| 1 | M | 43.6 | Very low | 62.9 | Low | 239 Ų | 239 | 118.5 Ų | 118.5 | 100% | 1.177 | 57% | 0.567 | S | S | * | * | | | | 0 | 117.3 | 0 | -73.9 | -166.5 | 171.7 | 0 | 0 | 109.5 | K3 | M1-K3 PolarHBondContact O-N 3.46Š|
| 2 | S | 47.2 | Very low | 63.3 | Low | 113 Ų | 113 | 113.5 Ų | 113.5 | 79% | 0.79 | 55% | 0.554 | S | S | * | * | | | trans | -80.7 | 103.4 | 173.4 | 178.4 | 0 | 0 | 0 | 0 | 108.5 | R4 | S2-R4 PolarHBondContact O-N 3.17Å; S2-R4 VanDerWaalsContact O-N 3.14Å |
| 3 | K | 61.2 | Low | 63.5 | Low | 128 Ų | 128 | 108.1 Ų | 108.1 | 56% | 0.557 | 53% | 0.531 | S | S | * | . | | | trans | -69.2 | 107.3 | 173.1 | -69.2 | -177.4 | -178.8 | 178 | 0 | 107.6 | M1 Y5 | M1-K3 PolarHBondContact O-N 3.46Å; K3-Y5 HydrophobicContact CB-CE2 4.15Å; K3-Y5 PolarHBondContact O-N 3.39Å |
| 4 | R | 58.3 | Low | 63.3 | Low | 194 Ų | 194 | 109.7 Ų | 109.7 | 73% | 0.732 | 53% | 0.529 | S | S | * | . | | | trans | -80 | 111.4 | 168.8 | -67.2 | -171.4 | -176.9 | -173.7 | 4.8 | 107.7 | S2 | S2-R4 PolarHBondContact O-N 3.17Å; S2-R4 VanDerWaalsContact O-N 3.14Å |
| 5 | Y | 66 | Low | 63.2 | Low | 87 Ų | 87 | 113.5 Ų | 113.5 | 34% | 0.341 | 55% | 0.545 | S | S | . | . | | | trans | -80.7 | 134.9 | 173.3 | -63.4 | -78.6 | 0 | 0 | 0 | 109.2 | K3 F9 F10 | K3-Y5 HydrophobicContact CB-CE2 4.15Å; K3-Y5 PolarHBondContact O-N 3.39Å; Y5-F9 AromaticContact CD1-CD1 3.65Å; Y5-F9 HydrophobicContact CD1-CD1 3.65Å; Y5-F9 AromaticContact CD1-CE1 3.64Å; Y5-F9 HydrophobicContact CD1-CE1 3.64Å; Y5-F9 HydrophobicContact CD1-CG 4.3Å; Y5-F9 HydrophobicContact CD1-CZ 4.3Å; Y5-F9 HydrophobicContact CE1-CE1 4.09Å; Y5-F9 HydrophobicContact CE1-CZ 4.45Å; Y5-F9 HydrophobicContact CG-CD1 4.09Å; Y5-F9 HydrophobicContact CG-CE1 4.3Å; Y5-F10 HydrophobicContact CD2-CZ 4.33Å; Y5-F10 HydrophobicContact CG-CE2 4.27Å; Y5-F10 HydrophobicContact CG-CZ 4.36Å |
| 6 | S | 69.4 | Low | 63 | Low | 68 Ų | 68 | 111.8 Ų | 111.8 | 48% | 0.476 | 56% | 0.555 | S | S | . | * | | | trans | -70.3 | 155.3 | 177.7 | 65.7 | 0 | 0 | 0 | 0 | 110.8 | E8 F9 F10 | S6-E8 PolarHBondContact O-N 3.31Å; S6-F9 WeakPolarHBondContact O-CB 3.38Å; S6-F9 PolarHBondContact O-N 3.08Å; S6-F9 VanDerWaalsContact O-N 3.12Å; S6-F9 PolarHBondContact OG-N 3.34Å; S6-F10 WeakPolarHBondContact O-CD2 3.26Å; S6-F10 PolarHBondContact O-N 3.42Å |
| 7 | K | 71.2 | Confident | 62.6 | Low | 119 Ų | 119 | 107.1 Ų | 107.1 | 52% | 0.517 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -54.6 | -41.4 | 172.9 | -175.8 | 178 | 176.7 | 178.9 | 0 | 111.6 | F9 F10 M11 F32 | K7-F9 VanDerWaalsContact C-N 3.32Å; K7-F9 PolarHBondContact O-N 3.39Å; K7-F10 PolarHBondContact O-N 3.35Å; K7-M11 WeakPolarHBondContact O-CG 3.41Å; K7-M11 PolarHBondContact O-N 3.41Å; K7-F32 HydrophobicContact CB-CE1 4.11Å; K7-F32 HydrophobicContact CG-CE1 4.23Å; K7-F32 HydrophobicContact CG-CZ 4.43Å |
| 8 | E | 72.3 | Confident | 62.1 | Low | 134 Ų | 134 | 111.2 Ų | 111.2 | 63% | 0.626 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -58.7 | -40.5 | 176.8 | -56.7 | -53.1 | 134.7 | 0 | 0 | 112.6 | S6 F10 M11 S12 | S6-E8 PolarHBondContact O-N 3.31Å; E8-F10 PolarHBondContact O-N 3.05Å; E8-M11 PolarHBondContact O-N 3.16Å; E8-S12 PolarHBondContact O-N 2.9Å |
| 9 | F | 71 | Confident | 62 | Low | 95 Ų | 95 | 109.5 Ų | 109.5 | 42% | 0.417 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -60.5 | -48.2 | 177.7 | 177.6 | -100.1 | 0 | 0 | 0 | 111.3 | Y5 S6 K7 M11 S12 V13 | Y5-F9 AromaticContact CD1-CD1 3.65Å; Y5-F9 HydrophobicContact CD1-CD1 3.65Å; Y5-F9 AromaticContact CD1-CE1 3.64Å; Y5-F9 HydrophobicContact CD1-CE1 3.64Å; Y5-F9 HydrophobicContact CD1-CG 4.3Å; Y5-F9 HydrophobicContact CD1-CZ 4.3Å; Y5-F9 HydrophobicContact CE1-CE1 4.09Å; Y5-F9 HydrophobicContact CE1-CZ 4.45Å; Y5-F9 HydrophobicContact CG-CD1 4.09Å; Y5-F9 HydrophobicContact CG-CE1 4.3Å; S6-F9 WeakPolarHBondContact O-CB 3.38Å; S6-F9 PolarHBondContact O-N 3.08Å; S6-F9 VanDerWaalsContact O-N 3.12Å; S6-F9 PolarHBondContact OG-N 3.34Å; K7-F9 VanDerWaalsContact C-N 3.32Å; K7-F9 PolarHBondContact O-N 3.39Å; F9-M11 VanDerWaalsContact C-N 3.34Å; F9-M11 PolarHBondContact O-N 3.08Å; F9-S12 PolarHBondContact O-N 3.43Å; F9-S12 PolarHBondContact O-OG 3.14Å; F9-V13 HydrophobicContact CD1-CG2 4.47Å; F9-V13 HydrophobicContact CE1-CG2 4.09Å; F9-V13 HydrophobicContact CZ-CG2 4.13Å; F9-V13 WeakPolarHBondContact O-CG2 3.3Å; F9-V13 PolarHBondContact O-N 3.44Å |
| 10 | F | 65.7 | Low | 61.8 | Low | 41 Ų | 41 | 113.2 Ų | 113.2 | 18% | 0.18 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -70.2 | -29.9 | 177.6 | -72.6 | -80.6 | 0 | 0 | 0 | 113.3 | Y5 S6 K7 E8 S12 V13 R14 Y31 F32 | Y5-F10 HydrophobicContact CD2-CZ 4.33Å; Y5-F10 HydrophobicContact CG-CE2 4.27Å; Y5-F10 HydrophobicContact CG-CZ 4.36Å; S6-F10 WeakPolarHBondContact O-CD2 3.26Å; S6-F10 PolarHBondContact O-N 3.42Å; K7-F10 PolarHBondContact O-N 3.35Å; E8-F10 PolarHBondContact O-N 3.05Å; F10-S12 VanDerWaalsContact C-N 3.33Å; F10-V13 PolarHBondContact O-N 3.11Å; F10-R14 VanDerWaalsContact O-CB 3.3Å; F10-R14 WeakPolarHBondContact O-CB 3.5Å; F10-R14 PolarHBondContact O-N 3.15Å; F10-Y31 HydrophobicContact CE2-CD1 4.17Å; F10-Y31 AromaticContact CE2-CE1 3.8Å; F10-Y31 HydrophobicContact CE2-CE1 3.8Å; F10-Y31 HydrophobicContact CZ-CD1 4.22Å; F10-Y31 HydrophobicContact CZ-CE1 4Å; F10-F32 HydrophobicContact CB-CE2 3.87Å; F10-F32 HydrophobicContact CB-CZ 3.53Å; F10-F32 AromaticContact CD2-CE1 3.95Å; F10-F32 HydrophobicContact CD2-CE1 3.95Å; F10-F32 HydrophobicContact CD2-CE2 4.19Å; F10-F32 AromaticContact CD2-CZ 3.33Å; F10-F32 HydrophobicContact CD2-CZ 3.33Å; F10-F32 HydrophobicContact CE2-CE1 4.46Å; F10-F32 HydrophobicContact CE2-CZ 4.1Å; F10-F32 HydrophobicContact CG-CE2 4.08Å; F10-F32 AromaticContact CG-CZ 3.61Å; F10-F32 HydrophobicContact CG-CZ 3.61Å |
| 11 | M | 66.3 | Low | 61.9 | Low | 85 Ų | 85 | 110.3 Ų | 110.3 | 42% | 0.419 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.5 | -40.9 | 172.4 | -69.7 | -152.3 | 68.7 | 0 | 0 | 111.1 | K7 E8 F9 V13 R14 E15 | K7-M11 WeakPolarHBondContact O-CG 3.41Å; K7-M11 PolarHBondContact O-N 3.41Å; E8-M11 PolarHBondContact O-N 3.16Å; F9-M11 VanDerWaalsContact C-N 3.34Å; F9-M11 PolarHBondContact O-N 3.08Å; M11-V13 PolarHBondContact O-N 3.26Å; M11-R14 WeakPolarHBondContact O-CB 3.48Å; M11-R14 PolarHBondContact O-N 2.94Å; M11-E15 PolarHBondContact O-N 3.47Å |
| 12 | S | 67.4 | Low | 63.1 | Low | 59 Ų | 59 | 102.7 Ų | 102.7 | 41% | 0.413 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.4 | -38.8 | 174.2 | 75.7 | 0 | 0 | 0 | 0 | 112.8 | E8 F9 F10 E15 A16 | E8-S12 PolarHBondContact O-N 2.9Å; F9-S12 PolarHBondContact O-N 3.43Å; F9-S12 PolarHBondContact O-OG 3.14Å; F10-S12 VanDerWaalsContact C-N 3.33Å; S12-E15 PolarHBondContact O-N 2.77Å; S12-A16 VanDerWaalsContact O-CB 3.26Å; S12-A16 WeakPolarHBondContact O-CB 3.41Å; S12-A16 PolarHBondContact O-N 2.65Å |
| 13 | V | 65.2 | Low | 64.2 | Low | 43 Ų | 43 | 104.9 Ų | 104.9 | 26% | 0.261 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -68.6 | -36.4 | 175.4 | 175.2 | 0 | 0 | 0 | 0 | 111.2 | F9 F10 M11 E15 A16 A17 W19 | F9-V13 HydrophobicContact CD1-CG2 4.47Å; F9-V13 HydrophobicContact CE1-CG2 4.09Å; F9-V13 HydrophobicContact CZ-CG2 4.13Å; F9-V13 WeakPolarHBondContact O-CG2 3.3Å; F9-V13 PolarHBondContact O-N 3.44Å; F10-V13 PolarHBondContact O-N 3.11Å; M11-V13 PolarHBondContact O-N 3.26Å; V13-E15 VanDerWaalsContact C-N 3.32Å; V13-A16 PolarHBondContact O-N 3.46Å; V13-A17 WeakPolarHBondContact O-CB 3.43Å; V13-A17 PolarHBondContact O-N 3.38Å; V13-W19 HydrophobicContact CG1-CH2 4.24Å; V13-W19 HydrophobicContact CG1-CZ2 3.64Å |
| 14 | R | 61.7 | Low | 64.4 | Low | 131 Ų | 131 | 101.9 Ų | 101.9 | 49% | 0.494 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67 | -32.3 | 176.1 | -176.1 | -179.2 | 175.2 | 178.3 | -1.5 | 112.6 | F10 M11 A17 | F10-R14 VanDerWaalsContact O-CB 3.3Å; F10-R14 WeakPolarHBondContact O-CB 3.5Å; F10-R14 PolarHBondContact O-N 3.15Å; M11-R14 WeakPolarHBondContact O-CB 3.48Å; M11-R14 PolarHBondContact O-N 2.94Å; R14-A17 VanDerWaalsContact O-O 3.05Å |
| 15 | E | 61.9 | Low | 65 | Low | 167 Ų | 167 | 94.8 Ų | 94.8 | 78% | 0.78 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -78.6 | -41.7 | 173.8 | -76.6 | -178.3 | 170.9 | 0 | 0 | 112.1 | M11 S12 V13 | M11-E15 PolarHBondContact O-N 3.47Å; S12-E15 PolarHBondContact O-N 2.77Å; V13-E15 VanDerWaalsContact C-N 3.32Å |
| 16 | A | 59.4 | Low | 65.4 | Low | 85 Ų | 85 | 95 Ų | 95 | 70% | 0.702 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -72 | -33.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | S12 V13 | S12-A16 VanDerWaalsContact O-CB 3.26Å; S12-A16 WeakPolarHBondContact O-CB 3.41Å; S12-A16 PolarHBondContact O-N 2.65Å; V13-A16 PolarHBondContact O-N 3.46Å |
