| 1 | L | 82.4 | Confident | 89 | Confident | 144 Ų | 144 | 106.1 Ų | 106.1 | 75% | 0.754 | 55% | 0.553 | S | S | * | * | | | | 0 | -61.6 | 0 | -170.6 | 150.9 | 0 | 0 | 0 | 109.8 | E3 R4 Q5 | L1-E3 PolarHBondContact O-N 3.04Å; L1-R4 PolarHBondContact O-N 2.79Å; L1-R4 VanDerWaalsContact O-N 3.13Å; L1-Q5 WeakPolarHBondContact O-CG 3.33Å; L1-Q5 PolarHBondContact O-N 2.75Å; L1-Q5 VanDerWaalsContact O-N 3.1Å |
| 2 | F | 86.8 | Confident | 89.1 | Confident | 75 Ų | 75 | 109.5 Ų | 109.5 | 33% | 0.329 | 56% | 0.56 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -52.7 | -55.5 | 177 | -67.4 | -88 | 0 | 0 | 0 | 113.3 | R4 Q5 G6 L7 P8 L13 | F2-R4 PolarHBondContact O-N 3.27Å; F2-Q5 PolarHBondContact O-N 2.68Å; F2-G6 PolarHBondContact O-N 3.26Å; F2-L7 HydrophobicContact CB-CB 4.32Å; F2-L7 PolarHBondContact O-N 3.35Å; F2-L7 HydrophobicContact CD1-CD1 4.41Å; F2-L7 HydrophobicContact CD1-CB 4.01Å; F2-L7 CarbonylContact C-O 3.46Å; F2-P8 WeakPolarHBondContact CD1-O 3.4Å; F2-L13 HydrophobicContact CZ-CD1 4.25Å |
| 3 | E | 87.9 | Confident | 89 | Confident | 172 Ų | 172 | 105.3 Ų | 105.3 | 80% | 0.804 | 54% | 0.539 | S | S | * | . | G | 310 helix | trans | -56.6 | -37.5 | 177.8 | -62.6 | 166.2 | 172.2 | 0 | 0 | 112.9 | L1 Q5 G6 | L1-E3 PolarHBondContact O-N 3.04Å; E3-Q5 VanDerWaalsContact C-N 3.31Å; E3-Q5 PolarHBondContact O-N 3.05Å; E3-G6 PolarHBondContact O-N 3.44Å |
| 4 | R | 88.6 | Confident | 89.1 | Confident | 219 Ų | 219 | 103.3 Ų | 103.3 | 83% | 0.826 | 54% | 0.536 | S | S | * | . | G | 310 helix | trans | -72.1 | -25.2 | -178.9 | -63.4 | -177.9 | 176.5 | -135.4 | -0.6 | 112.8 | L1 F2 | L1-R4 PolarHBondContact O-N 2.79Å; L1-R4 VanDerWaalsContact O-N 3.13Å; F2-R4 PolarHBondContact O-N 3.27Å |
| 5 | Q | 89.6 | Confident | 89 | Confident | 135 Ų | 135 | 99.3 Ų | 99.3 | 63% | 0.631 | 53% | 0.531 | S | S | * | . | G | 310 helix | trans | -94.8 | 4.5 | 175.5 | -57 | -51.4 | 91.2 | 0 | 0 | 112.6 | L1 F2 E3 L7 | L1-Q5 WeakPolarHBondContact O-CG 3.33Å; L1-Q5 PolarHBondContact O-N 2.75Å; L1-Q5 VanDerWaalsContact O-N 3.1Å; F2-Q5 PolarHBondContact O-N 2.68Å; E3-Q5 VanDerWaalsContact C-N 3.31Å; E3-Q5 PolarHBondContact O-N 3.05Å; Q5-L7 HydrophobicContact CB-CD1 4Å; Q5-L7 PolarHBondContact O-N 3.38Å; Q5-L7 HydrophobicContact CB-CG 3.88Å |
| 6 | G | 92.3 | Very high | 88.6 | Confident | 70 Ų | 70 | 98.5 Ų | 98.5 | 72% | 0.722 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.1 | 17.1 | -171.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | F2 E3 | F2-G6 PolarHBondContact O-N 3.26Å; E3-G6 PolarHBondContact O-N 3.44Å |
