| 1 | M | 48.8 | Very low | 56.5 | Low | 246 Ų | 246 | 152.2 Ų | 152.2 | 100% | 1.212 | 81% | 0.811 | S | S | * | * | | | | 0 | 125.3 | 0 | -75.6 | 164.2 | 150.7 | 0 | 0 | 108.3 | | |
| 2 | S | 47.4 | Very low | 56.5 | Low | 107 Ų | 107 | 151.4 Ų | 151.4 | 75% | 0.748 | 82% | 0.821 | S | S | * | * | | | trans | -64.7 | 131.1 | -161.5 | 45.3 | 0 | 0 | 0 | 0 | 115 | L4 | S2-L4 PolarHBondContact O-N 3.43Š|
| 3 | R | 62.5 | Low | 56.2 | Low | 222 Ų | 222 | 145.5 Ų | 145.5 | 84% | 0.838 | 82% | 0.817 | S | S | * | * | | | trans | -80.6 | 107.2 | 162.9 | -65.8 | -178.1 | -173.8 | -173.7 | 0.9 | 108.3 | F5 | R3-F5 HydrophobicContact CB-CE2 4.24Å; R3-F5 PolarHBondContact O-N 3.43Å |
| 4 | L | 65 | Low | 56 | Low | 129 Ų | 129 | 145.1 Ų | 145.1 | 68% | 0.675 | 82% | 0.819 | S | S | * | * | | | trans | -75.9 | 101.5 | 171.1 | -79.6 | 156.7 | 0 | 0 | 0 | 108.6 | S2 Y6 | S2-L4 PolarHBondContact O-N 3.43Å; L4-Y6 HydrophobicContact CB-CE2 4.21Å; L4-Y6 PolarHBondContact O-N 3.23Å |
| 5 | F | 57.2 | Low | 56.1 | Low | 183 Ų | 183 | 140 Ų | 140 | 80% | 0.803 | 81% | 0.812 | S | S | * | * | | | trans | -78.3 | 107.5 | 161.6 | -72.9 | -87.8 | 0 | 0 | 0 | 107.8 | R3 G7 | R3-F5 HydrophobicContact CB-CE2 4.24Å; R3-F5 PolarHBondContact O-N 3.43Å; F5-G7 PolarHBondContact O-N 3.09Å; F5-G7 VanDerWaalsContact O-N 3.09Å |
| 6 | Y | 56.8 | Low | 56.2 | Low | 200 Ų | 200 | 135.9 Ų | 135.9 | 78% | 0.784 | 80% | 0.799 | S | S | * | * | | | trans | -74.2 | 97.6 | 166 | -72.4 | -82.7 | 0 | 0 | 0 | 108.2 | L4 V8 | L4-Y6 HydrophobicContact CB-CE2 4.21Å; L4-Y6 PolarHBondContact O-N 3.23Å; Y6-V8 PolarHBondContact O-N 3.18Å |
| 7 | G | 54.6 | Low | 56.4 | Low | 74 Ų | 74 | 135.3 Ų | 135.3 | 76% | 0.763 | 80% | 0.8 | S | S | * | * | | | trans | -65.8 | 110.5 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110 | F5 K9 | F5-G7 PolarHBondContact O-N 3.09Å; F5-G7 VanDerWaalsContact O-N 3.09Å; G7-K9 PolarHBondContact O-N 3.21Å |
| 8 | V | 56.1 | Low | 56.6 | Low | 137 Ų | 137 | 140.9 Ų | 140.9 | 83% | 0.83 | 81% | 0.805 | S | S | * | * | | | trans | -71.1 | 106.1 | 163.5 | 167.3 | 0 | 0 | 0 | 0 | 107 | Y6 P10 | Y6-V8 PolarHBondContact O-N 3.18Å; V8-P10 WeakPolarHBondContact O-CD 3.46Å |
| 9 | K | 61.8 | Low | 56.8 | Low | 191 Ų | 191 | 146.5 Ų | 146.5 | 83% | 0.83 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 122.4 | 170.5 | -127.6 | -171 | 173.8 | 91.7 | 0 | 107.8 | G7 G11 | G7-K9 PolarHBondContact O-N 3.21Å; K9-G11 PolarHBondContact O-N 3.19Å |
| 10 | P | 55.5 | Low | 56.9 | Low | 122 Ų | 122 | 144.7 Ų | 144.7 | 79% | 0.792 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 116.6 | 166.5 | 27.2 | -30.3 | 0 | 0 | 0 | 107.8 | V8 | V8-P10 WeakPolarHBondContact O-CD 3.46Š|
| 11 | G | 56.1 | Low | 57.1 | Low | 63 Ų | 63 | 140.4 Ų | 140.4 | 65% | 0.649 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 149 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | K9 G13 | K9-G11 PolarHBondContact O-N 3.19Å; G11-G13 PolarHBondContact O-N 3.26Å |
| 12 | P | 56.4 | Low | 57.8 | Low | 143 Ų | 143 | 135.9 Ų | 135.9 | 93% | 0.929 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -74.6 | 124.2 | 176.4 | 30.7 | -29.6 | 0 | 0 | 0 | 109.1 | | |
| 13 | G | 52.8 | Low | 58.6 | Low | 74 Ų | 74 | 136.4 Ų | 136.4 | 76% | 0.763 | 77% | 0.773 | S | S | * | * | | | trans | 141.8 | 51 | 165.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | G11 G15 | G11-G13 PolarHBondContact O-N 3.26Å; G13-G15 VanDerWaalsContact C-N 3.3Å; G13-G15 PolarHBondContact O-N 3.43Å; G13-G15 VanDerWaalsContact O-N 3.12Å |
| 14 | V | 53 | Low | 58.8 | Low | 141 Ų | 141 | 132.1 Ų | 132.1 | 86% | 0.855 | 76% | 0.76 | S | S | * | * | | | trans | -75.8 | 93.3 | 154.4 | 177.9 | 0 | 0 | 0 | 0 | 106.9 | A16 | V14-A16 PolarHBondContact O-N 3.03Š|
| 15 | G | 58.3 | Low | 59.2 | Low | 68 Ų | 68 | 131.2 Ų | 131.2 | 70% | 0.701 | 76% | 0.76 | S | S | * | * | | | trans | -68.8 | 119.6 | 149.2 | 0 | 0 | 0 | 0 | 0 | 106.7 | G13 | G13-G15 VanDerWaalsContact C-N 3.3Å; G13-G15 PolarHBondContact O-N 3.43Å; G13-G15 VanDerWaalsContact O-N 3.12Å |
| 16 | A | 56.8 | Low | 60.2 | Low | 74 Ų | 74 | 127 Ų | 127 | 61% | 0.612 | 75% | 0.75 | S | S | * | * | | | trans | -50 | 140.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 110 | V14 R18 | V14-A16 PolarHBondContact O-N 3.03Å; A16-R18 PolarHBondContact O-N 2.99Å |
| 17 | P | 60.2 | Low | 60.8 | Low | 126 Ų | 126 | 123.6 Ų | 123.6 | 82% | 0.818 | 75% | 0.745 | S | S | * | * | | | trans | -58.3 | 105.4 | 170.1 | -15.1 | 27.4 | 0 | 0 | 0 | 107 | R19 | P17-R19 PolarHBondContact O-N 3.44Š|
| 18 | R | 59 | Low | 61.8 | Low | 236 Ų | 236 | 125.4 Ų | 125.4 | 89% | 0.891 | 74% | 0.743 | S | S | * | * | | | trans | -60.9 | 117.8 | 169.5 | -71.2 | -172.5 | -179.3 | -89.9 | 0.2 | 105 | A16 S20 | A16-R18 PolarHBondContact O-N 2.99Å; R18-S20 PolarHBondContact O-N 3.15Å |
| 19 | R | 60.1 | Low | 62.4 | Low | 247 Ų | 247 | 129.1 Ų | 129.1 | 93% | 0.932 | 74% | 0.742 | S | S | * | * | | | trans | -56.2 | 88.9 | 164.3 | -80.5 | 175.2 | 64.2 | -141.1 | 2.1 | 107.1 | P17 G21 | P17-R19 PolarHBondContact O-N 3.44Å; R19-G21 PolarHBondContact O-N 3.12Å |
| 20 | S | 59.1 | Low | 62.5 | Low | 111 Ų | 111 | 131.4 Ų | 131.4 | 78% | 0.776 | 75% | 0.745 | S | S | * | * | | | trans | -80.1 | 66.9 | 167.5 | 173 | 0 | 0 | 0 | 0 | 107 | R18 H22 | R18-S20 PolarHBondContact O-N 3.15Å; S20-H22 PolarHBondContact O-N 3.49Å |
| 21 | G | 60.8 | Low | 62.5 | Low | 54 Ų | 54 | 131.6 Ų | 131.6 | 56% | 0.557 | 75% | 0.748 | S | S | * | * | | | trans | -63.4 | 125.8 | 158 | 0 | 0 | 0 | 0 | 0 | 107.1 | R19 T23 | R19-G21 PolarHBondContact O-N 3.12Å; G21-T23 PolarHBondContact O-N 3.45Å |
| 22 | H | 65.3 | Low | 62.7 | Low | 152 Ų | 152 | 132.6 Ų | 132.6 | 70% | 0.704 | 75% | 0.75 | S | S | * | * | | | trans | -76.2 | 71.8 | 176.1 | -170.4 | 67 | 0 | 0 | 0 | 109.2 | S20 | S20-H22 PolarHBondContact O-N 3.49Š|
| 23 | T | 63.9 | Low | 62.5 | Low | 118 Ų | 118 | 131.4 Ų | 131.4 | 72% | 0.724 | 74% | 0.742 | S | S | * | * | | | trans | -94 | 109.8 | 174.8 | -54.5 | 0 | 0 | 0 | 0 | 107.5 | G21 T25 | G21-T23 PolarHBondContact O-N 3.45Å; T23-T25 PolarHBondContact O-N 3.28Å |
| 24 | F | 66.2 | Low | 62.1 | Low | 131 Ų | 131 | 133.8 Ų | 133.8 | 58% | 0.575 | 74% | 0.744 | S | S | * | * | | | trans | -77.4 | 119.1 | 169.4 | 68.5 | -80.9 | 0 | 0 | 0 | 108 | V26 | F24-V26 HydrophobicContact CD2-CG2 3.58Å; F24-V26 HydrophobicContact CE2-CG2 3.35Å; F24-V26 HydrophobicContact CZ-CG2 4.49Å; F24-V26 PolarHBondContact O-N 3.25Å |
