-R373 PolarHBondContact O-N 3.1Å; E371-R373 VanDerWaalsContact C-N 3.28Å; E371-R373 PolarHBondContact O-N 3.38Å |
| 374 | E | 48.5 | Very low | 55.9 | Low | 120 Ų | 120 | 125.5 Ų | 125.5 | 56% | 0.561 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -80 | -34.5 | 170.8 | -92.2 | 174 | 153.7 | 0 | 0 | 112.9 | L370 E371 Q376 R377 | L370-E374 PolarHBondContact O-N 2.76Å; E371-E374 PolarHBondContact O-N 3.13Å; E374-Q376 PolarHBondContact O-N 3.2Å; E374-R377 PolarHBondContact O-N 2.95Å; E374-R377 VanDerWaalsContact O-N 3.13Å |
| 375 | V | 49.2 | Very low | 57.5 | Low | 102 Ų | 102 | 126 Ų | 126 | 62% | 0.618 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -66 | -28.4 | 170.7 | 179.5 | 0 | 0 | 0 | 0 | 111.4 | E371 R377 R378 L379 | E371-V375 WeakPolarHBondContact O-CG2 3.44Å; E371-V375 PolarHBondContact O-N 3.23Å; V375-R377 VanDerWaalsContact C-N 3.27Å; V375-R377 PolarHBondContact O-N 3.48Å; V375-R378 PolarHBondContact O-N 3.33Å; V375-R378 VanDerWaalsContact O-N 3.15Å; V375-L379 PolarHBondContact O-N 3.15Å |
| 376 | Q | 46.5 | Very low | 59.7 | Low | 126 Ų | 126 | 125.1 Ų | 125.1 | 59% | 0.589 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.6 | -16.4 | 172.9 | -83.3 | -173 | -36.1 | 0 | 0 | 114.6 | R372 E374 R378 | R372-Q376 PolarHBondContact O-N 2.89Å; E374-Q376 PolarHBondContact O-N 3.2Å; Q376-R378 PolarHBondContact O-N 3.49Å |
| 377 | R | 50.8 | Low | 62.4 | Low | 220 Ų | 220 | 127 Ų | 127 | 83% | 0.83 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83 | 0.2 | 171 | -63.2 | -165.9 | -168.4 | 177.9 | 4.6 | 113.5 | E374 V375 | E374-R377 PolarHBondContact O-N 2.95Å; E374-R377 VanDerWaalsContact O-N 3.13Å; V375-R377 VanDerWaalsContact C-N 3.27Å; V375-R377 PolarHBondContact O-N 3.48Å |
| 378 | R | 55.7 | Low | 64.7 | Low | 233 Ų | 233 | 125.5 Ų | 125.5 | 88% | 0.879 | 60% | 0.603 | S | S | * | * | S | Bend | trans | -119.5 | 3 | 170.8 | -67.2 | -171.6 | 179.4 | -119.8 | 1.1 | 113.2 | V375 Q376 | V375-R378 PolarHBondContact O-N 3.33Å; V375-R378 VanDerWaalsContact O-N 3.15Å; Q376-R378 PolarHBondContact O-N 3.49Å |
| 379 | L | 58.1 | Low | 67.1 | Low | 117 Ų | 117 | 127.1 Ų | 127.1 | 61% | 0.613 | 60% | 0.6 | S | S | * | * | S | Bend | trans | -102.1 | 108.7 | 174.8 | -160.9 | 65.9 | 0 | 0 | 0 | 106.7 | V375 P381 | V375-L379 PolarHBondContact O-N 3.15Å; L379-P381 WeakPolarHBondContact O-CD 3.2Å |
| 380 | V | 67.8 | Low | 69.4 | Low | 88 Ų | 88 | 130.5 Ų | 130.5 | 53% | 0.533 | 61% | 0.61 | S | S | . | * | trans | -48.9 | 117 | 171.5 | 174.6 | 0 | 0 | 0 | 0 | 106.5 | V382 I384 | V380-V382 PolarHBondContact O-N 2.81Å; V380-I384 HydrophobicContact CG1-CB 3.71Å; V380-I384 HydrophobicContact CG1-CG2 3.9Å | ||
| 381 | P | 81.9 | Confident | 71.8 | Confident | 49 Ų | 49 | 127.5 Ų | 127.5 | 32% | 0.318 | 60% | 0.6 | S | S | . | * | trans | -53.8 | 136.5 | 178.9 | -26.8 | 33.7 | 0 | 0 | 0 | 109.8 | L379 Y383 I384 Q385 | L379-P381 WeakPolarHBondContact O-CD 3.2Å; P381-Y383 HydrophobicContact CB-CD1 3.29Å; P381-Y383 HydrophobicContact CB-CE1 2.98Å; P381-Y383 HydrophobicContact CB-CE2 4.42Å; P381-Y383 HydrophobicContact CB-CG 4.14Å; P381-Y383 HydrophobicContact CG-CD1 4.41Å; P381-Y383 HydrophobicContact CG-CE1 3.65Å; P381-Y383 PolarHBondContact O-N 3.39Å; P381-I384 HydrophobicContact CB-CD1 4.47Å; P381-I384 HydrophobicContact CB-CG1 4.23Å; P381-I384 HydrophobicContact CG-CD1 4.05Å; P381-I384 HydrophobicContact CG-CG1 4.36Å; P381-I384 WeakPolarHBondContact O-CB 3.38Å; P381-I384 PolarHBondContact O-N 3.23Å; P381-Q385 PolarHBondContact O-N 2.89Å | ||
