| 1 | M | 66.6 | Low | 64.9 | Low | 240 Ų | 240 | 165.3 Ų | 165.3 | 100% | 1.182 | 85% | 0.847 | S | S | * | * | | | | 0 | 130 | 0 | -80.8 | 144.1 | 169.5 | 0 | 0 | 108.4 | C3 | M1-C3 PolarHBondContact O-N 2.6Š|
| 2 | L | 67.3 | Low | 64.5 | Low | 166 Ų | 166 | 166.9 Ų | 166.9 | 87% | 0.869 | 85% | 0.848 | S | S | * | * | | | trans | -85.9 | 107.9 | -176 | -173.5 | 66.4 | 0 | 0 | 0 | 109.4 | C4 | L2-C4 PolarHBondContact O-N 2.64Å; L2-C4 VanDerWaalsContact O-N 3.07Å |
| 3 | C | 63.5 | Low | 63.5 | Low | 113 Ų | 113 | 166.8 Ų | 166.8 | 76% | 0.764 | 84% | 0.838 | S | S | * | * | | | trans | -65 | 110.3 | 180 | -64.5 | 0 | 0 | 0 | 0 | 110.2 | M1 I5 | M1-C3 PolarHBondContact O-N 2.6Å; C3-I5 PolarHBondContact O-N 3.36Å |
| 4 | C | 66.3 | Low | 62.8 | Low | 113 Ų | 113 | 164.6 Ų | 164.6 | 76% | 0.764 | 83% | 0.83 | S | S | * | * | | | trans | -72.1 | 91.2 | -176.5 | -67.2 | 0 | 0 | 0 | 0 | 111 | L2 R6 | L2-C4 PolarHBondContact O-N 2.64Å; L2-C4 VanDerWaalsContact O-N 3.07Å; C4-R6 PolarHBondContact O-N 3.16Å |
| 5 | I | 69.3 | Low | 62.4 | Low | 151 Ų | 151 | 164.6 Ų | 164.6 | 77% | 0.774 | 83% | 0.826 | S | S | * | * | | | trans | -65.6 | 94.2 | 171.5 | -57.9 | 172.7 | 0 | 0 | 0 | 108.5 | C3 R7 | C3-I5 PolarHBondContact O-N 3.36Å; I5-R7 PolarHBondContact O-N 3.18Å |
| 6 | R | 69.4 | Low | 61.8 | Low | 227 Ų | 227 | 161.4 Ų | 161.4 | 86% | 0.857 | 81% | 0.813 | S | S | * | * | | | trans | -68.9 | 101.2 | 170.7 | -64.5 | -176.9 | 86 | 145.9 | 2.6 | 107.8 | C4 T8 | C4-R6 PolarHBondContact O-N 3.16Å; R6-T8 VanDerWaalsContact C-N 3.34Å; R6-T8 PolarHBondContact O-N 3.32Å |
| 7 | R | 65.7 | Low | 61.2 | Low | 234 Ų | 234 | 157.8 Ų | 157.8 | 88% | 0.883 | 81% | 0.813 | S | S | * | * | | | trans | -61.8 | 94.3 | 169.4 | -71.1 | -179.2 | 174 | 104.9 | -3.1 | 109.4 | I5 | I5-R7 PolarHBondContact O-N 3.18Š|
| 8 | T | 65.8 | Low | 60.7 | Low | 128 Ų | 128 | 156.8 Ų | 156.8 | 79% | 0.785 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -65 | 131.5 | 163.9 | 46.1 | 0 | 0 | 0 | 0 | 108.3 | R6 | R6-T8 VanDerWaalsContact C-N 3.34Å; R6-T8 PolarHBondContact O-N 3.32Å |
| 9 | K | 70.6 | Confident | 60.3 | Low | 187 Ų | 187 | 156.6 Ų | 156.6 | 81% | 0.813 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 147.9 | 174.6 | -90.5 | 101.3 | 169.9 | -171.6 | 0 | 109.7 | V11 | K9-V11 PolarHBondContact O-N 3.19Š|
| 10 | P | 56.7 | Low | 59.7 | Low | 123 Ų | 123 | 155.2 Ų | 155.2 | 80% | 0.799 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 125.6 | 161.4 | 27.9 | -32.3 | 0 | 0 | 0 | 107.8 | E12 | P10-E12 PolarHBondContact O-N 3.45Š|
| 11 | V | 52.8 | Low | 59.5 | Low | 136 Ų | 136 | 155.6 Ų | 155.6 | 82% | 0.824 | 80% | 0.795 | S | S | * | * | | | trans | -66.7 | 114.6 | 164.3 | 163.7 | 0 | 0 | 0 | 0 | 106.3 | K9 K13 | K9-V11 PolarHBondContact O-N 3.19Å; V11-K13 PolarHBondContact O-N 3.48Å |
| 12 | E | 60.1 | Low | 58.8 | Low | 185 Ų | 185 | 149.9 Ų | 149.9 | 86% | 0.864 | 77% | 0.765 | S | S | * | * | | | trans | -53.7 | 120.8 | 169 | -161.5 | 167.9 | 168.7 | 0 | 0 | 107.8 | P10 N14 | P10-E12 PolarHBondContact O-N 3.45Å; E12-N14 PolarHBondContact O-N 2.64Å |
| 13 | K | 52 | Low | 58.2 | Low | 166 Ų | 166 | 151.2 Ų | 151.2 | 72% | 0.722 | 77% | 0.767 | S | S | * | * | | | trans | -67.1 | 112.3 | -176.6 | -72.1 | 177.5 | 174.5 | -179.8 | 0 | 108.4 | V11 E15 | V11-K13 PolarHBondContact O-N 3.48Å; K13-E15 HydrophobicContact CB-CG 3.85Å; K13-E15 PolarHBondContact O-N 3.15Å; K13-E15 VanDerWaalsContact O-N 3.14Å |
| 14 | N | 52.9 | Low | 57.5 | Low | 135 Ų | 135 | 152.9 Ų | 152.9 | 72% | 0.722 | 77% | 0.768 | S | S | * | * | | | trans | -80.9 | 88.8 | 168.6 | -165.2 | -62.1 | 0 | 0 | 0 | 107.2 | E12 D16 | E12-N14 PolarHBondContact O-N 2.64Å; N14-D16 PolarHBondContact O-N 3.31Å; N14-D16 VanDerWaalsContact O-N 3.08Å; N14-D16 WeakPolarHBondContact OD1-CB 3.04Å |
| 15 | E | 57.3 | Low | 57.2 | Low | 165 Ų | 165 | 150.1 Ų | 150.1 | 77% | 0.771 | 76% | 0.759 | S | S | * | * | | | trans | -79.6 | 31.1 | -176.4 | -65 | -179.6 | 120.9 | 0 | 0 | 112.6 | K13 | K13-E15 HydrophobicContact CB-CG 3.85Å; K13-E15 PolarHBondContact O-N 3.15Å; K13-E15 VanDerWaalsContact O-N 3.14Å |
| 16 | D | 52.8 | Low | 56.3 | Low | 114 Ų | 114 | 148.4 Ų | 148.4 | 61% | 0.61 | 76% | 0.756 | S | S | * | * | | | trans | -104.4 | 11.1 | -176.4 | -118.6 | -69 | 0 | 0 | 0 | 113 | N14 | N14-D16 PolarHBondContact O-N 3.31Å; N14-D16 VanDerWaalsContact O-N 3.08Å; N14-D16 WeakPolarHBondContact OD1-CB 3.04Å |
| 17 | A | 51.5 | Low | 56 | Low | 100 Ų | 100 | 142.7 Ų | 142.7 | 83% | 0.826 | 75% | 0.748 | S | S | * | * | | | trans | -87.8 | -12 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q19 | A17-Q19 PolarHBondContact O-N 3.25Š|
| 18 | D | 52.5 | Low | 55.5 | Low | 139 Ų | 139 | 138.5 Ų | 138.5 | 74% | 0.743 | 74% | 0.743 | S | S | * | * | | | trans | -90.5 | 58.3 | 166.4 | -146.3 | -71.4 | 0 | 0 | 0 | 109.4 | K20 | D18-K20 PolarHBondContact O-N 2.81Š|
| 19 | Q | 53.6 | Low | 55.4 | Low | 154 Ų | 154 | 138.3 Ų | 138.3 | 72% | 0.72 | 73% | 0.732 | S | S | * | * | | | trans | -69.1 | 74.6 | 155.6 | -79.9 | 179.9 | 40.2 | 0 | 0 | 107.7 | A17 I21 | A17-Q19 PolarHBondContact O-N 3.25Å; Q19-I21 PolarHBondContact O-N 3.43Å |
| 20 | K | 48.3 | Very low | 55.1 | Low | 127 Ų | 127 | 134.3 Ų | 134.3 | 55% | 0.552 | 73% | 0.725 | S | S | * | * | | | trans | -31.5 | 125.2 | 157.4 | -171.6 | -177.9 | 178.7 | -151 | 0 | 107.6 | D18 E22 | D18-K20 PolarHBondContact O-N 2.81Å; K20-E22 HydrophobicContact CB-CG 4.22Å; K20-E22 HydrophobicContact CD-CG 3.73Å; K20-E22 WeakPolarHBondContact CE-OE1 3.42Å; K20-E22 HydrophobicContact CG-CG 3.89Å; K20-E22 IonicContact NZ-OE1 2.87Å; K20-E22 PolarHBondContact NZ-OE1 3.5Å; K20-E22 IonicContact NZ-OE2 2.72Å; K20-E22 PolarHBondContact NZ-OE2 3.38Å; K20-E22 PolarHBondContact O-N 2.99Å |
| 21 | I | 55.5 | Low | 55.9 | Low | 165 Ų | 165 | 133.7 Ų | 133.7 | 85% | 0.846 | 71% | 0.711 | S | S | * | * | | | trans | -74.1 | 64 | 173.6 | -62.8 | 162.5 | 0 | 0 | 0 | 106.8 | Q19 Q23 | Q19-I21 PolarHBondContact O-N 3.43Å; I21-Q23 PolarHBondContact O-N 2.68Å; I21-Q23 VanDerWaalsContact O-N 3.08Å |
| 22 | E | 51.1 | Low | 57.2 | Low | 119 Ų | 119 | 129.7 Ų | 129.7 | 56% | 0.556 | 69% | 0.685 | S | S | * | * | | | trans | -61.8 | 107.3 | 161.1 | -67 | -71.8 | 67.8 | 0 | 0 | 105 | K20 D24 | K20-E22 HydrophobicContact CB-CG 4.22Å; K20-E22 HydrophobicContact CD-CG 3.73Å; K20-E22 WeakPolarHBondContact CE-OE1 3.42Å; K20-E22 HydrophobicContact CG-CG 3.89Å; K20-E22 IonicContact NZ-OE1 2.87Å; K20-E22 PolarHBondContact NZ-OE1 3.5Å; K20-E22 IonicContact NZ-OE2 2.72Å; K20-E22 PolarHBondContact NZ-OE2 3.38Å; K20-E22 PolarHBondContact O-N 2.99Å; E22-D24 PolarHBondContact O-N 3.49Å |
| 23 | Q | 54.6 | Low | 58.5 | Low | 195 Ų | 195 | 128.4 Ų | 128.4 | 91% | 0.911 | 68% | 0.677 | S | S | * | * | | | trans | -73.5 | 51.1 | 173.7 | -171.5 | 177.4 | 80.9 | 0 | 0 | 109.6 | I21 | I21-Q23 PolarHBondContact O-N 2.68Å; I21-Q23 VanDerWaalsContact O-N 3.08Å |
| 24 | D | 48.8 | Very low | 60.4 | Low | 147 Ų | 147 | 123.4 Ų | 123.4 | 79% | 0.786 | 67% | 0.666 | S | S | * | * | | | trans | -117.9 | 147.9 | -177.6 | -144.1 | -68.7 | 0 | 0 | 0 | 111.5 | E22 | E22-D24 PolarHBondContact O-N 3.49Š|
| 25 | G | 60.8 | Low | 62.3 | Low | 56 Ų | 56 | 122.5 Ų | 122.5 | 58% | 0.577 | 66% | 0.657 | S | S | * | * | | | trans | -93.4 | 125.4 | -147 | 0 | 0 | 0 | 0 | 0 | 115.2 | P27 | G25-P27 VanDerWaalsContact O-CD 3.28Å; G25-P27 WeakPolarHBondContact O-CD 3.24Å |
| 26 | T | 50.4 | Low | 64 | Low | 114 Ų | 114 | 122.2 Ų | 122.2 | 70% | 0.699 | 65% | 0.653 | S | S | * | * | | | trans | -105.4 | 87.4 | 152.2 | 43 | 0 | 0 | 0 | 0 | 110 | N28 | T26-N28 PolarHBondContact O-N 3.04Š|
| 27 | P | 62.4 | Low | 66.1 | Low | 107 Ų | 107 | 119 Ų | 119 | 70% | 0.695 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.3 | 130.3 | 178.8 | 29.6 | -33.6 | 0 | 0 | 0 | 110.8 | G25 | G25-P27 VanDerWaalsContact O-CD 3.28Å; G25-P27 WeakPolarHBondContact O-CD 3.24Å |
