| 1 | A | 51.8 | Low | 55.8 | Low | 149 Ų | 149 | 156 Ų | 156 | 100% | 1.231 | 88% | 0.876 | S | S | * | * | | | | 0 | 125.7 | 0 | 0 | 0 | 0 | 0 | 0 | 109.4 | | |
| 2 | P | 55 | Low | 55.4 | Low | 133 Ų | 133 | 152.8 Ų | 152.8 | 86% | 0.864 | 87% | 0.872 | S | S | * | * | P | Polyproline II helix | trans | -86.8 | 145.8 | 177 | 33.6 | -28.9 | 0 | 0 | 0 | 111.2 | | |
| 3 | R | 60.4 | Low | 54.6 | Low | 237 Ų | 237 | 146.2 Ų | 146.2 | 89% | 0.894 | 86% | 0.858 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 149.8 | -179.2 | -61.6 | -179.3 | -174.6 | -128.6 | 1.9 | 111.5 | | |
| 4 | P | 60.3 | Low | 53.8 | Low | 131 Ų | 131 | 145.1 Ų | 145.1 | 85% | 0.851 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -77.8 | 141.3 | 178.8 | 31.5 | -32.2 | 0 | 0 | 0 | 111.6 | | |
| 5 | R | 62.5 | Low | 53.3 | Low | 250 Ų | 250 | 149.8 Ų | 149.8 | 94% | 0.943 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 130.3 | 171.7 | -63 | -176.3 | -173.5 | -146.1 | 1.9 | 109 | | |
| 6 | G | 56.3 | Low | 52.4 | Low | 68 Ų | 68 | 145.3 Ų | 145.3 | 70% | 0.701 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 168.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | | |
| 7 | P | 60.4 | Low | 52.1 | Low | 125 Ų | 125 | 151.5 Ų | 151.5 | 81% | 0.812 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 141.2 | -165 | 31.5 | -33.1 | 0 | 0 | 0 | 113.2 | V9 | P7-V9 PolarHBondContact O-N 3.15Š|
| 8 | L | 57.7 | Low | 51.3 | Low | 179 Ų | 179 | 147.7 Ų | 147.7 | 94% | 0.937 | 85% | 0.847 | S | S | * | * | | | trans | -70.4 | 113.4 | 164.8 | -85.3 | 142.5 | 0 | 0 | 0 | 109.3 | G10 | L8-G10 PolarHBondContact O-N 3.17Š|
| 9 | V | 55.1 | Low | 50.8 | Low | 129 Ų | 129 | 144.3 Ų | 144.3 | 78% | 0.782 | 85% | 0.848 | S | S | * | * | | | trans | -81.1 | 101.3 | 168.3 | 170.6 | 0 | 0 | 0 | 0 | 108.6 | P7 | P7-V9 PolarHBondContact O-N 3.15Š|
| 10 | G | 45.5 | Very low | 50.7 | Low | 66 Ų | 66 | 145.8 Ų | 145.8 | 68% | 0.68 | 85% | 0.846 | S | S | * | * | | | trans | -75.3 | 130.4 | 161.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | L8 | L8-G10 PolarHBondContact O-N 3.17Š|
| 11 | R | 48.4 | Very low | 50.7 | Low | 249 Ų | 249 | 146 Ų | 146 | 94% | 0.94 | 84% | 0.839 | S | S | * | * | | | trans | -95.1 | 99.1 | 162.9 | -81.2 | 175.8 | 72.4 | -171.7 | 3.1 | 108.3 | | |
| 12 | S | 51.2 | Low | 50.4 | Low | 118 Ų | 118 | 146.1 Ų | 146.1 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | | | trans | -95.6 | 130.7 | 168.9 | 54.3 | 0 | 0 | 0 | 0 | 110.7 | | |
