| 1 | M | 68.1 | Low | 81.7 | Confident | 244 Ų | 244 | 167.1 Ų | 167.1 | 100% | 1.202 | 84% | 0.839 | S | S | * | * | | | | 0 | 119.6 | 0 | -67.3 | -175.7 | 175.1 | 0 | 0 | 108 | | |
| 2 | S | 75.9 | Confident | 82.4 | Confident | 126 Ų | 126 | 161 Ų | 161 | 88% | 0.881 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 136.9 | -179 | 46.9 | 0 | 0 | 0 | 0 | 110.9 | | |
| 3 | R | 83.4 | Confident | 82.5 | Confident | 227 Ų | 227 | 160.7 Ų | 160.7 | 86% | 0.857 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 140.5 | -180 | -71.4 | 176 | 170 | 168.7 | -4.2 | 110 | V5 | R3-V5 PolarHBondContact O-N 3.25Š|
| 4 | P | 77.4 | Confident | 82.5 | Confident | 114 Ų | 114 | 154.6 Ų | 154.6 | 74% | 0.74 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 122.5 | 177.6 | 25.8 | -31.5 | 0 | 0 | 0 | 110 | R6 | P4-R6 PolarHBondContact O-N 3.4Š|
| 5 | V | 80.7 | Confident | 82.3 | Confident | 131 Ų | 131 | 153.8 Ų | 153.8 | 79% | 0.794 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 124.1 | 175.7 | -178.1 | 0 | 0 | 0 | 0 | 108.3 | R3 | R3-V5 PolarHBondContact O-N 3.25Š|
| 6 | R | 83.8 | Confident | 81.8 | Confident | 216 Ų | 216 | 153 Ų | 153 | 82% | 0.815 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -83.9 | 128.1 | 172.3 | -74.5 | -175.4 | 175.6 | 90.4 | -3 | 109.1 | P4 K8 | P4-R6 PolarHBondContact O-N 3.4Å; R6-K8 PolarHBondContact O-N 3Å |
| 7 | N | 83.2 | Confident | 80.9 | Confident | 154 Ų | 154 | 151.5 Ų | 151.5 | 82% | 0.824 | 75% | 0.75 | S | S | * | * | | | trans | -64.4 | 103.8 | 177 | -60.9 | 16.2 | 0 | 0 | 0 | 109.3 | | |
| 8 | K | 83.9 | Confident | 79.9 | Confident | 201 Ų | 201 | 152.9 Ų | 152.9 | 87% | 0.874 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 122.5 | 171.7 | -64.2 | 178.1 | 178.9 | -179.5 | 0 | 108 | R6 | R6-K8 PolarHBondContact O-N 3Š|
| 9 | K | 87.6 | Confident | 78.9 | Confident | 193 Ų | 193 | 149.6 Ų | 149.6 | 84% | 0.839 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -84.6 | 131.9 | 171.7 | -66.3 | -178.7 | 179.7 | 178.4 | 0 | 108.1 | V11 | K9-V11 PolarHBondContact O-N 2.97Š|
| 10 | V | 85.7 | Confident | 78.1 | Confident | 147 Ų | 147 | 149.1 Ų | 149.1 | 89% | 0.891 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 124 | 172.2 | -178 | 0 | 0 | 0 | 0 | 107.9 | | |
| 11 | V | 89.3 | Confident | 77.2 | Confident | 85 Ų | 85 | 147.4 Ų | 147.4 | 52% | 0.515 | 74% | 0.741 | S | S | . | * | P | Polyproline II helix | trans | -89.6 | 131.2 | 174.9 | 179.7 | 0 | 0 | 0 | 0 | 107.8 | K9 Y13 | K9-V11 PolarHBondContact O-N 2.97Å; V11-Y13 HydrophobicContact CB-CE2 4.2Å; V11-Y13 HydrophobicContact CG1-CE2 4.45Å; V11-Y13 WeakPolarHBondContact O-CD2 3.38Å |
| 12 | N | 89.7 | Confident | 76.8 | Confident | 94 Ų | 94 | 138.7 Ų | 138.7 | 50% | 0.503 | 71% | 0.708 | S | S | . | * | | | trans | -89.7 | 107.5 | 178.5 | -175.1 | -5.1 | 0 | 0 | 0 | 110.1 | S14 | N12-S14 VanDerWaalsContact C-N 3.27Å; N12-S14 PolarHBondContact O-N 3.06Å; N12-S14 WeakPolarHBondContact OD1-CB 3.05Å; N12-S14 PolarHBondContact OD1-N 2.84Å |
| 13 | Y | 83.5 | Confident | 75.9 | Confident | 157 Ų | 157 | 139.4 Ų | 139.4 | 62% | 0.616 | 70% | 0.702 | S | S | * | * | G | 310 helix | trans | -77.4 | -9.4 | 179.5 | -65.6 | -85.7 | 0 | 0 | 0 | 113.9 | V11 Q15 F16 Q17 | V11-Y13 HydrophobicContact CB-CE2 4.2Å; V11-Y13 HydrophobicContact CG1-CE2 4.45Å; V11-Y13 WeakPolarHBondContact O-CD2 3.38Å; Y13-Q15 PolarHBondContact O-N 3.15Å; Y13-Q15 VanDerWaalsContact O-N 3.12Å; Y13-F16 PolarHBondContact O-N 3.1Å; Y13-F16 VanDerWaalsContact O-N 3.08Å; Y13-Q17 PolarHBondContact O-OE1 3.41Å |
| 14 | S | 82.6 | Confident | 74.7 | Confident | 76 Ų | 76 | 136.1 Ų | 136.1 | 53% | 0.531 | 70% | 0.696 | S | S | . | * | G | 310 helix | trans | -57.4 | -26.4 | 174.2 | -172.6 | 0 | 0 | 0 | 0 | 113.6 | N12 F16 | N12-S14 VanDerWaalsContact C-N 3.27Å; N12-S14 PolarHBondContact O-N 3.06Å; N12-S14 WeakPolarHBondContact OD1-CB 3.05Å; N12-S14 PolarHBondContact OD1-N 2.84Å; S14-F16 PolarHBondContact O-N 3.13Å |
| 15 | Q | 79.6 | Confident | 73.6 | Confident | 142 Ų | 142 | 137.6 Ų | 137.6 | 66% | 0.664 | 69% | 0.693 | S | S | * | * | G | 310 helix | trans | -73.6 | -11.7 | -179.2 | -59.4 | -179.4 | 21.9 | 0 | 0 | 113.5 | Y13 | Y13-Q15 PolarHBondContact O-N 3.15Å; Y13-Q15 VanDerWaalsContact O-N 3.12Å |
| 16 | F | 74.1 | Confident | 72.3 | Confident | 141 Ų | 141 | 140.9 Ų | 140.9 | 62% | 0.618 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.8 | -9.7 | -178.2 | -66.2 | -82 | 0 | 0 | 0 | 113.5 | Y13 S14 E18 S19 | Y13-F16 PolarHBondContact O-N 3.1Å; Y13-F16 VanDerWaalsContact O-N 3.08Å; S14-F16 PolarHBondContact O-N 3.13Å; F16-E18 VanDerWaalsContact C-N 3.29Å; F16-E18 PolarHBondContact O-N 3.13Å; F16-S19 PolarHBondContact O-N 3.09Å |
| 17 | Q | 66.9 | Low | 71 | Confident | 127 Ų | 127 | 133.1 Ų | 133.1 | 59% | 0.593 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -69.5 | -21.8 | 176.8 | -90.7 | 105 | 31.9 | 0 | 0 | 113.8 | Y13 S19 D20 | Y13-Q17 PolarHBondContact O-OE1 3.41Å; Q17-S19 PolarHBondContact O-N 2.76Å; Q17-D20 PolarHBondContact O-N 2.8Å |
| 18 | E | 63.4 | Low | 69.6 | Low | 178 Ų | 178 | 136.1 Ų | 136.1 | 83% | 0.832 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -69.7 | -9.3 | 174.9 | -84.7 | 177.2 | 169.3 | 0 | 0 | 113.9 | F16 | F16-E18 VanDerWaalsContact C-N 3.29Å; F16-E18 PolarHBondContact O-N 3.13Å |
| 19 | S | 60.4 | Low | 68 | Low | 90 Ų | 90 | 130.3 Ų | 130.3 | 63% | 0.629 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -98.2 | -9.9 | 179.5 | -57.1 | 0 | 0 | 0 | 0 | 114.3 | F16 Q17 D21 | F16-S19 PolarHBondContact O-N 3.09Å; Q17-S19 PolarHBondContact O-N 2.76Å; S19-D21 VanDerWaalsContact C-N 3.33Å |
| 20 | D | 63.2 | Low | 66.7 | Low | 138 Ų | 138 | 125.3 Ų | 125.3 | 74% | 0.738 | 65% | 0.648 | S | S | * | * | G | 310 helix | trans | -85.2 | -11.1 | 177.5 | -152.2 | 24.7 | 0 | 0 | 0 | 112.1 | Q17 A22 | Q17-D20 PolarHBondContact O-N 2.8Å; D20-A22 PolarHBondContact O-N 2.68Å |
| 21 | D | 58.4 | Low | 65.3 | Low | 115 Ų | 115 | 125.2 Ų | 125.2 | 62% | 0.615 | 64% | 0.642 | S | S | * | * | G | 310 helix | trans | -83.5 | 9.8 | 176 | -145.6 | 17.8 | 0 | 0 | 0 | 112.6 | S19 D23 | S19-D21 VanDerWaalsContact C-N 3.33Å; D21-D23 VanDerWaalsContact C-N 3.34Å |
| 22 | A | 59.2 | Low | 63.9 | Low | 60 Ų | 60 | 128 Ų | 128 | 50% | 0.496 | 65% | 0.647 | S | S | . | * | G | 310 helix | trans | -81.4 | -10 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | D20 | D20-A22 PolarHBondContact O-N 2.68Š|
| 23 | D | 58.4 | Low | 62.3 | Low | 141 Ų | 141 | 129.4 Ų | 129.4 | 75% | 0.754 | 66% | 0.662 | S | S | * | * | G | 310 helix | trans | -77.7 | -17.5 | 179.1 | -93.6 | -3.2 | 0 | 0 | 0 | 113.3 | D21 | D21-D23 VanDerWaalsContact C-N 3.34Š|
| 24 | E | 57.7 | Low | 61 | Low | 158 Ų | 158 | 131.8 Ų | 131.8 | 74% | 0.738 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -79.6 | -21.8 | 178.2 | -62.1 | -163.6 | 167.3 | 0 | 0 | 113.6 | | |
| 25 | E | 54.9 | Low | 60.1 | Low | 146 Ų | 146 | 137.2 Ų | 137.2 | 68% | 0.682 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -82.5 | -17.3 | -178.3 | -170.4 | 163.4 | -159.4 | 0 | 0 | 113.6 | G27 N29 | E25-G27 PolarHBondContact O-N 2.88Å; E25-N29 PolarHBondContact O-ND2 2.68Å |
| 26 | Y | 52.3 | Low | 58.8 | Low | 199 Ų | 199 | 136.6 Ų | 136.6 | 78% | 0.78 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -72 | -25.3 | 179 | -104.5 | -89 | 0 | 0 | 0 | 113.7 | | |
| 27 | G | 57.3 | Low | 58.1 | Low | 54 Ų | 54 | 141 Ų | 141 | 56% | 0.557 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -78.9 | -23.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | E25 S30 | E25-G27 PolarHBondContact O-N 2.88Å; G27-S30 PolarHBondContact O-OG 2.69Å |
| 28 | R | 54.4 | Low | 57.6 | Low | 216 Ų | 216 | 139.2 Ų | 139.2 | 82% | 0.815 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86 | -10.8 | -174.1 | -159.3 | -180 | -175.3 | -97.4 | -0.8 | 114 | | |
| 29 | N | 50.3 | Low | 57.4 | Low | 79 Ų | 79 | 134.7 Ų | 134.7 | 42% | 0.422 | 71% | 0.71 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -102.9 | -1.4 | -173.5 | -75.4 | -64.1 | 0 | 0 | 0 | 114.3 | E25 D31 K32 | E25-N29 PolarHBondContact O-ND2 2.68Å; N29-D31 PolarHBondContact O-N 2.79Å; N29-K32 PolarHBondContact OD1-NZ 2.98Å |
| 30 | S | 58.8 | Low | 57.1 | Low | 88 Ų | 88 | 135.9 Ų | 135.9 | 62% | 0.615 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.6 | -12.5 | -178.2 | 39.6 | 0 | 0 | 0 | 0 | 115.3 | G27 K32 | G27-S30 PolarHBondContact O-OG 2.69Å; S30-K32 VanDerWaalsContact C-N 3.3Å; S30-K32 PolarHBondContact O-N 2.68Å |
| 31 | D | 56.4 | Low | 57 | Low | 145 Ų | 145 | 140.8 Ų | 140.8 | 78% | 0.775 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85 | 7.3 | -176.2 | -63 | -39.1 | 0 | 0 | 0 | 115 | N29 | N29-D31 PolarHBondContact O-N 2.79Š|
| 32 | K | 60.5 | Low | 56.7 | Low | 143 Ų | 143 | 144.1 Ų | 144.1 | 62% | 0.622 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -86.3 | 124.7 | 176.9 | -68 | 163.3 | -175.3 | 158 | 0 | 108.9 | N29 S30 K34 | N29-K32 PolarHBondContact OD1-NZ 2.98Å; S30-K32 VanDerWaalsContact C-N 3.3Å; S30-K32 PolarHBondContact O-N 2.68Å; K32-K34 PolarHBondContact O-N 3.19Å; K32-K34 VanDerWaalsContact O-N 3.14Å |
| 33 | P | 55.4 | Low | 56.6 | Low | 124 Ų | 124 | 147.6 Ų | 147.6 | 81% | 0.805 | 75% | 0.751 | S | S | * | * | | | trans | -60.1 | 122.2 | -176.1 | 23.2 | -32.7 | 0 | 0 | 0 | 110.7 | K35 | P33-K35 PolarHBondContact O-N 3.25Å; P33-K35 VanDerWaalsContact O-N 3.1Å |