| 28 | N | 54.8 | Low | 68.2 | Low | 146 Ų | 146 | 116.2 Ų | 116.2 | 78% | 0.781 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 95.2 | 39.9 | 172.6 | -52.1 | -75.1 | 0 | 0 | 0 | 118.1 | T26 | T26-N28 PolarHBondContact O-N 3.04Š|
| 29 | K | 63.3 | Low | 70.3 | Confident | 125 Ų | 125 | 113.8 Ų | 113.8 | 54% | 0.543 | 61% | 0.61 | S | S | . | * | | | trans | -93.5 | 133.1 | 140.9 | -148.9 | 72.9 | 174.7 | -165.6 | 0 | 109.2 | E31 D32 | K29-E31 WeakPolarHBondContact CE-OE2 3.29Å; K29-E31 HydrophobicContact CG-CB 4.06Å; K29-E31 HydrophobicContact CG-CG 4.38Å; K29-E31 WeakPolarHBondContact CG-OE2 2.97Å; K29-E31 PolarHBondContact O-N 3.39Å; K29-D32 WeakPolarHBondContact CB-OD2 3.33Å; K29-D32 PolarHBondContact O-N 2.84Å |
| 30 | P | 65.9 | Low | 72.4 | Confident | 103 Ų | 103 | 114 Ų | 114 | 67% | 0.669 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -63.5 | -23.9 | 175.3 | 24.6 | -33.3 | 0 | 0 | 0 | 112.3 | D32 K33 A34 | P30-D32 VanDerWaalsContact C-N 3.29Å; P30-D32 PolarHBondContact O-N 2.91Å; P30-K33 PolarHBondContact O-N 3.44Å; P30-A34 PolarHBondContact O-N 2.97Å |
| 31 | E | 72.9 | Confident | 74.8 | Confident | 109 Ų | 109 | 113.7 Ų | 113.7 | 51% | 0.509 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -56.5 | -38.2 | 174 | -71.8 | 163.7 | 130.5 | 0 | 0 | 112.1 | K29 K33 A34 H35 | K29-E31 WeakPolarHBondContact CE-OE2 3.29Å; K29-E31 HydrophobicContact CG-CB 4.06Å; K29-E31 HydrophobicContact CG-CG 4.38Å; K29-E31 WeakPolarHBondContact CG-OE2 2.97Å; K29-E31 PolarHBondContact O-N 3.39Å; E31-K33 VanDerWaalsContact C-N 3.25Å; E31-K33 PolarHBondContact O-N 3.4Å; E31-A34 CarbonylContact O-C 3.58Å; E31-A34 WeakPolarHBondContact O-CA 3.38Å; E31-A34 WeakPolarHBondContact O-CB 3.3Å; E31-A34 PolarHBondContact O-N 3.41Å; E31-H35 PolarHBondContact O-CD2 3.46Å; E31-H35 PolarHBondContact O-N 2.9Å |
| 32 | D | 80.6 | Confident | 76.8 | Confident | 52 Ų | 52 | 110.3 Ų | 110.3 | 28% | 0.278 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -61.8 | -32.9 | 179.4 | -61.3 | -54.2 | 0 | 0 | 0 | 113.2 | K29 P30 K36 | K29-D32 WeakPolarHBondContact CB-OD2 3.33Å; K29-D32 PolarHBondContact O-N 2.84Å; P30-D32 VanDerWaalsContact C-N 3.29Å; P30-D32 PolarHBondContact O-N 2.91Å; D32-K36 VanDerWaalsContact O-CB 3.27Å; D32-K36 WeakPolarHBondContact O-CB 3.34Å; D32-K36 WeakPolarHBondContact O-CD 3.47Å; D32-K36 WeakPolarHBondContact O-CG 3.48Å; D32-K36 PolarHBondContact O-N 2.83Å |
| 33 | K | 87.3 | Confident | 79 | Confident | 159 Ų | 159 | 107.5 Ų | 107.5 | 69% | 0.691 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -71.2 | -40.9 | 175.6 | -64.8 | -178.8 | -178.1 | 176.6 | 0 | 110.4 | P30 E31 A37 | P30-K33 PolarHBondContact O-N 3.44Å; E31-K33 VanDerWaalsContact C-N 3.25Å; E31-K33 PolarHBondContact O-N 3.4Å; K33-A37 VanDerWaalsContact O-CB 3.29Å; K33-A37 WeakPolarHBondContact O-CB 3.44Å; K33-A37 PolarHBondContact O-N 3.45Å |
| 34 | A | 91.1 | Very high | 81.1 | Confident | 60 Ų | 60 | 101.5 Ų | 101.5 | 50% | 0.496 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64.8 | -44.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | P30 E31 A37 A38 | P30-A34 PolarHBondContact O-N 2.97Å; E31-A34 CarbonylContact O-C 3.58Å; E31-A34 WeakPolarHBondContact O-CA 3.38Å; E31-A34 WeakPolarHBondContact O-CB 3.3Å; E31-A34 PolarHBondContact O-N 3.41Å; A34-A37 PolarHBondContact O-N 3Å; A34-A38 VanDerWaalsContact O-CB 3.28Å; A34-A38 WeakPolarHBondContact O-CB 3.39Å; A34-A38 PolarHBondContact O-N 3.03Å |
| 35 | H | 92.9 | Very high | 83.4 | Confident | 117 Ų | 117 | 100.6 Ų | 100.6 | 54% | 0.542 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.9 | -43.7 | 176.6 | -67.4 | -56.8 | 0 | 0 | 0 | 112.3 | E31 A37 A38 T39 | E31-H35 PolarHBondContact O-CD2 3.46Å; E31-H35 PolarHBondContact O-N 2.9Å; H35-A37 VanDerWaalsContact C-N 3.35Å; H35-A37 PolarHBondContact O-N 2.98Å; H35-A38 PolarHBondContact O-N 3.41Å; H35-T39 WeakPolarHBondContact O-CB 3.36Å; H35-T39 PolarHBondContact O-N 3.26Å; H35-T39 PolarHBondContact O-OG1 3.44Å; H35-T39 VanDerWaalsContact O-OG1 3.05Å |
| 36 | K | 93.7 | Very high | 85.1 | Confident | 158 Ų | 158 | 105.3 Ų | 105.3 | 69% | 0.687 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -61.8 | -40.9 | 174.5 | -74.4 | 169 | -176.9 | 175.2 | 0 | 112 | D32 K40 | D32-K36 VanDerWaalsContact O-CB 3.27Å; D32-K36 WeakPolarHBondContact O-CB 3.34Å; D32-K36 WeakPolarHBondContact O-CD 3.47Å; D32-K36 WeakPolarHBondContact O-CG 3.48Å; D32-K36 PolarHBondContact O-N 2.83Å; K36-K40 PolarHBondContact O-N 3.4Å; K36-K40 VanDerWaalsContact O-N 3.14Å |
| 37 | A | 95.8 | Very high | 87.4 | Confident | 48 Ų | 48 | 100.8 Ų | 100.8 | 40% | 0.397 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.1 | -47.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | K33 A34 H35 T39 K40 I41 | K33-A37 VanDerWaalsContact O-CB 3.29Å; K33-A37 WeakPolarHBondContact O-CB 3.44Å; K33-A37 PolarHBondContact O-N 3.45Å; A34-A37 PolarHBondContact O-N 3Å; H35-A37 VanDerWaalsContact C-N 3.35Å; H35-A37 PolarHBondContact O-N 2.98Å; A37-T39 PolarHBondContact O-N 3.23Å; A37-K40 WeakPolarHBondContact O-CB 3.34Å; A37-K40 PolarHBondContact O-N 2.85Å; A37-K40 VanDerWaalsContact O-N 3.13Å; A37-I41 WeakPolarHBondContact O-CG1 3.39Å; A37-I41 PolarHBondContact O-N 3.24Å |
| 38 | A | 95.9 | Very high | 89 | Confident | 40 Ų | 40 | 100.4 Ų | 100.4 | 33% | 0.331 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -58.7 | -45.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | A34 H35 K40 I41 Q42 | A34-A38 VanDerWaalsContact O-CB 3.28Å; A34-A38 WeakPolarHBondContact O-CB 3.39Å; A34-A38 PolarHBondContact O-N 3.03Å; H35-A38 PolarHBondContact O-N 3.41Å; A38-K40 VanDerWaalsContact C-N 3.33Å; A38-K40 PolarHBondContact O-N 2.84Å; A38-I41 PolarHBondContact O-N 3.31Å; A38-Q42 WeakPolarHBondContact O-CG 3.39Å; A38-Q42 PolarHBondContact O-N 2.93Å |
| 39 | T | 97.1 | Very high | 91 | Very high | 89 Ų | 89 | 96.2 Ų | 96.2 | 55% | 0.546 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.8 | -40.9 | 175.1 | -63.6 | 0 | 0 | 0 | 0 | 111.9 | H35 A37 Q42 A43 | H35-T39 WeakPolarHBondContact O-CB 3.36Å; H35-T39 PolarHBondContact O-N 3.26Å; H35-T39 PolarHBondContact O-OG1 3.44Å; H35-T39 VanDerWaalsContact O-OG1 3.05Å; A37-T39 PolarHBondContact O-N 3.23Å; T39-Q42 PolarHBondContact O-N 3.48Å; T39-A43 WeakPolarHBondContact O-CB 3.4Å; T39-A43 PolarHBondContact O-N 3.38Å |
| 40 | K | 97.6 | Very high | 92.6 | Very high | 158 Ų | 158 | 93.7 Ų | 93.7 | 69% | 0.687 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.1 | -40.1 | 176.2 | -171.9 | 174 | -178.4 | 177.4 | 0 | 112.6 | K36 A37 A38 S44 | K36-K40 PolarHBondContact O-N 3.4Å; K36-K40 VanDerWaalsContact O-N 3.14Å; A37-K40 WeakPolarHBondContact O-CB 3.34Å; A37-K40 PolarHBondContact O-N 2.85Å; A37-K40 VanDerWaalsContact O-N 3.13Å; A38-K40 VanDerWaalsContact C-N 3.33Å; A38-K40 PolarHBondContact O-N 2.84Å; K40-S44 WeakPolarHBondContact O-CB 3.41Å; K40-S44 PolarHBondContact O-N 2.82Å; K40-S44 PolarHBondContact O-OG 3.44Å |
| 41 | I | 97.8 | Very high | 93.9 | Very high | 120 Ų | 120 | 96.1 Ų | 96.1 | 62% | 0.615 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.1 | -49.1 | 174.7 | -67 | 165 | 0 | 0 | 0 | 109.9 | A37 A38 A43 S44 F45 | A37-I41 WeakPolarHBondContact O-CG1 3.39Å; A37-I41 PolarHBondContact O-N 3.24Å; A38-I41 PolarHBondContact O-N 3.31Å; I41-A43 PolarHBondContact O-N 2.97Å; I41-S44 PolarHBondContact O-N 3.13Å; I41-F45 WeakPolarHBondContact O-CB 3.48Å; I41-F45 PolarHBondContact O-N 3.15Å |
| 42 | Q | 97.4 | Very high | 94.9 | Very high | 94 Ų | 94 | 95.6 Ų | 95.6 | 44% | 0.439 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.9 | -41.7 | 178.5 | -71.2 | -177 | 18.6 | 0 | 0 | 112.9 | A38 T39 F45 R46 | A38-Q42 WeakPolarHBondContact O-CG 3.39Å; A38-Q42 PolarHBondContact O-N 2.93Å; T39-Q42 PolarHBondContact O-N 3.48Å; Q42-F45 PolarHBondContact O-N 2.94Å; Q42-R46 WeakPolarHBondContact O-CB 3.35Å; Q42-R46 VanDerWaalsContact O-CG 3.3Å; Q42-R46 WeakPolarHBondContact O-CG 3.35Å; Q42-R46 PolarHBondContact O-N 3.46Å |