| 382 | V | 80.9 | Confident | 74.2 | Confident | 106 Ų | 106 | 123.8 Ų | 123.8 | 64% | 0.642 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -54.1 | -31 | -174.4 | 178.5 | 0 | 0 | 0 | 0 | 111.5 | V380 I384 Q385 V386 | V380-V382 PolarHBondContact O-N 2.81Å; V382-I384 VanDerWaalsContact C-N 3.35Å; V382-I384 PolarHBondContact O-N 3.43Å; V382-Q385 PolarHBondContact O-N 3.49Å; V382-V386 HydrophobicContact CG1-CG2 4.45Å; V382-V386 WeakPolarHBondContact O-CG2 3.28Å; V382-V386 PolarHBondContact O-N 2.91Å |
| 383 | Y | 81.9 | Confident | 76.4 | Confident | 164 Ų | 164 | 117.1 Ų | 117.1 | 64% | 0.643 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -62.6 | -35.8 | 174.5 | 71.4 | -100.1 | 0 | 0 | 0 | 113.4 | P381 V386 L387 | P381-Y383 HydrophobicContact CB-CD1 3.29Å; P381-Y383 HydrophobicContact CB-CE1 2.98Å; P381-Y383 HydrophobicContact CB-CE2 4.42Å; P381-Y383 HydrophobicContact CB-CG 4.14Å; P381-Y383 HydrophobicContact CG-CD1 4.41Å; P381-Y383 HydrophobicContact CG-CE1 3.65Å; P381-Y383 PolarHBondContact O-N 3.39Å; Y383-V386 PolarHBondContact O-N 3.34Å; Y383-L387 VanDerWaalsContact O-CB 3.28Å; Y383-L387 WeakPolarHBondContact O-CB 3.43Å; Y383-L387 PolarHBondContact O-N 3.01Å |
| 384 | I | 87.2 | Confident | 78.6 | Confident | 66 Ų | 66 | 110.6 Ų | 110.6 | 34% | 0.338 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -69.5 | -38.8 | 176.3 | -56 | -172.3 | 0 | 0 | 0 | 110 | V380 P381 V382 L387 V388 | V380-I384 HydrophobicContact CG1-CB 3.71Å; V380-I384 HydrophobicContact CG1-CG2 3.9Å; P381-I384 HydrophobicContact CB-CD1 4.47Å; P381-I384 HydrophobicContact CB-CG1 4.23Å; P381-I384 HydrophobicContact CG-CD1 4.05Å; P381-I384 HydrophobicContact CG-CG1 4.36Å; P381-I384 WeakPolarHBondContact O-CB 3.38Å; P381-I384 PolarHBondContact O-N 3.23Å; V382-I384 VanDerWaalsContact C-N 3.35Å; V382-I384 PolarHBondContact O-N 3.43Å; I384-L387 PolarHBondContact O-N 3Å; I384-V388 HydrophobicContact CG2-CG2 4.39Å; I384-V388 VanDerWaalsContact O-CG2 3.28Å; I384-V388 WeakPolarHBondContact O-CG2 3.48Å; I384-V388 PolarHBondContact O-N 3.43Å |
| 385 | Q | 84.6 | Confident | 80.8 | Confident | 134 Ų | 134 | 109.6 Ų | 109.6 | 63% | 0.626 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -63.8 | -41.6 | 175.8 | -175.8 | 177.6 | -19 | 0 | 0 | 111.7 | P381 V382 F389 | P381-Q385 PolarHBondContact O-N 2.89Å; V382-Q385 PolarHBondContact O-N 3.49Å; Q385-F389 PolarHBondContact O-N 3.38Å |
| 386 | V | 92.6 | Very high | 83 | Confident | 89 Ų | 89 | 109.8 Ų | 109.8 | 54% | 0.539 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -66.6 | -40.2 | 175.2 | 175.4 | 0 | 0 | 0 | 0 | 111.3 | V382 Y383 F389 F390 | V382-V386 HydrophobicContact CG1-CG2 4.45Å; V382-V386 WeakPolarHBondContact O-CG2 3.28Å; V382-V386 PolarHBondContact O-N 2.91Å; Y383-V386 PolarHBondContact O-N 3.34Å; V386-F389 WeakPolarHBondContact O-CB 3.35Å; V386-F389 PolarHBondContact O-N 2.88Å; V386-F390 PolarHBondContact O-N 2.94Å |
| 387 | L | 93.7 | Very high | 85.2 | Confident | 117 Ų | 117 | 109.9 Ų | 109.9 | 61% | 0.613 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -66 | -40.3 | 178.1 | -167.4 | 149.1 | 0 | 0 | 0 | 112 | Y383 I384 F390 A391 | Y383-L387 VanDerWaalsContact O-CB 3.28Å; Y383-L387 WeakPolarHBondContact O-CB 3.43Å; Y383-L387 PolarHBondContact O-N 3.01Å; I384-L387 PolarHBondContact O-N 3Å; L387-F390 PolarHBondContact O-N 3.24Å; L387-A391 WeakPolarHBondContact O-CB 3.28Å; L387-A391 PolarHBondContact O-N 3.04Å |
| 388 | V | 94.9 | Very high | 87.1 | Confident | 82 Ų | 82 | 104.1 Ų | 104.1 | 50% | 0.497 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.3 | -40.1 | 173.6 | 172.2 | 0 | 0 | 0 | 0 | 111 | I384 A391 V392 | I384-V388 HydrophobicContact CG2-CG2 4.39Å; I384-V388 VanDerWaalsContact O-CG2 3.28Å; I384-V388 WeakPolarHBondContact O-CG2 3.48Å; I384-V388 PolarHBondContact O-N 3.43Å; V388-A391 PolarHBondContact O-N 3.26Å; V388-V392 WeakPolarHBondContact O-CG2 3.41Å; V388-V392 PolarHBondContact O-N 3.44Å |