| 34 | K | 57.1 | Low | 56.5 | Low | 207 Ų | 207 | 150.2 Ų | 150.2 | 90% | 0.9 | 76% | 0.755 | S | S | * | * | | | trans | -61.7 | 110.4 | 177.9 | -67.4 | -175.4 | -178.7 | 172.8 | 0 | 109.1 | K32 | K32-K34 PolarHBondContact O-N 3.19Å; K32-K34 VanDerWaalsContact O-N 3.14Å |
| 35 | K | 62.9 | Low | 56.3 | Low | 191 Ų | 191 | 154.3 Ų | 154.3 | 83% | 0.83 | 76% | 0.764 | S | S | * | * | | | trans | -63.1 | 132.5 | 166.9 | -66.1 | 178.7 | -178.8 | 175.4 | 0 | 108.2 | P33 R37 | P33-K35 PolarHBondContact O-N 3.25Å; P33-K35 VanDerWaalsContact O-N 3.1Å; K35-R37 PolarHBondContact O-N 3.14Å; K35-R37 VanDerWaalsContact O-N 3.08Å |
| 36 | P | 53 | Low | 56.3 | Low | 128 Ų | 128 | 157 Ų | 157 | 83% | 0.831 | 77% | 0.773 | S | S | * | * | | | trans | -64.3 | 116.4 | 177 | 26.7 | -32.5 | 0 | 0 | 0 | 108.4 | A38 | P36-A38 PolarHBondContact O-N 3.36Å; P36-A38 VanDerWaalsContact O-N 3.12Å |
| 37 | R | 59 | Low | 56.4 | Low | 234 Ų | 234 | 159.2 Ų | 159.2 | 88% | 0.883 | 78% | 0.78 | S | S | * | * | | | trans | -62.6 | 112.9 | 172.1 | 177.9 | 172.6 | 158 | 111.2 | -5.7 | 107 | K35 A39 | K35-R37 PolarHBondContact O-N 3.14Å; K35-R37 VanDerWaalsContact O-N 3.08Å; R37-A39 PolarHBondContact O-N 3.24Å |
| 38 | A | 56.4 | Low | 55.9 | Low | 89 Ų | 89 | 161.2 Ų | 161.2 | 74% | 0.736 | 79% | 0.786 | S | S | * | * | | | trans | -52 | 139.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | P36 | P36-A38 PolarHBondContact O-N 3.36Å; P36-A38 VanDerWaalsContact O-N 3.12Å |
| 39 | A | 59 | Low | 56.1 | Low | 84 Ų | 84 | 159.8 Ų | 159.8 | 69% | 0.694 | 79% | 0.785 | S | S | * | * | | | trans | -48 | 139.1 | -177.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | R37 R41 | R37-A39 PolarHBondContact O-N 3.24Å; A39-R41 PolarHBondContact O-N 3.49Å |
| 40 | P | 55.5 | Low | 56 | Low | 114 Ų | 114 | 163.3 Ų | 163.3 | 74% | 0.74 | 80% | 0.804 | S | S | * | * | | | trans | -61.3 | 115.3 | 178.1 | 25.8 | -31.7 | 0 | 0 | 0 | 108.3 | E42 | P40-E42 PolarHBondContact O-N 3.07Å; P40-E42 VanDerWaalsContact O-N 3.16Å |
| 41 | R | 59.8 | Low | 55.3 | Low | 241 Ų | 241 | 164.6 Ų | 164.6 | 91% | 0.909 | 81% | 0.813 | S | S | * | * | | | trans | -56.1 | 123.9 | 172.3 | -76.1 | -177.6 | 165.5 | 108.3 | -2 | 108.3 | A39 V43 | A39-R41 PolarHBondContact O-N 3.49Å; R41-V43 PolarHBondContact O-N 2.73Å |
| 42 | E | 53.5 | Low | 55 | Low | 185 Ų | 185 | 166.7 Ų | 166.7 | 86% | 0.864 | 82% | 0.818 | S | S | * | * | | | trans | -43.5 | 116.6 | -176.6 | -63.9 | 172.5 | 163.5 | 0 | 0 | 111.5 | P40 K44 | P40-E42 PolarHBondContact O-N 3.07Å; P40-E42 VanDerWaalsContact O-N 3.16Å; E42-K44 PolarHBondContact O-N 3.45Å |
| 43 | V | 55.7 | Low | 54.1 | Low | 133 Ų | 133 | 168.4 Ų | 168.4 | 81% | 0.806 | 83% | 0.829 | S | S | * | * | | | trans | -68.8 | 105.8 | 167.7 | -178.7 | 0 | 0 | 0 | 0 | 105.9 | R41 R45 | R41-V43 PolarHBondContact O-N 2.73Å; V43-R45 PolarHBondContact O-N 3.31Å |
| 44 | K | 56.4 | Low | 54 | Low | 196 Ų | 196 | 170.4 Ų | 170.4 | 85% | 0.852 | 83% | 0.833 | S | S | * | * | | | trans | -44.7 | 103.5 | 172.6 | -68.9 | -179.8 | 176.4 | 177.3 | 0 | 109.4 | E42 K46 | E42-K44 PolarHBondContact O-N 3.45Å; K44-K46 PolarHBondContact O-N 2.91Å |
| 45 | R | 54.7 | Low | 53.7 | Low | 244 Ų | 244 | 166.2 Ų | 166.2 | 92% | 0.921 | 83% | 0.829 | S | S | * | * | | | trans | -63.6 | 117.1 | 172.6 | -65.6 | -178.2 | -178.4 | 177.3 | 0.1 | 107.2 | V43 R47 | V43-R45 PolarHBondContact O-N 3.31Å; R45-R47 PolarHBondContact O-N 3.08Å; R45-R47 VanDerWaalsContact O-N 3.12Å |
| 46 | K | 54.3 | Low | 53 | Low | 202 Ų | 202 | 166.5 Ų | 166.5 | 88% | 0.878 | 83% | 0.833 | S | S | * | * | | | trans | -64.9 | 109.8 | 164.2 | -78.5 | -105.1 | -176.7 | 173.3 | 0 | 106.5 | K44 S48 | K44-K46 PolarHBondContact O-N 2.91Å; K46-S48 PolarHBondContact O-N 3.29Å |
| 47 | R | 55.1 | Low | 52.9 | Low | 247 Ų | 247 | 167.4 Ų | 167.4 | 93% | 0.932 | 83% | 0.831 | S | S | * | * | | | trans | -16.1 | 91.8 | 160.6 | -167.9 | 176.1 | -170.2 | 168.5 | 2.3 | 112.9 | R45 | R45-R47 PolarHBondContact O-N 3.08Å; R45-R47 VanDerWaalsContact O-N 3.12Å |
| 48 | S | 45.4 | Very low | 52.1 | Low | 95 Ų | 95 | 161.9 Ų | 161.9 | 66% | 0.664 | 83% | 0.829 | S | S | * | * | | | trans | -75.8 | 123.5 | 152.6 | 49.4 | 0 | 0 | 0 | 0 | 106.1 | K46 | K46-S48 PolarHBondContact O-N 3.29Š|
| 49 | K | 58.1 | Low | 51.3 | Low | 187 Ų | 187 | 163.7 Ų | 163.7 | 81% | 0.813 | 83% | 0.826 | S | S | * | * | S | Bend | trans | -61.1 | 145.7 | 162.7 | -142.6 | 150.8 | 179.1 | 174 | 0 | 106.4 | | |
| 50 | N | 48.2 | Very low | 50.8 | Low | 153 Ų | 153 | 167.3 Ų | 167.3 | 82% | 0.818 | 83% | 0.829 | S | S | * | * | | | trans | 96.3 | 69.5 | -175.6 | -54 | 55.9 | 0 | 0 | 0 | 114.9 | | |
| 51 | S | 45.7 | Very low | 50.8 | Low | 115 Ų | 115 | 170.6 Ų | 170.6 | 80% | 0.804 | 83% | 0.831 | S | S | * | * | | | trans | -162.7 | 89.2 | 145.9 | 24.7 | 0 | 0 | 0 | 0 | 107.9 | | |
| 52 | Q | 50.3 | Low | 50.2 | Low | 188 Ų | 188 | 167.7 Ų | 167.7 | 88% | 0.879 | 83% | 0.833 | S | S | * | * | | | trans | -139.1 | 60.2 | 165.6 | -169 | -168.4 | -52.7 | 0 | 0 | 107.4 | | |
| 53 | E | 41.6 | Very low | 49.9 | Very low | 180 Ų | 180 | 164.1 Ų | 164.1 | 84% | 0.841 | 83% | 0.828 | S | S | * | * | | | trans | -145 | 78.8 | 166.8 | -72.7 | -171.3 | 137.1 | 0 | 0 | 107.2 | | |
| 54 | D | 53.3 | Low | 49.5 | Very low | 166 Ų | 166 | 167 Ų | 167 | 89% | 0.888 | 83% | 0.83 | S | S | * | * | | | trans | -156.7 | 69.1 | 160.4 | -95.7 | -43.3 | 0 | 0 | 0 | 106.1 | | |
| 55 | S | 50.6 | Low | 49.3 | Very low | 119 Ų | 119 | 162.6 Ų | 162.6 | 83% | 0.832 | 82% | 0.824 | S | S | * | * | | | trans | -175.5 | 73.5 | 162.4 | -88 | 0 | 0 | 0 | 0 | 109.8 | | |
| 56 | E | 48.4 | Very low | 48.7 | Very low | 196 Ų | 196 | 159.3 Ų | 159.3 | 92% | 0.916 | 82% | 0.819 | S | S | * | * | | | trans | -123.6 | 66.7 | 160.5 | -67.4 | -168.9 | 139.5 | 0 | 0 | 108.5 | | |
| 57 | D | 49.8 | Very low | 48.5 | Very low | 147 Ų | 147 | 157.2 Ų | 157.2 | 79% | 0.786 | 82% | 0.817 | S | S | * | * | | | trans | -144.9 | 85 | 157.1 | -164.5 | 29.2 | 0 | 0 | 0 | 108.5 | | |
| 58 | S | 41.7 | Very low | 47.9 | Very low | 118 Ų | 118 | 152.2 Ų | 152.2 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | | | trans | -166.7 | 88.9 | 159.1 | -84.2 | 0 | 0 | 0 | 0 | 108.9 | | |
| 59 | D | 41.3 | Very low | 48 | Very low | 128 Ų | 128 | 152.5 Ų | 152.5 | 68% | 0.684 | 81% | 0.811 | S | S | * | * | | | trans | 19.7 | 120.8 | 133.2 | -94.9 | -80.1 | 0 | 0 | 0 | 118.5 | | |
| 60 | E | 48.4 | Very low | 47.4 | Very low | 160 Ų | 160 | 147.8 Ų | 147.8 | 75% | 0.748 | 81% | 0.807 | S | S | * | * | | | | 68.4 | 122.3 | 125.5 | -134.5 | 116.3 | -119.2 | 0 | 0 | 118.8 | | |
| 61 | K | 54.2 | Low | 47.5 | Very low | 183 Ų | 183 | 148.6 Ų | 148.6 | 80% | 0.796 | 81% | 0.811 | S | S | * | * | | | trans | 93.4 | 91.1 | 158.2 | -40.6 | -137.4 | -174.4 | -162 | 0 | 116.3 | | |
| 62 | L | 46.9 | Very low | 47.9 | Very low | 180 Ų | 180 | 149.6 Ų | 149.6 | 94% | 0.942 | 81% | 0.808 | S | S | * | * | | | | -155.3 | 107.1 | 128.8 | -79.1 | -168.8 | 0 | 0 | 0 | 110.1 | | |
| 63 | S | 48.4 | Very low | 47.8 | Very low | 110 Ų | 110 | 149.1 Ų | 149.1 | 77% | 0.769 | 80% | 0.803 | S | S | * | * | | | trans | -81.2 | 130.8 | 171.4 | 34.8 | 0 | 0 | 0 | 0 | 111.3 | | |
| 64 | K | 46.7 | Very low | 48.1 | Very low | 193 Ų | 193 | 143.5 Ų | 143.5 | 84% | 0.839 | 79% | 0.793 | S | S | * | * | | | trans | 160.4 | 116.9 | 133.2 | -95.5 | 161.8 | 173.4 | 163.2 | 0 | 113.8 | | |
| 65 | S | 51.8 | Low | 47.8 | Very low | 104 Ų | 104 | 141 Ų | 141 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | | | trans | 29.6 | 120.3 | 133.4 | 62.1 | 0 | 0 | 0 | 0 | 119.7 | | |
| 66 | Q | 43.5 | Very low | 47.5 | Very low | 174 Ų | 174 | 142.7 Ų | 142.7 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | | | | -171.9 | 119.2 | 109.6 | -90.1 | -138.9 | -68.4 | 0 | 0 | 110.8 | | |
| 67 | N | 49.9 | Very low | 47.4 | Very low | 158 Ų | 158 | 142 Ų | 142 | 85% | 0.845 | 78% | 0.78 | S | S | * | * | | | trans | -81.8 | 135.7 | 147.6 | -95.7 | -81.1 | 0 | 0 | 0 | 107.1 | | |
| 68 | D | 42.8 | Very low | 47.4 | Very low | 143 Ų | 143 | 138.4 Ų | 138.4 | 77% | 0.765 | 78% | 0.778 | S | S | * | * | | | trans | 154.7 | 136.7 | 162 | -93.4 | -30.5 | 0 | 0 | 0 | 106.4 | | |
| 69 | S | 47 | Very low | 47.8 | Very low | 101 Ų | 101 | 141 Ų | 141 | 71% | 0.706 | 78% | 0.783 | S | S | * | * | | | cis | -167.2 | 139.2 | 11 | 58.5 | 0 | 0 | 0 | 0 | 106.7 | | |
| 70 | A | 45.6 | Very low | 48.5 | Very low | 88 Ų | 88 | 142.1 Ų | 142.1 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | | | | 66.2 | 126.8 | 112.1 | 0 | 0 | 0 | 0 | 0 | 117.9 | | |
| 71 | D | 50.3 | Low | 48.3 | Very low | 169 Ų | 169 | 142.8 Ų | 142.8 | 90% | 0.904 | 79% | 0.79 | S | S | * | * | | | trans | 4.5 | 119.2 | 146.6 | -78.1 | -100.1 | 0 | 0 | 0 | 117.9 | | |
| 72 | D | 52.8 | Low | 48 | Very low | 136 Ų | 136 | 137.7 Ų | 137.7 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | | | trans | -159.5 | 130.7 | 141.7 | -151.7 | 6.2 | 0 | 0 | 0 | 111.9 | | |
| 73 | F | 48.7 | Very low | 48.1 | Very low | 178 Ų | 178 | 136.6 Ų | 136.6 | 78% | 0.781 | 78% | 0.779 | S | S | * | * | | | trans | 85.4 | 71.3 | 175.8 | -59.8 | -77.3 | 0 | 0 | 0 | 119.9 | | |
| 74 | G | 48.3 | Very low | 47.8 | Very low | 62 Ų | 62 | 139.9 Ų | 139.9 | 64% | 0.639 | 78% | 0.782 | S | S | * | * | | | trans | -87.5 | 166.8 | 136.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | | |
| 75 | S | 46.4 | Very low | 47.7 | Very low | 115 Ų | 115 | 136.5 Ų | 136.5 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | | | trans | 74.4 | 142.5 | 175.2 | 83.8 | 0 | 0 | 0 | 0 | 114.1 | | |
