| 1 | F | 50.6 | Low | 72 | Confident | 256 Ų | 256 | 134.6 Ų | 134.6 | 100% | 1.123 | 74% | 0.738 | S | S | * | * | | | | 0 | 137.2 | 0 | -62.6 | -84.1 | 0 | 0 | 0 | 108.9 | | |
| 2 | P | 65 | Low | 73.2 | Confident | 126 Ų | 126 | 130.8 Ų | 130.8 | 82% | 0.818 | 72% | 0.715 | S | S | * | * | | | trans | -65.7 | 142.9 | 170.9 | 29 | -33.9 | 0 | 0 | 0 | 110.2 | A4 | P2-A4 PolarHBondContact O-N 3.22Š|
| 3 | Q | 68.6 | Low | 74 | Confident | 195 Ų | 195 | 129 Ų | 129 | 91% | 0.911 | 72% | 0.718 | S | S | * | * | | | trans | -73.4 | 114.3 | 179.5 | -176.6 | 174.1 | -5.2 | 0 | 0 | 109.8 | N5 | Q3-N5 PolarHBondContact O-N 3.5Š|
| 4 | A | 70.6 | Confident | 74.6 | Confident | 79 Ų | 79 | 126.3 Ų | 126.3 | 65% | 0.653 | 71% | 0.713 | S | S | * | * | | | trans | -63.5 | 129.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | P2 T6 | P2-A4 PolarHBondContact O-N 3.22Å; A4-T6 PolarHBondContact O-N 3.49Å; A4-T6 VanDerWaalsContact O-N 3.15Å |
| 5 | N | 71.8 | Confident | 75.4 | Confident | 130 Ų | 130 | 123.9 Ų | 123.9 | 70% | 0.695 | 69% | 0.693 | S | S | * | * | | | trans | -70.9 | 109.7 | 175.7 | -177.2 | 3.2 | 0 | 0 | 0 | 109.7 | Q3 T7 | Q3-N5 PolarHBondContact O-N 3.5Å; N5-T7 PolarHBondContact ND2-OG1 3.15Å; N5-T7 WeakPolarHBondContact OD1-CB 3.22Å; N5-T7 PolarHBondContact OD1-N 3.38Å; N5-T7 PolarHBondContact OD1-OG1 3.4Å |
| 6 | T | 78.8 | Confident | 76.2 | Confident | 133 Ų | 133 | 119.4 Ų | 119.4 | 82% | 0.816 | 68% | 0.677 | S | S | * | * | | | trans | -89.7 | -2 | 179.9 | 57.3 | 0 | 0 | 0 | 0 | 113.9 | A4 | A4-T6 PolarHBondContact O-N 3.49Å; A4-T6 VanDerWaalsContact O-N 3.15Å |
| 7 | T | 74.6 | Confident | 76.9 | Confident | 96 Ų | 96 | 122.5 Ų | 122.5 | 59% | 0.589 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -75.9 | 126.3 | -180 | 62.6 | 0 | 0 | 0 | 0 | 110.8 | N5 | N5-T7 PolarHBondContact ND2-OG1 3.15Å; N5-T7 WeakPolarHBondContact OD1-CB 3.22Å; N5-T7 PolarHBondContact OD1-N 3.38Å; N5-T7 PolarHBondContact OD1-OG1 3.4Å |
| 8 | P | 72.8 | Confident | 77.8 | Confident | 107 Ų | 107 | 117.9 Ų | 117.9 | 70% | 0.695 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 136.9 | 177.9 | 27.7 | -33.5 | 0 | 0 | 0 | 110.1 | K10 | P8-K10 PolarHBondContact O-N 3.3Š|
| 9 | P | 77.1 | Confident | 78.7 | Confident | 97 Ų | 97 | 118.5 Ų | 118.5 | 63% | 0.63 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 134.6 | 179.1 | 24 | -33.4 | 0 | 0 | 0 | 110.8 | L11 | P9-L11 HydrophobicContact CB-CD2 4.23Å; P9-L11 HydrophobicContact CG-CD2 4.21Å; P9-L11 PolarHBondContact O-N 2.85Å |
| 10 | K | 82.4 | Confident | 79.5 | Confident | 212 Ų | 212 | 114.6 Ų | 114.6 | 92% | 0.922 | 65% | 0.645 | S | S | * | * | | | trans | -81.3 | 81.5 | -172.6 | -167.8 | 173.8 | -176.6 | 176.9 | 0 | 110.9 | P8 | P8-K10 PolarHBondContact O-N 3.3Š|
| 11 | L | 80.1 | Confident | 80.2 | Confident | 50 Ų | 50 | 111.5 Ų | 111.5 | 26% | 0.262 | 63% | 0.634 | S | S | . | * | | | trans | -62.7 | 149.4 | -178.5 | -47.1 | -173 | 0 | 0 | 0 | 111.9 | P9 E15 R19 | P9-L11 HydrophobicContact CB-CD2 4.23Å; P9-L11 HydrophobicContact CG-CD2 4.21Å; P9-L11 PolarHBondContact O-N 2.85Å; L11-E15 WeakPolarHBondContact CA-OE2 3.46Å; L11-E15 HydrophobicContact CB-CB 4.4Å; L11-E15 HydrophobicContact CB-CG 4.09Å; L11-E15 WeakPolarHBondContact CB-OE2 3.23Å; L11-E15 HydrophobicContact CD1-CG 4.34Å; L11-E15 HydrophobicContact CD2-CG 4.38Å; L11-E15 HydrophobicContact CG-CG 4.48Å; L11-R19 HydrophobicContact CD1-CB 4.4Å |
| 12 | N | 85.9 | Confident | 82.3 | Confident | 88 Ų | 88 | 104.2 Ų | 104.2 | 47% | 0.471 | 61% | 0.606 | S | S | . | * | | | trans | -80.5 | 171.1 | 172.5 | 66.8 | 71.3 | 0 | 0 | 0 | 111.7 | S14 E15 A16 | N12-S14 PolarHBondContact O-N 3.12Å; N12-S14 PolarHBondContact OD1-N 3.18Å; N12-S14 PolarHBondContact OD1-OG 3.48Å; N12-E15 PolarHBondContact N-OE2 2.68Å; N12-E15 VanDerWaalsContact N-OE2 3.16Å; N12-E15 WeakPolarHBondContact ND2-CB 3.42Å; N12-E15 PolarHBondContact ND2-OE2 3.38Å; N12-E15 PolarHBondContact O-N 2.86Å; N12-E15 VanDerWaalsContact OD1-CB 3.26Å; N12-E15 WeakPolarHBondContact OD1-CB 3.36Å; N12-E15 PolarHBondContact OD1-N 2.66Å; N12-A16 WeakPolarHBondContact O-CB 3.33Å; N12-A16 PolarHBondContact O-N 3.25Å |
| 13 | S | 83.2 | Confident | 83.8 | Confident | 108 Ų | 108 | 102.3 Ų | 102.3 | 76% | 0.755 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -63.9 | -42.6 | -171.7 | -173.4 | 0 | 0 | 0 | 0 | 114.1 | K17 | S13-K17 PolarHBondContact O-N 3.1Å; S13-K17 VanDerWaalsContact O-N 3.15Å |
| 14 | S | 83.3 | Confident | 85.1 | Confident | 91 Ų | 91 | 95.1 Ų | 95.1 | 64% | 0.636 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -70.7 | -38.9 | 177.4 | 39.9 | 0 | 0 | 0 | 0 | 111.8 | N12 K17 G18 | N12-S14 PolarHBondContact O-N 3.12Å; N12-S14 PolarHBondContact OD1-N 3.18Å; N12-S14 PolarHBondContact OD1-OG 3.48Å; S14-K17 PolarHBondContact O-N 3.45Å; S14-G18 PolarHBondContact O-N 2.98Å |
| 15 | E | 86.7 | Confident | 86.3 | Confident | 91 Ų | 91 | 95.5 Ų | 95.5 | 43% | 0.425 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64.8 | -41.1 | 174.1 | -177.2 | -177.7 | -157.3 | 0 | 0 | 112.5 | L11 N12 K17 G18 R19 | L11-E15 WeakPolarHBondContact CA-OE2 3.46Å; L11-E15 HydrophobicContact CB-CB 4.4Å; L11-E15 HydrophobicContact CB-CG 4.09Å; L11-E15 WeakPolarHBondContact CB-OE2 3.23Å; L11-E15 HydrophobicContact CD1-CG 4.34Å; L11-E15 HydrophobicContact CD2-CG 4.38Å; L11-E15 HydrophobicContact CG-CG 4.48Å; N12-E15 PolarHBondContact N-OE2 2.68Å; N12-E15 VanDerWaalsContact N-OE2 3.16Å; N12-E15 WeakPolarHBondContact ND2-CB 3.42Å; N12-E15 PolarHBondContact ND2-OE2 3.38Å; N12-E15 PolarHBondContact O-N 2.86Å; N12-E15 VanDerWaalsContact OD1-CB 3.26Å; N12-E15 WeakPolarHBondContact OD1-CB 3.36Å; N12-E15 PolarHBondContact OD1-N 2.66Å; E15-K17 VanDerWaalsContact C-N 3.32Å; E15-K17 PolarHBondContact O-N 3.29Å; E15-G18 PolarHBondContact O-N 3.04Å; E15-R19 WeakPolarHBondContact O-CB 3.26Å; E15-R19 PolarHBondContact O-N 3.27Å |
| 16 | A | 87.4 | Confident | 87.5 | Confident | 52 Ų | 52 | 94.7 Ų | 94.7 | 43% | 0.43 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.3 | -40.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | N12 G20 | N12-A16 WeakPolarHBondContact O-CB 3.33Å; N12-A16 PolarHBondContact O-N 3.25Å; A16-G20 PolarHBondContact O-N 2.86Å |
| 17 | K | 87.9 | Confident | 88.3 | Confident | 171 Ų | 171 | 93.8 Ų | 93.8 | 74% | 0.743 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -67.1 | -41.7 | 174.4 | -170.8 | 172.4 | -178.6 | 176.5 | 0 | 112.2 | S13 S14 E15 G20 A21 | S13-K17 PolarHBondContact O-N 3.1Å; S13-K17 VanDerWaalsContact O-N 3.15Å; S14-K17 PolarHBondContact O-N 3.45Å; E15-K17 VanDerWaalsContact C-N 3.32Å; E15-K17 PolarHBondContact O-N 3.29Å; K17-G20 PolarHBondContact O-N 3.15Å; K17-A21 PolarHBondContact O-N 3.33Å; K17-A21 VanDerWaalsContact O-N 3.1Å |
| 18 | G | 93 | Very high | 89.4 | Confident | 41 Ų | 41 | 95.9 Ų | 95.9 | 42% | 0.423 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.8 | -44.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | S14 E15 G20 A21 L22 | S14-G18 PolarHBondContact O-N 2.98Å; E15-G18 PolarHBondContact O-N 3.04Å; G18-G20 VanDerWaalsContact C-N 3.33Å; G18-G20 PolarHBondContact O-N 3.44Å; G18-A21 PolarHBondContact O-N 2.82Å; G18-L22 WeakPolarHBondContact O-CB 3.26Å; G18-L22 PolarHBondContact O-N 2.83Å |
| 19 | R | 94.9 | Very high | 90.4 | Very high | 128 Ų | 128 | 93.2 Ų | 93.2 | 48% | 0.483 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.2 | -39.4 | 173.1 | -178.6 | 176.3 | 176.7 | -169.1 | 0.7 | 111.9 | L11 E15 L22 L23 | L11-R19 HydrophobicContact CD1-CB 4.4Å; E15-R19 WeakPolarHBondContact O-CB 3.26Å; E15-R19 PolarHBondContact O-N 3.27Å; R19-L22 PolarHBondContact O-N 2.82Å; R19-L23 HydrophobicContact CG-CD1 3.92Å; R19-L23 HydrophobicContact CG-CG 4.24Å; R19-L23 WeakPolarHBondContact O-CB 3.36Å; R19-L23 VanDerWaalsContact O-CG 3.25Å; R19-L23 WeakPolarHBondContact O-CG 3.25Å; R19-L23 PolarHBondContact O-N 2.95Å |
| 20 | G | 94.8 | Very high | 91.3 | Very high | 41 Ų | 41 | 92.8 Ų | 92.8 | 42% | 0.423 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -59.8 | -45.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | A16 K17 G18 S24 | A16-G20 PolarHBondContact O-N 2.86Å; K17-G20 PolarHBondContact O-N 3.15Å; G18-G20 VanDerWaalsContact C-N 3.33Å; G18-G20 PolarHBondContact O-N 3.44Å; G20-S24 PolarHBondContact O-N 3.38Å; G20-S24 VanDerWaalsContact O-N 3.11Å |
| 21 | A | 94.6 | Very high | 91.8 | Very high | 49 Ų | 49 | 93.1 Ų | 93.1 | 41% | 0.405 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -62.5 | -51.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | K17 G18 L23 S24 D25 | K17-A21 PolarHBondContact O-N 3.33Å; K17-A21 VanDerWaalsContact O-N 3.1Å; G18-A21 PolarHBondContact O-N 2.82Å; A21-L23 PolarHBondContact O-N 2.92Å; A21-S24 WeakPolarHBondContact O-CA 3.32Å; A21-S24 WeakPolarHBondContact O-CB 3.45Å; A21-S24 PolarHBondContact O-N 2.93Å; A21-S24 PolarHBondContact O-OG 3.48Å; A21-D25 PolarHBondContact O-N 3.13Å |
| 22 | L | 95.7 | Very high | 92.4 | Very high | 104 Ų | 104 | 98.3 Ų | 98.3 | 55% | 0.545 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -56.2 | -45.8 | 178.9 | 175.8 | 61.9 | 0 | 0 | 0 | 112.6 | G18 R19 S24 D25 I26 | G18-L22 WeakPolarHBondContact O-CB 3.26Å; G18-L22 PolarHBondContact O-N 2.83Å; R19-L22 PolarHBondContact O-N 2.82Å; L22-S24 VanDerWaalsContact C-N 3.3Å; L22-S24 PolarHBondContact O-N 3.35Å; L22-D25 PolarHBondContact O-N 3.18Å; L22-I26 HydrophobicContact CD1-CD1 4.09Å; L22-I26 HydrophobicContact CD1-CG1 4.37Å; L22-I26 HydrophobicContact CG-CD1 3.97Å; L22-I26 WeakPolarHBondContact O-CG1 3.49Å; L22-I26 PolarHBondContact O-N 3.11Å |
| 23 | L | 96.3 | Very high | 92.8 | Very high | 85 Ų | 85 | 103.5 Ų | 103.5 | 45% | 0.445 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -61.9 | -39 | 175.3 | -72.9 | 171.9 | 0 | 0 | 0 | 111.4 | R19 A21 D25 I26 C27 | R19-L23 HydrophobicContact CG-CD1 3.92Å; R19-L23 HydrophobicContact CG-CG 4.24Å; R19-L23 WeakPolarHBondContact O-CB 3.36Å; R19-L23 VanDerWaalsContact O-CG 3.25Å; R19-L23 WeakPolarHBondContact O-CG 3.25Å; R19-L23 PolarHBondContact O-N 2.95Å; A21-L23 PolarHBondContact O-N 2.92Å; L23-D25 VanDerWaalsContact C-N 3.32Å; L23-D25 PolarHBondContact O-N 3.11Å; L23-I26 PolarHBondContact O-N 3.01Å; L23-C27 WeakPolarHBondContact O-CB 3.33Å; L23-C27 PolarHBondContact O-N 3.26Å; L23-C27 PolarHBondContact O-SG 2.93Å |
| 24 | S | 95.8 | Very high | 93.2 | Very high | 45 Ų | 45 | 107.3 Ų | 107.3 | 32% | 0.315 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -63.6 | -37.2 | 175.1 | 86.2 | 0 | 0 | 0 | 0 | 112.3 | G20 A21 L22 C27 K28 | G20-S24 PolarHBondContact O-N 3.38Å; G20-S24 VanDerWaalsContact O-N 3.11Å; A21-S24 WeakPolarHBondContact O-CA 3.32Å; A21-S24 WeakPolarHBondContact O-CB 3.45Å; A21-S24 PolarHBondContact O-N 2.93Å; A21-S24 PolarHBondContact O-OG 3.48Å; L22-S24 VanDerWaalsContact C-N 3.3Å; L22-S24 PolarHBondContact O-N 3.35Å; S24-C27 PolarHBondContact O-N 3.27Å; S24-K28 WeakPolarHBondContact O-CD 3.32Å; S24-K28 WeakPolarHBondContact O-CE 3.44Å; S24-K28 VanDerWaalsContact O-CG 3.23Å; S24-K28 WeakPolarHBondContact O-CG 3.48Å; S24-K28 PolarHBondContact O-N 3.32Å; S24-K28 PolarHBondContact OG-NZ 3.39Å |
| 25 | D | 96.3 | Very high | 93.5 | Very high | 86 Ų | 86 | 107.6 Ų | 107.6 | 46% | 0.46 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -74.8 | -35.4 | 179.1 | -65.6 | -33.5 | 0 | 0 | 0 | 112.1 | A21 L22 L23 C27 K28 G29 | A21-D25 PolarHBondContact O-N 3.13Å; L22-D25 PolarHBondContact O-N 3.18Å; L23-D25 VanDerWaalsContact C-N 3.32Å; L23-D25 PolarHBondContact O-N 3.11Å; D25-C27 VanDerWaalsContact C-N 3.33Å; D25-K28 PolarHBondContact O-N 2.98Å; D25-K28 IonicContact OD1-NZ 2.66Å; D25-K28 PolarHBondContact OD1-NZ 2.97Å; D25-G29 PolarHBondContact O-N 2.92Å |
| 26 | I | 95.6 | Very high | 93.4 | Very high | 113 Ų | 113 | 109.7 Ų | 109.7 | 58% | 0.579 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -60.8 | -42.7 | 168.8 | -68.4 | 164.8 | 0 | 0 | 0 | 110.6 | L22 L23 G29 | L22-I26 HydrophobicContact CD1-CD1 4.09Å; L22-I26 HydrophobicContact CD1-CG1 4.37Å; L22-I26 HydrophobicContact CG-CD1 3.97Å; L22-I26 WeakPolarHBondContact O-CG1 3.49Å; L22-I26 PolarHBondContact O-N 3.11Å; L23-I26 PolarHBondContact O-N 3.01Å; I26-G29 PolarHBondContact O-N 3.43Å |
| 27 | C | 95.7 | Very high | 93.2 | Very high | 114 Ų | 114 | 114.1 Ų | 114.1 | 77% | 0.77 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -70.6 | -28.5 | 177.3 | -68.4 | 0 | 0 | 0 | 0 | 114.1 | L23 S24 D25 | L23-C27 WeakPolarHBondContact O-CB 3.33Å; L23-C27 PolarHBondContact O-N 3.26Å; L23-C27 PolarHBondContact O-SG 2.93Å; S24-C27 PolarHBondContact O-N 3.27Å; D25-C27 VanDerWaalsContact C-N 3.33Å |
| 28 | K | 97.3 | Very high | 92.8 | Very high | 141 Ų | 141 | 111.2 Ų | 111.2 | 61% | 0.613 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -72.7 | -33 | 170.3 | -68.6 | 160.3 | -145 | 159.1 | 0 | 111.7 | S24 D25 | S24-K28 WeakPolarHBondContact O-CD 3.32Å; S24-K28 WeakPolarHBondContact O-CE 3.44Å; S24-K28 VanDerWaalsContact O-CG 3.23Å; S24-K28 WeakPolarHBondContact O-CG 3.48Å; S24-K28 PolarHBondContact O-N 3.32Å; S24-K28 PolarHBondContact OG-NZ 3.39Å; D25-K28 PolarHBondContact O-N 2.98Å; D25-K28 IonicContact OD1-NZ 2.66Å; D25-K28 PolarHBondContact OD1-NZ 2.97Å |
| 29 | G | 95 | Very high | 91.8 | Very high | 50 Ų | 50 | 113.9 Ų | 113.9 | 52% | 0.515 | 62% | 0.62 | S | S | . | * | | | trans | 74.4 | 169.1 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | D25 I26 | D25-G29 PolarHBondContact O-N 2.92Å; I26-G29 PolarHBondContact O-N 3.43Å |
| 30 | A | 94.9 | Very high | 90.9 | Very high | 89 Ų | 89 | 112.1 Ų | 112.1 | 74% | 0.736 | 62% | 0.62 | S | S | * | * | | | trans | -133.1 | 141.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111 | L32 | A30-L32 PolarHBondContact O-N 2.98Š|
| 31 | K | 93.8 | Very high | 90 | Very high | 218 Ų | 218 | 120.4 Ų | 120.4 | 95% | 0.948 | 64% | 0.639 | S | S | * | * | | | trans | -79.3 | 112.1 | 173.7 | -74.1 | -172.8 | 174.6 | -179.8 | 0 | 110.1 | | |
