| 1 | M | 56 | Low | 66.3 | Low | 225 Ų | 225 | 186.8 Ų | 186.8 | 100% | 1.108 | 86% | 0.859 | S | S | * | * | | | | 0 | 112 | 0 | -169.3 | 154.8 | 115.4 | 0 | 0 | 108.6 | | |
| 2 | K | 51.9 | Low | 66 | Low | 211 Ų | 211 | 183.8 Ų | 183.8 | 92% | 0.917 | 85% | 0.853 | S | S | * | * | | | trans | -140.8 | 131.4 | 175.4 | -74.2 | -168.3 | 177.2 | -178.7 | 0 | 108.8 | | |
| 3 | M | 71.8 | Confident | 65.5 | Low | 165 Ų | 165 | 177.8 Ų | 177.8 | 81% | 0.813 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -77 | 144.3 | -149.6 | -63 | -72.8 | -82.1 | 0 | 0 | 113.7 | | |
| 4 | K | 73.6 | Confident | 65.5 | Low | 203 Ų | 203 | 176.1 Ų | 176.1 | 88% | 0.883 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 130.9 | 178.7 | -170.3 | 175.7 | -179.2 | 179.5 | 0 | 110.2 | Q6 | K4-Q6 PolarHBondContact O-N 3.35Š|
| 5 | I | 73.4 | Confident | 64.9 | Low | 163 Ų | 163 | 174.3 Ų | 174.3 | 84% | 0.836 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 119 | 178.6 | -64.4 | 166.9 | 0 | 0 | 0 | 108.9 | K7 | I5-K7 PolarHBondContact O-N 3.1Š|
| 6 | Q | 68.9 | Low | 65.1 | Low | 183 Ų | 183 | 175.7 Ų | 175.7 | 86% | 0.855 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 117 | 177.9 | -146 | 175.5 | 42.7 | 0 | 0 | 108.2 | K4 K8 | K4-Q6 PolarHBondContact O-N 3.35Å; Q6-K8 PolarHBondContact O-N 3.1Å |
| 7 | K | 69.2 | Low | 64.7 | Low | 194 Ų | 194 | 170.1 Ų | 170.1 | 84% | 0.843 | 82% | 0.819 | S | S | * | * | | | trans | -67.8 | 97.6 | -177.5 | -163.6 | -176.4 | -175.6 | -172.9 | 0 | 108.6 | I5 E9 | I5-K7 PolarHBondContact O-N 3.1Å; K7-E9 PolarHBondContact O-N 3.21Å |
| 8 | K | 65.9 | Low | 64.6 | Low | 205 Ų | 205 | 167.8 Ų | 167.8 | 89% | 0.891 | 81% | 0.811 | S | S | * | * | | | trans | -75 | 98.5 | 169.5 | -141.7 | 178.1 | -174 | 179.9 | 0 | 107.1 | Q6 K10 | Q6-K8 PolarHBondContact O-N 3.1Å; K8-K10 PolarHBondContact O-N 3.4Å; K8-K10 VanDerWaalsContact O-N 3.13Å |
| 9 | E | 66.4 | Low | 64.4 | Low | 152 Ų | 152 | 165.9 Ų | 165.9 | 71% | 0.71 | 81% | 0.806 | S | S | * | * | | | trans | -54.2 | 113.8 | 173.1 | -138.4 | 176.1 | -175.9 | 0 | 0 | 108.3 | K7 Q11 | K7-E9 PolarHBondContact O-N 3.21Å; E9-Q11 VanDerWaalsContact C-N 3.29Å; E9-Q11 PolarHBondContact O-N 3.35Å |
| 10 | K | 66.8 | Low | 64.3 | Low | 190 Ų | 190 | 164.7 Ų | 164.7 | 83% | 0.826 | 80% | 0.798 | S | S | * | * | | | trans | -72.8 | 95.4 | 171.3 | -148.8 | 179.7 | -174 | -176.2 | 0 | 105.1 | K8 L12 | K8-K10 PolarHBondContact O-N 3.4Å; K8-K10 VanDerWaalsContact O-N 3.13Å; K10-L12 PolarHBondContact O-N 3.4Å |
| 11 | Q | 65.8 | Low | 64.3 | Low | 164 Ų | 164 | 160.2 Ų | 160.2 | 77% | 0.766 | 78% | 0.784 | S | S | * | * | | | trans | -51.3 | 100.1 | 171.9 | -74.8 | -89.7 | -18.2 | 0 | 0 | 107.9 | E9 S13 | E9-Q11 VanDerWaalsContact C-N 3.29Å; E9-Q11 PolarHBondContact O-N 3.35Å; Q11-S13 VanDerWaalsContact C-N 3.33Å; Q11-S13 PolarHBondContact O-N 2.85Å |
| 12 | L | 62.5 | Low | 64.6 | Low | 150 Ų | 150 | 156.1 Ų | 156.1 | 79% | 0.785 | 77% | 0.774 | S | S | * | * | | | trans | -74.5 | 97.3 | 169.6 | -66 | 176.8 | 0 | 0 | 0 | 105.3 | K10 N14 | K10-L12 PolarHBondContact O-N 3.4Å; L12-N14 PolarHBondContact O-N 3.28Å |
| 13 | S | 60 | Low | 65.1 | Low | 107 Ų | 107 | 154.4 Ų | 154.4 | 75% | 0.748 | 77% | 0.771 | S | S | * | * | | | trans | -51.1 | 122.4 | 173.6 | 50.9 | 0 | 0 | 0 | 0 | 109.3 | Q11 L15 | Q11-S13 VanDerWaalsContact C-N 3.33Å; Q11-S13 PolarHBondContact O-N 2.85Å; S13-L15 PolarHBondContact O-N 3.38Å |
| 14 | N | 64.6 | Low | 64.7 | Low | 154 Ų | 154 | 150.8 Ų | 150.8 | 82% | 0.824 | 76% | 0.762 | S | S | * | * | | | trans | -55.3 | 94.7 | 179.6 | -65.4 | -70.5 | 0 | 0 | 0 | 111.2 | L12 K16 | L12-N14 PolarHBondContact O-N 3.28Å; N14-K16 VanDerWaalsContact C-N 3.34Å; N14-K16 PolarHBondContact O-N 3.4Å; N14-K16 VanDerWaalsContact O-N 3.1Å |
| 15 | L | 57.4 | Low | 64.3 | Low | 149 Ų | 149 | 148.7 Ų | 148.7 | 78% | 0.78 | 76% | 0.761 | S | S | * | * | | | trans | -80.1 | 91.2 | 166.3 | -162.9 | 72.4 | 0 | 0 | 0 | 106.8 | S13 V17 | S13-L15 PolarHBondContact O-N 3.38Å; L15-V17 HydrophobicContact CB-CG2 4.41Å; L15-V17 HydrophobicContact CD2-CG2 3.41Å; L15-V17 VanDerWaalsContact CD2-CG2 3.41Å; L15-V17 HydrophobicContact CG-CG2 3.58Å; L15-V17 PolarHBondContact O-N 3.36Å |
| 16 | K | 67.2 | Low | 63.9 | Low | 196 Ų | 196 | 145.3 Ų | 145.3 | 85% | 0.852 | 76% | 0.757 | S | S | * | * | | | trans | -66.4 | 77.9 | 161.9 | -69.8 | -179 | -178.6 | -173.3 | 0 | 107.3 | N14 L18 | N14-K16 VanDerWaalsContact C-N 3.34Å; N14-K16 PolarHBondContact O-N 3.4Å; N14-K16 VanDerWaalsContact O-N 3.1Å; K16-L18 VanDerWaalsContact C-N 3.29Å; K16-L18 PolarHBondContact O-N 3.07Å |