| 7 | L | 90.3 | Very high | 88.1 | Confident | 90 Ų | 90 | 98.8 Ų | 98.8 | 47% | 0.471 | 54% | 0.535 | S | S | . | . | P | Polyproline II helix | trans | -84.1 | 146.4 | 178.7 | -67.4 | 176.1 | 0 | 0 | 0 | 110.4 | F2 Q5 G9 | F2-L7 HydrophobicContact CB-CB 4.32Å; F2-L7 PolarHBondContact O-N 3.35Å; F2-L7 HydrophobicContact CD1-CD1 4.41Å; F2-L7 HydrophobicContact CD1-CB 4.01Å; F2-L7 CarbonylContact C-O 3.46Å; Q5-L7 HydrophobicContact CB-CD1 4Å; Q5-L7 PolarHBondContact O-N 3.38Å; Q5-L7 HydrophobicContact CB-CG 3.88Å; L7-G9 PolarHBondContact O-N 3.27Å |
| 8 | P | 89 | Confident | 88.1 | Confident | 75 Ų | 75 | 100.7 Ų | 100.7 | 49% | 0.487 | 53% | 0.534 | S | S | . | . | P | Polyproline II helix | trans | -52.9 | 140.1 | 171.5 | 18.4 | -29.2 | 0 | 0 | 0 | 111.1 | F2 K12 | F2-P8 WeakPolarHBondContact CD1-O 3.4Å; P8-K12 HydrophobicContact CB-CB 4.1Å; P8-K12 HydrophobicContact CB-CD 3.17Å; P8-K12 HydrophobicContact CB-CG 4.26Å; P8-K12 HydrophobicContact CG-CD 4.4Å |
| 9 | G | 91.5 | Very high | 87.8 | Confident | 11 Ų | 11 | 105.4 Ų | 105.4 | 11% | 0.113 | 55% | 0.549 | C | S | . | . | P | Polyproline II helix | trans | -62.5 | 168.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | L7 E11 K12 | L7-G9 PolarHBondContact O-N 3.27Å; G9-E11 PolarHBondContact N-OE1 3.15Å; G9-E11 PolarHBondContact O-N 3.07Å; G9-E11 WeakPolarHBondContact CA-OE2 3.4Å; G9-E11 WeakPolarHBondContact CA-OE1 3.22Å; G9-K12 PolarHBondContact O-N 3.03Å |
| 10 | P | 89 | Confident | 87.4 | Confident | 67 Ų | 67 | 101.9 Ų | 101.9 | 44% | 0.435 | 54% | 0.54 | S | S | . | . | G | 310 helix | trans | -58.3 | -22.6 | -177.3 | 25.3 | -34.3 | 0 | 0 | 0 | 112.9 | K12 L13 R18 | P10-K12 PolarHBondContact O-N 3.02Å; P10-L13 HydrophobicContact CB-CD1 4.38Å; P10-L13 WeakPolarHBondContact O-CB 3.49Å; P10-L13 PolarHBondContact O-N 2.91Å; P10-R18 WeakPolarHBondContact O-CD 3.36Å; P10-R18 PolarHBondContact O-NE 3.03Å; P10-R18 WeakPolarHBondContact O-CG 3.18Å |
| 11 | E | 91.3 | Very high | 87 | Confident | 109 Ų | 109 | 104.5 Ų | 104.5 | 51% | 0.509 | 55% | 0.552 | S | S | . | * | G | 310 helix | trans | -61.1 | -10.3 | 175 | 72.3 | -74.1 | 168.6 | 0 | 0 | 114.8 | G9 R18 | G9-E11 PolarHBondContact N-OE1 3.15Å; G9-E11 PolarHBondContact O-N 3.07Å; G9-E11 WeakPolarHBondContact CA-OE2 3.4Å; G9-E11 WeakPolarHBondContact CA-OE1 3.22Å; E11-R18 VanDerWaalsContact C-CZ 3.46Å; E11-R18 PolarHBondContact O-NH2 3.1Å; E11-R18 PolarHBondContact O-NH1 3.2Å; E11-R18 PolarHBondContact O-NE 2.9Å |