| 76 | E | 45 | Very low | 47.7 | Very low | 154 Ų | 154 | 139.3 Ų | 139.3 | 72% | 0.72 | 78% | 0.781 | S | S | * | * | | | cis | -172 | 169.1 | 25.1 | 175.8 | 66.4 | -158.1 | 0 | 0 | 104.4 | | |
| 77 | E | 45.1 | Very low | 47.9 | Very low | 180 Ų | 180 | 138.7 Ų | 138.7 | 84% | 0.841 | 78% | 0.778 | S | S | * | * | | | trans | 93.2 | 106.4 | 148.6 | -139.4 | 108.6 | -144 | 0 | 0 | 118.3 | | |
| 78 | G | 50.4 | Low | 47.8 | Very low | 72 Ų | 72 | 139.2 Ų | 139.2 | 74% | 0.742 | 78% | 0.781 | S | S | * | * | | | trans | 137.4 | 50.2 | 141.4 | 0 | 0 | 0 | 0 | 0 | 119.3 | | |
| 79 | N | 50.6 | Low | 48 | Very low | 174 Ų | 174 | 136 Ų | 136 | 93% | 0.93 | 78% | 0.781 | S | S | * | * | | | trans | -76.1 | 114.1 | 149.8 | -88.4 | 23 | 0 | 0 | 0 | 108.8 | | |
| 80 | D | 56.8 | Low | 47.5 | Very low | 150 Ų | 150 | 134.6 Ų | 134.6 | 80% | 0.802 | 78% | 0.783 | S | S | * | * | | | trans | -153.9 | 99.4 | 164.1 | -157.7 | 34 | 0 | 0 | 0 | 108.8 | | |
| 81 | F | 44.2 | Very low | 47.6 | Very low | 175 Ų | 175 | 136.4 Ų | 136.4 | 77% | 0.768 | 79% | 0.79 | S | S | * | * | | | | 66.2 | 118 | 105 | -152.5 | -94.8 | 0 | 0 | 0 | 115.2 | | |
| 82 | G | 47.4 | Very low | 47.7 | Very low | 76 Ų | 76 | 134.5 Ų | 134.5 | 78% | 0.784 | 78% | 0.779 | S | S | * | * | | | trans | -178.8 | 53.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | | |
| 83 | E | 48.8 | Very low | 47.5 | Very low | 156 Ų | 156 | 137.8 Ų | 137.8 | 73% | 0.729 | 79% | 0.788 | S | S | * | * | | | trans | -62.2 | 168.1 | 155.6 | -174.1 | 166.9 | 177.1 | 0 | 0 | 109.8 | | |
| 84 | E | 42.9 | Very low | 47.2 | Very low | 179 Ų | 179 | 136.7 Ų | 136.7 | 84% | 0.836 | 79% | 0.785 | S | S | * | * | | | trans | 102.8 | 117.8 | -173.6 | -58.6 | 176.7 | -169.6 | 0 | 0 | 112.1 | | |
| 85 | D | 44.3 | Very low | 47.4 | Very low | 122 Ų | 122 | 137.5 Ų | 137.5 | 65% | 0.652 | 79% | 0.786 | S | S | * | * | | | cis | -160.6 | 143 | 17.6 | -134.3 | -48.2 | 0 | 0 | 0 | 110.2 | | |
| 86 | D | 50.2 | Low | 47.8 | Very low | 164 Ų | 164 | 141 Ų | 141 | 88% | 0.877 | 79% | 0.786 | S | S | * | * | | | trans | -96 | 100.3 | 171.9 | -95.5 | -59.1 | 0 | 0 | 0 | 108.6 | | |
| 87 | E | 47.8 | Very low | 48 | Very low | 161 Ų | 161 | 143.9 Ų | 143.9 | 75% | 0.752 | 79% | 0.791 | S | S | * | * | | | trans | -135.5 | 93.1 | 173.3 | -72.7 | 173.6 | 128.8 | 0 | 0 | 113.1 | | |
| 88 | D | 47.7 | Very low | 48.3 | Very low | 169 Ų | 169 | 139 Ų | 139 | 90% | 0.904 | 79% | 0.789 | S | S | * | * | | | | 27.1 | 125.7 | 121.6 | -133.1 | -53.8 | 0 | 0 | 0 | 118.4 | | |
| 89 | G | 47.1 | Very low | 48.6 | Very low | 75 Ų | 75 | 145.1 Ų | 145.1 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | | | trans | 179.1 | 55.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 119.2 | | |
| 90 | G | 38 | Very low | 48.4 | Very low | 72 Ų | 72 | 146.8 Ų | 146.8 | 74% | 0.742 | 79% | 0.794 | S | S | * | * | | | trans | 54.9 | 112.6 | 134.4 | 0 | 0 | 0 | 0 | 0 | 121 | | |
| 91 | S | 48.1 | Very low | 48 | Very low | 125 Ų | 125 | 143 Ų | 143 | 87% | 0.874 | 79% | 0.79 | S | S | * | * | | | trans | -61.4 | 121.4 | 155.8 | 52.9 | 0 | 0 | 0 | 0 | 113.2 | | |
| 92 | D | 51.3 | Low | 48.5 | Very low | 129 Ų | 129 | 144.7 Ų | 144.7 | 69% | 0.69 | 80% | 0.797 | S | S | * | * | | | trans | -162.9 | 111.5 | 154.9 | -169.1 | 8.9 | 0 | 0 | 0 | 112.4 | E94 | D92-E94 PolarHBondContact OD1-N 3.12Š|
| 93 | F | 48.1 | Very low | 48.4 | Very low | 205 Ų | 205 | 147.5 Ų | 147.5 | 90% | 0.899 | 80% | 0.8 | S | S | * | * | | | trans | -149.6 | 87 | 132.9 | -137.2 | -95.4 | 0 | 0 | 0 | 110.4 | | |
| 94 | E | 44 | Very low | 48.1 | Very low | 155 Ų | 155 | 144.4 Ų | 144.4 | 72% | 0.724 | 80% | 0.801 | S | S | * | * | | | trans | -42.5 | 153.1 | 166.5 | -154.1 | -166.4 | -166.4 | 0 | 0 | 115.5 | D92 K96 | D92-E94 PolarHBondContact OD1-N 3.12Å; E94-K96 PolarHBondContact O-N 3.27Å |
| 95 | A | 51.8 | Low | 48.1 | Very low | 79 Ų | 79 | 145.5 Ų | 145.5 | 65% | 0.653 | 80% | 0.803 | S | S | * | * | | | trans | -39.4 | 124.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | | |
| 96 | K | 54.9 | Low | 48.2 | Very low | 188 Ų | 188 | 146.6 Ų | 146.6 | 82% | 0.817 | 81% | 0.814 | S | S | * | * | | | trans | -123.6 | 84.6 | 143.2 | -70 | -163.3 | 178.1 | 171.8 | 0 | 112.4 | E94 | E94-K96 PolarHBondContact O-N 3.27Š|
| 97 | R | 49 | Very low | 47.8 | Very low | 216 Ų | 216 | 143.6 Ų | 143.6 | 82% | 0.815 | 81% | 0.811 | S | S | * | * | | | | 55.3 | 102.5 | 121.8 | -67.8 | 163.3 | 23.6 | 169.2 | -8.7 | 116.9 | | |
| 98 | G | 51.1 | Low | 48.1 | Very low | 78 Ų | 78 | 144.9 Ų | 144.9 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | | | trans | -65.5 | 128 | 147.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 99 | K | 56.8 | Low | 48 | Very low | 200 Ų | 200 | 143 Ų | 143 | 87% | 0.87 | 81% | 0.812 | S | S | * | * | | | trans | 173.3 | 114.7 | 145.7 | -108.9 | 170.3 | 175.8 | 172 | 0 | 109 | | |
| 100 | K | 47.1 | Very low | 48.1 | Very low | 208 Ų | 208 | 145.5 Ų | 145.5 | 90% | 0.904 | 81% | 0.812 | S | S | * | * | | | trans | 165 | 98.9 | 132.1 | -87.7 | 164.7 | -171.5 | -174.2 | 0 | 109 | | |
| 101 | G | 48.2 | Very low | 48.7 | Very low | 71 Ų | 71 | 152 Ų | 152 | 73% | 0.732 | 82% | 0.82 | S | S | * | * | | | trans | -71.2 | 143.8 | 149 | 0 | 0 | 0 | 0 | 0 | 108.9 | | |
| 102 | K | 54.4 | Low | 48.8 | Very low | 210 Ų | 210 | 157.4 Ų | 157.4 | 91% | 0.913 | 82% | 0.821 | S | S | * | * | | | trans | -173.8 | 139.1 | 144.4 | -101.2 | 164.7 | -174.6 | -172.5 | 0 | 109.8 | | |
| 103 | T | 45.7 | Very low | 48.8 | Very low | 136 Ų | 136 | 157 Ų | 157 | 83% | 0.834 | 82% | 0.823 | S | S | * | * | | | trans | -52.4 | 147.7 | -177.4 | 52.1 | 0 | 0 | 0 | 0 | 115.8 | | |
| 104 | A | 40.9 | Very low | 48.7 | Very low | 91 Ų | 91 | 153.5 Ų | 153.5 | 75% | 0.752 | 82% | 0.821 | S | S | * | * | | | trans | -171.9 | 113.9 | 135.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 105 | K | 44.7 | Very low | 49.1 | Very low | 202 Ų | 202 | 155.4 Ų | 155.4 | 88% | 0.878 | 83% | 0.827 | S | S | * | * | | | | 49.3 | 112.6 | 129.1 | -57.5 | 179.9 | -178.7 | 176.7 | 0 | 120.5 | | |
| 106 | V | 46.2 | Very low | 49.1 | Very low | 145 Ų | 145 | 161.7 Ų | 161.7 | 88% | 0.879 | 83% | 0.834 | S | S | * | * | | | trans | 18.2 | 114.6 | 131.4 | -175.5 | 0 | 0 | 0 | 0 | 117.4 | | |
| 107 | A | 41.9 | Very low | 49 | Very low | 100 Ų | 100 | 162.1 Ų | 162.1 | 83% | 0.826 | 84% | 0.836 | S | S | * | * | | | trans | -151.1 | 139.6 | 146.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | | |
| 108 | K | 52.4 | Low | 49 | Very low | 188 Ų | 188 | 161.7 Ų | 161.7 | 82% | 0.817 | 83% | 0.834 | S | S | * | * | | | trans | -68.5 | 154.5 | -164.8 | -58.1 | 164 | -179.3 | 172.7 | 0 | 113.5 | T110 | K108-T110 PolarHBondContact O-N 3.49Š|
| 109 | P | 47 | Very low | 49 | Very low | 130 Ų | 130 | 163.9 Ų | 163.9 | 84% | 0.844 | 83% | 0.834 | S | S | * | * | | | trans | -81.9 | 113.8 | 172.7 | 31.9 | -30.7 | 0 | 0 | 0 | 110.9 | | |
| 110 | T | 48.9 | Very low | 48.7 | Very low | 128 Ų | 128 | 158.8 Ų | 158.8 | 79% | 0.785 | 83% | 0.829 | S | S | * | * | | | trans | -81.7 | 116.6 | 170.9 | 61.9 | 0 | 0 | 0 | 0 | 110 | K108 R112 | K108-T110 PolarHBondContact O-N 3.49Å; T110-R112 PolarHBondContact O-N 3.06Å |
| 111 | K | 50.9 | Low | 48.5 | Very low | 207 Ų | 207 | 156.7 Ų | 156.7 | 90% | 0.9 | 83% | 0.828 | S | S | * | * | | | trans | -58.8 | 124 | 172 | -62 | 168.8 | 178.8 | 177.3 | 0 | 110.8 | | |
| 112 | R | 49.6 | Very low | 48.2 | Very low | 239 Ų | 239 | 160.3 Ų | 160.3 | 90% | 0.902 | 83% | 0.831 | S | S | * | * | | | trans | -141.4 | 139 | 159.3 | -67.4 | -174.2 | 71.5 | 153.3 | -1.9 | 110.5 | T110 | T110-R112 PolarHBondContact O-N 3.06Š|
| 113 | T | 51.8 | Low | 47.4 | Very low | 120 Ų | 120 | 155.1 Ų | 155.1 | 74% | 0.736 | 82% | 0.821 | S | S | * | * | | | trans | -73 | 154.2 | -164.6 | 48.5 | 0 | 0 | 0 | 0 | 114.7 | K115 | T113-K115 PolarHBondContact O-N 3.06Š|
| 114 | P | 45.5 | Very low | 47.6 | Very low | 132 Ų | 132 | 156.7 Ų | 156.7 | 86% | 0.857 | 82% | 0.824 | S | S | * | * | | | trans | -85.5 | 110 | 173.4 | 32.1 | -28.2 | 0 | 0 | 0 | 110.5 | | |
| 115 | K | 53.1 | Low | 48 | Very low | 195 Ų | 195 | 160.9 Ų | 160.9 | 85% | 0.848 | 83% | 0.828 | S | S | * | * | | | trans | -78.8 | 120.6 | 168.6 | -76.5 | -169.1 | 177.5 | -178 | 0 | 109.9 | T113 K117 | T113-K115 PolarHBondContact O-N 3.06Å; K115-K117 PolarHBondContact O-N 3.16Å |
| 116 | R | 50.6 | Low | 48.2 | Very low | 211 Ų | 211 | 158.1 Ų | 158.1 | 80% | 0.796 | 82% | 0.819 | S | S | * | * | | | trans | -42 | 124.6 | 162.4 | -117.7 | 169.2 | 56.9 | 159.5 | -1.8 | 111.8 | | |
| 117 | K | 53.2 | Low | 48.5 | Very low | 197 Ų | 197 | 159 Ų | 159 | 86% | 0.857 | 82% | 0.824 | S | S | * | * | | | trans | -137.4 | 114.3 | 151.9 | -75 | -66.3 | -176 | 171.4 | 0 | 108.3 | K115 | K115-K117 PolarHBondContact O-N 3.16Š|
| 118 | R | 49.6 | Very low | 49.3 | Very low | 207 Ų | 207 | 156.9 Ų | 156.9 | 78% | 0.781 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 136.3 | 158 | -70.7 | -176.8 | 161.5 | 107.7 | -0.2 | 106.8 | | |
| 119 | P | 51.2 | Low | 49.6 | Very low | 125 Ų | 125 | 158.8 Ų | 158.8 | 81% | 0.812 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -93.2 | 123.4 | 145.9 | 30.5 | -24.7 | 0 | 0 | 0 | 108.6 | | |
| 120 | A | 49 | Very low | 49.9 | Very low | 92 Ų | 92 | 160.9 Ų | 160.9 | 76% | 0.76 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 147.2 | 154.7 | 0 | 0 | 0 | 0 | 0 | 107 | | |