| 17 | V | 58.8 | Low | 63.7 | Low | 81 Ų | 81 | 142 Ų | 142 | 49% | 0.491 | 75% | 0.754 | S | S | . | * | | | trans | -69.8 | 102 | 159.9 | -175.6 | 0 | 0 | 0 | 0 | 104.5 | L15 N19 | L15-V17 HydrophobicContact CB-CG2 4.41Å; L15-V17 HydrophobicContact CD2-CG2 3.41Å; L15-V17 VanDerWaalsContact CD2-CG2 3.41Å; L15-V17 HydrophobicContact CG-CG2 3.58Å; L15-V17 PolarHBondContact O-N 3.36Å; V17-N19 PolarHBondContact O-N 3.02Å; V17-N19 PolarHBondContact O-ND2 3.42Å |
| 18 | L | 62 | Low | 63.5 | Low | 128 Ų | 128 | 138.8 Ų | 138.8 | 67% | 0.67 | 75% | 0.751 | S | S | * | * | | | trans | -62.8 | 87 | 168 | -177.8 | 57.6 | 0 | 0 | 0 | 106.6 | K16 H20 | K16-L18 VanDerWaalsContact C-N 3.29Å; K16-L18 PolarHBondContact O-N 3.07Å; L18-H20 WeakPolarHBondContact CD2-NE2 3.47Å; L18-H20 WeakPolarHBondContact CG-NE2 3.48Å; L18-H20 PolarHBondContact O-N 3.1Å |
| 19 | N | 61.6 | Low | 63.6 | Low | 133 Ų | 133 | 136.2 Ų | 136.2 | 71% | 0.711 | 75% | 0.747 | S | S | * | * | | | trans | -70.1 | 85.5 | 175.5 | -72 | -75.6 | 0 | 0 | 0 | 107.2 | V17 S21 | V17-N19 PolarHBondContact O-N 3.02Å; V17-N19 PolarHBondContact O-ND2 3.42Å; N19-S21 PolarHBondContact O-N 3.07Å |
| 20 | H | 63.2 | Low | 63.5 | Low | 140 Ų | 140 | 136.4 Ų | 136.4 | 65% | 0.648 | 75% | 0.746 | S | S | * | * | | | trans | -75.5 | 99.6 | 163.6 | -68.6 | -56.9 | 0 | 0 | 0 | 107.6 | L18 | L18-H20 WeakPolarHBondContact CD2-NE2 3.47Å; L18-H20 WeakPolarHBondContact CG-NE2 3.48Å; L18-H20 PolarHBondContact O-N 3.1Å |
| 21 | S | 62.7 | Low | 63.4 | Low | 71 Ų | 71 | 133.6 Ų | 133.6 | 50% | 0.497 | 74% | 0.74 | S | S | . | * | | | trans | -62.4 | 141.8 | 169.1 | -69.2 | 0 | 0 | 0 | 0 | 109.2 | N19 M23 S24 | N19-S21 PolarHBondContact O-N 3.07Å; S21-M23 PolarHBondContact O-N 2.86Å; S21-S24 WeakPolarHBondContact O-CB 3.05Å; S21-S24 PolarHBondContact O-N 2.96Å |
| 22 | P | 63.7 | Low | 63.6 | Low | 140 Ų | 140 | 133.4 Ų | 133.4 | 91% | 0.909 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.7 | -11.7 | 179.3 | -25.3 | 34.9 | 0 | 0 | 0 | 115.2 | | |
| 23 | M | 62.4 | Low | 64.1 | Low | 174 Ų | 174 | 134.6 Ų | 134.6 | 86% | 0.857 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.4 | 6.9 | 177.4 | -59.8 | -154.9 | -43.2 | 0 | 0 | 114.2 | S21 D25 | S21-M23 PolarHBondContact O-N 2.86Å; M23-D25 VanDerWaalsContact C-N 3.28Å; M23-D25 PolarHBondContact O-N 3.13Å |
| 24 | S | 62.3 | Low | 64.7 | Low | 89 Ų | 89 | 133.9 Ų | 133.9 | 62% | 0.622 | 73% | 0.726 | S | S | * | * | | | trans | -83.2 | 6.8 | -174.8 | -70.7 | 0 | 0 | 0 | 0 | 115.1 | S21 | S21-S24 WeakPolarHBondContact O-CB 3.05Å; S21-S24 PolarHBondContact O-N 2.96Å |
| 25 | D | 64.7 | Low | 65 | Low | 159 Ų | 159 | 131.3 Ų | 131.3 | 85% | 0.85 | 72% | 0.718 | S | S | * | * | | | trans | -121.3 | 79.5 | 174.2 | -162.2 | 15.9 | 0 | 0 | 0 | 111.2 | M23 | M23-D25 VanDerWaalsContact C-N 3.28Å; M23-D25 PolarHBondContact O-N 3.13Å |
| 26 | A | 66.1 | Low | 65.6 | Low | 92 Ų | 92 | 127.3 Ų | 127.3 | 76% | 0.76 | 70% | 0.703 | S | S | * | * | | | trans | -163.1 | 62.8 | 164.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | | |
| 27 | S | 65.3 | Low | 65.5 | Low | 113 Ų | 113 | 123.6 Ų | 123.6 | 79% | 0.79 | 70% | 0.699 | S | S | * | * | | | trans | -110.6 | 85.1 | 156.1 | 63.2 | 0 | 0 | 0 | 0 | 108.3 | | |
| 28 | V | 64 | Low | 65.5 | Low | 128 Ų | 128 | 128.5 Ų | 128.5 | 78% | 0.776 | 71% | 0.714 | S | S | * | * | | | trans | -90.5 | 101.9 | 159.9 | 177.7 | 0 | 0 | 0 | 0 | 106.1 | F30 | V28-F30 PolarHBondContact O-N 3.05Å; V28-F30 VanDerWaalsContact O-N 3.08Å |
| 29 | N | 67.1 | Low | 65.4 | Low | 151 Ų | 151 | 128.6 Ų | 128.6 | 81% | 0.807 | 72% | 0.715 | S | S | * | * | | | trans | -67.7 | 102.5 | 165.7 | -104.7 | -8.9 | 0 | 0 | 0 | 107.2 | | |
| 30 | F | 64.9 | Low | 65.2 | Low | 156 Ų | 156 | 128.5 Ų | 128.5 | 68% | 0.684 | 72% | 0.723 | S | S | * | * | | | trans | -96.7 | 88.9 | 169.3 | -160.8 | -112.3 | 0 | 0 | 0 | 108.5 | V28 Y32 | V28-F30 PolarHBondContact O-N 3.05Å; V28-F30 VanDerWaalsContact O-N 3.08Å; F30-Y32 PolarHBondContact O-N 2.97Å; F30-Y32 HydrophobicContact CZ-CG 4.24Å; F30-Y32 HydrophobicContact CZ-CE2 4.11Å; F30-Y32 VanDerWaalsContact CZ-CD2 3.44Å; F30-Y32 HydrophobicContact CZ-CD2 3.44Å; F30-Y32 AromaticContact CZ-CD2 3.44Å; F30-Y32 HydrophobicContact CE1-CG 3.54Å; F30-Y32 HydrophobicContact CE1-CE2 4.13Å; F30-Y32 AromaticContact CE1-CG 3.54Å; F30-Y32 HydrophobicContact CD1-CD2 4.25Å; F30-Y32 HydrophobicContact CD1-CG 4.26Å; F30-Y32 AromaticContact CE1-CD2 3.21Å; F30-Y32 HydrophobicContact CE1-CD2 3.21Å; F30-Y32 VanDerWaalsContact CE1-CB 3.42Å |