| 389 | F | 95.4 | Very high | 88.8 | Confident | 147 Ų | 147 | 97.3 Ų | 97.3 | 65% | 0.645 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.6 | -46.4 | 174.6 | 178.4 | -98.8 | 0 | 0 | 0 | 111.5 | Q385 V386 A391 V392 V393 | Q385-F389 PolarHBondContact O-N 3.38Å; V386-F389 WeakPolarHBondContact O-CB 3.35Å; V386-F389 PolarHBondContact O-N 2.88Å; F389-A391 VanDerWaalsContact C-N 3.35Å; F389-A391 PolarHBondContact O-N 2.85Å; F389-V392 PolarHBondContact O-N 3.47Å; F389-V393 HydrophobicContact CD1-CG2 4.27Å; F389-V393 HydrophobicContact CE1-CG2 3.88Å; F389-V393 HydrophobicContact CE2-CG2 4.33Å; F389-V393 HydrophobicContact CZ-CG2 3.91Å; F389-V393 WeakPolarHBondContact O-CG2 3.34Å; F389-V393 PolarHBondContact O-N 3.42Å |
| 390 | F | 96.2 | Very high | 90.4 | Very high | 138 Ų | 138 | 97 Ų | 97 | 61% | 0.605 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.9 | -41.3 | 176.6 | -163.4 | -99.4 | 0 | 0 | 0 | 111.7 | V386 L387 V392 V393 C394 | V386-F390 PolarHBondContact O-N 2.94Å; L387-F390 PolarHBondContact O-N 3.24Å; F390-V392 PolarHBondContact O-N 3.36Å; F390-V393 PolarHBondContact O-N 2.8Å; F390-C394 WeakPolarHBondContact CE1-SG 3.45Å; F390-C394 WeakPolarHBondContact O-CB 3.35Å; F390-C394 PolarHBondContact O-N 3.3Å; F390-C394 PolarHBondContact O-SG 3.33Å |
| 391 | A | 95.6 | Very high | 91.3 | Very high | 42 Ų | 42 | 94.9 Ų | 94.9 | 35% | 0.347 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.8 | -42.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | L387 V388 F389 C394 I395 | L387-A391 WeakPolarHBondContact O-CB 3.28Å; L387-A391 PolarHBondContact O-N 3.04Å; V388-A391 PolarHBondContact O-N 3.26Å; F389-A391 VanDerWaalsContact C-N 3.35Å; F389-A391 PolarHBondContact O-N 2.85Å; A391-C394 PolarHBondContact O-N 3.26Å; A391-I395 WeakPolarHBondContact O-CB 3.45Å; A391-I395 WeakPolarHBondContact O-CD1 3.47Å; A391-I395 WeakPolarHBondContact O-CG1 3.2Å; A391-I395 PolarHBondContact O-N 2.95Å |
| 392 | V | 96.8 | Very high | 91.3 | Very high | 74 Ų | 74 | 97.1 Ų | 97.1 | 45% | 0.448 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.7 | -43.8 | 175.3 | 172.1 | 0 | 0 | 0 | 0 | 111 | V388 F389 F390 I395 L396 | V388-V392 WeakPolarHBondContact O-CG2 3.41Å; V388-V392 PolarHBondContact O-N 3.44Å; F389-V392 PolarHBondContact O-N 3.47Å; F390-V392 PolarHBondContact O-N 3.36Å; V392-I395 PolarHBondContact O-N 2.89Å; V392-L396 HydrophobicContact CG1-CD1 3.99Å; V392-L396 HydrophobicContact CG1-CG 4.37Å; V392-L396 WeakPolarHBondContact O-CB 3.38Å; V392-L396 VanDerWaalsContact O-CG 3.28Å; V392-L396 WeakPolarHBondContact O-CG 3.28Å; V392-L396 PolarHBondContact O-N 3.3Å |
| 393 | V | 96.6 | Very high | 91.6 | Very high | 63 Ų | 63 | 95.3 Ų | 95.3 | 38% | 0.382 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.3 | -43.2 | 176.2 | 172.8 | 0 | 0 | 0 | 0 | 111.1 | F389 F390 L396 F397 | F389-V393 HydrophobicContact CD1-CG2 4.27Å; F389-V393 HydrophobicContact CE1-CG2 3.88Å; F389-V393 HydrophobicContact CE2-CG2 4.33Å; F389-V393 HydrophobicContact CZ-CG2 3.91Å; F389-V393 WeakPolarHBondContact O-CG2 3.34Å; F389-V393 PolarHBondContact O-N 3.42Å; F390-V393 PolarHBondContact O-N 2.8Å; V393-L396 PolarHBondContact O-N 2.81Å; V393-F397 VanDerWaalsContact O-CB 3.31Å; V393-F397 WeakPolarHBondContact O-CB 3.46Å; V393-F397 PolarHBondContact O-N 3.29Å |
| 394 | C | 95.6 | Very high | 91.5 | Very high | 46 Ų | 46 | 92.6 Ų | 92.6 | 31% | 0.311 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62 | -43.8 | 174.7 | -73.1 | 0 | 0 | 0 | 0 | 112 | F390 A391 F397 L398 | F390-C394 WeakPolarHBondContact CE1-SG 3.45Å; F390-C394 WeakPolarHBondContact O-CB 3.35Å; F390-C394 PolarHBondContact O-N 3.3Å; F390-C394 PolarHBondContact O-SG 3.33Å; A391-C394 PolarHBondContact O-N 3.26Å; C394-F397 PolarHBondContact O-N 2.81Å; C394-L398 WeakPolarHBondContact O-CB 3.28Å; C394-L398 VanDerWaalsContact O-CG 3.28Å; C394-L398 WeakPolarHBondContact O-CG 3.26Å; C394-L398 PolarHBondContact O-N 2.88Å |