| 25 | T | 74.3 | Confident | 62 | Low | 110 Ų | 110 | 131.7 Ų | 131.7 | 68% | 0.675 | 74% | 0.742 | S | S | * | * | | | trans | -81.6 | 110.7 | 177.4 | -51.1 | 0 | 0 | 0 | 0 | 108.7 | T23 N27 | T23-T25 PolarHBondContact O-N 3.28Å; T25-N27 PolarHBondContact O-N 2.81Å |
| 26 | V | 76.4 | Confident | 61.7 | Low | 96 Ų | 96 | 133.7 Ų | 133.7 | 58% | 0.582 | 75% | 0.745 | S | S | * | * | | | trans | -81.7 | 102.4 | 168.6 | -174.3 | 0 | 0 | 0 | 0 | 107.7 | F24 P28 | F24-V26 HydrophobicContact CD2-CG2 3.58Å; F24-V26 HydrophobicContact CE2-CG2 3.35Å; F24-V26 HydrophobicContact CZ-CG2 4.49Å; F24-V26 PolarHBondContact O-N 3.25Å; V26-P28 WeakPolarHBondContact O-CD 3.43Å |
| 27 | N | 71.2 | Confident | 61.1 | Low | 128 Ų | 128 | 135.8 Ų | 135.8 | 68% | 0.684 | 75% | 0.753 | S | S | * | * | | | trans | -88.5 | 104.8 | 168.1 | -81 | -51.2 | 0 | 0 | 0 | 108.5 | T25 R29 | T25-N27 PolarHBondContact O-N 2.81Å; N27-R29 PolarHBondContact O-N 3.27Å |
| 28 | P | 74.4 | Confident | 60.2 | Low | 111 Ų | 111 | 134 Ų | 134 | 72% | 0.721 | 75% | 0.749 | S | S | * | * | | | trans | -62.6 | 115.6 | 173.9 | 25 | -31.2 | 0 | 0 | 0 | 108 | V26 R30 | V26-P28 WeakPolarHBondContact O-CD 3.43Å; P28-R30 PolarHBondContact O-N 3.21Å |
| 29 | R | 68.8 | Low | 59.5 | Low | 215 Ų | 215 | 128.5 Ų | 128.5 | 81% | 0.811 | 74% | 0.744 | S | S | * | * | | | trans | -64.9 | 110.4 | 172.4 | -65.2 | -169.3 | -169.6 | -140.5 | 4.2 | 106.6 | N27 C31 | N27-R29 PolarHBondContact O-N 3.27Å; R29-C31 PolarHBondContact O-N 2.92Å; R29-C31 VanDerWaalsContact O-N 3.08Å |
| 30 | R | 64.3 | Low | 59.4 | Low | 240 Ų | 240 | 122.1 Ų | 122.1 | 91% | 0.906 | 73% | 0.734 | S | S | * | * | | | trans | -58.1 | 116.3 | 158.9 | -76.4 | -169.2 | -94.4 | -110.4 | 2.6 | 105.7 | P28 A32 | P28-R30 PolarHBondContact O-N 3.21Å; R30-A32 VanDerWaalsContact C-N 3.33Å; R30-A32 PolarHBondContact O-N 3.21Å |
| 31 | C | 55.8 | Low | 58.3 | Low | 126 Ų | 126 | 123.8 Ų | 123.8 | 85% | 0.851 | 74% | 0.739 | S | S | * | * | | | trans | -52.2 | 100.6 | 170.8 | -87.5 | 0 | 0 | 0 | 0 | 108.1 | R29 | R29-C31 PolarHBondContact O-N 2.92Å; R29-C31 VanDerWaalsContact O-N 3.08Å |
| 32 | A | 59 | Low | 57.4 | Low | 84 Ų | 84 | 128.5 Ų | 128.5 | 69% | 0.694 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 132.7 | 162.5 | 0 | 0 | 0 | 0 | 0 | 106.4 | R30 | R30-A32 VanDerWaalsContact C-N 3.33Å; R30-A32 PolarHBondContact O-N 3.21Å |
| 33 | P | 51.9 | Low | 56.4 | Low | 117 Ų | 117 | 127.2 Ų | 127.2 | 76% | 0.76 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 138.2 | 176.8 | 25.8 | -32.8 | 0 | 0 | 0 | 108.9 | A35 | P33-A35 PolarHBondContact O-N 2.91Š|
| 34 | P | 45.9 | Very low | 55.3 | Low | 124 Ų | 124 | 125.6 Ų | 125.6 | 81% | 0.805 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 123.5 | 174 | 26 | -32 | 0 | 0 | 0 | 108.5 | S36 | P34-S36 PolarHBondContact O-N 3.41Š|
| 35 | A | 49.9 | Very low | 54 | Low | 97 Ų | 97 | 125.5 Ų | 125.5 | 80% | 0.802 | 77% | 0.766 | S | S | * | * | | | trans | -59.2 | 113 | 161.8 | 0 | 0 | 0 | 0 | 0 | 107.3 | P33 | P33-A35 PolarHBondContact O-N 2.91Š|
| 36 | S | 52.4 | Low | 52.5 | Low | 111 Ų | 111 | 124.8 Ų | 124.8 | 78% | 0.776 | 77% | 0.771 | S | S | * | * | | | trans | -49.3 | 135.4 | 174.1 | -172.8 | 0 | 0 | 0 | 0 | 110.5 | P34 | P34-S36 PolarHBondContact O-N 3.41Š|
| 37 | P | 44.3 | Very low | 50.9 | Low | 118 Ų | 118 | 127 Ų | 127 | 77% | 0.766 | 78% | 0.78 | S | S | * | * | | | | -142.3 | 136.1 | 99.8 | 33 | -16.5 | 0 | 0 | 0 | 114.5 | | |
| 38 | A | 41.1 | Very low | 49.7 | Very low | 89 Ų | 89 | 125.9 Ų | 125.9 | 74% | 0.736 | 79% | 0.788 | S | S | * | * | | | trans | 40.7 | 142.6 | 151.5 | 0 | 0 | 0 | 0 | 0 | 122.7 | | |
| 39 | P | 43.7 | Very low | 48.6 | Very low | 120 Ų | 120 | 124.4 Ų | 124.4 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | | | trans | -98 | -171 | -176.5 | 43.5 | -37.3 | 0 | 0 | 0 | 112.5 | | |
| 40 | P | 58 | Low | 47.7 | Very low | 112 Ų | 112 | 116.7 Ų | 116.7 | 73% | 0.727 | 77% | 0.772 | S | S | * | * | | | cis | -135.2 | 146.8 | -20.5 | 28.4 | -8.6 | 0 | 0 | 0 | 114.4 | | |
| 41 | V | 37.6 | Very low | 47.2 | Very low | 147 Ų | 147 | 110.6 Ų | 110.6 | 89% | 0.891 | 77% | 0.766 | S | S | * | * | | | trans | -156.1 | 120.4 | 140.1 | -154.7 | 0 | 0 | 0 | 0 | 110.8 | | |
| 42 | N | 41.1 | Very low | 47.1 | Very low | 153 Ų | 153 | 107.9 Ų | 107.9 | 82% | 0.818 | 76% | 0.76 | S | S | * | * | | | trans | -78.6 | 154 | 171.2 | -79 | -26.7 | 0 | 0 | 0 | 110.5 | | |
| 43 | P | 44 | Very low | 47 | Very low | 124 Ų | 124 | 109 Ų | 109 | 81% | 0.805 | 76% | 0.763 | S | S | * | * | | | | -141.9 | 144.1 | 79.1 | 33.4 | -14.4 | 0 | 0 | 0 | 116.4 | | |
| 44 | A | 40.2 | Very low | 47.5 | Very low | 85 Ų | 85 | 107 Ų | 107 | 70% | 0.702 | 76% | 0.763 | S | S | * | * | S | Bend | trans | 77.1 | 102.3 | 149 | 0 | 0 | 0 | 0 | 0 | 119.2 | | |
| 45 | T | 40.7 | Very low | 48.4 | Very low | 128 Ų | 128 | 110.1 Ų | 110.1 | 79% | 0.785 | 76% | 0.764 | S | S | * | * | | | trans | 57.7 | 66.6 | 145.3 | 55.1 | 0 | 0 | 0 | 0 | 116.8 | | |
| 46 | A | 42 | Very low | 49.5 | Very low | 95 Ų | 95 | 116.3 Ų | 116.3 | 79% | 0.785 | 77% | 0.773 | S | S | * | * | | | trans | -99.3 | 89.7 | 140.3 | 0 | 0 | 0 | 0 | 0 | 106.3 | A48 | A46-A48 PolarHBondContact O-N 3.21Š|
| 47 | D | 41.8 | Very low | 50.9 | Low | 144 Ų | 144 | 120.8 Ų | 120.8 | 77% | 0.77 | 77% | 0.773 | S | S | * | * | | | trans | -60.3 | 85.8 | 161.8 | -94.5 | -56.9 | 0 | 0 | 0 | 107.5 | A49 | D47-A49 PolarHBondContact O-N 2.96Š|
| 48 | A | 47.3 | Very low | 52.7 | Low | 104 Ų | 104 | 125.2 Ų | 125.2 | 86% | 0.86 | 78% | 0.776 | S | S | * | * | | | trans | -75 | 55.2 | 159.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | A46 | A46-A48 PolarHBondContact O-N 3.21Š|
| 49 | A | 51.8 | Low | 54.9 | Low | 80 Ų | 80 | 124.7 Ų | 124.7 | 66% | 0.661 | 77% | 0.765 | S | S | * | * | | | trans | -106.4 | 82.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 107.8 | D47 | D47-A49 PolarHBondContact O-N 2.96Š|
| 50 | G | 48.5 | Very low | 56.9 | Low | 52 Ų | 52 | 121.2 Ų | 121.2 | 54% | 0.536 | 74% | 0.742 | S | S | . | * | | | trans | -159.8 | 19 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | G52 | G50-G52 PolarHBondContact O-N 2.94Å; G50-G52 VanDerWaalsContact O-N 3.09Å |
| 51 | S | 54.1 | Low | 58.1 | Low | 112 Ų | 112 | 120 Ų | 120 | 78% | 0.783 | 74% | 0.742 | S | S | * | * | | | trans | -80.5 | 73.6 | 162.9 | 165.8 | 0 | 0 | 0 | 0 | 108.1 | S53 | S51-S53 PolarHBondContact O-N 3.39Š|
| 52 | G | 53.2 | Low | 60 | Low | 70 Ų | 70 | 121.8 Ų | 121.8 | 72% | 0.722 | 74% | 0.74 | S | S | * | * | | | trans | -66.3 | 87.3 | 166.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | G50 G54 | G50-G52 PolarHBondContact O-N 2.94Å; G50-G52 VanDerWaalsContact O-N 3.09Å; G52-G54 PolarHBondContact O-N 2.74Å; G52-G54 VanDerWaalsContact O-N 3.17Å |