| 43 | A | 97.7 | Very high | 95.4 | Very high | 60 Ų | 60 | 100.4 Ų | 100.4 | 50% | 0.496 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64 | -44.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | T39 I41 G47 | T39-A43 WeakPolarHBondContact O-CB 3.4Å; T39-A43 PolarHBondContact O-N 3.38Å; I41-A43 PolarHBondContact O-N 2.97Å; A43-G47 PolarHBondContact O-N 2.96Å |
| 44 | S | 98 | Very high | 95.4 | Very high | 69 Ų | 69 | 99.4 Ų | 99.4 | 48% | 0.483 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.5 | -41.3 | 177 | -59.2 | 0 | 0 | 0 | 0 | 112.1 | K40 I41 G47 H48 | K40-S44 WeakPolarHBondContact O-CB 3.41Å; K40-S44 PolarHBondContact O-N 2.82Å; K40-S44 PolarHBondContact O-OG 3.44Å; I41-S44 PolarHBondContact O-N 3.13Å; S44-G47 PolarHBondContact O-N 2.87Å; S44-H48 WeakPolarHBondContact O-CB 3.3Å; S44-H48 PolarHBondContact O-N 3.4Å |
| 45 | F | 97.8 | Very high | 95.4 | Very high | 128 Ų | 128 | 103.9 Ų | 103.9 | 56% | 0.561 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.1 | -50 | 176.9 | -177.6 | -102.6 | 0 | 0 | 0 | 111.8 | I41 Q42 G47 H48 I49 | I41-F45 WeakPolarHBondContact O-CB 3.48Å; I41-F45 PolarHBondContact O-N 3.15Å; Q42-F45 PolarHBondContact O-N 2.94Å; F45-G47 VanDerWaalsContact C-N 3.27Å; F45-G47 PolarHBondContact O-N 3.41Å; F45-H48 WeakPolarHBondContact O-CB 3.44Å; F45-H48 PolarHBondContact O-N 3.14Å; F45-I49 HydrophobicContact CD1-CG1 4.16Å; F45-I49 HydrophobicContact CE1-CD1 4.27Å; F45-I49 HydrophobicContact CE1-CG1 3.76Å; F45-I49 HydrophobicContact CE2-CD1 4.09Å; F45-I49 HydrophobicContact CE2-CG1 4.16Å; F45-I49 HydrophobicContact CZ-CD1 3.78Å; F45-I49 HydrophobicContact CZ-CG1 3.77Å; F45-I49 WeakPolarHBondContact O-CG1 3.29Å; F45-I49 PolarHBondContact O-N 3.39Å |
| 46 | R | 97 | Very high | 94.7 | Very high | 156 Ų | 156 | 102.3 Ų | 102.3 | 59% | 0.589 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -54 | -45.6 | 173.7 | -74.2 | 174.5 | 176.9 | 117.7 | 2.5 | 111 | Q42 H48 I49 T50 | Q42-R46 WeakPolarHBondContact O-CB 3.35Å; Q42-R46 VanDerWaalsContact O-CG 3.3Å; Q42-R46 WeakPolarHBondContact O-CG 3.35Å; Q42-R46 PolarHBondContact O-N 3.46Å; R46-H48 PolarHBondContact O-N 2.91Å; R46-I49 PolarHBondContact O-N 3.04Å; R46-T50 PolarHBondContact O-N 3.21Å; R46-T50 PolarHBondContact O-OG1 3.35Å |
| 47 | G | 97.9 | Very high | 93.4 | Very high | 19 Ų | 19 | 97.6 Ų | 97.6 | 20% | 0.196 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -64 | -36.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | A43 S44 F45 R51 | A43-G47 PolarHBondContact O-N 2.96Å; S44-G47 PolarHBondContact O-N 2.87Å; F45-G47 VanDerWaalsContact C-N 3.27Å; F45-G47 PolarHBondContact O-N 3.41Å; G47-R51 VanDerWaalsContact C-CZ 3.49Å; G47-R51 WeakPolarHBondContact O-CB 3.18Å; G47-R51 WeakPolarHBondContact O-CG 3.27Å; G47-R51 VanDerWaalsContact O-CZ 3.24Å; G47-R51 PolarHBondContact O-N 3.23Å; G47-R51 PolarHBondContact O-NE 2.92Å; G47-R51 PolarHBondContact O-NH1 3.05Å |
| 48 | H | 97.3 | Very high | 91.7 | Very high | 98 Ų | 98 | 104 Ų | 104 | 45% | 0.454 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.9 | -48.8 | 174.2 | 175.3 | 85 | 0 | 0 | 0 | 111.1 | S44 F45 R46 T50 R51 K52 | S44-H48 WeakPolarHBondContact O-CB 3.3Å; S44-H48 PolarHBondContact O-N 3.4Å; F45-H48 WeakPolarHBondContact O-CB 3.44Å; F45-H48 PolarHBondContact O-N 3.14Å; R46-H48 PolarHBondContact O-N 2.91Å; H48-T50 VanDerWaalsContact C-N 3.33Å; H48-T50 PolarHBondContact O-N 3.22Å; H48-R51 PolarHBondContact O-N 3.29Å; H48-K52 WeakPolarHBondContact O-CB 3.28Å; H48-K52 PolarHBondContact O-N 2.81Å |
| 49 | I | 96.4 | Very high | 89.9 | Confident | 58 Ų | 58 | 109.4 Ų | 109.4 | 30% | 0.297 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -58.6 | -43.6 | 176.7 | -63.5 | -62.4 | 0 | 0 | 0 | 111.2 | F45 R46 K52 K53 | F45-I49 HydrophobicContact CD1-CG1 4.16Å; F45-I49 HydrophobicContact CE1-CD1 4.27Å; F45-I49 HydrophobicContact CE1-CG1 3.76Å; F45-I49 HydrophobicContact CE2-CD1 4.09Å; F45-I49 HydrophobicContact CE2-CG1 4.16Å; F45-I49 HydrophobicContact CZ-CD1 3.78Å; F45-I49 HydrophobicContact CZ-CG1 3.77Å; F45-I49 WeakPolarHBondContact O-CG1 3.29Å; F45-I49 PolarHBondContact O-N 3.39Å; R46-I49 PolarHBondContact O-N 3.04Å; I49-K52 PolarHBondContact O-N 3.12Å; I49-K53 HydrophobicContact CG2-CD 4.04Å; I49-K53 HydrophobicContact CG2-CG 4.45Å; I49-K53 WeakPolarHBondContact O-CB 3.48Å; I49-K53 VanDerWaalsContact O-CG 3.3Å; I49-K53 WeakPolarHBondContact O-CG 3.43Å; I49-K53 PolarHBondContact O-N 3.27Å |
| 50 | T | 95.6 | Very high | 87.8 | Confident | 72 Ų | 72 | 114.5 Ų | 114.5 | 44% | 0.442 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -63.8 | -47.3 | 176.4 | -61.7 | 0 | 0 | 0 | 0 | 112.2 | R46 H48 K52 K53 M54 | R46-T50 PolarHBondContact O-N 3.21Å; R46-T50 PolarHBondContact O-OG1 3.35Å; H48-T50 VanDerWaalsContact C-N 3.33Å; H48-T50 PolarHBondContact O-N 3.22Å; T50-K52 VanDerWaalsContact C-N 3.33Å; T50-K52 PolarHBondContact O-N 3.26Å; T50-K53 PolarHBondContact O-N 3.08Å; T50-M54 HydrophobicContact CG2-CE 3.78Å; T50-M54 HydrophobicContact CG2-SD 3.87Å; T50-M54 WeakPolarHBondContact O-CG 3.1Å; T50-M54 PolarHBondContact O-N 2.96Å |
| 51 | R | 94.8 | Very high | 86.1 | Confident | 155 Ų | 155 | 115.7 Ų | 115.7 | 59% | 0.585 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -62.7 | -39.3 | 177.6 | -75.4 | -176.2 | -63.4 | -91 | 0.4 | 112.2 | G47 H48 M54 K55 | G47-R51 VanDerWaalsContact C-CZ 3.49Å; G47-R51 WeakPolarHBondContact O-CB 3.18Å; G47-R51 WeakPolarHBondContact O-CG 3.27Å; G47-R51 VanDerWaalsContact O-CZ 3.24Å; G47-R51 PolarHBondContact O-N 3.23Å; G47-R51 PolarHBondContact O-NE 2.92Å; G47-R51 PolarHBondContact O-NH1 3.05Å; H48-R51 PolarHBondContact O-N 3.29Å; R51-M54 PolarHBondContact O-N 3.37Å; R51-K55 WeakPolarHBondContact O-CB 3.28Å; R51-K55 PolarHBondContact O-N 2.87Å |
| 52 | K | 94.3 | Very high | 83.8 | Confident | 98 Ų | 98 | 117.6 Ų | 117.6 | 43% | 0.426 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.6 | -48.7 | 176.8 | -174.9 | 157.5 | 174 | 55.1 | 0 | 110.7 | H48 I49 T50 M54 K55 D56 | H48-K52 WeakPolarHBondContact O-CB 3.28Å; H48-K52 PolarHBondContact O-N 2.81Å; I49-K52 PolarHBondContact O-N 3.12Å; T50-K52 VanDerWaalsContact C-N 3.33Å; T50-K52 PolarHBondContact O-N 3.26Å; K52-M54 VanDerWaalsContact C-N 3.28Å; K52-M54 PolarHBondContact O-N 3.25Å; K52-K55 PolarHBondContact O-N 3.45Å; K52-K55 VanDerWaalsContact O-N 3.15Å; K52-D56 VanDerWaalsContact CE-OD2 3.24Å; K52-D56 WeakPolarHBondContact CE-OD2 3.08Å; K52-D56 WeakPolarHBondContact CG-OD2 3.38Å; K52-D56 IonicContact NZ-OD1 2.64Å; K52-D56 PolarHBondContact NZ-OD1 2.83Å; K52-D56 IonicContact NZ-OD2 2.6Å; K52-D56 PolarHBondContact NZ-OD2 2.71Å; K52-D56 VanDerWaalsContact O-CB 3.29Å; K52-D56 WeakPolarHBondContact O-CB 3.42Å; K52-D56 PolarHBondContact O-N 3.04Å |
| 53 | K | 91 | Very high | 81.7 | Confident | 153 Ų | 153 | 116.7 Ų | 116.7 | 67% | 0.665 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -59.1 | -32.1 | 174.1 | -74.6 | 179 | 176.5 | -172.7 | 0 | 114.8 | I49 T50 G57 | I49-K53 HydrophobicContact CG2-CD 4.04Å; I49-K53 HydrophobicContact CG2-CG 4.45Å; I49-K53 WeakPolarHBondContact O-CB 3.48Å; I49-K53 VanDerWaalsContact O-CG 3.3Å; I49-K53 WeakPolarHBondContact O-CG 3.43Å; I49-K53 PolarHBondContact O-N 3.27Å; T50-K53 PolarHBondContact O-N 3.08Å; K53-G57 PolarHBondContact O-N 2.72Å |
| 54 | M | 87.1 | Confident | 79 | Confident | 138 Ų | 138 | 120.6 Ų | 120.6 | 68% | 0.68 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -77.3 | -37.2 | 176.3 | -73.8 | 172.5 | 168.9 | 0 | 0 | 112.1 | T50 R51 K52 G57 | T50-M54 HydrophobicContact CG2-CE 3.78Å; T50-M54 HydrophobicContact CG2-SD 3.87Å; T50-M54 WeakPolarHBondContact O-CG 3.1Å; T50-M54 PolarHBondContact O-N 2.96Å; R51-M54 PolarHBondContact O-N 3.37Å; K52-M54 VanDerWaalsContact C-N 3.28Å; K52-M54 PolarHBondContact O-N 3.25Å; M54-G57 PolarHBondContact O-N 2.79Å |