| 31 | D | 65.4 | Low | 64.8 | Low | 131 Ų | 131 | 126.5 Ų | 126.5 | 70% | 0.701 | 73% | 0.725 | S | S | * | * | | | trans | -73.7 | 78.9 | 164.6 | -85.8 | -50.5 | 0 | 0 | 0 | 108.7 | K33 | D31-K33 PolarHBondContact O-N 3.18Š|
| 32 | Y | 69.9 | Low | 64.1 | Low | 160 Ų | 160 | 129.4 Ų | 129.4 | 63% | 0.627 | 74% | 0.74 | S | S | * | * | | | trans | -78.4 | 101.4 | 169.2 | -157 | -113.8 | 0 | 0 | 0 | 109.1 | F30 S34 | F30-Y32 PolarHBondContact O-N 2.97Å; F30-Y32 HydrophobicContact CZ-CG 4.24Å; F30-Y32 HydrophobicContact CZ-CE2 4.11Å; F30-Y32 VanDerWaalsContact CZ-CD2 3.44Å; F30-Y32 HydrophobicContact CZ-CD2 3.44Å; F30-Y32 AromaticContact CZ-CD2 3.44Å; F30-Y32 HydrophobicContact CE1-CG 3.54Å; F30-Y32 HydrophobicContact CE1-CE2 4.13Å; F30-Y32 AromaticContact CE1-CG 3.54Å; F30-Y32 HydrophobicContact CD1-CD2 4.25Å; F30-Y32 HydrophobicContact CD1-CG 4.26Å; F30-Y32 AromaticContact CE1-CD2 3.21Å; F30-Y32 HydrophobicContact CE1-CD2 3.21Å; F30-Y32 VanDerWaalsContact CE1-CB 3.42Å; Y32-S34 PolarHBondContact O-N 3.47Å |
| 33 | K | 73.1 | Confident | 63.6 | Low | 175 Ų | 175 | 129.3 Ų | 129.3 | 76% | 0.761 | 73% | 0.732 | S | S | * | * | | | trans | -75.2 | 105.2 | 160 | -62.7 | -56 | -178.1 | -153.9 | 0 | 107 | D31 | D31-K33 PolarHBondContact O-N 3.18Š|
| 34 | S | 72.5 | Confident | 63 | Low | 91 Ų | 91 | 130.3 Ų | 130.3 | 64% | 0.636 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 130.5 | 173 | 51.5 | 0 | 0 | 0 | 0 | 110 | Y32 | Y32-S34 PolarHBondContact O-N 3.47Š|
| 35 | P | 71.1 | Confident | 62.5 | Low | 101 Ų | 101 | 134.6 Ų | 134.6 | 66% | 0.656 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 140.6 | 170.3 | 27 | -31.2 | 0 | 0 | 0 | 109.6 | | |
| 36 | S | 68.9 | Low | 62 | Low | 65 Ų | 65 | 133.9 Ų | 133.9 | 46% | 0.455 | 74% | 0.736 | S | S | . | * | P | Polyproline II helix | trans | -66 | 133.4 | -179.5 | 179.6 | 0 | 0 | 0 | 0 | 109.9 | F38 D39 | S36-F38 PolarHBondContact O-N 3.37Å; S36-D39 PolarHBondContact O-N 3.05Å |
| 37 | P | 65.6 | Low | 61.4 | Low | 118 Ų | 118 | 137 Ų | 137 | 77% | 0.766 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.5 | -6.6 | -178.8 | -21.9 | 32.4 | 0 | 0 | 0 | 115.5 | | |
| 38 | F | 59.6 | Low | 61.2 | Low | 183 Ų | 183 | 139.8 Ų | 139.8 | 80% | 0.803 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106 | 6.8 | -173.3 | -68.8 | -76.1 | 0 | 0 | 0 | 114.9 | S36 C40 | S36-F38 PolarHBondContact O-N 3.37Å; F38-C40 VanDerWaalsContact C-N 3.32Å; F38-C40 PolarHBondContact O-N 3.49Å |
| 39 | D | 59.5 | Low | 60.8 | Low | 130 Ų | 130 | 142.3 Ų | 142.3 | 70% | 0.695 | 74% | 0.74 | S | S | * | * | | | trans | -85.6 | 8.1 | -179.5 | -77.4 | -30.3 | 0 | 0 | 0 | 115 | S36 S41 | S36-D39 PolarHBondContact O-N 3.05Å; D39-S41 PolarHBondContact O-N 2.88Å |
| 40 | C | 56.7 | Low | 60 | Low | 132 Ų | 132 | 141.8 Ų | 141.8 | 89% | 0.892 | 74% | 0.737 | S | S | * | * | | | trans | -93.7 | 75.1 | 167.7 | -73.7 | 0 | 0 | 0 | 0 | 110 | F38 | F38-C40 VanDerWaalsContact C-N 3.32Å; F38-C40 PolarHBondContact O-N 3.49Å |
| 41 | S | 56.3 | Low | 59.6 | Low | 97 Ų | 97 | 140.4 Ų | 140.4 | 68% | 0.678 | 74% | 0.741 | S | S | * | * | | | trans | -81.3 | 145.7 | 166.4 | 60.2 | 0 | 0 | 0 | 0 | 111.4 | D39 | D39-S41 PolarHBondContact O-N 2.88Š|
| 42 | T | 48 | Very low | 59.1 | Low | 132 Ų | 132 | 137.5 Ų | 137.5 | 81% | 0.81 | 74% | 0.735 | S | S | * | * | | | trans | 83.4 | 121.6 | 156.7 | 21.2 | 0 | 0 | 0 | 0 | 119.8 | | |
| 43 | D | 52.4 | Low | 58.6 | Low | 138 Ų | 138 | 134.3 Ų | 134.3 | 74% | 0.738 | 74% | 0.737 | S | S | * | * | | | trans | 86.1 | 85 | 139.5 | -150.6 | 67.5 | 0 | 0 | 0 | 117.7 | | |
| 44 | Q | 49.8 | Very low | 57.7 | Low | 196 Ų | 196 | 134.4 Ų | 134.4 | 92% | 0.916 | 74% | 0.74 | S | S | * | * | | | trans | -159.8 | 96.5 | 133.2 | -110.7 | 167.8 | 59.5 | 0 | 0 | 111.2 | | |
| 45 | E | 50.7 | Low | 56.7 | Low | 179 Ų | 179 | 136.1 Ų | 136.1 | 84% | 0.836 | 75% | 0.75 | S | S | * | * | | | trans | -65.3 | 163.3 | 160.5 | -154.3 | 175 | 127.2 | 0 | 0 | 110.5 | | |
| 46 | E | 55.7 | Low | 56.4 | Low | 143 Ų | 143 | 138.4 Ų | 138.4 | 67% | 0.668 | 76% | 0.756 | S | S | * | * | | | trans | 91.9 | 115 | 169.5 | -75.6 | -153.1 | 124.4 | 0 | 0 | 121.2 | | |
| 47 | K | 53.8 | Low | 55.9 | Low | 159 Ų | 159 | 140.7 Ų | 140.7 | 69% | 0.691 | 77% | 0.769 | S | S | * | * | | | trans | 72.8 | 94 | 139 | -69.3 | 170.5 | 173.1 | 135 | 0 | 118.2 | | |