| 121 | D | 44 | Very low | 50.4 | Low | 164 Ų | 164 | 161.6 Ų | 161.6 | 88% | 0.877 | 81% | 0.805 | S | S | * | * | | | trans | 67.9 | 109.5 | 171.6 | -105.2 | 23.3 | 0 | 0 | 0 | 116.9 | | |
| 122 | D | 40.9 | Very low | 51 | Low | 147 Ų | 147 | 162.4 Ų | 162.4 | 79% | 0.786 | 80% | 0.802 | S | S | * | * | | | | -176.9 | 133 | 110.4 | -144.7 | -23.1 | 0 | 0 | 0 | 111.4 | | |
| 123 | S | 37.8 | Very low | 51.6 | Low | 101 Ų | 101 | 157.2 Ų | 157.2 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | | | trans | 70.8 | 111.2 | 152.9 | -67.9 | 0 | 0 | 0 | 0 | 122.2 | E125 | S123-E125 PolarHBondContact O-N 3.29Š|
| 124 | D | 50.4 | Low | 52.2 | Low | 170 Ų | 170 | 156.5 Ų | 156.5 | 91% | 0.909 | 79% | 0.792 | S | S | * | * | | | trans | -86.3 | 56.9 | 170.3 | -172.8 | 39.8 | 0 | 0 | 0 | 112 | | |
| 125 | E | 50.2 | Low | 52.8 | Low | 178 Ų | 178 | 160.5 Ų | 160.5 | 83% | 0.832 | 79% | 0.79 | S | S | * | * | | | trans | -150.1 | 140.6 | 175.3 | -151 | 119.2 | -155.6 | 0 | 0 | 110.8 | S123 | S123-E125 PolarHBondContact O-N 3.29Š|
| 126 | E | 47.4 | Very low | 53.3 | Low | 145 Ų | 145 | 159 Ų | 159 | 68% | 0.678 | 79% | 0.786 | S | S | * | * | | | trans | 82.4 | 63.2 | 177 | -57.1 | -162 | 126.5 | 0 | 0 | 119.9 | S128 | E126-S128 PolarHBondContact O-N 2.96Š|
| 127 | V | 53 | Low | 53.6 | Low | 164 Ų | 164 | 153 Ų | 153 | 99% | 0.994 | 78% | 0.782 | S | S | * | * | | | trans | -84.5 | 60.2 | 146.6 | -70.6 | 0 | 0 | 0 | 0 | 111.4 | | |
| 128 | S | 58.5 | Low | 53.9 | Low | 54 Ų | 54 | 146.9 Ų | 146.9 | 38% | 0.378 | 77% | 0.768 | S | S | . | * | | | trans | -122.7 | 122.2 | 170.8 | 51.9 | 0 | 0 | 0 | 0 | 111 | E126 | E126-S128 PolarHBondContact O-N 2.96Š|
| 129 | R | 59.5 | Low | 54.5 | Low | 229 Ų | 229 | 140.3 Ų | 140.3 | 86% | 0.864 | 75% | 0.751 | S | S | * | * | S | Bend | trans | 70.8 | 48.6 | 159.4 | -57.1 | -178.4 | -81.3 | -167.2 | -5.1 | 118.8 | | |
| 130 | K | 53.1 | Low | 55.6 | Low | 174 Ų | 174 | 141.9 Ų | 141.9 | 76% | 0.757 | 75% | 0.745 | S | S | * | * | | | trans | -119.4 | 63.9 | 153.2 | -68 | 100.5 | 178.5 | -179.9 | 0 | 112 | R132 | K130-R132 PolarHBondContact O-N 3.1Š|
| 131 | V | 59.2 | Low | 56.8 | Low | 143 Ų | 143 | 140.5 Ų | 140.5 | 87% | 0.867 | 73% | 0.734 | S | S | * | * | | | trans | -74.7 | 72.1 | 163.5 | -175.2 | 0 | 0 | 0 | 0 | 108.1 | | |
| 132 | R | 64.3 | Low | 58.4 | Low | 223 Ų | 223 | 136.4 Ų | 136.4 | 84% | 0.842 | 72% | 0.715 | S | S | * | * | | | trans | -128.4 | 108.6 | 178 | -134.1 | 173 | -176.1 | 118.2 | -2.3 | 109.2 | K130 | K130-R132 PolarHBondContact O-N 3.1Š|
| 133 | T | 62.1 | Low | 60.1 | Low | 131 Ų | 131 | 132.8 Ų | 132.8 | 80% | 0.804 | 70% | 0.701 | S | S | * | * | | | trans | 80.2 | 65 | 171.5 | 72.8 | 0 | 0 | 0 | 0 | 117 | R135 | T133-R135 PolarHBondContact O-N 3.32Š|
| 134 | V | 63.5 | Low | 62.2 | Low | 105 Ų | 105 | 133.9 Ų | 133.9 | 64% | 0.636 | 69% | 0.693 | S | S | * | * | | | trans | -61.5 | 121 | 155.9 | 179.5 | 0 | 0 | 0 | 0 | 108 | Q136 T139 | V134-Q136 PolarHBondContact O-N 3.32Å; V134-T139 HydrophobicContact CG1-CG2 3.61Å |
| 135 | R | 58.7 | Low | 63.8 | Low | 215 Ų | 215 | 132 Ų | 132 | 81% | 0.811 | 68% | 0.679 | S | S | * | * | | | trans | -61.7 | 116.5 | 178.9 | -66.9 | 176.6 | -179.4 | -173.4 | 0.2 | 109.4 | T133 A137 A138 | T133-R135 PolarHBondContact O-N 3.32Å; R135-A137 PolarHBondContact O-N 3.22Å; R135-A138 PolarHBondContact O-N 3.4Å |
| 136 | Q | 62.6 | Low | 65.2 | Low | 163 Ų | 163 | 131.8 Ų | 131.8 | 76% | 0.762 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -57.3 | -14.1 | -176.8 | -67.2 | -176.8 | -22.7 | 0 | 0 | 115.3 | V134 T139 K140 | V134-Q136 PolarHBondContact O-N 3.32Å; Q136-T139 PolarHBondContact O-OG1 3.45Å; Q136-K140 WeakPolarHBondContact O-CG 3.2Å |
| 137 | A | 57.3 | Low | 66.7 | Low | 85 Ų | 85 | 130.6 Ų | 130.6 | 70% | 0.702 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -74.8 | -35.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113 | R135 | R135-A137 PolarHBondContact O-N 3.22Å |
| 138 | A | 60.3 | Low | 67.8 | Low | 70 Ų | 70 | 128.9 Ų | 128.9 | 58% | 0.579 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -80.2 | -28.2 | -176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | R135 K140 | R135-A138 PolarHBondContact O-N 3.4Å; A138-K140 VanDerWaalsContact C-N 3.33Å; A138-K140 PolarHBondContact O-N 2.97Å |
| 139 | T | 61.3 | Low | 68.5 | Low | 68 Ų | 68 | 133.5 Ų | 133.5 | 42% | 0.417 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -73.7 | -23 | -178.6 | 54.5 | 0 | 0 | 0 | 0 | 113.2 | V134 Q136 S143 | V134-T139 HydrophobicContact CG1-CG2 3.61Å; Q136-T139 PolarHBondContact O-OG1 3.45Å; T139-S143 WeakPolarHBondContact O-CB 3.35Å; T139-S143 PolarHBondContact O-N 3.46Å |
| 140 | K | 75.4 | Confident | 69.2 | Low | 158 Ų | 158 | 129.3 Ų | 129.3 | 69% | 0.687 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -71.1 | -35.3 | 179.6 | -64.9 | -175.6 | 74.2 | 155.8 | 0 | 112.8 | Q136 A138 K144 | Q136-K140 WeakPolarHBondContact O-CG 3.2Å; A138-K140 VanDerWaalsContact C-N 3.33Å; A138-K140 PolarHBondContact O-N 2.97Å; K140-K144 WeakPolarHBondContact O-CB 3.08Å; K140-K144 PolarHBondContact O-N 2.9Å |
| 141 | A | 73 | Confident | 69.7 | Low | 64 Ų | 64 | 123.7 Ų | 123.7 | 53% | 0.529 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -67.6 | -45.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | K144 Q145 | A141-K144 PolarHBondContact O-N 3.33Å; A141-Q145 PolarHBondContact O-N 3.07Å |
| 142 | V | 78.4 | Confident | 69.7 | Low | 78 Ų | 78 | 124.5 Ų | 124.5 | 47% | 0.473 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -69.1 | -36 | 177.8 | -178.6 | 0 | 0 | 0 | 0 | 111.7 | Q145 R146 | V142-Q145 PolarHBondContact O-N 3.49Å; V142-R146 PolarHBondContact O-N 3.04Å |
| 143 | S | 77.3 | Confident | 69.7 | Low | 70 Ų | 70 | 117 Ų | 117 | 49% | 0.49 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -64.8 | -39.2 | 174 | -171.2 | 0 | 0 | 0 | 0 | 111.9 | T139 R146 E147 | T139-S143 WeakPolarHBondContact O-CB 3.35Å; T139-S143 PolarHBondContact O-N 3.46Å; S143-R146 PolarHBondContact O-N 2.87Å; S143-E147 WeakPolarHBondContact O-CB 3.34Å; S143-E147 PolarHBondContact O-N 2.91Å |
| 144 | K | 80.3 | Confident | 69.5 | Low | 124 Ų | 124 | 114.5 Ų | 114.5 | 54% | 0.539 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -71.2 | -33.3 | 177.5 | -165 | 166.3 | -178.9 | 66.3 | 0 | 112.1 | K140 A141 E147 I148 | K140-K144 WeakPolarHBondContact O-CB 3.08Å; K140-K144 PolarHBondContact O-N 2.9Å; A141-K144 PolarHBondContact O-N 3.33Å; K144-E147 PolarHBondContact O-N 3.32Å; K144-I148 WeakPolarHBondContact O-CG1 3.39Å; K144-I148 PolarHBondContact O-N 2.86Å; K144-I148 VanDerWaalsContact O-N 3.14Å |
| 145 | Q | 83.6 | Confident | 68.9 | Low | 132 Ų | 132 | 115 Ų | 115 | 62% | 0.617 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -65.3 | -43.1 | 169.4 | -76.4 | -176.6 | -34.8 | 0 | 0 | 111.9 | A141 V142 E147 I148 L149 | A141-Q145 PolarHBondContact O-N 3.07Å; V142-Q145 PolarHBondContact O-N 3.49Å; Q145-E147 VanDerWaalsContact C-N 3.33Å; Q145-I148 PolarHBondContact O-N 3.49Å; Q145-L149 PolarHBondContact O-N 3.43Å |
| 146 | R | 80.7 | Confident | 68.4 | Low | 173 Ų | 173 | 112.8 Ų | 112.8 | 65% | 0.653 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -64.2 | -37.2 | 173.3 | -80.6 | -170.8 | -172.7 | -174.3 | 0.4 | 112.5 | V142 S143 L149 L150 | V142-R146 PolarHBondContact O-N 3.04Å; S143-R146 PolarHBondContact O-N 2.87Å; R146-L149 PolarHBondContact O-N 3.14Å; R146-L150 HydrophobicContact CB-CD1 4.09Å; R146-L150 HydrophobicContact CG-CD1 4.3Å; R146-L150 WeakPolarHBondContact O-CB 3.18Å; R146-L150 WeakPolarHBondContact O-CD1 3.39Å; R146-L150 PolarHBondContact O-N 3.32Å |
| 147 | E | 78.1 | Confident | 67.6 | Low | 119 Ų | 119 | 111.9 Ų | 111.9 | 56% | 0.556 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -61.9 | -41.4 | 176.8 | -174.6 | -173.9 | 167.7 | 0 | 0 | 111.9 | S143 K144 Q145 L149 G151 | S143-E147 WeakPolarHBondContact O-CB 3.34Å; S143-E147 PolarHBondContact O-N 2.91Å; K144-E147 PolarHBondContact O-N 3.32Å; Q145-E147 VanDerWaalsContact C-N 3.33Å; E147-L149 VanDerWaalsContact C-N 3.32Å; E147-L149 PolarHBondContact O-N 2.74Å; E147-G151 WeakPolarHBondContact O-CA 3.37Å; E147-G151 PolarHBondContact O-N 2.84Å |
| 148 | I | 76.8 | Confident | 67 | Low | 128 Ų | 128 | 115.3 Ų | 115.3 | 66% | 0.656 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -68.9 | -34.4 | 175.4 | -62 | 161.6 | 0 | 0 | 0 | 111.2 | K144 Q145 | K144-I148 WeakPolarHBondContact O-CG1 3.39Å; K144-I148 PolarHBondContact O-N 2.86Å; K144-I148 VanDerWaalsContact O-N 3.14Å; Q145-I148 PolarHBondContact O-N 3.49Å |
| 149 | L | 73.3 | Confident | 66.1 | Low | 152 Ų | 152 | 120.2 Ų | 120.2 | 80% | 0.796 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -80.4 | -24.3 | -177.4 | -124 | 132.9 | 0 | 0 | 0 | 114.2 | Q145 R146 E147 | Q145-L149 PolarHBondContact O-N 3.43Å; R146-L149 PolarHBondContact O-N 3.14Å; E147-L149 VanDerWaalsContact C-N 3.32Å; E147-L149 PolarHBondContact O-N 2.74Å |
| 150 | L | 74.4 | Confident | 65.3 | Low | 140 Ų | 140 | 128.5 Ų | 128.5 | 73% | 0.733 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -122.4 | -9.1 | -176.1 | -73.6 | 122 | 0 | 0 | 0 | 113.9 | R146 | R146-L150 HydrophobicContact CB-CD1 4.09Å; R146-L150 HydrophobicContact CG-CD1 4.3Å; R146-L150 WeakPolarHBondContact O-CB 3.18Å; R146-L150 WeakPolarHBondContact O-CD1 3.39Å; R146-L150 PolarHBondContact O-N 3.32Å |
| 151 | G | 62.7 | Low | 63.6 | Low | 56 Ų | 56 | 130 Ų | 130 | 58% | 0.577 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -101.2 | 3.2 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | E147 G153 | E147-G151 WeakPolarHBondContact O-CA 3.37Å; E147-G151 PolarHBondContact O-N 2.84Å; G151-G153 PolarHBondContact O-N 3.44Å |