| 55 | K | 89.6 | Confident | 76.8 | Confident | 153 Ų | 153 | 121.9 Ų | 121.9 | 67% | 0.665 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -79.6 | -43.4 | -178.6 | -172.6 | 164.6 | -179.4 | 176.4 | 0 | 112.6 | R51 K52 G57 E58 | R51-K55 WeakPolarHBondContact O-CB 3.28Å; R51-K55 PolarHBondContact O-N 2.87Å; K52-K55 PolarHBondContact O-N 3.45Å; K52-K55 VanDerWaalsContact O-N 3.15Å; K55-G57 PolarHBondContact O-N 3.45Å; K55-E58 PolarHBondContact O-N 3.49Å |
| 56 | D | 78.4 | Confident | 74.6 | Confident | 84 Ų | 84 | 121 Ų | 121 | 45% | 0.449 | 62% | 0.624 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -73.4 | 1.8 | 171.4 | -49.9 | -8.5 | 0 | 0 | 0 | 111.9 | K52 E59 | K52-D56 VanDerWaalsContact CE-OD2 3.24Å; K52-D56 WeakPolarHBondContact CE-OD2 3.08Å; K52-D56 WeakPolarHBondContact CG-OD2 3.38Å; K52-D56 IonicContact NZ-OD1 2.64Å; K52-D56 PolarHBondContact NZ-OD1 2.83Å; K52-D56 IonicContact NZ-OD2 2.6Å; K52-D56 PolarHBondContact NZ-OD2 2.71Å; K52-D56 VanDerWaalsContact O-CB 3.29Å; K52-D56 WeakPolarHBondContact O-CB 3.42Å; K52-D56 PolarHBondContact O-N 3.04Å; D56-E59 VanDerWaalsContact O-O 3.13Å |
| 57 | G | 66.9 | Low | 72.3 | Confident | 60 Ų | 60 | 117.7 Ų | 117.7 | 62% | 0.619 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.3 | -11.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | K53 M54 K55 | K53-G57 PolarHBondContact O-N 2.72Å; M54-G57 PolarHBondContact O-N 2.79Å; K55-G57 PolarHBondContact O-N 3.45Å |
| 58 | E | 60 | Low | 70 | Confident | 181 Ų | 181 | 121.3 Ų | 121.3 | 85% | 0.846 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.7 | -16.6 | 173.9 | -69 | -169.7 | 136.8 | 0 | 0 | 113 | K55 | K55-E58 PolarHBondContact O-N 3.49Š|
| 59 | E | 58.3 | Low | 67.3 | Low | 155 Ų | 155 | 126 Ų | 126 | 72% | 0.724 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -108 | 132.2 | 172.5 | -67.4 | -177.7 | -169.3 | 0 | 0 | 109.2 | D56 | D56-E59 VanDerWaalsContact O-O 3.13Š|
| 60 | E | 53.8 | Low | 64.7 | Low | 195 Ų | 195 | 131.9 Ų | 131.9 | 91% | 0.911 | 71% | 0.707 | S | S | * | * | | | trans | -51.1 | 165.3 | -154.6 | -64.8 | -162.1 | 121.3 | 0 | 0 | 119.9 | | |
| 61 | K | 60.8 | Low | 62.4 | Low | 184 Ų | 184 | 133.3 Ų | 133.3 | 80% | 0.8 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -41.1 | 162 | 168.5 | -69.3 | 177 | 164.6 | -176.7 | 0 | 115.3 | | |
| 62 | D | 50.2 | Low | 59.8 | Low | 160 Ų | 160 | 130.5 Ų | 130.5 | 86% | 0.856 | 74% | 0.736 | S | S | * | * | | | trans | 76.8 | 61.6 | 157.5 | -52.4 | -40.5 | 0 | 0 | 0 | 115.6 | | |
| 63 | G | 52.3 | Low | 56.9 | Low | 74 Ų | 74 | 132.1 Ų | 132.1 | 76% | 0.763 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -162.6 | 82.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | | |
| 64 | D | 42.2 | Very low | 54.7 | Low | 143 Ų | 143 | 128.6 Ų | 128.6 | 77% | 0.765 | 76% | 0.756 | S | S | * | * | | | trans | 63.4 | 126.3 | 165.5 | -161.3 | -110.9 | 0 | 0 | 0 | 119.5 | | |
| 65 | S | 51.3 | Low | 52.3 | Low | 96 Ų | 96 | 129.1 Ų | 129.1 | 67% | 0.671 | 76% | 0.757 | S | S | * | * | | | trans | -91.7 | 114.3 | 162.3 | 159 | 0 | 0 | 0 | 0 | 106.9 | A67 | S65-A67 PolarHBondContact O-N 3.26Š|
| 66 | P | 50.8 | Low | 49.9 | Very low | 109 Ų | 109 | 131.3 Ų | 131.3 | 71% | 0.708 | 77% | 0.77 | S | S | * | * | | | trans | -73.8 | 73 | -175.9 | 29.9 | -36.1 | 0 | 0 | 0 | 111.9 | | |
| 67 | A | 48.6 | Very low | 47.8 | Very low | 86 Ų | 86 | 132.5 Ų | 132.5 | 71% | 0.711 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -89.5 | 100.6 | 152 | 0 | 0 | 0 | 0 | 0 | 106.5 | S65 | S65-A67 PolarHBondContact O-N 3.26Š|
| 68 | A | 50.7 | Low | 46.4 | Very low | 95 Ų | 95 | 138.6 Ų | 138.6 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | | | trans | 68.8 | 95.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 117.2 | | |
| 69 | E | 40.6 | Very low | 45.1 | Very low | 198 Ų | 198 | 137.2 Ų | 137.2 | 93% | 0.925 | 78% | 0.781 | S | S | * | * | | | | -121.3 | 135.5 | 122.1 | -84.5 | -136.6 | 126.8 | 0 | 0 | 109.3 | | |
| 70 | E | 42.1 | Very low | 44 | Very low | 181 Ų | 181 | 135 Ų | 135 | 85% | 0.846 | 79% | 0.789 | S | S | * | * | | | trans | -91.7 | 153.9 | 173.6 | -83.7 | -152.8 | 127.4 | 0 | 0 | 111.8 | A72 | E70-A72 PolarHBondContact O-N 2.72Š|
| 71 | A | 46.9 | Very low | 43.1 | Very low | 101 Ų | 101 | 133.3 Ų | 133.3 | 84% | 0.835 | 78% | 0.781 | S | S | * | * | | | trans | 46.5 | 69.2 | 138.4 | 0 | 0 | 0 | 0 | 0 | 119.9 | | |
| 72 | A | 40.5 | Very low | 41.7 | Very low | 97 Ų | 97 | 127.8 Ų | 127.8 | 80% | 0.802 | 78% | 0.776 | S | S | * | * | | | trans | -150.1 | 137.5 | 136.6 | 0 | 0 | 0 | 0 | 0 | 107.7 | E70 | E70-A72 PolarHBondContact O-N 2.72Š|
| 73 | N | 32.3 | Very low | 40.9 | Very low | 132 Ų | 132 | 128.9 Ų | 128.9 | 71% | 0.706 | 78% | 0.776 | S | S | * | * | | | cis | -148.9 | 135.7 | 27 | -175.7 | -60 | 0 | 0 | 0 | 109.6 | E75 | N73-E75 PolarHBondContact OD1-N 3.4Š|
| 74 | G | 45.1 | Very low | 40 | Very low | 79 Ų | 79 | 134 Ų | 134 | 81% | 0.814 | 78% | 0.78 | S | S | * | * | | | trans | -91 | 96.8 | 164.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | E76 | G74-E76 PolarHBondContact O-N 3.36Š|
| 75 | E | 37.2 | Very low | 39.9 | Very low | 149 Ų | 149 | 131.1 Ų | 131.1 | 70% | 0.696 | 78% | 0.776 | S | S | * | * | | | trans | -96.6 | 87.1 | 176.3 | -160.5 | -171.2 | 118.8 | 0 | 0 | 110.9 | N73 T77 | N73-E75 PolarHBondContact OD1-N 3.4Å; E75-T77 VanDerWaalsContact C-N 3.33Å; E75-T77 WeakPolarHBondContact CG-OG1 2.98Å; E75-T77 PolarHBondContact O-N 3.07Å; E75-T77 VanDerWaalsContact O-N 3.16Å; E75-T77 PolarHBondContact OE1-OG1 3.14Å |
| 76 | E | 38.2 | Very low | 39.5 | Very low | 199 Ų | 199 | 132.6 Ų | 132.6 | 93% | 0.93 | 78% | 0.783 | S | S | * | * | | | trans | -76 | 85.1 | 158.1 | -73.7 | -165 | 116.6 | 0 | 0 | 109.8 | G74 K78 | G74-E76 PolarHBondContact O-N 3.36Å; E76-K78 PolarHBondContact O-N 3.08Å |
| 77 | T | 34.7 | Very low | 38.9 | Very low | 108 Ų | 108 | 131.3 Ų | 131.3 | 66% | 0.663 | 78% | 0.782 | S | S | * | * | | | trans | -82.1 | 110.2 | 168 | -72.6 | 0 | 0 | 0 | 0 | 110.6 | E75 | E75-T77 VanDerWaalsContact C-N 3.33Å; E75-T77 WeakPolarHBondContact CG-OG1 2.98Å; E75-T77 PolarHBondContact O-N 3.07Å; E75-T77 VanDerWaalsContact O-N 3.16Å; E75-T77 PolarHBondContact OE1-OG1 3.14Å |
| 78 | K | 37.9 | Very low | 38.2 | Very low | 189 Ų | 189 | 136 Ų | 136 | 82% | 0.822 | 79% | 0.786 | S | S | * | * | | | trans | -55.2 | 138.6 | 175.2 | -98.8 | 173.6 | 174.5 | 169.9 | 0 | 113.6 | E76 | E76-K78 PolarHBondContact O-N 3.08Š|
| 79 | K | 33 | Very low | 37.5 | Very low | 152 Ų | 152 | 137.9 Ų | 137.9 | 66% | 0.661 | 78% | 0.779 | S | S | * | * | | | | 51.9 | 101.4 | 128.7 | -160.7 | -169.9 | -170.4 | -154.4 | 0 | 117.6 | E81 | K79-E81 WeakPolarHBondContact CE-OE2 3.1Å; K79-E81 HydrophobicContact CG-CB 4.46Å; K79-E81 IonicContact NZ-OE2 3.31Å; K79-E81 PolarHBondContact NZ-OE2 3.2Å |
| 80 | A | 35.4 | Very low | 37.1 | Very low | 108 Ų | 108 | 135.4 Ų | 135.4 | 89% | 0.893 | 77% | 0.767 | S | S | * | * | | | trans | -99.6 | 137.1 | 137.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | | |
| 81 | E | 33.8 | Very low | 36.8 | Very low | 159 Ų | 159 | 135.1 Ų | 135.1 | 74% | 0.743 | 77% | 0.766 | S | S | * | * | | | trans | -122 | 151.8 | 178.7 | -164.1 | 178.4 | -164 | 0 | 0 | 108.6 | K79 | K79-E81 WeakPolarHBondContact CE-OE2 3.1Å; K79-E81 HydrophobicContact CG-CB 4.46Å; K79-E81 IonicContact NZ-OE2 3.31Å; K79-E81 PolarHBondContact NZ-OE2 3.2Å |
| 82 | G | 31.6 | Very low | 35.8 | Very low | 68 Ų | 68 | 136 Ų | 136 | 70% | 0.701 | 76% | 0.761 | S | S | * | * | | | trans | 102.4 | 141.8 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | | |
| 83 | E | 33.7 | Very low | 35.2 | Very low | 184 Ų | 184 | 137.8 Ų | 137.8 | 86% | 0.86 | 76% | 0.762 | S | S | * | * | | | cis | -160.4 | 155.3 | 0.7 | -174.7 | 156 | 99.5 | 0 | 0 | 110.3 | | |
| 84 | E | 34.1 | Very low | 35.1 | Very low | 182 Ų | 182 | 135.1 Ų | 135.1 | 85% | 0.85 | 77% | 0.766 | S | S | * | * | | | trans | 57.4 | 127.8 | 169.4 | -80.5 | -167 | 152.4 | 0 | 0 | 122.8 | | |