| 17 | A | 55.9 | Low | 65.7 | Low | 33 Ų | 33 | 96.4 Ų | 96.4 | 27% | 0.273 | 49% | 0.487 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.4 | 125.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | V13 R14 W19 | V13-A17 WeakPolarHBondContact O-CB 3.43Å; V13-A17 PolarHBondContact O-N 3.38Å; R14-A17 VanDerWaalsContact O-O 3.05Å; A17-W19 VanDerWaalsContact C-CD1 3.45Å; A17-W19 HydrophobicContact CB-CG 4.42Å; A17-W19 PolarHBondContact O-N 2.92Å |
| 18 | F | 54.2 | Low | 65.8 | Low | 181 Ų | 181 | 91.9 Ų | 91.9 | 79% | 0.794 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | 71 | 175.1 | -74 | -88.8 | 0 | 0 | 0 | 111.1 | K20 | F18-K20 PolarHBondContact O-N 3.37Š|
| 19 | W | 59.5 | Low | 66 | Low | 79 Ų | 79 | 88.4 Ų | 88.4 | 30% | 0.299 | 46% | 0.455 | S | S | . | . | | | trans | -77.9 | 70.8 | -180 | -71.9 | 26.9 | 0 | 0 | 0 | 107.5 | V13 A17 I24 C28 | V13-W19 HydrophobicContact CG1-CH2 4.24Å; V13-W19 HydrophobicContact CG1-CZ2 3.64Å; A17-W19 VanDerWaalsContact C-CD1 3.45Å; A17-W19 HydrophobicContact CB-CG 4.42Å; A17-W19 PolarHBondContact O-N 2.92Å; W19-I24 HydrophobicContact CD2-CB 4.24Å; W19-I24 HydrophobicContact CD2-CD1 4.47Å; W19-I24 HydrophobicContact CD2-CG2 3.85Å; W19-I24 HydrophobicContact CE3-CB 3.65Å; W19-I24 HydrophobicContact CE3-CG2 3.13Å; W19-I24 HydrophobicContact CH2-CG2 3.64Å; W19-I24 HydrophobicContact CZ2-CG2 4.28Å; W19-I24 HydrophobicContact CZ3-CB 4.03Å; W19-I24 HydrophobicContact CZ3-CG2 3.02Å; W19-C28 VanDerWaalsContact CZ3-SG 3.51Å |
| 20 | K | 58.6 | Low | 66.4 | Low | 183 Ų | 183 | 88.3 Ų | 88.3 | 80% | 0.796 | 46% | 0.46 | S | S | * | . | | | trans | -77.1 | -9.3 | 173.4 | -68 | -175.7 | 179.1 | 177.4 | 0 | 112.1 | F18 S22 | F18-K20 PolarHBondContact O-N 3.37Å; K20-S22 PolarHBondContact O-N 2.99Å |
| 21 | S | 64.6 | Low | 67 | Low | 52 Ų | 52 | 90.8 Ų | 90.8 | 36% | 0.364 | 47% | 0.468 | S | S | . | . | | | trans | -82.4 | 111.6 | 177.3 | 178.2 | 0 | 0 | 0 | 0 | 109.9 | K23 I24 I25 | S21-K23 PolarHBondContact O-N 2.89Å; S21-K23 VanDerWaalsContact O-N 3.13Å; S21-I24 PolarHBondContact O-N 2.65Å; S21-I25 PolarHBondContact O-N 3.19Å |
| 22 | S | 68.2 | Low | 67.3 | Low | 79 Ų | 79 | 88.7 Ų | 88.7 | 55% | 0.552 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -48.8 | -36.7 | 174.3 | 50.2 | 0 | 0 | 0 | 0 | 112.3 | K20 I24 I25 D26 | K20-S22 PolarHBondContact O-N 2.99Å; S22-I24 VanDerWaalsContact C-N 3.31Å; S22-I24 PolarHBondContact O-N 3.39Å; S22-I25 PolarHBondContact O-N 3.09Å; S22-D26 VanDerWaalsContact O-CG 3.29Å; S22-D26 PolarHBondContact O-N 3.21Å |
| 23 | K | 69.8 | Low | 67.6 | Low | 160 Ų | 160 | 93.9 Ų | 93.9 | 70% | 0.696 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -57.7 | -40.5 | 178.3 | -65.6 | -176.6 | 179.2 | 179.5 | 0 | 112.9 | S21 D26 V27 | S21-K23 PolarHBondContact O-N 2.89Å; S21-K23 VanDerWaalsContact O-N 3.13Å; K23-D26 PolarHBondContact O-N 3Å; K23-V27 VanDerWaalsContact O-CG2 3.31Å; K23-V27 WeakPolarHBondContact O-CG2 3.31Å; K23-V27 PolarHBondContact O-N 3.16Å |
| 24 | I | 66.9 | Low | 68.1 | Low | 65 Ų | 65 | 98.4 Ų | 98.4 | 33% | 0.333 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -77.4 | -35.9 | -175.7 | -39 | 176.4 | 0 | 0 | 0 | 110.6 | W19 S21 S22 D26 V27 C28 | W19-I24 HydrophobicContact CD2-CB 4.24Å; W19-I24 HydrophobicContact CD2-CD1 4.47Å; W19-I24 HydrophobicContact CD2-CG2 3.85Å; W19-I24 HydrophobicContact CE3-CB 3.65Å; W19-I24 HydrophobicContact CE3-CG2 3.13Å; W19-I24 HydrophobicContact CH2-CG2 3.64Å; W19-I24 HydrophobicContact CZ2-CG2 4.28Å; W19-I24 HydrophobicContact CZ3-CB 4.03Å; W19-I24 HydrophobicContact CZ3-CG2 3.02Å; S21-I24 PolarHBondContact O-N 2.65Å; S22-I24 VanDerWaalsContact C-N 3.31Å; S22-I24 PolarHBondContact O-N 3.39Å; I24-D26 VanDerWaalsContact C-N 3.31Å; I24-D26 PolarHBondContact O-N 3.48Å; I24-V27 PolarHBondContact O-N 3.38Å; I24-C28 PolarHBondContact O-N 2.65Å |
| 25 | I | 69.1 | Low | 68.4 | Low | 45 Ų | 45 | 95 Ų | 95 | 23% | 0.231 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -60.2 | -43.7 | 171.2 | -63.6 | 173.1 | 0 | 0 | 0 | 110.3 | S21 S22 C28 N29 | S21-I25 PolarHBondContact O-N 3.19Å; S22-I25 PolarHBondContact O-N 3.09Å; I25-C28 PolarHBondContact O-N 2.87Å; I25-N29 WeakPolarHBondContact CG2-ND2 3.46Å; I25-N29 WeakPolarHBondContact O-CB 3.07Å; I25-N29 PolarHBondContact O-N 3.27Å; I25-N29 PolarHBondContact O-ND2 3.17Å |
| 26 | D | 75.1 | Confident | 68.6 | Low | 91 Ų | 91 | 92.2 Ų | 92.2 | 49% | 0.487 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -65.1 | -40.6 | 178.7 | -71.6 | -24.4 | 0 | 0 | 0 | 112.5 | S22 K23 I24 N29 N30 | S22-D26 VanDerWaalsContact O-CG 3.29Å; S22-D26 PolarHBondContact O-N 3.21Å; K23-D26 PolarHBondContact O-N 3Å; I24-D26 VanDerWaalsContact C-N 3.31Å; I24-D26 PolarHBondContact O-N 3.48Å; D26-N29 PolarHBondContact O-N 3.12Å; D26-N30 WeakPolarHBondContact O-CB 3.48Å; D26-N30 PolarHBondContact O-N 3.03Å; D26-N30 PolarHBondContact O-ND2 3.48Å |
| 27 | V | 76.5 | Confident | 68.8 | Low | 98 Ų | 98 | 92.4 Ų | 92.4 | 59% | 0.594 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -62.3 | -46.5 | 175.1 | 171 | 0 | 0 | 0 | 0 | 111.1 | K23 I24 N30 Y31 | K23-V27 VanDerWaalsContact O-CG2 3.31Å; K23-V27 WeakPolarHBondContact O-CG2 3.31Å; K23-V27 PolarHBondContact O-N 3.16Å; I24-V27 PolarHBondContact O-N 3.38Å; V27-N30 PolarHBondContact O-N 3.27Å; V27-Y31 PolarHBondContact O-N 3.17Å |
| 28 | C | 72.9 | Confident | 69 | Low | 23 Ų | 23 | 96.5 Ų | 96.5 | 16% | 0.155 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -62.1 | -45.7 | 176.1 | -84.2 | 0 | 0 | 0 | 0 | 112.2 | W19 I24 I25 N30 Y31 F32 | W19-C28 VanDerWaalsContact CZ3-SG 3.51Å; I24-C28 PolarHBondContact O-N 2.65Å; I25-C28 PolarHBondContact O-N 2.87Å; C28-N30 VanDerWaalsContact C-N 3.3Å; C28-N30 PolarHBondContact O-N 3.22Å; C28-Y31 WeakPolarHBondContact O-CB 3.36Å; C28-Y31 PolarHBondContact O-N 3.45Å; C28-F32 HydrophobicContact CB-CE2 4.49Å; C28-F32 WeakPolarHBondContact O-CD2 3.41Å; C28-F32 PolarHBondContact O-N 3.05Å |
| 29 | N | 76.9 | Confident | 69.1 | Low | 61 Ų | 61 | 90.2 Ų | 90.2 | 33% | 0.326 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -60.8 | -40.5 | 177.9 | -73.7 | -25.6 | 0 | 0 | 0 | 111.8 | I25 D26 F32 R33 | I25-N29 WeakPolarHBondContact CG2-ND2 3.46Å; I25-N29 WeakPolarHBondContact O-CB 3.07Å; I25-N29 PolarHBondContact O-N 3.27Å; I25-N29 PolarHBondContact O-ND2 3.17Å; D26-N29 PolarHBondContact O-N 3.12Å; N29-F32 PolarHBondContact O-N 3.32Å; N29-R33 WeakPolarHBondContact O-CG 3.37Å; N29-R33 PolarHBondContact O-N 3.28Å |
| 30 | N | 78.9 | Confident | 68.9 | Low | 94 Ų | 94 | 94.3 Ų | 94.3 | 50% | 0.503 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -66 | -39.4 | 175.8 | -80.1 | -27.2 | 0 | 0 | 0 | 112.3 | D26 V27 C28 K34 | D26-N30 WeakPolarHBondContact O-CB 3.48Å; D26-N30 PolarHBondContact O-N 3.03Å; D26-N30 PolarHBondContact O-ND2 3.48Å; V27-N30 PolarHBondContact O-N 3.27Å; C28-N30 VanDerWaalsContact C-N 3.3Å; C28-N30 PolarHBondContact O-N 3.22Å; N30-K34 PolarHBondContact O-N 3.43Å; N30-K34 VanDerWaalsContact O-N 3.12Å |
| 31 | Y | 77.9 | Confident | 68.8 | Low | 93 Ų | 93 | 88.8 Ų | 88.8 | 37% | 0.365 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.9 | -47.3 | 173.8 | -179.9 | -98.7 | 0 | 0 | 0 | 111.3 | F10 V27 C28 R33 K34 V35 | F10-Y31 HydrophobicContact CE2-CD1 4.17Å; F10-Y31 AromaticContact CE2-CE1 3.8Å; F10-Y31 HydrophobicContact CE2-CE1 3.8Å; F10-Y31 HydrophobicContact CZ-CD1 4.22Å; F10-Y31 HydrophobicContact CZ-CE1 4Å; V27-Y31 PolarHBondContact O-N 3.17Å; C28-Y31 WeakPolarHBondContact O-CB 3.36Å; C28-Y31 PolarHBondContact O-N 3.45Å; Y31-R33 PolarHBondContact O-N 3.4Å; Y31-K34 PolarHBondContact O-N 3.24Å; Y31-V35 HydrophobicContact CD1-CG2 4.14Å; Y31-V35 HydrophobicContact CE1-CG2 3.71Å; Y31-V35 HydrophobicContact CE2-CG2 4.18Å; Y31-V35 WeakPolarHBondContact O-CG2 3.45Å; Y31-V35 PolarHBondContact O-N 3.47Å |
| 32 | F | 72.8 | Confident | 68.4 | Low | 41 Ų | 41 | 93.7 Ų | 93.7 | 18% | 0.18 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -63.6 | -41.4 | 179.1 | -77.1 | -59.5 | 0 | 0 | 0 | 113.6 | K7 F10 C28 N29 K34 V35 E36 | K7-F32 HydrophobicContact CB-CE1 4.11Å; K7-F32 HydrophobicContact CG-CE1 4.23Å; K7-F32 HydrophobicContact CG-CZ 4.43Å; F10-F32 HydrophobicContact CB-CE2 3.87Å; F10-F32 HydrophobicContact CB-CZ 3.53Å; F10-F32 AromaticContact CD2-CE1 3.95Å; F10-F32 HydrophobicContact CD2-CE1 3.95Å; F10-F32 HydrophobicContact CD2-CE2 4.19Å; F10-F32 AromaticContact CD2-CZ 3.33Å; F10-F32 HydrophobicContact CD2-CZ 3.33Å; F10-F32 HydrophobicContact CE2-CE1 4.46Å; F10-F32 HydrophobicContact CE2-CZ 4.1Å; F10-F32 HydrophobicContact CG-CE2 4.08Å; F10-F32 AromaticContact CG-CZ 3.61Å; F10-F32 HydrophobicContact CG-CZ 3.61Å; C28-F32 HydrophobicContact CB-CE2 4.49Å; C28-F32 WeakPolarHBondContact O-CD2 3.41Å; C28-F32 PolarHBondContact O-N 3.05Å; N29-F32 PolarHBondContact O-N 3.32Å; F32-K34 VanDerWaalsContact C-N 3.3Å; F32-K34 PolarHBondContact O-N 2.99Å; F32-V35 PolarHBondContact O-N 3.03Å; F32-E36 WeakPolarHBondContact O-CB 3.39Å; F32-E36 WeakPolarHBondContact O-CG 3.41Å; F32-E36 PolarHBondContact O-N 3.37Å |