| 395 | I | 95.4 | Very high | 91 | Very high | 98 Ų | 98 | 93.9 Ų | 93.9 | 50% | 0.503 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.7 | -43.2 | 176.9 | -69.1 | 163.1 | 0 | 0 | 0 | 110.5 | A391 V392 F397 L398 I399 | A391-I395 WeakPolarHBondContact O-CB 3.45Å; A391-I395 WeakPolarHBondContact O-CD1 3.47Å; A391-I395 WeakPolarHBondContact O-CG1 3.2Å; A391-I395 PolarHBondContact O-N 2.95Å; V392-I395 PolarHBondContact O-N 2.89Å; I395-F397 VanDerWaalsContact C-N 3.33Å; I395-F397 PolarHBondContact O-N 2.85Å; I395-L398 PolarHBondContact O-N 3.32Å; I395-I399 HydrophobicContact CG2-CD1 3.86Å; I395-I399 HydrophobicContact CG2-CG1 4.47Å; I395-I399 VanDerWaalsContact O-CG1 3.26Å; I395-I399 WeakPolarHBondContact O-CG1 3.31Å; I395-I399 PolarHBondContact O-N 3.5Å |
| 396 | L | 93.9 | Very high | 90.5 | Very high | 107 Ų | 107 | 91.1 Ų | 91.1 | 56% | 0.56 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -64.7 | -38.1 | 176 | -70.5 | 173.8 | 0 | 0 | 0 | 112 | V392 V393 I399 F400 | V392-L396 HydrophobicContact CG1-CD1 3.99Å; V392-L396 HydrophobicContact CG1-CG 4.37Å; V392-L396 WeakPolarHBondContact O-CB 3.38Å; V392-L396 VanDerWaalsContact O-CG 3.28Å; V392-L396 WeakPolarHBondContact O-CG 3.28Å; V392-L396 PolarHBondContact O-N 3.3Å; V393-L396 PolarHBondContact O-N 2.81Å; L396-I399 PolarHBondContact O-N 3.41Å; L396-F400 VanDerWaalsContact O-CB 3.29Å; L396-F400 WeakPolarHBondContact O-CB 3.31Å; L396-F400 PolarHBondContact O-N 3.47Å |
| 397 | F | 94.1 | Very high | 89.5 | Confident | 127 Ų | 127 | 91 Ų | 91 | 56% | 0.557 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -65.5 | -43 | 174.1 | 179.2 | -100.1 | 0 | 0 | 0 | 111.5 | V393 C394 I395 F400 V401 | V393-F397 VanDerWaalsContact O-CB 3.31Å; V393-F397 WeakPolarHBondContact O-CB 3.46Å; V393-F397 PolarHBondContact O-N 3.29Å; C394-F397 PolarHBondContact O-N 2.81Å; I395-F397 VanDerWaalsContact C-N 3.33Å; I395-F397 PolarHBondContact O-N 2.85Å; F397-F400 WeakPolarHBondContact O-CB 3.38Å; F397-F400 PolarHBondContact O-N 2.73Å; F397-V401 HydrophobicContact CD1-CG2 4.23Å; F397-V401 HydrophobicContact CE1-CG2 3.77Å; F397-V401 HydrophobicContact CE2-CG2 4.12Å; F397-V401 HydrophobicContact CZ-CG2 3.71Å; F397-V401 WeakPolarHBondContact O-CG2 3.42Å; F397-V401 PolarHBondContact O-N 3.48Å |
| 398 | L | 90.6 | Very high | 88.4 | Confident | 99 Ų | 99 | 87.1 Ų | 87.1 | 52% | 0.518 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.3 | -42.3 | 174.1 | -71.5 | 174.8 | 0 | 0 | 0 | 111.1 | C394 I395 F400 V401 N402 | C394-L398 WeakPolarHBondContact O-CB 3.28Å; C394-L398 VanDerWaalsContact O-CG 3.28Å; C394-L398 WeakPolarHBondContact O-CG 3.26Å; C394-L398 PolarHBondContact O-N 2.88Å; I395-L398 PolarHBondContact O-N 3.32Å; L398-F400 VanDerWaalsContact C-N 3.3Å; L398-F400 PolarHBondContact O-N 2.84Å; L398-V401 PolarHBondContact O-N 3.2Å; L398-N402 VanDerWaalsContact O-CB 3.31Å; L398-N402 WeakPolarHBondContact O-CB 3.29Å; L398-N402 PolarHBondContact O-N 2.82Å; L398-N402 PolarHBondContact O-ND2 2.77Å |
| 399 | I | 91.9 | Very high | 87.1 | Confident | 91 Ų | 91 | 87.7 Ų | 87.7 | 47% | 0.467 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62.5 | -41.6 | 174.2 | -68.5 | 164.5 | 0 | 0 | 0 | 110.1 | I395 L396 N402 V403 | I395-I399 HydrophobicContact CG2-CD1 3.86Å; I395-I399 HydrophobicContact CG2-CG1 4.47Å; I395-I399 VanDerWaalsContact O-CG1 3.26Å; I395-I399 WeakPolarHBondContact O-CG1 3.31Å; I395-I399 PolarHBondContact O-N 3.5Å; L396-I399 PolarHBondContact O-N 3.41Å; I399-N402 PolarHBondContact O-N 3.39Å; I399-V403 HydrophobicContact CG2-CG2 4.1Å; I399-V403 VanDerWaalsContact O-CB 3.28Å; I399-V403 WeakPolarHBondContact O-CB 3.18Å; I399-V403 WeakPolarHBondContact O-CG2 3.28Å; I399-V403 PolarHBondContact O-N 2.83Å |