| 32 | L | 92.3 | Very high | 89.1 | Confident | 160 Ų | 160 | 122.8 Ų | 122.8 | 84% | 0.838 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -79 | 151.4 | 171.9 | -56.7 | -178.6 | 0 | 0 | 0 | 110.8 | A30 | A30-L32 PolarHBondContact O-N 2.98Š|
| 33 | K | 93.5 | Very high | 87.9 | Confident | 197 Ų | 197 | 120.7 Ų | 120.7 | 86% | 0.857 | 65% | 0.65 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 132.1 | 171.7 | -68.2 | -179.4 | 64.2 | -179 | 0 | 109.4 | V35 | K33-V35 PolarHBondContact O-N 3.19Š|
| 34 | K | 93 | Very high | 86.4 | Confident | 188 Ų | 188 | 121.9 Ų | 121.9 | 82% | 0.817 | 66% | 0.663 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 116.1 | 169.7 | -176.4 | 176.2 | -179.5 | -179.6 | 0 | 109.1 | | |
| 35 | V | 89.3 | Confident | 84.8 | Confident | 96 Ų | 96 | 125.5 Ų | 125.5 | 58% | 0.582 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 124.7 | 166.4 | 177.7 | 0 | 0 | 0 | 0 | 107.4 | K33 E37 V38 | K33-V35 PolarHBondContact O-N 3.19Å; V35-E37 WeakPolarHBondContact CG1-O 3.47Å; V35-V38 HydrophobicContact CG1-CG2 4.01Å |
| 36 | T | 85.4 | Confident | 83.3 | Confident | 135 Ų | 135 | 128.5 Ų | 128.5 | 83% | 0.828 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -93.7 | -25.4 | 178.1 | 46.2 | 0 | 0 | 0 | 0 | 112.8 | | |
| 37 | E | 82.9 | Confident | 81.2 | Confident | 145 Ų | 145 | 129.1 Ų | 129.1 | 68% | 0.678 | 70% | 0.703 | S | S | * | * | | | trans | -113.5 | 97.9 | 175.6 | -172.7 | -170.5 | 156.9 | 0 | 0 | 108.8 | V35 | V35-E37 WeakPolarHBondContact CG1-O 3.47Š|
| 38 | V | 78.8 | Confident | 79.1 | Confident | 110 Ų | 110 | 130.1 Ų | 130.1 | 67% | 0.667 | 71% | 0.705 | S | S | * | * | | | trans | -96.2 | 111.8 | 167.1 | -173 | 0 | 0 | 0 | 0 | 106.3 | V35 D40 | V35-V38 HydrophobicContact CG1-CG2 4.01Å; V38-D40 HydrophobicContact CG1-CB 4.1Å; V38-D40 PolarHBondContact O-N 3.45Å |
| 39 | N | 72.8 | Confident | 76.6 | Confident | 97 Ų | 97 | 132.9 Ų | 132.9 | 52% | 0.519 | 72% | 0.718 | S | S | . | * | | | trans | -78.2 | 57 | 179.2 | -150.9 | -70.1 | 0 | 0 | 0 | 110.2 | R41 | N39-R41 PolarHBondContact O-N 2.99Å; N39-R41 VanDerWaalsContact O-N 3.1Å; N39-R41 PolarHBondContact OD1-NE 2.88Å; N39-R41 PolarHBondContact OD1-NH2 3.44Å |
| 40 | D | 76.3 | Confident | 74.2 | Confident | 91 Ų | 91 | 140 Ų | 140 | 49% | 0.487 | 73% | 0.734 | S | S | . | * | | | trans | -78.1 | 93.3 | -177.4 | -170.2 | -9.9 | 0 | 0 | 0 | 110.6 | V38 S42 | V38-D40 HydrophobicContact CG1-CB 4.1Å; V38-D40 PolarHBondContact O-N 3.45Å; D40-S42 PolarHBondContact O-N 3.43Å; D40-S42 VanDerWaalsContact OD1-CB 3.3Å; D40-S42 WeakPolarHBondContact OD1-CB 3.48Å; D40-S42 PolarHBondContact OD1-N 2.93Å; D40-S42 PolarHBondContact OD1-OG 3.11Å |
| 41 | R | 74.1 | Confident | 71.8 | Confident | 215 Ų | 215 | 145.6 Ų | 145.6 | 81% | 0.811 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.3 | 8.8 | 176.7 | -55.9 | -174.4 | -171.5 | -176.5 | 2.5 | 113.4 | N39 | N39-R41 PolarHBondContact O-N 2.99Å; N39-R41 VanDerWaalsContact O-N 3.1Å; N39-R41 PolarHBondContact OD1-NE 2.88Å; N39-R41 PolarHBondContact OD1-NH2 3.44Å |
| 42 | S | 77.6 | Confident | 69.3 | Low | 100 Ų | 100 | 140.5 Ų | 140.5 | 70% | 0.699 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.6 | -17.5 | 173.5 | 76.7 | 0 | 0 | 0 | 0 | 113 | D40 | D40-S42 PolarHBondContact O-N 3.43Å; D40-S42 VanDerWaalsContact OD1-CB 3.3Å; D40-S42 WeakPolarHBondContact OD1-CB 3.48Å; D40-S42 PolarHBondContact OD1-N 2.93Å; D40-S42 PolarHBondContact OD1-OG 3.11Å |
| 43 | A | 69.3 | Low | 67.1 | Low | 59 Ų | 59 | 141 Ų | 141 | 49% | 0.488 | 74% | 0.738 | S | S | . | * | S | Bend | trans | -66.9 | 128.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | V45 | A43-V45 PolarHBondContact O-N 2.79Š|
| 44 | P | 64.6 | Low | 64.7 | Low | 111 Ų | 111 | 139.5 Ų | 139.5 | 72% | 0.721 | 74% | 0.738 | S | S | * | * | | | trans | -66.7 | 131 | 178 | 27.2 | -33.8 | 0 | 0 | 0 | 110.6 | L46 | P44-L46 PolarHBondContact O-N 2.98Š|
| 45 | V | 62.8 | Low | 62.3 | Low | 121 Ų | 121 | 134.8 Ų | 134.8 | 73% | 0.733 | 73% | 0.734 | S | S | * | * | | | trans | -72.1 | 98.1 | 175.8 | -178.3 | 0 | 0 | 0 | 0 | 108.9 | A43 D47 | A43-V45 PolarHBondContact O-N 2.79Å; V45-D47 PolarHBondContact O-N 3.15Å |
| 46 | L | 64.4 | Low | 60.4 | Low | 148 Ų | 148 | 134 Ų | 134 | 78% | 0.775 | 74% | 0.737 | S | S | * | * | | | trans | -81.2 | 94.7 | 167.8 | -66.2 | 177.9 | 0 | 0 | 0 | 108.6 | P44 T48 | P44-L46 PolarHBondContact O-N 2.98Å; L46-T48 PolarHBondContact O-N 3.4Å |
| 47 | D | 52.3 | Low | 58.8 | Low | 127 Ų | 127 | 138.7 Ų | 138.7 | 68% | 0.679 | 74% | 0.74 | S | S | * | * | | | trans | -62.7 | 94.8 | 175.2 | -80.3 | -40.8 | 0 | 0 | 0 | 110.7 | V45 F49 | V45-D47 PolarHBondContact O-N 3.15Å; D47-F49 WeakPolarHBondContact O-CD2 3.14Å; D47-F49 PolarHBondContact O-N 2.72Å |
| 48 | T | 51.3 | Low | 56.9 | Low | 134 Ų | 134 | 137.9 Ų | 137.9 | 82% | 0.822 | 75% | 0.746 | S | S | * | * | | | trans | -69.7 | 99.3 | 173.2 | 53.8 | 0 | 0 | 0 | 0 | 109.5 | L46 K50 | L46-T48 PolarHBondContact O-N 3.4Å; T48-K50 PolarHBondContact O-N 2.99Å; T48-K50 VanDerWaalsContact O-N 3.09Å |
| 49 | F | 43.6 | Very low | 55.6 | Low | 200 Ų | 200 | 139.7 Ų | 139.7 | 88% | 0.877 | 76% | 0.757 | S | S | * | * | | | trans | -50.5 | 118.9 | 179.5 | -76.6 | -87.9 | 0 | 0 | 0 | 111.4 | D47 K51 | D47-F49 WeakPolarHBondContact O-CD2 3.14Å; D47-F49 PolarHBondContact O-N 2.72Å; F49-K51 PolarHBondContact O-N 3.16Å |
| 50 | K | 45.5 | Very low | 54.6 | Low | 198 Ų | 198 | 142.3 Ų | 142.3 | 86% | 0.861 | 77% | 0.77 | S | S | * | * | | | trans | -62.8 | 122.7 | -179.1 | -177.8 | 179.2 | 179.1 | -178.2 | 0 | 109.3 | T48 S52 | T48-K50 PolarHBondContact O-N 2.99Å; T48-K50 VanDerWaalsContact O-N 3.09Å; K50-S52 PolarHBondContact O-N 3.38Å |
| 51 | K | 44.9 | Very low | 53.2 | Low | 208 Ų | 208 | 144.4 Ų | 144.4 | 90% | 0.904 | 78% | 0.78 | S | S | * | * | | | trans | -46.6 | 111.3 | -179.5 | -66.4 | 178.3 | 179.1 | 178.5 | 0 | 112.2 | F49 | F49-K51 PolarHBondContact O-N 3.16Š|
| 52 | S | 40 | Very low | 51.7 | Low | 110 Ų | 110 | 140.6 Ų | 140.6 | 77% | 0.769 | 77% | 0.774 | S | S | * | * | | | trans | -105 | 143.2 | 152.9 | 47.6 | 0 | 0 | 0 | 0 | 108.3 | K50 L54 | K50-S52 PolarHBondContact O-N 3.38Å; S52-L54 PolarHBondContact O-N 2.99Å |
| 53 | N | 47.3 | Very low | 50.4 | Low | 171 Ų | 171 | 142 Ų | 142 | 91% | 0.914 | 78% | 0.784 | S | S | * | * | | | trans | -77.1 | 123.8 | 174.2 | -77.3 | -22.5 | 0 | 0 | 0 | 109.5 | | |
| 54 | L | 41.8 | Very low | 49.1 | Very low | 165 Ų | 165 | 143.9 Ų | 143.9 | 86% | 0.864 | 79% | 0.79 | S | S | * | * | | | trans | -137.7 | 126.4 | 151.7 | -174.5 | 58.3 | 0 | 0 | 0 | 107.5 | S52 | S52-L54 PolarHBondContact O-N 2.99Š|
| 55 | A | 44.6 | Very low | 48.4 | Very low | 90 Ų | 90 | 149.3 Ų | 149.3 | 74% | 0.744 | 80% | 0.802 | S | S | * | * | | | trans | -101.1 | 144.3 | -178.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | | |
| 56 | A | 49.2 | Very low | 47.8 | Very low | 78 Ų | 78 | 148.4 Ų | 148.4 | 65% | 0.645 | 80% | 0.796 | S | S | * | * | | | trans | 62.3 | 151.4 | -167.1 | 0 | 0 | 0 | 0 | 0 | 113 | | |
| 57 | W | 50.7 | Low | 47.2 | Very low | 234 Ų | 234 | 144.1 Ų | 144.1 | 89% | 0.886 | 79% | 0.788 | S | S | * | * | | | cis | -127.5 | -173.1 | 15.7 | -74.1 | 58.9 | 0 | 0 | 0 | 112.2 | | |
| 58 | T | 42.7 | Very low | 47.3 | Very low | 129 Ų | 129 | 147.4 Ų | 147.4 | 79% | 0.791 | 80% | 0.802 | S | S | * | * | | | trans | 70.8 | 102.4 | 166.5 | 56.2 | 0 | 0 | 0 | 0 | 118.9 | L60 | T58-L60 PolarHBondContact O-N 2.67Å; T58-L60 VanDerWaalsContact O-N 3.11Å |
| 59 | T | 51.3 | Low | 47.5 | Very low | 148 Ų | 148 | 143.5 Ų | 143.5 | 91% | 0.908 | 79% | 0.788 | S | S | * | * | | | trans | -81.1 | 72.5 | 177.9 | -50 | 0 | 0 | 0 | 0 | 112.9 | | |
| 60 | L | 53.6 | Low | 48.1 | Very low | 152 Ų | 152 | 136.9 Ų | 136.9 | 80% | 0.796 | 77% | 0.77 | S | S | * | * | | | trans | -161 | 125 | 165.7 | -135.2 | 69.1 | 0 | 0 | 0 | 106.3 | T58 | T58-L60 PolarHBondContact O-N 2.67Å; T58-L60 VanDerWaalsContact O-N 3.11Å |
| 61 | I | 44.9 | Very low | 48.8 | Very low | 135 Ų | 135 | 134.5 Ų | 134.5 | 69% | 0.692 | 77% | 0.766 | S | S | * | * | S | Bend | cis | -138.3 | 138.8 | 34.3 | -71.4 | -85.3 | 0 | 0 | 0 | 110.5 | | |
| 62 | I | 43.3 | Very low | 49.4 | Very low | 135 Ų | 135 | 133 Ų | 133 | 69% | 0.692 | 76% | 0.76 | S | S | * | * | | | trans | 25.7 | 116.5 | 153.7 | -55.6 | 171.5 | 0 | 0 | 0 | 118.5 | T64 | I62-T64 HydrophobicContact CG2-CG2 3.89Å; I62-T64 PolarHBondContact O-N 3.46Å |
| 63 | S | 50.2 | Low | 50.3 | Low | 129 Ų | 129 | 135.1 Ų | 135.1 | 90% | 0.902 | 76% | 0.758 | S | S | * | * | | | trans | -68.5 | 94.8 | 164.9 | -71.4 | 0 | 0 | 0 | 0 | 112.9 | | |
| 64 | T | 41.5 | Very low | 50.9 | Low | 99 Ų | 99 | 130.1 Ų | 130.1 | 61% | 0.607 | 75% | 0.746 | S | S | * | * | | | trans | -128.9 | 93.6 | 165.6 | 41.9 | 0 | 0 | 0 | 0 | 112.7 | I62 V66 | I62-T64 HydrophobicContact CG2-CG2 3.89Å; I62-T64 PolarHBondContact O-N 3.46Å; T64-V66 HydrophobicContact CG2-CG2 3.82Å; T64-V66 PolarHBondContact O-N 2.98Å |
| 65 | K | 50.8 | Low | 52.2 | Low | 224 Ų | 224 | 125.4 Ų | 125.4 | 97% | 0.974 | 74% | 0.737 | S | S | * | * | | | trans | -71.3 | 62.7 | 149.9 | -79.1 | -176.3 | 176.5 | 174.6 | 0 | 109.6 | | |
| 66 | V | 50.4 | Low | 53.5 | Low | 102 Ų | 102 | 127.6 Ų | 127.6 | 62% | 0.618 | 74% | 0.741 | S | S | * | * | | | trans | -98 | 105.8 | 171.6 | 173.5 | 0 | 0 | 0 | 0 | 107.3 | T64 M68 | T64-V66 HydrophobicContact CG2-CG2 3.82Å; T64-V66 PolarHBondContact O-N 2.98Å; V66-M68 PolarHBondContact O-N 2.92Å |
| 67 | G | 51 | Low | 54.2 | Low | 58 Ų | 58 | 129.2 Ų | 129.2 | 60% | 0.598 | 75% | 0.745 | S | S | * | * | | | trans | -63.5 | 133.8 | 170.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | G69 | G67-G69 PolarHBondContact O-N 2.91Š|
| 68 | M | 54.4 | Low | 55 | Low | 197 Ų | 197 | 127.6 Ų | 127.6 | 97% | 0.97 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.4 | 24.6 | -176.6 | -65.4 | 165.3 | 58.9 | 0 | 0 | 114.5 | V66 | V66-M68 PolarHBondContact O-N 2.92Š|
| 69 | G | 55.3 | Low | 55.9 | Low | 52 Ų | 52 | 128.7 Ų | 128.7 | 54% | 0.536 | 75% | 0.745 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -96.6 | -11.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | G67 | G67-G69 PolarHBondContact O-N 2.91Š|
| 70 | A | 56.3 | Low | 56.8 | Low | 60 Ų | 60 | 131.9 Ų | 131.9 | 50% | 0.496 | 74% | 0.74 | S | S | . | * | G | 310 helix | trans | -80.1 | -20.6 | -171.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | F72 Q73 | A70-F72 PolarHBondContact O-N 3.03Å; A70-Q73 PolarHBondContact O-N 3.07Å; A70-Q73 VanDerWaalsContact O-N 3.07Å |
| 71 | L | 60.3 | Low | 57.2 | Low | 148 Ų | 148 | 130.8 Ų | 130.8 | 78% | 0.775 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | -62.8 | -19.5 | -167.9 | -167.7 | 62 | 0 | 0 | 0 | 114.2 | | |
| 72 | F | 58.7 | Low | 57.7 | Low | 178 Ų | 178 | 131 Ų | 131 | 78% | 0.781 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -107.9 | 5.3 | 179.9 | -60.5 | -77.1 | 0 | 0 | 0 | 114.4 | A70 | A70-F72 PolarHBondContact O-N 3.03Š|
| 73 | Q | 58.8 | Low | 57.9 | Low | 154 Ų | 154 | 126.7 Ų | 126.7 | 72% | 0.72 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.1 | -28.5 | 172.2 | -101.6 | 87.5 | 96.2 | 0 | 0 | 112.6 | A70 G75 | A70-Q73 PolarHBondContact O-N 3.07Å; A70-Q73 VanDerWaalsContact O-N 3.07Å; Q73-G75 PolarHBondContact O-N 2.73Å; Q73-G75 VanDerWaalsContact O-N 3.09Å |
| 74 | G | 60.2 | Low | 58 | Low | 65 Ų | 65 | 128.7 Ų | 128.7 | 67% | 0.67 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -76.3 | 89 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 75 | G | 68.9 | Low | 57.9 | Low | 66 Ų | 66 | 127.6 Ų | 127.6 | 68% | 0.68 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 142.9 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q73 | Q73-G75 PolarHBondContact O-N 2.73Å; Q73-G75 VanDerWaalsContact O-N 3.09Å |
| 76 | V | 70.9 | Confident | 57.9 | Low | 136 Ų | 136 | 122.5 Ų | 122.5 | 82% | 0.824 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -47.3 | 131.3 | -171.6 | -70.9 | 0 | 0 | 0 | 0 | 113 | K78 | V76-K78 PolarHBondContact O-N 3.16Å; V76-K78 VanDerWaalsContact O-N 3.11Å |
| 77 | P | 63.8 | Low | 57.9 | Low | 113 Ų | 113 | 122.1 Ų | 122.1 | 73% | 0.734 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 120.4 | -177.2 | 23.5 | -32.9 | 0 | 0 | 0 | 110 | L79 | P77-L79 PolarHBondContact O-N 3.34Š|
| 78 | K | 68.1 | Low | 57.5 | Low | 200 Ų | 200 | 129.8 Ų | 129.8 | 87% | 0.87 | 77% | 0.765 | S | S | * | * | | | trans | -68.3 | 90.1 | -176.5 | -172.5 | 85.9 | 175.9 | -172.1 | 0 | 109.7 | V76 R80 | V76-K78 PolarHBondContact O-N 3.16Å; V76-K78 VanDerWaalsContact O-N 3.11Å; K78-R80 PolarHBondContact O-N 3.02Å |
| 79 | L | 61.4 | Low | 57.2 | Low | 152 Ų | 152 | 123.8 Ų | 123.8 | 80% | 0.796 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 127.9 | 173.5 | -62.3 | -178.4 | 0 | 0 | 0 | 109.4 | P77 | P77-L79 PolarHBondContact O-N 3.34Š|
| 80 | R | 70.3 | Confident | 56.8 | Low | 215 Ų | 215 | 126.7 Ų | 126.7 | 81% | 0.811 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 132.3 | 173.7 | -65.9 | -175.9 | -71.1 | 108.8 | -4.9 | 108.1 | K78 V82 | K78-R80 PolarHBondContact O-N 3.02Å; R80-V82 PolarHBondContact O-N 3.23Å; R80-V82 VanDerWaalsContact O-N 3.15Å |
| 81 | P | 62.2 | Low | 56.6 | Low | 129 Ų | 129 | 130.7 Ų | 130.7 | 84% | 0.838 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 121.4 | 165.9 | -22.2 | 33.5 | 0 | 0 | 0 | 109 | G83 | P81-G83 PolarHBondContact O-N 3.49Š|
| 82 | V | 55.6 | Low | 55.8 | Low | 138 Ų | 138 | 127.1 Ų | 127.1 | 84% | 0.836 | 78% | 0.783 | S | S | * | * | | | trans | -83.2 | 104.1 | 167.6 | 178.3 | 0 | 0 | 0 | 0 | 105.8 | R80 | R80-V82 PolarHBondContact O-N 3.23Å; R80-V82 VanDerWaalsContact O-N 3.15Å |
| 83 | G | 47.3 | Very low | 55.2 | Low | 45 Ų | 45 | 130.4 Ų | 130.4 | 46% | 0.464 | 79% | 0.79 | S | S | . | * | | | trans | -74.1 | 137.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | P81 G85 | P81-G83 PolarHBondContact O-N 3.49Å; G83-G85 PolarHBondContact O-N 2.79Å |