| 13 | G | 44.9 | Very low | 50.2 | Low | 67 Ų | 67 | 148 Ų | 148 | 69% | 0.691 | 81% | 0.809 | S | S | * | * | | | trans | 108.8 | 150.8 | 145.8 | 0 | 0 | 0 | 0 | 0 | 117.5 | | |
| 14 | L | 43.5 | Very low | 49.8 | Very low | 130 Ų | 130 | 146.2 Ų | 146.2 | 68% | 0.681 | 81% | 0.808 | S | S | * | * | | | cis | -168.6 | 132.6 | -8.7 | -91.2 | 174.4 | 0 | 0 | 0 | 106.7 | | |
| 15 | R | 47.1 | Very low | 49.4 | Very low | 216 Ų | 216 | 148 Ų | 148 | 82% | 0.815 | 80% | 0.804 | S | S | * | * | | | trans | 56.4 | 128.7 | 140.5 | -64 | -175.8 | -73.5 | -111.5 | 9.1 | 122.8 | | |
| 16 | G | 38.2 | Very low | 48.6 | Very low | 78 Ų | 78 | 142.1 Ų | 142.1 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | | | | -146 | 97.3 | 128.9 | 0 | 0 | 0 | 0 | 0 | 107.4 | | |
| 17 | R | 47.4 | Very low | 48.6 | Very low | 250 Ų | 250 | 145.4 Ų | 145.4 | 94% | 0.943 | 80% | 0.799 | S | S | * | * | | | | 70.2 | 103.4 | 87.3 | -158.3 | -178.7 | -159.7 | -101.9 | 2.4 | 114.5 | | |
| 18 | G | 37.5 | Very low | 47.9 | Very low | 83 Ų | 83 | 147.1 Ų | 147.1 | 86% | 0.856 | 80% | 0.796 | S | S | * | * | | | trans | 103.8 | 117.9 | 132.8 | 0 | 0 | 0 | 0 | 0 | 117.6 | | |
| 19 | G | 41.7 | Very low | 48.2 | Very low | 83 Ų | 83 | 143.2 Ų | 143.2 | 86% | 0.856 | 78% | 0.784 | S | S | * | * | | | trans | 159.3 | 74.4 | 164.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 20 | E | 48.4 | Very low | 48.5 | Very low | 174 Ų | 174 | 142.5 Ų | 142.5 | 81% | 0.813 | 78% | 0.779 | S | S | * | * | | | trans | -64.7 | 137.6 | 168.4 | -97.2 | 168.4 | 121.3 | 0 | 0 | 111.7 | | |
| 21 | E | 51.1 | Low | 49.2 | Very low | 150 Ų | 150 | 144.9 Ų | 144.9 | 70% | 0.701 | 78% | 0.783 | S | S | * | * | | | trans | 55.3 | 125.1 | 141 | -48.1 | -172.8 | 129.4 | 0 | 0 | 120.7 | | |
| 22 | Q | 46.8 | Very low | 49.7 | Very low | 152 Ų | 152 | 143 Ų | 143 | 71% | 0.71 | 78% | 0.781 | S | S | * | * | | | | 160.7 | 127.1 | 100.1 | -79.4 | -165.7 | -9.4 | 0 | 0 | 111.8 | | |
| 23 | K | 50.7 | Low | 50.3 | Low | 173 Ų | 173 | 142.5 Ų | 142.5 | 75% | 0.752 | 78% | 0.778 | S | S | * | * | | | trans | 44.8 | 118.9 | 137.3 | -51.5 | -172.4 | 179.2 | -176.8 | 0 | 117.8 | | |
| 24 | K | 50.5 | Low | 51 | Low | 199 Ų | 199 | 147.6 Ų | 147.6 | 87% | 0.865 | 78% | 0.781 | S | S | * | * | | | | 173.3 | 137.4 | 93 | -82.9 | -167.6 | -169.7 | -167.6 | 0 | 109.6 | | |