| 12 | K | 90.1 | Very high | 86.8 | Confident | 147 Ų | 147 | 102.1 Ų | 102.1 | 64% | 0.639 | 55% | 0.546 | S | S | * | . | G | 310 helix | trans | -101.6 | -8.8 | 175 | -72.1 | 158 | -178.5 | -79.8 | 0 | 113.4 | P8 G9 P10 | P8-K12 HydrophobicContact CB-CB 4.1Å; P8-K12 HydrophobicContact CB-CD 3.17Å; P8-K12 HydrophobicContact CB-CG 4.26Å; P8-K12 HydrophobicContact CG-CD 4.4Å; G9-K12 PolarHBondContact O-N 3.03Å; P10-K12 PolarHBondContact O-N 3.02Å |
| 13 | L | 88.2 | Confident | 86.2 | Confident | 55 Ų | 55 | 110.7 Ų | 110.7 | 29% | 0.288 | 58% | 0.576 | S | S | . | * | S | Bend | trans | -71 | 158.1 | 175.5 | -61.8 | 176.8 | 0 | 0 | 0 | 111.3 | F2 P10 L17 R18 | F2-L13 HydrophobicContact CZ-CD1 4.25Å; P10-L13 HydrophobicContact CB-CD1 4.38Å; P10-L13 WeakPolarHBondContact O-CB 3.49Å; P10-L13 PolarHBondContact O-N 2.91Å; L13-L17 HydrophobicContact CB-CB 4.28Å; L13-R18 HydrophobicContact CB-CG 4Å; L13-R18 PolarHBondContact O-NE 3.23Å; L13-R18 PolarHBondContact O-NH2 3.13Å |
| 14 | P | 90.6 | Very high | 85.2 | Confident | 77 Ų | 77 | 107.6 Ų | 107.6 | 50% | 0.5 | 57% | 0.568 | S | S | . | * | | | trans | -59.8 | 146.5 | 169.6 | 6.5 | -7.6 | 0 | 0 | 0 | 111.2 | S16 L17 R18 | P14-S16 PolarHBondContact O-N 3.47Å; P14-L17 HydrophobicContact CG-CD1 4.07Å; P14-L17 HydrophobicContact CG-CD2 4.32Å; P14-L17 PolarHBondContact O-N 3.24Å; P14-R18 PolarHBondContact O-N 3.19Å; P14-R18 VanDerWaalsContact O-N 3.15Å |
| 15 | G | 88 | Confident | 83.9 | Confident | 44 Ų | 44 | 106.8 Ų | 106.8 | 45% | 0.454 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -57.5 | -28.5 | -169.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | K19 | G15-K19 WeakPolarHBondContact O-CG 3.41Å |
| 16 | S | 82.9 | Confident | 82.7 | Confident | 86 Ų | 86 | 105.2 Ų | 105.2 | 60% | 0.601 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -68.3 | -36 | 173.9 | 49.6 | 0 | 0 | 0 | 0 | 113.1 | P14 | P14-S16 PolarHBondContact O-N 3.47Å |
| 17 | L | 80.1 | Confident | 81.4 | Confident | 103 Ų | 103 | 108.4 Ų | 108.4 | 54% | 0.539 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -79.7 | -30.4 | 178.6 | -81.7 | 68.3 | 0 | 0 | 0 | 111.8 | L13 P14 K19 G20 | L13-L17 HydrophobicContact CB-CB 4.28Å; P14-L17 HydrophobicContact CG-CD1 4.07Å; P14-L17 HydrophobicContact CG-CD2 4.32Å; P14-L17 PolarHBondContact O-N 3.24Å; L17-K19 PolarHBondContact O-N 3.24Å; L17-K19 VanDerWaalsContact C-N 3.26Å; L17-G20 PolarHBondContact O-N 3.45Å |