| 84 | D | 52.1 | Low | 54.6 | Low | 171 Ų | 171 | 129.4 Ų | 129.4 | 91% | 0.914 | 80% | 0.8 | S | S | * | * | | | | 63.8 | 43.4 | 125.8 | -41.2 | -31.1 | 0 | 0 | 0 | 117.4 | | |
| 85 | G | 39.6 | Very low | 53.8 | Low | 77 Ų | 77 | 130.2 Ų | 130.2 | 79% | 0.794 | 80% | 0.801 | S | S | * | * | | | trans | -87.6 | 118 | 157.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | G83 | G83-G85 PolarHBondContact O-N 2.79Š|
| 86 | S | 50.6 | Low | 52.8 | Low | 117 Ų | 117 | 135.5 Ų | 135.5 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | | | trans | -88.4 | 159.4 | -179.5 | 60.4 | 0 | 0 | 0 | 0 | 113.3 | | |
| 87 | A | 50.9 | Low | 51.8 | Low | 94 Ų | 94 | 139.7 Ų | 139.7 | 78% | 0.777 | 81% | 0.813 | S | S | * | * | S | Bend | trans | 76 | 153.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 118.1 | | |
| 88 | F | 42.6 | Very low | 51.2 | Low | 218 Ų | 218 | 138.8 Ų | 138.8 | 96% | 0.956 | 81% | 0.807 | S | S | * | * | | | trans | 57.7 | 129.1 | -173 | -102.6 | -103.2 | 0 | 0 | 0 | 116.4 | | |
| 89 | G | 47.3 | Very low | 50.2 | Low | 72 Ų | 72 | 135.6 Ų | 135.6 | 74% | 0.742 | 81% | 0.807 | S | S | * | * | | | trans | -137.2 | 160.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 90 | S | 47.4 | Very low | 49.8 | Very low | 113 Ų | 113 | 131.9 Ų | 131.9 | 79% | 0.79 | 81% | 0.806 | S | S | * | * | | | trans | -159.3 | 139.5 | 158.6 | -165.4 | 0 | 0 | 0 | 0 | 111.4 | | |
| 91 | V | 51 | Low | 48.6 | Very low | 144 Ų | 144 | 126.1 Ų | 126.1 | 87% | 0.873 | 80% | 0.798 | S | S | * | * | | | trans | 27.1 | 102.7 | 156.7 | -175.5 | 0 | 0 | 0 | 0 | 117.8 | | |
| 92 | G | 45 | Very low | 48 | Very low | 73 Ų | 73 | 131.2 Ų | 131.2 | 75% | 0.753 | 80% | 0.801 | S | S | * | * | | | trans | -156.1 | 53.9 | -176.4 | 0 | 0 | 0 | 0 | 0 | 118 | | |
| 93 | R | 44.6 | Very low | 47.3 | Very low | 246 Ų | 246 | 130.6 Ų | 130.6 | 93% | 0.928 | 80% | 0.8 | S | S | * | * | | | trans | 50.6 | 71.5 | 160.2 | -62 | 176.6 | 173.5 | -114.4 | -2 | 117.5 | | |
| 94 | S | 46.4 | Very low | 47 | Very low | 134 Ų | 134 | 133.3 Ų | 133.3 | 94% | 0.937 | 82% | 0.817 | S | S | * | * | | | trans | -77.3 | 120.2 | 158.9 | -172.7 | 0 | 0 | 0 | 0 | 110.1 | | |
| 95 | A | 44.1 | Very low | 46.6 | Very low | 82 Ų | 82 | 129.6 Ų | 129.6 | 68% | 0.678 | 81% | 0.811 | S | S | * | * | | | trans | -135.3 | 119.4 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | | |
| 96 | L | 48.5 | Very low | 46.8 | Very low | 177 Ų | 177 | 131.9 Ų | 131.9 | 93% | 0.927 | 81% | 0.812 | S | S | * | * | | | trans | 58 | 59.9 | 156.8 | -55 | 177.3 | 0 | 0 | 0 | 117.7 | | |
| 97 | R | 49.5 | Very low | 46.9 | Very low | 223 Ų | 223 | 137.6 Ų | 137.6 | 84% | 0.842 | 82% | 0.815 | S | S | * | * | | | trans | -96.4 | 115.7 | 152 | -178.8 | 179.7 | 176.2 | -173.4 | -0.5 | 109.7 | | |
| 98 | P | 49.9 | Very low | 46.6 | Very low | 94 Ų | 94 | 138.4 Ų | 138.4 | 61% | 0.61 | 81% | 0.813 | S | S | * | * | | | trans | -67.9 | 140.5 | 174.2 | -19.4 | 32.3 | 0 | 0 | 0 | 112 | | |
| 99 | P | 48.2 | Very low | 46.7 | Very low | 134 Ų | 134 | 134.1 Ų | 134.1 | 87% | 0.87 | 81% | 0.807 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.5 | 125.8 | 169.8 | 30.8 | -32.1 | 0 | 0 | 0 | 110.4 | | |
| 100 | G | 52.5 | Low | 46.2 | Very low | 74 Ų | 74 | 137 Ų | 137 | 76% | 0.763 | 82% | 0.815 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 143.6 | -21.7 | 166.9 | 0 | 0 | 0 | 0 | 0 | 117.2 | R102 | G100-R102 PolarHBondContact O-N 3.32Š|
| 101 | S | 45.7 | Very low | 45.6 | Very low | 93 Ų | 93 | 135.2 Ų | 135.2 | 65% | 0.65 | 82% | 0.815 | S | S | * | * | | | trans | -77.8 | 89.9 | -176.5 | 44.7 | 0 | 0 | 0 | 0 | 113.3 | | |
| 102 | R | 50.1 | Low | 44.8 | Very low | 236 Ų | 236 | 132.2 Ų | 132.2 | 89% | 0.891 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 130.2 | 158.7 | -70.1 | -175.3 | 175.7 | -167.2 | -1.4 | 109.2 | G100 A104 | G100-R102 PolarHBondContact O-N 3.32Å; R102-A104 PolarHBondContact O-N 3.47Å |
| 103 | P | 39.3 | Very low | 44.2 | Very low | 126 Ų | 126 | 134 Ų | 134 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 131.3 | 167.6 | 28.5 | -32.6 | 0 | 0 | 0 | 109.5 | | |
| 104 | A | 41.3 | Very low | 43.7 | Very low | 101 Ų | 101 | 128.6 Ų | 128.6 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 134.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | R102 | R102-A104 PolarHBondContact O-N 3.47Š|
| 105 | A | 44.5 | Very low | 43 | Very low | 94 Ų | 94 | 127.8 Ų | 127.8 | 78% | 0.777 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 144 | 176 | 0 | 0 | 0 | 0 | 0 | 111.3 | | |
| 106 | P | 43.9 | Very low | 43.2 | Very low | 125 Ų | 125 | 129.5 Ų | 129.5 | 81% | 0.812 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 134.5 | 176.2 | 28.8 | -34 | 0 | 0 | 0 | 111.1 | | |
| 107 | R | 52.2 | Low | 42.4 | Very low | 236 Ų | 236 | 127.7 Ų | 127.7 | 89% | 0.891 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 141.1 | 165.8 | -84.6 | -179.1 | 161.2 | -165.1 | -5.8 | 110.1 | | |
| 108 | P | 45.3 | Very low | 41.6 | Very low | 112 Ų | 112 | 124.9 Ų | 124.9 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 153 | 165.2 | 31.3 | -34.4 | 0 | 0 | 0 | 110.8 | | |
| 109 | P | 44.6 | Very low | 40.9 | Very low | 127 Ų | 127 | 123.8 Ų | 123.8 | 83% | 0.825 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 143.4 | 171.4 | 31 | -34.2 | 0 | 0 | 0 | 110.9 | | |
| 110 | S | 36.6 | Very low | 40.2 | Very low | 132 Ų | 132 | 125.3 Ų | 125.3 | 92% | 0.923 | 80% | 0.799 | S | S | * | * | | | trans | -86.1 | 111.3 | 169.1 | -165.5 | 0 | 0 | 0 | 0 | 108.9 | | |
| 111 | G | 33.6 | Very low | 39.3 | Very low | 76 Ų | 76 | 131.3 Ų | 131.3 | 78% | 0.784 | 80% | 0.804 | S | S | * | * | | | trans | -116.1 | 143.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | | |
| 112 | G | 35.5 | Very low | 39.2 | Very low | 81 Ų | 81 | 132 Ų | 132 | 84% | 0.835 | 81% | 0.806 | S | S | * | * | | | trans | -123.4 | 147.8 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | | |
| 113 | S | 32.2 | Very low | 38.2 | Very low | 111 Ų | 111 | 126 Ų | 126 | 78% | 0.776 | 80% | 0.8 | S | S | * | * | | | trans | -155.5 | 133.4 | 158 | 43.1 | 0 | 0 | 0 | 0 | 106.8 | | |
| 114 | T | 33.3 | Very low | 37.7 | Very low | 133 Ų | 133 | 125.7 Ų | 125.7 | 82% | 0.816 | 80% | 0.801 | S | S | * | * | | | | 70.7 | 77.7 | 59.9 | 48.3 | 0 | 0 | 0 | 0 | 117.3 | | |
| 115 | S | 31.3 | Very low | 37.5 | Very low | 117 Ų | 117 | 126 Ų | 126 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | | | trans | 69.5 | 165.2 | 144.4 | -88.9 | 0 | 0 | 0 | 0 | 120.2 | | |
| 116 | P | 48.7 | Very low | 37 | Very low | 117 Ų | 117 | 128.1 Ų | 128.1 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | | | cis | -127.3 | 154.2 | -2.7 | 35.7 | -18.8 | 0 | 0 | 0 | 117.6 | | |
| 117 | N | 31.8 | Very low | 36.8 | Very low | 140 Ų | 140 | 130.1 Ų | 130.1 | 75% | 0.749 | 79% | 0.794 | S | S | * | * | | | trans | 9.5 | 131.5 | 145.3 | -170.3 | 33.4 | 0 | 0 | 0 | 122 | | |
| 118 | L | 33.5 | Very low | 36.1 | Very low | 163 Ų | 163 | 126.3 Ų | 126.3 | 85% | 0.853 | 79% | 0.786 | S | S | * | * | | | | -163.2 | 164.7 | 121.6 | -106.9 | 169.2 | 0 | 0 | 0 | 113.3 | | |
| 119 | A | 35.3 | Very low | 35.8 | Very low | 72 Ų | 72 | 131.7 Ų | 131.7 | 60% | 0.595 | 79% | 0.792 | S | S | * | * | | | trans | -87.1 | 151 | -156.6 | 0 | 0 | 0 | 0 | 0 | 117.3 | | |
| 120 | N | 33.2 | Very low | 35.3 | Very low | 166 Ų | 166 | 130.4 Ų | 130.4 | 89% | 0.888 | 79% | 0.786 | S | S | * | * | | | | -174.3 | 165.9 | 114.5 | -92.5 | -28.2 | 0 | 0 | 0 | 114.2 | | |
| 121 | K | 34.2 | Very low | 35.4 | Very low | 200 Ų | 200 | 132.9 Ų | 132.9 | 87% | 0.87 | 78% | 0.783 | S | S | * | * | | | trans | -126.8 | 179.1 | 179.9 | -95.3 | -169.9 | 177.6 | -174.4 | 0 | 108.9 | | |
| 122 | P | 43.2 | Very low | 35.8 | Very low | 106 Ų | 106 | 140.3 Ų | 140.3 | 69% | 0.688 | 79% | 0.787 | S | S | * | * | | | cis | -131.5 | -174.1 | -2.1 | 36 | -16.4 | 0 | 0 | 0 | 115.3 | | |
| 123 | S | 28.4 | Very low | 36.3 | Very low | 110 Ų | 110 | 142.5 Ų | 142.5 | 77% | 0.769 | 79% | 0.786 | S | S | * | * | | | trans | 66.8 | 140.2 | 163.2 | 69.3 | 0 | 0 | 0 | 0 | 117.2 | | |
| 124 | S | 30.1 | Very low | 36.8 | Very low | 120 Ų | 120 | 142.5 Ų | 142.5 | 84% | 0.839 | 79% | 0.787 | S | S | * | * | | | cis | -156.6 | -179.1 | -7 | -90.7 | 0 | 0 | 0 | 0 | 107.7 | | |
| 125 | S | 37.1 | Very low | 37.7 | Very low | 107 Ų | 107 | 143.9 Ų | 143.9 | 75% | 0.748 | 79% | 0.788 | S | S | * | * | | | cis | -146.8 | -177.2 | 10.3 | 65.6 | 0 | 0 | 0 | 0 | 111.6 | | |
| 126 | D | 32.8 | Very low | 38.6 | Very low | 139 Ų | 139 | 143.7 Ų | 143.7 | 74% | 0.743 | 78% | 0.784 | S | S | * | * | | | trans | -61.4 | 145.2 | 164.8 | -59.9 | -96.9 | 0 | 0 | 0 | 113.5 | | |
| 127 | H | 40.6 | Very low | 38.1 | Very low | 168 Ų | 168 | 145.5 Ų | 145.5 | 78% | 0.778 | 79% | 0.787 | S | S | * | * | | | | -172.9 | 150.4 | 119.6 | -104.7 | 51.7 | 0 | 0 | 0 | 113.7 | | |
| 128 | Q | 37.2 | Very low | 39.1 | Very low | 155 Ų | 155 | 146 Ų | 146 | 72% | 0.724 | 79% | 0.789 | S | S | * | * | | | trans | 64.7 | 105 | 167.2 | -56.5 | -46.6 | -47.1 | 0 | 0 | 120.7 | | |
| 129 | R | 38.4 | Very low | 39.2 | Very low | 226 Ų | 226 | 143 Ų | 143 | 85% | 0.853 | 78% | 0.782 | S | S | * | * | | | trans | -75.2 | 131.6 | 163.4 | -95 | -178.3 | 168.6 | -144.7 | 2.2 | 111.9 | | |
| 130 | S | 34.5 | Very low | 39.5 | Very low | 100 Ų | 100 | 151.1 Ų | 151.1 | 70% | 0.699 | 80% | 0.797 | S | S | * | * | | | trans | 44.3 | 106 | 144 | 63.2 | 0 | 0 | 0 | 0 | 120.2 | | |
| 131 | H | 38.6 | Very low | 40.1 | Very low | 184 Ų | 184 | 149 Ų | 149 | 85% | 0.852 | 79% | 0.792 | S | S | * | * | | | trans | -114.9 | 84.6 | 153.8 | -72 | -57.4 | 0 | 0 | 0 | 111.4 | | |
| 132 | R | 41.7 | Very low | 40.2 | Very low | 231 Ų | 231 | 144.4 Ų | 144.4 | 87% | 0.872 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 122 | 163.9 | -179.1 | -174.2 | -173 | -174.5 | 3.5 | 107.3 | S134 | R132-S134 PolarHBondContact O-N 3.18Š|
| 133 | P | 46.1 | Very low | 39.7 | Very low | 127 Ų | 127 | 142.9 Ų | 142.9 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 117.7 | 179.1 | 27.2 | -33 | 0 | 0 | 0 | 110.3 | | |
| 134 | S | 43.3 | Very low | 40.1 | Very low | 112 Ų | 112 | 146 Ų | 146 | 78% | 0.783 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -94.3 | 153.6 | 171.7 | 50.6 | 0 | 0 | 0 | 0 | 111.2 | R132 | R132-S134 PolarHBondContact O-N 3.18Š|
| 135 | L | 52.2 | Low | 40.3 | Very low | 161 Ų | 161 | 146.1 Ų | 146.1 | 84% | 0.843 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 156.1 | 175.4 | -71.3 | 161 | 0 | 0 | 0 | 111.2 | D137 | L135-D137 PolarHBondContact O-N 3.15Š|
| 136 | P | 50 | Low | 40.4 | Very low | 113 Ų | 113 | 146.9 Ų | 146.9 | 73% | 0.734 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 130.8 | 173.4 | 28.9 | -34.2 | 0 | 0 | 0 | 110.6 | | |
| 137 | D | 39 | Very low | 40.7 | Very low | 155 Ų | 155 | 145.9 Ų | 145.9 | 83% | 0.829 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -81.5 | 148.2 | 175 | -157.7 | -14.7 | 0 | 0 | 0 | 110.7 | L135 | L135-D137 PolarHBondContact O-N 3.15Š|
| 138 | I | 51.4 | Low | 40.6 | Very low | 151 Ų | 151 | 144.2 Ų | 144.2 | 77% | 0.774 | 82% | 0.82 | S | S | * | * | | | trans | -128.5 | 83.5 | -170.8 | -51 | 175.2 | 0 | 0 | 0 | 108.7 | | |
| 139 | S | 36 | Very low | 40.6 | Very low | 101 Ų | 101 | 140.3 Ų | 140.3 | 71% | 0.706 | 82% | 0.822 | S | S | * | * | | | trans | -154 | 119.8 | 173.4 | -91 | 0 | 0 | 0 | 0 | 115.3 | | |
| 140 | R | 41.3 | Very low | 40.6 | Very low | 242 Ų | 242 | 133.3 Ų | 133.3 | 91% | 0.913 | 82% | 0.82 | S | S | * | * | | | trans | 81.9 | 153.1 | 154.6 | -64.3 | -176.2 | 178.5 | -127.7 | -3.7 | 118 | | |
| 141 | P | 46.3 | Very low | 41.1 | Very low | 120 Ų | 120 | 136.8 Ų | 136.8 | 78% | 0.779 | 83% | 0.827 | S | S | * | * | | | trans | -136.3 | -171.9 | -136 | 45 | -28.7 | 0 | 0 | 0 | 116.6 | | |
| 142 | A | 36.3 | Very low | 41.7 | Very low | 105 Ų | 105 | 136.8 Ų | 136.8 | 87% | 0.868 | 83% | 0.825 | S | S | * | * | | | trans | 82.6 | 133.4 | 163 | 0 | 0 | 0 | 0 | 0 | 117.9 | | |
| 143 | G | 32.5 | Very low | 41.9 | Very low | 74 Ų | 74 | 133.1 Ų | 133.1 | 76% | 0.763 | 82% | 0.817 | S | S | * | * | | | trans | 153.4 | 91.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | | |
| 144 | N | 36.3 | Very low | 41.5 | Very low | 175 Ų | 175 | 132.6 Ų | 132.6 | 94% | 0.936 | 82% | 0.816 | S | S | * | * | | | trans | -76.4 | 129.5 | 176.5 | -83.5 | 5.6 | 0 | 0 | 0 | 111.6 | | |
| 145 | S | 34.4 | Very low | 41.6 | Very low | 123 Ų | 123 | 133.1 Ų | 133.1 | 86% | 0.86 | 82% | 0.815 | S | S | * | * | | | trans | -158.1 | 150.6 | 148.5 | 55.2 | 0 | 0 | 0 | 0 | 111 | | |
| 146 | S | 39.2 | Very low | 41.4 | Very low | 122 Ų | 122 | 131.7 Ų | 131.7 | 85% | 0.853 | 82% | 0.818 | S | S | * | * | | | trans | -101.2 | 130.1 | -171 | 53 | 0 | 0 | 0 | 0 | 113.5 | | |
| 147 | S | 39 | Very low | 41.8 | Very low | 119 Ų | 119 | 129.6 Ų | 129.6 | 83% | 0.832 | 81% | 0.811 | S | S | * | * | | | trans | -148.4 | 129.5 | 161.2 | 61.8 | 0 | 0 | 0 | 0 | 111.3 | | |
| 148 | S | 39.7 | Very low | 42.9 | Very low | 132 Ų | 132 | 127.9 Ų | 127.9 | 92% | 0.923 | 81% | 0.808 | S | S | * | * | | | trans | -74.6 | 141.3 | 176.4 | 43.3 | 0 | 0 | 0 | 0 | 112 | | |
| 149 | G | 36.5 | Very low | 43.6 | Very low | 74 Ų | 74 | 126.3 Ų | 126.3 | 76% | 0.763 | 81% | 0.808 | S | S | * | * | | | trans | -154.1 | 105.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | M151 | G149-M151 PolarHBondContact O-N 3.26Š|
| 150 | G | 39.1 | Very low | 45.3 | Very low | 79 Ų | 79 | 127 Ų | 127 | 81% | 0.814 | 81% | 0.81 | S | S | * | * | | | trans | -71.7 | 126.9 | -167.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | K152 | G150-K152 PolarHBondContact O-N 3.26Š|
| 151 | M | 45.1 | Very low | 46.4 | Very low | 172 Ų | 172 | 121 Ų | 121 | 85% | 0.847 | 80% | 0.802 | S | S | * | * | | | trans | -66.3 | 115.5 | 163.9 | -67.2 | 168.9 | 172.8 | 0 | 0 | 109.4 | G149 | G149-M151 PolarHBondContact O-N 3.26Š|