| 25 | E | 52.9 | Low | 51.4 | Low | 168 Ų | 168 | 148.8 Ų | 148.8 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | | | trans | -55.8 | 139.7 | 174.6 | -59.4 | 162.8 | 149.1 | 0 | 0 | 111.3 | I27 | E25-I27 PolarHBondContact O-N 3.24Š|
| 26 | P | 45.9 | Very low | 52 | Low | 128 Ų | 128 | 146.9 Ų | 146.9 | 83% | 0.831 | 79% | 0.785 | S | S | * | * | | | trans | -87.2 | 101.4 | 158 | 13.9 | 2.5 | 0 | 0 | 0 | 108.5 | H28 | P26-H28 PolarHBondContact O-N 3.14Š|
| 27 | I | 55.5 | Low | 52.9 | Low | 137 Ų | 137 | 150.5 Ų | 150.5 | 70% | 0.703 | 79% | 0.786 | S | S | * | * | | | trans | -70.6 | 104.2 | 166.9 | -56.4 | 173.9 | 0 | 0 | 0 | 107.2 | E25 S29 | E25-I27 PolarHBondContact O-N 3.24Å; I27-S29 PolarHBondContact O-N 3.31Å |
| 28 | H | 46.7 | Very low | 53.3 | Low | 161 Ų | 161 | 146.3 Ų | 146.3 | 75% | 0.745 | 78% | 0.779 | S | S | * | * | | | trans | -91.6 | 91.2 | 167.5 | -170.5 | -75 | 0 | 0 | 0 | 109.3 | P26 V30 | P26-H28 PolarHBondContact O-N 3.14Å; H28-V30 PolarHBondContact O-N 3.03Å |
| 29 | S | 63.6 | Low | 54.1 | Low | 97 Ų | 97 | 151.6 Ų | 151.6 | 68% | 0.678 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 123.4 | 168.7 | -72.3 | 0 | 0 | 0 | 0 | 110.2 | I27 | I27-S29 PolarHBondContact O-N 3.31Š|
| 30 | V | 61.5 | Low | 54.9 | Low | 114 Ų | 114 | 156.1 Ų | 156.1 | 69% | 0.691 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -84.6 | 129.1 | 173.3 | 177.6 | 0 | 0 | 0 | 0 | 109.4 | H28 K32 | H28-V30 PolarHBondContact O-N 3.03Å; V30-K32 PolarHBondContact O-N 3.04Å |
| 31 | P | 59.6 | Low | 55 | Low | 116 Ų | 116 | 155.1 Ų | 155.1 | 75% | 0.753 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 125.6 | 169.3 | -8.9 | 24.6 | 0 | 0 | 0 | 109.8 | S33 | P31-S33 PolarHBondContact O-N 3.48Š|
| 32 | K | 59.6 | Low | 55.1 | Low | 209 Ų | 209 | 153.9 Ų | 153.9 | 91% | 0.909 | 78% | 0.78 | S | S | * | * | | | trans | -69.4 | 113.9 | 168.5 | -75.6 | -178.5 | 173.1 | 173.4 | 0 | 109.3 | V30 | V30-K32 PolarHBondContact O-N 3.04Š|
| 33 | S | 63 | Low | 55.3 | Low | 107 Ų | 107 | 154.4 Ų | 154.4 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | | | trans | -78.3 | 128 | 161.4 | 52.2 | 0 | 0 | 0 | 0 | 109.3 | P31 | P31-S33 PolarHBondContact O-N 3.48Š|
| 34 | K | 59.4 | Low | 54.5 | Low | 175 Ų | 175 | 154.7 Ų | 154.7 | 76% | 0.761 | 79% | 0.787 | S | S | * | * | | | trans | -106.3 | 88.9 | 177.6 | 179 | 172 | -179 | 172.9 | 0 | 107.1 | K36 | K34-K36 PolarHBondContact O-N 2.98Š|