| 400 | F | 89.9 | Confident | 85.9 | Confident | 109 Ų | 109 | 84.4 Ų | 84.4 | 48% | 0.478 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.1 | -51 | 177.5 | 178.2 | -101.4 | 0 | 0 | 0 | 111.4 | L396 F397 L398 N402 V403 E404 | L396-F400 VanDerWaalsContact O-CB 3.29Å; L396-F400 WeakPolarHBondContact O-CB 3.31Å; L396-F400 PolarHBondContact O-N 3.47Å; F397-F400 WeakPolarHBondContact O-CB 3.38Å; F397-F400 PolarHBondContact O-N 2.73Å; L398-F400 VanDerWaalsContact C-N 3.3Å; L398-F400 PolarHBondContact O-N 2.84Å; F400-N402 PolarHBondContact O-N 3.46Å; F400-V403 PolarHBondContact O-N 3.13Å; F400-E404 WeakPolarHBondContact CE1-OE2 3.34Å; F400-E404 VanDerWaalsContact CZ-CD 3.47Å; F400-E404 VanDerWaalsContact CZ-OE1 3.29Å; F400-E404 WeakPolarHBondContact CZ-OE1 3.15Å; F400-E404 WeakPolarHBondContact CZ-OE2 3.28Å; F400-E404 VanDerWaalsContact O-CB 3.28Å; F400-E404 WeakPolarHBondContact O-CB 3.02Å; F400-E404 PolarHBondContact O-N 3.24Å |
| 401 | V | 88.3 | Confident | 84.7 | Confident | 45 Ų | 45 | 82.9 Ų | 82.9 | 27% | 0.273 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -59.7 | -46.8 | 175.2 | 171.7 | 0 | 0 | 0 | 0 | 110.9 | F397 L398 V403 E404 D405 | F397-V401 HydrophobicContact CD1-CG2 4.23Å; F397-V401 HydrophobicContact CE1-CG2 3.77Å; F397-V401 HydrophobicContact CE2-CG2 4.12Å; F397-V401 HydrophobicContact CZ-CG2 3.71Å; F397-V401 WeakPolarHBondContact O-CG2 3.42Å; F397-V401 PolarHBondContact O-N 3.48Å; L398-V401 PolarHBondContact O-N 3.2Å; V401-V403 VanDerWaalsContact C-N 3.32Å; V401-V403 PolarHBondContact O-N 3.26Å; V401-E404 PolarHBondContact O-N 2.8Å; V401-D405 VanDerWaalsContact CG1-OD2 3.23Å; V401-D405 WeakPolarHBondContact CG1-OD2 3.21Å; V401-D405 VanDerWaalsContact O-CB 3.23Å; V401-D405 WeakPolarHBondContact O-CB 3.23Å; V401-D405 PolarHBondContact O-N 2.73Å |
| 402 | N | 82.3 | Confident | 83.6 | Confident | 96 Ų | 96 | 86.3 Ų | 86.3 | 51% | 0.513 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.8 | -36 | 177.2 | -78.3 | -74 | 0 | 0 | 0 | 112.5 | L398 I399 F400 T406 | L398-N402 VanDerWaalsContact O-CB 3.31Å; L398-N402 WeakPolarHBondContact O-CB 3.29Å; L398-N402 PolarHBondContact O-N 2.82Å; L398-N402 PolarHBondContact O-ND2 2.77Å; I399-N402 PolarHBondContact O-N 3.39Å; F400-N402 PolarHBondContact O-N 3.46Å; N402-T406 WeakPolarHBondContact O-CB 2.92Å; N402-T406 WeakPolarHBondContact O-CG2 3.29Å; N402-T406 PolarHBondContact O-N 2.77Å; N402-T406 PolarHBondContact O-OG1 2.78Å |
| 403 | V | 86.9 | Confident | 82.6 | Confident | 67 Ų | 67 | 87.7 Ų | 87.7 | 41% | 0.406 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -69.4 | -43.4 | 176 | 166.4 | 0 | 0 | 0 | 0 | 110 | I399 F400 V401 T406 N407 | I399-V403 HydrophobicContact CG2-CG2 4.1Å; I399-V403 VanDerWaalsContact O-CB 3.28Å; I399-V403 WeakPolarHBondContact O-CB 3.18Å; I399-V403 WeakPolarHBondContact O-CG2 3.28Å; I399-V403 PolarHBondContact O-N 2.83Å; F400-V403 PolarHBondContact O-N 3.13Å; V401-V403 VanDerWaalsContact C-N 3.32Å; V401-V403 PolarHBondContact O-N 3.26Å; V403-T406 VanDerWaalsContact CA-OG1 3.31Å; V403-T406 WeakPolarHBondContact CA-OG1 3.39Å; V403-T406 PolarHBondContact O-N 3.36Å; V403-T406 PolarHBondContact O-OG1 3.19Å; V403-N407 WeakPolarHBondContact O-CB 3.31Å; V403-N407 PolarHBondContact O-N 2.82Å; V403-N407 PolarHBondContact O-ND2 3.14Å; V403-N407 VanDerWaalsContact O-ND2 3.13Å; V403-N407 PolarHBondContact O-OD1 3.48Å |