| 48 | I | 59.8 | Low | 55.5 | Low | 171 Ų | 171 | 144.1 Ų | 144.1 | 88% | 0.877 | 78% | 0.775 | S | S | * | * | | | | -142.2 | 90.3 | 122.1 | -49.2 | 179.9 | 0 | 0 | 0 | 108.2 | | |
| 49 | E | 55.4 | Low | 55.5 | Low | 180 Ų | 180 | 143.6 Ų | 143.6 | 84% | 0.841 | 77% | 0.772 | S | S | * | * | | | trans | -84.9 | 111.9 | 157.7 | 178.1 | 158.6 | -166.2 | 0 | 0 | 106.9 | | |
| 50 | D | 51.2 | Low | 55.2 | Low | 141 Ų | 141 | 144.3 Ų | 144.3 | 75% | 0.754 | 78% | 0.776 | S | S | * | * | | | trans | -142 | 83.8 | 156.3 | -166.7 | 20.9 | 0 | 0 | 0 | 108.9 | | |
| 51 | V | 56.8 | Low | 55.3 | Low | 126 Ų | 126 | 145.9 Ų | 145.9 | 76% | 0.764 | 78% | 0.775 | S | S | * | * | | | trans | -76.8 | 109.3 | 157.3 | 162 | 0 | 0 | 0 | 0 | 106.6 | | |
| 52 | A | 53.7 | Low | 54.6 | Low | 70 Ų | 70 | 150 Ų | 150 | 58% | 0.579 | 78% | 0.777 | S | S | * | * | | | trans | 161.5 | 139.4 | 133.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | | |
| 53 | S | 59.7 | Low | 54.8 | Low | 94 Ų | 94 | 150.5 Ų | 150.5 | 66% | 0.657 | 78% | 0.78 | S | S | * | * | | | trans | 70.4 | 105.5 | 171.5 | 78.8 | 0 | 0 | 0 | 0 | 113.3 | | |
| 54 | H | 54.3 | Low | 54.7 | Low | 177 Ų | 177 | 148.5 Ų | 148.5 | 82% | 0.819 | 78% | 0.783 | S | S | * | * | | | | -155.8 | 96.5 | 66.1 | -66 | -74.6 | 0 | 0 | 0 | 110.2 | | |
| 55 | C | 52 | Low | 54.5 | Low | 126 Ų | 126 | 145.2 Ų | 145.2 | 85% | 0.851 | 77% | 0.767 | S | S | * | * | | | trans | -93.9 | 99.6 | 165.9 | -166.2 | 0 | 0 | 0 | 0 | 107.8 | | |
| 56 | L | 64.3 | Low | 54.7 | Low | 149 Ų | 149 | 145.5 Ų | 145.5 | 78% | 0.78 | 77% | 0.768 | S | S | * | * | | | trans | -85.3 | 130.3 | 164.4 | -67 | 175.3 | 0 | 0 | 0 | 107.7 | Q58 | L56-Q58 PolarHBondContact O-N 2.91Š|
| 57 | P | 58.3 | Low | 54.6 | Low | 113 Ų | 113 | 147.4 Ų | 147.4 | 73% | 0.734 | 78% | 0.777 | S | S | * | * | | | trans | -67.7 | 102.7 | 175.1 | 24.7 | -29.2 | 0 | 0 | 0 | 109.8 | K59 | P57-K59 VanDerWaalsContact C-N 3.26Å; P57-K59 PolarHBondContact O-N 2.81Å |
| 58 | Q | 57.8 | Low | 54.6 | Low | 190 Ų | 190 | 143.7 Ų | 143.7 | 89% | 0.888 | 78% | 0.776 | S | S | * | * | | | trans | -67.3 | 76.6 | 167 | -179.4 | -168.1 | -31.9 | 0 | 0 | 109.7 | L56 | L56-Q58 PolarHBondContact O-N 2.91Š|
| 59 | K | 59.1 | Low | 54.4 | Low | 172 Ų | 172 | 139.4 Ų | 139.4 | 75% | 0.748 | 77% | 0.767 | S | S | * | * | | | trans | -143.7 | 125.6 | 171.2 | -60.2 | -178.6 | -176.6 | 174.3 | 0 | 109.5 | P57 | P57-K59 VanDerWaalsContact C-N 3.26Å; P57-K59 PolarHBondContact O-N 2.81Å |
| 60 | D | 54.2 | Low | 54.3 | Low | 146 Ų | 146 | 136.9 Ų | 136.9 | 78% | 0.781 | 76% | 0.764 | S | S | * | * | S | Bend | trans | 91.6 | 45 | 157.7 | -46.4 | -24.8 | 0 | 0 | 0 | 120 | | |
| 61 | L | 57.6 | Low | 54.7 | Low | 164 Ų | 164 | 137.1 Ų | 137.1 | 86% | 0.859 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -133 | 2.4 | 169.5 | -82.5 | 176.6 | 0 | 0 | 0 | 118.6 | | |
| 62 | Y | 42.2 | Very low | 54.7 | Low | 184 Ų | 184 | 140.2 Ų | 140.2 | 72% | 0.722 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -154.2 | 43.6 | 177.5 | -131.1 | -86.4 | 0 | 0 | 0 | 117.3 | E65 | Y62-E65 PolarHBondContact OH-OE2 3.04Š|
| 63 | T | 52.7 | Low | 54.9 | Low | 142 Ų | 142 | 142.4 Ų | 142.4 | 87% | 0.871 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -130.1 | 45.7 | 169 | 31.3 | 0 | 0 | 0 | 0 | 112 | | |
| 64 | A | 49.3 | Very low | 55.1 | Low | 97 Ų | 97 | 149.7 Ų | 149.7 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -148.2 | -3.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | | |
| 65 | E | 46.4 | Very low | 55.6 | Low | 126 Ų | 126 | 149.6 Ų | 149.6 | 59% | 0.589 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -108.2 | 26 | 176.3 | -158.7 | -134.6 | 173.6 | 0 | 0 | 111.8 | Y62 | Y62-E65 PolarHBondContact OH-OE2 3.04Š|
| 66 | E | 54.7 | Low | 55.9 | Low | 185 Ų | 185 | 151.9 Ų | 151.9 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -88.7 | -7.2 | 173 | -165 | 173.4 | 127.5 | 0 | 0 | 112.3 | | |
| 67 | E | 54.3 | Low | 55.5 | Low | 183 Ų | 183 | 151.2 Ų | 151.2 | 86% | 0.855 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -113.6 | -2.6 | -163.9 | -136.9 | -141.4 | 164.7 | 0 | 0 | 117.5 | | |
| 68 | A | 53.7 | Low | 55.6 | Low | 81 Ų | 81 | 150.4 Ų | 150.4 | 67% | 0.669 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -119.2 | -10.5 | -172.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | | |
| 69 | A | 54.3 | Low | 55.7 | Low | 82 Ų | 82 | 148.5 Ų | 148.5 | 68% | 0.678 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -101.1 | 1.7 | -169.5 | 0 | 0 | 0 | 0 | 0 | 116 | | |