| 53 | S | 58.1 | Low | 62 | Low | 107 Ų | 107 | 119 Ų | 119 | 75% | 0.748 | 72% | 0.722 | S | S | * | * | | | trans | -59.3 | 115 | 176 | 55.2 | 0 | 0 | 0 | 0 | 110.8 | S51 | S51-S53 PolarHBondContact O-N 3.39Š|
| 54 | G | 61.8 | Low | 63.6 | Low | 75 Ų | 75 | 117.3 Ų | 117.3 | 77% | 0.773 | 71% | 0.705 | S | S | * | * | S | Bend | trans | 90.3 | 14.7 | 131.6 | 0 | 0 | 0 | 0 | 0 | 119.7 | G52 | G52-G54 PolarHBondContact O-N 2.74Å; G52-G54 VanDerWaalsContact O-N 3.17Å |
| 55 | K | 64.2 | Low | 65.5 | Low | 190 Ų | 190 | 120 Ų | 120 | 83% | 0.826 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -141 | 142.9 | 169.7 | -59.6 | -176.6 | -174.5 | -176.7 | 0 | 110.5 | R57 | K55-R57 PolarHBondContact O-N 3.16Š|
| 56 | K | 73.3 | Confident | 67.3 | Low | 227 Ų | 227 | 118.3 Ų | 118.3 | 99% | 0.987 | 70% | 0.697 | S | S | * | * | | | trans | -57.7 | 82.1 | 176.2 | -66 | -178.8 | -177.6 | 179.3 | 0 | 109.8 | | |
| 57 | R | 81.3 | Confident | 68.6 | Low | 205 Ų | 205 | 120.3 Ų | 120.3 | 77% | 0.774 | 69% | 0.693 | S | S | * | * | | | trans | -123 | 139.9 | 177.7 | -166.7 | -174.8 | 177.7 | -171.5 | -1.1 | 108.3 | K55 | K55-R57 PolarHBondContact O-N 3.16Š|
| 58 | Y | 83.4 | Confident | 69.8 | Low | 210 Ų | 210 | 116.2 Ų | 116.2 | 82% | 0.824 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 142.9 | 170.4 | -65.2 | -76.1 | 0 | 0 | 0 | 110.2 | | |
| 59 | P | 85.8 | Confident | 70.8 | Confident | 79 Ų | 79 | 113.7 Ų | 113.7 | 51% | 0.513 | 67% | 0.67 | S | S | . | * | P | Polyproline II helix | trans | -56.9 | 145.7 | 177.2 | -20.7 | 31.1 | 0 | 0 | 0 | 111.3 | E63 I64 | P59-E63 WeakPolarHBondContact CA-OE2 3.15Å; P59-E63 HydrophobicContact CB-CB 4.21Å; P59-I64 HydrophobicContact CB-CG1 3.98Å |
| 60 | T | 86.6 | Confident | 71.4 | Confident | 46 Ų | 46 | 118.2 Ų | 118.2 | 28% | 0.282 | 67% | 0.671 | S | S | . | * | P | Polyproline II helix | trans | -74.1 | 158.8 | 171.7 | 65.6 | 0 | 0 | 0 | 0 | 110.7 | E62 E63 I64 | T60-E62 PolarHBondContact O-N 2.99Å; T60-E62 VanDerWaalsContact O-N 3.12Å; T60-E63 PolarHBondContact N-OE2 3.13Å; T60-E63 WeakPolarHBondContact O-CB 3.34Å; T60-E63 PolarHBondContact O-N 3.48Å; T60-E63 VanDerWaalsContact OG1-CG 3.25Å; T60-E63 WeakPolarHBondContact OG1-CG 3.43Å; T60-E63 PolarHBondContact OG1-OE1 3.34Å; T60-I64 WeakPolarHBondContact O-CG1 3.34Å; T60-I64 PolarHBondContact O-N 2.9Å |
| 61 | A | 82.7 | Confident | 72.3 | Confident | 88 Ų | 88 | 121.3 Ų | 121.3 | 73% | 0.727 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.7 | -31.5 | -173.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | I64 | A61-I64 PolarHBondContact O-N 3.46Š|
| 62 | E | 78.1 | Confident | 72.7 | Confident | 184 Ų | 184 | 124.5 Ų | 124.5 | 86% | 0.86 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | -24.3 | -180 | -62.6 | 170.3 | -167.9 | 0 | 0 | 112.2 | T60 I64 | T60-E62 PolarHBondContact O-N 2.99Å; T60-E62 VanDerWaalsContact O-N 3.12Å; E62-I64 VanDerWaalsContact C-N 3.32Å |
| 63 | E | 83.1 | Confident | 73.5 | Confident | 93 Ų | 93 | 126 Ų | 126 | 44% | 0.435 | 66% | 0.66 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.9 | -18.3 | 174.3 | -67.2 | 160.4 | -154.9 | 0 | 0 | 112.3 | P59 T60 L65 | P59-E63 WeakPolarHBondContact CA-OE2 3.15Å; P59-E63 HydrophobicContact CB-CB 4.21Å; T60-E63 PolarHBondContact N-OE2 3.13Å; T60-E63 WeakPolarHBondContact O-CB 3.34Å; T60-E63 PolarHBondContact O-N 3.48Å; T60-E63 VanDerWaalsContact OG1-CG 3.25Å; T60-E63 WeakPolarHBondContact OG1-CG 3.43Å; T60-E63 PolarHBondContact OG1-OE1 3.34Å; E63-L65 PolarHBondContact O-N 2.83Å; E63-L65 VanDerWaalsContact O-N 3.13Å |
| 64 | I | 77.7 | Confident | 73.9 | Confident | 89 Ų | 89 | 126.6 Ų | 126.6 | 46% | 0.456 | 66% | 0.664 | S | S | . | * | | | trans | -80.9 | 97 | -179.2 | -59.9 | 169.9 | 0 | 0 | 0 | 109.6 | P59 T60 A61 E62 V66 | P59-I64 HydrophobicContact CB-CG1 3.98Å; T60-I64 WeakPolarHBondContact O-CG1 3.34Å; T60-I64 PolarHBondContact O-N 2.9Å; A61-I64 PolarHBondContact O-N 3.46Å; E62-I64 VanDerWaalsContact C-N 3.32Å; I64-V66 HydrophobicContact CG2-CG2 4.22Å; I64-V66 PolarHBondContact O-N 3.2Å |
| 65 | L | 79.1 | Confident | 74.2 | Confident | 142 Ų | 142 | 134.6 Ų | 134.6 | 74% | 0.743 | 67% | 0.671 | S | S | * | * | | | trans | -84.5 | 106.3 | 168.5 | -61.7 | 178.1 | 0 | 0 | 0 | 110.4 | E63 L67 | E63-L65 PolarHBondContact O-N 2.83Å; E63-L65 VanDerWaalsContact O-N 3.13Å; L65-L67 PolarHBondContact O-N 3.03Å |
| 66 | V | 78.8 | Confident | 74.3 | Confident | 93 Ų | 93 | 126.8 Ų | 126.8 | 56% | 0.564 | 64% | 0.64 | S | S | * | * | | | trans | -76 | 90.7 | 174.7 | -173.7 | 0 | 0 | 0 | 0 | 109.5 | I64 G68 | I64-V66 HydrophobicContact CG2-CG2 4.22Å; I64-V66 PolarHBondContact O-N 3.2Å; V66-G68 PolarHBondContact O-N 3.19Å; V66-G68 VanDerWaalsContact O-N 3.14Å |
| 67 | L | 69.4 | Low | 73.7 | Confident | 136 Ų | 136 | 122.2 Ų | 122.2 | 71% | 0.712 | 64% | 0.635 | S | S | * | * | S | Bend | trans | -72.2 | 104.9 | 172 | -64.1 | 178.8 | 0 | 0 | 0 | 109.2 | L65 | L65-L67 PolarHBondContact O-N 3.03Š|
| 68 | G | 67 | Low | 72.8 | Confident | 59 Ų | 59 | 114.7 Ų | 114.7 | 61% | 0.608 | 61% | 0.61 | S | S | * | * | S | Bend | trans | 85.4 | 83.9 | -170.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | V66 | V66-G68 PolarHBondContact O-N 3.19Å; V66-G68 VanDerWaalsContact O-N 3.14Å |
| 69 | G | 68.7 | Low | 72.1 | Confident | 51 Ų | 51 | 107.2 Ų | 107.2 | 53% | 0.526 | 59% | 0.586 | S | S | . | * | | | trans | -72.5 | -174.4 | 156.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | L71 | G69-L71 PolarHBondContact O-N 2.96Š|
| 70 | Y | 63.5 | Low | 71.3 | Confident | 174 Ų | 174 | 112.2 Ų | 112.2 | 68% | 0.682 | 60% | 0.6 | S | S | * | * | | | trans | -64.5 | 65.9 | 164.2 | -72.1 | -43.6 | 0 | 0 | 0 | 110.8 | R72 L78 | Y70-R72 PolarHBondContact O-N 3.16Å; Y70-L78 HydrophobicContact CD1-CD1 3.76Å; Y70-L78 HydrophobicContact CD1-CD2 3.62Å; Y70-L78 HydrophobicContact CD1-CG 4.11Å; Y70-L78 HydrophobicContact CD2-CD2 4.18Å; Y70-L78 HydrophobicContact CE1-CD2 4.29Å; Y70-L78 HydrophobicContact CG-CD1 3.8Å; Y70-L78 HydrophobicContact CG-CD2 3.56Å; Y70-L78 HydrophobicContact CG-CG 4.23Å; Y70-L78 WeakPolarHBondContact O-CD1 3.26Å |