| 85 | A | 39.8 | Very low | 34.5 | Very low | 82 Ų | 82 | 140.7 Ų | 140.7 | 68% | 0.678 | 77% | 0.77 | S | S | * | * | | | trans | -88.3 | 166.3 | 151.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 86 | P | 43.2 | Very low | 34.3 | Very low | 126 Ų | 126 | 142.5 Ų | 142.5 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | | | | -146.4 | 133.3 | 110.7 | 33.5 | -17.1 | 0 | 0 | 0 | 117.3 | | |
| 87 | A | 36.7 | Very low | 34.1 | Very low | 83 Ų | 83 | 137.1 Ų | 137.1 | 69% | 0.686 | 77% | 0.768 | S | S | * | * | | | | 66.4 | 130.9 | 126.7 | 0 | 0 | 0 | 0 | 0 | 124.1 | | |
| 88 | K | 35 | Very low | 34 | Very low | 184 Ų | 184 | 141.2 Ų | 141.2 | 80% | 0.8 | 78% | 0.777 | S | S | * | * | | | trans | 71.5 | 151.6 | 151.3 | -67 | 169.4 | 162.7 | -146 | 0 | 117.2 | | |
| 89 | Q | 34.9 | Very low | 33.7 | Very low | 135 Ų | 135 | 140.5 Ų | 140.5 | 63% | 0.631 | 77% | 0.774 | S | S | * | * | | | cis | -148 | 165.5 | -6.4 | -118.5 | 159.9 | -99.5 | 0 | 0 | 104.8 | | |
| 90 | E | 34 | Very low | 33.6 | Very low | 145 Ų | 145 | 140.9 Ų | 140.9 | 68% | 0.678 | 78% | 0.778 | S | S | * | * | | | cis | -173.7 | 157.7 | 42.6 | -146 | 144.8 | -131.3 | 0 | 0 | 110.4 | | |
| 91 | E | 35.7 | Very low | 33.1 | Very low | 176 Ų | 176 | 139 Ų | 139 | 82% | 0.822 | 77% | 0.769 | S | S | * | * | | | trans | 24.5 | 146.2 | 147.1 | -70.2 | -166.4 | 152.8 | 0 | 0 | 123.3 | | |
| 92 | T | 24.7 | Very low | 33 | Very low | 118 Ų | 118 | 140.2 Ų | 140.2 | 72% | 0.724 | 78% | 0.775 | S | S | * | * | | | cis | -149.2 | 171.5 | -0.8 | 48 | 0 | 0 | 0 | 0 | 106.3 | | |
| 93 | T | 28.5 | Very low | 33 | Very low | 136 Ų | 136 | 144.7 Ų | 144.7 | 83% | 0.834 | 78% | 0.778 | S | S | * | * | | | cis | -144.6 | 166 | 24.7 | 43.1 | 0 | 0 | 0 | 0 | 109.8 | | |
| 94 | G | 29.2 | Very low | 33 | Very low | 75 Ų | 75 | 142.8 Ų | 142.8 | 77% | 0.773 | 78% | 0.779 | S | S | * | * | | | trans | -117.5 | 156.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | | |
| 95 | E | 33.2 | Very low | 33.1 | Very low | 196 Ų | 196 | 140.3 Ų | 140.3 | 92% | 0.916 | 77% | 0.772 | S | S | * | * | | | trans | -147.6 | 153.4 | 144.3 | -167 | 138.8 | 105.6 | 0 | 0 | 109.2 | | |
| 96 | E | 33.5 | Very low | 32.9 | Very low | 187 Ų | 187 | 145.3 Ų | 145.3 | 87% | 0.874 | 78% | 0.781 | S | S | * | * | | | trans | -83.4 | 172.9 | -167.5 | -41.8 | 179 | 89.6 | 0 | 0 | 112.1 | | |
| 97 | A | 34.3 | Very low | 32.7 | Very low | 86 Ų | 86 | 144 Ų | 144 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | | | cis | -161.3 | 169.4 | 5.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 98 | K | 31.7 | Very low | 32.7 | Very low | 195 Ų | 195 | 148.8 Ų | 148.8 | 85% | 0.848 | 79% | 0.786 | S | S | * | * | | | trans | 70.8 | 117.4 | 160.2 | -99.3 | 174 | 173 | 178.7 | 0 | 118.6 | | |
| 99 | K | 31.9 | Very low | 33 | Very low | 174 Ų | 174 | 145.8 Ų | 145.8 | 76% | 0.757 | 78% | 0.784 | S | S | * | * | | | | 56.8 | 130.6 | 62.2 | -107 | -166.1 | 159.7 | -138.1 | 0 | 111.7 | | |
| 100 | E | 29.8 | Very low | 33.7 | Very low | 159 Ų | 159 | 145.3 Ų | 145.3 | 74% | 0.743 | 79% | 0.792 | S | S | * | * | | | cis | -143.8 | 162.7 | 18.2 | -50.1 | -171.6 | 127.2 | 0 | 0 | 107.7 | | |
| 101 | G | 26.4 | Very low | 33.5 | Very low | 69 Ų | 69 | 141.7 Ų | 141.7 | 71% | 0.711 | 79% | 0.794 | S | S | * | * | | | | 127.5 | 167.6 | 59.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | | |
| 102 | E | 30.4 | Very low | 33.6 | Very low | 185 Ų | 185 | 137.6 Ų | 137.6 | 86% | 0.864 | 79% | 0.79 | S | S | * | * | | | trans | 67.4 | 104.2 | 173.3 | -124.8 | 162.4 | 119.4 | 0 | 0 | 116.5 | | |
| 103 | E | 31.7 | Very low | 34.5 | Very low | 161 Ų | 161 | 139.5 Ų | 139.5 | 75% | 0.752 | 80% | 0.796 | S | S | * | * | | | | 51.1 | 113.7 | 80.5 | -70.1 | -147.4 | 89.8 | 0 | 0 | 115.6 | | |
| 104 | T | 35.4 | Very low | 35.4 | Very low | 144 Ų | 144 | 141.3 Ų | 141.3 | 88% | 0.883 | 79% | 0.792 | S | S | * | * | | | | -168.3 | 149.1 | 113 | 18.5 | 0 | 0 | 0 | 0 | 112.1 | | |
| 105 | N | 34.4 | Very low | 36.5 | Very low | 131 Ų | 131 | 143.4 Ų | 143.4 | 70% | 0.701 | 79% | 0.792 | S | S | * | * | | | trans | -101.4 | 159.7 | -177.1 | -93.3 | -85.7 | 0 | 0 | 0 | 111.7 | | |
| 106 | Q | 35.8 | Very low | 36.9 | Very low | 186 Ų | 186 | 137.8 Ų | 137.8 | 87% | 0.869 | 78% | 0.779 | S | S | * | * | | | trans | 69 | 114.1 | 154.1 | -67.9 | 169.8 | 102 | 0 | 0 | 121.5 | | |
| 107 | A | 39.4 | Very low | 37.7 | Very low | 100 Ų | 100 | 136 Ų | 136 | 83% | 0.826 | 78% | 0.775 | S | S | * | * | | | | -178.3 | 122.1 | 122.9 | 0 | 0 | 0 | 0 | 0 | 106.5 | | |
| 108 | K | 36.5 | Very low | 38 | Very low | 183 Ų | 183 | 137 Ų | 137 | 80% | 0.796 | 78% | 0.777 | S | S | * | * | | | cis | 81.7 | 93.4 | 28.3 | -152.9 | 166.3 | -172.8 | 176 | 0 | 115.6 | | |
| 109 | T | 42.2 | Very low | 39.1 | Very low | 121 Ų | 121 | 132.6 Ų | 132.6 | 74% | 0.742 | 77% | 0.769 | S | S | * | * | | | trans | 74.2 | 161.9 | 152.9 | 59.8 | 0 | 0 | 0 | 0 | 119.1 | | |
| 110 | P | 48.7 | Very low | 39.1 | Very low | 124 Ų | 124 | 128.8 Ų | 128.8 | 81% | 0.805 | 77% | 0.77 | S | S | * | * | | | cis | -141.7 | 175.3 | -44.8 | 39.3 | -24.2 | 0 | 0 | 0 | 114.5 | | |
| 111 | G | 30.7 | Very low | 39.4 | Very low | 69 Ų | 69 | 124.7 Ų | 124.7 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | | | trans | 110.9 | 135.8 | 139 | 0 | 0 | 0 | 0 | 0 | 118.4 | | |
| 112 | A | 37.3 | Very low | 39.9 | Very low | 90 Ų | 90 | 128 Ų | 128 | 74% | 0.744 | 78% | 0.777 | S | S | * | * | | | trans | 52.1 | 142.6 | 155.8 | 0 | 0 | 0 | 0 | 0 | 118.6 | | |
| 113 | D | 43.8 | Very low | 40.3 | Very low | 158 Ų | 158 | 124.1 Ų | 124.1 | 85% | 0.845 | 78% | 0.776 | S | S | * | * | | | cis | -148.5 | 162.2 | 33.3 | -105.5 | -59.7 | 0 | 0 | 0 | 114 | | |
| 114 | K | 47.2 | Very low | 40.9 | Very low | 175 Ų | 175 | 122.5 Ų | 122.5 | 76% | 0.761 | 78% | 0.777 | S | S | * | * | | | trans | -112.8 | 125.5 | 176.6 | 172.4 | -166.4 | 177.2 | -175.6 | 0 | 110.4 | A116 | K114-A116 HydrophobicContact CG-CB 4.37Š|
| 115 | P | 52.2 | Low | 41.3 | Very low | 119 Ų | 119 | 121.4 Ų | 121.4 | 77% | 0.773 | 78% | 0.775 | S | S | * | * | | | trans | -116.1 | 121.7 | 141.8 | 32.5 | -23.3 | 0 | 0 | 0 | 108.7 | | |
| 116 | A | 41.5 | Very low | 42.2 | Very low | 77 Ų | 77 | 121.1 Ų | 121.1 | 64% | 0.636 | 78% | 0.781 | S | S | * | * | | | cis | 60.2 | 59.4 | 40.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | K114 | K114-A116 HydrophobicContact CG-CB 4.37Š|
| 117 | N | 50.4 | Low | 42.4 | Very low | 149 Ų | 149 | 119 Ų | 119 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | | | trans | -140.4 | 129.9 | 147.4 | -152 | -84.8 | 0 | 0 | 0 | 111.4 | | |
| 118 | S | 40.9 | Very low | 42.3 | Very low | 107 Ų | 107 | 118.8 Ų | 118.8 | 75% | 0.748 | 78% | 0.778 | S | S | * | * | | | trans | -134.1 | 136.8 | 168.2 | 175.9 | 0 | 0 | 0 | 0 | 106.3 | | |
| 119 | P | 53.7 | Low | 42.3 | Very low | 104 Ų | 104 | 114.7 Ų | 114.7 | 68% | 0.675 | 78% | 0.778 | S | S | * | * | | | trans | -128.4 | 128.3 | 134 | 38 | -29.2 | 0 | 0 | 0 | 108.5 | | |
| 120 | A | 31.7 | Very low | 42.4 | Very low | 94 Ų | 94 | 113.8 Ų | 113.8 | 78% | 0.777 | 78% | 0.783 | S | S | * | * | | | | 41.7 | 94.6 | 71.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 121 | G | 36.3 | Very low | 42.3 | Very low | 72 Ų | 72 | 113.7 Ų | 113.7 | 74% | 0.742 | 78% | 0.783 | S | S | * | * | | | cis | 125.1 | 131.9 | 24.4 | 0 | 0 | 0 | 0 | 0 | 107.6 | | |
| 122 | T | 37.2 | Very low | 42.7 | Very low | 140 Ų | 140 | 115.1 Ų | 115.1 | 86% | 0.859 | 79% | 0.788 | S | S | * | * | | | trans | -146.1 | 104.5 | 173.8 | 31.8 | 0 | 0 | 0 | 0 | 109.5 | | |
| 123 | A | 39.5 | Very low | 42.6 | Very low | 103 Ų | 103 | 115.9 Ų | 115.9 | 85% | 0.851 | 79% | 0.794 | S | S | * | * | | | trans | -78 | 124.3 | 163.8 | 0 | 0 | 0 | 0 | 0 | 109 | | |