| 152 | K | 50.2 | Low | 47.3 | Very low | 185 Ų | 185 | 120.4 Ų | 120.4 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | | | trans | -115.7 | 106.1 | 169.2 | 73.1 | -176.5 | -166.9 | -64.3 | 0 | 110.6 | G150 | G150-K152 PolarHBondContact O-N 3.26Š|
| 153 | H | 45.1 | Very low | 48.8 | Very low | 154 Ų | 154 | 120.6 Ų | 120.6 | 71% | 0.713 | 79% | 0.791 | S | S | * | * | | | trans | -92.9 | 111.1 | 171.3 | -50.9 | -64.1 | 0 | 0 | 0 | 107.9 | T155 | H153-T155 VanDerWaalsContact C-N 3.33Å; H153-T155 PolarHBondContact O-N 2.92Å |
| 154 | S | 39.1 | Very low | 50 | Low | 115 Ų | 115 | 126.4 Ų | 126.4 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | | | trans | -76.6 | 79.8 | -176.4 | -61 | 0 | 0 | 0 | 0 | 111.7 | S156 | S154-S156 PolarHBondContact O-N 3.35Š|
| 155 | T | 45 | Very low | 50.7 | Low | 123 Ų | 123 | 125 Ų | 125 | 76% | 0.755 | 79% | 0.788 | S | S | * | * | | | trans | -72.6 | 93.9 | 175.6 | -53.1 | 0 | 0 | 0 | 0 | 110.6 | H153 A157 | H153-T155 VanDerWaalsContact C-N 3.33Å; H153-T155 PolarHBondContact O-N 2.92Å; T155-A157 HydrophobicContact CG2-CB 4.28Å; T155-A157 PolarHBondContact O-N 3.05Å; T155-A157 VanDerWaalsContact O-N 3.15Å |
| 156 | S | 48.9 | Very low | 51.6 | Low | 131 Ų | 131 | 129 Ų | 129 | 92% | 0.916 | 79% | 0.79 | S | S | * | * | | | trans | -78.7 | 92.3 | 167.6 | -168.9 | 0 | 0 | 0 | 0 | 109.6 | S154 | S154-S156 PolarHBondContact O-N 3.35Š|
| 157 | A | 57.1 | Low | 51.9 | Low | 69 Ų | 69 | 128.4 Ų | 128.4 | 57% | 0.57 | 79% | 0.786 | S | S | * | * | | | trans | -143.7 | 136 | 167.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | T155 | T155-A157 HydrophobicContact CG2-CB 4.28Å; T155-A157 PolarHBondContact O-N 3.05Å; T155-A157 VanDerWaalsContact O-N 3.15Å |
| 158 | P | 62.6 | Low | 51.8 | Low | 120 Ų | 120 | 126.4 Ų | 126.4 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 150.3 | 173.5 | 29.6 | -34.4 | 0 | 0 | 0 | 110.4 | | |
| 159 | P | 66.6 | Low | 52.3 | Low | 117 Ų | 117 | 132.7 Ų | 132.7 | 76% | 0.76 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 147.5 | 175.7 | 28 | -34.8 | 0 | 0 | 0 | 111 | | |
| 160 | P | 70.3 | Confident | 52.7 | Low | 115 Ų | 115 | 132.5 Ų | 132.5 | 75% | 0.747 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 152.4 | 174.2 | 29.6 | -35.1 | 0 | 0 | 0 | 111.1 | | |
| 161 | P | 64.4 | Low | 52.6 | Low | 117 Ų | 117 | 136.7 Ų | 136.7 | 76% | 0.76 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 152.6 | 174.8 | 28.6 | -35.2 | 0 | 0 | 0 | 111.5 | | |
| 162 | P | 66.2 | Low | 52.6 | Low | 108 Ų | 108 | 133 Ų | 133 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 151.3 | 179.9 | 27.9 | -35.3 | 0 | 0 | 0 | 112.1 | | |
| 163 | P | 67.6 | Low | 52.5 | Low | 109 Ų | 109 | 129.6 Ų | 129.6 | 71% | 0.708 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 139.8 | -179.9 | 28.6 | -34.9 | 0 | 0 | 0 | 112 | N165 | P163-N165 PolarHBondContact O-N 3.16Š|
| 164 | F | 57.8 | Low | 52.6 | Low | 196 Ų | 196 | 128.2 Ų | 128.2 | 86% | 0.86 | 79% | 0.787 | S | S | * | * | | | trans | -72.9 | 106.9 | 172.7 | -69.4 | -83.1 | 0 | 0 | 0 | 110.7 | K166 | F164-K166 PolarHBondContact O-N 3.38Š|
| 165 | N | 50.3 | Low | 52.9 | Low | 144 Ų | 144 | 129.2 Ų | 129.2 | 77% | 0.77 | 79% | 0.788 | S | S | * | * | | | trans | -66.9 | 86.1 | 177.1 | -73.3 | -16.4 | 0 | 0 | 0 | 112.1 | P163 S167 | P163-N165 PolarHBondContact O-N 3.16Å; N165-S167 PolarHBondContact O-N 3.27Å |
| 166 | K | 53.4 | Low | 52.7 | Low | 207 Ų | 207 | 129.5 Ų | 129.5 | 90% | 0.9 | 79% | 0.793 | S | S | * | * | | | trans | -78.3 | 61.1 | 172.3 | -76 | -170.5 | 172.3 | -176.5 | 0 | 112.4 | F164 | F164-K166 PolarHBondContact O-N 3.38Š|
| 167 | S | 45.2 | Very low | 52.3 | Low | 110 Ų | 110 | 130 Ų | 130 | 77% | 0.769 | 79% | 0.785 | S | S | * | * | | | trans | -153.4 | 67 | 175.1 | 62.1 | 0 | 0 | 0 | 0 | 112.5 | N165 | N165-S167 PolarHBondContact O-N 3.27Š|
| 168 | G | 38 | Very low | 51.5 | Low | 77 Ų | 77 | 133.5 Ų | 133.5 | 79% | 0.794 | 79% | 0.789 | S | S | * | * | | | trans | -145.9 | 123.3 | 169.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | | |
| 169 | R | 49.1 | Very low | 50.2 | Low | 265 Ų | 265 | 136.6 Ų | 136.6 | 100% | 1 | 79% | 0.791 | S | S | * | * | | | trans | -88 | 138.9 | 178.5 | -65.7 | -175.6 | 178.9 | -154 | 1.3 | 110 | | |
| 170 | G | 44.5 | Very low | 48.7 | Very low | 69 Ų | 69 | 134.4 Ų | 134.4 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | | | trans | -178.4 | 138 | 170.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | | |
| 171 | N | 38.1 | Very low | 47.2 | Very low | 167 Ų | 167 | 135.5 Ų | 135.5 | 89% | 0.893 | 80% | 0.796 | S | S | * | * | | | trans | 53.2 | 82.4 | 165.6 | -58.4 | -4.8 | 0 | 0 | 0 | 117.4 | | |
| 172 | A | 46 | Very low | 45.7 | Very low | 94 Ų | 94 | 134.9 Ų | 134.9 | 78% | 0.777 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 140 | 148.6 | 0 | 0 | 0 | 0 | 0 | 109.5 | | |
| 173 | P | 46.6 | Very low | 44.2 | Very low | 115 Ų | 115 | 139.9 Ų | 139.9 | 75% | 0.747 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 148.6 | 168.6 | 31.2 | -33.6 | 0 | 0 | 0 | 110.7 | | |
| 174 | P | 46.8 | Very low | 42.5 | Very low | 125 Ų | 125 | 141.5 Ų | 141.5 | 81% | 0.812 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 146.9 | -177.2 | 31.5 | -35.6 | 0 | 0 | 0 | 112.7 | P176 | P174-P176 WeakPolarHBondContact O-CD 3.38Š|
| 175 | T | 47.3 | Very low | 41.4 | Very low | 135 Ų | 135 | 142.8 Ų | 142.8 | 83% | 0.828 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -84 | 121.4 | 169.5 | 51.2 | 0 | 0 | 0 | 0 | 111 | | |
| 176 | P | 39.9 | Very low | 40.8 | Very low | 130 Ų | 130 | 140.3 Ų | 140.3 | 84% | 0.844 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -82.4 | 128 | 168.1 | 32 | -30.9 | 0 | 0 | 0 | 110.6 | P174 | P174-P176 WeakPolarHBondContact O-CD 3.38Š|
| 177 | N | 41.3 | Very low | 40.2 | Very low | 142 Ų | 142 | 139 Ų | 139 | 76% | 0.759 | 78% | 0.784 | S | S | * | * | | | trans | -134.3 | 115.5 | 169.8 | 177.8 | 8.8 | 0 | 0 | 0 | 109.1 | | |
| 178 | Q | 39.9 | Very low | 40 | Very low | 141 Ų | 141 | 139.8 Ų | 139.8 | 66% | 0.659 | 78% | 0.784 | S | S | * | * | | | trans | 163.9 | 137.4 | 141.9 | -95.2 | -179.4 | 64.6 | 0 | 0 | 112.7 | | |
| 179 | K | 34.1 | Very low | 40.4 | Very low | 185 Ų | 185 | 144 Ų | 144 | 80% | 0.804 | 79% | 0.787 | S | S | * | * | | | trans | 67.8 | 139.1 | 150.5 | -65.3 | 161.6 | 178 | 158.3 | 0 | 118.8 | | |
| 180 | G | 35.7 | Very low | 40.4 | Very low | 71 Ų | 71 | 137.1 Ų | 137.1 | 73% | 0.732 | 78% | 0.777 | S | S | * | * | | | trans | -91 | -167 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114 | | |
| 181 | P | 39.2 | Very low | 40.6 | Very low | 138 Ų | 138 | 138.8 Ų | 138.8 | 90% | 0.896 | 78% | 0.776 | S | S | * | * | | | | -144.1 | -173.7 | 78.4 | 41.7 | -26.1 | 0 | 0 | 0 | 116.8 | | |
| 182 | S | 31.9 | Very low | 40.8 | Very low | 104 Ų | 104 | 137.4 Ų | 137.4 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | | | trans | -65.2 | 135.9 | -173.3 | 177.5 | 0 | 0 | 0 | 0 | 117.9 | | |
| 183 | Y | 35.4 | Very low | 40.6 | Very low | 213 Ų | 213 | 138.7 Ų | 138.7 | 84% | 0.835 | 77% | 0.774 | S | S | * | * | | | | -163.1 | 121.2 | 121.1 | 45.9 | -101.5 | 0 | 0 | 0 | 109.1 | | |
| 184 | N | 31.6 | Very low | 40.3 | Very low | 143 Ų | 143 | 138.5 Ų | 138.5 | 77% | 0.765 | 78% | 0.775 | S | S | * | * | | | | 73.1 | 96.7 | 73.8 | -169.6 | 5.7 | 0 | 0 | 0 | 115 | | |
| 185 | R | 35.7 | Very low | 39.5 | Very low | 223 Ų | 223 | 145 Ų | 145 | 84% | 0.842 | 78% | 0.784 | S | S | * | * | | | trans | -153.5 | 120 | 140.2 | -136.1 | -155.8 | 166.5 | 137.6 | 6.2 | 114.7 | | |
| 186 | D | 36.9 | Very low | 38.6 | Very low | 93 Ų | 93 | 141.3 Ų | 141.3 | 50% | 0.497 | 77% | 0.773 | S | S | . | * | | | trans | 55.3 | 102.2 | 147.2 | -67.6 | -39.6 | 0 | 0 | 0 | 123.4 | | |
| 187 | K | 41 | Very low | 38.2 | Very low | 178 Ų | 178 | 141.1 Ų | 141.1 | 77% | 0.774 | 77% | 0.774 | S | S | * | * | | | trans | 66.1 | 105.7 | 139.1 | -41.3 | -52 | 172.4 | -175.7 | 0 | 118.4 | | |
| 188 | V | 41 | Very low | 37.6 | Very low | 127 Ų | 127 | 139.1 Ų | 139.1 | 77% | 0.77 | 77% | 0.772 | S | S | * | * | | | | 98.3 | 114.8 | 53.5 | 165.8 | 0 | 0 | 0 | 0 | 113.1 | | |
| 189 | L | 45.6 | Very low | 37.2 | Very low | 165 Ų | 165 | 137 Ų | 137 | 86% | 0.864 | 77% | 0.772 | S | S | * | * | | | trans | -127.7 | 138.6 | 154.8 | -72.4 | 173.5 | 0 | 0 | 0 | 107.7 | | |
| 190 | P | 50.5 | Low | 36.9 | Very low | 121 Ų | 121 | 133.2 Ų | 133.2 | 79% | 0.786 | 77% | 0.769 | S | S | * | * | | | trans | -83.2 | 139.3 | -178 | 32.1 | -34 | 0 | 0 | 0 | 112.8 | | |
| 191 | P | 49.2 | Very low | 36.7 | Very low | 105 Ų | 105 | 135.1 Ų | 135.1 | 68% | 0.682 | 77% | 0.771 | S | S | * | * | | | trans | -104.8 | 136.4 | 178.7 | 36.5 | -31.1 | 0 | 0 | 0 | 114.6 | | |
| 192 | T | 41.8 | Very low | 36.2 | Very low | 138 Ų | 138 | 133.6 Ų | 133.6 | 85% | 0.847 | 76% | 0.764 | S | S | * | * | | | trans | 62.9 | -178.2 | 154.1 | 78.3 | 0 | 0 | 0 | 0 | 114.6 | | |
| 193 | P | 42.1 | Very low | 36.2 | Very low | 120 Ų | 120 | 133.8 Ų | 133.8 | 78% | 0.779 | 77% | 0.765 | S | S | * | * | | | cis | -128.8 | 169.9 | 13.4 | 43.8 | -26.8 | 0 | 0 | 0 | 118.4 | | |
| 194 | S | 39.3 | Very low | 36 | Very low | 112 Ų | 112 | 128.8 Ų | 128.8 | 78% | 0.783 | 76% | 0.761 | S | S | * | * | | | trans | -80.6 | 150 | 166.9 | 53.4 | 0 | 0 | 0 | 0 | 113.2 | | |
| 195 | R | 30.8 | Very low | 35.9 | Very low | 260 Ų | 260 | 127.2 Ų | 127.2 | 98% | 0.981 | 76% | 0.762 | S | S | * | * | | | trans | -151.6 | 155 | 154.3 | -118.5 | -179.8 | -179.8 | -158.4 | -1.2 | 110.5 | | |
| 196 | G | 28.8 | Very low | 35.7 | Very low | 58 Ų | 58 | 121.4 Ų | 121.4 | 60% | 0.598 | 76% | 0.755 | S | S | * | * | | | trans | -141.6 | -173 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 197 | S | 31.1 | Very low | 35.6 | Very low | 126 Ų | 126 | 121.7 Ų | 121.7 | 88% | 0.881 | 77% | 0.765 | S | S | * | * | | | trans | 65.6 | 143.8 | -172.8 | 74.6 | 0 | 0 | 0 | 0 | 113.7 | | |
| 198 | S | 28.1 | Very low | 35.1 | Very low | 101 Ų | 101 | 120.4 Ų | 120.4 | 71% | 0.706 | 77% | 0.766 | S | S | * | * | | | cis | -161 | -179.5 | 20.1 | 56 | 0 | 0 | 0 | 0 | 113.5 | | |
| 199 | S | 30.9 | Very low | 34.9 | Very low | 95 Ų | 95 | 121.3 Ų | 121.3 | 66% | 0.664 | 77% | 0.772 | S | S | * | * | | | trans | 62.3 | 101.5 | 144.8 | 65.7 | 0 | 0 | 0 | 0 | 123.1 | | |
| 200 | S | 29.5 | Very low | 34.3 | Very low | 106 Ų | 106 | 122.7 Ų | 122.7 | 74% | 0.741 | 77% | 0.765 | S | S | * | * | | | | 54 | 152.4 | 119.3 | 62.1 | 0 | 0 | 0 | 0 | 124.8 | | |
| 201 | S | 29.7 | Very low | 33.5 | Very low | 111 Ų | 111 | 122.8 Ų | 122.8 | 78% | 0.776 | 77% | 0.769 | S | S | * | * | | | trans | 67.1 | 150.3 | 158.1 | 37.5 | 0 | 0 | 0 | 0 | 118.5 | | |
| 202 | S | 30.5 | Very low | 32.7 | Very low | 106 Ų | 106 | 122 Ų | 122 | 74% | 0.741 | 76% | 0.759 | S | S | * | * | | | cis | -164.3 | 154 | -13.6 | 45.5 | 0 | 0 | 0 | 0 | 112.4 | | |
| 203 | S | 30 | Very low | 32.3 | Very low | 109 Ų | 109 | 124 Ų | 124 | 76% | 0.762 | 76% | 0.759 | S | S | * | * | | | trans | -5.3 | 123.7 | 162.8 | 56.8 | 0 | 0 | 0 | 0 | 122.8 | | |
| 204 | S | 31.6 | Very low | 31.8 | Very low | 107 Ų | 107 | 123.5 Ų | 123.5 | 75% | 0.748 | 76% | 0.758 | S | S | * | * | | | trans | -173.3 | 138.5 | 130.2 | 41.9 | 0 | 0 | 0 | 0 | 108.7 | | |
| 205 | S | 29.1 | Very low | 31.8 | Very low | 110 Ų | 110 | 123.5 Ų | 123.5 | 77% | 0.769 | 76% | 0.758 | S | S | * | * | | | cis | 74.1 | 118.4 | 48.3 | -56.1 | 0 | 0 | 0 | 0 | 111.5 | | |
| 206 | S | 32.4 | Very low | 31.9 | Very low | 102 Ų | 102 | 116.9 Ų | 116.9 | 71% | 0.713 | 75% | 0.751 | S | S | * | * | | | cis | -157.9 | 172.6 | 14.5 | -64.5 | 0 | 0 | 0 | 0 | 112.9 | | |
| 207 | S | 33.9 | Very low | 32.8 | Very low | 99 Ų | 99 | 123.3 Ų | 123.3 | 69% | 0.692 | 76% | 0.763 | S | S | * | * | | | trans | 37.5 | 137.9 | 142.2 | 59.2 | 0 | 0 | 0 | 0 | 121.1 | | |
| 208 | N | 31.7 | Very low | 33.6 | Very low | 150 Ų | 150 | 123.1 Ų | 123.1 | 80% | 0.802 | 76% | 0.759 | S | S | * | * | | | cis | -155.1 | 160.4 | 4.6 | -90.6 | -26.5 | 0 | 0 | 0 | 106.1 | | |
| 209 | V | 37.3 | Very low | 34.6 | Very low | 146 Ų | 146 | 124.2 Ų | 124.2 | 89% | 0.885 | 76% | 0.763 | S | S | * | * | | | | -149.9 | 154.4 | 68.7 | 165.9 | 0 | 0 | 0 | 0 | 110.3 | | |
| 210 | R | 32.5 | Very low | 35.2 | Very low | 194 Ų | 194 | 126 Ų | 126 | 73% | 0.732 | 78% | 0.776 | S | S | * | * | | | trans | -111.4 | 134.9 | -167.5 | -179.8 | -177.8 | 179.7 | -169.6 | 1.2 | 112.1 | N212 | R210-N212 PolarHBondContact NE-OD1 3.15Å; R210-N212 PolarHBondContact NH2-OD1 3.4Å; R210-N212 VanDerWaalsContact NH2-OD1 3.11Å |
| 211 | S | 33.3 | Very low | 35.4 | Very low | 124 Ų | 124 | 124.4 Ų | 124.4 | 87% | 0.867 | 78% | 0.776 | S | S | * | * | | | trans | -133.9 | 125.5 | 158 | -73.1 | 0 | 0 | 0 | 0 | 109 | | |
| 212 | N | 32.7 | Very low | 36.1 | Very low | 88 Ų | 88 | 123 Ų | 123 | 47% | 0.471 | 78% | 0.779 | S | S | . | * | | | trans | -83.7 | 157.6 | -176.4 | -64.7 | -38.9 | 0 | 0 | 0 | 110.1 | R210 | R210-N212 PolarHBondContact NE-OD1 3.15Å; R210-N212 PolarHBondContact NH2-OD1 3.4Å; R210-N212 VanDerWaalsContact NH2-OD1 3.11Å |
| 213 | H | 32.8 | Very low | 36.5 | Very low | 181 Ų | 181 | 123.3 Ų | 123.3 | 84% | 0.838 | 78% | 0.781 | S | S | * | * | | | | -160.9 | 156.2 | 57.1 | -92.9 | -84.7 | 0 | 0 | 0 | 113.7 | | |
| 214 | S | 32.8 | Very low | 37.5 | Very low | 108 Ų | 108 | 124.2 Ų | 124.2 | 76% | 0.755 | 79% | 0.787 | S | S | * | * | | | trans | -96.2 | 147.6 | -178.9 | -50.2 | 0 | 0 | 0 | 0 | 113.3 | | |
| 215 | S | 38.3 | Very low | 38.6 | Very low | 113 Ų | 113 | 127.1 Ų | 127.1 | 79% | 0.79 | 79% | 0.791 | S | S | * | * | | | trans | 40.6 | 125 | 140.1 | 64.1 | 0 | 0 | 0 | 0 | 120.8 | | |
| 216 | S | 32.7 | Very low | 40.4 | Very low | 120 Ų | 120 | 126.9 Ų | 126.9 | 84% | 0.839 | 79% | 0.787 | S | S | * | * | | | trans | -134.8 | 137.6 | 138.8 | 55.6 | 0 | 0 | 0 | 0 | 110.7 | | |
| 217 | K | 47.5 | Very low | 41.9 | Very low | 194 Ų | 194 | 127.5 Ų | 127.5 | 84% | 0.843 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -95.1 | 141.1 | 162.7 | -65.6 | 176 | 178.5 | 177.4 | 0 | 107.2 | | |