| 404 | E | 78.9 | Confident | 81.5 | Confident | 108 Ų | 108 | 90 Ų | 90 | 51% | 0.505 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -68.1 | -37.5 | 179 | -150.2 | 153.1 | -131.3 | 0 | 0 | 111.5 | F400 V401 N407 G408 | F400-E404 WeakPolarHBondContact CE1-OE2 3.34Å; F400-E404 VanDerWaalsContact CZ-CD 3.47Å; F400-E404 VanDerWaalsContact CZ-OE1 3.29Å; F400-E404 WeakPolarHBondContact CZ-OE1 3.15Å; F400-E404 WeakPolarHBondContact CZ-OE2 3.28Å; F400-E404 VanDerWaalsContact O-CB 3.28Å; F400-E404 WeakPolarHBondContact O-CB 3.02Å; F400-E404 PolarHBondContact O-N 3.24Å; V401-E404 PolarHBondContact O-N 2.8Å; E404-N407 PolarHBondContact O-N 3.35Å; E404-G408 PolarHBondContact O-N 3.44Å |
| 405 | D | 76.8 | Confident | 80.4 | Confident | 92 Ų | 92 | 91.6 Ų | 91.6 | 49% | 0.492 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -68.3 | -39.4 | 170.9 | -68.5 | -27.8 | 0 | 0 | 0 | 111.2 | V401 N407 G408 V409 | V401-D405 VanDerWaalsContact CG1-OD2 3.23Å; V401-D405 WeakPolarHBondContact CG1-OD2 3.21Å; V401-D405 VanDerWaalsContact O-CB 3.23Å; V401-D405 WeakPolarHBondContact O-CB 3.23Å; V401-D405 PolarHBondContact O-N 2.73Å; D405-N407 VanDerWaalsContact C-N 3.35Å; D405-G408 PolarHBondContact O-N 2.81Å; D405-V409 WeakPolarHBondContact O-CB 3.23Å; D405-V409 WeakPolarHBondContact O-CG2 3.33Å; D405-V409 PolarHBondContact O-N 3.34Å |
| 406 | T | 73.8 | Confident | 79.3 | Confident | 77 Ų | 77 | 93 Ų | 93 | 47% | 0.472 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -67.8 | -36.2 | 173.7 | 60.9 | 0 | 0 | 0 | 0 | 111.7 | N402 V403 V409 V410 | N402-T406 WeakPolarHBondContact O-CB 2.92Å; N402-T406 WeakPolarHBondContact O-CG2 3.29Å; N402-T406 PolarHBondContact O-N 2.77Å; N402-T406 PolarHBondContact O-OG1 2.78Å; V403-T406 VanDerWaalsContact CA-OG1 3.31Å; V403-T406 WeakPolarHBondContact CA-OG1 3.39Å; V403-T406 PolarHBondContact O-N 3.36Å; V403-T406 PolarHBondContact O-OG1 3.19Å; T406-V409 PolarHBondContact O-N 2.8Å; T406-V410 WeakPolarHBondContact O-CB 3.19Å; T406-V410 WeakPolarHBondContact O-CG2 3.45Å; T406-V410 PolarHBondContact O-N 2.81Å |
| 407 | N | 71.5 | Confident | 78 | Confident | 87 Ų | 87 | 93.9 Ų | 93.9 | 47% | 0.465 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.7 | -42 | 173.4 | -65.8 | -27.4 | 0 | 0 | 0 | 110 | V403 E404 D405 V409 V410 D411 | V403-N407 WeakPolarHBondContact O-CB 3.31Å; V403-N407 PolarHBondContact O-N 2.82Å; V403-N407 PolarHBondContact O-ND2 3.14Å; V403-N407 VanDerWaalsContact O-ND2 3.13Å; V403-N407 PolarHBondContact O-OD1 3.48Å; E404-N407 PolarHBondContact O-N 3.35Å; D405-N407 VanDerWaalsContact C-N 3.35Å; N407-V409 PolarHBondContact O-N 3.49Å; N407-V410 PolarHBondContact O-N 3.38Å; N407-D411 WeakPolarHBondContact O-CB 3.35Å; N407-D411 PolarHBondContact O-N 2.8Å |
| 408 | G | 71.6 | Confident | 76.5 | Confident | 35 Ų | 35 | 94.3 Ų | 94.3 | 36% | 0.361 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.8 | -36.9 | 175 | 0 | 0 | 0 | 0 | 0 | 113.4 | E404 D405 L412 | E404-G408 PolarHBondContact O-N 3.44Å; D405-G408 PolarHBondContact O-N 2.81Å; G408-L412 WeakPolarHBondContact O-CB 3.07Å; G408-L412 PolarHBondContact O-N 2.79Å |
| 409 | V | 68 | Low | 74.6 | Confident | 94 Ų | 94 | 94.2 Ų | 94.2 | 57% | 0.57 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -73.8 | -37.5 | 174.7 | 171.4 | 0 | 0 | 0 | 0 | 111.5 | D405 T406 N407 L412 L413 | D405-V409 WeakPolarHBondContact O-CB 3.23Å; D405-V409 WeakPolarHBondContact O-CG2 3.33Å; D405-V409 PolarHBondContact O-N 3.34Å; T406-V409 PolarHBondContact O-N 2.8Å; N407-V409 PolarHBondContact O-N 3.49Å; V409-L412 PolarHBondContact O-N 3.2Å; V409-L413 VanDerWaalsContact O-CB 3.31Å; V409-L413 WeakPolarHBondContact O-CB 3.38Å; V409-L413 PolarHBondContact O-N 2.9Å |
| 410 | V | 69.4 | Low | 72.9 | Confident | 78 Ų | 78 | 95.3 Ų | 95.3 | 47% | 0.473 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67.6 | -40.8 | 174.8 | 168.9 | 0 | 0 | 0 | 0 | 110.8 | T406 N407 L413 E414 | T406-V410 WeakPolarHBondContact O-CB 3.19Å; T406-V410 WeakPolarHBondContact O-CG2 3.45Å; T406-V410 PolarHBondContact O-N 2.81Å; N407-V410 PolarHBondContact O-N 3.38Å; V410-L413 CarbonylContact O-C 3.6Å; V410-L413 PolarHBondContact O-N 3.45Å; V410-E414 WeakPolarHBondContact O-CB 3.31Å; V410-E414 PolarHBondContact O-N 3.05Å |