| 71 | L | 68.2 | Low | 70.3 | Confident | 117 Ų | 117 | 111.9 Ų | 111.9 | 61% | 0.613 | 61% | 0.605 | S | S | * | * | | | trans | -60.5 | 116.1 | 175 | -172.6 | 62.2 | 0 | 0 | 0 | 107.1 | G69 L73 S76 | G69-L71 PolarHBondContact O-N 2.96Å; L71-L73 HydrophobicContact CB-CG 4.28Å; L71-L73 HydrophobicContact CD2-CD1 4.22Å; L71-L73 HydrophobicContact CD2-CD2 3.48Å; L71-L73 VanDerWaalsContact CD2-CD2 3.48Å; L71-L73 HydrophobicContact CD2-CG 3.8Å; L71-L73 HydrophobicContact CG-CD2 3.77Å; L71-L73 HydrophobicContact CG-CG 3.8Å; L71-L73 PolarHBondContact O-N 2.84Å; L71-S76 PolarHBondContact O-OG 2.82Å |
| 72 | R | 63.4 | Low | 69.3 | Low | 179 Ų | 179 | 110.7 Ų | 110.7 | 68% | 0.675 | 59% | 0.592 | S | S | * | * | | | trans | -73.3 | 63.5 | 175.9 | -104.9 | -174.6 | 164.4 | 154.3 | -0.4 | 110.3 | Y70 L78 V79 | Y70-R72 PolarHBondContact O-N 3.16Å; R72-L78 HydrophobicContact CG-CB 3.8Å; R72-L78 PolarHBondContact NE-O 2.96Å; R72-L78 PolarHBondContact NH2-O 3.1Å; R72-V79 HydrophobicContact CG-CG2 4.44Å |
| 73 | L | 70.1 | Confident | 68.4 | Low | 102 Ų | 102 | 107 Ų | 107 | 53% | 0.534 | 58% | 0.584 | S | S | . | * | | | trans | -64.4 | 146 | 168 | -62.5 | 175.1 | 0 | 0 | 0 | 108.9 | L71 R75 S76 V79 | L71-L73 HydrophobicContact CB-CG 4.28Å; L71-L73 HydrophobicContact CD2-CD1 4.22Å; L71-L73 HydrophobicContact CD2-CD2 3.48Å; L71-L73 VanDerWaalsContact CD2-CD2 3.48Å; L71-L73 HydrophobicContact CD2-CG 3.8Å; L71-L73 HydrophobicContact CG-CD2 3.77Å; L71-L73 HydrophobicContact CG-CG 3.8Å; L71-L73 PolarHBondContact O-N 2.84Å; L73-R75 PolarHBondContact O-N 3.04Å; L73-S76 PolarHBondContact N-OG 3.11Å; L73-S76 PolarHBondContact O-N 2.71Å; L73-S76 PolarHBondContact O-OG 2.84Å; L73-S76 VanDerWaalsContact O-OG 3.11Å; L73-V79 WeakPolarHBondContact O-CG2 3.47Å |
| 74 | S | 65.8 | Low | 67.2 | Low | 119 Ų | 119 | 110.9 Ų | 110.9 | 83% | 0.832 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.7 | -14.6 | -178 | -41.3 | 0 | 0 | 0 | 0 | 114.7 | | |
| 75 | R | 67.4 | Low | 66.2 | Low | 244 Ų | 244 | 114.9 Ų | 114.9 | 92% | 0.921 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.7 | 13 | 176.2 | -70 | -177.5 | 51.5 | -162.7 | -8.9 | 114.3 | L73 | L73-R75 PolarHBondContact O-N 3.04Š|
| 76 | S | 66.2 | Low | 65.2 | Low | 26 Ų | 26 | 114 Ų | 114 | 18% | 0.182 | 60% | 0.603 | C | S | . | * | S | Bend | trans | -81.9 | 155.1 | 176.9 | 73.7 | 0 | 0 | 0 | 0 | 111.6 | L71 L73 L78 V79 | L71-S76 PolarHBondContact O-OG 2.82Å; L73-S76 PolarHBondContact N-OG 3.11Å; L73-S76 PolarHBondContact O-N 2.71Å; L73-S76 PolarHBondContact O-OG 2.84Å; L73-S76 VanDerWaalsContact O-OG 3.11Å; S76-L78 PolarHBondContact O-N 2.81Å; S76-L78 VanDerWaalsContact O-N 3.09Å; S76-V79 WeakPolarHBondContact O-CB 3.42Å; S76-V79 PolarHBondContact O-N 2.73Å; S76-V79 VanDerWaalsContact O-N 3.1Å |
| 77 | C | 60.6 | Low | 64.5 | Low | 130 Ų | 130 | 116.2 Ų | 116.2 | 88% | 0.878 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | -10.3 | 175.4 | 53.9 | 0 | 0 | 0 | 0 | 113.8 | | |
| 78 | L | 62.8 | Low | 64.4 | Low | 47 Ų | 47 | 118.3 Ų | 118.3 | 25% | 0.246 | 61% | 0.611 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -88.3 | -17.8 | 178.6 | -56.8 | 148.1 | 0 | 0 | 0 | 112.1 | Y70 R72 S76 K80 | Y70-L78 HydrophobicContact CD1-CD1 3.76Å; Y70-L78 HydrophobicContact CD1-CD2 3.62Å; Y70-L78 HydrophobicContact CD1-CG 4.11Å; Y70-L78 HydrophobicContact CD2-CD2 4.18Å; Y70-L78 HydrophobicContact CE1-CD2 4.29Å; Y70-L78 HydrophobicContact CG-CD1 3.8Å; Y70-L78 HydrophobicContact CG-CD2 3.56Å; Y70-L78 HydrophobicContact CG-CG 4.23Å; Y70-L78 WeakPolarHBondContact O-CD1 3.26Å; R72-L78 HydrophobicContact CG-CB 3.8Å; R72-L78 PolarHBondContact NE-O 2.96Å; R72-L78 PolarHBondContact NH2-O 3.1Å; S76-L78 PolarHBondContact O-N 2.81Å; S76-L78 VanDerWaalsContact O-N 3.09Å; L78-K80 PolarHBondContact O-N 3.09Å; L78-K80 VanDerWaalsContact O-N 3.15Å |
| 79 | V | 68.8 | Low | 64.6 | Low | 53 Ų | 53 | 123.6 Ų | 123.6 | 32% | 0.321 | 62% | 0.619 | S | S | . | * | S | Bend | trans | -70.9 | 107.5 | 168.2 | 169.4 | 0 | 0 | 0 | 0 | 106.4 | R72 L73 S76 G81 | R72-V79 HydrophobicContact CG-CG2 4.44Å; L73-V79 WeakPolarHBondContact O-CG2 3.47Å; S76-V79 WeakPolarHBondContact O-CB 3.42Å; S76-V79 PolarHBondContact O-N 2.73Å; S76-V79 VanDerWaalsContact O-N 3.1Å; V79-G81 PolarHBondContact O-N 2.9Å |
| 80 | K | 69.4 | Low | 64.9 | Low | 185 Ų | 185 | 128 Ų | 128 | 80% | 0.804 | 63% | 0.63 | S | S | * | * | | | trans | -58.6 | 107.8 | 166.5 | -166.5 | 166.6 | -179.6 | 176.5 | 0 | 105.2 | L78 | L78-K80 PolarHBondContact O-N 3.09Å; L78-K80 VanDerWaalsContact O-N 3.15Å |
| 81 | G | 64.8 | Low | 65.9 | Low | 38 Ų | 38 | 129.3 Ų | 129.3 | 39% | 0.392 | 64% | 0.639 | S | S | . | * | | | trans | -55.8 | 158.9 | -171.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | V79 | V79-G81 PolarHBondContact O-N 2.9Š|
| 82 | S | 62.5 | Low | 66.7 | Low | 64 Ų | 64 | 129.9 Ų | 129.9 | 45% | 0.448 | 64% | 0.642 | S | S | . | * | | | trans | -39.5 | 137.6 | 175.4 | 167.8 | 0 | 0 | 0 | 0 | 111.6 | E84 R85 | S82-E84 PolarHBondContact O-N 2.78Å; S82-E84 WeakPolarHBondContact OG-CB 3.01Å; S82-E84 PolarHBondContact OG-N 3.32Å; S82-R85 PolarHBondContact O-N 3.21Å |
| 83 | P | 59.6 | Low | 67.7 | Low | 106 Ų | 106 | 126.2 Ų | 126.2 | 69% | 0.688 | 64% | 0.644 | S | S | * | * | G | 310 helix | trans | -58.5 | -13.7 | 176.5 | 27.2 | -36 | 0 | 0 | 0 | 112.9 | R85 H86 | P83-R85 PolarHBondContact O-N 3.39Å; P83-H86 VanDerWaalsContact O-CB 3.26Å; P83-H86 WeakPolarHBondContact O-CB 3.44Å; P83-H86 PolarHBondContact O-N 2.99Å |
| 84 | E | 57.5 | Low | 68.5 | Low | 175 Ų | 175 | 128.6 Ų | 128.6 | 82% | 0.818 | 65% | 0.65 | S | S | * | * | G | 310 helix | trans | -69.4 | -20.6 | 173.4 | -162.9 | 171.4 | -166 | 0 | 0 | 113.2 | S82 H86 | S82-E84 PolarHBondContact O-N 2.78Å; S82-E84 WeakPolarHBondContact OG-CB 3.01Å; S82-E84 PolarHBondContact OG-N 3.32Å; E84-H86 VanDerWaalsContact C-N 3.3Å |
| 85 | R | 55.9 | Low | 69.4 | Low | 173 Ų | 173 | 126.2 Ų | 126.2 | 65% | 0.653 | 63% | 0.633 | S | S | * | * | G | 310 helix | trans | -91.7 | 22.3 | 164.8 | -61.9 | -140.2 | -54.5 | -104.7 | 2.8 | 112.6 | S82 P83 H87 | S82-R85 PolarHBondContact O-N 3.21Å; P83-R85 PolarHBondContact O-N 3.39Å; R85-H87 WeakPolarHBondContact CD-NE2 3.43Å; R85-H87 PolarHBondContact O-CD2 3.1Å; R85-H87 VanDerWaalsContact O-CD2 3.25Å; R85-H87 PolarHBondContact O-N 3.43Å |
| 86 | H | 59.5 | Low | 70.1 | Confident | 124 Ų | 124 | 122 Ų | 122 | 57% | 0.574 | 62% | 0.624 | S | S | * | * | | | trans | -68.4 | 69.8 | 150.6 | -97.7 | -91.2 | 0 | 0 | 0 | 107.7 | P83 E84 K88 | P83-H86 VanDerWaalsContact O-CB 3.26Å; P83-H86 WeakPolarHBondContact O-CB 3.44Å; P83-H86 PolarHBondContact O-N 2.99Å; E84-H86 VanDerWaalsContact C-N 3.3Å; H86-K88 PolarHBondContact O-N 3.46Å |