| 218 | P | 47.4 | Very low | 43.4 | Very low | 122 Ų | 122 | 128.4 Ų | 128.4 | 79% | 0.792 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 140.9 | 165.6 | 30.9 | -32.7 | 0 | 0 | 0 | 110.3 | | |
| 219 | P | 49.6 | Very low | 45.1 | Very low | 124 Ų | 124 | 126.2 Ų | 126.2 | 81% | 0.805 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 166 | 172.8 | 34.4 | -35.1 | 0 | 0 | 0 | 112 | | |
| 220 | S | 42.9 | Very low | 46.4 | Very low | 132 Ų | 132 | 124.4 Ų | 124.4 | 92% | 0.923 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 132.1 | 166.6 | -176.9 | 0 | 0 | 0 | 0 | 110.6 | | |
| 221 | G | 35 | Very low | 47.8 | Very low | 72 Ų | 72 | 121.2 Ų | 121.2 | 74% | 0.742 | 78% | 0.782 | S | S | * | * | | | trans | -157.1 | 121.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | | |
| 222 | G | 43.5 | Very low | 48.3 | Very low | 83 Ų | 83 | 125.7 Ų | 125.7 | 86% | 0.856 | 78% | 0.781 | S | S | * | * | | | trans | -93.7 | 128.4 | -167 | 0 | 0 | 0 | 0 | 0 | 114.4 | | |
| 223 | S | 40 | Very low | 49 | Very low | 112 Ų | 112 | 132.2 Ų | 132.2 | 78% | 0.783 | 80% | 0.799 | S | S | * | * | | | trans | -160.9 | 97.1 | 155.2 | 41.6 | 0 | 0 | 0 | 0 | 110.3 | M225 | S223-M225 PolarHBondContact O-N 3.29Å; S223-M225 VanDerWaalsContact O-N 3.17Å |
| 224 | S | 50.7 | Low | 49.6 | Very low | 127 Ų | 127 | 129.9 Ų | 129.9 | 89% | 0.888 | 80% | 0.8 | S | S | * | * | | | trans | -78.5 | 98.3 | 174.8 | -172.9 | 0 | 0 | 0 | 0 | 109.8 | | |
| 225 | M | 55.1 | Low | 49.9 | Very low | 169 Ų | 169 | 130.5 Ų | 130.5 | 83% | 0.833 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -93.8 | 129.4 | 162.6 | -68.9 | -160.2 | 75 | 0 | 0 | 109.4 | S223 | S223-M225 PolarHBondContact O-N 3.29Å; S223-M225 VanDerWaalsContact O-N 3.17Å |
| 226 | P | 65.2 | Low | 50 | Low | 105 Ų | 105 | 128.3 Ų | 128.3 | 68% | 0.682 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 150.5 | 171.9 | 29.3 | -34 | 0 | 0 | 0 | 110.5 | | |
| 227 | P | 65.3 | Low | 50.4 | Low | 115 Ų | 115 | 129.2 Ų | 129.2 | 75% | 0.747 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 148.6 | 174.2 | 28 | -34.9 | 0 | 0 | 0 | 111 | | |
| 228 | P | 64.8 | Low | 50 | Low | 117 Ų | 117 | 124 Ų | 124 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 144.7 | -179.2 | 26.8 | -34.8 | 0 | 0 | 0 | 111.5 | | |
| 229 | P | 66.7 | Low | 49.6 | Very low | 104 Ų | 104 | 126.4 Ų | 126.4 | 68% | 0.675 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 148.6 | 178.4 | 28 | -34.8 | 0 | 0 | 0 | 111.3 | | |
| 230 | P | 64.9 | Low | 48.8 | Very low | 108 Ų | 108 | 123.9 Ų | 123.9 | 70% | 0.701 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 150.5 | 176.7 | 28.3 | -35.1 | 0 | 0 | 0 | 111.2 | Y232 | P230-Y232 PolarHBondContact O-N 3.2Š|
| 231 | P | 62 | Low | 48.7 | Very low | 127 Ų | 127 | 123.9 Ų | 123.9 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 126.3 | -176.9 | 25.1 | -34.2 | 0 | 0 | 0 | 111.5 | R233 | P231-R233 PolarHBondContact O-N 3.43Š|
| 232 | Y | 43.8 | Very low | 49.2 | Very low | 218 Ų | 218 | 125.8 Ų | 125.8 | 86% | 0.855 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -56 | 124.5 | 177.3 | -74.8 | -93.5 | 0 | 0 | 0 | 111.3 | P230 | P230-Y232 PolarHBondContact O-N 3.2Š|
| 233 | R | 48.8 | Very low | 49 | Very low | 226 Ų | 226 | 130.4 Ų | 130.4 | 85% | 0.853 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 137.9 | 153.2 | -77.6 | -173.9 | 173 | -168.4 | -3.7 | 108.3 | P231 S235 | P231-R233 PolarHBondContact O-N 3.43Å; R233-S235 PolarHBondContact O-N 3.18Å |
| 234 | P | 45.4 | Very low | 49.5 | Very low | 131 Ų | 131 | 131.5 Ų | 131.5 | 85% | 0.851 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 117.5 | 178.4 | 27.2 | -33.4 | 0 | 0 | 0 | 110.4 | | |
| 235 | S | 38.4 | Very low | 49 | Very low | 121 Ų | 121 | 132.7 Ų | 132.7 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 134.5 | 170.8 | -66.5 | 0 | 0 | 0 | 0 | 110.5 | R233 T237 | R233-S235 PolarHBondContact O-N 3.18Å; S235-T237 PolarHBondContact O-N 2.98Å |
| 236 | G | 40.2 | Very low | 48.6 | Very low | 68 Ų | 68 | 130 Ų | 130 | 70% | 0.701 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 120.7 | 175 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 237 | T | 41.1 | Very low | 47.7 | Very low | 138 Ų | 138 | 128.7 Ų | 128.7 | 85% | 0.847 | 80% | 0.796 | S | S | * | * | | | trans | 43.7 | 115.6 | 143.7 | 56.6 | 0 | 0 | 0 | 0 | 120.6 | S235 | S235-T237 PolarHBondContact O-N 2.98Š|
| 238 | A | 39.8 | Very low | 46.5 | Very low | 86 Ų | 86 | 127.5 Ų | 127.5 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | | | trans | 82.7 | 110.5 | 134.1 | 0 | 0 | 0 | 0 | 0 | 121.5 | | |
| 239 | N | 38.4 | Very low | 45.8 | Very low | 171 Ų | 171 | 126.1 Ų | 126.1 | 91% | 0.914 | 80% | 0.803 | S | S | * | * | | | trans | 63.7 | 104.7 | 130.5 | -55.3 | -9 | 0 | 0 | 0 | 120.5 | | |
| 240 | G | 33.5 | Very low | 45.4 | Very low | 71 Ų | 71 | 127 Ų | 127 | 73% | 0.732 | 81% | 0.809 | S | S | * | * | | | trans | -171.8 | 139.1 | 159.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | | |
| 241 | P | 40.8 | Very low | 44.9 | Very low | 133 Ų | 133 | 128.9 Ų | 128.9 | 86% | 0.864 | 81% | 0.809 | S | S | * | * | | | trans | -76.3 | 155.1 | -171 | 30.6 | -35.6 | 0 | 0 | 0 | 113.5 | Q243 | P241-Q243 PolarHBondContact O-N 3.11Š|
| 242 | S | 45.3 | Very low | 45 | Very low | 112 Ų | 112 | 129.9 Ų | 129.9 | 78% | 0.783 | 81% | 0.806 | S | S | * | * | | | trans | -66.3 | 125.2 | 178.8 | 52.7 | 0 | 0 | 0 | 0 | 113 | | |
| 243 | Q | 38.2 | Very low | 45.8 | Very low | 180 Ų | 180 | 125.2 Ų | 125.2 | 84% | 0.841 | 80% | 0.802 | S | S | * | * | | | trans | -123.4 | 125.3 | 153.6 | -97.7 | -68.4 | -2.4 | 0 | 0 | 107.8 | P241 | P241-Q243 PolarHBondContact O-N 3.11Š|
| 244 | V | 50.2 | Low | 46.5 | Very low | 134 Ų | 134 | 121.6 Ų | 121.6 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | | | trans | -109 | 104.5 | -179 | -83.1 | 0 | 0 | 0 | 0 | 108.8 | | |
| 245 | D | 41 | Very low | 46.9 | Very low | 153 Ų | 153 | 126.7 Ų | 126.7 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | | | trans | -143.6 | 162.4 | 158.2 | -155.2 | 2.4 | 0 | 0 | 0 | 111.7 | | |
| 246 | S | 46.9 | Very low | 47.9 | Very low | 111 Ų | 111 | 131 Ų | 131 | 78% | 0.776 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -75.2 | 153.9 | -156.4 | -47.4 | 0 | 0 | 0 | 0 | 114.2 | | |
| 247 | G | 45.9 | Very low | 48.7 | Very low | 78 Ų | 78 | 134.5 Ų | 134.5 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | | | trans | 98.6 | 60.6 | 161.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | A249 | G247-A249 PolarHBondContact O-N 3.25Å; G247-A249 VanDerWaalsContact O-N 3.16Å |
| 248 | G | 40.8 | Very low | 49.1 | Very low | 91 Ų | 91 | 131.6 Ų | 131.6 | 94% | 0.938 | 79% | 0.789 | S | S | * | * | | | trans | -68.1 | 107.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 249 | A | 50.6 | Low | 49.9 | Very low | 87 Ų | 87 | 135.4 Ų | 135.4 | 72% | 0.719 | 80% | 0.796 | S | S | * | * | | | trans | -119.9 | 131 | 157.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | G247 E251 | G247-A249 PolarHBondContact O-N 3.25Å; G247-A249 VanDerWaalsContact O-N 3.16Å; A249-E251 PolarHBondContact O-N 2.86Å |
| 250 | P | 56.7 | Low | 50.4 | Low | 124 Ų | 124 | 137.4 Ų | 137.4 | 81% | 0.805 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 122.1 | -177.8 | 28.2 | -33.5 | 0 | 0 | 0 | 111 | L252 | P250-L252 PolarHBondContact O-N 3.09Š|
| 251 | E | 55.7 | Low | 51.1 | Low | 147 Ų | 147 | 143.6 Ų | 143.6 | 69% | 0.687 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 122 | 178.7 | -166.8 | -175.5 | 179.7 | 0 | 0 | 110.9 | A249 Q254 | A249-E251 PolarHBondContact O-N 2.86Å; E251-Q254 WeakPolarHBondContact OE1-CG 3.23Å; E251-Q254 PolarHBondContact OE1-NE2 3.23Å |
| 252 | L | 63.3 | Low | 51.2 | Low | 147 Ų | 147 | 145 Ų | 145 | 77% | 0.77 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 135 | 173.8 | -67.7 | 174.6 | 0 | 0 | 0 | 110 | P250 Q254 | P250-L252 PolarHBondContact O-N 3.09Å; L252-Q254 PolarHBondContact O-N 3.07Å |
| 253 | P | 62 | Low | 51.2 | Low | 120 Ų | 120 | 148.8 Ų | 148.8 | 78% | 0.779 | 80% | 0.796 | S | S | * | * | | | trans | -52.8 | 108.2 | -178.7 | -29.5 | 35.7 | 0 | 0 | 0 | 113 | R255 | P253-R255 PolarHBondContact O-N 3.11Š|
| 254 | Q | 62.2 | Low | 51.1 | Low | 150 Ų | 150 | 145.2 Ų | 145.2 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | | | trans | -61.1 | 104.1 | -175.5 | -67.7 | -166.4 | 23.2 | 0 | 0 | 111.1 | E251 L252 K256 | E251-Q254 WeakPolarHBondContact OE1-CG 3.23Å; E251-Q254 PolarHBondContact OE1-NE2 3.23Å; L252-Q254 PolarHBondContact O-N 3.07Å; Q254-K256 PolarHBondContact O-N 2.87Å |
| 255 | R | 53.8 | Low | 50.6 | Low | 238 Ų | 238 | 144.9 Ų | 144.9 | 90% | 0.898 | 79% | 0.79 | S | S | * | * | | | trans | -69.8 | 101.4 | 176.4 | -61.6 | -176 | 72.7 | 178.2 | 3.7 | 108.5 | P253 N257 | P253-R255 PolarHBondContact O-N 3.11Å; R255-N257 PolarHBondContact O-N 3.1Å |
| 256 | K | 59.8 | Low | 50.4 | Low | 212 Ų | 212 | 141.5 Ų | 141.5 | 92% | 0.922 | 79% | 0.792 | S | S | * | * | | | trans | -65.3 | 68 | -179.2 | -60 | -177.1 | -176.7 | 179.6 | 0 | 112.6 | Q254 | Q254-K256 PolarHBondContact O-N 2.87Š|
| 257 | N | 57 | Low | 49.8 | Very low | 142 Ų | 142 | 140.2 Ų | 140.2 | 76% | 0.759 | 80% | 0.795 | S | S | * | * | | | trans | -124.3 | 81.5 | 174.3 | -173.1 | 25.3 | 0 | 0 | 0 | 109.7 | R255 | R255-N257 PolarHBondContact O-N 3.1Š|
| 258 | S | 49.6 | Very low | 49.4 | Very low | 76 Ų | 76 | 140.7 Ų | 140.7 | 53% | 0.531 | 80% | 0.8 | S | S | . | * | | | trans | -131.7 | 101.2 | 178.8 | -161.7 | 0 | 0 | 0 | 0 | 108.5 | R260 | S258-R260 PolarHBondContact O-N 3.36Å; S258-R260 VanDerWaalsContact OG-CG 3.26Å; S258-R260 WeakPolarHBondContact OG-CG 3.35Å; S258-R260 PolarHBondContact OG-NE 3.15Å; S258-R260 VanDerWaalsContact OG-NE 3.13Å |
| 259 | L | 56.9 | Low | 49 | Very low | 166 Ų | 166 | 140.1 Ų | 140.1 | 87% | 0.869 | 79% | 0.794 | S | S | * | * | | | trans | -74.2 | 66.6 | 177.3 | -131.1 | 98.5 | 0 | 0 | 0 | 109.8 | K261 | L259-K261 VanDerWaalsContact C-N 3.27Å; L259-K261 PolarHBondContact O-N 3.4Å |
| 260 | R | 48 | Very low | 48.8 | Very low | 213 Ų | 213 | 145.6 Ų | 145.6 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | | | trans | -74.8 | 77.2 | -176.1 | -63.6 | -161 | 178.7 | -155.2 | 2 | 111.2 | S258 K262 | S258-R260 PolarHBondContact O-N 3.36Å; S258-R260 VanDerWaalsContact OG-CG 3.26Å; S258-R260 WeakPolarHBondContact OG-CG 3.35Å; S258-R260 PolarHBondContact OG-NE 3.15Å; S258-R260 VanDerWaalsContact OG-NE 3.13Å; R260-K262 PolarHBondContact O-N 3.02Å |
| 261 | K | 48.7 | Very low | 48 | Very low | 202 Ų | 202 | 142.9 Ų | 142.9 | 88% | 0.878 | 80% | 0.8 | S | S | * | * | | | trans | -73.9 | 62.2 | 170.7 | -163.3 | 179.4 | -176.9 | -179.5 | 0 | 110.8 | L259 | L259-K261 VanDerWaalsContact C-N 3.27Å; L259-K261 PolarHBondContact O-N 3.4Å |
| 262 | K | 42.4 | Very low | 47.7 | Very low | 163 Ų | 163 | 146.1 Ų | 146.1 | 71% | 0.709 | 81% | 0.806 | S | S | * | * | | | trans | -94.5 | 111.8 | 170.1 | -162 | -169 | -175.8 | -166.4 | 0 | 108.6 | R260 T264 | R260-K262 PolarHBondContact O-N 3.02Å; K262-T264 HydrophobicContact CD-CG2 3.77Å; K262-T264 VanDerWaalsContact CE-CG2 3.42Å; K262-T264 HydrophobicContact CG-CG2 4.15Å |
| 263 | Q | 45.7 | Very low | 46.6 | Very low | 191 Ų | 191 | 146.8 Ų | 146.8 | 89% | 0.893 | 81% | 0.81 | S | S | * | * | | | trans | -74.5 | 122 | 160.1 | -73.8 | 178 | -49 | 0 | 0 | 107.9 | | |
| 264 | T | 35.2 | Very low | 45.8 | Very low | 104 Ų | 104 | 149 Ų | 149 | 64% | 0.638 | 81% | 0.81 | S | S | * | * | | | trans | -133.8 | 118.4 | 161.8 | 40.5 | 0 | 0 | 0 | 0 | 107.8 | K262 | K262-T264 HydrophobicContact CD-CG2 3.77Å; K262-T264 VanDerWaalsContact CE-CG2 3.42Å; K262-T264 HydrophobicContact CG-CG2 4.15Å |
| 265 | S | 41.5 | Very low | 45.4 | Very low | 127 Ų | 127 | 145.9 Ų | 145.9 | 89% | 0.888 | 81% | 0.81 | S | S | * | * | | | trans | -77.9 | 137.6 | 178.8 | 46.6 | 0 | 0 | 0 | 0 | 112.1 | | |
| 266 | G | 36.3 | Very low | 45.5 | Very low | 83 Ų | 83 | 140.2 Ų | 140.2 | 86% | 0.856 | 80% | 0.803 | S | S | * | * | | | trans | 90.8 | 147 | 160.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | | |
| 267 | G | 34 | Very low | 45.7 | Very low | 83 Ų | 83 | 135.7 Ų | 135.7 | 86% | 0.856 | 80% | 0.796 | S | S | * | * | | | trans | 111.4 | 110 | 166 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 268 | G | 36.7 | Very low | 46 | Very low | 88 Ų | 88 | 134.3 Ų | 134.3 | 91% | 0.907 | 79% | 0.794 | S | S | * | * | | | trans | -66.7 | 167.2 | -172.3 | 0 | 0 | 0 | 0 | 0 | 117.3 | | |
| 269 | G | 34 | Very low | 46.3 | Very low | 79 Ų | 79 | 136.5 Ų | 136.5 | 81% | 0.814 | 81% | 0.807 | S | S | * | * | | | trans | 174.2 | 128.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110 | | |
| 270 | Q | 44.7 | Very low | 45.9 | Very low | 202 Ų | 202 | 137.5 Ų | 137.5 | 94% | 0.944 | 81% | 0.809 | S | S | * | * | | | trans | -83.9 | 146.5 | -176.7 | -65.6 | -169.5 | 5.4 | 0 | 0 | 112.3 | | |
| 271 | G | 40.3 | Very low | 46.2 | Very low | 67 Ų | 67 | 133.8 Ų | 133.8 | 69% | 0.691 | 81% | 0.81 | S | S | * | * | | | trans | -170.2 | 60.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | N273 | G271-N273 PolarHBondContact O-N 2.85Å; G271-N273 VanDerWaalsContact O-N 3.15Å |
| 272 | R | 49.2 | Very low | 46.4 | Very low | 216 Ų | 216 | 129 Ų | 129 | 82% | 0.815 | 80% | 0.8 | S | S | * | * | | | trans | -64.1 | 110.3 | 178.2 | -78.6 | 177.8 | 170.9 | 161.5 | -3.9 | 111.2 | | |
| 273 | N | 41.6 | Very low | 46.9 | Very low | 161 Ų | 161 | 127.4 Ų | 127.4 | 86% | 0.861 | 81% | 0.806 | S | S | * | * | | | trans | -138.2 | 84.3 | 160.6 | -81.6 | -62.1 | 0 | 0 | 0 | 108.2 | G271 A275 | G271-N273 PolarHBondContact O-N 2.85Å; G271-N273 VanDerWaalsContact O-N 3.15Å; N273-A275 PolarHBondContact O-N 2.97Å |
| 274 | H | 45.4 | Very low | 46.4 | Very low | 166 Ų | 166 | 123.8 Ų | 123.8 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | | | trans | -80.8 | 109.7 | -178.6 | -72.6 | -90 | 0 | 0 | 0 | 110.6 | | |