| 411 | D | 71.4 | Confident | 71.1 | Confident | 106 Ų | 106 | 97.8 Ų | 97.8 | 57% | 0.567 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -63.9 | -40.4 | 173.8 | -81.5 | -10.2 | 0 | 0 | 0 | 111.6 | N407 L413 E414 S415 | N407-D411 WeakPolarHBondContact O-CB 3.35Å; N407-D411 PolarHBondContact O-N 2.8Å; D411-L413 VanDerWaalsContact C-N 3.35Å; D411-E414 PolarHBondContact O-N 3.37Å; D411-S415 VanDerWaalsContact O-CB 3.31Å; D411-S415 WeakPolarHBondContact O-CB 3.31Å; D411-S415 PolarHBondContact O-N 2.88Å |
| 412 | L | 73.1 | Confident | 69.6 | Low | 114 Ų | 114 | 99.2 Ų | 99.2 | 60% | 0.597 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -63.7 | -40 | 172.3 | -107 | 160.4 | 0 | 0 | 0 | 112 | G408 V409 S415 L416 | G408-L412 WeakPolarHBondContact O-CB 3.07Å; G408-L412 PolarHBondContact O-N 2.79Å; V409-L412 PolarHBondContact O-N 3.2Å; L412-S415 PolarHBondContact O-N 2.93Å; L412-L416 WeakPolarHBondContact O-CB 3.38Å; L412-L416 PolarHBondContact O-N 3.44Å |
| 413 | L | 73.9 | Confident | 68.3 | Low | 102 Ų | 102 | 103.6 Ų | 103.6 | 53% | 0.534 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -69.7 | -36.9 | 177.9 | -166.6 | 71 | 0 | 0 | 0 | 111.5 | V409 V410 D411 L416 N417 | V409-L413 VanDerWaalsContact O-CB 3.31Å; V409-L413 WeakPolarHBondContact O-CB 3.38Å; V409-L413 PolarHBondContact O-N 2.9Å; V410-L413 CarbonylContact O-C 3.6Å; V410-L413 PolarHBondContact O-N 3.45Å; D411-L413 VanDerWaalsContact C-N 3.35Å; L413-L416 PolarHBondContact O-N 3.43Å; L413-N417 WeakPolarHBondContact O-CB 3.47Å; L413-N417 VanDerWaalsContact O-CG 3.25Å; L413-N417 PolarHBondContact O-N 2.98Å; L413-N417 PolarHBondContact O-ND2 2.88Å |
| 414 | E | 74.3 | Confident | 67 | Low | 111 Ų | 111 | 108.1 Ų | 108.1 | 52% | 0.519 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -68.2 | -39.1 | 173.6 | -175.8 | 154 | -173 | 0 | 0 | 111.4 | V410 D411 L416 N417 Q418 | V410-E414 WeakPolarHBondContact O-CB 3.31Å; V410-E414 PolarHBondContact O-N 3.05Å; D411-E414 PolarHBondContact O-N 3.37Å; E414-L416 VanDerWaalsContact C-N 3.32Å; E414-L416 PolarHBondContact O-N 3.09Å; E414-N417 PolarHBondContact O-N 3.04Å; E414-Q418 WeakPolarHBondContact O-CG 3.42Å; E414-Q418 PolarHBondContact O-N 3.46Å; E414-Q418 VanDerWaalsContact O-N 3.09Å |
| 415 | S | 73.3 | Confident | 66 | Low | 81 Ų | 81 | 112.4 Ų | 112.4 | 57% | 0.566 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -69.1 | -27.2 | 173.5 | -157.6 | 0 | 0 | 0 | 0 | 113.1 | D411 L412 | D411-S415 VanDerWaalsContact O-CB 3.31Å; D411-S415 WeakPolarHBondContact O-CB 3.31Å; D411-S415 PolarHBondContact O-N 2.88Å; L412-S415 PolarHBondContact O-N 2.93Å |
| 416 | L | 70.9 | Confident | 65.2 | Low | 128 Ų | 128 | 113.2 Ų | 113.2 | 67% | 0.67 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -80.8 | -31.6 | 172.5 | -110.1 | 128.6 | 0 | 0 | 0 | 113 | L412 L413 E414 Q418 | L412-L416 WeakPolarHBondContact O-CB 3.38Å; L412-L416 PolarHBondContact O-N 3.44Å; L413-L416 PolarHBondContact O-N 3.43Å; E414-L416 VanDerWaalsContact C-N 3.32Å; E414-L416 PolarHBondContact O-N 3.09Å; L416-Q418 VanDerWaalsContact C-N 3.25Å |
| 417 | N | 67.2 | Low | 64.1 | Low | 125 Ų | 125 | 119.5 Ų | 119.5 | 67% | 0.668 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -72.6 | -20.8 | 173.8 | -77.7 | -42.2 | 0 | 0 | 0 | 112.2 | L413 E414 C419 | L413-N417 WeakPolarHBondContact O-CB 3.47Å; L413-N417 VanDerWaalsContact O-CG 3.25Å; L413-N417 PolarHBondContact O-N 2.98Å; L413-N417 PolarHBondContact O-ND2 2.88Å; E414-N417 PolarHBondContact O-N 3.04Å; N417-C419 PolarHBondContact O-N 3.34Å |