| 70 | T | 53.3 | Low | 55.7 | Low | 126 Ų | 126 | 148.2 Ų | 148.2 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | | | trans | -115.1 | 19.8 | -176.1 | 59.7 | 0 | 0 | 0 | 0 | 114.6 | F72 | T70-F72 PolarHBondContact O-N 3.03Š|
| 71 | L | 59.6 | Low | 56.2 | Low | 147 Ų | 147 | 144 Ų | 144 | 77% | 0.77 | 77% | 0.774 | S | S | * | * | | | trans | -72 | 49.7 | 173 | -72.7 | 170.9 | 0 | 0 | 0 | 114.2 | | |
| 72 | F | 56.3 | Low | 56.6 | Low | 190 Ų | 190 | 144.3 Ų | 144.3 | 83% | 0.833 | 77% | 0.774 | S | S | * | * | | | trans | -136.6 | 118 | 163.8 | -72.7 | -74.3 | 0 | 0 | 0 | 111.4 | T70 R74 | T70-F72 PolarHBondContact O-N 3.03Å; F72-R74 PolarHBondContact O-N 3.1Å |
| 73 | P | 58.9 | Low | 57.7 | Low | 116 Ų | 116 | 144.8 Ų | 144.8 | 75% | 0.753 | 78% | 0.782 | S | S | * | * | | | trans | -79.1 | 91.4 | 174 | 31.7 | -29.8 | 0 | 0 | 0 | 108.7 | K75 | P73-K75 PolarHBondContact O-N 2.8Å; P73-K75 VanDerWaalsContact O-N 3.1Å |
| 74 | R | 63.5 | Low | 58.3 | Low | 248 Ų | 248 | 144.8 Ų | 144.8 | 94% | 0.936 | 78% | 0.777 | S | S | * | * | | | trans | -78.6 | 98.2 | 173 | -162 | 173 | -176.9 | -178.9 | 0.3 | 109.7 | F72 | F72-R74 PolarHBondContact O-N 3.1Š|
| 75 | K | 65.8 | Low | 59 | Low | 174 Ų | 174 | 145.9 Ų | 145.9 | 76% | 0.757 | 78% | 0.779 | S | S | * | * | | | trans | -64 | 128.8 | 178.5 | -62.4 | 179.3 | 178.8 | -178 | 0 | 112 | P73 | P73-K75 PolarHBondContact O-N 2.8Å; P73-K75 VanDerWaalsContact O-N 3.1Å |
| 76 | M | 57.9 | Low | 59.8 | Low | 174 Ų | 174 | 143.3 Ų | 143.3 | 86% | 0.857 | 79% | 0.786 | S | S | * | * | | | trans | 55.2 | 121.2 | 132.9 | -51.8 | -179.8 | 85.4 | 0 | 0 | 120.4 | | |
| 77 | T | 55 | Low | 60.3 | Low | 135 Ų | 135 | 138 Ų | 138 | 83% | 0.828 | 78% | 0.781 | S | S | * | * | | | trans | 159.6 | 140.6 | 139.5 | -177 | 0 | 0 | 0 | 0 | 107.9 | | |
| 78 | S | 60.6 | Low | 61.1 | Low | 97 Ų | 97 | 132.7 Ų | 132.7 | 68% | 0.678 | 78% | 0.775 | S | S | * | * | | | cis | -170.6 | 152.5 | -17.1 | 55.5 | 0 | 0 | 0 | 0 | 104.8 | | |
| 79 | H | 59.6 | Low | 61.6 | Low | 150 Ų | 150 | 132 Ų | 132 | 69% | 0.694 | 78% | 0.777 | S | S | * | * | | | trans | 57.6 | 84 | 146.1 | -161 | -74.5 | 0 | 0 | 0 | 118 | | |
| 80 | N | 59.3 | Low | 61.7 | Low | 166 Ų | 166 | 134.5 Ų | 134.5 | 89% | 0.888 | 78% | 0.784 | S | S | * | * | | | trans | -123.1 | 64.8 | 143.7 | -84.4 | -12.9 | 0 | 0 | 0 | 109.1 | M82 | N80-M82 PolarHBondContact O-N 2.87Š|
| 81 | G | 65.8 | Low | 62.5 | Low | 57 Ų | 57 | 132.8 Ų | 132.8 | 59% | 0.588 | 79% | 0.791 | S | S | * | * | | | trans | -85.1 | 90.2 | 153.7 | 0 | 0 | 0 | 0 | 0 | 107.6 | | |
| 82 | M | 66 | Low | 63.1 | Low | 171 Ų | 171 | 131.8 Ų | 131.8 | 84% | 0.842 | 79% | 0.791 | S | S | * | * | | | trans | -148.2 | 51.5 | 165.6 | -162.1 | 139.2 | 68.9 | 0 | 0 | 112.3 | N80 | N80-M82 PolarHBondContact O-N 2.87Š|
| 83 | E | 64.4 | Low | 64 | Low | 193 Ų | 193 | 132.3 Ų | 132.3 | 90% | 0.902 | 79% | 0.793 | S | S | * | * | | | trans | -113.8 | 47.4 | 156.9 | 61.6 | -176.7 | 110.4 | 0 | 0 | 110.9 | S85 | E83-S85 VanDerWaalsContact C-N 3.27Å; E83-S85 PolarHBondContact O-N 3.2Å |
| 84 | D | 65.9 | Low | 65 | Low | 142 Ų | 142 | 136.7 Ų | 136.7 | 76% | 0.759 | 80% | 0.8 | S | S | * | * | | | trans | -91.9 | 73.5 | 149.9 | -172.3 | 24.6 | 0 | 0 | 0 | 108.7 | | |
| 85 | S | 62.9 | Low | 65.9 | Low | 120 Ų | 120 | 134.5 Ų | 134.5 | 84% | 0.839 | 80% | 0.797 | S | S | * | * | | | trans | -135.4 | 44.8 | 161.5 | -73.9 | 0 | 0 | 0 | 0 | 109.3 | E83 | E83-S85 VanDerWaalsContact C-N 3.27Å; E83-S85 PolarHBondContact O-N 3.2Å |
| 86 | G | 64.4 | Low | 66.7 | Low | 72 Ų | 72 | 136.7 Ų | 136.7 | 74% | 0.742 | 80% | 0.801 | S | S | * | * | | | trans | -104.7 | 30.3 | 169.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | G88 | G86-G88 PolarHBondContact O-N 2.91Š|
| 87 | G | 65.9 | Low | 67.8 | Low | 74 Ų | 74 | 136.6 Ų | 136.6 | 76% | 0.763 | 80% | 0.795 | S | S | * | * | | | trans | -86.6 | 81.3 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | | |
| 88 | G | 69.3 | Low | 68.8 | Low | 71 Ų | 71 | 139 Ų | 139 | 73% | 0.732 | 79% | 0.794 | S | S | * | * | | | trans | 69.7 | 105.6 | 142.3 | 0 | 0 | 0 | 0 | 0 | 118.3 | G86 | G86-G88 PolarHBondContact O-N 2.91Š|
| 89 | G | 65.5 | Low | 69.7 | Low | 68 Ų | 68 | 142.2 Ų | 142.2 | 70% | 0.701 | 80% | 0.796 | S | S | * | * | | | trans | -60.8 | 168.2 | 158.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | | |
| 90 | T | 56.3 | Low | 70.2 | Confident | 134 Ų | 134 | 142 Ų | 142 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | S | Bend | trans | 77.6 | 93.7 | 176.2 | 66.2 | 0 | 0 | 0 | 0 | 117.2 | V92 | T90-V92 PolarHBondContact O-N 3Å; T90-V92 VanDerWaalsContact C-N 3.28Å |
| 91 | G | 68.9 | Low | 70.2 | Confident | 90 Ų | 90 | 140.5 Ų | 140.5 | 93% | 0.928 | 80% | 0.795 | S | S | * | * | | | | 59.4 | 6.1 | 124.8 | 0 | 0 | 0 | 0 | 0 | 121.4 | K93 | G91-K93 PolarHBondContact O-N 3.18Š|
| 92 | V | 72.5 | Confident | 69.9 | Low | 126 Ų | 126 | 140.6 Ų | 140.6 | 76% | 0.764 | 80% | 0.796 | S | S | * | * | | | trans | -83.7 | 110.3 | 176.8 | -178.1 | 0 | 0 | 0 | 0 | 109.3 | T90 K94 | T90-V92 PolarHBondContact O-N 3Å; T90-V92 VanDerWaalsContact C-N 3.28Å; V92-K94 PolarHBondContact O-N 2.76Å |
| 93 | K | 76.8 | Confident | 69.4 | Low | 200 Ų | 200 | 140 Ų | 140 | 87% | 0.87 | 80% | 0.796 | S | S | * | * | | | trans | -58.1 | 114.7 | 171.4 | -83.1 | -176.1 | 175.1 | 173.3 | 0 | 109 | G91 K95 | G91-K93 PolarHBondContact O-N 3.18Å; K93-K95 PolarHBondContact O-N 3.17Å |
| 94 | K | 79.4 | Confident | 69.1 | Low | 208 Ų | 208 | 140.1 Ų | 140.1 | 90% | 0.904 | 80% | 0.797 | S | S | * | * | | | trans | -58.5 | 115.9 | 173 | -74.2 | -173.1 | 176.8 | 177.6 | 0 | 109.1 | V92 R96 | V92-K94 PolarHBondContact O-N 2.76Å; K94-R96 PolarHBondContact O-N 3.45Å |
| 95 | K | 81.2 | Confident | 68.5 | Low | 203 Ų | 203 | 142.7 Ų | 142.7 | 88% | 0.883 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 126.7 | 171.4 | -172.1 | 176.5 | -178.7 | 179.3 | 0 | 108.2 | K93 K97 | K93-K95 PolarHBondContact O-N 3.17Å; K95-K97 PolarHBondContact O-N 2.73Å |
| 96 | R | 82.4 | Confident | 67.8 | Low | 220 Ų | 220 | 140.9 Ų | 140.9 | 83% | 0.83 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 131.2 | 178.6 | -176 | 175.2 | 177.6 | 169.8 | 0.3 | 109.9 | K94 K98 | K94-R96 PolarHBondContact O-N 3.45Å; R96-K98 PolarHBondContact O-N 3.36Å |
| 97 | K | 81.3 | Confident | 66.7 | Low | 171 Ų | 171 | 142 Ų | 142 | 74% | 0.743 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 126.2 | 172.2 | -171.3 | 169.7 | 179 | 179 | 0 | 108.9 | K95 K99 | K95-K97 PolarHBondContact O-N 2.73Å; K97-K99 PolarHBondContact O-N 3.08Å |
| 98 | K | 77.5 | Confident | 66.2 | Low | 185 Ų | 185 | 143.1 Ų | 143.1 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 130 | 170.2 | -171.9 | 176.5 | 178.9 | -176.4 | 0 | 106.8 | R96 E100 | R96-K98 PolarHBondContact O-N 3.36Å; K98-E100 PolarHBondContact O-N 2.99Å |
| 99 | K | 78.6 | Confident | 65.4 | Low | 166 Ų | 166 | 149.5 Ų | 149.5 | 72% | 0.722 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 127.6 | 173.4 | -74.5 | -74.2 | -173.4 | 171.5 | 0 | 107.8 | K97 | K97-K99 PolarHBondContact O-N 3.08Š|
| 100 | E | 70.1 | Confident | 64.5 | Low | 145 Ų | 145 | 149.7 Ų | 149.7 | 68% | 0.678 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 134.5 | 169.6 | -73.5 | -68.7 | 155.4 | 0 | 0 | 108 | K98 G102 | K98-E100 PolarHBondContact O-N 2.99Å; E100-G102 PolarHBondContact O-N 2.96Å |
| 101 | P | 59.2 | Low | 64.2 | Low | 135 Ų | 135 | 148.4 Ų | 148.4 | 88% | 0.877 | 81% | 0.814 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | 43.5 | -177.4 | 35.2 | -36.5 | 0 | 0 | 0 | 111.9 | | |
| 102 | G | 59.3 | Low | 63.3 | Low | 59 Ų | 59 | 153.2 Ų | 153.2 | 61% | 0.608 | 81% | 0.81 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133 | -1.8 | -170.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | E100 Q104 | E100-G102 PolarHBondContact O-N 2.96Å; G102-Q104 PolarHBondContact O-N 2.93Å; G102-Q104 VanDerWaalsContact C-N 3.29Å |
| 103 | D | 55.3 | Low | 62.5 | Low | 159 Ų | 159 | 154.6 Ų | 154.6 | 85% | 0.85 | 81% | 0.813 | S | S | * | * | | | trans | -97.3 | 40.9 | -179.7 | -137 | 7.1 | 0 | 0 | 0 | 112 | | |
| 104 | Q | 59.3 | Low | 61.7 | Low | 195 Ų | 195 | 154.4 Ų | 154.4 | 91% | 0.911 | 81% | 0.807 | S | S | * | * | | | trans | -134.4 | 69.2 | 164.6 | -79.3 | -163.8 | 15.6 | 0 | 0 | 108.8 | G102 | G102-Q104 PolarHBondContact O-N 2.93Å; G102-Q104 VanDerWaalsContact C-N 3.29Å |
| 105 | E | 52.6 | Low | 60.6 | Low | 196 Ų | 196 | 153.1 Ų | 153.1 | 92% | 0.916 | 80% | 0.804 | S | S | * | * | | | trans | -135.2 | 93.3 | 160.1 | -158.7 | 163.7 | 168.8 | 0 | 0 | 109.7 | | |
| 106 | G | 47.3 | Very low | 59.4 | Low | 81 Ų | 81 | 149.4 Ų | 149.4 | 84% | 0.835 | 80% | 0.8 | S | S | * | * | | | trans | -176.9 | 23 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | | |
| 107 | A | 43 | Very low | 58.1 | Low | 96 Ų | 96 | 146.4 Ų | 146.4 | 79% | 0.793 | 79% | 0.794 | S | S | * | * | | | trans | -127.3 | 86.5 | 162.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | K109 | A107-K109 PolarHBondContact O-N 3.28Å; A107-K109 VanDerWaalsContact O-N 3.1Å |