| 275 | A | 53.3 | Low | 46.6 | Very low | 85 Ų | 85 | 124 Ų | 124 | 70% | 0.702 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 148.1 | 155.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | N273 | N273-A275 PolarHBondContact O-N 2.97Š|
| 276 | P | 55.5 | Low | 46.8 | Very low | 118 Ų | 118 | 122.9 Ų | 122.9 | 77% | 0.766 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 146.8 | 177.4 | 28 | -34.8 | 0 | 0 | 0 | 111.4 | | |
| 277 | P | 64.4 | Low | 47.2 | Very low | 117 Ų | 117 | 128.1 Ų | 128.1 | 76% | 0.76 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 152.1 | 172.3 | 30.1 | -34.8 | 0 | 0 | 0 | 111 | | |
| 278 | P | 61.9 | Low | 47.9 | Very low | 113 Ų | 113 | 133.3 Ų | 133.3 | 73% | 0.734 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -66 | 150.7 | 173.3 | 29.6 | -35.1 | 0 | 0 | 0 | 111.1 | | |
| 279 | P | 56.5 | Low | 48.2 | Very low | 123 Ų | 123 | 135.7 Ų | 135.7 | 80% | 0.799 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 138 | -179.8 | 27 | -34.7 | 0 | 0 | 0 | 111.6 | | |
| 280 | M | 48.3 | Very low | 49.1 | Very low | 186 Ų | 186 | 137.7 Ų | 137.7 | 92% | 0.916 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -77.8 | 132.7 | 175.1 | -62.6 | -179.8 | 72.2 | 0 | 0 | 110.2 | | |
| 281 | V | 53.6 | Low | 49.3 | Very low | 136 Ų | 136 | 139.2 Ų | 139.2 | 82% | 0.824 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 129.1 | 177.1 | -164.8 | 0 | 0 | 0 | 0 | 108.9 | | |
| 282 | P | 54.1 | Low | 50 | Low | 102 Ų | 102 | 141 Ų | 141 | 66% | 0.662 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 144.5 | -180 | 29 | -35 | 0 | 0 | 0 | 111.8 | | |
| 283 | P | 52.8 | Low | 50.9 | Low | 128 Ų | 128 | 136 Ų | 136 | 83% | 0.831 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 124.7 | 170.7 | 31.8 | -31.5 | 0 | 0 | 0 | 110.2 | | |
| 284 | S | 35.5 | Very low | 51.6 | Low | 116 Ų | 116 | 134 Ų | 134 | 81% | 0.811 | 79% | 0.79 | S | S | * | * | | | trans | -135.2 | 120.4 | 165.6 | -85.2 | 0 | 0 | 0 | 0 | 111.8 | | |
| 285 | S | 38 | Very low | 52.3 | Low | 109 Ų | 109 | 132.1 Ų | 132.1 | 76% | 0.762 | 79% | 0.792 | S | S | * | * | | | trans | -54.1 | 131 | 175 | 47.1 | 0 | 0 | 0 | 0 | 114.4 | | |
| 286 | S | 46.8 | Very low | 52.4 | Low | 103 Ų | 103 | 132.6 Ų | 132.6 | 72% | 0.72 | 80% | 0.796 | S | S | * | * | | | trans | 29.7 | 115.3 | 138.5 | 60.3 | 0 | 0 | 0 | 0 | 119.6 | | |
| 287 | Q | 44 | Very low | 52.2 | Low | 193 Ų | 193 | 138.7 Ų | 138.7 | 90% | 0.902 | 80% | 0.804 | S | S | * | * | | | | -129.3 | 146.3 | 129.9 | -70.2 | -161.6 | 29.8 | 0 | 0 | 109.6 | | |
| 288 | Q | 49.7 | Very low | 51.7 | Low | 192 Ų | 192 | 141.2 Ų | 141.2 | 90% | 0.897 | 81% | 0.806 | S | S | * | * | | | trans | -94.4 | 125 | 177.1 | -66.9 | -176.3 | -12.5 | 0 | 0 | 109.9 | | |
| 289 | V | 42.4 | Very low | 51.3 | Low | 138 Ų | 138 | 141.3 Ų | 141.3 | 84% | 0.836 | 81% | 0.807 | S | S | * | * | | | trans | -131.9 | 120.4 | 159.2 | -175.5 | 0 | 0 | 0 | 0 | 109.2 | | |
| 290 | S | 52.1 | Low | 50.6 | Low | 121 Ų | 121 | 142 Ų | 142 | 85% | 0.846 | 81% | 0.811 | S | S | * | * | | | trans | -49.8 | 129.3 | -173.9 | -51.7 | 0 | 0 | 0 | 0 | 114.5 | | |
| 291 | R | 50.6 | Low | 50.6 | Low | 234 Ų | 234 | 136.7 Ų | 136.7 | 88% | 0.883 | 80% | 0.804 | S | S | * | * | | | trans | -119.3 | 120.5 | 157.7 | -155.3 | 174.9 | -159 | -92.4 | 2 | 108 | | |
| 292 | P | 54.6 | Low | 50.4 | Low | 104 Ų | 104 | 142.1 Ų | 142.1 | 68% | 0.675 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 148.5 | -174.1 | 27.2 | -34.6 | 0 | 0 | 0 | 111.4 | | |
| 293 | P | 66.9 | Low | 49.5 | Very low | 112 Ų | 112 | 146.7 Ų | 146.7 | 73% | 0.727 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 150.5 | 170.1 | 29.2 | -34.6 | 0 | 0 | 0 | 110.4 | | |
| 294 | P | 57.5 | Low | 48.7 | Very low | 118 Ų | 118 | 146.9 Ų | 146.9 | 77% | 0.766 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 143.2 | 175.2 | 28.1 | -34.5 | 0 | 0 | 0 | 110.5 | A296 | P294-A296 PolarHBondContact O-N 3.3Š|
| 295 | P | 60.8 | Low | 48.7 | Very low | 126 Ų | 126 | 146 Ų | 146 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 131.8 | -176.1 | 25.1 | -34 | 0 | 0 | 0 | 111.6 | R297 | P295-R297 PolarHBondContact O-N 2.75Š|
| 296 | A | 54.5 | Low | 48.8 | Very low | 95 Ų | 95 | 147 Ų | 147 | 79% | 0.785 | 82% | 0.821 | S | S | * | * | | | trans | -66 | 114.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | P294 E298 | P294-A296 PolarHBondContact O-N 3.3Å; A296-E298 PolarHBondContact O-N 3.26Å; A296-E298 VanDerWaalsContact O-N 3.12Å |
| 297 | R | 51.7 | Low | 48.6 | Very low | 247 Ų | 247 | 150.8 Ų | 150.8 | 93% | 0.932 | 83% | 0.828 | S | S | * | * | | | trans | -84.8 | 84.8 | -179 | -167.1 | 176.3 | -168.8 | 164.4 | 4.3 | 110.2 | P295 | P295-R297 PolarHBondContact O-N 2.75Š|
| 298 | E | 52.8 | Low | 48 | Very low | 169 Ų | 169 | 149.6 Ų | 149.6 | 79% | 0.79 | 83% | 0.827 | S | S | * | * | | | trans | -58.2 | 143.3 | 176.1 | -64.8 | -161.3 | 142.3 | 0 | 0 | 112.2 | A296 | A296-E298 PolarHBondContact O-N 3.26Å; A296-E298 VanDerWaalsContact O-N 3.12Å |
| 299 | P | 53.7 | Low | 47.6 | Very low | 116 Ų | 116 | 145.4 Ų | 145.4 | 75% | 0.753 | 82% | 0.816 | S | S | * | * | | | trans | -73.2 | 129.3 | 172.3 | 29.9 | -32.8 | 0 | 0 | 0 | 110.2 | G301 | P299-G301 PolarHBondContact O-N 3.2Å; P299-G301 VanDerWaalsContact O-N 3.11Å |
| 300 | P | 43.3 | Very low | 47.8 | Very low | 137 Ų | 137 | 145.1 Ų | 145.1 | 89% | 0.89 | 82% | 0.817 | S | S | * | * | S | Bend | trans | -70.2 | 110.1 | -177.7 | 28 | -34.1 | 0 | 0 | 0 | 110.8 | | |
| 301 | G | 47.3 | Very low | 47 | Very low | 74 Ų | 74 | 144.5 Ų | 144.5 | 76% | 0.763 | 81% | 0.813 | S | S | * | * | | | trans | -179.4 | 16.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 118.8 | P299 | P299-G301 PolarHBondContact O-N 3.2Å; P299-G301 VanDerWaalsContact O-N 3.11Å |
| 302 | R | 49.8 | Very low | 46.4 | Very low | 250 Ų | 250 | 138.7 Ų | 138.7 | 94% | 0.943 | 81% | 0.808 | S | S | * | * | | | trans | -129.4 | 113.4 | 176.9 | -72.5 | -172.4 | 171.9 | -166.8 | -3.5 | 112.6 | | |
| 303 | K | 35 | Very low | 45.8 | Very low | 198 Ų | 198 | 139 Ų | 139 | 86% | 0.861 | 81% | 0.813 | S | S | * | * | | | trans | -132.4 | 116.2 | 163.7 | -72.4 | -168.5 | 175.8 | -172.7 | 0 | 109.7 | | |
| 304 | T | 35.9 | Very low | 44.5 | Very low | 132 Ų | 132 | 145.2 Ų | 145.2 | 81% | 0.81 | 82% | 0.822 | S | S | * | * | | | trans | 43.8 | 109 | 145.3 | 54.8 | 0 | 0 | 0 | 0 | 121.6 | | |
| 305 | A | 34.9 | Very low | 43.5 | Very low | 98 Ų | 98 | 147.3 Ų | 147.3 | 81% | 0.81 | 83% | 0.826 | S | S | * | * | | | trans | 67.7 | 163.4 | 131.4 | 0 | 0 | 0 | 0 | 0 | 119.9 | | |
| 306 | P | 40.4 | Very low | 42.4 | Very low | 129 Ų | 129 | 145 Ų | 145 | 84% | 0.838 | 83% | 0.826 | S | S | * | * | | | cis | -121.5 | -174.1 | 2.6 | 42 | -27.7 | 0 | 0 | 0 | 115.9 | | |
| 307 | Q | 42.1 | Very low | 41.8 | Very low | 184 Ų | 184 | 143.9 Ų | 143.9 | 86% | 0.86 | 82% | 0.824 | S | S | * | * | | | trans | -78 | 166.4 | 174.1 | -84 | -166.1 | -17.1 | 0 | 0 | 114 | | |
| 308 | L | 31.1 | Very low | 41.6 | Very low | 167 Ų | 167 | 143.4 Ų | 143.4 | 87% | 0.874 | 82% | 0.822 | S | S | * | * | | | trans | -157.5 | 178.7 | 135.2 | -101.1 | 179.4 | 0 | 0 | 0 | 109.2 | | |
| 309 | P | 42.6 | Very low | 41.3 | Very low | 104 Ų | 104 | 142.8 Ų | 142.8 | 68% | 0.675 | 82% | 0.824 | S | S | * | * | | | trans | -95.9 | 169.1 | -136.2 | 38.9 | -40 | 0 | 0 | 0 | 117.2 | | |
| 310 | P | 45.9 | Very low | 41.4 | Very low | 132 Ų | 132 | 141.6 Ų | 141.6 | 86% | 0.857 | 82% | 0.824 | S | S | * | * | | | trans | -84.2 | 127.6 | 177.1 | 32.9 | -34 | 0 | 0 | 0 | 113.6 | | |
| 311 | S | 36.5 | Very low | 42 | Very low | 109 Ų | 109 | 140.9 Ų | 140.9 | 76% | 0.762 | 82% | 0.819 | S | S | * | * | | | trans | -107.7 | 105.3 | 173.9 | 61.1 | 0 | 0 | 0 | 0 | 113 | | |
| 312 | S | 36.2 | Very low | 42.7 | Very low | 112 Ų | 112 | 142.8 Ų | 142.8 | 78% | 0.783 | 82% | 0.818 | S | S | * | * | | | trans | 40 | 113.9 | 147.6 | 61.4 | 0 | 0 | 0 | 0 | 120.5 | | |
| 313 | S | 43.4 | Very low | 43.1 | Very low | 110 Ų | 110 | 136.4 Ų | 136.4 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | | | trans | -28.7 | 138.9 | 148.9 | 176.4 | 0 | 0 | 0 | 0 | 115.9 | | |
| 314 | R | 38 | Very low | 44 | Very low | 242 Ų | 242 | 132.6 Ų | 132.6 | 91% | 0.913 | 80% | 0.804 | S | S | * | * | | | trans | -151.2 | 130 | 142.7 | -113.4 | 171.6 | -172.3 | -169.9 | 0.7 | 111.5 | | |
| 315 | N | 36.9 | Very low | 44.9 | Very low | 162 Ų | 162 | 132.3 Ų | 132.3 | 87% | 0.866 | 81% | 0.805 | S | S | * | * | | | trans | -82.6 | 155.8 | 170.1 | -82.1 | -42.4 | 0 | 0 | 0 | 110.9 | | |
| 316 | G | 37.7 | Very low | 45.2 | Very low | 79 Ų | 79 | 139.2 Ų | 139.2 | 81% | 0.814 | 81% | 0.812 | S | S | * | * | | | trans | 101 | 144.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 317 | G | 42.2 | Very low | 45.3 | Very low | 71 Ų | 71 | 144.2 Ų | 144.2 | 73% | 0.732 | 81% | 0.814 | S | S | * | * | | | cis | 136.5 | 128.8 | -3.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 318 | R | 48.1 | Very low | 45 | Very low | 236 Ų | 236 | 138.7 Ų | 138.7 | 89% | 0.891 | 81% | 0.807 | S | S | * | * | | | trans | 85.1 | 158 | 176.3 | -52.8 | -175.8 | 175.9 | -179.8 | -1 | 117.5 | | |
| 319 | D | 45.3 | Very low | 45.3 | Very low | 156 Ų | 156 | 138.1 Ų | 138.1 | 83% | 0.834 | 80% | 0.799 | S | S | * | * | | | trans | 71 | 119.3 | 159.4 | -50.7 | -36.6 | 0 | 0 | 0 | 120.5 | | |
| 320 | A | 56.6 | Low | 44.9 | Very low | 91 Ų | 91 | 138.2 Ų | 138.2 | 75% | 0.752 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -99.4 | 155.7 | 170.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | | |
| 321 | P | 56.2 | Low | 44.5 | Very low | 122 Ų | 122 | 138.5 Ų | 138.5 | 79% | 0.792 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 146.5 | -173.4 | 27.6 | -35.6 | 0 | 0 | 0 | 113.4 | | |
| 322 | P | 62.7 | Low | 44.4 | Very low | 115 Ų | 115 | 136.7 Ų | 136.7 | 75% | 0.747 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 157.6 | 179.2 | 31.8 | -36.2 | 0 | 0 | 0 | 113.2 | | |
| 323 | P | 58.5 | Low | 44.3 | Very low | 115 Ų | 115 | 137.8 Ų | 137.8 | 75% | 0.747 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 157.9 | 175.4 | 32.2 | -35.7 | 0 | 0 | 0 | 113 | | |
| 324 | P | 53.3 | Low | 43.8 | Very low | 118 Ų | 118 | 137.3 Ų | 137.3 | 77% | 0.766 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 155.3 | -177.9 | 31.1 | -36.2 | 0 | 0 | 0 | 113.6 | | |
| 325 | P | 54.8 | Low | 43.3 | Very low | 127 Ų | 127 | 133.5 Ų | 133.5 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 144.4 | -174.7 | 32.1 | -35.8 | 0 | 0 | 0 | 114.1 | | |
| 326 | Y | 41.8 | Very low | 43 | Very low | 243 Ų | 243 | 132.2 Ų | 132.2 | 95% | 0.953 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 150 | 165.3 | -101.2 | -102.7 | 0 | 0 | 0 | 111.5 | | |
| 327 | R | 42.5 | Very low | 42.7 | Very low | 233 Ų | 233 | 136.8 Ų | 136.8 | 88% | 0.879 | 78% | 0.78 | S | S | * | * | | | trans | -133.1 | 124.1 | 178.4 | -165.9 | -176.4 | -161.7 | -145.2 | 5 | 108.5 | | |
| 328 | G | 35.6 | Very low | 42.2 | Very low | 69 Ų | 69 | 136.9 Ų | 136.9 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | | | trans | 150.7 | 42.4 | -176.9 | 0 | 0 | 0 | 0 | 0 | 119.4 | | |
| 329 | H | 36.1 | Very low | 41.8 | Very low | 154 Ų | 154 | 137.3 Ų | 137.3 | 71% | 0.713 | 78% | 0.782 | S | S | * | * | | | trans | -40 | 155.1 | 144.1 | 11.6 | -102.6 | 0 | 0 | 0 | 112 | | |
| 330 | S | 34.9 | Very low | 41.4 | Very low | 106 Ų | 106 | 136.3 Ų | 136.3 | 74% | 0.741 | 78% | 0.781 | S | S | * | * | | | cis | -173.1 | 177.4 | 10.3 | -96.6 | 0 | 0 | 0 | 0 | 107.7 | | |
| 331 | T | 36.2 | Very low | 40.8 | Very low | 139 Ų | 139 | 141.1 Ų | 141.1 | 85% | 0.853 | 79% | 0.786 | S | S | * | * | | | cis | -168.2 | 164.3 | -2.8 | 16.9 | 0 | 0 | 0 | 0 | 109.3 | | |
| 332 | G | 34.5 | Very low | 39.9 | Very low | 70 Ų | 70 | 141.3 Ų | 141.3 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | | | trans | 117.9 | 143.8 | 163.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | | |
| 333 | V | 34.4 | Very low | 38.8 | Very low | 135 Ų | 135 | 143.9 Ų | 143.9 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | | | cis | 152.5 | 134.8 | -31.7 | 160.5 | 0 | 0 | 0 | 0 | 108.5 | | |
| 334 | S | 32.6 | Very low | 38.4 | Very low | 100 Ų | 100 | 143.7 Ų | 143.7 | 70% | 0.699 | 79% | 0.792 | S | S | * | * | | | trans | 66.5 | 156.8 | 171 | -73.5 | 0 | 0 | 0 | 0 | 118.8 | | |
| 335 | E | 29.2 | Very low | 38.1 | Very low | 162 Ų | 162 | 143.7 Ų | 143.7 | 76% | 0.757 | 79% | 0.792 | S | S | * | * | | | cis | -161.3 | -177.8 | -28 | -163.9 | 147 | -178.2 | 0 | 0 | 111.6 | | |
| 336 | Q | 30.6 | Very low | 37.6 | Very low | 135 Ų | 135 | 143.8 Ų | 143.8 | 63% | 0.631 | 79% | 0.793 | S | S | * | * | | | trans | -56.9 | 175.7 | -161.5 | -58.7 | -174.2 | 14.8 | 0 | 0 | 121.6 | | |
| 337 | H | 31.8 | Very low | 37.7 | Very low | 176 Ų | 176 | 137.3 Ų | 137.3 | 82% | 0.815 | 78% | 0.783 | S | S | * | * | | | trans | 80 | 149.3 | 163.6 | -41.6 | -61.2 | 0 | 0 | 0 | 117 | | |
| 338 | G | 30.9 | Very low | 37.7 | Very low | 73 Ų | 73 | 132.1 Ų | 132.1 | 75% | 0.753 | 78% | 0.779 | S | S | * | * | | | cis | -172.9 | -169.5 | -1.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 339 | R | 39.8 | Very low | 38.1 | Very low | 245 Ų | 245 | 133.8 Ų | 133.8 | 93% | 0.925 | 78% | 0.78 | S | S | * | * | | | trans | -57.6 | 158.7 | 165.5 | -85.2 | 172 | 160.7 | 170.6 | -7.7 | 109.7 | | |
| 340 | V | 35.7 | Very low | 38.9 | Very low | 134 Ų | 134 | 131.3 Ų | 131.3 | 81% | 0.812 | 78% | 0.778 | S | S | * | * | | | cis | -156.1 | 169.6 | 45 | -147.1 | 0 | 0 | 0 | 0 | 111.9 | | |
| 341 | K | 44.4 | Very low | 39 | Very low | 193 Ų | 193 | 135.1 Ų | 135.1 | 84% | 0.839 | 78% | 0.781 | S | S | * | * | | | trans | -102.2 | 142 | 164.2 | -70 | -179.5 | 177.2 | 179.3 | 0 | 111.6 | | |
| 342 | P | 38.8 | Very low | 39.2 | Very low | 125 Ų | 125 | 135.3 Ų | 135.3 | 81% | 0.812 | 78% | 0.776 | S | S | * | * | | | trans | -96.2 | 169.3 | 152.6 | -7.1 | 27.2 | 0 | 0 | 0 | 112.7 | | |