| 35 | D | 52.7 | Low | 53.9 | Low | 154 Ų | 154 | 150 Ų | 150 | 82% | 0.824 | 78% | 0.775 | S | S | * | * | | | trans | -85 | 103.9 | 168.4 | -80.7 | -50.3 | 0 | 0 | 0 | 109.4 | | |
| 36 | K | 60 | Low | 53.6 | Low | 176 Ų | 176 | 153.9 Ų | 153.9 | 77% | 0.765 | 78% | 0.782 | S | S | * | * | | | trans | -85.9 | 109.2 | 159.1 | -77.6 | -165.5 | 154.3 | -157.1 | 0 | 107.2 | K34 | K34-K36 PolarHBondContact O-N 2.98Š|
| 37 | L | 56.2 | Low | 53.3 | Low | 155 Ų | 155 | 156.7 Ų | 156.7 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | | | trans | -122.4 | 110.1 | 156.2 | -112.1 | -180 | 0 | 0 | 0 | 109.9 | E39 | L37-E39 PolarHBondContact O-N 3.14Š|
| 38 | M | 56.5 | Low | 52.6 | Low | 162 Ų | 162 | 154.5 Ų | 154.5 | 80% | 0.798 | 79% | 0.787 | S | S | * | * | | | trans | -36.1 | 120.3 | 158.1 | 36.4 | -178.8 | 67.6 | 0 | 0 | 113.1 | | |
| 39 | E | 54.5 | Low | 52.4 | Low | 194 Ų | 194 | 153.2 Ų | 153.2 | 91% | 0.907 | 79% | 0.786 | S | S | * | * | | | trans | -124.6 | 136.1 | 153.3 | -162.5 | 175.6 | 140.4 | 0 | 0 | 108.9 | L37 | L37-E39 PolarHBondContact O-N 3.14Š|
| 40 | K | 59 | Low | 51.6 | Low | 178 Ų | 178 | 160.5 Ų | 160.5 | 77% | 0.774 | 80% | 0.798 | S | S | * | * | | | trans | -76.7 | 148.7 | -156.5 | -66.5 | -88.3 | -178.8 | 167.4 | 0 | 111.4 | S42 | K40-S42 PolarHBondContact O-N 3.24Š|
| 41 | H | 49.4 | Very low | 50.7 | Low | 152 Ų | 152 | 163.1 Ų | 163.1 | 70% | 0.704 | 80% | 0.803 | S | S | * | * | | | trans | -44.1 | 122.5 | 158.4 | -142.2 | -93.8 | 0 | 0 | 0 | 111.4 | | |
| 42 | S | 52.6 | Low | 50.1 | Low | 125 Ų | 125 | 163 Ų | 163 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | | | trans | -115.8 | 101.5 | 158.1 | -75.4 | 0 | 0 | 0 | 0 | 108.1 | K40 | K40-S42 PolarHBondContact O-N 3.24Š|
| 43 | Q | 51.3 | Low | 49.3 | Very low | 162 Ų | 162 | 162 Ų | 162 | 76% | 0.757 | 80% | 0.803 | S | S | * | * | | | trans | -92.5 | 119.4 | 161.7 | -93.2 | 177.8 | -12.5 | 0 | 0 | 107.7 | | |
| 44 | E | 34 | Very low | 48.9 | Very low | 180 Ų | 180 | 166.3 Ų | 166.3 | 84% | 0.841 | 81% | 0.809 | S | S | * | * | | | trans | -174.6 | 136.9 | 154.4 | -119.7 | -162.9 | 79.9 | 0 | 0 | 105.8 | | |
| 45 | T | 39.1 | Very low | 48.5 | Very low | 101 Ų | 101 | 164.1 Ų | 164.1 | 62% | 0.62 | 81% | 0.812 | S | S | * | * | | | cis | -162 | 135.2 | 7.1 | -23.2 | 0 | 0 | 0 | 0 | 104.3 | Q47 | T45-Q47 PolarHBondContact O-N 3.1Š|