| 33 | R | 74.1 | Confident | 67.6 | Low | 167 Ų | 167 | 96.2 Ų | 96.2 | 63% | 0.63 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -59 | -43.1 | 174 | -72.7 | -176.2 | -158.7 | -172.3 | 8.6 | 111.4 | N29 Y31 E36 T37 | N29-R33 WeakPolarHBondContact O-CG 3.37Å; N29-R33 PolarHBondContact O-N 3.28Å; Y31-R33 PolarHBondContact O-N 3.4Å; R33-E36 PolarHBondContact O-N 3.47Å; R33-T37 WeakPolarHBondContact O-CB 3.35Å; R33-T37 WeakPolarHBondContact O-CG2 3.47Å; R33-T37 PolarHBondContact O-N 3.01Å; R33-T37 PolarHBondContact O-OG1 3.47Å |
| 34 | K | 74.9 | Confident | 66.6 | Low | 139 Ų | 139 | 99 Ų | 99 | 60% | 0.604 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.6 | -47.7 | 176.8 | -75.8 | -174.6 | 178.6 | -173.9 | 0 | 111.8 | N30 Y31 F32 E36 T37 E38 | N30-K34 PolarHBondContact O-N 3.43Å; N30-K34 VanDerWaalsContact O-N 3.12Å; Y31-K34 PolarHBondContact O-N 3.24Å; F32-K34 VanDerWaalsContact C-N 3.3Å; F32-K34 PolarHBondContact O-N 2.99Å; K34-E36 PolarHBondContact O-N 3.31Å; K34-T37 WeakPolarHBondContact CA-OG1 3.07Å; K34-T37 PolarHBondContact O-N 3.29Å; K34-T37 PolarHBondContact O-OG1 3.13Å; K34-E38 WeakPolarHBondContact O-CB 3.41Å; K34-E38 WeakPolarHBondContact O-CG 3.37Å; K34-E38 PolarHBondContact O-N 2.93Å |
| 35 | V | 68.2 | Low | 65.9 | Low | 58 Ų | 58 | 104.8 Ų | 104.8 | 35% | 0.352 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.6 | -39.6 | 179.2 | 176.3 | 0 | 0 | 0 | 0 | 111.9 | Y31 F32 S39 | Y31-V35 HydrophobicContact CD1-CG2 4.14Å; Y31-V35 HydrophobicContact CE1-CG2 3.71Å; Y31-V35 HydrophobicContact CE2-CG2 4.18Å; Y31-V35 WeakPolarHBondContact O-CG2 3.45Å; Y31-V35 PolarHBondContact O-N 3.47Å; F32-V35 PolarHBondContact O-N 3.03Å; V35-S39 WeakPolarHBondContact O-CB 3.49Å; V35-S39 PolarHBondContact O-N 2.9Å; V35-S39 PolarHBondContact O-OG 2.95Å |
| 36 | E | 65.7 | Low | 64.9 | Low | 109 Ų | 109 | 107.9 Ų | 107.9 | 51% | 0.509 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.3 | -40.4 | 174.4 | -75.6 | -178.1 | 179.4 | 0 | 0 | 111.9 | F32 R33 K34 S39 K40 | F32-E36 WeakPolarHBondContact O-CB 3.39Å; F32-E36 WeakPolarHBondContact O-CG 3.41Å; F32-E36 PolarHBondContact O-N 3.37Å; R33-E36 PolarHBondContact O-N 3.47Å; K34-E36 PolarHBondContact O-N 3.31Å; E36-S39 WeakPolarHBondContact CA-OG 3.44Å; E36-S39 PolarHBondContact O-OG 3.34Å; E36-K40 WeakPolarHBondContact O-CB 3.41Å; E36-K40 WeakPolarHBondContact O-CG 3.4Å; E36-K40 PolarHBondContact O-N 3.41Å; E36-K40 VanDerWaalsContact O-N 3.12Å |
| 37 | T | 63.2 | Low | 63.6 | Low | 89 Ų | 89 | 113.4 Ų | 113.4 | 55% | 0.546 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -69.9 | -37.2 | 176.6 | 53.1 | 0 | 0 | 0 | 0 | 113 | R33 K34 A41 | R33-T37 WeakPolarHBondContact O-CB 3.35Å; R33-T37 WeakPolarHBondContact O-CG2 3.47Å; R33-T37 PolarHBondContact O-N 3.01Å; R33-T37 PolarHBondContact O-OG1 3.47Å; K34-T37 WeakPolarHBondContact CA-OG1 3.07Å; K34-T37 PolarHBondContact O-N 3.29Å; K34-T37 PolarHBondContact O-OG1 3.13Å; T37-A41 WeakPolarHBondContact O-CB 3.32Å; T37-A41 PolarHBondContact O-N 2.9Å |
| 38 | E | 60.3 | Low | 62.1 | Low | 119 Ų | 119 | 114.2 Ų | 114.2 | 56% | 0.556 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -75.2 | -32.7 | 179.2 | -75.5 | -178.1 | -167.4 | 0 | 0 | 112.8 | K34 A41 K42 | K34-E38 WeakPolarHBondContact O-CB 3.41Å; K34-E38 WeakPolarHBondContact O-CG 3.37Å; K34-E38 PolarHBondContact O-N 2.93Å; E38-A41 PolarHBondContact O-N 3.04Å; E38-K42 PolarHBondContact O-N 3.16Å |
| 39 | S | 57.1 | Low | 60.7 | Low | 50 Ų | 50 | 117.3 Ų | 117.3 | 35% | 0.35 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -68 | -43 | 172.4 | 50.6 | 0 | 0 | 0 | 0 | 111.2 | V35 E36 A41 K42 D43 | V35-S39 WeakPolarHBondContact O-CB 3.49Å; V35-S39 PolarHBondContact O-N 2.9Å; V35-S39 PolarHBondContact O-OG 2.95Å; E36-S39 WeakPolarHBondContact CA-OG 3.44Å; E36-S39 PolarHBondContact O-OG 3.34Å; S39-A41 VanDerWaalsContact C-N 3.28Å; S39-A41 PolarHBondContact O-N 2.79Å; S39-K42 PolarHBondContact O-N 2.92Å; S39-D43 PolarHBondContact O-N 3.39Å |
| 40 | K | 55.7 | Low | 59.5 | Low | 165 Ų | 165 | 120.1 Ų | 120.1 | 72% | 0.717 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -63.8 | -30 | 173.2 | -66.8 | -93.3 | -178.4 | 173.8 | 0 | 113.2 | E36 | E36-K40 WeakPolarHBondContact O-CB 3.41Å; E36-K40 WeakPolarHBondContact O-CG 3.4Å; E36-K40 PolarHBondContact O-N 3.41Å; E36-K40 VanDerWaalsContact O-N 3.12Å |
| 41 | A | 56.5 | Low | 57.8 | Low | 67 Ų | 67 | 120.7 Ų | 120.7 | 55% | 0.554 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -72.6 | -31.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | T37 E38 S39 | T37-A41 WeakPolarHBondContact O-CB 3.32Å; T37-A41 PolarHBondContact O-N 2.9Å; E38-A41 PolarHBondContact O-N 3.04Å; S39-A41 VanDerWaalsContact C-N 3.28Å; S39-A41 PolarHBondContact O-N 2.79Å |
| 42 | K | 56.1 | Low | 56.2 | Low | 155 Ų | 155 | 121.6 Ų | 121.6 | 67% | 0.674 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -83.6 | -15.7 | 178.2 | -70.8 | -178 | 178 | -179.6 | 0 | 113.8 | E38 S39 R44 | E38-K42 PolarHBondContact O-N 3.16Å; S39-K42 PolarHBondContact O-N 2.92Å; K42-R44 VanDerWaalsContact C-N 3.29Å; K42-R44 PolarHBondContact O-N 2.95Å |
| 43 | D | 52.1 | Low | 54.8 | Low | 132 Ų | 132 | 126.9 Ų | 126.9 | 71% | 0.706 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | 10.1 | 172.8 | -83.9 | -40.5 | 0 | 0 | 0 | 114.4 | S39 K45 | S39-D43 PolarHBondContact O-N 3.39Å; D43-K45 PolarHBondContact O-N 3.19Å |
| 44 | R | 48.8 | Very low | 53.4 | Low | 219 Ų | 219 | 124.1 Ų | 124.1 | 83% | 0.826 | 66% | 0.664 | S | S | * | * | | | trans | -68.1 | 84.9 | 155.4 | -74.4 | -164.6 | 178.3 | -164.5 | 1.8 | 107.4 | K42 | K42-R44 VanDerWaalsContact C-N 3.29Å; K42-R44 PolarHBondContact O-N 2.95Å |
| 45 | K | 51.6 | Low | 51.9 | Low | 186 Ų | 186 | 124.6 Ų | 124.6 | 81% | 0.809 | 68% | 0.679 | S | S | * | * | | | trans | -40 | 127.4 | 158.8 | -81.3 | -177.3 | 176.8 | 179.5 | 0 | 106.2 | D43 K47 | D43-K45 PolarHBondContact O-N 3.19Å; K45-K47 PolarHBondContact O-N 3.39Å |
| 46 | P | 46.8 | Very low | 50.8 | Low | 109 Ų | 109 | 130.9 Ų | 130.9 | 71% | 0.708 | 70% | 0.701 | S | S | * | * | | | trans | -51 | 124 | 167.4 | 21.7 | -29.3 | 0 | 0 | 0 | 105.1 | V48 | P46-V48 PolarHBondContact O-N 3.05Š|
| 47 | K | 48.3 | Very low | 49.9 | Very low | 207 Ų | 207 | 129.8 Ų | 129.8 | 90% | 0.9 | 71% | 0.711 | S | S | * | * | | | trans | -54.2 | 102.5 | 160.1 | -121.1 | 177.7 | 178.2 | 179.5 | 0 | 102 | K45 A49 | K45-K47 PolarHBondContact O-N 3.39Å; K47-A49 PolarHBondContact O-N 2.9Å |
| 48 | V | 44.9 | Very low | 48.5 | Very low | 116 Ų | 116 | 130.9 Ų | 130.9 | 70% | 0.703 | 73% | 0.729 | S | S | * | * | | | trans | -58.4 | 98.1 | 169.3 | 174.6 | 0 | 0 | 0 | 0 | 102.2 | P46 T50 | P46-V48 PolarHBondContact O-N 3.05Å; V48-T50 PolarHBondContact O-N 3.35Å |
| 49 | A | 43.6 | Very low | 48 | Very low | 88 Ų | 88 | 132.9 Ų | 132.9 | 73% | 0.727 | 74% | 0.743 | S | S | * | * | | | trans | -62.6 | 93.5 | 161.5 | 0 | 0 | 0 | 0 | 0 | 102.4 | K47 P51 | K47-A49 PolarHBondContact O-N 2.9Å; A49-P51 WeakPolarHBondContact O-CD 3.43Å |
| 50 | T | 51.4 | Low | 47.3 | Very low | 119 Ų | 119 | 135.2 Ų | 135.2 | 73% | 0.73 | 76% | 0.759 | S | S | * | * | | | trans | -48.3 | 113.4 | 165.9 | 7.6 | 0 | 0 | 0 | 0 | 105 | V48 S52 | V48-T50 PolarHBondContact O-N 3.35Å; T50-S52 PolarHBondContact O-N 3.43Å |
| 51 | P | 44.2 | Very low | 46.6 | Very low | 107 Ų | 107 | 135.9 Ų | 135.9 | 70% | 0.695 | 77% | 0.77 | S | S | * | * | | | trans | -60.7 | 116.9 | 164 | 26.4 | -28.2 | 0 | 0 | 0 | 104 | A49 L53 | A49-P51 WeakPolarHBondContact O-CD 3.43Å; P51-L53 PolarHBondContact O-N 3.23Å |
| 52 | S | 43.3 | Very low | 46.4 | Very low | 111 Ų | 111 | 143.7 Ų | 143.7 | 78% | 0.776 | 79% | 0.785 | S | S | * | * | | | trans | -50.7 | 108.5 | 170.7 | 48.9 | 0 | 0 | 0 | 0 | 106.8 | T50 | T50-S52 PolarHBondContact O-N 3.43Š|
| 53 | L | 44.9 | Very low | 45.8 | Very low | 152 Ų | 152 | 142.2 Ų | 142.2 | 80% | 0.796 | 79% | 0.791 | S | S | * | * | | | trans | -55 | 132.5 | 173.6 | -79.3 | 160.4 | 0 | 0 | 0 | 107.2 | P51 T55 | P51-L53 PolarHBondContact O-N 3.23Å; L53-T55 PolarHBondContact O-N 3.38Å |