| 343 | L | 38.1 | Very low | 39.1 | Very low | 169 Ų | 169 | 136.8 Ų | 136.8 | 89% | 0.885 | 78% | 0.775 | S | S | * | * | | | trans | -122.8 | 166.6 | 177.2 | -82.1 | 172.4 | 0 | 0 | 0 | 111.4 | | |
| 344 | P | 51.4 | Low | 39.1 | Very low | 111 Ų | 111 | 135.8 Ų | 135.8 | 72% | 0.721 | 78% | 0.775 | S | S | * | * | | | trans | -103 | 162.1 | -160 | 39.2 | -36.4 | 0 | 0 | 0 | 116.3 | | |
| 345 | P | 46 | Very low | 39.3 | Very low | 119 Ų | 119 | 137.1 Ų | 137.1 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | | | trans | -103.9 | 176.6 | 161.6 | 38.4 | -28.6 | 0 | 0 | 0 | 112.1 | | |
| 346 | P | 45 | Very low | 39.6 | Very low | 129 Ų | 129 | 134.2 Ų | 134.2 | 84% | 0.838 | 78% | 0.782 | S | S | * | * | | | trans | -117.4 | 177 | -132.5 | 35.3 | -21.4 | 0 | 0 | 0 | 117.4 | | |
| 347 | S | 43.2 | Very low | 39.9 | Very low | 106 Ų | 106 | 132.6 Ų | 132.6 | 74% | 0.741 | 79% | 0.785 | S | S | * | * | | | trans | -105.5 | 142.7 | 176.1 | -177.3 | 0 | 0 | 0 | 0 | 112 | | |
| 348 | P | 43.7 | Very low | 40.8 | Very low | 125 Ų | 125 | 135.7 Ų | 135.7 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | | | trans | -116.1 | 116.3 | 161.3 | 34.3 | -21.9 | 0 | 0 | 0 | 112.1 | | |
| 349 | S | 43.5 | Very low | 41.4 | Very low | 104 Ų | 104 | 138.4 Ų | 138.4 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | | | trans | -118.3 | 139.5 | 170 | 58.6 | 0 | 0 | 0 | 0 | 110.6 | | |
| 350 | P | 53 | Low | 41.7 | Very low | 101 Ų | 101 | 132.9 Ų | 132.9 | 66% | 0.656 | 79% | 0.787 | S | S | * | * | | | trans | -120.5 | 118.6 | 167.1 | 16.1 | 5.4 | 0 | 0 | 0 | 114.1 | | |
| 351 | F | 36.2 | Very low | 42.6 | Very low | 187 Ų | 187 | 131.2 Ų | 131.2 | 82% | 0.82 | 79% | 0.788 | S | S | * | * | | | trans | 66.5 | 143 | 133.8 | -51.3 | -42 | 0 | 0 | 0 | 120.8 | | |
| 352 | L | 40.3 | Very low | 43.2 | Very low | 143 Ų | 143 | 124.8 Ų | 124.8 | 75% | 0.749 | 78% | 0.776 | S | S | * | * | | | cis | -155.9 | 140.6 | -4.8 | -114.1 | 167.1 | 0 | 0 | 0 | 112.6 | | |
| 353 | S | 33.8 | Very low | 44.7 | Very low | 100 Ų | 100 | 124.7 Ų | 124.7 | 70% | 0.699 | 78% | 0.776 | S | S | * | * | | | trans | 28.2 | 128.7 | 151.4 | -60.7 | 0 | 0 | 0 | 0 | 123.9 | | |
| 354 | S | 32.5 | Very low | 46.2 | Very low | 115 Ų | 115 | 122.2 Ų | 122.2 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | | | | -179.5 | 133.1 | 101.3 | -78 | 0 | 0 | 0 | 0 | 115.3 | | |
| 355 | S | 38.3 | Very low | 47.2 | Very low | 127 Ų | 127 | 122.5 Ų | 122.5 | 89% | 0.888 | 77% | 0.772 | S | S | * | * | | | trans | 62.7 | 143.3 | 154.1 | -153.6 | 0 | 0 | 0 | 0 | 119.5 | | |
| 356 | S | 35.8 | Very low | 48.4 | Very low | 102 Ų | 102 | 122.2 Ų | 122.2 | 71% | 0.713 | 77% | 0.77 | S | S | * | * | | | cis | -165.7 | 173.2 | -25.6 | -174.2 | 0 | 0 | 0 | 0 | 109.7 | | |
| 357 | S | 36.5 | Very low | 49.7 | Very low | 101 Ų | 101 | 121 Ų | 121 | 71% | 0.706 | 76% | 0.762 | S | S | * | * | | | trans | 65.4 | 81.1 | 160.2 | -65 | 0 | 0 | 0 | 0 | 121.5 | | |
| 358 | R | 49.2 | Very low | 51.2 | Low | 240 Ų | 240 | 121.1 Ų | 121.1 | 91% | 0.906 | 76% | 0.76 | S | S | * | * | | | | 40.1 | 96.1 | 127.3 | -62.7 | -179.4 | 172.3 | -146.4 | -1.9 | 119.6 | | |
| 359 | T | 43.8 | Very low | 52.4 | Low | 130 Ų | 130 | 120.8 Ų | 120.8 | 80% | 0.798 | 76% | 0.758 | S | S | * | * | | | | -172.3 | 143.6 | 123.7 | 14.3 | 0 | 0 | 0 | 0 | 109.8 | A361 | T359-A361 PolarHBondContact O-N 2.98Å; T359-A361 VanDerWaalsContact O-N 3.11Å |
| 360 | P | 46.3 | Very low | 52.9 | Low | 129 Ų | 129 | 125.2 Ų | 125.2 | 84% | 0.838 | 77% | 0.765 | S | S | * | * | | | trans | -73.6 | 100.7 | 165.8 | 30.2 | -30.2 | 0 | 0 | 0 | 108.1 | G362 | P360-G362 PolarHBondContact O-N 2.97Š|
| 361 | A | 54 | Low | 52.8 | Low | 99 Ų | 99 | 128.9 Ų | 128.9 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 120.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | T359 | T359-A361 PolarHBondContact O-N 2.98Å; T359-A361 VanDerWaalsContact O-N 3.11Å |
| 362 | G | 58 | Low | 53.5 | Low | 58 Ų | 58 | 127.2 Ų | 127.2 | 60% | 0.598 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 165.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | P360 | P360-G362 PolarHBondContact O-N 2.97Š|
| 363 | P | 69.6 | Low | 54.1 | Low | 124 Ų | 124 | 124.1 Ų | 124.1 | 81% | 0.805 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 145.2 | 172.9 | 25.8 | -34.6 | 0 | 0 | 0 | 110.2 | | |
| 364 | P | 70.2 | Confident | 54.8 | Low | 117 Ų | 117 | 124.8 Ų | 124.8 | 76% | 0.76 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 145.7 | -177.5 | 24.7 | -34.4 | 0 | 0 | 0 | 110.7 | | |
| 365 | P | 71.9 | Confident | 55.2 | Low | 117 Ų | 117 | 123.4 Ų | 123.4 | 76% | 0.76 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 143.3 | -180 | 25.4 | -34.3 | 0 | 0 | 0 | 110.3 | | |
| 366 | P | 71.9 | Confident | 56 | Low | 113 Ų | 113 | 124.4 Ų | 124.4 | 73% | 0.734 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 147.2 | 178.5 | 26.4 | -34.7 | 0 | 0 | 0 | 110.4 | | |
| 367 | P | 72.9 | Confident | 56.6 | Low | 102 Ų | 102 | 121.4 Ų | 121.4 | 66% | 0.662 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 143.7 | 178.2 | 25.3 | -34.4 | 0 | 0 | 0 | 110.4 | | |
| 368 | P | 73.6 | Confident | 57.3 | Low | 109 Ų | 109 | 122.5 Ų | 122.5 | 71% | 0.708 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 141.4 | -179.4 | 25.3 | -34.3 | 0 | 0 | 0 | 110.3 | F370 | P368-F370 PolarHBondContact O-N 3.28Š|
| 369 | P | 68.5 | Low | 57.5 | Low | 119 Ų | 119 | 115.5 Ų | 115.5 | 77% | 0.773 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 131.7 | -177 | 24.9 | -34.2 | 0 | 0 | 0 | 110.3 | R371 | P369-R371 PolarHBondContact O-N 3.25Š|
| 370 | F | 53.8 | Low | 57.8 | Low | 197 Ų | 197 | 113 Ų | 113 | 86% | 0.864 | 72% | 0.717 | S | S | * | * | | | trans | -59.9 | 93.4 | -178.5 | -65 | -77.4 | 0 | 0 | 0 | 111.3 | P368 N372 | P368-F370 PolarHBondContact O-N 3.28Å; F370-N372 PolarHBondContact O-N 2.93Å; F370-N372 VanDerWaalsContact O-N 3.07Å |
| 371 | R | 51.3 | Low | 58.2 | Low | 177 Ų | 177 | 114.5 Ų | 114.5 | 67% | 0.668 | 71% | 0.71 | S | S | * | * | | | trans | -75.2 | 97.2 | 178.6 | -173.7 | 173.4 | -173.9 | -96.9 | -4.7 | 109 | P369 G373 H374 | P369-R371 PolarHBondContact O-N 3.25Å; R371-G373 PolarHBondContact O-N 3.48Å; R371-H374 PolarHBondContact NH1-CD2 2.91Å; R371-H374 PolarHBondContact NH1-CE1 3.1Å; R371-H374 VanDerWaalsContact NH1-CE1 3.34Å; R371-H374 PolarHBondContact NH1-ND1 3.41Å; R371-H374 PolarHBondContact NH1-NE2 2.59Å; R371-H374 VanDerWaalsContact NH1-NE2 3.16Å; R371-H374 PolarHBondContact O-N 3.29Å |
| 372 | N | 52 | Low | 58.3 | Low | 152 Ų | 152 | 112.5 Ų | 112.5 | 81% | 0.813 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -39.5 | 126.5 | 178.8 | -96.2 | 33.9 | 0 | 0 | 0 | 112.5 | F370 H374 | F370-N372 PolarHBondContact O-N 2.93Å; F370-N372 VanDerWaalsContact O-N 3.07Å; N372-H374 PolarHBondContact O-ND1 2.79Å |
| 373 | G | 52.1 | Low | 58.3 | Low | 79 Ų | 79 | 116.3 Ų | 116.3 | 81% | 0.814 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 78.4 | 18.5 | 166.6 | 0 | 0 | 0 | 0 | 0 | 117.5 | R371 | R371-G373 PolarHBondContact O-N 3.48Š|
| 374 | H | 47.9 | Very low | 57.7 | Low | 113 Ų | 113 | 116.6 Ų | 116.6 | 52% | 0.523 | 69% | 0.687 | S | S | . | * | | | trans | -132.6 | 63 | -179.2 | -64.1 | 82.7 | 0 | 0 | 0 | 113.5 | R371 N372 T376 | R371-H374 PolarHBondContact NH1-CD2 2.91Å; R371-H374 PolarHBondContact NH1-CE1 3.1Å; R371-H374 VanDerWaalsContact NH1-CE1 3.34Å; R371-H374 PolarHBondContact NH1-ND1 3.41Å; R371-H374 PolarHBondContact NH1-NE2 2.59Å; R371-H374 VanDerWaalsContact NH1-NE2 3.16Å; R371-H374 PolarHBondContact O-N 3.29Å; N372-H374 PolarHBondContact O-ND1 2.79Å; H374-T376 PolarHBondContact O-N 2.8Å |
| 375 | S | 42 | Very low | 57.5 | Low | 86 Ų | 86 | 115.5 Ų | 115.5 | 60% | 0.601 | 68% | 0.675 | S | S | * | * | | | trans | -75.8 | 84 | 172 | -61.1 | 0 | 0 | 0 | 0 | 111.3 | G377 | S375-G377 PolarHBondContact O-N 3.24Š|
| 376 | T | 53.9 | Low | 57.7 | Low | 149 Ų | 149 | 114.2 Ų | 114.2 | 91% | 0.914 | 66% | 0.662 | S | S | * | * | | | trans | -75.9 | 68.8 | 162.7 | 51.7 | 0 | 0 | 0 | 0 | 109.5 | H374 | H374-T376 PolarHBondContact O-N 2.8Š|
| 377 | G | 48.3 | Very low | 57.9 | Low | 39 Ų | 39 | 114.9 Ų | 114.9 | 40% | 0.402 | 65% | 0.653 | S | S | . | * | S | Bend | trans | -165.7 | 154.9 | -178.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | S375 S379 | S375-G377 PolarHBondContact O-N 3.24Å; G377-S379 PolarHBondContact O-N 3.34Å |
| 378 | P | 52.4 | Low | 57.9 | Low | 124 Ų | 124 | 114.5 Ų | 114.5 | 81% | 0.805 | 64% | 0.643 | S | S | * | * | G | 310 helix | trans | -66.1 | -13.4 | -158.9 | 23.1 | -34 | 0 | 0 | 0 | 116.1 | S380 K381 | P378-S380 PolarHBondContact O-N 3.46Å; P378-K381 PolarHBondContact O-N 3.3Å |
| 379 | S | 52.6 | Low | 57.9 | Low | 93 Ų | 93 | 113.5 Ų | 113.5 | 65% | 0.65 | 64% | 0.639 | S | S | * | * | G | 310 helix | trans | -63.6 | -19.3 | -177.1 | -172.6 | 0 | 0 | 0 | 0 | 115 | G377 K381 S382 | G377-S379 PolarHBondContact O-N 3.34Å; S379-K381 PolarHBondContact O-N 2.77Å; S379-K381 VanDerWaalsContact O-N 3.15Å; S379-S382 PolarHBondContact O-N 3.44Å |
| 380 | S | 50.8 | Low | 58.4 | Low | 78 Ų | 78 | 114.4 Ų | 114.4 | 55% | 0.545 | 63% | 0.63 | S | S | . | * | G | 310 helix | trans | -71.1 | -3 | 180 | -72.9 | 0 | 0 | 0 | 0 | 114.8 | P378 | P378-S380 PolarHBondContact O-N 3.46Š|
| 381 | K | 54.3 | Low | 59.6 | Low | 160 Ų | 160 | 110 Ų | 110 | 70% | 0.696 | 61% | 0.611 | S | S | * | * | G | 310 helix | trans | -82.4 | -32.9 | 172.3 | -66 | -171.5 | 176.3 | -171 | 0 | 113.7 | P378 S379 I383 M384 D385 | P378-K381 PolarHBondContact O-N 3.3Å; S379-K381 PolarHBondContact O-N 2.77Å; S379-K381 VanDerWaalsContact O-N 3.15Å; K381-I383 VanDerWaalsContact C-N 3.26Å; K381-I383 PolarHBondContact O-N 3.12Å; K381-I383 VanDerWaalsContact O-N 3.11Å; K381-M384 WeakPolarHBondContact O-CB 3.3Å; K381-M384 PolarHBondContact O-N 3.04Å; K381-D385 PolarHBondContact O-N 2.64Å; K381-D385 VanDerWaalsContact O-N 3.1Å |
| 382 | S | 56.8 | Low | 61.1 | Low | 56 Ų | 56 | 108.9 Ų | 108.9 | 39% | 0.392 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -62.6 | -30.1 | -164 | 83.9 | 0 | 0 | 0 | 0 | 113.8 | S379 M384 D385 D386 | S379-S382 PolarHBondContact O-N 3.44Å; S382-M384 PolarHBondContact O-N 2.88Å; S382-D385 CarbonylContact O-C 3.54Å; S382-D385 PolarHBondContact O-N 2.95Å; S382-D386 WeakPolarHBondContact O-CB 3.35Å; S382-D386 PolarHBondContact O-N 3.48Å |
| 383 | I | 56.7 | Low | 62.5 | Low | 139 Ų | 139 | 108.2 Ų | 108.2 | 71% | 0.713 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -71.8 | -15.3 | 179.3 | -157.5 | 63.8 | 0 | 0 | 0 | 113.7 | K381 | K381-I383 VanDerWaalsContact C-N 3.26Å; K381-I383 PolarHBondContact O-N 3.12Å; K381-I383 VanDerWaalsContact O-N 3.11Å |
| 384 | M | 58.5 | Low | 64.1 | Low | 129 Ų | 129 | 110.2 Ų | 110.2 | 64% | 0.635 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -88.8 | -47.4 | 168.9 | -155.6 | 96 | 153 | 0 | 0 | 109.3 | K381 S382 D386 F387 E388 | K381-M384 WeakPolarHBondContact O-CB 3.3Å; K381-M384 PolarHBondContact O-N 3.04Å; S382-M384 PolarHBondContact O-N 2.88Å; M384-D386 PolarHBondContact O-N 3.08Å; M384-F387 PolarHBondContact O-N 3Å; M384-E388 VanDerWaalsContact CG-OE1 3.23Å; M384-E388 WeakPolarHBondContact CG-OE1 3.24Å; M384-E388 PolarHBondContact O-N 3.41Å |
| 385 | D | 65.4 | Low | 65.9 | Low | 95 Ų | 95 | 108.5 Ų | 108.5 | 51% | 0.508 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -56.9 | -33.4 | 177.5 | -134.5 | 26 | 0 | 0 | 0 | 112.3 | K381 S382 F387 E388 S389 | K381-D385 PolarHBondContact O-N 2.64Å; K381-D385 VanDerWaalsContact O-N 3.1Å; S382-D385 CarbonylContact O-C 3.54Å; S382-D385 PolarHBondContact O-N 2.95Å; D385-F387 PolarHBondContact O-N 3.14Å; D385-E388 PolarHBondContact O-N 2.72Å; D385-S389 WeakPolarHBondContact O-CB 3.12Å; D385-S389 PolarHBondContact O-N 2.75Å; D385-S389 PolarHBondContact O-OG 2.89Å |
| 386 | D | 76.6 | Confident | 67.7 | Low | 90 Ų | 90 | 110.6 Ų | 110.6 | 48% | 0.481 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -65.4 | -22.8 | 175.9 | -75.6 | -21.4 | 0 | 0 | 0 | 112.9 | S382 M384 K390 | S382-D386 WeakPolarHBondContact O-CB 3.35Å; S382-D386 PolarHBondContact O-N 3.48Å; M384-D386 PolarHBondContact O-N 3.08Å; D386-K390 VanDerWaalsContact O-CD 3.24Å; D386-K390 WeakPolarHBondContact O-CD 3.46Å; D386-K390 WeakPolarHBondContact O-CG 3.25Å |
| 387 | F | 76.3 | Confident | 69.2 | Low | 126 Ų | 126 | 111 Ų | 111 | 55% | 0.553 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -89.4 | -43 | 172.5 | -175.9 | -92.8 | 0 | 0 | 0 | 111.4 | M384 D385 K390 F391 | M384-F387 PolarHBondContact O-N 3Å; D385-F387 PolarHBondContact O-N 3.14Å; F387-K390 PolarHBondContact O-N 2.82Å; F387-F391 HydrophobicContact CE2-CE2 4.32Å; F387-F391 HydrophobicContact CZ-CE2 4.14Å |
| 388 | E | 73 | Confident | 71.2 | Confident | 95 Ų | 95 | 113.8 Ų | 113.8 | 44% | 0.444 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -69 | -44.5 | -177.6 | -68.1 | 171.8 | -146.5 | 0 | 0 | 111.1 | M384 D385 K390 F391 | M384-E388 VanDerWaalsContact CG-OE1 3.23Å; M384-E388 WeakPolarHBondContact CG-OE1 3.24Å; M384-E388 PolarHBondContact O-N 3.41Å; D385-E388 PolarHBondContact O-N 2.72Å; E388-K390 PolarHBondContact O-N 3.35Å; E388-K390 VanDerWaalsContact O-N 3.14Å; E388-F391 CarbonylContact O-C 3.53Å; E388-F391 PolarHBondContact O-N 3.28Å; E388-F391 VanDerWaalsContact O-N 3.08Å |
| 389 | S | 73.1 | Confident | 72.9 | Confident | 88 Ų | 88 | 112.8 Ų | 112.8 | 62% | 0.615 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | -19.2 | 176.4 | 61.3 | 0 | 0 | 0 | 0 | 115.2 | D385 F391 | D385-S389 WeakPolarHBondContact O-CB 3.12Å; D385-S389 PolarHBondContact O-N 2.75Å; D385-S389 PolarHBondContact O-OG 2.89Å; S389-F391 VanDerWaalsContact C-N 3.27Å; S389-F391 PolarHBondContact O-N 3.33Å |