| 18 | R | 87.7 | Confident | 80 | Confident | 134 Ų | 134 | 107 Ų | 107 | 51% | 0.506 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -60.3 | -37 | 175.2 | -63.6 | -166.5 | -164.4 | 158.6 | 12.4 | 112.8 | P10 E11 L13 P14 G20 | P10-R18 WeakPolarHBondContact O-CD 3.36Å; P10-R18 PolarHBondContact O-NE 3.03Å; P10-R18 WeakPolarHBondContact O-CG 3.18Å; E11-R18 VanDerWaalsContact C-CZ 3.46Å; E11-R18 PolarHBondContact O-NH2 3.1Å; E11-R18 PolarHBondContact O-NH1 3.2Å; E11-R18 PolarHBondContact O-NE 2.9Å; L13-R18 HydrophobicContact CB-CG 4Å; L13-R18 PolarHBondContact O-NE 3.23Å; L13-R18 PolarHBondContact O-NH2 3.13Å; P14-R18 PolarHBondContact O-N 3.19Å; P14-R18 VanDerWaalsContact O-N 3.15Å; R18-G20 PolarHBondContact O-N 3.45Å |
| 19 | K | 83 | Confident | 78.5 | Confident | 190 Ų | 190 | 108.9 Ų | 108.9 | 83% | 0.826 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78 | 1 | -177.6 | -67 | 178.3 | -179.5 | -176.4 | 0 | 112.8 | G15 L17 | G15-K19 WeakPolarHBondContact O-CG 3.41Å; L17-K19 PolarHBondContact O-N 3.24Å; L17-K19 VanDerWaalsContact C-N 3.26Å |
| 20 | G | 77.9 | Confident | 77.2 | Confident | 35 Ų | 35 | 114.2 Ų | 114.2 | 36% | 0.361 | 64% | 0.638 | S | S | . | * | | | trans | 69.9 | 161.6 | -168.3 | 0 | 0 | 0 | 0 | 0 | 111 | L17 R18 | L17-G20 PolarHBondContact O-N 3.45Å; R18-G20 PolarHBondContact O-N 3.45Å |
| 21 | I | 80.2 | Confident | 75.8 | Confident | 156 Ų | 156 | 114.8 Ų | 114.8 | 80% | 0.8 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -66.2 | 127.4 | 168.2 | -58.5 | 170.2 | 0 | 0 | 0 | 105.9 | R23 | I21-R23 PolarHBondContact O-N 2.74Š|
| 22 | P | 78.4 | Confident | 74.3 | Confident | 95 Ų | 95 | 113.8 Ų | 113.8 | 62% | 0.617 | 66% | 0.659 | S | S | * | * | | | trans | -46 | 129.9 | 172.7 | -27 | 33.6 | 0 | 0 | 0 | 108.9 | T24 | P22-T24 HydrophobicContact CB-CG2 4.35Å; P22-T24 PolarHBondContact O-N 3.18Å; P22-T24 PolarHBondContact O-OG1 2.73Å |
| 23 | R | 72.7 | Confident | 72.8 | Confident | 255 Ų | 255 | 112.7 Ų | 112.7 | 96% | 0.962 | 67% | 0.67 | S | S | * | * | | | trans | -70.7 | 39.7 | 176.6 | -71.6 | -167 | 174.6 | 111.3 | -3.6 | 111.9 | I21 K25 | I21-R23 PolarHBondContact O-N 2.74Å; R23-K25 PolarHBondContact O-N 3.45Å |
| 24 | T | 67.9 | Low | 71.2 | Confident | 106 Ų | 106 | 116.1 Ų | 116.1 | 65% | 0.65 | 69% | 0.692 | S | S | * | * | S | Bend | trans | -57 | 136.7 | 157 | 52.5 | 0 | 0 | 0 | 0 | 106.7 | P22 S26 | P22-T24 HydrophobicContact CB-CG2 4.35Å; P22-T24 PolarHBondContact O-N 3.18Å; P22-T24 PolarHBondContact O-OG1 2.73Å; T24-S26 VanDerWaalsContact C-N 3.32Å; T24-S26 PolarHBondContact O-N 3.32Å |