| 54 | P | 44.8 | Very low | 45.1 | Very low | 109 Ų | 109 | 145 Ų | 145 | 71% | 0.708 | 80% | 0.802 | S | S | * | * | | | trans | -60.8 | 116.4 | 173 | 24.4 | -30.4 | 0 | 0 | 0 | 107.7 | K56 | P54-K56 PolarHBondContact O-N 2.8Š|
| 55 | T | 43.7 | Very low | 44.7 | Very low | 149 Ų | 149 | 139.2 Ų | 139.2 | 91% | 0.914 | 80% | 0.802 | S | S | * | * | | | trans | -61.4 | 79 | 168.9 | -46 | 0 | 0 | 0 | 0 | 108.5 | L53 | L53-T55 PolarHBondContact O-N 3.38Š|
| 56 | K | 45.1 | Very low | 44.1 | Very low | 190 Ų | 190 | 135.5 Ų | 135.5 | 83% | 0.826 | 81% | 0.806 | S | S | * | * | | | trans | -139.7 | 118.8 | 173.3 | -84.8 | -166.7 | 174 | -178.8 | 0 | 111 | P54 | P54-K56 PolarHBondContact O-N 2.8Š|
| 57 | A | 45.1 | Very low | 43.7 | Very low | 87 Ų | 87 | 133.5 Ų | 133.5 | 72% | 0.719 | 80% | 0.804 | S | S | * | * | | | trans | 69 | 104.8 | 156.8 | 0 | 0 | 0 | 0 | 0 | 117.1 | L59 | A57-L59 PolarHBondContact O-N 3Å; A57-L59 VanDerWaalsContact O-N 3.13Å |
| 58 | A | 35.2 | Very low | 43.4 | Very low | 112 Ų | 112 | 129.8 Ų | 129.8 | 93% | 0.926 | 79% | 0.794 | S | S | * | * | | | trans | -49.3 | 112.7 | 155.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 59 | L | 48.6 | Very low | 43 | Very low | 161 Ų | 161 | 131.9 Ų | 131.9 | 84% | 0.843 | 80% | 0.797 | S | S | * | * | | | trans | -106.3 | 119 | 168.3 | -90.6 | 156.4 | 0 | 0 | 0 | 108.1 | A57 L61 | A57-L59 PolarHBondContact O-N 3Å; A57-L59 VanDerWaalsContact O-N 3.13Å; L59-L61 PolarHBondContact O-N 3.32Å |
| 60 | S | 42.5 | Very low | 42.9 | Very low | 98 Ų | 98 | 139.9 Ų | 139.9 | 69% | 0.685 | 81% | 0.808 | S | S | * | * | | | trans | -52.4 | 128.1 | -176.1 | 63.2 | 0 | 0 | 0 | 0 | 112.2 | R62 | S60-R62 PolarHBondContact O-N 3Å; S60-R62 VanDerWaalsContact O-N 3.07Å |
| 61 | L | 42 | Very low | 42.3 | Very low | 180 Ų | 180 | 140.4 Ų | 140.4 | 94% | 0.942 | 82% | 0.817 | S | S | * | * | | | trans | -61.7 | 104.3 | 162.6 | -75.1 | 157.6 | 0 | 0 | 0 | 109 | L59 | L59-L61 PolarHBondContact O-N 3.32Š|
| 62 | R | 51.5 | Low | 42.2 | Very low | 230 Ų | 230 | 138.4 Ų | 138.4 | 87% | 0.868 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -98.2 | 131.5 | 157.4 | -86.3 | -172.1 | 161.1 | 167.4 | -3.7 | 108.8 | S60 | S60-R62 PolarHBondContact O-N 3Å; S60-R62 VanDerWaalsContact O-N 3.07Å |
| 63 | P | 43.8 | Very low | 41.8 | Very low | 125 Ų | 125 | 138.7 Ų | 138.7 | 81% | 0.812 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 152.4 | -177.2 | 32.1 | -33.7 | 0 | 0 | 0 | 111.9 | | |
| 64 | M | 37.6 | Very low | 41.6 | Very low | 189 Ų | 189 | 138.8 Ų | 138.8 | 93% | 0.931 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -48.8 | 134.7 | -172 | -68.4 | 161.5 | 21.4 | 0 | 0 | 115.4 | | |
| 65 | A | 40.8 | Very low | 41.4 | Very low | 99 Ų | 99 | 145.3 Ų | 145.3 | 82% | 0.818 | 83% | 0.829 | S | S | * | * | | | trans | -114.9 | 129.3 | 154.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | | |
| 66 | A | 38.4 | Very low | 41.5 | Very low | 108 Ų | 108 | 145.4 Ų | 145.4 | 89% | 0.893 | 82% | 0.823 | S | S | * | * | | | trans | -60.6 | 145.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111 | | |
| 67 | G | 38.5 | Very low | 41.5 | Very low | 66 Ų | 66 | 141.2 Ų | 141.2 | 68% | 0.68 | 82% | 0.815 | S | S | * | * | | | trans | 163.3 | 94.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | | |
| 68 | D | 41.5 | Very low | 41.2 | Very low | 129 Ų | 129 | 142.3 Ų | 142.3 | 69% | 0.69 | 82% | 0.824 | S | S | * | * | | | trans | 62.5 | 120.5 | 140.6 | -71.3 | -60.5 | 0 | 0 | 0 | 122.7 | | |
| 69 | Q | 37.4 | Very low | 41.5 | Very low | 160 Ų | 160 | 141.4 Ų | 141.4 | 75% | 0.748 | 81% | 0.811 | S | S | * | * | | | | 60.4 | 92.7 | 127.7 | -64.6 | 177.8 | 26.9 | 0 | 0 | 118.6 | | |
| 70 | W | 40.7 | Very low | 40.9 | Very low | 256 Ų | 256 | 142.3 Ų | 142.3 | 97% | 0.97 | 81% | 0.811 | S | S | * | * | | | trans | -128.9 | 94.5 | 140.8 | -72.1 | 76.7 | 0 | 0 | 0 | 109.2 | G72 | W70-G72 PolarHBondContact O-N 3.14Š|
| 71 | S | 39.1 | Very low | 40.9 | Very low | 131 Ų | 131 | 142.4 Ų | 142.4 | 92% | 0.916 | 81% | 0.811 | S | S | * | * | | | trans | -65.4 | 112.3 | 161.6 | -178 | 0 | 0 | 0 | 0 | 107.7 | | |
| 72 | G | 42.2 | Very low | 40.9 | Very low | 65 Ų | 65 | 140.3 Ų | 140.3 | 67% | 0.67 | 81% | 0.806 | S | S | * | * | | | trans | -146.7 | 77.4 | -175.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | W70 N74 | W70-G72 PolarHBondContact O-N 3.14Å; G72-N74 PolarHBondContact O-N 3.44Å; G72-N74 VanDerWaalsContact O-N 3.12Å |
| 73 | S | 34.5 | Very low | 40.4 | Very low | 116 Ų | 116 | 136 Ų | 136 | 81% | 0.811 | 80% | 0.799 | S | S | * | * | | | trans | -8.1 | 96.7 | 162.3 | -159.2 | 0 | 0 | 0 | 0 | 115.8 | | |
| 74 | N | 40.7 | Very low | 40.2 | Very low | 154 Ų | 154 | 133.9 Ų | 133.9 | 82% | 0.824 | 78% | 0.781 | S | S | * | * | | | trans | -153.6 | 79.7 | 154.5 | -94.3 | -32.2 | 0 | 0 | 0 | 108 | G72 I76 | G72-N74 PolarHBondContact O-N 3.44Å; G72-N74 VanDerWaalsContact O-N 3.12Å; N74-I76 PolarHBondContact O-N 3.18Å |
| 75 | R | 41.2 | Very low | 40.6 | Very low | 247 Ų | 247 | 134.2 Ų | 134.2 | 93% | 0.932 | 77% | 0.772 | S | S | * | * | | | trans | -66.3 | 99.8 | 166 | -76.4 | -173.3 | -177.7 | -165.7 | 1.5 | 108.2 | | |
| 76 | I | 45.7 | Very low | 41 | Very low | 150 Ų | 150 | 135.3 Ų | 135.3 | 77% | 0.769 | 76% | 0.76 | S | S | * | * | | | trans | -79.4 | 119.7 | 158.3 | -57.9 | 173.9 | 0 | 0 | 0 | 105.9 | N74 A78 | N74-I76 PolarHBondContact O-N 3.18Å; I76-A78 PolarHBondContact O-N 3.46Å; I76-A78 VanDerWaalsContact O-N 3.12Å |
| 77 | P | 44.8 | Very low | 41.4 | Very low | 103 Ų | 103 | 135.9 Ų | 135.9 | 67% | 0.669 | 75% | 0.748 | S | S | * | * | | | trans | -64.7 | 116.5 | 172.6 | 24.4 | -29.2 | 0 | 0 | 0 | 108.9 | S79 | P77-S79 PolarHBondContact O-N 2.99Š|
| 78 | A | 38.4 | Very low | 41.5 | Very low | 110 Ų | 110 | 135.6 Ų | 135.6 | 91% | 0.909 | 75% | 0.745 | S | S | * | * | | | trans | -67.7 | 79.6 | 168.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | I76 | I76-A78 PolarHBondContact O-N 3.46Å; I76-A78 VanDerWaalsContact O-N 3.12Å |
| 79 | S | 42.1 | Very low | 41.5 | Very low | 92 Ų | 92 | 135.5 Ų | 135.5 | 64% | 0.643 | 75% | 0.753 | S | S | * | * | | | trans | -154.8 | 64.4 | 171.4 | 66.9 | 0 | 0 | 0 | 0 | 110.2 | P77 | P77-S79 PolarHBondContact O-N 2.99Š|
| 80 | Q | 36.5 | Very low | 41.8 | Very low | 180 Ų | 180 | 138.8 Ų | 138.8 | 84% | 0.841 | 76% | 0.759 | S | S | * | * | | | trans | -128.8 | 105 | 152.1 | -74.5 | -156.4 | 4.8 | 0 | 0 | 108 | T82 | Q80-T82 PolarHBondContact O-N 2.88Š|
| 81 | S | 41.9 | Very low | 41.6 | Very low | 100 Ų | 100 | 130.3 Ų | 130.3 | 70% | 0.699 | 75% | 0.751 | S | S | * | * | | | trans | -48.4 | 111.9 | 157.4 | 47 | 0 | 0 | 0 | 0 | 106.9 | I83 | S81-I83 PolarHBondContact O-N 3.44Š|
| 82 | T | 41.3 | Very low | 41.6 | Very low | 137 Ų | 137 | 129.6 Ų | 129.6 | 84% | 0.84 | 75% | 0.746 | S | S | * | * | | | trans | -62.7 | 94.9 | 167 | -42.8 | 0 | 0 | 0 | 0 | 105.3 | Q80 N84 | Q80-T82 PolarHBondContact O-N 2.88Å; T82-N84 PolarHBondContact O-N 3.43Å |
| 83 | I | 41.5 | Very low | 41.7 | Very low | 140 Ų | 140 | 130.8 Ų | 130.8 | 72% | 0.718 | 74% | 0.744 | S | S | * | * | | | trans | -65.9 | 93.4 | 174.4 | -64.4 | 170.7 | 0 | 0 | 0 | 104.9 | S81 W85 | S81-I83 PolarHBondContact O-N 3.44Å; I83-W85 VanDerWaalsContact C-N 3.33Å; I83-W85 PolarHBondContact O-N 3.28Å |
| 84 | N | 40.5 | Very low | 41.9 | Very low | 79 Ų | 79 | 135.3 Ų | 135.3 | 42% | 0.422 | 75% | 0.745 | S | S | . | * | | | trans | -67.3 | 100.4 | 168.9 | -157.8 | 6 | 0 | 0 | 0 | 105.2 | T82 Q86 D87 | T82-N84 PolarHBondContact O-N 3.43Å; N84-Q86 PolarHBondContact O-N 3.4Å; N84-D87 WeakPolarHBondContact CB-OD2 3.15Å; N84-D87 PolarHBondContact ND2-OD2 3.41Å; N84-D87 PolarHBondContact O-N 3.12Å |
| 85 | W | 44.5 | Very low | 42 | Very low | 196 Ų | 196 | 137.1 Ų | 137.1 | 74% | 0.742 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.1 | -11.5 | -178.1 | 54.3 | -89.7 | 0 | 0 | 0 | 112.9 | I83 | I83-W85 VanDerWaalsContact C-N 3.33Å; I83-W85 PolarHBondContact O-N 3.28Å |
| 86 | Q | 50.4 | Low | 42.3 | Very low | 123 Ų | 123 | 129.9 Ų | 129.9 | 58% | 0.575 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.7 | -21.2 | 173.3 | -65 | -178.9 | 2.1 | 0 | 0 | 113.5 | N84 | N84-Q86 PolarHBondContact O-N 3.4Š|
| 87 | D | 46.8 | Very low | 41.9 | Very low | 119 Ų | 119 | 127 Ų | 127 | 64% | 0.636 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.7 | -11.3 | 179.8 | -72.5 | -43.5 | 0 | 0 | 0 | 113.4 | N84 C89 | N84-D87 WeakPolarHBondContact CB-OD2 3.15Å; N84-D87 PolarHBondContact ND2-OD2 3.41Å; N84-D87 PolarHBondContact O-N 3.12Å; D87-C89 PolarHBondContact O-N 3.01Å |