| 108 | A | 53.7 | Low | 57.1 | Low | 98 Ų | 98 | 144.5 Ų | 144.5 | 81% | 0.81 | 80% | 0.799 | S | S | * | * | | | trans | -54.4 | 115.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 109 | K | 53.2 | Low | 56.3 | Low | 205 Ų | 205 | 145 Ų | 145 | 89% | 0.891 | 80% | 0.801 | S | S | * | * | S | Bend | trans | 72 | 96.1 | 160.9 | -48.2 | -151.4 | -175.2 | -171 | 0 | 117.2 | A107 | A107-K109 PolarHBondContact O-N 3.28Å; A107-K109 VanDerWaalsContact O-N 3.1Å |
| 110 | G | 46.3 | Very low | 55.3 | Low | 72 Ų | 72 | 147.9 Ų | 147.9 | 74% | 0.742 | 81% | 0.807 | S | S | * | * | | | | 95.2 | 92.4 | 127.6 | 0 | 0 | 0 | 0 | 0 | 116.9 | | |
| 111 | S | 50 | Low | 54.6 | Low | 106 Ų | 106 | 149.3 Ų | 149.3 | 74% | 0.741 | 81% | 0.811 | S | S | * | * | | | trans | 39.9 | 99.5 | 130.3 | -167.9 | 0 | 0 | 0 | 0 | 117.2 | | |
| 112 | K | 50.9 | Low | 54.4 | Low | 192 Ų | 192 | 153.5 Ų | 153.5 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | | | | 170.7 | 103.4 | 115.4 | -89.6 | 158.5 | -170.2 | 176 | 0 | 110.7 | R114 | K112-R114 PolarHBondContact O-N 3.21Š|
| 113 | D | 56.2 | Low | 54.6 | Low | 155 Ų | 155 | 159 Ų | 159 | 83% | 0.829 | 82% | 0.819 | S | S | * | * | | | trans | -24.1 | 109.2 | 137 | -179.7 | 45.3 | 0 | 0 | 0 | 113.1 | | |
| 114 | R | 58.1 | Low | 54.6 | Low | 195 Ų | 195 | 157 Ų | 157 | 74% | 0.736 | 82% | 0.815 | S | S | * | * | | | trans | 159.7 | 109.1 | 146.1 | -95.2 | -179.5 | 168.9 | 169.1 | 2.4 | 111.4 | K112 | K112-R114 PolarHBondContact O-N 3.21Š|
| 115 | E | 57.3 | Low | 54.4 | Low | 182 Ų | 182 | 156.4 Ų | 156.4 | 85% | 0.85 | 81% | 0.809 | S | S | * | * | | | trans | -49.2 | 152 | 159.9 | -81.8 | 175.1 | 149.4 | 0 | 0 | 112.5 | K117 | E115-K117 PolarHBondContact O-N 2.94Å; E115-K117 VanDerWaalsContact O-N 3.1Å |
| 116 | P | 55.8 | Low | 54.8 | Low | 124 Ų | 124 | 156.8 Ų | 156.8 | 81% | 0.805 | 81% | 0.811 | S | S | * | * | | | trans | -69.8 | 108.6 | -169.5 | 27.5 | -33.6 | 0 | 0 | 0 | 112 | P118 | P116-P118 WeakPolarHBondContact O-CD 3.19Š|
| 117 | K | 55.6 | Low | 55.6 | Low | 158 Ų | 158 | 157.3 Ų | 157.3 | 69% | 0.687 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 128.7 | 167.9 | -94.7 | -178.9 | 172.2 | 178.5 | 0 | 111.9 | E115 K119 | E115-K117 PolarHBondContact O-N 2.94Å; E115-K117 VanDerWaalsContact O-N 3.1Å; K117-K119 PolarHBondContact O-N 3.45Å |
| 118 | P | 60.8 | Low | 55.8 | Low | 131 Ų | 131 | 161.3 Ų | 161.3 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -68 | 120.4 | 153.1 | 24.7 | -27.8 | 0 | 0 | 0 | 109.7 | P116 | P116-P118 WeakPolarHBondContact O-CD 3.19Š|
| 119 | K | 60.3 | Low | 56.1 | Low | 195 Ų | 195 | 163.2 Ų | 163.2 | 85% | 0.848 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 127.9 | 173.1 | -73.9 | 173.8 | 177.1 | 169.8 | 0 | 109.7 | K117 | K117-K119 PolarHBondContact O-N 3.45Š|
| 120 | R | 57.5 | Low | 56.4 | Low | 227 Ų | 227 | 158.5 Ų | 158.5 | 86% | 0.857 | 78% | 0.782 | S | S | * | * | | | trans | 166.8 | 149.5 | 139.2 | -92.1 | 179.8 | 152.2 | 91.9 | -3.4 | 109.2 | | |
| 121 | K | 54 | Low | 56.7 | Low | 174 Ų | 174 | 165.2 Ų | 165.2 | 76% | 0.757 | 79% | 0.785 | S | S | * | * | | | cis | -164.5 | 152 | -16.2 | -88.7 | -95.6 | 177.2 | -179.1 | 0 | 105 | | |
| 122 | R | 55.3 | Low | 56.9 | Low | 224 Ų | 224 | 168.7 Ų | 168.7 | 85% | 0.845 | 79% | 0.786 | S | S | * | * | | | trans | 74.6 | 133.6 | 162 | -102 | 179.5 | 157.2 | 120.6 | -3.4 | 116.4 | | |
| 123 | E | 64.1 | Low | 57.3 | Low | 173 Ų | 173 | 164.1 Ų | 164.1 | 81% | 0.808 | 79% | 0.785 | S | S | * | * | | | cis | -132.2 | 160.8 | 25.8 | -69 | -165.8 | 147.6 | 0 | 0 | 115.7 | | |
| 124 | P | 55.7 | Low | 57.1 | Low | 117 Ų | 117 | 166.6 Ų | 166.6 | 76% | 0.76 | 79% | 0.788 | S | S | * | * | | | trans | -82 | 127.6 | -177.2 | -2.7 | 22.8 | 0 | 0 | 0 | 113 | | |
| 125 | K | 54.4 | Low | 57.2 | Low | 184 Ų | 184 | 166 Ų | 166 | 80% | 0.8 | 79% | 0.794 | S | S | * | * | | | trans | 26 | 115.7 | 147.9 | -121.7 | 171.4 | -177.1 | 173.4 | 0 | 117.6 | P127 | K125-P127 HydrophobicContact CG-CB 4.44Š|
| 126 | E | 61.1 | Low | 57.1 | Low | 203 Ų | 203 | 163 Ų | 163 | 95% | 0.949 | 79% | 0.79 | S | S | * | * | | | trans | -94.4 | 116.6 | 138.3 | -82 | -165.3 | 163.1 | 0 | 0 | 109.3 | | |
| 127 | P | 63.4 | Low | 57 | Low | 92 Ų | 92 | 166.4 Ų | 166.4 | 60% | 0.597 | 79% | 0.792 | S | S | * | * | | | trans | -106.4 | 111.4 | 178.3 | 34.1 | -22.6 | 0 | 0 | 0 | 111.2 | K125 | K125-P127 HydrophobicContact CG-CB 4.44Š|