| 152 | D | 60.5 | Low | 61.9 | Low | 160 Ų | 160 | 134.3 Ų | 134.3 | 86% | 0.856 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -87.2 | 30.3 | 172.7 | -161.5 | 30 | 0 | 0 | 0 | 112.2 | | |
| 153 | G | 64.3 | Low | 60 | Low | 66 Ų | 66 | 139.2 Ų | 139.2 | 68% | 0.68 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -137.8 | 73 | -173.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | G151 | G151-G153 PolarHBondContact O-N 3.44Š|
| 154 | G | 56.8 | Low | 58.2 | Low | 78 Ų | 78 | 143.9 Ų | 143.9 | 80% | 0.804 | 74% | 0.742 | S | S | * | * | | | trans | 82.9 | 99.5 | 154.7 | 0 | 0 | 0 | 0 | 0 | 117.3 | | |
| 155 | S | 51.3 | Low | 56.4 | Low | 116 Ų | 116 | 145.6 Ų | 145.6 | 81% | 0.811 | 75% | 0.751 | S | S | * | * | | | trans | -152 | 72.1 | 139.1 | 70.9 | 0 | 0 | 0 | 0 | 108.8 | D157 | S155-D157 PolarHBondContact O-N 3.32Å; S155-D157 VanDerWaalsContact O-N 3.09Å |
| 156 | E | 47.7 | Very low | 54.9 | Low | 168 Ų | 168 | 144.2 Ų | 144.2 | 79% | 0.785 | 76% | 0.763 | S | S | * | * | | | trans | -70.9 | 90.3 | 158.3 | -149.2 | 173 | 178 | 0 | 0 | 106 | E158 | E156-E158 HydrophobicContact CG-CG 3.91Å; E156-E158 PolarHBondContact O-N 3Å; E156-E158 VanDerWaalsContact O-N 3.1Å |
| 157 | D | 45.3 | Very low | 52.9 | Low | 145 Ų | 145 | 143.9 Ų | 143.9 | 78% | 0.775 | 77% | 0.766 | S | S | * | * | | | trans | -76.9 | 75.5 | 167.5 | -175.4 | 58.1 | 0 | 0 | 0 | 106.1 | S155 E159 | S155-D157 PolarHBondContact O-N 3.32Å; S155-D157 VanDerWaalsContact O-N 3.09Å; D157-E159 PolarHBondContact O-N 3.33Å; D157-E159 VanDerWaalsContact O-N 3.15Å |
| 158 | E | 45.4 | Very low | 51.7 | Low | 156 Ų | 156 | 144 Ų | 144 | 73% | 0.729 | 78% | 0.777 | S | S | * | * | | | trans | -72.1 | 105.1 | 167.3 | -67.8 | -151.3 | 140.7 | 0 | 0 | 108.3 | E156 R160 | E156-E158 HydrophobicContact CG-CG 3.91Å; E156-E158 PolarHBondContact O-N 3Å; E156-E158 VanDerWaalsContact O-N 3.1Å; E158-R160 PolarHBondContact O-N 3.24Å |
| 159 | E | 42.2 | Very low | 50.6 | Low | 173 Ų | 173 | 145.1 Ų | 145.1 | 81% | 0.808 | 79% | 0.785 | S | S | * | * | | | trans | -48.8 | 105.2 | 161.1 | -75.6 | -178.4 | 148.1 | 0 | 0 | 109.9 | D157 E161 | D157-E159 PolarHBondContact O-N 3.33Å; D157-E159 VanDerWaalsContact O-N 3.15Å; E159-E161 PolarHBondContact O-N 3.19Å |
| 160 | R | 44.7 | Very low | 49.7 | Very low | 243 Ų | 243 | 143.3 Ų | 143.3 | 92% | 0.917 | 78% | 0.782 | S | S | * | * | | | trans | -17.8 | 100.5 | 135.7 | -165.4 | -171.6 | -146.4 | 179.8 | 5.8 | 112.8 | E158 | E158-R160 PolarHBondContact O-N 3.24Š|
| 161 | E | 38.1 | Very low | 48.7 | Very low | 188 Ų | 188 | 143.7 Ų | 143.7 | 88% | 0.879 | 79% | 0.785 | S | S | * | * | | | trans | -147.8 | 126.3 | 154.3 | -125.6 | 172.7 | -152 | 0 | 0 | 111.2 | E159 | E159-E161 PolarHBondContact O-N 3.19Š|
| 162 | D | 37.5 | Very low | 48.1 | Very low | 155 Ų | 155 | 150 Ų | 150 | 83% | 0.829 | 80% | 0.799 | S | S | * | * | | | trans | -54.4 | 133 | -179.6 | -58.4 | -68.7 | 0 | 0 | 0 | 114 | | |
| 163 | K | 39 | Very low | 48.1 | Very low | 181 Ų | 181 | 148.1 Ų | 148.1 | 79% | 0.787 | 80% | 0.799 | S | S | * | * | | | | 175.1 | 147.6 | 127.4 | -108.9 | 164.9 | 177.9 | 167.8 | 0 | 114 | | |
| 164 | E | 40.5 | Very low | 47.6 | Very low | 168 Ų | 168 | 148.6 Ų | 148.6 | 79% | 0.785 | 80% | 0.803 | S | S | * | * | | | trans | 73.5 | 110.3 | 156.8 | -71.3 | 162.4 | -164.5 | 0 | 0 | 113.2 | | |
| 165 | E | 42.1 | Very low | 47.3 | Very low | 160 Ų | 160 | 150.5 Ų | 150.5 | 75% | 0.748 | 81% | 0.805 | S | S | * | * | | | cis | -155.5 | 133.6 | 35.3 | -85.6 | 157.9 | 153 | 0 | 0 | 110.3 | F167 | E165-F167 HydrophobicContact CB-CD2 4.12Å; E165-F167 HydrophobicContact CB-CE2 4.46Å; E165-F167 HydrophobicContact CG-CE2 4.4Å |
| 166 | A | 51.5 | Low | 47.1 | Very low | 103 Ų | 103 | 152.2 Ų | 152.2 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | | | trans | -93.2 | 97.4 | 161.9 | 0 | 0 | 0 | 0 | 0 | 108 | | |
| 167 | F | 38.8 | Very low | 47.5 | Very low | 166 Ų | 166 | 152.4 Ų | 152.4 | 73% | 0.728 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -100.2 | 116.9 | 156.7 | -85.7 | -86.8 | 0 | 0 | 0 | 107.3 | E165 | E165-F167 HydrophobicContact CB-CD2 4.12Å; E165-F167 HydrophobicContact CB-CE2 4.46Å; E165-F167 HydrophobicContact CG-CE2 4.4Å |
| 168 | P | 52.5 | Low | 48.2 | Very low | 122 Ų | 122 | 153 Ų | 153 | 79% | 0.792 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 121.6 | 170 | 30.2 | -29 | 0 | 0 | 0 | 110.4 | | |
| 169 | D | 53.3 | Low | 48.7 | Very low | 151 Ų | 151 | 154.9 Ų | 154.9 | 81% | 0.807 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 158.7 | 172.1 | -69.3 | -47.8 | 0 | 0 | 0 | 113.2 | | |
| 170 | P | 55.1 | Low | 49.5 | Very low | 114 Ų | 114 | 154.8 Ų | 154.8 | 74% | 0.74 | 82% | 0.817 | S | S | * | * | | | trans | -126.3 | 5.1 | 156.7 | 37 | -25.1 | 0 | 0 | 0 | 117.5 | | |
| 171 | D | 53.8 | Low | 50.3 | Low | 148 Ų | 148 | 149.8 Ų | 149.8 | 79% | 0.791 | 81% | 0.812 | S | S | * | * | | | trans | -145.6 | 47.6 | -169.1 | -72.3 | -56.2 | 0 | 0 | 0 | 118.1 | | |
| 172 | E | 50.6 | Low | 50.9 | Low | 189 Ų | 189 | 149.8 Ų | 149.8 | 88% | 0.883 | 81% | 0.813 | S | S | * | * | | | trans | -130.7 | 85.1 | 155.6 | -71.8 | -170.1 | 170.1 | 0 | 0 | 108.5 | | |
| 173 | S | 59.3 | Low | 51.5 | Low | 121 Ų | 121 | 149.7 Ų | 149.7 | 85% | 0.846 | 81% | 0.812 | S | S | * | * | | | | 61 | 102.9 | 90.9 | -165.2 | 0 | 0 | 0 | 0 | 111.7 | | |
| 174 | G | 53.6 | Low | 52.2 | Low | 75 Ų | 75 | 148.2 Ų | 148.2 | 77% | 0.773 | 81% | 0.813 | S | S | * | * | | | trans | -80.4 | 166.5 | -162.3 | 0 | 0 | 0 | 0 | 0 | 117.2 | | |
| 175 | S | 50.6 | Low | 53 | Low | 119 Ų | 119 | 145.7 Ų | 145.7 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | | | trans | 171.2 | 73.9 | 148.1 | 172 | 0 | 0 | 0 | 0 | 108.6 | | |
| 176 | D | 47.6 | Very low | 53.9 | Low | 152 Ų | 152 | 145.4 Ų | 145.4 | 81% | 0.813 | 81% | 0.808 | S | S | * | * | | | trans | -125.6 | 58.3 | 165.4 | -173.5 | 31.3 | 0 | 0 | 0 | 108.6 | | |
| 177 | E | 56.7 | Low | 54.3 | Low | 171 Ų | 171 | 144.7 Ų | 144.7 | 80% | 0.799 | 80% | 0.797 | S | S | * | * | | | trans | -111.7 | 122.8 | 165.7 | -71.1 | 178.1 | 160.3 | 0 | 0 | 105.9 | | |
| 178 | D | 58.7 | Low | 55.2 | Low | 157 Ų | 157 | 144.2 Ų | 144.2 | 84% | 0.84 | 80% | 0.802 | S | S | * | * | S | Bend | trans | 101.5 | 27.3 | 158.5 | -47.3 | -28.1 | 0 | 0 | 0 | 121.2 | | |
| 179 | F | 56.3 | Low | 55.2 | Low | 196 Ų | 196 | 149.6 Ų | 149.6 | 86% | 0.86 | 81% | 0.808 | S | S | * | * | | | trans | -126.1 | 47.8 | 158.2 | -154.2 | -97.8 | 0 | 0 | 0 | 114 | | |
| 180 | M | 59.1 | Low | 55.3 | Low | 172 Ų | 172 | 145.4 Ų | 145.4 | 85% | 0.847 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -128.1 | 121.8 | 160.6 | -69.7 | -82.1 | 172 | 0 | 0 | 107.1 | | |
| 181 | V | 61.6 | Low | 55.4 | Low | 137 Ų | 137 | 151.6 Ų | 151.6 | 83% | 0.83 | 81% | 0.809 | S | S | * | * | | | trans | 96.3 | 91.7 | 172.4 | -171 | 0 | 0 | 0 | 0 | 115.3 | | |
| 182 | E | 51.8 | Low | 55.4 | Low | 189 Ų | 189 | 149.4 Ų | 149.4 | 88% | 0.883 | 81% | 0.806 | S | S | * | * | | | trans | 178.9 | 81.4 | 131.2 | -101 | 163.8 | -178 | 0 | 0 | 109.9 | | |
| 183 | D | 48.2 | Very low | 55.7 | Low | 152 Ų | 152 | 150.3 Ų | 150.3 | 81% | 0.813 | 81% | 0.807 | S | S | * | * | | | | -166.9 | 81.7 | 124.3 | -135.1 | -2.2 | 0 | 0 | 0 | 108.9 | D185 | D183-D185 PolarHBondContact O-N 3.27Å; D183-D185 VanDerWaalsContact O-N 3.13Å |
| 184 | D | 54.5 | Low | 55.6 | Low | 151 Ų | 151 | 149.6 Ų | 149.6 | 81% | 0.807 | 80% | 0.802 | S | S | * | * | | | trans | -75.1 | 70.7 | 159.9 | -173.9 | 20.8 | 0 | 0 | 0 | 108.1 | | |
| 185 | D | 57.7 | Low | 55.8 | Low | 115 Ų | 115 | 156.1 Ų | 156.1 | 62% | 0.615 | 81% | 0.809 | S | S | * | * | | | trans | -112.3 | 61.7 | 163.7 | -164.3 | 7.1 | 0 | 0 | 0 | 110.4 | D183 S187 | D183-D185 PolarHBondContact O-N 3.27Å; D183-D185 VanDerWaalsContact O-N 3.13Å; D185-S187 PolarHBondContact O-N 2.94Å; D185-S187 PolarHBondContact OD1-OG 3.19Å |
| 186 | D | 60.4 | Low | 56.2 | Low | 153 Ų | 153 | 162 Ų | 162 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | | | trans | -76 | 87.1 | 161.5 | -94.3 | -20.8 | 0 | 0 | 0 | 109.5 | | |
| 187 | S | 61.3 | Low | 56.8 | Low | 89 Ų | 89 | 159.4 Ų | 159.4 | 62% | 0.622 | 81% | 0.807 | S | S | * | * | S | Bend | trans | -145.7 | -4.1 | 162.1 | 65.1 | 0 | 0 | 0 | 0 | 118.9 | D185 | D185-S187 PolarHBondContact O-N 2.94Å; D185-S187 PolarHBondContact OD1-OG 3.19Å |
| 188 | D | 56.2 | Low | 56.9 | Low | 155 Ų | 155 | 156.2 Ų | 156.2 | 83% | 0.829 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -136.3 | 13.2 | 179.4 | -98.7 | -25 | 0 | 0 | 0 | 118 | G190 | D188-G190 PolarHBondContact O-N 3.24Å; D188-G190 VanDerWaalsContact O-N 3.14Å |
| 189 | Y | 53.3 | Low | 56.6 | Low | 236 Ų | 236 | 158.5 Ų | 158.5 | 93% | 0.925 | 81% | 0.806 | S | S | * | * | | | trans | -85.1 | 36.4 | 162.3 | -117.2 | -87.6 | 0 | 0 | 0 | 113.2 | R191 | Y189-R191 PolarHBondContact O-N 2.91Š|
| 190 | G | 55.7 | Low | 56.8 | Low | 63 Ų | 63 | 157.4 Ų | 157.4 | 65% | 0.649 | 80% | 0.8 | S | S | * | * | | | trans | -54.9 | 125.9 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | D188 | D188-G190 PolarHBondContact O-N 3.24Å; D188-G190 VanDerWaalsContact O-N 3.14Å |
| 191 | R | 56.5 | Low | 56.7 | Low | 243 Ų | 243 | 155.5 Ų | 155.5 | 92% | 0.917 | 80% | 0.798 | S | S | * | * | S | Bend | trans | 60.3 | 89.9 | 166 | -61.9 | 179.8 | 179 | -104.9 | 0.7 | 113.9 | Y189 | Y189-R191 PolarHBondContact O-N 2.91Š|