| 25 | K | 62.3 | Low | 69.5 | Low | 203 Ų | 203 | 121.8 Ų | 121.8 | 88% | 0.883 | 73% | 0.734 | S | S | * | * | | | trans | -51.3 | 102.1 | 174.2 | -65.7 | 177.1 | 75.4 | 177.9 | 0 | 107.2 | R23 V27 | R23-K25 PolarHBondContact O-N 3.45Å; K25-V27 PolarHBondContact O-N 3.11Å |
| 26 | S | 63.5 | Low | 68.6 | Low | 102 Ų | 102 | 125.7 Ų | 125.7 | 71% | 0.713 | 75% | 0.748 | S | S | * | * | | | trans | -63.8 | 106.3 | 171.9 | 176.8 | 0 | 0 | 0 | 0 | 105 | T24 G28 | T24-S26 VanDerWaalsContact C-N 3.32Å; T24-S26 PolarHBondContact O-N 3.32Å; S26-G28 PolarHBondContact O-N 2.98Å; S26-G28 VanDerWaalsContact O-N 3.11Å |
| 27 | V | 65.1 | Low | 67.8 | Low | 136 Ų | 136 | 127.7 Ų | 127.7 | 82% | 0.824 | 76% | 0.756 | S | S | * | * | | | trans | -63.2 | 110.3 | 158.5 | -74.4 | 0 | 0 | 0 | 0 | 104.2 | K25 | K25-V27 PolarHBondContact O-N 3.11Š|
| 28 | G | 61 | Low | 67.1 | Low | 61 Ų | 61 | 129.1 Ų | 129.1 | 63% | 0.629 | 77% | 0.768 | S | S | * | * | | | trans | -45.8 | 142.9 | -159.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | S26 S30 | S26-G28 PolarHBondContact O-N 2.98Å; S26-G28 VanDerWaalsContact O-N 3.11Å; G28-S30 PolarHBondContact O-N 3.09Å |
| 29 | S | 57.8 | Low | 65.9 | Low | 114 Ų | 114 | 128.8 Ų | 128.8 | 80% | 0.797 | 78% | 0.783 | S | S | * | * | | | trans | -54.6 | 91.4 | 167.7 | -177 | 0 | 0 | 0 | 0 | 109.2 | A31 | S29-A31 VanDerWaalsContact C-N 3.34Å; S29-A31 PolarHBondContact O-N 2.75Å; S29-A31 VanDerWaalsContact O-N 3.09Å |
| 30 | S | 63.5 | Low | 64.8 | Low | 124 Ų | 124 | 125 Ų | 125 | 87% | 0.867 | 78% | 0.78 | S | S | * | * | | | trans | -71.2 | 95.6 | 164.2 | -169.1 | 0 | 0 | 0 | 0 | 106.6 | G28 | G28-S30 PolarHBondContact O-N 3.09Š|
| 31 | A | 59 | Low | 64 | Low | 78 Ų | 78 | 131 Ų | 131 | 65% | 0.645 | 81% | 0.808 | S | S | * | * | | | trans | -148.9 | 83.2 | 168 | 0 | 0 | 0 | 0 | 0 | 108.6 | S29 | S29-A31 VanDerWaalsContact C-N 3.34Å; S29-A31 PolarHBondContact O-N 2.75Å; S29-A31 VanDerWaalsContact O-N 3.09Å |
| 32 | A | 60 | Low | 62.8 | Low | 88 Ų | 88 | 129.2 Ų | 129.2 | 73% | 0.727 | 81% | 0.809 | S | S | * | * | | | trans | 45.1 | 92.9 | 137.9 | 0 | 0 | 0 | 0 | 0 | 117.9 | | |
| 33 | S | 58.5 | Low | 61.6 | Low | 125 Ų | 125 | 131.8 Ų | 131.8 | 87% | 0.874 | 82% | 0.824 | S | S | * | * | | | trans | -84 | 89.1 | 133.3 | 59.1 | 0 | 0 | 0 | 0 | 108.1 | | |
| 34 | V | 55.7 | Low | 60.7 | Low | 126 Ų | 126 | 121.6 Ų | 121.6 | 76% | 0.764 | 81% | 0.812 | S | S | * | * | | | trans | -133.3 | 91.7 | 160.6 | 179.6 | 0 | 0 | 0 | 0 | 107.1 | | |
| 35 | S | 53.8 | Low | 60 | Low | 196 Ų | 196 | 123 Ų | 123 | 100% | 1.371 | 83% | 0.827 | S | S | * | * | | | | 179.6 | 0 | 125.4 | 17 | 0 | 0 | 0 | 0 | 108.8 | | |