| 124 | T | 43.7 | Very low | 42.5 | Very low | 126 Ų | 126 | 112.9 Ų | 112.9 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | | | trans | -140.6 | 84 | 161.3 | 54.1 | 0 | 0 | 0 | 0 | 109.9 | | |
| 125 | S | 43.8 | Very low | 42.5 | Very low | 122 Ų | 122 | 109.9 Ų | 109.9 | 85% | 0.853 | 79% | 0.792 | S | S | * | * | | | trans | -71.8 | 139.4 | 152.4 | -56.5 | 0 | 0 | 0 | 0 | 108.8 | | |
| 126 | P | 54.6 | Low | 42.3 | Very low | 125 Ų | 125 | 110.2 Ų | 110.2 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | | | trans | -113.8 | 148 | 140.4 | 33.2 | -30.6 | 0 | 0 | 0 | 111.5 | | |
| 127 | V | 39.2 | Very low | 42 | Very low | 142 Ų | 142 | 113.4 Ų | 113.4 | 86% | 0.861 | 81% | 0.806 | S | S | * | * | | | trans | -84 | 162.1 | -178.2 | 119.5 | 0 | 0 | 0 | 0 | 111.5 | | |
| 128 | A | 37.3 | Very low | 41.3 | Very low | 94 Ų | 94 | 110.7 Ų | 110.7 | 78% | 0.777 | 80% | 0.804 | S | S | * | * | | | trans | 68.6 | 109 | 162.8 | 0 | 0 | 0 | 0 | 0 | 119.5 | | |
| 129 | A | 36.3 | Very low | 41.1 | Very low | 97 Ų | 97 | 110.3 Ų | 110.3 | 80% | 0.802 | 81% | 0.808 | S | S | * | * | | | | -157 | 119.3 | 121.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | | |
| 130 | A | 44.1 | Very low | 40.2 | Very low | 102 Ų | 102 | 112.1 Ų | 112.1 | 84% | 0.843 | 82% | 0.817 | S | S | * | * | | | trans | -86.1 | 145.6 | 162.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | | |
| 131 | P | 46.4 | Very low | 40.9 | Very low | 123 Ų | 123 | 111.9 Ų | 111.9 | 80% | 0.799 | 82% | 0.815 | S | S | * | * | | | trans | -115.8 | 153.6 | 147.6 | 34 | -27 | 0 | 0 | 0 | 111.8 | | |
| 132 | A | 38.6 | Very low | 41.1 | Very low | 99 Ų | 99 | 114.5 Ų | 114.5 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | | | trans | -67.3 | 159.5 | -171.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | A134 | A132-A134 PolarHBondContact O-N 3.28Š|
| 133 | A | 37.1 | Very low | 41.2 | Very low | 106 Ų | 106 | 112.7 Ų | 112.7 | 88% | 0.876 | 81% | 0.812 | S | S | * | * | | | trans | -59.3 | 128.2 | 169.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 134 | A | 40.5 | Very low | 41.5 | Very low | 95 Ų | 95 | 115.8 Ų | 115.8 | 79% | 0.785 | 81% | 0.809 | S | S | * | * | | | trans | -112.3 | 118.3 | 164.4 | 0 | 0 | 0 | 0 | 0 | 108.5 | A132 | A132-A134 PolarHBondContact O-N 3.28Š|
| 135 | S | 46.9 | Very low | 41.2 | Very low | 111 Ų | 111 | 115.9 Ų | 115.9 | 78% | 0.776 | 81% | 0.812 | S | S | * | * | | | trans | -69.6 | 133.6 | -179.3 | -49.7 | 0 | 0 | 0 | 0 | 111.5 | T137 | S135-T137 PolarHBondContact O-N 3.23Š|
| 136 | P | 47.7 | Very low | 40.9 | Very low | 127 Ų | 127 | 118.6 Ų | 118.6 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | | | trans | -78.7 | 110.8 | 166.8 | 30 | -30.9 | 0 | 0 | 0 | 110.4 | A138 | P136-A138 PolarHBondContact O-N 2.89Š|
| 137 | T | 36 | Very low | 39.9 | Very low | 143 Ų | 143 | 120.4 Ų | 120.4 | 88% | 0.877 | 81% | 0.806 | S | S | * | * | | | trans | -63.6 | 125.7 | 166.8 | -47.5 | 0 | 0 | 0 | 0 | 109.5 | S135 | S135-T137 PolarHBondContact O-N 3.23Š|
| 138 | A | 36.8 | Very low | 39.7 | Very low | 92 Ų | 92 | 122.8 Ų | 122.8 | 76% | 0.76 | 81% | 0.808 | S | S | * | * | | | trans | -88.7 | 146.7 | -172.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | P136 | P136-A138 PolarHBondContact O-N 2.89Š|
| 139 | A | 35.2 | Very low | 39.9 | Very low | 100 Ų | 100 | 125.5 Ų | 125.5 | 83% | 0.826 | 81% | 0.805 | S | S | * | * | | | trans | 63.3 | 81.6 | 155.1 | 0 | 0 | 0 | 0 | 0 | 118.7 | | |
| 140 | T | 36 | Very low | 39.8 | Very low | 141 Ų | 141 | 127.1 Ų | 127.1 | 87% | 0.865 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 135.8 | 142.4 | -47.7 | 0 | 0 | 0 | 0 | 109 | | |
| 141 | A | 46.6 | Very low | 39 | Very low | 89 Ų | 89 | 131.6 Ų | 131.6 | 74% | 0.736 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 139.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 142 | P | 39.9 | Very low | 38.2 | Very low | 127 Ų | 127 | 129.4 Ų | 129.4 | 83% | 0.825 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -90.3 | 132.3 | 161.1 | 32.8 | -28.8 | 0 | 0 | 0 | 111.1 | | |
| 143 | S | 38.8 | Very low | 38.1 | Very low | 103 Ų | 103 | 133.7 Ų | 133.7 | 72% | 0.72 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -73 | 158.4 | 173.8 | -55.1 | 0 | 0 | 0 | 0 | 113.1 | | |
| 144 | E | 45.1 | Very low | 37.7 | Very low | 167 Ų | 167 | 137.8 Ų | 137.8 | 78% | 0.78 | 80% | 0.804 | S | S | * | * | | | trans | 26 | 126.3 | 148.7 | -66.3 | 170.5 | 90.2 | 0 | 0 | 120.3 | | |
| 145 | P | 38 | Very low | 37.4 | Very low | 129 Ų | 129 | 141.1 Ų | 141.1 | 84% | 0.838 | 80% | 0.8 | S | S | * | * | | | trans | -104.5 | 144.5 | 133.4 | 32.8 | -27.3 | 0 | 0 | 0 | 111 | | |
| 146 | Q | 37.4 | Very low | 36.9 | Very low | 178 Ų | 178 | 141.9 Ų | 141.9 | 83% | 0.832 | 80% | 0.803 | S | S | * | * | | | trans | -77.9 | 156.2 | -169.8 | -69.5 | -177 | -18.3 | 0 | 0 | 114.4 | E148 | Q146-E148 PolarHBondContact O-N 3.04Š|
| 147 | K | 33.4 | Very low | 36.2 | Very low | 163 Ų | 163 | 144 Ų | 144 | 71% | 0.709 | 80% | 0.799 | S | S | * | * | | | trans | -58.7 | 119.6 | 167.7 | 178.8 | -164.4 | -176.3 | -152.5 | 0 | 111.8 | E149 | K147-E149 WeakPolarHBondContact CE-OE1 3.34Å; K147-E149 IonicContact NZ-OE1 2.72Å; K147-E149 PolarHBondContact NZ-OE1 2.89Å |
| 148 | E | 35.8 | Very low | 35.9 | Very low | 192 Ų | 192 | 144.9 Ų | 144.9 | 90% | 0.897 | 79% | 0.793 | S | S | * | * | | | trans | -124.3 | 134.8 | 152.8 | -85.1 | -167.9 | 133 | 0 | 0 | 110.7 | Q146 | Q146-E148 PolarHBondContact O-N 3.04Š|
| 149 | E | 40.7 | Very low | 35.6 | Very low | 152 Ų | 152 | 146.2 Ų | 146.2 | 71% | 0.71 | 79% | 0.792 | S | S | * | * | | | trans | -95.5 | 131 | -177.8 | -61.9 | 169 | 156 | 0 | 0 | 109.9 | K147 | K147-E149 WeakPolarHBondContact CE-OE1 3.34Å; K147-E149 IonicContact NZ-OE1 2.72Å; K147-E149 PolarHBondContact NZ-OE1 2.89Å |
| 150 | P | 33.8 | Very low | 35.3 | Very low | 131 Ų | 131 | 149.7 Ų | 149.7 | 85% | 0.851 | 79% | 0.791 | S | S | * | * | | | trans | -99.6 | 113.5 | 149.2 | 30.9 | -27.3 | 0 | 0 | 0 | 109.7 | | |
| 151 | K | 28.9 | Very low | 35 | Very low | 195 Ų | 195 | 147 Ų | 147 | 85% | 0.848 | 78% | 0.783 | S | S | * | * | | | trans | -75.7 | 155.5 | 172.4 | 166.3 | -178.9 | 172.8 | -176.9 | 0 | 110.9 | | |
| 152 | A | 29.3 | Very low | 34.2 | Very low | 77 Ų | 77 | 149.2 Ų | 149.2 | 64% | 0.636 | 79% | 0.787 | S | S | * | * | | | trans | 77.4 | 107.3 | 160.9 | 0 | 0 | 0 | 0 | 0 | 118.8 | | |
| 153 | E | 35.2 | Very low | 33.9 | Very low | 190 Ų | 190 | 146.9 Ų | 146.9 | 89% | 0.888 | 78% | 0.779 | S | S | * | * | | | | 91.2 | 146 | 119.8 | -133.5 | 144.7 | 123.6 | 0 | 0 | 120.6 | | |
| 154 | E | 30.4 | Very low | 33.7 | Very low | 192 Ų | 192 | 151.6 Ų | 151.6 | 90% | 0.897 | 79% | 0.787 | S | S | * | * | | | trans | 67.4 | 88.5 | 168.9 | -143.4 | 179.2 | 135.1 | 0 | 0 | 120.2 | | |
| 155 | K | 33.3 | Very low | 33.3 | Very low | 164 Ų | 164 | 149 Ų | 149 | 71% | 0.713 | 79% | 0.786 | S | S | * | * | | | trans | -127.1 | 144.4 | 137.5 | -141.4 | -145.7 | 176.3 | -163.4 | 0 | 105.8 | K157 | K155-K157 PolarHBondContact NZ-O 2.94Š|
| 156 | P | 35.8 | Very low | 33.8 | Very low | 127 Ų | 127 | 148.1 Ų | 148.1 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | | | | -134.7 | 143.9 | 72.9 | 34.8 | -20.2 | 0 | 0 | 0 | 114.4 | | |
| 157 | K | 33.5 | Very low | 33.3 | Very low | 173 Ų | 173 | 145.8 Ų | 145.8 | 75% | 0.752 | 78% | 0.779 | S | S | * | * | | | trans | -116.3 | 118.1 | 156.8 | 177.1 | -176 | -176.5 | 179 | 0 | 106.6 | K155 | K155-K157 PolarHBondContact NZ-O 2.94Š|
| 158 | E | 29.7 | Very low | 33.2 | Very low | 160 Ų | 160 | 144.2 Ų | 144.2 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | | | trans | -161.6 | 143 | 155.4 | -115.1 | -172.4 | 116.5 | 0 | 0 | 111.1 | | |
| 159 | V | 30.6 | Very low | 33 | Very low | 121 Ų | 121 | 139.3 Ų | 139.3 | 73% | 0.733 | 78% | 0.776 | S | S | * | * | | | trans | 43.3 | 152.9 | 155.5 | -53.1 | 0 | 0 | 0 | 0 | 120.9 | | |