| 88 | G | 39.7 | Very low | 41.9 | Very low | 61 Ų | 61 | 129.6 Ų | 129.6 | 63% | 0.629 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | -3.2 | -170.2 | 0 | 0 | 0 | 0 | 0 | 117.6 | | |
| 89 | C | 42.6 | Very low | 42.2 | Very low | 126 Ų | 126 | 132 Ų | 132 | 85% | 0.851 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.9 | 6.3 | -173.5 | -69.9 | 0 | 0 | 0 | 0 | 114.8 | D87 | D87-C89 PolarHBondContact O-N 3.01Š|
| 90 | R | 43.6 | Very low | 42.5 | Very low | 230 Ų | 230 | 135.7 Ų | 135.7 | 87% | 0.868 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -109.4 | 89.1 | 177.9 | -75.4 | -172.6 | 173.9 | -137.1 | -0.3 | 110.5 | | |
| 91 | G | 35.7 | Very low | 43 | Very low | 78 Ų | 78 | 134.3 Ų | 134.3 | 80% | 0.804 | 72% | 0.721 | S | S | * | * | S | Bend | trans | 78.6 | 90.2 | 158.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | | |
| 92 | S | 40 | Very low | 42.9 | Very low | 115 Ų | 115 | 132.7 Ų | 132.7 | 80% | 0.804 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -177.3 | -15.4 | 138.6 | -166.3 | 0 | 0 | 0 | 0 | 113.8 | | |
| 93 | S | 43.1 | Very low | 43.1 | Very low | 91 Ų | 91 | 134.9 Ų | 134.9 | 64% | 0.636 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -107.5 | 1.1 | -167.6 | 59.7 | 0 | 0 | 0 | 0 | 116.7 | K95 | S93-K95 VanDerWaalsContact C-N 3.33Å; S93-K95 PolarHBondContact O-N 3.12Å |
| 94 | Y | 39.4 | Very low | 43 | Very low | 210 Ų | 210 | 137.5 Ų | 137.5 | 82% | 0.824 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | -18.5 | -177.9 | -149.3 | -96.5 | 0 | 0 | 0 | 113.8 | | |
| 95 | K | 42.9 | Very low | 43.2 | Very low | 192 Ų | 192 | 138.5 Ų | 138.5 | 84% | 0.835 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.4 | -18.6 | 177.9 | -78.7 | -168.6 | 173.9 | -174 | 0 | 114.3 | S93 | S93-K95 VanDerWaalsContact C-N 3.33Å; S93-K95 PolarHBondContact O-N 3.12Å |
| 96 | T | 46.5 | Very low | 43.2 | Very low | 95 Ų | 95 | 138.4 Ų | 138.4 | 58% | 0.583 | 75% | 0.754 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.7 | -16 | -177.9 | -4 | 0 | 0 | 0 | 0 | 113.5 | | |
| 97 | C | 37.2 | Very low | 42.5 | Very low | 89 Ų | 89 | 143.7 Ų | 143.7 | 60% | 0.601 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -86.3 | -22.8 | -179.8 | -146 | 0 | 0 | 0 | 0 | 113.4 | | |
| 98 | Q | 44.4 | Very low | 42.2 | Very low | 159 Ų | 159 | 143 Ų | 143 | 74% | 0.743 | 78% | 0.78 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | -20.3 | 174.6 | -86 | -160.5 | -8.3 | 0 | 0 | 113.6 | | |
| 99 | Q | 45.6 | Very low | 42.1 | Very low | 159 Ų | 159 | 145.8 Ų | 145.8 | 74% | 0.743 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84 | -18.1 | -176.7 | -148.6 | 165.6 | 25.8 | 0 | 0 | 113.3 | | |
| 100 | E | 47.6 | Very low | 42.1 | Very low | 171 Ų | 171 | 145.9 Ų | 145.9 | 80% | 0.799 | 78% | 0.78 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.6 | -17.6 | 174.4 | -70.5 | -151.2 | 151.2 | 0 | 0 | 114.3 | G102 | E100-G102 VanDerWaalsContact C-N 3.3Å; E100-G102 PolarHBondContact O-N 2.86Å |
| 101 | L | 46.9 | Very low | 41.9 | Very low | 151 Ų | 151 | 140.6 Ų | 140.6 | 79% | 0.791 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | 3.4 | 179.8 | -74.2 | 165.6 | 0 | 0 | 0 | 114.1 | | |
| 102 | G | 41.5 | Very low | 42.1 | Very low | 65 Ų | 65 | 141.5 Ų | 141.5 | 67% | 0.67 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.2 | 2.6 | -174.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | E100 | E100-G102 VanDerWaalsContact C-N 3.3Å; E100-G102 PolarHBondContact O-N 2.86Å |
| 103 | K | 44.6 | Very low | 42 | Very low | 183 Ų | 183 | 141.4 Ų | 141.4 | 80% | 0.796 | 78% | 0.775 | S | S | * | * | | | trans | -102.9 | 109.5 | 177.5 | -69.2 | -174.8 | -179.7 | -177.8 | 0 | 110.2 | A105 | K103-A105 PolarHBondContact O-N 2.97Š|
| 104 | Q | 39.7 | Very low | 41.9 | Very low | 196 Ų | 196 | 142.6 Ų | 142.6 | 92% | 0.916 | 78% | 0.783 | S | S | * | * | | | trans | -58.9 | 109.4 | 161.6 | -75.9 | -162.4 | 2.6 | 0 | 0 | 107.8 | E106 | Q104-E106 PolarHBondContact O-N 3.12Å; Q104-E106 VanDerWaalsContact O-N 3.16Å |
| 105 | A | 43.4 | Very low | 41.7 | Very low | 100 Ų | 100 | 143.2 Ų | 143.2 | 83% | 0.826 | 78% | 0.784 | S | S | * | * | | | trans | -72 | 107.9 | 169.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | K103 R107 | K103-A105 PolarHBondContact O-N 2.97Å; A105-R107 PolarHBondContact O-N 2.78Å |
| 106 | E | 45.3 | Very low | 41.8 | Very low | 193 Ų | 193 | 140.1 Ų | 140.1 | 90% | 0.902 | 78% | 0.784 | S | S | * | * | | | trans | -36.1 | 126.3 | 165.2 | -117.4 | 174.1 | 139.7 | 0 | 0 | 111.9 | Q104 A108 | Q104-E106 PolarHBondContact O-N 3.12Å; Q104-E106 VanDerWaalsContact O-N 3.16Å; E106-A108 PolarHBondContact O-N 3.35Å |
| 107 | R | 35.4 | Very low | 41.3 | Very low | 234 Ų | 234 | 140.9 Ų | 140.9 | 88% | 0.883 | 79% | 0.789 | S | S | * | * | | | trans | -67.2 | 121.6 | 171 | -115.9 | 177.6 | 173.7 | 173.7 | -2.5 | 108.6 | A105 V109 | A105-R107 PolarHBondContact O-N 2.78Å; R107-V109 PolarHBondContact O-N 3.2Å; R107-V109 VanDerWaalsContact O-N 3.08Å |
| 108 | A | 41.9 | Very low | 41.4 | Very low | 105 Ų | 105 | 140.2 Ų | 140.2 | 87% | 0.868 | 79% | 0.789 | S | S | * | * | | | trans | -64.9 | 108.8 | 164.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | E106 | E106-A108 PolarHBondContact O-N 3.35Š|
| 109 | V | 37.7 | Very low | 41.4 | Very low | 120 Ų | 120 | 143.9 Ų | 143.9 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | | | trans | -84.1 | 155.1 | 162.5 | -177.7 | 0 | 0 | 0 | 0 | 107.2 | R107 | R107-V109 PolarHBondContact O-N 3.2Å; R107-V109 VanDerWaalsContact O-N 3.08Å |
| 110 | V | 41.8 | Very low | 40.9 | Very low | 127 Ų | 127 | 139.7 Ų | 139.7 | 77% | 0.77 | 80% | 0.797 | S | S | * | * | | | trans | 98.9 | 139.2 | 161.5 | -166.7 | 0 | 0 | 0 | 0 | 115.6 | | |
| 111 | P | 40.1 | Very low | 40.6 | Very low | 119 Ų | 119 | 142.7 Ų | 142.7 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | | | cis | -129.6 | 169 | -24 | 32.3 | -14.3 | 0 | 0 | 0 | 114.6 | | |
| 112 | A | 39.2 | Very low | 40.5 | Very low | 97 Ų | 97 | 142.5 Ų | 142.5 | 80% | 0.802 | 80% | 0.801 | S | S | * | * | | | trans | -63.8 | 164.7 | 170 | 0 | 0 | 0 | 0 | 0 | 114.9 | | |
| 113 | S | 36.7 | Very low | 40.5 | Very low | 114 Ų | 114 | 145.7 Ų | 145.7 | 80% | 0.797 | 81% | 0.807 | S | S | * | * | | | trans | 94.1 | 102.4 | 158.3 | -167.5 | 0 | 0 | 0 | 0 | 117.7 | | |
| 114 | S | 42.3 | Very low | 41.2 | Very low | 115 Ų | 115 | 142.1 Ų | 142.1 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | | | | -176.9 | 116.2 | 110.6 | 27.4 | 0 | 0 | 0 | 0 | 110 | | |
| 115 | R | 35.8 | Very low | 41.3 | Very low | 224 Ų | 224 | 139.4 Ų | 139.4 | 85% | 0.845 | 80% | 0.795 | S | S | * | * | | | trans | -87.7 | 152.5 | 176.1 | -152.5 | 179.6 | -173.7 | -168.1 | 2.9 | 108.5 | | |
| 116 | P | 43.3 | Very low | 41.4 | Very low | 126 Ų | 126 | 145 Ų | 145 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | | | trans | -121.1 | 130.6 | 132.7 | 0.6 | 19.9 | 0 | 0 | 0 | 112 | | |
| 117 | T | 37.3 | Very low | 41.2 | Very low | 112 Ų | 112 | 140.5 Ų | 140.5 | 69% | 0.687 | 79% | 0.786 | S | S | * | * | | | trans | -57.1 | 140.5 | 166.6 | 33.2 | 0 | 0 | 0 | 0 | 113.2 | | |
| 118 | A | 39.5 | Very low | 41.9 | Very low | 74 Ų | 74 | 138.3 Ų | 138.3 | 61% | 0.612 | 78% | 0.783 | S | S | * | * | | | | 180 | 141.1 | 118.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | | |
| 119 | Y | 43 | Very low | 41.9 | Very low | 236 Ų | 236 | 140.9 Ų | 140.9 | 93% | 0.925 | 78% | 0.777 | S | S | * | * | | | trans | 68.2 | 106 | 171.1 | -48.4 | -77.6 | 0 | 0 | 0 | 115.1 | | |
| 120 | G | 35.8 | Very low | 42.2 | Very low | 71 Ų | 71 | 142.2 Ų | 142.2 | 73% | 0.732 | 78% | 0.78 | S | S | * | * | | | cis | 111.9 | 98.4 | 30.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | | |
| 121 | R | 41.5 | Very low | 42.2 | Very low | 234 Ų | 234 | 143 Ų | 143 | 88% | 0.883 | 78% | 0.78 | S | S | * | * | | | trans | 163.1 | 107.9 | 140.5 | -88.7 | 176.9 | -173.1 | -161.5 | 1.6 | 112 | | |
| 122 | D | 44.2 | Very low | 42.4 | Very low | 147 Ų | 147 | 145.2 Ų | 145.2 | 79% | 0.786 | 79% | 0.785 | S | S | * | * | | | trans | 58.7 | 101.3 | 137.4 | -53.2 | -53.1 | 0 | 0 | 0 | 120.5 | | |
| 123 | V | 41.9 | Very low | 42.5 | Very low | 132 Ų | 132 | 144.8 Ų | 144.8 | 80% | 0.8 | 78% | 0.781 | S | S | * | * | | | trans | -120.7 | 131.5 | 153.9 | 178.3 | 0 | 0 | 0 | 0 | 107.1 | | |
| 124 | P | 58.4 | Low | 42.7 | Very low | 108 Ų | 108 | 145.3 Ų | 145.3 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | | | trans | -96.7 | 113.4 | 153.3 | 0.2 | 19.5 | 0 | 0 | 0 | 109.1 | Y126 | P124-Y126 HydrophobicContact CB-CE2 4.32Š|