| 192 | S | 54.6 | Low | 56.4 | Low | 103 Ų | 103 | 155.1 Ų | 155.1 | 72% | 0.72 | 79% | 0.79 | S | S | * | * | | | | -176.4 | 66.9 | 87.8 | 49.8 | 0 | 0 | 0 | 0 | 113.8 | S194 | S192-S194 PolarHBondContact O-N 3.41Š|
| 193 | K | 55.8 | Low | 56.6 | Low | 207 Ų | 207 | 156.7 Ų | 156.7 | 90% | 0.9 | 79% | 0.788 | S | S | * | * | | | trans | -78.5 | 17.6 | 160.1 | -71.1 | -159.6 | 178.4 | 168.4 | 0 | 114.3 | K195 R196 | K193-K195 PolarHBondContact O-N 3.46Å; K193-K195 VanDerWaalsContact O-N 3.07Å; K193-R196 PolarHBondContact O-N 2.94Å |
| 194 | S | 58.6 | Low | 56.7 | Low | 106 Ų | 106 | 160.2 Ų | 160.2 | 74% | 0.741 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | 12.4 | 172.8 | -179.1 | 0 | 0 | 0 | 0 | 115.3 | S192 | S192-S194 PolarHBondContact O-N 3.41Š|
| 195 | K | 56.8 | Low | 56.7 | Low | 213 Ų | 213 | 157.9 Ų | 157.9 | 93% | 0.926 | 79% | 0.786 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.3 | 9.1 | 171.7 | -76.2 | -174.6 | -176.5 | 166.1 | 0 | 115 | K193 | K193-K195 PolarHBondContact O-N 3.46Å; K193-K195 VanDerWaalsContact O-N 3.07Å |
| 196 | R | 59.7 | Low | 56.8 | Low | 242 Ų | 242 | 163.2 Ų | 163.2 | 91% | 0.913 | 80% | 0.797 | S | S | * | * | S | Bend | trans | -103 | 23.3 | 168.6 | -158.1 | -179.7 | -90.4 | -153.6 | -3 | 114 | K193 | K193-R196 PolarHBondContact O-N 2.94Š|
| 197 | S | 59 | Low | 56.6 | Low | 98 Ų | 98 | 161.3 Ų | 161.3 | 69% | 0.685 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -146.3 | 125.5 | 170 | 179.7 | 0 | 0 | 0 | 0 | 109.9 | | |
| 198 | S | 58.6 | Low | 56.3 | Low | 103 Ų | 103 | 164.8 Ų | 164.8 | 72% | 0.72 | 80% | 0.799 | S | S | * | * | | | trans | 86.9 | 39.2 | 171.8 | 84.5 | 0 | 0 | 0 | 0 | 120.3 | | |
| 199 | K | 53.8 | Low | 56.3 | Low | 206 Ų | 206 | 168.3 Ų | 168.3 | 90% | 0.896 | 80% | 0.801 | S | S | * | * | | | trans | -96.6 | 79.6 | 141.5 | -145.2 | 80.3 | 178.1 | -175.5 | 0 | 108.5 | V201 | K199-V201 PolarHBondContact O-N 3.26Å; K199-V201 VanDerWaalsContact O-N 3.13Å |
| 200 | K | 59 | Low | 56.7 | Low | 172 Ų | 172 | 165 Ų | 165 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | | | trans | -39 | 124.5 | 163.8 | -68.9 | 175 | 178.6 | 175.5 | 0 | 107.4 | I202 | K200-I202 HydrophobicContact CB-CG1 4.23Å; K200-I202 PolarHBondContact O-N 3.03Å |
| 201 | V | 58 | Low | 57.1 | Low | 132 Ų | 132 | 171 Ų | 171 | 80% | 0.8 | 80% | 0.802 | S | S | * | * | | | trans | -60.4 | 78.5 | 163.5 | -163.5 | 0 | 0 | 0 | 0 | 105.9 | K199 R203 | K199-V201 PolarHBondContact O-N 3.26Å; K199-V201 VanDerWaalsContact O-N 3.13Å; V201-R203 HydrophobicContact CG1-CG 4.16Å; V201-R203 PolarHBondContact O-N 3.47Å |
| 202 | I | 54.6 | Low | 57.6 | Low | 130 Ų | 130 | 168.4 Ų | 168.4 | 67% | 0.667 | 80% | 0.798 | S | S | * | * | | | trans | -73.4 | 83.6 | 161 | -55.5 | 167.7 | 0 | 0 | 0 | 102.1 | K200 R204 | K200-I202 HydrophobicContact CB-CG1 4.23Å; K200-I202 PolarHBondContact O-N 3.03Å; I202-R204 HydrophobicContact CG2-CG 4.02Å; I202-R204 PolarHBondContact O-N 3.03Å |
| 203 | R | 56.4 | Low | 58 | Low | 221 Ų | 221 | 172.9 Ų | 172.9 | 83% | 0.834 | 80% | 0.804 | S | S | * | * | | | trans | -47.3 | 96.1 | 145.2 | -76.2 | -175.3 | 162.3 | 162.5 | -3.4 | 103.3 | V201 S205 | V201-R203 HydrophobicContact CG1-CG 4.16Å; V201-R203 PolarHBondContact O-N 3.47Å; R203-S205 PolarHBondContact O-N 2.95Å |
| 204 | R | 51.3 | Low | 58.4 | Low | 227 Ų | 227 | 167.8 Ų | 167.8 | 86% | 0.857 | 80% | 0.795 | S | S | * | * | | | trans | -63.6 | 90.4 | 169.3 | -65.6 | -179.8 | 94.9 | 118.2 | 0.7 | 102.4 | I202 R206 | I202-R204 HydrophobicContact CG2-CG 4.02Å; I202-R204 PolarHBondContact O-N 3.03Å; R204-R206 PolarHBondContact O-N 3.28Å |
| 205 | S | 54.5 | Low | 58.9 | Low | 102 Ų | 102 | 168.7 Ų | 168.7 | 71% | 0.713 | 80% | 0.799 | S | S | * | * | | | trans | -39.6 | 116.7 | 160.3 | 51.2 | 0 | 0 | 0 | 0 | 104.6 | R203 P207 | R203-S205 PolarHBondContact O-N 2.95Å; S205-P207 VanDerWaalsContact O-N 3.14Å |
| 206 | R | 59.3 | Low | 59.7 | Low | 226 Ų | 226 | 167.5 Ų | 167.5 | 85% | 0.853 | 79% | 0.793 | S | S | * | * | | | trans | -37.2 | 128.5 | 168 | -82.2 | 175.2 | 167.6 | 164.8 | -2.9 | 106.1 | R204 E208 | R204-R206 PolarHBondContact O-N 3.28Å; R206-E208 VanDerWaalsContact C-N 3.29Å; R206-E208 PolarHBondContact O-N 3.49Å |
| 207 | P | 55 | Low | 60.2 | Low | 114 Ų | 114 | 161 Ų | 161 | 74% | 0.74 | 78% | 0.782 | S | S | * | * | | | trans | -56.8 | 111.4 | 164.5 | 24.3 | -29.5 | 0 | 0 | 0 | 104.4 | S205 R209 | S205-P207 VanDerWaalsContact O-N 3.14Å; P207-R209 PolarHBondContact O-N 3.35Å |
| 208 | E | 56 | Low | 60.5 | Low | 161 Ų | 161 | 165.8 Ų | 165.8 | 75% | 0.752 | 79% | 0.785 | S | S | * | * | | | trans | -50.6 | 94.4 | 161.8 | -81.9 | -172.8 | 156 | 0 | 0 | 104.5 | R206 K210 | R206-E208 VanDerWaalsContact C-N 3.29Å; R206-E208 PolarHBondContact O-N 3.49Å; E208-K210 PolarHBondContact O-N 2.95Å |
| 209 | R | 56.3 | Low | 60.8 | Low | 229 Ų | 229 | 168 Ų | 168 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | | | trans | -62.1 | 96 | 162.7 | -92.8 | 176.9 | 126.2 | 167.1 | -1.5 | 102.4 | P207 E211 | P207-R209 PolarHBondContact O-N 3.35Å; R209-E211 VanDerWaalsContact C-N 3.34Å; R209-E211 PolarHBondContact O-N 3.43Å |
| 210 | K | 60.8 | Low | 61.1 | Low | 167 Ų | 167 | 166 Ų | 166 | 73% | 0.726 | 78% | 0.78 | S | S | * | * | | | trans | -35.1 | 106.7 | 167 | -70.6 | -70.2 | -177 | -167.6 | 0 | 105.8 | E208 K212 | E208-K210 PolarHBondContact O-N 2.95Å; K210-K212 PolarHBondContact O-N 3.14Å |
| 211 | E | 64.6 | Low | 61.2 | Low | 188 Ų | 188 | 161.2 Ų | 161.2 | 88% | 0.879 | 77% | 0.773 | S | S | * | * | | | trans | -65.7 | 76.1 | 177.4 | -73.2 | -176.4 | 151.5 | 0 | 0 | 107.1 | R209 K213 | R209-E211 VanDerWaalsContact C-N 3.34Å; R209-E211 PolarHBondContact O-N 3.43Å; E211-K213 PolarHBondContact O-N 2.94Å |
| 212 | K | 66.7 | Low | 61 | Low | 189 Ų | 189 | 161.1 Ų | 161.1 | 82% | 0.822 | 77% | 0.772 | S | S | * | * | | | trans | -69.9 | 92.1 | 158 | -67.4 | -159.1 | 178.5 | -174.9 | 0 | 104.2 | K210 S214 | K210-K212 PolarHBondContact O-N 3.14Å; K212-S214 PolarHBondContact O-N 3.49Å |
| 213 | K | 63.2 | Low | 61.2 | Low | 197 Ų | 197 | 160.8 Ų | 160.8 | 86% | 0.857 | 78% | 0.776 | S | S | * | * | | | trans | -2.2 | 98.9 | 165.5 | -70.8 | 168.6 | 177.9 | 172 | 0 | 110.2 | E211 | E211-K213 PolarHBondContact O-N 2.94Š|
| 214 | S | 64.9 | Low | 61.4 | Low | 101 Ų | 101 | 155.5 Ų | 155.5 | 71% | 0.706 | 77% | 0.769 | S | S | * | * | | | trans | -48.6 | 134.1 | 176.8 | 43.5 | 0 | 0 | 0 | 0 | 109 | K212 K216 | K212-S214 PolarHBondContact O-N 3.49Å; S214-K216 PolarHBondContact O-N 3.26Å |
| 215 | P | 69.3 | Low | 61.9 | Low | 125 Ų | 125 | 150.4 Ų | 150.4 | 81% | 0.812 | 77% | 0.765 | S | S | * | * | | | trans | -58.6 | 120.3 | 178.2 | -19.7 | 30.1 | 0 | 0 | 0 | 108.5 | | |
| 216 | K | 73.4 | Confident | 62.2 | Low | 187 Ų | 187 | 150.1 Ų | 150.1 | 81% | 0.813 | 76% | 0.763 | S | S | * | * | | | trans | -43.2 | 126.5 | -179.3 | -66.4 | 171.3 | -179.5 | 173.8 | 0 | 109.7 | S214 R218 | S214-K216 PolarHBondContact O-N 3.26Å; K216-R218 PolarHBondContact O-N 3.12Å |
| 217 | P | 69.8 | Low | 62 | Low | 106 Ų | 106 | 144.9 Ų | 144.9 | 69% | 0.688 | 76% | 0.758 | S | S | * | * | | | trans | -61.7 | 116.3 | 174.6 | 26.2 | -32.3 | 0 | 0 | 0 | 107.5 | L219 | P217-L219 PolarHBondContact O-N 3.19Š|
| 218 | R | 65.9 | Low | 62.1 | Low | 198 Ų | 198 | 148.1 Ų | 148.1 | 75% | 0.747 | 77% | 0.765 | S | S | * | * | | | trans | -75.9 | 76.2 | 174 | -65.1 | -178.4 | 71.8 | 160.4 | 4.9 | 107.8 | K216 K220 | K216-R218 PolarHBondContact O-N 3.12Å; R218-K220 VanDerWaalsContact C-N 3.25Å; R218-K220 PolarHBondContact O-N 3.06Å |
| 219 | L | 63.3 | Low | 62.4 | Low | 150 Ų | 150 | 150.4 Ų | 150.4 | 79% | 0.785 | 77% | 0.773 | S | S | * | * | | | trans | -65.8 | 91.6 | 165 | -65.4 | 176.1 | 0 | 0 | 0 | 107.3 | P217 A221 | P217-L219 PolarHBondContact O-N 3.19Å; L219-A221 PolarHBondContact O-N 2.86Å |
| 220 | K | 60.4 | Low | 62.4 | Low | 163 Ų | 163 | 142.7 Ų | 142.7 | 71% | 0.709 | 77% | 0.765 | S | S | * | * | | | trans | -90.5 | 64.6 | 164.2 | -54.1 | -164.8 | -172 | -174.5 | 0 | 107.7 | R218 | R218-K220 VanDerWaalsContact C-N 3.25Å; R218-K220 PolarHBondContact O-N 3.06Å |
| 221 | A | 61 | Low | 62.1 | Low | 73 Ų | 73 | 145.4 Ų | 145.4 | 60% | 0.603 | 78% | 0.777 | S | S | * | * | | | trans | -140.7 | 72.2 | 170.8 | 0 | 0 | 0 | 0 | 0 | 106.3 | L219 V223 | L219-A221 PolarHBondContact O-N 2.86Å; A221-V223 PolarHBondContact O-N 3.19Å |
| 222 | T | 54.5 | Low | 61.5 | Low | 129 Ų | 129 | 140.1 Ų | 140.1 | 79% | 0.791 | 77% | 0.773 | S | S | * | * | | | trans | -68.4 | 84 | 164 | -47 | 0 | 0 | 0 | 0 | 106.5 | T224 | T222-T224 HydrophobicContact CG2-CG2 3.92Å; T222-T224 PolarHBondContact O-N 3.16Å |
| 223 | V | 58 | Low | 61 | Low | 124 Ų | 124 | 142 Ų | 142 | 75% | 0.752 | 78% | 0.781 | S | S | * | * | | | trans | -82.1 | 95.8 | 162.1 | 177.7 | 0 | 0 | 0 | 0 | 104.8 | A221 P225 | A221-V223 PolarHBondContact O-N 3.19Å; V223-P225 WeakPolarHBondContact O-CD 3.48Å |
| 224 | T | 60.2 | Low | 60.3 | Low | 110 Ų | 110 | 135.8 Ų | 135.8 | 68% | 0.675 | 77% | 0.773 | S | S | * | * | | | trans | -69.1 | 113.2 | 167.9 | 47.6 | 0 | 0 | 0 | 0 | 107.8 | T222 S226 | T222-T224 HydrophobicContact CG2-CG2 3.92Å; T222-T224 PolarHBondContact O-N 3.16Å; T224-S226 PolarHBondContact O-N 3.03Å; T224-S226 VanDerWaalsContact O-N 3.16Å |