| 160 | E | 29.1 | Very low | 32.3 | Very low | 173 Ų | 173 | 138.5 Ų | 138.5 | 81% | 0.808 | 78% | 0.781 | S | S | * | * | | | cis | -166.1 | 169.3 | -31.1 | -168.3 | -179.9 | 135.3 | 0 | 0 | 104.5 | | |
| 161 | A | 30.1 | Very low | 32.3 | Very low | 85 Ų | 85 | 136 Ų | 136 | 70% | 0.702 | 77% | 0.772 | S | S | * | * | | | trans | -0.5 | 126.6 | 169 | 0 | 0 | 0 | 0 | 0 | 118 | | |
| 162 | T | 28.4 | Very low | 32.5 | Very low | 134 Ų | 134 | 135.5 Ų | 135.5 | 82% | 0.822 | 77% | 0.773 | S | S | * | * | | | | 177.4 | 173.6 | 64.5 | -163.4 | 0 | 0 | 0 | 0 | 112.2 | | |
| 163 | A | 34.8 | Very low | 32.6 | Very low | 78 Ų | 78 | 138.4 Ų | 138.4 | 65% | 0.645 | 77% | 0.773 | S | S | * | * | | | trans | -53.2 | 162.9 | -175.6 | 0 | 0 | 0 | 0 | 0 | 117.1 | | |
| 164 | K | 33.8 | Very low | 32.4 | Very low | 203 Ų | 203 | 136.3 Ų | 136.3 | 88% | 0.883 | 76% | 0.761 | S | S | * | * | | | trans | -160.5 | 130.2 | 136.5 | -100.7 | 136.9 | -167.7 | 178 | 0 | 113.6 | | |
| 165 | S | 37.3 | Very low | 32.3 | Very low | 111 Ų | 111 | 134.2 Ų | 134.2 | 78% | 0.776 | 75% | 0.749 | S | S | * | * | | | trans | -68.1 | 160.8 | 154 | -54.5 | 0 | 0 | 0 | 0 | 110 | | |
| 166 | P | 47.7 | Very low | 32.2 | Very low | 112 Ų | 112 | 132.3 Ų | 132.3 | 73% | 0.727 | 74% | 0.742 | S | S | * | * | | | trans | -87.8 | 152 | -160.1 | 34.4 | -35.7 | 0 | 0 | 0 | 113.7 | | |
| 167 | T | 28.8 | Very low | 31.9 | Very low | 129 Ų | 129 | 133 Ų | 133 | 79% | 0.791 | 74% | 0.735 | S | S | * | * | | | | 171.3 | 159 | 115.7 | 32.7 | 0 | 0 | 0 | 0 | 113.7 | | |
| 168 | T | 29.6 | Very low | 31.7 | Very low | 129 Ų | 129 | 131.8 Ų | 131.8 | 79% | 0.791 | 73% | 0.729 | S | S | * | * | | | trans | 59.7 | 98.9 | 161.3 | 55.4 | 0 | 0 | 0 | 0 | 121.2 | | |
| 169 | A | 32.6 | Very low | 31.6 | Very low | 90 Ų | 90 | 129 Ų | 129 | 74% | 0.744 | 73% | 0.727 | S | S | * | * | | | | 82.5 | 137.7 | 106.9 | 0 | 0 | 0 | 0 | 0 | 122.9 | | |
| 170 | T | 26.6 | Very low | 31.7 | Very low | 135 Ų | 135 | 130.7 Ų | 130.7 | 83% | 0.828 | 73% | 0.727 | S | S | * | * | | | trans | 93.6 | 115.3 | 138.9 | -62.7 | 0 | 0 | 0 | 0 | 121.1 | | |
| 171 | A | 33.4 | Very low | 31.7 | Very low | 79 Ų | 79 | 129.8 Ų | 129.8 | 65% | 0.653 | 72% | 0.723 | S | S | * | * | | | trans | 66.9 | 113 | 142.1 | 0 | 0 | 0 | 0 | 0 | 123.1 | | |
| 172 | E | 31.7 | Very low | 31.7 | Very low | 184 Ų | 184 | 134 Ų | 134 | 86% | 0.86 | 73% | 0.725 | S | S | * | * | | | | 60.1 | 145.3 | 118.2 | -63.5 | -163.2 | 106.8 | 0 | 0 | 124.8 | | |
| 173 | E | 32.7 | Very low | 31.8 | Very low | 138 Ų | 138 | 135.5 Ų | 135.5 | 65% | 0.645 | 72% | 0.72 | S | S | * | * | | | trans | 71.1 | 104.7 | 147.5 | -74.9 | -125.9 | 102.6 | 0 | 0 | 121.9 | | |
| 174 | K | 30.8 | Very low | 31.7 | Very low | 145 Ų | 145 | 138.5 Ų | 138.5 | 63% | 0.63 | 72% | 0.721 | S | S | * | * | | | | 87.1 | 147.6 | 103.5 | -161.3 | -163.8 | -141.4 | 140.9 | 0 | 120 | | |
| 175 | K | 27.8 | Very low | 31.7 | Very low | 149 Ų | 149 | 136.9 Ų | 136.9 | 65% | 0.648 | 72% | 0.717 | S | S | * | * | | | trans | 72.6 | 147.4 | 155.6 | -101.7 | 161.1 | 146.4 | -97.7 | 0 | 115.4 | | |
| 176 | E | 30.5 | Very low | 32 | Very low | 124 Ų | 124 | 135.3 Ų | 135.3 | 58% | 0.579 | 71% | 0.711 | S | S | * | * | | | cis | -158.5 | 170.2 | 3.5 | -150.4 | 155.5 | -161.1 | 0 | 0 | 112.1 | | |
| 177 | E | 30.3 | Very low | 31.9 | Very low | 141 Ų | 141 | 139.8 Ų | 139.8 | 66% | 0.659 | 71% | 0.713 | S | S | * | * | | | trans | 8 | 136.6 | 151.7 | -76 | -170.5 | 105.1 | 0 | 0 | 122.2 | | |
| 178 | K | 28.5 | Very low | 32.5 | Very low | 148 Ų | 148 | 142.4 Ų | 142.4 | 64% | 0.643 | 71% | 0.714 | S | S | * | * | | | | 94.4 | 156.1 | 57.8 | -170.2 | -161.8 | 162.5 | -166.2 | 0 | 111.6 | | |
| 179 | S | 28.9 | Very low | 32.8 | Very low | 100 Ų | 100 | 140.5 Ų | 140.5 | 70% | 0.699 | 71% | 0.711 | S | S | * | * | | | trans | 87.3 | 147.4 | 161.5 | 80.3 | 0 | 0 | 0 | 0 | 115.1 | | |
| 180 | E | 31.3 | Very low | 32.8 | Very low | 158 Ų | 158 | 143.3 Ų | 143.3 | 74% | 0.738 | 71% | 0.713 | S | S | * | * | | | cis | -177 | 157.8 | -30.1 | -112.4 | 158.6 | 162 | 0 | 0 | 105.4 | | |
| 181 | E | 30.1 | Very low | 33.6 | Very low | 154 Ų | 154 | 143.6 Ų | 143.6 | 72% | 0.72 | 72% | 0.715 | S | S | * | * | | | trans | 4.4 | 129.2 | 163.5 | -101.7 | -175.8 | 89.4 | 0 | 0 | 122.4 | | |
| 182 | K | 31.1 | Very low | 34.4 | Very low | 173 Ų | 173 | 145 Ų | 145 | 75% | 0.752 | 72% | 0.717 | S | S | * | * | | | | 86.8 | 156.8 | 116 | -170.4 | 167.4 | 177.6 | 179.6 | 0 | 121.5 | | |
| 183 | K | 29.5 | Very low | 34.6 | Very low | 165 Ų | 165 | 140.6 Ų | 140.6 | 72% | 0.717 | 71% | 0.712 | S | S | * | * | | | trans | 107.8 | 101.5 | 159.4 | -156 | 168 | -171.1 | -178.5 | 0 | 114 | | |
| 184 | E | 32.7 | Very low | 34.8 | Very low | 142 Ų | 142 | 138.7 Ų | 138.7 | 66% | 0.664 | 72% | 0.72 | S | S | * | * | | | | 91 | 112.2 | 68.7 | -170.6 | -165.7 | 120.7 | 0 | 0 | 113.2 | | |
| 185 | E | 34.6 | Very low | 35.6 | Very low | 169 Ų | 169 | 138.2 Ų | 138.2 | 79% | 0.79 | 73% | 0.729 | S | S | * | * | | | trans | 65.1 | 139.1 | 144 | -160.4 | 171.4 | 128 | 0 | 0 | 123.2 | | |
| 186 | A | 42.2 | Very low | 36.3 | Very low | 78 Ų | 78 | 135.4 Ų | 135.4 | 65% | 0.645 | 73% | 0.728 | S | S | * | * | | | trans | 116.2 | 132.8 | 156 | 0 | 0 | 0 | 0 | 0 | 115.1 | | |
| 187 | R | 46.4 | Very low | 37 | Very low | 205 Ų | 205 | 138.4 Ų | 138.4 | 77% | 0.774 | 75% | 0.747 | S | S | * | * | | | cis | -173.8 | 151.5 | 2.7 | -119.1 | 171.1 | -165.2 | -165.1 | 1.9 | 112.1 | | |
| 188 | K | 40.1 | Very low | 37.1 | Very low | 185 Ų | 185 | 137.5 Ų | 137.5 | 80% | 0.804 | 75% | 0.752 | S | S | * | * | | | trans | 74.4 | 150.8 | 153.4 | -47 | -119.4 | -178.7 | -177.1 | 0 | 118.1 | | |
| 189 | A | 37 | Very low | 38 | Very low | 89 Ų | 89 | 135.3 Ų | 135.3 | 74% | 0.736 | 76% | 0.761 | S | S | * | * | | | cis | -169.4 | 163.2 | -20.6 | 0 | 0 | 0 | 0 | 0 | 112 | | |
| 190 | D | 32.7 | Very low | 38.7 | Very low | 149 Ų | 149 | 139.9 Ų | 139.9 | 80% | 0.797 | 77% | 0.771 | S | S | * | * | | | trans | 68.1 | 106.2 | 145.9 | -150.8 | 68.9 | 0 | 0 | 0 | 122.9 | | |
| 191 | V | 42.8 | Very low | 39.2 | Very low | 141 Ų | 141 | 141.7 Ų | 141.7 | 86% | 0.855 | 78% | 0.777 | S | S | * | * | | | trans | -156.9 | 140.8 | 135.6 | -172.6 | 0 | 0 | 0 | 0 | 107.3 | | |
| 192 | P | 51.3 | Low | 39.6 | Very low | 107 Ų | 107 | 143.4 Ų | 143.4 | 70% | 0.695 | 79% | 0.785 | S | S | * | * | | | trans | -103.9 | 150.5 | -152.9 | 38.4 | -37.7 | 0 | 0 | 0 | 119.3 | | |
| 193 | A | 36.3 | Very low | 40.3 | Very low | 93 Ų | 93 | 142.4 Ų | 142.4 | 77% | 0.769 | 78% | 0.783 | S | S | * | * | | | trans | 41 | 137.9 | 131.9 | 0 | 0 | 0 | 0 | 0 | 124.3 | | |
| 194 | A | 35.9 | Very low | 41.3 | Very low | 98 Ų | 98 | 141 Ų | 141 | 81% | 0.81 | 79% | 0.791 | S | S | * | * | | | trans | 73.3 | 144.6 | 159.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | | |
| 195 | V | 47.5 | Very low | 41.4 | Very low | 134 Ų | 134 | 140.3 Ų | 140.3 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | | | cis | -131.4 | 152.5 | 15.2 | 171.3 | 0 | 0 | 0 | 0 | 111.6 | | |
| 196 | S | 42.9 | Very low | 41.7 | Very low | 91 Ų | 91 | 140 Ų | 140 | 64% | 0.636 | 79% | 0.79 | S | S | * | * | | | trans | -58 | 147.9 | 178.4 | -40.7 | 0 | 0 | 0 | 0 | 115.5 | T198 | S196-T198 PolarHBondContact O-N 3.07Š|
| 197 | L | 45 | Very low | 41.5 | Very low | 186 Ų | 186 | 143.2 Ų | 143.2 | 97% | 0.974 | 80% | 0.802 | S | S | * | * | | | trans | -71.8 | 106.3 | 153.4 | -73.2 | 167.6 | 0 | 0 | 0 | 108.9 | | |
| 198 | T | 33.1 | Very low | 41.1 | Very low | 123 Ų | 123 | 138.8 Ų | 138.8 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | | | trans | -129.3 | 140.5 | 168.2 | 45.5 | 0 | 0 | 0 | 0 | 110.1 | S196 | S196-T198 PolarHBondContact O-N 3.07Š|