| 87 | H | 62.7 | Low | 71 | Confident | 139 Ų | 139 | 126.1 Ų | 126.1 | 64% | 0.644 | 65% | 0.648 | S | S | * | * | | | trans | -53.4 | 115.1 | 163.2 | -58 | -66.6 | 0 | 0 | 0 | 106.1 | R85 Q89 | R85-H87 WeakPolarHBondContact CD-NE2 3.43Å; R85-H87 PolarHBondContact O-CD2 3.1Å; R85-H87 VanDerWaalsContact O-CD2 3.25Å; R85-H87 PolarHBondContact O-N 3.43Å; H87-Q89 PolarHBondContact O-N 3.16Å |
| 88 | K | 67.9 | Low | 71.8 | Confident | 180 Ų | 180 | 122.6 Ų | 122.6 | 78% | 0.783 | 63% | 0.629 | S | S | * | * | | | trans | 13.5 | 102.5 | 169.4 | -66.4 | 176.1 | 178 | -178.3 | 0 | 112.3 | H86 L90 | H86-K88 PolarHBondContact O-N 3.46Å; K88-L90 VanDerWaalsContact C-N 3.32Å; K88-L90 PolarHBondContact O-N 2.91Å |
| 89 | Q | 70.8 | Confident | 72.6 | Confident | 169 Ų | 169 | 125.7 Ų | 125.7 | 79% | 0.79 | 65% | 0.645 | S | S | * | * | | | trans | -48.9 | 103.4 | 168.7 | -79.9 | -176.8 | -4.9 | 0 | 0 | 108 | H87 K91 | H87-Q89 PolarHBondContact O-N 3.16Å; Q89-K91 PolarHBondContact O-N 3.44Å; Q89-K91 VanDerWaalsContact O-N 3.16Å |
| 90 | L | 75.8 | Confident | 73.2 | Confident | 145 Ų | 145 | 130.1 Ų | 130.1 | 76% | 0.759 | 66% | 0.662 | S | S | * | * | | | trans | -73.6 | 111.3 | 176.4 | -65.1 | 177.9 | 0 | 0 | 0 | 104.8 | K88 I92 | K88-L90 VanDerWaalsContact C-N 3.32Å; K88-L90 PolarHBondContact O-N 2.91Å; L90-I92 VanDerWaalsContact C-N 3.26Å; L90-I92 HydrophobicContact CB-CG1 4.28Å; L90-I92 PolarHBondContact O-N 3.41Å |
| 91 | K | 84.6 | Confident | 73.9 | Confident | 201 Ų | 201 | 126.8 Ų | 126.8 | 87% | 0.874 | 66% | 0.657 | S | S | * | * | | | trans | -78 | 86.9 | 174.3 | -163.4 | 171.7 | 178.4 | 179.7 | 0 | 106.9 | Q89 S93 | Q89-K91 PolarHBondContact O-N 3.44Å; Q89-K91 VanDerWaalsContact O-N 3.16Å; K91-S93 PolarHBondContact O-N 3.22Å |
| 92 | I | 83.9 | Confident | 74.9 | Confident | 128 Ų | 128 | 131.4 Ų | 131.4 | 66% | 0.656 | 68% | 0.678 | S | S | * | * | | | trans | -78.2 | 109 | 174.8 | -54.2 | 173.7 | 0 | 0 | 0 | 106.3 | L90 F94 | L90-I92 VanDerWaalsContact C-N 3.26Å; L90-I92 HydrophobicContact CB-CG1 4.28Å; L90-I92 PolarHBondContact O-N 3.41Å; I92-F94 HydrophobicContact CG2-CD2 4.38Å; I92-F94 HydrophobicContact CG2-CE1 4.46Å; I92-F94 HydrophobicContact CG2-CE2 3.65Å; I92-F94 HydrophobicContact CG2-CZ 3.7Å |
| 93 | S | 85.1 | Confident | 76 | Confident | 103 Ų | 103 | 136.7 Ų | 136.7 | 72% | 0.72 | 69% | 0.689 | S | S | * | * | | | trans | -115.4 | 133.5 | 170.4 | 55.8 | 0 | 0 | 0 | 0 | 108.8 | K91 | K91-S93 PolarHBondContact O-N 3.22Š|
| 94 | F | 86.3 | Confident | 77.4 | Confident | 151 Ų | 151 | 139.8 Ų | 139.8 | 66% | 0.662 | 70% | 0.695 | S | S | * | * | | | trans | -99.8 | 139.6 | 170.3 | -60.9 | -84 | 0 | 0 | 0 | 108.4 | I92 E96 L99 | I92-F94 HydrophobicContact CG2-CD2 4.38Å; I92-F94 HydrophobicContact CG2-CE1 4.46Å; I92-F94 HydrophobicContact CG2-CE2 3.65Å; I92-F94 HydrophobicContact CG2-CZ 3.7Å; F94-E96 PolarHBondContact O-N 2.78Å; F94-L99 HydrophobicContact CB-CD1 3.72Å; F94-L99 HydrophobicContact CB-CD2 4.2Å; F94-L99 HydrophobicContact CB-CG 4.09Å; F94-L99 HydrophobicContact CD1-CD2 4.45Å; F94-L99 HydrophobicContact CG-CD2 4.45Å |
| 95 | S | 86.1 | Confident | 78.9 | Confident | 69 Ų | 69 | 140.2 Ų | 140.2 | 48% | 0.483 | 69% | 0.69 | S | S | . | * | | | trans | -75.5 | 119.8 | 168.4 | 48.1 | 0 | 0 | 0 | 0 | 108.7 | T97 A98 L99 | S95-T97 PolarHBondContact O-N 3.05Å; S95-A98 PolarHBondContact O-N 3.02Å; S95-A98 WeakPolarHBondContact OG-CB 3.33Å; S95-L99 PolarHBondContact O-N 2.88Å |
| 96 | E | 82.5 | Confident | 80.4 | Confident | 156 Ų | 156 | 135.8 Ų | 135.8 | 73% | 0.729 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -53.4 | -38.5 | 178.7 | -69.1 | 176.4 | 173.4 | 0 | 0 | 111.8 | F94 A98 L99 E100 | F94-E96 PolarHBondContact O-N 2.78Å; E96-A98 VanDerWaalsContact C-N 3.25Å; E96-A98 PolarHBondContact O-N 3.15Å; E96-L99 WeakPolarHBondContact O-CB 3.46Å; E96-L99 PolarHBondContact O-N 3.15Å; E96-E100 WeakPolarHBondContact O-CG 3.33Å; E96-E100 PolarHBondContact O-N 3.05Å |
| 97 | T | 84.7 | Confident | 81.8 | Confident | 113 Ų | 113 | 133 Ų | 133 | 69% | 0.693 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -62.4 | -25.7 | 175.9 | 56 | 0 | 0 | 0 | 0 | 114.7 | S95 | S95-T97 PolarHBondContact O-N 3.05Å |
| 98 | A | 77.4 | Confident | 82.9 | Confident | 56 Ų | 56 | 134.3 Ų | 134.3 | 46% | 0.463 | 69% | 0.685 | S | S | . | * | H | α-helix | trans | -89.1 | -15.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | S95 E96 | S95-A98 PolarHBondContact O-N 3.02Å; S95-A98 WeakPolarHBondContact OG-CB 3.33Å; E96-A98 VanDerWaalsContact C-N 3.25Å; E96-A98 PolarHBondContact O-N 3.15Å |
| 99 | L | 79.5 | Confident | 83.5 | Confident | 112 Ų | 112 | 129.4 Ų | 129.4 | 59% | 0.586 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -84.1 | -21.8 | 175.5 | -66.7 | 173.8 | 0 | 0 | 0 | 112 | F94 S95 E96 T101 | F94-L99 HydrophobicContact CB-CD1 3.72Å; F94-L99 HydrophobicContact CB-CD2 4.2Å; F94-L99 HydrophobicContact CB-CG 4.09Å; F94-L99 HydrophobicContact CD1-CD2 4.45Å; F94-L99 HydrophobicContact CG-CD2 4.45Å; S95-L99 PolarHBondContact O-N 2.88Å; E96-L99 WeakPolarHBondContact O-CB 3.46Å; E96-L99 PolarHBondContact O-N 3.15Å; L99-T101 PolarHBondContact O-N 3.04Å |
| 100 | E | 81.3 | Confident | 84 | Confident | 146 Ų | 146 | 124.3 Ų | 124.3 | 68% | 0.682 | 66% | 0.656 | S | S | * | * | | | trans | -75.5 | 7.1 | 179.3 | -71.3 | 174.6 | 174.8 | 0 | 0 | 114.2 | E96 T102 | E96-E100 WeakPolarHBondContact O-CG 3.33Å; E96-E100 PolarHBondContact O-N 3.05Å; E100-T102 PolarHBondContact O-N 3.48Å |
| 101 | T | 84.2 | Confident | 84.1 | Confident | 115 Ų | 115 | 121.3 Ų | 121.3 | 71% | 0.706 | 64% | 0.643 | S | S | * | * | | | trans | -73.8 | 101.4 | 177.9 | 64 | 0 | 0 | 0 | 0 | 110.5 | L99 | L99-T101 PolarHBondContact O-N 3.04Š|
| 102 | T | 84.8 | Confident | 83.8 | Confident | 135 Ų | 135 | 117.4 Ų | 117.4 | 83% | 0.828 | 63% | 0.632 | S | S | * | * | | | trans | -88.7 | 121.9 | 170.6 | -16.3 | 0 | 0 | 0 | 0 | 109.4 | E100 | E100-T102 PolarHBondContact O-N 3.48Š|
| 103 | Y | 85.5 | Confident | 83.6 | Confident | 175 Ų | 175 | 119.3 Ų | 119.3 | 69% | 0.686 | 64% | 0.638 | S | S | * | * | | | trans | -87.9 | 115.6 | 169.8 | -178 | -103.5 | 0 | 0 | 0 | 109.3 | Y105 | Y103-Y105 AromaticContact CD1-CD2 3.66Å; Y103-Y105 HydrophobicContact CD1-CD2 3.66Å; Y103-Y105 AromaticContact CD1-CE2 3.82Å; Y103-Y105 HydrophobicContact CD1-CE2 3.82Å; Y103-Y105 HydrophobicContact CD1-CG 4.49Å; Y103-Y105 HydrophobicContact CE1-CD1 4.48Å; Y103-Y105 AromaticContact CE1-CD2 3.42Å; Y103-Y105 HydrophobicContact CE1-CD2 3.42Å; Y103-Y105 VanDerWaalsContact CE1-CD2 3.42Å; Y103-Y105 HydrophobicContact CE1-CE1 4.48Å; Y103-Y105 AromaticContact CE1-CE2 3.44Å; Y103-Y105 HydrophobicContact CE1-CE2 3.44Å; Y103-Y105 VanDerWaalsContact CE1-CE2 3.44Å; Y103-Y105 AromaticContact CE1-CG 3.97Å; Y103-Y105 HydrophobicContact CE1-CG 3.97Å; Y103-Y105 AromaticContact CE1-CZ 3.98Å |