| 225 | P | 63.4 | Low | 59.8 | Low | 119 Ų | 119 | 143.2 Ų | 143.2 | 77% | 0.773 | 79% | 0.786 | S | S | * | * | | | trans | -68 | 115.6 | 166.6 | 28.8 | -30.9 | 0 | 0 | 0 | 107.4 | V223 | V223-P225 WeakPolarHBondContact O-CD 3.48Š|
| 226 | S | 60.1 | Low | 59.1 | Low | 97 Ų | 97 | 142.7 Ų | 142.7 | 68% | 0.678 | 79% | 0.785 | S | S | * | * | | | trans | -58.1 | 138.5 | 169.2 | -172.7 | 0 | 0 | 0 | 0 | 109 | T224 M228 | T224-S226 PolarHBondContact O-N 3.03Å; T224-S226 VanDerWaalsContact O-N 3.16Å; S226-M228 PolarHBondContact O-N 3.12Å |
| 227 | P | 55.9 | Low | 57.5 | Low | 115 Ų | 115 | 139 Ų | 139 | 75% | 0.747 | 78% | 0.783 | S | S | * | * | | | trans | -72.3 | 99.3 | 177.7 | 29.4 | -31.2 | 0 | 0 | 0 | 108.5 | K229 | P227-K229 PolarHBondContact O-N 3.48Å; P227-K229 VanDerWaalsContact O-N 3.1Å |
| 228 | M | 55.8 | Low | 56.2 | Low | 182 Ų | 182 | 138.5 Ų | 138.5 | 90% | 0.897 | 79% | 0.788 | S | S | * | * | | | trans | -69.6 | 108.7 | 166.3 | -69.3 | -166.6 | 71.7 | 0 | 0 | 108.1 | S226 G230 | S226-M228 PolarHBondContact O-N 3.12Å; M228-G230 PolarHBondContact O-N 3.08Å |
| 229 | K | 62 | Low | 55 | Low | 209 Ų | 209 | 134 Ų | 134 | 91% | 0.909 | 79% | 0.793 | S | S | * | * | | | trans | -48.2 | 121.5 | 171.4 | -73.8 | 173.1 | 174 | 178.8 | 0 | 110.3 | P227 | P227-K229 PolarHBondContact O-N 3.48Å; P227-K229 VanDerWaalsContact O-N 3.1Å |
| 230 | G | 57.9 | Low | 54.2 | Low | 68 Ų | 68 | 137.2 Ų | 137.2 | 70% | 0.701 | 80% | 0.801 | S | S | * | * | | | trans | -87.1 | 142.9 | 166.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | M228 | M228-G230 PolarHBondContact O-N 3.08Š|
| 231 | K | 54.4 | Low | 53.5 | Low | 223 Ų | 223 | 133.8 Ų | 133.8 | 97% | 0.97 | 80% | 0.803 | S | S | * | * | | | trans | 63.8 | 134.1 | 157.8 | -74 | 173.6 | 172.4 | 177 | 0 | 118.8 | | |
| 232 | G | 52.1 | Low | 52.8 | Low | 77 Ų | 77 | 136.4 Ų | 136.4 | 79% | 0.794 | 81% | 0.814 | S | S | * | * | | | trans | 150.3 | 84.4 | 154.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | G234 | G232-G234 PolarHBondContact O-N 3.1Š|
| 233 | K | 55.6 | Low | 52.1 | Low | 228 Ų | 228 | 138 Ų | 138 | 99% | 0.991 | 81% | 0.812 | S | S | * | * | | | trans | -67.6 | 110.6 | 159.7 | -149.6 | 156.8 | -177 | 172.9 | 0 | 106.1 | | |
| 234 | G | 47.6 | Very low | 51.5 | Low | 68 Ų | 68 | 140.7 Ų | 140.7 | 70% | 0.701 | 81% | 0.814 | S | S | * | * | | | trans | -158.3 | 98.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | G232 S236 | G232-G234 PolarHBondContact O-N 3.1Å; G234-S236 PolarHBondContact O-N 3.44Å |
| 235 | R | 55.7 | Low | 50.5 | Low | 256 Ų | 256 | 140.7 Ų | 140.7 | 97% | 0.966 | 82% | 0.818 | S | S | * | * | | | trans | -71.4 | 120.8 | 164.6 | -63.6 | 168.3 | 77 | 176.1 | 3.6 | 106.2 | | |
| 236 | S | 53.6 | Low | 49.2 | Very low | 114 Ų | 114 | 140.8 Ų | 140.8 | 80% | 0.797 | 82% | 0.822 | S | S | * | * | | | trans | -135.1 | 92.7 | 156.4 | 60.4 | 0 | 0 | 0 | 0 | 107.7 | G234 | G234-S236 PolarHBondContact O-N 3.44Š|
| 237 | S | 41 | Very low | 48.6 | Very low | 109 Ų | 109 | 141.8 Ų | 141.8 | 76% | 0.762 | 83% | 0.826 | S | S | * | * | | | trans | -43.1 | 145.4 | 150.5 | 42.7 | 0 | 0 | 0 | 0 | 111.6 | | |
| 238 | A | 40.8 | Very low | 47.6 | Very low | 97 Ų | 97 | 143.9 Ų | 143.9 | 80% | 0.802 | 82% | 0.823 | S | S | * | * | | | trans | 44.5 | 108.4 | 147.6 | 0 | 0 | 0 | 0 | 0 | 118.2 | | |
| 239 | A | 42.7 | Very low | 46.6 | Very low | 103 Ų | 103 | 141.4 Ų | 141.4 | 85% | 0.851 | 81% | 0.81 | S | S | * | * | | | | 173.4 | 98 | 126.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 240 | K | 45.6 | Very low | 45.3 | Very low | 218 Ų | 218 | 139.4 Ų | 139.4 | 95% | 0.948 | 80% | 0.803 | S | S | * | * | | | trans | -118 | 109.3 | 141.7 | -85.3 | -169.9 | 176.1 | -176 | 0 | 105.7 | | |
| 241 | A | 45.9 | Very low | 44.3 | Very low | 91 Ų | 91 | 143.9 Ų | 143.9 | 75% | 0.752 | 81% | 0.806 | S | S | * | * | | | trans | -126 | 145.7 | 155.4 | 0 | 0 | 0 | 0 | 0 | 106.2 | | |
| 242 | P | 46.7 | Very low | 43.5 | Very low | 128 Ų | 128 | 141.2 Ų | 141.2 | 83% | 0.831 | 80% | 0.797 | S | S | * | * | | | | -145 | 119.1 | 97.8 | 33.4 | -16.2 | 0 | 0 | 0 | 113.4 | | |
| 243 | E | 40.2 | Very low | 42.7 | Very low | 162 Ų | 162 | 146 Ų | 146 | 76% | 0.757 | 80% | 0.799 | S | S | * | * | | | trans | -138.6 | 107.5 | 153.1 | -84.9 | -94.4 | 152.1 | 0 | 0 | 107 | | |
| 244 | K | 44.1 | Very low | 41.9 | Very low | 180 Ų | 180 | 143.6 Ų | 143.6 | 78% | 0.783 | 79% | 0.791 | S | S | * | * | | | trans | 79.8 | 136.7 | 153.3 | -52.3 | -166.1 | -178.8 | 179.9 | 0 | 120.6 | | |
| 245 | S | 39.7 | Very low | 41.9 | Very low | 110 Ų | 110 | 145.3 Ų | 145.3 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | | | trans | 88 | 95.7 | 161.3 | 68.8 | 0 | 0 | 0 | 0 | 119.9 | | |
| 246 | S | 35.8 | Very low | 40.8 | Very low | 122 Ų | 122 | 142 Ų | 142 | 85% | 0.853 | 79% | 0.785 | S | S | * | * | | | | 64 | 153.3 | 120.3 | -52.3 | 0 | 0 | 0 | 0 | 122.8 | | |
| 247 | P | 48 | Very low | 40 | Very low | 117 Ų | 117 | 141.5 Ų | 141.5 | 76% | 0.76 | 78% | 0.782 | S | S | * | * | | | trans | -114.3 | 165.2 | -149 | 41.4 | -30.1 | 0 | 0 | 0 | 115.1 | | |
| 248 | K | 33.7 | Very low | 40.3 | Very low | 160 Ų | 160 | 141.7 Ų | 141.7 | 70% | 0.696 | 78% | 0.781 | S | S | * | * | | | trans | -179.4 | 120 | 148.3 | -108 | 168.8 | 170.8 | -87.7 | 0 | 110.4 | | |
| 249 | E | 36.1 | Very low | 39.9 | Very low | 130 Ų | 130 | 143.3 Ų | 143.3 | 61% | 0.607 | 78% | 0.775 | S | S | * | * | | | | 91.3 | 114.9 | 109.1 | -88.2 | 169.2 | -168 | 0 | 0 | 110.7 | | |
| 250 | E | 35 | Very low | 39.7 | Very low | 167 Ų | 167 | 145.2 Ų | 145.2 | 78% | 0.78 | 77% | 0.766 | S | S | * | * | | | | 73.9 | 125.1 | 103.9 | -71 | 179.2 | 164.1 | 0 | 0 | 109.5 | | |
| 251 | E | 37.3 | Very low | 39.4 | Very low | 162 Ų | 162 | 141.2 Ų | 141.2 | 76% | 0.757 | 75% | 0.751 | S | S | * | * | | | | 168.5 | 125.9 | 77.1 | -170.5 | 162.8 | -170.6 | 0 | 0 | 103.3 | | |
| 252 | E | 36.5 | Very low | 39 | Very low | 166 Ų | 166 | 144 Ų | 144 | 78% | 0.776 | 75% | 0.749 | S | S | * | * | | | | 49.3 | 129.5 | 111.7 | -55.6 | -172.9 | 156.8 | 0 | 0 | 113.1 | | |
| 253 | E | 36 | Very low | 38.5 | Very low | 178 Ų | 178 | 145 Ų | 145 | 83% | 0.832 | 74% | 0.742 | S | S | * | * | | | | 176.4 | 135.6 | 61.1 | -133.2 | 174.8 | 169.5 | 0 | 0 | 106.7 | | |
| 254 | E | 37.5 | Very low | 38.2 | Very low | 178 Ų | 178 | 145.4 Ų | 145.4 | 83% | 0.832 | 74% | 0.744 | S | S | * | * | | | trans | -67.9 | 157.9 | 145.6 | -105.6 | 177.8 | 170.1 | 0 | 0 | 107.6 | | |
| 255 | P | 47.6 | Very low | 37.8 | Very low | 104 Ų | 104 | 144.5 Ų | 144.5 | 68% | 0.675 | 74% | 0.743 | S | S | * | * | | | | -161 | 175.1 | 61.3 | 39.4 | -15.1 | 0 | 0 | 0 | 118.6 | | |
| 256 | E | 32.5 | Very low | 37.5 | Very low | 185 Ų | 185 | 146.6 Ų | 146.6 | 86% | 0.864 | 74% | 0.74 | S | S | * | * | | | trans | 43.6 | 128.3 | 138.9 | -68.5 | -179.6 | 141.3 | 0 | 0 | 124.2 | | |
| 257 | S | 37.9 | Very low | 37.4 | Very low | 104 Ų | 104 | 147.9 Ų | 147.9 | 73% | 0.727 | 73% | 0.732 | S | S | * | * | | | trans | -56.8 | 163.8 | 154.2 | 47.7 | 0 | 0 | 0 | 0 | 114.1 | | |
| 258 | P | 47.1 | Very low | 36.7 | Very low | 114 Ų | 114 | 150.3 Ų | 150.3 | 74% | 0.74 | 73% | 0.734 | S | S | * | * | | | | -164.4 | -161.8 | 66.1 | 40.9 | -15 | 0 | 0 | 0 | 117.9 | | |
| 259 | L | 32.3 | Very low | 36.8 | Very low | 130 Ų | 130 | 149.5 Ų | 149.5 | 68% | 0.681 | 73% | 0.732 | S | S | * | * | | | trans | 93.3 | 118.8 | 155.2 | -112.6 | 91.1 | 0 | 0 | 0 | 120.7 | | |
| 260 | E | 37.4 | Very low | 36.7 | Very low | 144 Ų | 144 | 148.5 Ų | 148.5 | 67% | 0.673 | 74% | 0.735 | S | S | * | * | | | | 82.8 | 148.6 | 102 | -86.8 | 176.7 | -167.2 | 0 | 0 | 112.2 | | |
| 261 | E | 39.2 | Very low | 36.5 | Very low | 134 Ų | 134 | 145.5 Ų | 145.5 | 63% | 0.626 | 73% | 0.728 | S | S | * | * | | | cis | -174.9 | 161.1 | 22.1 | -124.5 | 166.9 | 177 | 0 | 0 | 108.1 | | |
| 262 | E | 37.5 | Very low | 36.3 | Very low | 150 Ų | 150 | 146.4 Ų | 146.4 | 70% | 0.701 | 73% | 0.729 | S | S | * | * | | | trans | 51.2 | 155.3 | 139.3 | -71.8 | 174.9 | 164.7 | 0 | 0 | 121.7 | | |
| 263 | E | 37.4 | Very low | 36 | Very low | 148 Ų | 148 | 147.3 Ų | 147.3 | 69% | 0.692 | 73% | 0.731 | S | S | * | * | | | cis | -165.7 | 143.6 | 7.3 | -118.6 | 172.4 | 157.4 | 0 | 0 | 103.7 | | |
| 264 | E | 34 | Very low | 35.8 | Very low | 170 Ų | 170 | 146.5 Ų | 146.5 | 79% | 0.794 | 73% | 0.732 | S | S | * | * | | | | 34.3 | 128.4 | 106.7 | -81.3 | 176.4 | 173.6 | 0 | 0 | 114.5 | | |
| 265 | E | 35.2 | Very low | 35.6 | Very low | 162 Ų | 162 | 143.1 Ų | 143.1 | 76% | 0.757 | 73% | 0.728 | S | S | * | * | | | | -175.9 | 161 | 50.6 | -126.6 | 171.7 | -178.7 | 0 | 0 | 109.3 | | |
| 266 | E | 33.3 | Very low | 35.1 | Very low | 153 Ų | 153 | 143 Ų | 143 | 72% | 0.715 | 73% | 0.73 | S | S | * | * | | | trans | -2.5 | 160.9 | 143.1 | -68.9 | 178.4 | 162 | 0 | 0 | 118.9 | | |
| 267 | E | 33.4 | Very low | 35.7 | Very low | 149 Ų | 149 | 140.3 Ų | 140.3 | 70% | 0.696 | 73% | 0.728 | S | S | * | * | | | cis | -177.2 | 166.7 | 3.6 | -110.5 | 180 | 167.7 | 0 | 0 | 105.3 | | |
| 268 | E | 34.5 | Very low | 35.6 | Very low | 168 Ų | 168 | 139.3 Ų | 139.3 | 79% | 0.785 | 73% | 0.726 | S | S | * | * | | | trans | 62.3 | 160 | 153.6 | -80.6 | -165.6 | 147.9 | 0 | 0 | 118.3 | | |
| 269 | E | 36.1 | Very low | 35.8 | Very low | 143 Ų | 143 | 139 Ų | 139 | 67% | 0.668 | 72% | 0.724 | S | S | * | * | | | cis | -166.6 | 144.9 | 2.4 | -133.1 | -158 | 136.4 | 0 | 0 | 106.4 | | |
| 270 | V | 33.3 | Very low | 35.8 | Very low | 109 Ų | 109 | 141.6 Ų | 141.6 | 66% | 0.661 | 73% | 0.73 | S | S | * | * | | | | 68.1 | 113.7 | 127.4 | 161.2 | 0 | 0 | 0 | 0 | 122.4 | | |