| 125 | D | 42.4 | Very low | 42.8 | Very low | 139 Ų | 139 | 148.8 Ų | 148.8 | 74% | 0.743 | 79% | 0.789 | S | S | * | * | | | trans | -76.8 | 124 | 171.7 | -162.9 | -8.9 | 0 | 0 | 0 | 109 | | |
| 126 | Y | 46.1 | Very low | 43.3 | Very low | 217 Ų | 217 | 148 Ų | 148 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | | | trans | -122.8 | 80.1 | 169.6 | -85 | -81.9 | 0 | 0 | 0 | 109.2 | P124 | P124-Y126 HydrophobicContact CB-CE2 4.32Š|
| 127 | S | 41.8 | Very low | 43.3 | Very low | 100 Ų | 100 | 147.2 Ų | 147.2 | 70% | 0.699 | 79% | 0.789 | S | S | * | * | | | trans | -81.4 | 104.8 | 161.7 | 173.6 | 0 | 0 | 0 | 0 | 110 | | |
| 128 | K | 49.1 | Very low | 43.4 | Very low | 188 Ų | 188 | 148.1 Ų | 148.1 | 82% | 0.817 | 80% | 0.795 | S | S | * | * | | | trans | -159 | 108.6 | 150.6 | -64.8 | -160.6 | -178.5 | -178.7 | 0 | 107.6 | | |
| 129 | Q | 42.2 | Very low | 43.5 | Very low | 159 Ų | 159 | 153.1 Ų | 153.1 | 74% | 0.743 | 81% | 0.805 | S | S | * | * | | | | 68.9 | 108.2 | 87.6 | -162.1 | 179.5 | -5.1 | 0 | 0 | 111.8 | | |
| 130 | D | 43.9 | Very low | 43.5 | Very low | 147 Ų | 147 | 149.1 Ų | 149.1 | 79% | 0.786 | 80% | 0.795 | S | S | * | * | | | | 174.9 | 124.6 | 122.6 | -86.8 | -40.5 | 0 | 0 | 0 | 112.7 | | |
| 131 | D | 42.7 | Very low | 43.9 | Very low | 145 Ų | 145 | 152.9 Ų | 152.9 | 78% | 0.775 | 79% | 0.793 | S | S | * | * | | | trans | -59.6 | 141.6 | 161.2 | -69.8 | -78.5 | 0 | 0 | 0 | 111.1 | | |
| 132 | N | 44.2 | Very low | 44 | Very low | 165 Ų | 165 | 147 Ų | 147 | 88% | 0.882 | 79% | 0.787 | S | S | * | * | | | | -174.7 | 140.6 | 126.5 | -104.6 | -62.2 | 0 | 0 | 0 | 113.8 | | |
| 133 | A | 41.2 | Very low | 44 | Very low | 87 Ų | 87 | 150 Ų | 150 | 72% | 0.719 | 79% | 0.794 | S | S | * | * | | | trans | -66.9 | 149.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | | |
| 134 | S | 39.9 | Very low | 43.7 | Very low | 126 Ų | 126 | 148.2 Ų | 148.2 | 88% | 0.881 | 79% | 0.793 | S | S | * | * | | | trans | -155.4 | 110.4 | 147 | -106.7 | 0 | 0 | 0 | 0 | 112.2 | | |
| 135 | Q | 43.8 | Very low | 43 | Very low | 187 Ų | 187 | 149.6 Ų | 149.6 | 87% | 0.874 | 80% | 0.799 | S | S | * | * | | | trans | -70.9 | 138.9 | 162.3 | -63.8 | 176.5 | -68.6 | 0 | 0 | 110.4 | | |
| 136 | K | 46.9 | Very low | 42.9 | Very low | 209 Ų | 209 | 147.5 Ų | 147.5 | 91% | 0.909 | 80% | 0.801 | S | S | * | * | | | trans | 179.3 | 139.1 | 154.1 | -107.2 | 170.6 | 178.4 | -179.4 | 0 | 106.8 | | |
| 137 | S | 43.7 | Very low | 43 | Very low | 108 Ų | 108 | 144.7 Ų | 144.7 | 76% | 0.755 | 80% | 0.799 | S | S | * | * | | | cis | -158.5 | 150.6 | 7.7 | 58.6 | 0 | 0 | 0 | 0 | 111.1 | | |
| 138 | T | 39.3 | Very low | 43 | Very low | 132 Ų | 132 | 145.3 Ų | 145.3 | 81% | 0.81 | 80% | 0.801 | S | S | * | * | | | trans | -47.3 | 141.3 | 156 | -14.4 | 0 | 0 | 0 | 0 | 113 | | |
| 139 | Q | 41.9 | Very low | 42.5 | Very low | 178 Ų | 178 | 146.3 Ų | 146.3 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | | | | -176.1 | 152.1 | 121.7 | -114.9 | 177.4 | -0.3 | 0 | 0 | 113.9 | | |
| 140 | Q | 42.5 | Very low | 42.6 | Very low | 152 Ų | 152 | 146.6 Ų | 146.6 | 71% | 0.71 | 81% | 0.812 | S | S | * | * | | | trans | -62 | 162.9 | -174.6 | -62.7 | 162 | -28.7 | 0 | 0 | 111.8 | | |
| 141 | H | 45.2 | Very low | 42.1 | Very low | 151 Ų | 151 | 143.1 Ų | 143.1 | 70% | 0.699 | 81% | 0.811 | S | S | * | * | | | | -175.7 | 135 | 78.2 | -82.3 | -86.1 | 0 | 0 | 0 | 111 | | |
| 142 | S | 42.4 | Very low | 42 | Very low | 109 Ų | 109 | 146.6 Ų | 146.6 | 76% | 0.762 | 81% | 0.813 | S | S | * | * | | | trans | 20.5 | 128.5 | 138.7 | -40.6 | 0 | 0 | 0 | 0 | 120.3 | | |
| 143 | K | 44.1 | Very low | 42 | Very low | 211 Ų | 211 | 142.5 Ų | 142.5 | 92% | 0.917 | 80% | 0.798 | S | S | * | * | | | | 165.1 | 137.5 | 99.2 | -154.9 | 163.5 | -173.2 | 177.3 | 0 | 111.1 | | |
| 144 | A | 35.4 | Very low | 42.2 | Very low | 94 Ų | 94 | 149.8 Ų | 149.8 | 78% | 0.777 | 81% | 0.806 | S | S | * | * | | | trans | -79 | 143.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 145 | T | 44.8 | Very low | 42.3 | Very low | 137 Ų | 137 | 151.4 Ų | 151.4 | 84% | 0.84 | 80% | 0.8 | S | S | * | * | | | trans | -135.7 | 117.8 | 155.1 | -45.2 | 0 | 0 | 0 | 0 | 109.1 | | |
| 146 | A | 39.6 | Very low | 42.3 | Very low | 95 Ų | 95 | 147.8 Ų | 147.8 | 79% | 0.785 | 80% | 0.795 | S | S | * | * | | | trans | -62 | 135.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | | |
| 147 | I | 48.4 | Very low | 42 | Very low | 158 Ų | 158 | 149.7 Ų | 149.7 | 81% | 0.81 | 80% | 0.797 | S | S | * | * | | | trans | -130.4 | 123.6 | 161.2 | -58.5 | -179.4 | 0 | 0 | 0 | 107.7 | | |
| 148 | P | 42.8 | Very low | 41.9 | Very low | 113 Ų | 113 | 148 Ų | 148 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | | | trans | -76.7 | 157.5 | -171.4 | 31.2 | -34.1 | 0 | 0 | 0 | 112.7 | N150 | P148-N150 PolarHBondContact O-N 3.22Å; P148-N150 VanDerWaalsContact O-N 3.11Å |
| 149 | K | 38.5 | Very low | 42.1 | Very low | 210 Ų | 210 | 149.1 Ų | 149.1 | 91% | 0.913 | 79% | 0.791 | S | S | * | * | | | trans | -50.6 | 105.3 | 177.7 | -62.1 | 171 | 179.5 | 174.5 | 0 | 111.7 | | |
| 150 | N | 43.6 | Very low | 42.3 | Very low | 164 Ų | 164 | 149.4 Ų | 149.4 | 88% | 0.877 | 79% | 0.792 | S | S | * | * | | | trans | -103.6 | 91.1 | 159.2 | -111.5 | -7.3 | 0 | 0 | 0 | 108.9 | P148 R152 | P148-N150 PolarHBondContact O-N 3.22Å; P148-N150 VanDerWaalsContact O-N 3.11Å; N150-R152 PolarHBondContact O-N 2.96Å; N150-R152 VanDerWaalsContact O-N 3.14Å |
| 151 | G | 34.3 | Very low | 42.5 | Very low | 74 Ų | 74 | 153.6 Ų | 153.6 | 76% | 0.763 | 80% | 0.801 | S | S | * | * | | | trans | -58.8 | 109.8 | 172 | 0 | 0 | 0 | 0 | 0 | 109.8 | S153 | G151-S153 VanDerWaalsContact C-N 3.32Å; G151-S153 PolarHBondContact O-N 2.85Å; G151-S153 VanDerWaalsContact O-N 3.09Å |
| 152 | R | 40.8 | Very low | 42.4 | Very low | 218 Ų | 218 | 156.2 Ų | 156.2 | 82% | 0.823 | 81% | 0.811 | S | S | * | * | | | trans | -82.3 | 84.5 | 173.9 | -151.2 | 173.4 | -72.1 | -158.2 | -1.1 | 107.1 | N150 W154 | N150-R152 PolarHBondContact O-N 2.96Å; N150-R152 VanDerWaalsContact O-N 3.14Å; R152-W154 PolarHBondContact O-N 2.99Å |
| 153 | S | 43.4 | Very low | 42.1 | Very low | 80 Ų | 80 | 155.3 Ų | 155.3 | 56% | 0.559 | 82% | 0.818 | S | S | * | * | | | trans | -67.6 | 121.8 | 172.7 | 69.7 | 0 | 0 | 0 | 0 | 109 | G151 Q155 | G151-S153 VanDerWaalsContact C-N 3.32Å; G151-S153 PolarHBondContact O-N 2.85Å; G151-S153 VanDerWaalsContact O-N 3.09Å; S153-Q155 VanDerWaalsContact CB-OE1 3.22Å; S153-Q155 PolarHBondContact O-N 2.82Å; S153-Q155 PolarHBondContact OG-OE1 2.91Å |
| 154 | W | 44.7 | Very low | 41.9 | Very low | 239 Ų | 239 | 149 Ų | 149 | 91% | 0.905 | 81% | 0.813 | S | S | * | * | | | trans | -86.1 | 74.3 | 165.9 | -71.8 | 73.3 | 0 | 0 | 0 | 106.7 | R152 S156 | R152-W154 PolarHBondContact O-N 2.99Å; W154-S156 PolarHBondContact O-N 3.22Å |
| 155 | Q | 43.3 | Very low | 42.1 | Very low | 160 Ų | 160 | 150.9 Ų | 150.9 | 75% | 0.748 | 82% | 0.815 | S | S | * | * | | | trans | -70.4 | 128 | 174 | -120.3 | 102.6 | 16.4 | 0 | 0 | 109.6 | S153 R157 | S153-Q155 VanDerWaalsContact CB-OE1 3.22Å; S153-Q155 PolarHBondContact O-N 2.82Å; S153-Q155 PolarHBondContact OG-OE1 2.91Å; Q155-R157 PolarHBondContact O-N 3.48Å |
| 156 | S | 42 | Very low | 42.5 | Very low | 111 Ų | 111 | 153.6 Ų | 153.6 | 78% | 0.776 | 82% | 0.815 | S | S | * | * | | | trans | -36.4 | 119.5 | 177.1 | -67.3 | 0 | 0 | 0 | 0 | 114.9 | W154 A158 | W154-S156 PolarHBondContact O-N 3.22Å; S156-A158 PolarHBondContact O-N 3.04Å |
| 157 | R | 40.6 | Very low | 42.9 | Very low | 249 Ų | 249 | 158.7 Ų | 158.7 | 94% | 0.94 | 82% | 0.82 | S | S | * | * | | | trans | -81.1 | 69.8 | 162.6 | -160.9 | 176.8 | -166.8 | 175.8 | 3.9 | 108.8 | Q155 | Q155-R157 PolarHBondContact O-N 3.48Š|
| 158 | A | 41.7 | Very low | 42.6 | Very low | 73 Ų | 73 | 155.8 Ų | 155.8 | 60% | 0.603 | 82% | 0.819 | S | S | * | * | | | trans | -143 | 53.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | S156 | S156-A158 PolarHBondContact O-N 3.04Š|
| 159 | D | 43.4 | Very low | 43 | Very low | 155 Ų | 155 | 159.8 Ų | 159.8 | 83% | 0.829 | 83% | 0.828 | S | S | * | * | | | trans | -171.5 | 83.6 | 161.8 | -105 | -42.6 | 0 | 0 | 0 | 110.2 | | |
| 160 | Q | 47.7 | Very low | 43.2 | Very low | 184 Ų | 184 | 158.5 Ų | 158.5 | 86% | 0.86 | 83% | 0.825 | S | S | * | * | | | trans | -142 | 44.8 | 167.1 | -83.5 | -159.1 | -3.8 | 0 | 0 | 111.3 | | |
| 161 | R | 46.2 | Very low | 43.4 | Very low | 240 Ų | 240 | 154.5 Ų | 154.5 | 91% | 0.906 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -132.2 | 40.8 | 170.7 | -80.8 | -165.7 | 167 | -150.7 | -2.4 | 112.9 | | |