| 104 | Q | 89.3 | Confident | 83.2 | Confident | 171 Ų | 171 | 121.4 Ų | 121.4 | 80% | 0.799 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 118.6 | 172.5 | -169.7 | 90.8 | 29.7 | 0 | 0 | 108.3 | | |
| 105 | Y | 89.8 | Confident | 82.5 | Confident | 183 Ų | 183 | 120.3 Ų | 120.3 | 72% | 0.718 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 144.9 | 168.3 | -107.2 | -90.6 | 0 | 0 | 0 | 110.1 | Y103 | Y103-Y105 AromaticContact CD1-CD2 3.66Å; Y103-Y105 HydrophobicContact CD1-CD2 3.66Å; Y103-Y105 AromaticContact CD1-CE2 3.82Å; Y103-Y105 HydrophobicContact CD1-CE2 3.82Å; Y103-Y105 HydrophobicContact CD1-CG 4.49Å; Y103-Y105 HydrophobicContact CE1-CD1 4.48Å; Y103-Y105 AromaticContact CE1-CD2 3.42Å; Y103-Y105 HydrophobicContact CE1-CD2 3.42Å; Y103-Y105 VanDerWaalsContact CE1-CD2 3.42Å; Y103-Y105 HydrophobicContact CE1-CE1 4.48Å; Y103-Y105 AromaticContact CE1-CE2 3.44Å; Y103-Y105 HydrophobicContact CE1-CE2 3.44Å; Y103-Y105 VanDerWaalsContact CE1-CE2 3.44Å; Y103-Y105 AromaticContact CE1-CG 3.97Å; Y103-Y105 HydrophobicContact CE1-CG 3.97Å; Y103-Y105 AromaticContact CE1-CZ 3.98Å |
| 106 | P | 87.4 | Confident | 81.6 | Confident | 80 Ų | 80 | 118.7 Ų | 118.7 | 52% | 0.519 | 64% | 0.636 | S | S | . | * | P | Polyproline II helix | trans | -51.9 | 151.5 | 165.4 | -23.3 | 33.1 | 0 | 0 | 0 | 111 | | |
| 107 | S | 88.1 | Confident | 81.1 | Confident | 67 Ų | 67 | 117.6 Ų | 117.6 | 47% | 0.469 | 64% | 0.642 | S | S | . | * | P | Polyproline II helix | trans | -63.9 | 145 | 177 | 59.5 | 0 | 0 | 0 | 0 | 110.8 | S109 S110 | S107-S109 WeakPolarHBondContact CB-OG 3.48Å; S107-S109 PolarHBondContact O-N 3.38Å; S107-S109 VanDerWaalsContact O-N 3.16Å; S107-S109 PolarHBondContact OG-OG 3.39Å; S107-S110 WeakPolarHBondContact O-CB 3.49Å; S107-S110 PolarHBondContact O-N 3.01Å |
| 108 | E | 85.3 | Confident | 80.2 | Confident | 166 Ų | 166 | 119.1 Ų | 119.1 | 78% | 0.776 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -58.2 | -29.6 | 176.1 | -61.7 | -179.5 | 134.8 | 0 | 0 | 111.7 | S110 V111 L112 | E108-S110 VanDerWaalsContact C-N 3.3Å; E108-S110 PolarHBondContact O-N 2.89Å; E108-V111 WeakPolarHBondContact O-CB 3.34Å; E108-V111 PolarHBondContact O-N 3.46Å; E108-V111 VanDerWaalsContact O-N 3.1Å; E108-L112 WeakPolarHBondContact O-CG 2.9Å; E108-L112 PolarHBondContact O-N 2.69Å |
| 109 | S | 81.3 | Confident | 79.4 | Confident | 76 Ų | 76 | 121.3 Ų | 121.3 | 53% | 0.531 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -61 | -34.7 | 172.4 | 44.7 | 0 | 0 | 0 | 0 | 113.6 | S107 V111 L112 E113 | S107-S109 WeakPolarHBondContact CB-OG 3.48Å; S107-S109 PolarHBondContact O-N 3.38Å; S107-S109 VanDerWaalsContact O-N 3.16Å; S107-S109 PolarHBondContact OG-OG 3.39Å; S109-V111 VanDerWaalsContact C-N 3.27Å; S109-V111 PolarHBondContact O-N 2.86Å; S109-L112 PolarHBondContact O-N 3.11Å; S109-E113 WeakPolarHBondContact O-CB 3.42Å; S109-E113 PolarHBondContact O-N 3.31Å |
| 110 | S | 81.3 | Confident | 78.1 | Confident | 63 Ų | 63 | 124.8 Ų | 124.8 | 44% | 0.441 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -70.2 | -26.7 | 175.6 | -174.1 | 0 | 0 | 0 | 0 | 112.1 | S107 E108 | S107-S110 WeakPolarHBondContact O-CB 3.49Å; S107-S110 PolarHBondContact O-N 3.01Å; E108-S110 VanDerWaalsContact C-N 3.3Å; E108-S110 PolarHBondContact O-N 2.89Å |
| 111 | V | 78.6 | Confident | 76.8 | Confident | 81 Ų | 81 | 122.9 Ų | 122.9 | 49% | 0.491 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -76.6 | -39.5 | 175.1 | -180 | 0 | 0 | 0 | 0 | 110.2 | E108 S109 D114 L115 | E108-V111 WeakPolarHBondContact O-CB 3.34Å; E108-V111 PolarHBondContact O-N 3.46Å; E108-V111 VanDerWaalsContact O-N 3.1Å; S109-V111 VanDerWaalsContact C-N 3.27Å; S109-V111 PolarHBondContact O-N 2.86Å; V111-D114 PolarHBondContact O-N 3.37Å; V111-L115 HydrophobicContact CG1-CD1 4.12Å; V111-L115 WeakPolarHBondContact O-CG 3.19Å; V111-L115 PolarHBondContact O-N 3.41Å |
| 112 | L | 77.9 | Confident | 74.8 | Confident | 120 Ų | 120 | 123.2 Ų | 123.2 | 63% | 0.628 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -68.9 | -34.1 | 177.3 | -66.6 | 178.7 | 0 | 0 | 0 | 112.9 | E108 S109 D114 L115 G116 | E108-L112 WeakPolarHBondContact O-CG 2.9Å; E108-L112 PolarHBondContact O-N 2.69Å; S109-L112 PolarHBondContact O-N 3.11Å; L112-D114 VanDerWaalsContact C-N 3.34Å; L112-L115 PolarHBondContact O-N 2.81Å; L112-G116 PolarHBondContact O-N 3.03Å |
| 113 | E | 79.3 | Confident | 73.1 | Confident | 168 Ų | 168 | 124.6 Ų | 124.6 | 79% | 0.785 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -68 | -33.2 | 176.5 | -164.6 | 168.8 | -169.7 | 0 | 0 | 112.3 | S109 | S109-E113 WeakPolarHBondContact O-CB 3.42Å; S109-E113 PolarHBondContact O-N 3.31Å |
| 114 | D | 76.9 | Confident | 71.1 | Confident | 147 Ų | 147 | 120.5 Ų | 120.5 | 79% | 0.786 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -72.9 | -29.5 | 174 | -170.8 | 58.7 | 0 | 0 | 0 | 112.7 | V111 L112 G116 | V111-D114 PolarHBondContact O-N 3.37Å; L112-D114 VanDerWaalsContact C-N 3.34Å; D114-G116 VanDerWaalsContact C-N 3.25Å; D114-G116 PolarHBondContact O-N 3.14Å |
| 115 | L | 70.7 | Confident | 68.9 | Low | 128 Ų | 128 | 118.2 Ų | 118.2 | 67% | 0.67 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | -4.8 | 178.8 | -70.3 | 171.5 | 0 | 0 | 0 | 113.9 | V111 L112 | V111-L115 HydrophobicContact CG1-CD1 4.12Å; V111-L115 WeakPolarHBondContact O-CG 3.19Å; V111-L115 PolarHBondContact O-N 3.41Å; L112-L115 PolarHBondContact O-N 2.81Å |
| 116 | G | 67.8 | Low | 66.9 | Low | 35 Ų | 35 | 118 Ų | 118 | 36% | 0.361 | 68% | 0.68 | S | S | . | * | | | trans | 66.5 | 172.3 | -178 | 0 | 0 | 0 | 0 | 0 | 112.5 | L112 D114 E118 | L112-G116 PolarHBondContact O-N 3.03Å; D114-G116 VanDerWaalsContact C-N 3.25Å; D114-G116 PolarHBondContact O-N 3.14Å; G116-E118 PolarHBondContact O-N 3.06Å |
| 117 | P | 72.4 | Confident | 64.7 | Low | 132 Ų | 132 | 118.1 Ų | 118.1 | 86% | 0.857 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -57 | 118.8 | -179.4 | 23.3 | -31.9 | 0 | 0 | 0 | 110.1 | | |
| 118 | E | 64.9 | Low | 62 | Low | 145 Ų | 145 | 121.1 Ų | 121.1 | 68% | 0.678 | 70% | 0.703 | S | S | * | * | | | trans | -57.1 | 129.2 | 172 | -147.2 | -101.5 | 152.1 | 0 | 0 | 107.6 | G116 E120 | G116-E118 PolarHBondContact O-N 3.06Å; E118-E120 PolarHBondContact O-N 3.01Å |
| 119 | P | 60.7 | Low | 60 | Low | 102 Ų | 102 | 121.6 Ų | 121.6 | 66% | 0.662 | 71% | 0.705 | S | S | * | * | | | trans | -61.2 | 114.5 | 175.5 | 25.6 | -31.7 | 0 | 0 | 0 | 107.6 | T121 | P119-T121 PolarHBondContact O-N 3.44Š|