| 418 | Q | 62.7 | Low | 63.1 | Low | 136 Ų | 136 | 122 Ų | 122 | 64% | 0.636 | 67% | 0.67 | S | S | * | * | trans | -79.1 | 62.5 | 165.1 | -69.6 | 168.8 | 30.8 | 0 | 0 | 110.2 | E414 L416 | E414-Q418 WeakPolarHBondContact O-CG 3.42Å; E414-Q418 PolarHBondContact O-N 3.46Å; E414-Q418 VanDerWaalsContact O-N 3.09Å; L416-Q418 VanDerWaalsContact C-N 3.25Å | ||
| 419 | C | 50 | Low | 62.1 | Low | 96 Ų | 96 | 124.9 Ų | 124.9 | 65% | 0.649 | 69% | 0.69 | S | S | * | * | trans | -72.4 | 135.4 | 167 | -166.9 | 0 | 0 | 0 | 0 | 108.8 | N417 D421 | N417-C419 PolarHBondContact O-N 3.34Å; C419-D421 PolarHBondContact O-N 2.85Å | ||
| 420 | P | 57.7 | Low | 61.4 | Low | 114 Ų | 114 | 125 Ų | 125 | 74% | 0.74 | 70% | 0.701 | S | S | * | * | trans | -70.1 | 118.8 | 178.1 | 28 | -32.4 | 0 | 0 | 0 | 109.1 | G422 | P420-G422 VanDerWaalsContact C-N 3.29Å; P420-G422 PolarHBondContact O-N 3.27Å | ||
| 421 | D | 50.3 | Low | 60.3 | Low | 162 Ų | 162 | 127.9 Ų | 127.9 | 87% | 0.866 | 72% | 0.723 | S | S | * | * | trans | -63.3 | 96.6 | 166.2 | -76.8 | -36.2 | 0 | 0 | 0 | 108.1 | C419 E423 | C419-D421 PolarHBondContact O-N 2.85Å; D421-E423 PolarHBondContact O-N 3.41Å | ||
| 422 | G | 58.5 | Low | 59.4 | Low | 75 Ų | 75 | 126.4 Ų | 126.4 | 77% | 0.773 | 73% | 0.732 | S | S | * | * | trans | -74.2 | 110.6 | 167.2 | 0 | 0 | 0 | 0 | 0 | 109 | P420 | P420-G422 VanDerWaalsContact C-N 3.29Å; P420-G422 PolarHBondContact O-N 3.27Å | ||
| 423 | E | 54.3 | Low | 58.5 | Low | 187 Ų | 187 | 130.2 Ų | 130.2 | 87% | 0.874 | 75% | 0.747 | S | S | * | * | trans | -103.8 | 89 | 159.7 | 46.5 | -171.3 | 148 | 0 | 0 | 109.1 | D421 | D421-E423 PolarHBondContact O-N 3.41Š| ||
| 424 | D | 58.6 | Low | 57.3 | Low | 162 Ų | 162 | 137 Ų | 137 | 87% | 0.866 | 78% | 0.783 | S | S | * | * | trans | -89.3 | 110.8 | 154 | -82.5 | -39.9 | 0 | 0 | 0 | 107.5 | ||||
| 425 | E | 58.9 | Low | 56.5 | Low | 198 Ų | 198 | 138.4 Ų | 138.4 | 93% | 0.925 | 80% | 0.796 | S | S | * | * | trans | -130.6 | 106.8 | 156.7 | -158.6 | 168.6 | 174.4 | 0 | 0 | 110.9 | ||||
| 426 | T | 60 | Low | 55.6 | Low | 110 Ų | 110 | 141.4 Ų | 141.4 | 68% | 0.675 | 81% | 0.808 | S | S | * | * | trans | -78.1 | 138.6 | 172.8 | -26.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 427 | R | 49.7 | Very low | 54.7 | Low | 209 Ų | 209 | 142.1 Ų | 142.1 | 79% | 0.789 | 82% | 0.816 | S | S | * | * | trans | 141.1 | 116 | 134 | -77.8 | 178 | 162.4 | 107 | 0.9 | 115.2 | ||||
| 428 | D | 50.9 | Low | 54 | Low | 140 Ų | 140 | 143.1 Ų | 143.1 | 75% | 0.749 | 82% | 0.824 | S | S | * | * | 63.2 | 137.3 | 122.7 | -52.4 | -28.7 | 0 | 0 | 0 | 122.9 | |||||
| 429 | A | 50.2 | Low | 53.5 | Low | 95 Ų | 95 | 143.6 Ų | 143.6 | 79% | 0.785 | 84% | 0.836 | S | S | * | * | trans | 95.6 | 99.2 | 145.9 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 430 | A | 53.2 | Low | 53.7 | Low | 96 Ų | 96 | 146.7 Ų | 146.7 | 79% | 0.793 | 85% | 0.849 | S | S | * | * | 51.7 | 117.9 | 117.8 | 0 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 431 | C | 47.2 | Very low | 53.4 | Low | 139 Ų | 139 | 149.1 Ų | 149.1 | 94% | 0.939 | 86% | 0.857 | S | S | * | * | trans | 155.1 | 127.8 | 139.6 | -88.6 | 0 | 0 | 0 | 0 | 106 | ||||
| 432 | G | 51.8 | Low | 53.7 | Low | 74 Ų | 74 | 148.1 Ų | 148.1 | 76% | 0.763 | 86% | 0.856 | S | S | * | * | cis | 131.9 | 113.8 | 30.8 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 433 | E | 55.9 | Low | 53.3 | Low | 195 Ų | 195 | 154.2 Ų | 154.2 | 91% | 0.911 | 86% | 0.863 | S | S | * | * | trans | 38.9 | 126.6 | 163.5 | -65.6 | -162.6 | 115.3 | 0 | 0 | 122.3 | ||||
| 434 | L | 48.3 | Very low | 53.2 | Low | 245 Ų | 245 | 151.2 Ų | 151.2 | 100% | 1.283 | 86% | 0.862 | S | S | * | * | -154.4 | 0 | 105.3 | -99.7 | 168 | 0 | 0 | 0 | 111.1 |
Retrieved 434 of 434 residues in 273.3 ms
(Link to these results)