| 162 | K | 43.1 | Very low | 44 | Very low | 207 Ų | 207 | 160.2 Ų | 160.2 | 90% | 0.9 | 82% | 0.817 | S | S | * | * | S | Bend | trans | -150.6 | 126.6 | 161 | -70.3 | -164.8 | 179.1 | 179.7 | 0 | 109.4 | | |
| 163 | G | 36.1 | Very low | 44 | Very low | 89 Ų | 89 | 152.9 Ų | 152.9 | 92% | 0.918 | 81% | 0.809 | S | S | * | * | | | trans | 112.8 | 89.1 | 167.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | | |
| 164 | G | 38.8 | Very low | 44.1 | Very low | 78 Ų | 78 | 158.3 Ų | 158.3 | 80% | 0.804 | 83% | 0.825 | S | S | * | * | | | trans | -161.6 | 79.8 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | | |
| 165 | T | 41.4 | Very low | 44 | Very low | 134 Ų | 134 | 158 Ų | 158 | 82% | 0.822 | 82% | 0.824 | S | S | * | * | | | trans | -59.4 | 140 | 177.2 | 42.2 | 0 | 0 | 0 | 0 | 111.9 | | |
| 166 | K | 51.8 | Low | 44.4 | Very low | 195 Ų | 195 | 158.6 Ų | 158.6 | 85% | 0.848 | 83% | 0.832 | S | S | * | * | | | trans | -176.3 | 122 | 137.5 | -100.5 | 161.9 | -171.6 | -175.7 | 0 | 112.8 | | |
| 167 | K | 49.5 | Very low | 44.8 | Very low | 202 Ų | 202 | 157.6 Ų | 157.6 | 88% | 0.878 | 83% | 0.83 | S | S | * | * | | | trans | 75 | 112.4 | 145.1 | -66.9 | -170.6 | 173.2 | -172.2 | 0 | 119.9 | | |
| 168 | A | 40.8 | Very low | 44.6 | Very low | 97 Ų | 97 | 151 Ų | 151 | 80% | 0.802 | 83% | 0.829 | S | S | * | * | | | trans | -39.3 | 141.9 | 159.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | | |
| 169 | Q | 50.4 | Low | 44.5 | Very low | 197 Ų | 197 | 151.3 Ų | 151.3 | 92% | 0.921 | 84% | 0.839 | S | S | * | * | | | trans | -150.7 | 130.3 | 130.8 | -105.4 | 176.6 | -11.4 | 0 | 0 | 109.6 | | |
| 170 | H | 42.7 | Very low | 44.4 | Very low | 182 Ų | 182 | 151.2 Ų | 151.2 | 84% | 0.843 | 84% | 0.838 | S | S | * | * | | | trans | -36.8 | 159.2 | 160.3 | -98.4 | -128.5 | 0 | 0 | 0 | 113.2 | | |
| 171 | S | 49.6 | Very low | 44.3 | Very low | 81 Ų | 81 | 148.3 Ų | 148.3 | 57% | 0.566 | 84% | 0.838 | S | S | * | * | | | cis | -174.3 | 161.8 | 10.2 | 38 | 0 | 0 | 0 | 0 | 107.8 | | |
| 172 | E | 46.7 | Very low | 44.2 | Very low | 193 Ų | 193 | 141.1 Ų | 141.1 | 90% | 0.902 | 83% | 0.83 | S | S | * | * | | | trans | 59.3 | 129.7 | 154.3 | -68.1 | 166.3 | 152.7 | 0 | 0 | 117.6 | | |
| 173 | G | 39.8 | Very low | 44.2 | Very low | 64 Ų | 64 | 143.2 Ų | 143.2 | 66% | 0.66 | 83% | 0.832 | S | S | * | * | | | cis | 145.3 | 120.2 | 21.4 | 0 | 0 | 0 | 0 | 0 | 105.3 | | |
| 174 | H | 45.9 | Very low | 44.5 | Very low | 195 Ų | 195 | 150.3 Ų | 150.3 | 90% | 0.903 | 83% | 0.831 | S | S | * | * | | | trans | 170.4 | 113.6 | 139.4 | -104.2 | -77.3 | 0 | 0 | 0 | 111.1 | | |
| 175 | R | 42.6 | Very low | 44.9 | Very low | 231 Ų | 231 | 157 Ų | 157 | 87% | 0.872 | 84% | 0.838 | S | S | * | * | | | trans | -61.3 | 148.3 | 159 | -82.7 | 171 | 154.7 | 159.8 | -7.1 | 110.2 | | |
| 176 | L | 52.2 | Low | 44.7 | Very low | 174 Ų | 174 | 154.4 Ų | 154.4 | 91% | 0.911 | 84% | 0.839 | S | S | * | * | | | trans | 167.5 | 142.5 | 140.2 | -83 | -179 | 0 | 0 | 0 | 105.4 | | |
| 177 | A | 49 | Very low | 43.8 | Very low | 90 Ų | 90 | 148.4 Ų | 148.4 | 74% | 0.744 | 83% | 0.832 | S | S | * | * | | | cis | -161.9 | 155.8 | -17.9 | 0 | 0 | 0 | 0 | 0 | 105.2 | | |
| 178 | A | 37.1 | Very low | 43 | Very low | 111 Ų | 111 | 145.2 Ų | 145.2 | 92% | 0.917 | 83% | 0.834 | S | S | * | * | | | trans | -60.5 | 141.1 | -178 | 0 | 0 | 0 | 0 | 0 | 113 | | |
| 179 | G | 38.7 | Very low | 42.7 | Very low | 79 Ų | 79 | 144.9 Ų | 144.9 | 81% | 0.814 | 83% | 0.831 | S | S | * | * | | | trans | -131.9 | 96.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 180 | D | 41.5 | Very low | 41.9 | Very low | 153 Ų | 153 | 143.7 Ų | 143.7 | 82% | 0.818 | 83% | 0.83 | S | S | * | * | | | trans | -58.9 | 137.1 | 173.3 | -126.5 | -46.2 | 0 | 0 | 0 | 111.9 | | |
| 181 | S | 46.8 | Very low | 41.9 | Very low | 122 Ų | 122 | 140.7 Ų | 140.7 | 85% | 0.853 | 83% | 0.826 | S | S | * | * | | | trans | -166.4 | 86.7 | 155.2 | -87 | 0 | 0 | 0 | 0 | 110.6 | | |
| 182 | A | 43.2 | Very low | 41.1 | Very low | 89 Ų | 89 | 143.1 Ų | 143.1 | 74% | 0.736 | 84% | 0.838 | S | S | * | * | | | trans | -61.5 | 131.2 | 162.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | | |
| 183 | R | 43.5 | Very low | 40.6 | Very low | 252 Ų | 252 | 145.3 Ų | 145.3 | 95% | 0.951 | 84% | 0.838 | S | S | * | * | | | trans | -137.6 | 101.1 | 157.1 | -140.2 | 176.5 | -169.7 | -158.6 | 3.2 | 110.2 | | |
| 184 | R | 42.5 | Very low | 40.3 | Very low | 237 Ų | 237 | 151.3 Ų | 151.3 | 89% | 0.894 | 85% | 0.849 | S | S | * | * | | | trans | -70.8 | 144.3 | 170.6 | -67.4 | -177.5 | -178.5 | -177.1 | 0.9 | 110.9 | | |
| 185 | K | 48.2 | Very low | 39.8 | Very low | 218 Ų | 218 | 145.6 Ų | 145.6 | 95% | 0.948 | 84% | 0.843 | S | S | * | * | | | trans | 158.2 | 126 | 147.9 | -92 | -176.3 | -178.2 | -168.3 | 0 | 105.5 | | |
| 186 | G | 35.5 | Very low | 39.4 | Very low | 81 Ų | 81 | 141.1 Ų | 141.1 | 84% | 0.835 | 84% | 0.841 | S | S | * | * | | | cis | 160.7 | 156.7 | 10.3 | 0 | 0 | 0 | 0 | 0 | 106.8 | | |
| 187 | G | 33.8 | Very low | 38.4 | Very low | 68 Ų | 68 | 137.5 Ų | 137.5 | 70% | 0.701 | 84% | 0.836 | S | S | * | * | | | trans | 100.6 | 91.3 | 167.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | | |
| 188 | C | 33.1 | Very low | 37.9 | Very low | 136 Ų | 136 | 137.6 Ų | 137.6 | 92% | 0.919 | 84% | 0.837 | S | S | * | * | | | | 61.9 | 133.7 | 85.3 | -58.8 | 0 | 0 | 0 | 0 | 113 | | |
| 189 | A | 35 | Very low | 38.1 | Very low | 90 Ų | 90 | 140.1 Ų | 140.1 | 74% | 0.744 | 83% | 0.83 | S | S | * | * | | | cis | -171.9 | 136.9 | -16.2 | 0 | 0 | 0 | 0 | 0 | 103.4 | | |
| 190 | L | 33.8 | Very low | 38 | Very low | 172 Ų | 172 | 146.3 Ų | 146.3 | 90% | 0.901 | 83% | 0.829 | S | S | * | * | | | trans | -72 | 140.7 | 170.5 | -79.6 | 153.9 | 0 | 0 | 0 | 109.7 | | |
| 191 | P | 40.8 | Very low | 37.7 | Very low | 118 Ų | 118 | 146.9 Ų | 146.9 | 77% | 0.766 | 83% | 0.827 | S | S | * | * | | | trans | -110.2 | 109.6 | 150.7 | 31.7 | -22.2 | 0 | 0 | 0 | 110.2 | | |
| 192 | T | 34.2 | Very low | 37.1 | Very low | 133 Ų | 133 | 145.8 Ų | 145.8 | 82% | 0.816 | 83% | 0.825 | S | S | * | * | | | trans | -61.5 | 126.2 | 153.6 | -45 | 0 | 0 | 0 | 0 | 108.1 | | |
| 193 | R | 36 | Very low | 37.4 | Very low | 239 Ų | 239 | 147.2 Ų | 147.2 | 90% | 0.902 | 83% | 0.827 | S | S | * | * | | | trans | -138.2 | 99.5 | 166.2 | -128.4 | -178.4 | -178.7 | -117.8 | 1.2 | 110.7 | | |
| 194 | Q | 32.5 | Very low | 37.2 | Very low | 189 Ų | 189 | 141.2 Ų | 141.2 | 88% | 0.883 | 82% | 0.82 | S | S | * | * | | | trans | -59.6 | 143.6 | 148.8 | -77.3 | 170.2 | -31.1 | 0 | 0 | 108.9 | | |
| 195 | G | 35.3 | Very low | 36.7 | Very low | 75 Ų | 75 | 135.6 Ų | 135.6 | 77% | 0.773 | 82% | 0.818 | S | S | * | * | | | trans | -165.9 | 94.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | | |
| 196 | T | 34.9 | Very low | 36.1 | Very low | 137 Ų | 137 | 129.8 Ų | 129.8 | 84% | 0.84 | 81% | 0.81 | S | S | * | * | | | trans | -71.8 | 147.8 | 174 | 39.4 | 0 | 0 | 0 | 0 | 113.4 | | |
| 197 | A | 31.8 | Very low | 36.1 | Very low | 98 Ų | 98 | 129.9 Ų | 129.9 | 81% | 0.81 | 80% | 0.803 | S | S | * | * | | | trans | 72.2 | 153.6 | 140.6 | 0 | 0 | 0 | 0 | 0 | 121.4 | | |
| 198 | A | 37.9 | Very low | 36.7 | Very low | 92 Ų | 92 | 132 Ų | 132 | 76% | 0.76 | 80% | 0.804 | S | S | * | * | | | trans | 87.7 | 97.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 199 | Q | 40.9 | Very low | 36.6 | Very low | 165 Ų | 165 | 131.2 Ų | 131.2 | 77% | 0.771 | 80% | 0.795 | S | S | * | * | | | | 98 | 136.3 | 76.8 | -98.9 | -156.7 | 12.2 | 0 | 0 | 111.8 | | |
| 200 | R | 37.5 | Very low | 36.9 | Very low | 208 Ų | 208 | 134.6 Ų | 134.6 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | | | trans | 77.2 | 129.6 | 163.4 | -65.5 | 164.4 | 166.5 | -117 | -1.7 | 114.9 | | |
| 201 | E | 35.6 | Very low | 37.1 | Very low | 166 Ų | 166 | 132.4 Ų | 132.4 | 78% | 0.776 | 79% | 0.794 | S | S | * | * | | | cis | -157.4 | 148.1 | 12 | -107.9 | 168.7 | 174.5 | 0 | 0 | 107.8 | | |
| 202 | A | 34.1 | Very low | 36.7 | Very low | 99 Ų | 99 | 130 Ų | 130 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -87.5 | 140.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 203 | P | 48.2 | Very low | 36.9 | Very low | 118 Ų | 118 | 135.4 Ų | 135.4 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -99.7 | 158.8 | 157.7 | 33.3 | -25.9 | 0 | 0 | 0 | 111.7 | | |
| 204 | P | 40.3 | Very low | 36.6 | Very low | 126 Ų | 126 | 129.2 Ų | 129.2 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -91 | 160.7 | -144 | 34.8 | -35.8 | 0 | 0 | 0 | 115.7 | | |