| 390 | K | 79.1 | Confident | 74.6 | Confident | 137 Ų | 137 | 113.4 Ų | 113.4 | 60% | 0.596 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.9 | -9.9 | 175.3 | -75.3 | 173.5 | 53.5 | -78.3 | 0 | 113.9 | D386 F387 E388 | D386-K390 VanDerWaalsContact O-CD 3.24Å; D386-K390 WeakPolarHBondContact O-CD 3.46Å; D386-K390 WeakPolarHBondContact O-CG 3.25Å; F387-K390 PolarHBondContact O-N 2.82Å; E388-K390 PolarHBondContact O-N 3.35Å; E388-K390 VanDerWaalsContact O-N 3.14Å |
| 391 | F | 77.9 | Confident | 76.4 | Confident | 104 Ų | 104 | 115.4 Ų | 115.4 | 46% | 0.456 | 60% | 0.596 | S | S | . | * | S | Bend | trans | -135.6 | 113.6 | 179.9 | -67.1 | -76.3 | 0 | 0 | 0 | 108 | F387 E388 S389 F393 | F387-F391 HydrophobicContact CE2-CE2 4.32Å; F387-F391 HydrophobicContact CZ-CE2 4.14Å; E388-F391 CarbonylContact O-C 3.53Å; E388-F391 PolarHBondContact O-N 3.28Å; E388-F391 VanDerWaalsContact O-N 3.08Å; S389-F391 VanDerWaalsContact C-N 3.27Å; S389-F391 PolarHBondContact O-N 3.33Å; F391-F393 HydrophobicContact CB-CD2 3.9Å; F391-F393 HydrophobicContact CB-CE2 3.49Å; F391-F393 VanDerWaalsContact CB-CE2 3.49Å; F391-F393 HydrophobicContact CB-CZ 3.92Å; F391-F393 HydrophobicContact CD2-CE2 4.44Å; F391-F393 HydrophobicContact CG-CE2 4.29Å; F391-F393 HydrophobicContact CG-CZ 4.43Å; F391-F393 VanDerWaalsContact O-CD2 3.25Å; F391-F393 WeakPolarHBondContact O-CD2 3.48Å; F391-F393 PolarHBondContact O-N 2.69Å |
| 392 | N | 82.8 | Confident | 77.9 | Confident | 154 Ų | 154 | 113.7 Ų | 113.7 | 82% | 0.824 | 60% | 0.601 | S | S | * | * | | | trans | -71.4 | 77.3 | 178.8 | -168.2 | 105.1 | 0 | 0 | 0 | 110.3 | | |
| 393 | F | 82.6 | Confident | 79.4 | Confident | 138 Ų | 138 | 120.2 Ų | 120.2 | 61% | 0.605 | 63% | 0.625 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 134.8 | 173.9 | -71.1 | -73.9 | 0 | 0 | 0 | 109.8 | F391 | F391-F393 HydrophobicContact CB-CD2 3.9Å; F391-F393 HydrophobicContact CB-CE2 3.49Å; F391-F393 VanDerWaalsContact CB-CE2 3.49Å; F391-F393 HydrophobicContact CB-CZ 3.92Å; F391-F393 HydrophobicContact CD2-CE2 4.44Å; F391-F393 HydrophobicContact CG-CE2 4.29Å; F391-F393 HydrophobicContact CG-CZ 4.43Å; F391-F393 VanDerWaalsContact O-CD2 3.25Å; F391-F393 WeakPolarHBondContact O-CD2 3.48Å; F391-F393 PolarHBondContact O-N 2.69Å |
| 394 | H | 85.8 | Confident | 80.9 | Confident | 122 Ų | 122 | 120.2 Ų | 120.2 | 57% | 0.565 | 62% | 0.622 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 136.8 | 164.8 | -68.9 | -101.4 | 0 | 0 | 0 | 108.4 | D398 | H394-D398 HydrophobicContact CB-CB 4.39Å; H394-D398 IonicContact CE1-OD2 3.76Å; H394-D398 IonicContact CG-OD2 3.57Å; H394-D398 IonicContact ND1-OD2 2.71Å; H394-D398 PolarHBondContact ND1-OD2 3.3Å |
| 395 | P | 85.4 | Confident | 82.3 | Confident | 77 Ų | 77 | 121.7 Ų | 121.7 | 50% | 0.5 | 63% | 0.626 | S | S | . | * | P | Polyproline II helix | trans | -64.4 | 157.4 | 177 | 30.2 | -35.5 | 0 | 0 | 0 | 110 | E397 D398 | P395-E397 WeakPolarHBondContact CB-OE2 3.1Å; P395-E397 PolarHBondContact O-N 3.09Å; P395-E397 VanDerWaalsContact O-N 3.12Å; P395-D398 HydrophobicContact CG-CB 3.84Å; P395-D398 PolarHBondContact O-N 3Å |
| 396 | I | 79.7 | Confident | 83.2 | Confident | 129 Ų | 129 | 125.8 Ų | 125.8 | 66% | 0.662 | 63% | 0.634 | S | S | * | * | G | 310 helix | trans | -64.2 | -22.4 | -174.5 | -169.8 | 165.8 | 0 | 0 | 0 | 112.3 | D398 L399 | I396-D398 VanDerWaalsContact C-N 3.34Å; I396-L399 HydrophobicContact CG1-CD1 4.28Å; I396-L399 PolarHBondContact O-N 3.27Å |
| 397 | E | 85.3 | Confident | 83.6 | Confident | 158 Ų | 158 | 126.8 Ų | 126.8 | 74% | 0.738 | 65% | 0.645 | S | S | * | * | G | 310 helix | trans | -73.1 | -18.5 | 174.2 | -60.8 | 76.6 | -170.4 | 0 | 0 | 114.1 | P395 | P395-E397 WeakPolarHBondContact CB-OE2 3.1Å; P395-E397 PolarHBondContact O-N 3.09Å; P395-E397 VanDerWaalsContact O-N 3.12Å |
| 398 | D | 90.4 | Very high | 83.7 | Confident | 98 Ų | 98 | 124.6 Ų | 124.6 | 52% | 0.524 | 65% | 0.646 | S | S | . | * | G | 310 helix | trans | -96.7 | -1.6 | 176.2 | -169 | 44.4 | 0 | 0 | 0 | 111.9 | H394 P395 I396 | H394-D398 HydrophobicContact CB-CB 4.39Å; H394-D398 IonicContact CE1-OD2 3.76Å; H394-D398 IonicContact CG-OD2 3.57Å; H394-D398 IonicContact ND1-OD2 2.71Å; H394-D398 PolarHBondContact ND1-OD2 3.3Å; P395-D398 HydrophobicContact CG-CB 3.84Å; P395-D398 PolarHBondContact O-N 3Å; I396-D398 VanDerWaalsContact C-N 3.34Å |
| 399 | L | 87.4 | Confident | 84.1 | Confident | 102 Ų | 102 | 127.8 Ų | 127.8 | 53% | 0.534 | 67% | 0.666 | S | S | . | * | S | Bend | trans | -78.2 | 138 | 167.7 | -57.8 | -176.5 | 0 | 0 | 0 | 109.6 | I396 | I396-L399 HydrophobicContact CG1-CD1 4.28Å; I396-L399 PolarHBondContact O-N 3.27Å |
| 400 | P | 88.9 | Confident | 84.5 | Confident | 107 Ų | 107 | 131.4 Ų | 131.4 | 70% | 0.695 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 144.8 | 174.9 | 26.5 | -34.3 | 0 | 0 | 0 | 110.3 | | |
| 401 | P | 88.2 | Confident | 84.5 | Confident | 119 Ų | 119 | 130.3 Ų | 130.3 | 77% | 0.773 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 133.9 | 174.8 | -28.3 | 35.4 | 0 | 0 | 0 | 111.2 | E403 | P401-E403 PolarHBondContact O-N 3.28Š|
| 402 | P | 86.5 | Confident | 84.4 | Confident | 125 Ų | 125 | 131 Ų | 131 | 81% | 0.812 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 132.7 | -178.6 | -27.5 | 34.8 | 0 | 0 | 0 | 111.8 | E404 | P402-E404 PolarHBondContact O-N 2.81Š|
| 403 | E | 86.9 | Confident | 83.8 | Confident | 192 Ų | 192 | 129.5 Ų | 129.5 | 90% | 0.897 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 129.5 | 177.2 | -67.6 | -174.6 | 174.5 | 0 | 0 | 110.5 | P401 F405 | P401-E403 PolarHBondContact O-N 3.28Å; E403-F405 PolarHBondContact O-N 2.97Å |
| 404 | E | 88.7 | Confident | 83 | Confident | 140 Ų | 140 | 127.9 Ų | 127.9 | 65% | 0.654 | 68% | 0.676 | S | S | * | * | P | Polyproline II helix | trans | -53 | 134.4 | 174 | -65.1 | -176.7 | 153.2 | 0 | 0 | 110 | P402 R406 | P402-E404 PolarHBondContact O-N 2.81Å; E404-R406 PolarHBondContact O-N 2.88Å; E404-R406 IonicContact OE2-CZ 3.56Å; E404-R406 IonicContact OE2-NE 3.64Å; E404-R406 IonicContact OE2-NH2 2.69Å; E404-R406 PolarHBondContact OE2-NH2 2.85Å |
| 405 | F | 87.6 | Confident | 81.9 | Confident | 160 Ų | 160 | 130 Ų | 130 | 70% | 0.702 | 68% | 0.683 | S | S | * | * | | | trans | -63.9 | 95.1 | 178.6 | 176.1 | -104 | 0 | 0 | 0 | 111.1 | E403 P407 | E403-F405 PolarHBondContact O-N 2.97Å; F405-P407 HydrophobicContact CD1-CG 4.34Å; F405-P407 HydrophobicContact CE1-CB 4.25Å; F405-P407 HydrophobicContact CE1-CG 3.95Å; F405-P407 WeakPolarHBondContact O-CD 3.36Å |
| 406 | R | 85.9 | Confident | 80.9 | Confident | 180 Ų | 180 | 129.8 Ų | 129.8 | 68% | 0.679 | 68% | 0.684 | S | S | * | * | | | trans | -81 | 118.3 | 170.5 | -66.9 | -72.5 | 159.2 | 164.7 | -7 | 108.6 | E404 S408 | E404-R406 PolarHBondContact O-N 2.88Å; E404-R406 IonicContact OE2-CZ 3.56Å; E404-R406 IonicContact OE2-NE 3.64Å; E404-R406 IonicContact OE2-NH2 2.69Å; E404-R406 PolarHBondContact OE2-NH2 2.85Å; R406-S408 PolarHBondContact O-N 2.71Å |
| 407 | P | 84.4 | Confident | 79.8 | Confident | 111 Ų | 111 | 130.1 Ų | 130.1 | 72% | 0.721 | 69% | 0.687 | S | S | * | * | | | trans | -66.7 | 91.6 | 178.4 | -20.6 | 34 | 0 | 0 | 0 | 111.2 | F405 | F405-P407 HydrophobicContact CD1-CG 4.34Å; F405-P407 HydrophobicContact CE1-CB 4.25Å; F405-P407 HydrophobicContact CE1-CG 3.95Å; F405-P407 WeakPolarHBondContact O-CD 3.36Å |
| 408 | S | 79 | Confident | 78.5 | Confident | 81 Ų | 81 | 134.1 Ų | 134.1 | 57% | 0.566 | 70% | 0.695 | S | S | * | * | | | trans | -82.4 | 137.2 | 175.3 | 49.1 | 0 | 0 | 0 | 0 | 110.9 | R406 R410 | R406-S408 PolarHBondContact O-N 2.71Å; S408-R410 PolarHBondContact O-N 3.17Å |
| 409 | N | 80.9 | Confident | 77 | Confident | 161 Ų | 161 | 132 Ų | 132 | 86% | 0.861 | 70% | 0.697 | S | S | * | * | | | trans | -67.3 | 94.7 | 171.4 | -85.7 | -38.1 | 0 | 0 | 0 | 109.4 | T411 | N409-T411 VanDerWaalsContact C-N 3.27Å; N409-T411 PolarHBondContact O-N 3.04Å |
| 410 | R | 81.1 | Confident | 75.6 | Confident | 164 Ų | 164 | 133.4 Ų | 133.4 | 62% | 0.619 | 71% | 0.709 | S | S | * | * | | | trans | -70.6 | 82.6 | 176.6 | -66.8 | -176.5 | 179.7 | 173 | -1.6 | 110.4 | S408 Y412 | S408-R410 PolarHBondContact O-N 3.17Å; R410-Y412 HydrophobicContact CB-CD2 4.14Å; R410-Y412 HydrophobicContact CB-CE2 3.62Å; R410-Y412 WeakPolarHBondContact CD-OH 3.47Å; R410-Y412 WeakPolarHBondContact O-CD2 3.5Å; R410-Y412 PolarHBondContact O-N 3.12Å |
| 411 | T | 78.2 | Confident | 74.2 | Confident | 115 Ų | 115 | 136.8 Ų | 136.8 | 71% | 0.706 | 72% | 0.718 | S | S | * | * | | | trans | -69.4 | 82.8 | 167.9 | -55.8 | 0 | 0 | 0 | 0 | 109.1 | N409 | N409-T411 VanDerWaalsContact C-N 3.27Å; N409-T411 PolarHBondContact O-N 3.04Å |
| 412 | Y | 76.4 | Confident | 72.7 | Confident | 118 Ų | 118 | 142.9 Ų | 142.9 | 46% | 0.463 | 73% | 0.725 | S | S | . | * | | | trans | -59.1 | 137.9 | 170.9 | -68.4 | -84.9 | 0 | 0 | 0 | 109.6 | R410 S414 K415 | R410-Y412 HydrophobicContact CB-CD2 4.14Å; R410-Y412 HydrophobicContact CB-CE2 3.62Å; R410-Y412 WeakPolarHBondContact CD-OH 3.47Å; R410-Y412 WeakPolarHBondContact O-CD2 3.5Å; R410-Y412 PolarHBondContact O-N 3.12Å; Y412-S414 PolarHBondContact O-N 3.49Å; Y412-K415 WeakPolarHBondContact O-CA 3.48Å; Y412-K415 PolarHBondContact O-N 3.12Å |
| 413 | P | 70.4 | Confident | 71.7 | Confident | 122 Ų | 122 | 139.7 Ų | 139.7 | 79% | 0.792 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.7 | -12.4 | 176.2 | -27.3 | 35.9 | 0 | 0 | 0 | 115.2 | S416 | P413-S416 PolarHBondContact O-OG 3.5Å; P413-S416 VanDerWaalsContact O-OG 3.12Å |
| 414 | S | 66.5 | Low | 70.7 | Confident | 105 Ų | 105 | 135.1 Ų | 135.1 | 73% | 0.734 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87 | -4.8 | 171.6 | 55 | 0 | 0 | 0 | 0 | 114.4 | Y412 | Y412-S414 PolarHBondContact O-N 3.49Š|
| 415 | K | 62.3 | Low | 69.6 | Low | 165 Ų | 165 | 134 Ų | 134 | 72% | 0.717 | 72% | 0.715 | S | S | * | * | | | trans | -117.3 | 6.2 | 179.6 | -76.1 | -162.7 | 172.2 | -168 | 0 | 113.8 | Y412 D417 | Y412-K415 WeakPolarHBondContact O-CA 3.48Å; Y412-K415 PolarHBondContact O-N 3.12Å; K415-D417 PolarHBondContact O-N 3.11Å |
| 416 | S | 63.5 | Low | 68.9 | Low | 74 Ų | 74 | 132.4 Ų | 132.4 | 52% | 0.517 | 72% | 0.721 | S | S | . | * | S | Bend | trans | -59.6 | 124.4 | 157.4 | 40.8 | 0 | 0 | 0 | 0 | 107.9 | P413 R418 | P413-S416 PolarHBondContact O-OG 3.5Å; P413-S416 VanDerWaalsContact O-OG 3.12Å; S416-R418 PolarHBondContact O-N 3.35Å |
| 417 | D | 57.2 | Low | 68.1 | Low | 135 Ų | 135 | 128.1 Ų | 128.1 | 72% | 0.722 | 72% | 0.724 | S | S | * | * | | | trans | -62.4 | 138.9 | 179.3 | -178.3 | 31.3 | 0 | 0 | 0 | 110 | K415 G419 | K415-D417 PolarHBondContact O-N 3.11Å; D417-G419 PolarHBondContact O-N 2.93Å; D417-G419 VanDerWaalsContact O-N 3.12Å |
| 418 | R | 58.2 | Low | 67.5 | Low | 243 Ų | 243 | 128.1 Ų | 128.1 | 92% | 0.917 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.5 | 17.9 | -178 | -59.4 | -175 | -172.9 | 172 | 2 | 112.2 | S416 | S416-R418 PolarHBondContact O-N 3.35Š|
| 419 | G | 58.9 | Low | 67.3 | Low | 54 Ų | 54 | 130.4 Ų | 130.4 | 56% | 0.557 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.3 | -10.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | D417 M421 | D417-G419 PolarHBondContact O-N 2.93Å; D417-G419 VanDerWaalsContact O-N 3.12Å; G419-M421 PolarHBondContact O-N 3.48Å |
| 420 | V | 57 | Low | 66.7 | Low | 130 Ų | 130 | 129.3 Ų | 129.3 | 79% | 0.788 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -80.7 | 113.4 | 174.3 | -171.6 | 0 | 0 | 0 | 0 | 109.7 | R422 | V420-R422 PolarHBondContact O-N 2.95Š|
| 421 | M | 60.6 | Low | 66.1 | Low | 179 Ų | 179 | 124.9 Ų | 124.9 | 88% | 0.882 | 74% | 0.742 | S | S | * | * | | | trans | -52.5 | 102.6 | 175.6 | -70.3 | -70.7 | -173.9 | 0 | 0 | 111.2 | G419 G423 | G419-M421 PolarHBondContact O-N 3.48Å; M421-G423 VanDerWaalsContact C-N 3.3Å; M421-G423 PolarHBondContact O-N 3.3Å |
| 422 | R | 57.2 | Low | 65.3 | Low | 246 Ų | 246 | 134.9 Ų | 134.9 | 93% | 0.928 | 77% | 0.766 | S | S | * | * | | | trans | -73 | 91.8 | 166.2 | -167.1 | 179.9 | -168.3 | -162.4 | 3.1 | 107.3 | V420 | V420-R422 PolarHBondContact O-N 2.95Š|
| 423 | G | 65 | Low | 64.7 | Low | 59 Ų | 59 | 135.7 Ų | 135.7 | 61% | 0.608 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 153 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | M421 | M421-G423 VanDerWaalsContact C-N 3.3Å; M421-G423 PolarHBondContact O-N 3.3Å |
| 424 | A | 65.9 | Low | 64.4 | Low | 95 Ų | 95 | 136.4 Ų | 136.4 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -52 | 139.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | | |
| 425 | P | 64.8 | Low | 64.3 | Low | 117 Ų | 117 | 138.2 Ų | 138.2 | 76% | 0.76 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 143.8 | 179.3 | 26.1 | -34.4 | 0 | 0 | 0 | 110.2 | A427 | P425-A427 PolarHBondContact O-N 3.11Š|
| 426 | P | 73.6 | Confident | 64.4 | Low | 127 Ų | 127 | 136.6 Ų | 136.6 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 140.2 | -179.5 | 25.5 | -34.3 | 0 | 0 | 0 | 110.5 | | |
| 427 | A | 69.6 | Low | 64.5 | Low | 90 Ų | 90 | 140.5 Ų | 140.5 | 74% | 0.744 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -61 | 144.8 | 179 | 0 | 0 | 0 | 0 | 0 | 111 | P425 | P425-A427 PolarHBondContact O-N 3.11Š|
| 428 | P | 71.3 | Confident | 65 | Low | 111 Ų | 111 | 140.9 Ų | 140.9 | 72% | 0.721 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 149 | 176 | 27.8 | -34.9 | 0 | 0 | 0 | 110.8 | V430 | P428-V430 PolarHBondContact O-N 2.76Š|
| 429 | P | 74 | Confident | 65.5 | Low | 129 Ų | 129 | 133.6 Ų | 133.6 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 125.9 | 179.2 | 26.8 | -34.1 | 0 | 0 | 0 | 110.6 | | |
| 430 | V | 69.9 | Low | 66 | Low | 138 Ų | 138 | 139.7 Ų | 139.7 | 84% | 0.836 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 126.4 | 172.3 | -175.3 | 0 | 0 | 0 | 0 | 108.2 | P428 | P428-V430 PolarHBondContact O-N 2.76Š|
| 431 | G | 67.8 | Low | 66.7 | Low | 71 Ų | 71 | 140.5 Ų | 140.5 | 73% | 0.732 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 153.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 432 | R | 60.9 | Low | 67.3 | Low | 324 Ų | 324 | 137 Ų | 137 | 100% | 1.223 | 82% | 0.818 | S | S | * | * | | | trans | -117.3 | 0 | 166.2 | -74.1 | -174.2 | 172.8 | -164.8 | -2 | 108.7 | | |