| 128 | K | 47.4 | Very low | 57.2 | Low | 181 Ų | 181 | 167.9 Ų | 167.9 | 79% | 0.787 | 80% | 0.798 | S | S | * | * | | | trans | 171.1 | 138.7 | 152.2 | -109 | 159.7 | 171.3 | 171 | 0 | 110.3 | | |
| 129 | E | 60.8 | Low | 56.8 | Low | 137 Ų | 137 | 166.1 Ų | 166.1 | 64% | 0.64 | 80% | 0.795 | S | S | * | * | | | cis | -168 | 161.9 | -10.3 | -118.6 | 175.2 | -142.2 | 0 | 0 | 106.2 | | |
| 130 | P | 60.2 | Low | 56.4 | Low | 107 Ų | 107 | 166.9 Ų | 166.9 | 70% | 0.695 | 80% | 0.798 | S | S | * | * | | | trans | -89.2 | 133.3 | -175 | 34.4 | -27.7 | 0 | 0 | 0 | 111.3 | | |
| 131 | R | 52.4 | Low | 56.5 | Low | 212 Ų | 212 | 163.2 Ų | 163.2 | 80% | 0.8 | 79% | 0.791 | S | S | * | * | | | trans | 178.8 | 131.4 | 167.5 | -100 | 142.7 | -173 | -141.9 | 7.8 | 109 | | |
| 132 | K | 53.3 | Low | 56.4 | Low | 179 Ų | 179 | 161.8 Ų | 161.8 | 78% | 0.778 | 79% | 0.787 | S | S | * | * | | | cis | -159.3 | 160.3 | 3.2 | -75.1 | -148 | 174.8 | -170.3 | 0 | 108.6 | | |
| 133 | A | 59.1 | Low | 56.1 | Low | 97 Ų | 97 | 160.7 Ų | 160.7 | 80% | 0.802 | 79% | 0.788 | S | S | * | * | | | trans | -47.2 | 139.5 | 156.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 134 | K | 53.4 | Low | 55.9 | Low | 207 Ų | 207 | 161 Ų | 161 | 90% | 0.9 | 79% | 0.789 | S | S | * | * | | | trans | -159.9 | 92.3 | 147.7 | -108.5 | -177.6 | -178.8 | -178.3 | 0 | 109.3 | | |
| 135 | E | 59.9 | Low | 55.8 | Low | 182 Ų | 182 | 160.2 Ų | 160.2 | 85% | 0.85 | 78% | 0.784 | S | S | * | * | | | trans | -58.4 | 178.1 | 140.6 | -64.3 | 179.5 | 153.4 | 0 | 0 | 108.9 | | |
| 136 | P | 54.4 | Low | 55.7 | Low | 118 Ų | 118 | 160.9 Ų | 160.9 | 77% | 0.766 | 79% | 0.787 | S | S | * | * | | | cis | -117.1 | 167.3 | -48.9 | 30.7 | -15.5 | 0 | 0 | 0 | 109.7 | | |
| 137 | K | 54.4 | Low | 55.1 | Low | 197 Ų | 197 | 160.4 Ų | 160.4 | 86% | 0.857 | 79% | 0.785 | S | S | * | * | | | trans | -136.6 | 92.4 | 165.7 | -117.4 | 179 | -176 | 177.3 | 0 | 112.8 | | |
| 138 | K | 58.4 | Low | 54.6 | Low | 189 Ų | 189 | 165.3 Ų | 165.3 | 82% | 0.822 | 80% | 0.797 | S | S | * | * | | | trans | 61.7 | 110.7 | 140.8 | -56.9 | -169.1 | 178.3 | -167.6 | 0 | 119 | K140 | K138-K140 PolarHBondContact O-N 3.34Š|
| 139 | A | 52.7 | Low | 54.5 | Low | 94 Ų | 94 | 167.9 Ų | 167.9 | 78% | 0.777 | 82% | 0.819 | S | S | * | * | | | trans | -46.3 | 126 | 147.1 | 0 | 0 | 0 | 0 | 0 | 110 | E141 | A139-E141 VanDerWaalsContact C-N 3.35Å; A139-E141 PolarHBondContact O-N 3.42Å |
| 140 | K | 52.5 | Low | 54.2 | Low | 211 Ų | 211 | 169.5 Ų | 169.5 | 92% | 0.917 | 83% | 0.828 | S | S | * | * | | | trans | -93.2 | 80.7 | 164.6 | -170.4 | 174.7 | -177.5 | 178.6 | 0 | 106.9 | K138 | K138-K140 PolarHBondContact O-N 3.34Š|
| 141 | E | 59.4 | Low | 53.9 | Low | 149 Ų | 149 | 172.7 Ų | 172.7 | 70% | 0.696 | 84% | 0.835 | S | S | * | * | | | trans | -84.2 | 145.6 | 167.4 | -134.4 | 174.4 | -165.7 | 0 | 0 | 109.3 | A139 | A139-E141 VanDerWaalsContact C-N 3.35Å; A139-E141 PolarHBondContact O-N 3.42Å |
| 142 | H | 51 | Low | 54 | Low | 145 Ų | 145 | 170.6 Ų | 170.6 | 67% | 0.671 | 84% | 0.837 | S | S | * | * | | | trans | 71.8 | 97 | 169.8 | -51.6 | -71.1 | 0 | 0 | 0 | 119.2 | | |
| 143 | K | 50.9 | Low | 54 | Low | 200 Ų | 200 | 170.1 Ų | 170.1 | 87% | 0.87 | 84% | 0.841 | S | S | * | * | | | | -126.2 | 93.5 | 126 | -90 | -166.3 | 174.6 | -172.2 | 0 | 108.5 | | |
| 144 | E | 58.9 | Low | 53.7 | Low | 179 Ų | 179 | 174.6 Ų | 174.6 | 84% | 0.836 | 84% | 0.843 | S | S | * | * | | | trans | -65.1 | 140 | 141.8 | -72.6 | -174 | 152.6 | 0 | 0 | 107.3 | | |
| 145 | P | 53.2 | Low | 53.7 | Low | 102 Ų | 102 | 172.5 Ų | 172.5 | 66% | 0.662 | 84% | 0.84 | S | S | * | * | | | | -145.2 | 134.6 | 124.9 | 29.9 | -11.5 | 0 | 0 | 0 | 114.5 | | |
| 146 | K | 51.8 | Low | 53.3 | Low | 198 Ų | 198 | 171.8 Ų | 171.8 | 86% | 0.861 | 84% | 0.839 | S | S | * | * | | | trans | 75.7 | 108.8 | 138.7 | -70.8 | -177.1 | 173.7 | -179.5 | 0 | 118.6 | | |
| 147 | Q | 50.2 | Low | 53.2 | Low | 192 Ų | 192 | 175.9 Ų | 175.9 | 90% | 0.897 | 84% | 0.844 | S | S | * | * | | | trans | -20.6 | 133.6 | 142.7 | -69.1 | 177.2 | -47.4 | 0 | 0 | 114.1 | | |
| 148 | K | 51.7 | Low | 53.1 | Low | 195 Ų | 195 | 174.2 Ų | 174.2 | 85% | 0.848 | 84% | 0.843 | S | S | * | * | | | trans | -145.4 | 117.9 | 144.2 | -72.3 | -157 | 174.7 | -163.5 | 0 | 108.8 | | |
| 149 | D | 46.2 | Very low | 52.6 | Low | 236 Ų | 236 | 172.8 Ų | 172.8 | 100% | 1.262 | 85% | 0.845 | S | S | * | * | | | trans | 50.3 | 0 | 160.6 | -57.1 | -43.6 | 0 | 0 | 0 | 120.3 | | |