| 120 | E | 52 | Low | 58.5 | Low | 185 Ų | 185 | 122.5 Ų | 122.5 | 86% | 0.864 | 71% | 0.709 | S | S | * | * | | | trans | -48.2 | 103 | 173.6 | -85.1 | -161 | 131.3 | 0 | 0 | 109.4 | E118 P122 | E118-E120 PolarHBondContact O-N 3.01Å; E120-P122 WeakPolarHBondContact O-CD 3.49Å |
| 121 | T | 53.8 | Low | 56.6 | Low | 107 Ų | 107 | 127.4 Ų | 127.4 | 66% | 0.656 | 73% | 0.731 | S | S | * | * | | | trans | -71.7 | 118.4 | 159.8 | 52.7 | 0 | 0 | 0 | 0 | 106.4 | P119 I123 | P119-T121 PolarHBondContact O-N 3.44Å; T121-I123 PolarHBondContact O-N 3.32Å |
| 122 | P | 42.9 | Very low | 54.9 | Low | 121 Ų | 121 | 131.4 Ų | 131.4 | 79% | 0.786 | 74% | 0.744 | S | S | * | * | | | trans | -60.7 | 125.9 | -174.2 | 22.5 | -31.7 | 0 | 0 | 0 | 110.7 | E120 A124 | E120-P122 WeakPolarHBondContact O-CD 3.49Å; P122-A124 PolarHBondContact O-N 3.47Å; P122-A124 VanDerWaalsContact O-N 3.08Å |
| 123 | I | 48.7 | Very low | 53.4 | Low | 164 Ų | 164 | 133.9 Ų | 133.9 | 84% | 0.841 | 75% | 0.752 | S | S | * | * | | | trans | -62.9 | 104.2 | 168.3 | -59.1 | 166.7 | 0 | 0 | 0 | 107.4 | T121 | T121-I123 PolarHBondContact O-N 3.32Š|
| 124 | A | 44.7 | Very low | 51.7 | Low | 89 Ų | 89 | 134.5 Ų | 134.5 | 74% | 0.736 | 76% | 0.755 | S | S | * | * | | | trans | -82.4 | 132.4 | 167.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | P122 | P122-A124 PolarHBondContact O-N 3.47Å; P122-A124 VanDerWaalsContact O-N 3.08Å |
| 125 | P | 42.2 | Very low | 50.2 | Low | 123 Ų | 123 | 135.1 Ų | 135.1 | 80% | 0.799 | 75% | 0.753 | S | S | * | * | | | trans | -76.1 | 141.6 | -169.8 | 30.9 | -34.2 | 0 | 0 | 0 | 112.7 | A127 | P125-A127 PolarHBondContact O-N 3.41Š|
| 126 | L | 48.4 | Very low | 49.1 | Very low | 180 Ų | 180 | 136.2 Ų | 136.2 | 94% | 0.942 | 76% | 0.755 | S | S | * | * | | | trans | -65.3 | 113.5 | 167.7 | -175.1 | 77.3 | 0 | 0 | 0 | 110.6 | | |
| 127 | A | 40.6 | Very low | 48.3 | Very low | 82 Ų | 82 | 141.5 Ų | 141.5 | 68% | 0.678 | 77% | 0.77 | S | S | * | * | | | | 165.2 | 139.6 | 128.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | P125 | P125-A127 PolarHBondContact O-N 3.41Š|
| 128 | T | 32.4 | Very low | 47 | Very low | 130 Ų | 130 | 142.5 Ų | 142.5 | 80% | 0.798 | 76% | 0.764 | S | S | * | * | | | trans | 89.8 | 88.9 | 150.5 | 15.6 | 0 | 0 | 0 | 0 | 121.7 | | |
| 129 | Q | 42.1 | Very low | 46.4 | Very low | 176 Ų | 176 | 142.4 Ų | 142.4 | 82% | 0.822 | 76% | 0.763 | S | S | * | * | | | | 71.7 | 152.4 | 124.5 | -73.1 | -80.7 | 52.8 | 0 | 0 | 119.6 | | |
| 130 | P | 50.1 | Low | 46 | Very low | 95 Ų | 95 | 144.4 Ų | 144.4 | 62% | 0.617 | 76% | 0.764 | S | S | * | * | | | | -115.8 | 135.3 | -119.4 | 37.9 | -26.6 | 0 | 0 | 0 | 113.8 | | |
| 131 | D | 40.5 | Very low | 46.1 | Very low | 166 Ų | 166 | 142.7 Ų | 142.7 | 89% | 0.888 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -177.2 | 30 | 155.9 | -115.6 | -42.9 | 0 | 0 | 0 | 114.9 | | |
| 132 | E | 44.2 | Very low | 45.8 | Very low | 165 Ų | 165 | 144.6 Ų | 144.6 | 77% | 0.771 | 76% | 0.757 | S | S | * | * | | | trans | -126.1 | 13.2 | -173.5 | -62 | -171.6 | 165.8 | 0 | 0 | 114.9 | E134 | E132-E134 VanDerWaalsContact C-N 3.26Å; E132-E134 PolarHBondContact O-N 3.23Å |
| 133 | E | 45.5 | Very low | 46.3 | Very low | 172 Ų | 172 | 144.9 Ų | 144.9 | 80% | 0.804 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | -7.7 | -176.3 | -69 | 178.4 | 179.9 | 0 | 0 | 115 | | |
| 134 | E | 44.6 | Very low | 46.6 | Very low | 180 Ų | 180 | 144.2 Ų | 144.2 | 84% | 0.841 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.2 | -19.1 | -179.2 | -74 | -171.1 | 175.6 | 0 | 0 | 114.7 | E132 | E132-E134 VanDerWaalsContact C-N 3.26Å; E132-E134 PolarHBondContact O-N 3.23Å |
| 135 | E | 44.5 | Very low | 47 | Very low | 161 Ų | 161 | 146.7 Ų | 146.7 | 75% | 0.752 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91 | -25.4 | 179.9 | -81.8 | -176.4 | 171 | 0 | 0 | 113.6 | | |
| 136 | E | 49.1 | Very low | 47 | Very low | 150 Ų | 150 | 148.4 Ų | 148.4 | 70% | 0.701 | 75% | 0.746 | S | S | * | * | H | α-helix | trans | -71.7 | -28.7 | 178.2 | -78.8 | -173.5 | 155.9 | 0 | 0 | 113.3 | E138 E140 | E136-E138 PolarHBondContact O-N 3.13Å; E136-E140 PolarHBondContact O-N 3.36Å |
| 137 | E | 49.2 | Very low | 47.2 | Very low | 146 Ų | 146 | 146.3 Ų | 146.3 | 68% | 0.682 | 74% | 0.743 | S | S | * | * | H | α-helix | trans | -70 | -30.4 | 179 | -76.5 | -167.6 | 162.3 | 0 | 0 | 112.6 | E141 | E137-E141 PolarHBondContact O-N 3.02Å |
| 138 | E | 46.5 | Very low | 47.7 | Very low | 154 Ų | 154 | 145.3 Ų | 145.3 | 72% | 0.72 | 74% | 0.741 | S | S | * | * | H | α-helix | trans | -74 | -34.1 | 178.4 | -76.7 | -169.3 | 160.7 | 0 | 0 | 112.4 | E136 E142 | E136-E138 PolarHBondContact O-N 3.13Å; E138-E142 PolarHBondContact O-N 3.48Å |
| 139 | E | 51.1 | Low | 48.2 | Very low | 143 Ų | 143 | 147.7 Ų | 147.7 | 67% | 0.668 | 75% | 0.748 | S | S | * | * | H | α-helix | trans | -73.6 | -31 | 176.4 | -82.6 | -167.4 | 145.4 | 0 | 0 | 113 | E142 L143 | E139-E142 PolarHBondContact O-N 3.43Å; E139-L143 PolarHBondContact O-N 3.34Å |
| 140 | E | 53.6 | Low | 48.8 | Very low | 144 Ų | 144 | 149.4 Ų | 149.4 | 67% | 0.673 | 76% | 0.756 | S | S | * | * | H | α-helix | trans | -69.1 | -35.4 | 175 | -88.9 | -156.2 | 111.6 | 0 | 0 | 112.8 | E136 | E136-E140 PolarHBondContact O-N 3.36Å |
| 141 | E | 52.4 | Low | 48.5 | Very low | 148 Ų | 148 | 147.8 Ų | 147.8 | 69% | 0.692 | 76% | 0.757 | S | S | * | * | H | α-helix | trans | -70 | -32.7 | 175.2 | -79.3 | -143.2 | 120.8 | 0 | 0 | 112.5 | E137 | E137-E141 PolarHBondContact O-N 3.02Å |
| 142 | E | 48.8 | Very low | 49 | Very low | 148 Ų | 148 | 143.5 Ų | 143.5 | 69% | 0.692 | 75% | 0.752 | S | S | * | * | H | α-helix | trans | -73.3 | -29.2 | 179.9 | -142.5 | -179.5 | 154.1 | 0 | 0 | 112.6 | E138 E139 | E138-E142 PolarHBondContact O-N 3.48Å; E139-E142 PolarHBondContact O-N 3.43Å |
| 143 | L | 54 | Low | 49.4 | Very low | 127 Ų | 127 | 143.1 Ų | 143.1 | 67% | 0.665 | 75% | 0.754 | S | S | * | * | H | α-helix | trans | -75.8 | -27.5 | 176.9 | -77.8 | 169.4 | 0 | 0 | 0 | 114 | E139 L145 | E139-L143 PolarHBondContact O-N 3.34Å; L143-L145 PolarHBondContact O-N 3.08Å |
| 144 | L | 54.7 | Low | 50.1 | Low | 150 Ų | 150 | 145 Ų | 145 | 79% | 0.785 | 75% | 0.754 | S | S | * | * | H | α-helix | trans | -72.8 | -18 | 176.5 | -73.5 | 169.6 | 0 | 0 | 0 | 113.1 | | |
| 145 | L | 53.4 | Low | 50.9 | Low | 141 Ų | 141 | 142.5 Ų | 142.5 | 74% | 0.738 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.3 | 6.7 | -175.7 | -71.6 | 168.3 | 0 | 0 | 0 | 114.5 | L143 P147 | L143-L145 PolarHBondContact O-N 3.08Å; L145-P147 WeakPolarHBondContact O-CD 3.33Å |