| 205 | S | 31.7 | Very low | 36.8 | Very low | 120 Ų | 120 | 124.4 Ų | 124.4 | 84% | 0.839 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -46.2 | 126.1 | 164.6 | -177.3 | 0 | 0 | 0 | 0 | 113.4 | | |
| 206 | A | 35.9 | Very low | 36.5 | Very low | 95 Ų | 95 | 126.5 Ų | 126.5 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | | | trans | -149 | 91.6 | 156.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | | |
| 207 | A | 36 | Very low | 36.6 | Very low | 83 Ų | 83 | 124.4 Ų | 124.4 | 69% | 0.686 | 79% | 0.788 | S | S | * | * | | | trans | -83.4 | 128 | 164.9 | 0 | 0 | 0 | 0 | 0 | 109 | T209 | A207-T209 PolarHBondContact O-N 3.24Š|
| 208 | P | 44.7 | Very low | 36.8 | Very low | 113 Ų | 113 | 125.5 Ų | 125.5 | 73% | 0.734 | 79% | 0.785 | S | S | * | * | | | trans | -85.4 | 104.6 | 158.8 | 30.1 | -25.7 | 0 | 0 | 0 | 108.6 | L210 | P208-L210 PolarHBondContact O-N 3.43Å; P208-L210 VanDerWaalsContact O-N 3.17Å |
| 209 | T | 32.3 | Very low | 36.7 | Very low | 119 Ų | 119 | 125.8 Ų | 125.8 | 73% | 0.73 | 79% | 0.787 | S | S | * | * | | | trans | -64.3 | 105.5 | 159.7 | -52 | 0 | 0 | 0 | 0 | 107.9 | A207 T211 | A207-T209 PolarHBondContact O-N 3.24Å; T209-T211 HydrophobicContact CG2-CG2 4.38Å |
| 210 | L | 41.4 | Very low | 36.5 | Very low | 161 Ų | 161 | 123.3 Ų | 123.3 | 84% | 0.843 | 78% | 0.783 | S | S | * | * | | | trans | -115.4 | 81.5 | 165 | -84 | 164.6 | 0 | 0 | 0 | 108.7 | P208 G212 | P208-L210 PolarHBondContact O-N 3.43Å; P208-L210 VanDerWaalsContact O-N 3.17Å; L210-G212 PolarHBondContact O-N 2.8Å |
| 211 | T | 37.7 | Very low | 36.4 | Very low | 127 Ų | 127 | 117.7 Ų | 117.7 | 78% | 0.779 | 78% | 0.781 | S | S | * | * | | | trans | -60.7 | 113.6 | 150.7 | 40.2 | 0 | 0 | 0 | 0 | 108.3 | T209 | T209-T211 HydrophobicContact CG2-CG2 4.38Š|
| 212 | G | 32.5 | Very low | 36.5 | Very low | 68 Ų | 68 | 115.8 Ų | 115.8 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | | | trans | 156.1 | 98.8 | 169.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | L210 | L210-G212 PolarHBondContact O-N 2.8Š|
| 213 | R | 37.3 | Very low | 36.6 | Very low | 246 Ų | 246 | 115.6 Ų | 115.6 | 93% | 0.928 | 77% | 0.769 | S | S | * | * | | | trans | 68.2 | 112.4 | 139.9 | -134.9 | 168.3 | 174.9 | 169.1 | -3.2 | 117.4 | A215 | R213-A215 PolarHBondContact O-N 3.01Š|
| 214 | A | 30.6 | Very low | 35.7 | Very low | 108 Ų | 108 | 115.8 Ų | 115.8 | 89% | 0.893 | 77% | 0.773 | S | S | * | * | | | trans | -46.2 | 124.9 | 168.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | | |
| 215 | A | 35.5 | Very low | 35.4 | Very low | 89 Ų | 89 | 113.5 Ų | 113.5 | 74% | 0.736 | 77% | 0.773 | S | S | * | * | | | trans | -140.1 | 108.8 | 160.1 | 0 | 0 | 0 | 0 | 0 | 107.8 | R213 A217 | R213-A215 PolarHBondContact O-N 3.01Å; A215-A217 PolarHBondContact O-N 3.12Å |
| 216 | S | 30.4 | Very low | 35.6 | Very low | 119 Ų | 119 | 112.7 Ų | 112.7 | 83% | 0.832 | 76% | 0.757 | S | S | * | * | | | trans | -50 | 120.4 | 162 | 167.7 | 0 | 0 | 0 | 0 | 109.1 | | |
| 217 | A | 36.9 | Very low | 35.7 | Very low | 92 Ų | 92 | 113.6 Ų | 113.6 | 76% | 0.76 | 76% | 0.755 | S | S | * | * | | | trans | -134 | 89.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | A215 A219 | A215-A217 PolarHBondContact O-N 3.12Å; A217-A219 PolarHBondContact O-N 2.75Å; A217-A219 VanDerWaalsContact O-N 3.08Å |
| 218 | T | 35.9 | Very low | 35.8 | Very low | 122 Ų | 122 | 114.7 Ų | 114.7 | 75% | 0.748 | 76% | 0.758 | S | S | * | * | | | trans | -68.6 | 95.3 | 167.9 | -42.9 | 0 | 0 | 0 | 0 | 108.5 | V220 | T218-V220 HydrophobicContact CG2-CG2 4.11Å; T218-V220 PolarHBondContact O-N 3.33Å |
| 219 | A | 35.2 | Very low | 35.6 | Very low | 97 Ų | 97 | 115.1 Ų | 115.1 | 80% | 0.802 | 76% | 0.758 | S | S | * | * | | | trans | -85.9 | 95.4 | 170.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | A217 A221 | A217-A219 PolarHBondContact O-N 2.75Å; A217-A219 VanDerWaalsContact O-N 3.08Å; A219-A221 PolarHBondContact O-N 2.98Å |
| 220 | V | 36.4 | Very low | 35.8 | Very low | 114 Ų | 114 | 115.1 Ų | 115.1 | 69% | 0.691 | 75% | 0.754 | S | S | * | * | | | trans | -84.5 | 101.2 | 165 | -174.5 | 0 | 0 | 0 | 0 | 107.1 | T218 T222 | T218-V220 HydrophobicContact CG2-CG2 4.11Å; T218-V220 PolarHBondContact O-N 3.33Å; V220-T222 PolarHBondContact O-N 2.73Å; V220-T222 VanDerWaalsContact O-N 3.15Å |
| 221 | A | 36.1 | Very low | 35.6 | Very low | 89 Ų | 89 | 112 Ų | 112 | 74% | 0.736 | 74% | 0.741 | S | S | * | * | | | trans | -71.9 | 102.7 | 169.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | A219 V223 | A219-A221 PolarHBondContact O-N 2.98Å; A221-V223 PolarHBondContact O-N 3.07Å |
| 222 | T | 36.6 | Very low | 35.8 | Very low | 127 Ų | 127 | 115.5 Ų | 115.5 | 78% | 0.779 | 74% | 0.741 | S | S | * | * | | | trans | -67 | 93.7 | 171.3 | -52.5 | 0 | 0 | 0 | 0 | 109.2 | V220 S224 | V220-T222 PolarHBondContact O-N 2.73Å; V220-T222 VanDerWaalsContact O-N 3.15Å; T222-S224 PolarHBondContact O-N 2.84Å |
| 223 | V | 36.4 | Very low | 35.9 | Very low | 94 Ų | 94 | 121.1 Ų | 121.1 | 57% | 0.57 | 75% | 0.747 | S | S | * | * | | | trans | -76.6 | 106.3 | 164.9 | -178.7 | 0 | 0 | 0 | 0 | 107.2 | A221 G225 | A221-V223 PolarHBondContact O-N 3.07Å; V223-G225 PolarHBondContact O-N 3.44Å |
| 224 | S | 30.6 | Very low | 36.1 | Very low | 122 Ų | 122 | 121.3 Ų | 121.3 | 85% | 0.853 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -45 | 119.2 | 174.7 | -161.2 | 0 | 0 | 0 | 0 | 110.7 | T222 | T222-S224 PolarHBondContact O-N 2.84Š|
| 225 | G | 33.2 | Very low | 36.4 | Very low | 79 Ų | 79 | 122 Ų | 122 | 81% | 0.814 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 108.5 | 12.6 | 175 | 0 | 0 | 0 | 0 | 0 | 117.7 | V223 | V223-G225 PolarHBondContact O-N 3.44Š|
| 226 | M | 36.3 | Very low | 36.4 | Very low | 102 Ų | 102 | 123.7 Ų | 123.7 | 50% | 0.502 | 76% | 0.76 | S | S | . | * | S | Bend | trans | -115.8 | 139.2 | 171.2 | -59.5 | -162.3 | 77.2 | 0 | 0 | 111.1 | S228 | M226-S228 PolarHBondContact O-N 2.88Å; M226-S228 VanDerWaalsContact O-N 3.16Å |
| 227 | P | 38.3 | Very low | 36.7 | Very low | 115 Ų | 115 | 123.9 Ų | 123.9 | 75% | 0.747 | 76% | 0.756 | S | S | * | * | | | trans | -60.3 | 121.9 | 170.9 | 25.2 | -31.7 | 0 | 0 | 0 | 108.4 | V229 | P227-V229 PolarHBondContact O-N 3Š|
| 228 | S | 38.2 | Very low | 36.7 | Very low | 106 Ų | 106 | 125.8 Ų | 125.8 | 74% | 0.741 | 76% | 0.756 | S | S | * | * | | | trans | -58.6 | 98 | 178 | -48.8 | 0 | 0 | 0 | 0 | 109.7 | M226 N230 | M226-S228 PolarHBondContact O-N 2.88Å; M226-S228 VanDerWaalsContact O-N 3.16Å; S228-N230 PolarHBondContact O-N 3.13Å; S228-N230 VanDerWaalsContact O-N 3.16Å |
| 229 | V | 40.1 | Very low | 36.8 | Very low | 122 Ų | 122 | 126.1 Ų | 126.1 | 74% | 0.739 | 76% | 0.756 | S | S | * | * | | | trans | -81.1 | 93.4 | 166.8 | -170.3 | 0 | 0 | 0 | 0 | 106.2 | P227 V231 | P227-V229 PolarHBondContact O-N 3Å; V229-V231 HydrophobicContact CG1-CG2 4.13Å; V229-V231 PolarHBondContact O-N 3.02Å |
| 230 | N | 36.2 | Very low | 36.9 | Very low | 119 Ų | 119 | 128 Ų | 128 | 64% | 0.636 | 75% | 0.753 | S | S | * | * | | | trans | -63.4 | 103 | 166.3 | -82.3 | -25.2 | 0 | 0 | 0 | 108 | S228 Y232 | S228-N230 PolarHBondContact O-N 3.13Å; S228-N230 VanDerWaalsContact O-N 3.16Å; N230-Y232 HydrophobicContact CB-CD2 4.22Å; N230-Y232 HydrophobicContact CB-CE2 3.81Å; N230-Y232 PolarHBondContact O-N 2.75Å |
| 231 | V | 37.6 | Very low | 36.9 | Very low | 96 Ų | 96 | 129 Ų | 129 | 58% | 0.582 | 76% | 0.757 | S | S | * | * | | | trans | -89.7 | 99.3 | 165.7 | -176.5 | 0 | 0 | 0 | 0 | 106.6 | V229 F233 | V229-V231 HydrophobicContact CG1-CG2 4.13Å; V229-V231 PolarHBondContact O-N 3.02Å; V231-F233 HydrophobicContact CB-CE2 4.42Å; V231-F233 HydrophobicContact CG1-CD2 4.26Å; V231-F233 HydrophobicContact CG1-CE2 3.82Å; V231-F233 HydrophobicContact CG1-CZ 3.99Å |
| 232 | Y | 41.3 | Very low | 37 | Very low | 199 Ų | 199 | 132.1 Ų | 132.1 | 78% | 0.78 | 76% | 0.759 | S | S | * | * | | | trans | -71.7 | 124.8 | 166 | -69.3 | -86.9 | 0 | 0 | 0 | 108.3 | N230 | N230-Y232 HydrophobicContact CB-CD2 4.22Å; N230-Y232 HydrophobicContact CB-CE2 3.81Å; N230-Y232 PolarHBondContact O-N 2.75Å |
| 233 | F | 35.9 | Very low | 37 | Very low | 187 Ų | 187 | 132.5 Ų | 132.5 | 82% | 0.82 | 76% | 0.757 | S | S | * | * | | | trans | -94.6 | 120.8 | 164.1 | -70.5 | -88 | 0 | 0 | 0 | 107.4 | V231 | V231-F233 HydrophobicContact CB-CE2 4.42Å; V231-F233 HydrophobicContact CG1-CD2 4.26Å; V231-F233 HydrophobicContact CG1-CE2 3.82Å; V231-F233 HydrophobicContact CG1-CZ 3.99Å |
| 234 | L | 40.2 | Very low | 37.1 | Very low | 249 Ų | 249 | 136 Ų | 136 | 100% | 1.304 | 78% | 0.775 | S | S | * | * | | | trans | -75.3 | 0 | 161 | -81.3 | 159.5 | 0 | 0 | 0 | 109.5 | | |