| 271 | V | 30.1 | Very low | 35.7 | Very low | 105 Ų | 105 | 143.6 Ų | 143.6 | 64% | 0.636 | 74% | 0.737 | S | S | * | * | | | | 95.1 | 105.1 | 124.2 | 172.5 | 0 | 0 | 0 | 0 | 121.8 | | |
| 272 | K | 33.8 | Very low | 35.5 | Very low | 180 Ų | 180 | 143.8 Ų | 143.8 | 78% | 0.783 | 75% | 0.747 | S | S | * | * | | | | 53.5 | 139 | 124.1 | -50.1 | 178.1 | -177.7 | 166.8 | 0 | 122 | | |
| 273 | K | 30.4 | Very low | 35.3 | Very low | 186 Ų | 186 | 145.4 Ų | 145.4 | 81% | 0.809 | 75% | 0.752 | S | S | * | * | | | trans | 95.3 | 107.4 | 146 | -72.3 | -173 | -179.8 | 177.6 | 0 | 117.1 | | |
| 274 | D | 31.5 | Very low | 35 | Very low | 160 Ų | 160 | 147.8 Ų | 147.8 | 86% | 0.856 | 76% | 0.763 | S | S | * | * | | | | 174.9 | 142.1 | 118 | -95.2 | -41.6 | 0 | 0 | 0 | 106.4 | | |
| 275 | S | 34 | Very low | 35.3 | Very low | 107 Ų | 107 | 145 Ų | 145 | 75% | 0.748 | 76% | 0.757 | S | S | * | * | | | cis | -166.7 | 136.7 | -4.5 | 180 | 0 | 0 | 0 | 0 | 103.7 | | |
| 276 | S | 36.8 | Very low | 35.7 | Very low | 102 Ų | 102 | 143.1 Ų | 143.1 | 71% | 0.713 | 76% | 0.759 | S | S | * | * | | | trans | -85.2 | 156.6 | 174.1 | -138.1 | 0 | 0 | 0 | 0 | 109.3 | | |
| 277 | P | 43.9 | Very low | 35.4 | Very low | 128 Ų | 128 | 139.3 Ų | 139.3 | 83% | 0.831 | 76% | 0.761 | S | S | * | * | | | | -147.5 | 151.3 | 79.8 | 33.8 | -13.5 | 0 | 0 | 0 | 116.7 | | |
| 278 | A | 36.3 | Very low | 35.3 | Very low | 83 Ų | 83 | 141.3 Ų | 141.3 | 69% | 0.686 | 77% | 0.767 | S | S | * | * | | | trans | -66.3 | -170.2 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 279 | P | 50.4 | Low | 35.2 | Very low | 108 Ų | 108 | 141.1 Ų | 141.1 | 70% | 0.701 | 77% | 0.766 | S | S | * | * | | | cis | -143.5 | 171.9 | 2.9 | 39.2 | -19 | 0 | 0 | 0 | 116.5 | | |
| 280 | K | 34 | Very low | 35 | Very low | 184 Ų | 184 | 144 Ų | 144 | 80% | 0.8 | 78% | 0.777 | S | S | * | * | | | | 172.9 | 124.1 | 125.8 | -91.8 | 159.4 | -170 | 180 | 0 | 112.8 | | |
| 281 | K | 35.2 | Very low | 35.2 | Very low | 187 Ų | 187 | 148.6 Ų | 148.6 | 81% | 0.813 | 79% | 0.788 | S | S | * | * | | | trans | 58.3 | 133.5 | 138.6 | -59.7 | -168.6 | -179.2 | -169.8 | 0 | 117.2 | | |
| 282 | T | 34.3 | Very low | 35.3 | Very low | 137 Ų | 137 | 152.7 Ų | 152.7 | 84% | 0.84 | 80% | 0.8 | S | S | * | * | | | cis | -165.9 | 142.1 | 20.9 | 8.3 | 0 | 0 | 0 | 0 | 108.4 | | |
| 283 | K | 33.2 | Very low | 35.6 | Very low | 184 Ų | 184 | 153.7 Ų | 153.7 | 80% | 0.8 | 80% | 0.804 | S | S | * | * | | | trans | -61 | 133.4 | 170 | 176.9 | -176.9 | -174.1 | 178.4 | 0 | 112.9 | V285 | K283-V285 HydrophobicContact CG-CG2 4.04Š|
| 284 | E | 31.3 | Very low | 35.8 | Very low | 199 Ų | 199 | 153.5 Ų | 153.5 | 93% | 0.93 | 81% | 0.806 | S | S | * | * | | | trans | -146.5 | 139.6 | 134.4 | -87 | -156.1 | 153.4 | 0 | 0 | 109.4 | | |
| 285 | V | 40.2 | Very low | 35.9 | Very low | 110 Ų | 110 | 153 Ų | 153 | 67% | 0.667 | 80% | 0.803 | S | S | * | * | | | trans | -126 | 165.8 | -175.8 | -147.9 | 0 | 0 | 0 | 0 | 103.6 | K283 | K283-V285 HydrophobicContact CG-CG2 4.04Š|
| 286 | P | 42.8 | Very low | 36 | Very low | 124 Ų | 124 | 151.8 Ų | 151.8 | 81% | 0.805 | 80% | 0.8 | S | S | * | * | | | cis | -151.6 | 160.3 | 28.3 | 37.3 | -12.9 | 0 | 0 | 0 | 119.8 | | |
| 287 | G | 27.2 | Very low | 36 | Very low | 73 Ų | 73 | 156.1 Ų | 156.1 | 75% | 0.753 | 81% | 0.809 | S | S | * | * | | | trans | -110.9 | 150.9 | 157 | 0 | 0 | 0 | 0 | 0 | 110.3 | | |
| 288 | K | 32.3 | Very low | 35.7 | Very low | 191 Ų | 191 | 159.4 Ų | 159.4 | 83% | 0.83 | 81% | 0.813 | S | S | * | * | | | trans | -69.2 | 167.2 | -166.2 | -76.9 | 175.3 | 169.1 | -180 | 0 | 117.1 | | |
| 289 | E | 32.4 | Very low | 35.8 | Very low | 163 Ų | 163 | 164.4 Ų | 164.4 | 76% | 0.762 | 82% | 0.822 | S | S | * | * | | | trans | 85 | 112.8 | 145.1 | -83.3 | 162.3 | -147.6 | 0 | 0 | 119.8 | | |
| 290 | K | 32.6 | Very low | 35.3 | Very low | 205 Ų | 205 | 168.5 Ų | 168.5 | 89% | 0.891 | 83% | 0.832 | S | S | * | * | | | | -179.7 | 154.4 | 100 | -92.9 | 178.3 | -175.8 | -180 | 0 | 112.4 | | |
| 291 | K | 35.9 | Very low | 35.6 | Very low | 205 Ų | 205 | 168.5 Ų | 168.5 | 89% | 0.891 | 84% | 0.835 | S | S | * | * | | | trans | -74.9 | 143.4 | -176.6 | -72.6 | 172.5 | 166.6 | 178.6 | 0 | 114.2 | | |
| 292 | E | 32.9 | Very low | 35.9 | Very low | 191 Ų | 191 | 168.8 Ų | 168.8 | 89% | 0.893 | 84% | 0.839 | S | S | * | * | | | trans | -142.8 | 117.8 | 149 | -72.9 | 177.9 | 157.7 | 0 | 0 | 103.5 | | |
| 293 | K | 40.9 | Very low | 36.1 | Very low | 200 Ų | 200 | 170.6 Ų | 170.6 | 87% | 0.87 | 84% | 0.838 | S | S | * | * | | | | 51.9 | 132.2 | 70.3 | -121.6 | -170.9 | -177.1 | -169.9 | 0 | 114 | | |
| 294 | E | 34.7 | Very low | 36.3 | Very low | 182 Ų | 182 | 170.8 Ų | 170.8 | 85% | 0.85 | 84% | 0.842 | S | S | * | * | | | trans | 95.8 | 125.4 | -170.4 | -57.8 | 172.4 | -170.2 | 0 | 0 | 110.7 | | |
| 295 | D | 32.7 | Very low | 37 | Very low | 149 Ų | 149 | 168.5 Ų | 168.5 | 80% | 0.797 | 84% | 0.836 | S | S | * | * | | | cis | -151.8 | 139.8 | 38.6 | -87.1 | -83.4 | 0 | 0 | 0 | 108.5 | | |
| 296 | A | 37.2 | Very low | 36.9 | Very low | 82 Ų | 82 | 166.5 Ų | 166.5 | 68% | 0.678 | 84% | 0.838 | S | S | * | * | | | | 75.7 | 112.5 | 72.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 297 | E | 35.8 | Very low | 37 | Very low | 193 Ų | 193 | 166.3 Ų | 166.3 | 90% | 0.902 | 84% | 0.84 | S | S | * | * | | | trans | 66.7 | 118 | 150.9 | -56.4 | -167.5 | 176.2 | 0 | 0 | 121.7 | | |
| 298 | E | 37.8 | Very low | 37.9 | Very low | 197 Ų | 197 | 171.5 Ų | 171.5 | 92% | 0.921 | 84% | 0.844 | S | S | * | * | | | | -166 | 134.6 | 110 | -121.5 | 173.6 | 178.1 | 0 | 0 | 110.8 | | |
| 299 | E | 38.8 | Very low | 38.5 | Very low | 188 Ų | 188 | 170.8 Ų | 170.8 | 88% | 0.879 | 84% | 0.844 | S | S | * | * | | | trans | -69.2 | 141 | 171 | -64.6 | 175.5 | 146.5 | 0 | 0 | 110.5 | | |
| 300 | E | 39.3 | Very low | 39.3 | Very low | 194 Ų | 194 | 169.8 Ų | 169.8 | 91% | 0.907 | 84% | 0.844 | S | S | * | * | | | trans | -151.8 | 115.6 | 141.4 | -143.7 | 171 | -164.1 | 0 | 0 | 109.7 | | |
| 301 | E | 39.9 | Very low | 40.3 | Very low | 184 Ų | 184 | 163.8 Ų | 163.8 | 86% | 0.86 | 83% | 0.833 | S | S | * | * | | | trans | -67.6 | 132.2 | 164.1 | -63.7 | 176.2 | 146.4 | 0 | 0 | 109.2 | | |
| 302 | E | 41.4 | Very low | 41.6 | Very low | 193 Ų | 193 | 160.3 Ų | 160.3 | 90% | 0.902 | 83% | 0.831 | S | S | * | * | | | trans | -140.7 | 123.6 | 140.5 | -86.5 | -161.3 | 156.6 | 0 | 0 | 109 | | |
| 303 | E | 39.3 | Very low | 42.9 | Very low | 176 Ų | 176 | 156.4 Ų | 156.4 | 82% | 0.822 | 82% | 0.824 | S | S | * | * | | | trans | -75.2 | 177.3 | 168.6 | -64.6 | -149.6 | 154 | 0 | 0 | 112.1 | | |
| 304 | E | 37.9 | Very low | 43.2 | Very low | 188 Ų | 188 | 150.8 Ų | 150.8 | 88% | 0.879 | 82% | 0.823 | S | S | * | * | | | trans | 70.3 | 118.4 | 170.7 | -71 | -178.3 | 132.1 | 0 | 0 | 114.6 | | |
| 305 | D | 44 | Very low | 44.2 | Very low | 150 Ų | 150 | 151.5 Ų | 151.5 | 80% | 0.802 | 83% | 0.827 | S | S | * | * | | | | -159.6 | 133.2 | 60 | -163.2 | -4.8 | 0 | 0 | 0 | 110.3 | | |
| 306 | G | 39.7 | Very low | 44.9 | Very low | 69 Ų | 69 | 155.5 Ų | 155.5 | 71% | 0.711 | 85% | 0.848 | S | S | * | * | | | trans | -87.4 | 130.8 | 169.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 307 | S | 44.4 | Very low | 45.3 | Very low | 119 Ų | 119 | 159.2 Ų | 159.2 | 83% | 0.832 | 86% | 0.857 | S | S | * | * | | | trans | -134.6 | 107.1 | 152.3 | 44.9 | 0 | 0 | 0 | 0 | 109.9 | | |
| 308 | E | 44.9 | Very low | 45.8 | Very low | 183 Ų | 183 | 157.4 Ų | 157.4 | 86% | 0.855 | 85% | 0.854 | S | S | * | * | | | trans | -65 | 171.6 | 163.7 | -164.3 | 165.5 | -179.5 | 0 | 0 | 110.5 | | |
| 309 | E | 45.2 | Very low | 46.2 | Very low | 175 Ų | 175 | 155.2 Ų | 155.2 | 82% | 0.818 | 85% | 0.851 | S | S | * | * | | | trans | 82.4 | 127.8 | 177.3 | -54.1 | -166.9 | 148.9 | 0 | 0 | 115.3 | | |
| 310 | D | 49 | Very low | 46.7 | Very low | 143 Ų | 143 | 153.3 Ų | 153.3 | 77% | 0.765 | 85% | 0.849 | S | S | * | * | | | cis | -160.4 | 139.3 | 22.3 | -136.4 | -46.2 | 0 | 0 | 0 | 109.2 | | |
| 311 | A | 55.5 | Low | 47.1 | Very low | 79 Ų | 79 | 150.8 Ų | 150.8 | 65% | 0.653 | 85% | 0.846 | S | S | * | * | | | trans | -95.6 | 133.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | S313 | A311-S313 PolarHBondContact O-N 3.44Š|
| 312 | P | 61.5 | Low | 47.6 | Very low | 132 Ų | 132 | 148.5 Ų | 148.5 | 86% | 0.857 | 85% | 0.845 | S | S | * | * | | | trans | -73.8 | 98.5 | 172.5 | 28.8 | -31.6 | 0 | 0 | 0 | 109.6 | G314 | P312-G314 PolarHBondContact O-N 3.37Š|
| 313 | S | 60.2 | Low | 48 | Very low | 108 Ų | 108 | 145.4 Ų | 145.4 | 76% | 0.755 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 125.3 | 163.7 | 58.2 | 0 | 0 | 0 | 0 | 109.3 | A311 | A311-S313 PolarHBondContact O-N 3.44Š|
| 314 | G | 48.6 | Very low | 48.7 | Very low | 82 Ų | 82 | 143 Ų | 143 | 85% | 0.845 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 138 | 166.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | P312 | P312-G314 PolarHBondContact O-N 3.37Š|
| 315 | E | 54.2 | Low | 49.6 | Very low | 197 Ų | 197 | 139.3 Ų | 139.3 | 92% | 0.921 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -103.2 | 125.1 | 172.3 | -133.5 | 169 | 117.7 | 0 | 0 | 108 | | |
| 316 | D | 48.1 | Very low | 50.1 | Low | 234 Ų | 234 | 138.3 Ų | 138.3 | 100% | 1.251 | 84% | 0.842 | S | S | * | * | | | trans | -106.2 | 0 | 159 | -175 | 26.5 | 0 | 0 | 0 | 106.3 | | |