| 199 | A | 46.1 | Very low | 40.9 | Very low | 101 Ų | 101 | 137.7 Ų | 137.7 | 84% | 0.835 | 80% | 0.796 | S | S | * | * | | | trans | -68.4 | 143.2 | -173.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 200 | E | 43.1 | Very low | 41.5 | Very low | 196 Ų | 196 | 143.4 Ų | 143.4 | 92% | 0.916 | 80% | 0.804 | S | S | * | * | | | trans | -131.9 | 160.8 | 149.2 | -77.8 | -151.9 | 96.8 | 0 | 0 | 111.1 | | |
| 201 | K | 42.5 | Very low | 42.2 | Very low | 197 Ų | 197 | 145.3 Ų | 145.3 | 86% | 0.857 | 81% | 0.806 | S | S | * | * | | | trans | -132.3 | 110.4 | -164.8 | 158.7 | -140.8 | 173 | -172.6 | 0 | 106 | | |
| 202 | E | 39 | Very low | 42 | Very low | 190 Ų | 190 | 146.1 Ų | 146.1 | 89% | 0.888 | 81% | 0.805 | S | S | * | * | | | trans | -149.9 | 154.2 | 170 | -131.9 | 177.1 | 137.1 | 0 | 0 | 113.7 | | |
| 203 | E | 45.7 | Very low | 41.6 | Very low | 152 Ų | 152 | 145.2 Ų | 145.2 | 71% | 0.71 | 81% | 0.807 | S | S | * | * | | | trans | -75.5 | 156.1 | 178.5 | -57.8 | -178.3 | 107.2 | 0 | 0 | 111.9 | N205 | E203-N205 PolarHBondContact O-N 3.47Å; E203-N205 VanDerWaalsContact O-N 3.12Å |
| 204 | P | 50.2 | Low | 41.7 | Very low | 136 Ų | 136 | 144.9 Ų | 144.9 | 88% | 0.883 | 80% | 0.804 | S | S | * | * | | | trans | -74.5 | 92.5 | 153.1 | 31.7 | -29.9 | 0 | 0 | 0 | 109.2 | | |
| 205 | N | 34.4 | Very low | 42 | Very low | 127 Ų | 127 | 148.8 Ų | 148.8 | 68% | 0.679 | 81% | 0.805 | S | S | * | * | | | trans | -69.2 | 149.9 | 174.1 | -156.2 | -85 | 0 | 0 | 0 | 111.7 | E203 | E203-N205 PolarHBondContact O-N 3.47Å; E203-N205 VanDerWaalsContact O-N 3.12Å |
| 206 | Q | 42.1 | Very low | 41.7 | Very low | 162 Ų | 162 | 150.2 Ų | 150.2 | 76% | 0.757 | 80% | 0.803 | S | S | * | * | | | trans | -76.9 | 128.5 | -174.9 | 171.8 | -178.3 | 70.6 | 0 | 0 | 111.4 | N208 | Q206-N208 HydrophobicContact CG-CB 4.5Š|
| 207 | T | 37.8 | Very low | 42 | Very low | 146 Ų | 146 | 151.2 Ų | 151.2 | 90% | 0.896 | 81% | 0.81 | S | S | * | * | | | trans | -119.6 | 138.9 | 157.7 | 55.3 | 0 | 0 | 0 | 0 | 110.2 | | |
| 208 | N | 38.2 | Very low | 41.8 | Very low | 112 Ų | 112 | 151.5 Ų | 151.5 | 60% | 0.599 | 80% | 0.803 | S | S | * | * | | | trans | -139.9 | 105.7 | -158 | 163.2 | 93.2 | 0 | 0 | 0 | 108.5 | Q206 | Q206-N208 HydrophobicContact CG-CB 4.5Š|
| 209 | D | 35.8 | Very low | 42.1 | Very low | 162 Ų | 162 | 149.7 Ų | 149.7 | 87% | 0.866 | 80% | 0.801 | S | S | * | * | | | trans | -150.1 | 79.1 | 175.8 | -91.3 | -55.4 | 0 | 0 | 0 | 112.7 | | |
| 210 | K | 48.2 | Very low | 42.2 | Very low | 208 Ų | 208 | 154 Ų | 154 | 90% | 0.904 | 80% | 0.804 | S | S | * | * | | | trans | -161.3 | 92 | 137.7 | -119.9 | 156.5 | -176.3 | 161.5 | 0 | 112.2 | | |
| 211 | K | 47.5 | Very low | 41.9 | Very low | 189 Ų | 189 | 152.4 Ų | 152.4 | 82% | 0.822 | 80% | 0.796 | S | S | * | * | | | trans | -134.7 | 114.1 | 159.8 | -79.9 | -168.7 | 178.5 | -177.8 | 0 | 109.7 | | |
| 212 | D | 39.1 | Very low | 41.6 | Very low | 159 Ų | 159 | 149.8 Ų | 149.8 | 85% | 0.85 | 79% | 0.792 | S | S | * | * | | | trans | -141.8 | 114.5 | 141.7 | -99.4 | -62.1 | 0 | 0 | 0 | 103.3 | | |
| 213 | A | 42.8 | Very low | 41.5 | Very low | 88 Ų | 88 | 144.5 Ų | 144.5 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | | | | 73.2 | 136.2 | 75.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 214 | A | 39.7 | Very low | 41.3 | Very low | 85 Ų | 85 | 146.2 Ų | 146.2 | 70% | 0.702 | 79% | 0.788 | S | S | * | * | | | cis | -164.5 | 172.9 | -11.4 | 0 | 0 | 0 | 0 | 0 | 108.1 | | |
| 215 | E | 41.2 | Very low | 41.4 | Very low | 181 Ų | 181 | 145.2 Ų | 145.2 | 85% | 0.846 | 78% | 0.782 | S | S | * | * | | | cis | -155.3 | -120.7 | -1.9 | -143.9 | 160.2 | 166.6 | 0 | 0 | 113.2 | | |
| 216 | E | 41.3 | Very low | 41.5 | Very low | 164 Ų | 164 | 146.7 Ų | 146.7 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | | | trans | -57.9 | 160.5 | -177.6 | -57.8 | -174.5 | 109.3 | 0 | 0 | 116.6 | | |
| 217 | S | 48.9 | Very low | 41.2 | Very low | 111 Ų | 111 | 142.6 Ų | 142.6 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | | | cis | -164.7 | 137.2 | 39.4 | 23.8 | 0 | 0 | 0 | 0 | 109.2 | | |
| 218 | K | 40.9 | Very low | 41.5 | Very low | 192 Ų | 192 | 140.5 Ų | 140.5 | 84% | 0.835 | 79% | 0.789 | S | S | * | * | | | | 89.3 | 137.7 | 66.6 | -170.8 | 178.7 | 177.6 | 178.8 | 0 | 114 | | |
| 219 | A | 40.4 | Very low | 41.9 | Very low | 86 Ų | 86 | 139.4 Ų | 139.4 | 71% | 0.711 | 80% | 0.795 | S | S | * | * | | | trans | 80.6 | 90 | 164.6 | 0 | 0 | 0 | 0 | 0 | 119.3 | | |
| 220 | E | 47.2 | Very low | 42.4 | Very low | 191 Ų | 191 | 140.5 Ų | 140.5 | 89% | 0.893 | 80% | 0.795 | S | S | * | * | | | | -8.2 | 127.7 | 110 | -174.9 | 175.2 | 177.8 | 0 | 0 | 116.1 | | |
| 221 | E | 36.3 | Very low | 42.5 | Very low | 162 Ų | 162 | 136.6 Ų | 136.6 | 76% | 0.757 | 79% | 0.789 | S | S | * | * | | | | 167 | 131.1 | 120 | -146.9 | -167.4 | 98 | 0 | 0 | 113.5 | | |
| 222 | N | 37.3 | Very low | 42.5 | Very low | 142 Ų | 142 | 132 Ų | 132 | 76% | 0.759 | 78% | 0.78 | S | S | * | * | | | trans | 77.4 | 151.1 | 143.9 | -105.6 | -34.5 | 0 | 0 | 0 | 126.6 | | |
| 223 | A | 36.1 | Very low | 42.9 | Very low | 80 Ų | 80 | 133.7 Ų | 133.7 | 66% | 0.661 | 78% | 0.783 | S | S | * | * | | | trans | 78.8 | 101.5 | 154 | 0 | 0 | 0 | 0 | 0 | 121.7 | | |
| 224 | H | 42.2 | Very low | 43.5 | Very low | 187 Ų | 187 | 134.5 Ų | 134.5 | 87% | 0.866 | 79% | 0.79 | S | S | * | * | | | trans | -65.3 | 149.8 | 132.7 | -87.4 | 35.3 | 0 | 0 | 0 | 109.7 | | |
| 225 | P | 50.9 | Low | 44.1 | Very low | 116 Ų | 116 | 140 Ų | 140 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | | | | -127.6 | 140.2 | 102.8 | 7.6 | 13.8 | 0 | 0 | 0 | 111.4 | | |
| 226 | D | 37.1 | Very low | 44.9 | Very low | 158 Ų | 158 | 141 Ų | 141 | 85% | 0.845 | 80% | 0.802 | S | S | * | * | | | | 76.3 | 135.4 | 80.4 | -148.8 | -47.3 | 0 | 0 | 0 | 113.2 | | |
| 227 | G | 35.4 | Very low | 45.4 | Very low | 75 Ų | 75 | 144 Ų | 144 | 77% | 0.773 | 82% | 0.823 | S | S | * | * | | | trans | 148.1 | 81.1 | -176.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | | |
| 228 | A | 45.3 | Very low | 45.3 | Very low | 103 Ų | 103 | 145.6 Ų | 145.6 | 85% | 0.851 | 83% | 0.826 | S | S | * | * | | | trans | -89.3 | 142.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | | |
| 229 | A | 46.4 | Very low | 45.5 | Very low | 89 Ų | 89 | 143.2 Ų | 143.2 | 74% | 0.736 | 83% | 0.825 | S | S | * | * | | | trans | -171.3 | 120.8 | 154.9 | 0 | 0 | 0 | 0 | 0 | 106.5 | | |
| 230 | E | 46.4 | Very low | 45.8 | Very low | 185 Ų | 185 | 146.3 Ų | 146.3 | 86% | 0.864 | 83% | 0.832 | S | S | * | * | | | cis | 56.9 | 86.9 | 38.2 | -78.6 | -80.5 | 99.7 | 0 | 0 | 113.3 | | |
| 231 | T | 49 | Very low | 45.7 | Very low | 126 Ų | 126 | 143.7 Ų | 143.7 | 77% | 0.773 | 83% | 0.828 | S | S | * | * | | | trans | -164.5 | 99.8 | 152.1 | 21.9 | 0 | 0 | 0 | 0 | 106.4 | | |
| 232 | S | 48.7 | Very low | 46.3 | Very low | 92 Ų | 92 | 142.6 Ų | 142.6 | 64% | 0.643 | 83% | 0.833 | S | S | * | * | | | | 74 | 105.2 | 87.3 | 71.7 | 0 | 0 | 0 | 0 | 114.8 | | |
| 233 | E | 47.6 | Very low | 46.9 | Very low | 195 Ų | 195 | 142.6 Ų | 142.6 | 91% | 0.911 | 84% | 0.838 | S | S | * | * | | | trans | 39 | 117.1 | 132.1 | -64 | -176.3 | 96.2 | 0 | 0 | 120.4 | | |
| 234 | A | 54.2 | Low | 47.6 | Very low | 104 Ų | 104 | 147.1 Ų | 147.1 | 86% | 0.86 | 85% | 0.85 | S | S | * | * | | | trans | -147 | 117.2 | 131.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | | |
| 235 | K | 53.3 | Low | 48.1 | Very low | 202 Ų | 202 | 144 Ų | 144 | 88% | 0.878 | 85% | 0.849 | S | S | * | * | | | trans | -117.1 | 121.7 | 174.5 | 177.8 | -176.2 | -179.7 | -175.8 | 0 | 105.9 | | |
| 236 | E | 57.3 | Low | 47.8 | Very low | 201 Ų | 201 | 146.3 Ų | 146.3 | 94% | 0.939 | 86% | 0.857 | S | S | * | * | | | trans | -121.1 | 101 | -177.7 | -151.4 | 168.3 | 153.2 | 0 | 0 | 109.3 | | |
| 237 | D | 53.1 | Low | 48.8 | Very low | 226 Ų | 226 | 145.3 Ų | 145.3 | 100% | 1.209 | 86% | 0.858 | S | S | * | * | | | trans | -144 | 0 | 163.6 | -173.1 | -105.5 | 0 | 0 | 0 | 106 | | |