| 146 | Q | 42 | Very low | 51.8 | Low | 159 Ų | 159 | 143.2 Ų | 143.2 | 74% | 0.743 | 75% | 0.752 | S | S | * | * | | | trans | -94 | 98.3 | 174.1 | -73.3 | -160.7 | 54.1 | 0 | 0 | 113 | G148 | Q146-G148 PolarHBondContact O-N 3.19Å; Q146-G148 VanDerWaalsContact O-N 3.11Å |
| 147 | P | 52.2 | Low | 52.9 | Low | 135 Ų | 135 | 139.9 Ų | 139.9 | 88% | 0.877 | 75% | 0.75 | S | S | * | * | | | trans | -76.3 | 97.9 | 169.6 | 29.1 | -32.9 | 0 | 0 | 0 | 110.6 | L145 | L145-P147 WeakPolarHBondContact O-CD 3.33Š|
| 148 | G | 50.9 | Low | 53.8 | Low | 62 Ų | 62 | 140.9 Ų | 140.9 | 64% | 0.639 | 76% | 0.759 | S | S | * | * | | | trans | 136.6 | 96.4 | 150.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | Q146 | Q146-G148 PolarHBondContact O-N 3.19Å; Q146-G148 VanDerWaalsContact O-N 3.11Å |
| 149 | L | 42.2 | Very low | 55 | Low | 180 Ų | 180 | 141.4 Ų | 141.4 | 94% | 0.942 | 77% | 0.765 | S | S | * | * | | | trans | -136.6 | 120.1 | 144.7 | -76 | -179.8 | 0 | 0 | 0 | 109.9 | G151 | L149-G151 PolarHBondContact O-N 2.82Å; L149-G151 VanDerWaalsContact O-N 3.15Å |
| 150 | Q | 55.2 | Low | 56 | Low | 211 Ų | 211 | 140.6 Ų | 140.6 | 99% | 0.986 | 77% | 0.77 | S | S | * | * | | | trans | -65.4 | 103 | 179.1 | -68.7 | -178.5 | 67.2 | 0 | 0 | 110.7 | | |
| 151 | G | 44.4 | Very low | 57.1 | Low | 61 Ų | 61 | 139 Ų | 139 | 63% | 0.629 | 77% | 0.766 | S | S | * | * | | | trans | -131.3 | 99.8 | 164.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | L149 L153 | L149-G151 PolarHBondContact O-N 2.82Å; L149-G151 VanDerWaalsContact O-N 3.15Å; G151-L153 VanDerWaalsContact C-N 3.33Å; G151-L153 PolarHBondContact O-N 3.08Å |
| 152 | G | 50.6 | Low | 58.3 | Low | 77 Ų | 77 | 140.5 Ų | 140.5 | 79% | 0.794 | 77% | 0.773 | S | S | * | * | | | trans | -65.7 | 81 | -167.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | R154 | G152-R154 PolarHBondContact O-N 3Š|
| 153 | L | 52.8 | Low | 59.6 | Low | 156 Ų | 156 | 138 Ų | 138 | 82% | 0.817 | 77% | 0.772 | S | S | * | * | | | trans | -66.4 | 92.6 | 156.8 | -60.3 | -178 | 0 | 0 | 0 | 106.4 | G151 T155 | G151-L153 VanDerWaalsContact C-N 3.33Å; G151-L153 PolarHBondContact O-N 3.08Å; L153-T155 PolarHBondContact O-N 3Å |
| 154 | R | 60 | Low | 59.9 | Low | 212 Ų | 212 | 137 Ų | 137 | 80% | 0.8 | 77% | 0.774 | S | S | * | * | | | trans | -64 | 88.2 | 167.5 | -57.9 | -168.4 | 96.1 | -143 | 4.6 | 105.8 | G152 K156 | G152-R154 PolarHBondContact O-N 3Å; R154-K156 VanDerWaalsContact C-N 3.33Å; R154-K156 PolarHBondContact O-N 2.76Å |
| 155 | T | 61 | Low | 60.5 | Low | 127 Ų | 127 | 141.3 Ų | 141.3 | 78% | 0.779 | 78% | 0.78 | S | S | * | * | | | trans | -51.5 | 105.7 | 166 | 47.3 | 0 | 0 | 0 | 0 | 105.2 | L153 A157 | L153-T155 PolarHBondContact O-N 3Å; T155-A157 VanDerWaalsContact C-N 3.27Å; T155-A157 PolarHBondContact O-N 3.12Å |
| 156 | K | 64.6 | Low | 61 | Low | 176 Ų | 176 | 149.8 Ų | 149.8 | 77% | 0.765 | 80% | 0.802 | S | S | * | * | | | trans | -65.8 | 100.5 | 176.4 | -62.7 | -82.3 | 177.2 | 161.5 | 0 | 103.9 | R154 L158 | R154-K156 VanDerWaalsContact C-N 3.33Å; R154-K156 PolarHBondContact O-N 2.76Å; K156-L158 PolarHBondContact O-N 3.33Å; K156-L158 VanDerWaalsContact O-N 3.16Å |
| 157 | A | 71.4 | Confident | 61.9 | Low | 81 Ų | 81 | 149.4 Ų | 149.4 | 67% | 0.669 | 81% | 0.805 | S | S | * | * | | | trans | -53.4 | 125.4 | 176 | 0 | 0 | 0 | 0 | 0 | 107.3 | T155 I159 | T155-A157 VanDerWaalsContact C-N 3.27Å; T155-A157 PolarHBondContact O-N 3.12Å; A157-I159 PolarHBondContact O-N 3.5Å |
| 158 | L | 67.3 | Low | 62.4 | Low | 166 Ų | 166 | 150.1 Ų | 150.1 | 87% | 0.869 | 80% | 0.801 | S | S | * | * | | | trans | -62.4 | 102.9 | 178.1 | -66.5 | 174.3 | 0 | 0 | 0 | 107.6 | K156 V160 | K156-L158 PolarHBondContact O-N 3.33Å; K156-L158 VanDerWaalsContact O-N 3.16Å; L158-V160 PolarHBondContact O-N 3.07Å; L158-V160 VanDerWaalsContact O-N 3.13Å |
| 159 | I | 71.6 | Confident | 63.1 | Low | 166 Ų | 166 | 155 Ų | 155 | 85% | 0.851 | 81% | 0.81 | S | S | * | * | | | trans | -73.9 | 105.6 | 173.6 | -64 | 165.7 | 0 | 0 | 0 | 105.9 | A157 D161 | A157-I159 PolarHBondContact O-N 3.5Å; I159-D161 PolarHBondContact O-N 3.17Å |
| 160 | V | 73.8 | Confident | 64.3 | Low | 125 Ų | 125 | 153.5 Ų | 153.5 | 76% | 0.758 | 80% | 0.803 | S | S | * | * | | | trans | -78.6 | 114.7 | 174.7 | 179.8 | 0 | 0 | 0 | 0 | 107.7 | L158 E162 | L158-V160 PolarHBondContact O-N 3.07Å; L158-V160 VanDerWaalsContact O-N 3.13Å; V160-E162 PolarHBondContact O-N 2.71Å; V160-E162 VanDerWaalsContact O-N 3.15Å |
| 161 | D | 75.1 | Confident | 64.9 | Low | 111 Ų | 111 | 149.9 Ų | 149.9 | 59% | 0.594 | 79% | 0.791 | S | S | * | * | | | trans | -72.3 | 102.5 | 173.6 | 179.7 | 43.3 | 0 | 0 | 0 | 110 | I159 S163 | I159-D161 PolarHBondContact O-N 3.17Å; D161-S163 PolarHBondContact O-N 2.98Å; D161-S163 WeakPolarHBondContact OD1-CB 3.25Å; D161-S163 PolarHBondContact OD1-N 2.76Å; D161-S163 WeakPolarHBondContact OD2-CB 3.41Å |
| 162 | E | 78.1 | Confident | 66.2 | Low | 179 Ų | 179 | 155.9 Ų | 155.9 | 84% | 0.836 | 80% | 0.802 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.1 | 2.1 | 179.3 | -148.3 | -167.6 | 148 | 0 | 0 | 112.8 | V160 C164 | V160-E162 PolarHBondContact O-N 2.71Å; V160-E162 VanDerWaalsContact O-N 3.15Å; E162-C164 PolarHBondContact O-N 3.09Å |
| 163 | S | 76.2 | Confident | 67.3 | Low | 97 Ų | 97 | 161.5 Ų | 161.5 | 68% | 0.678 | 80% | 0.803 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.3 | -21.2 | 174.7 | -160.6 | 0 | 0 | 0 | 0 | 112.4 | D161 R165 | D161-S163 PolarHBondContact O-N 2.98Å; D161-S163 WeakPolarHBondContact OD1-CB 3.25Å; D161-S163 PolarHBondContact OD1-N 2.76Å; D161-S163 WeakPolarHBondContact OD2-CB 3.41Å; S163-R165 PolarHBondContact O-N 3.2Å |
| 164 | C | 61.1 | Low | 68.5 | Low | 104 Ų | 104 | 161.9 Ų | 161.9 | 70% | 0.703 | 80% | 0.802 | S | S | * | * | S | Bend | trans | -73.4 | 91.3 | 171.9 | -69.5 | 0 | 0 | 0 | 0 | 111.6 | E162 R166 | E162-C164 PolarHBondContact O-N 3.09Å; C164-R166 PolarHBondContact O-N 2.88Å |
| 165 | R | 67.2 | Low | 69.2 | Low | 241 Ų | 241 | 157.8 Ų | 157.8 | 91% | 0.909 | 80% | 0.802 | S | S | * | * | | | trans | -67.5 | 129.9 | 169.5 | -66.7 | -171.5 | 175.1 | -171.8 | -1.3 | 110.8 | S163 | S163-R165 PolarHBondContact O-N 3.2Š|
| 166 | R | 62.6 | Low | 69.9 | Low | 320 Ų | 320 | 160.5 Ų | 160.5 | 100% | 1.208 | 80% | 0.804 | S | S | * | * | | | trans | -70.5 | 0 | 171.1 | -75.5 | -177 | 177.8 | 179.6 | 0.1 | 112.7 | C164 | C164-R166 PolarHBondContact O-N 2.88Š|