| 46 | R | 44.8 | Very low | 48 | Very low | 248 Ų | 248 | 162.3 Ų | 162.3 | 94% | 0.936 | 81% | 0.807 | S | S | * | * | | | trans | -65.3 | 121.9 | 164.3 | -75.7 | -172.8 | 170.1 | -173.4 | -2.5 | 107.7 | | |
| 47 | Q | 41.3 | Very low | 47.5 | Very low | 187 Ų | 187 | 162.1 Ų | 162.1 | 87% | 0.874 | 81% | 0.814 | S | S | * | * | | | trans | -130.2 | 113.9 | 149.8 | -71.5 | -144.4 | -32.1 | 0 | 0 | 109 | T45 | T45-Q47 PolarHBondContact O-N 3.1Š|
| 48 | A | 40.1 | Very low | 47.4 | Very low | 92 Ų | 92 | 158.1 Ų | 158.1 | 76% | 0.76 | 80% | 0.799 | S | S | * | * | | | trans | -70.4 | 154.4 | 165.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | | |
| 49 | D | 43.2 | Very low | 47 | Very low | 134 Ų | 134 | 158.2 Ų | 158.2 | 72% | 0.717 | 80% | 0.802 | S | S | * | * | | | trans | 57.1 | 96.3 | 143.3 | -165.7 | 24.7 | 0 | 0 | 0 | 117.1 | | |
| 50 | R | 46.2 | Very low | 46.9 | Very low | 249 Ų | 249 | 157.6 Ų | 157.6 | 94% | 0.94 | 80% | 0.799 | S | S | * | * | | | trans | -158.7 | 125.4 | 130.7 | -109.5 | 178.1 | -168 | 179.6 | 3.9 | 112 | | |
| 51 | E | 42.4 | Very low | 46.3 | Very low | 170 Ų | 170 | 157.2 Ų | 157.2 | 79% | 0.794 | 80% | 0.804 | S | S | * | * | | | trans | -69.9 | 160.5 | 174 | -42.6 | -177.3 | 115.1 | 0 | 0 | 110.9 | | |
| 52 | S | 47.3 | Very low | 45.9 | Very low | 113 Ų | 113 | 154.1 Ų | 154.1 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | | | trans | 71.4 | 112.8 | 160.1 | -114.3 | 0 | 0 | 0 | 0 | 118.3 | | |
| 53 | E | 42.4 | Very low | 45.8 | Very low | 187 Ų | 187 | 153.2 Ų | 153.2 | 87% | 0.874 | 80% | 0.799 | S | S | * | * | | | | 173.7 | 143.6 | 108.7 | -90.5 | -174.3 | 101.1 | 0 | 0 | 110.6 | | |
| 54 | K | 54.1 | Low | 45.3 | Very low | 198 Ų | 198 | 150.1 Ų | 150.1 | 86% | 0.861 | 80% | 0.801 | S | S | * | * | | | trans | -73.2 | 136.3 | -177.6 | -52.4 | 171.8 | -172.9 | -177.8 | 0 | 109.5 | V56 | K54-V56 PolarHBondContact O-N 3.05Š|
| 55 | P | 52.5 | Low | 46.2 | Very low | 129 Ų | 129 | 147.9 Ų | 147.9 | 84% | 0.838 | 80% | 0.799 | S | S | * | * | | | trans | -78.6 | 111.2 | 162.2 | 28.2 | -27.7 | 0 | 0 | 0 | 109.3 | D57 | P55-D57 PolarHBondContact O-N 3.18Š|
| 56 | V | 41.9 | Very low | 46.8 | Very low | 117 Ų | 117 | 147.5 Ų | 147.5 | 71% | 0.709 | 81% | 0.807 | S | S | * | * | | | trans | -44 | 120.9 | 164.8 | 158.4 | 0 | 0 | 0 | 0 | 110.7 | K54 S58 | K54-V56 PolarHBondContact O-N 3.05Å; V56-S58 VanDerWaalsContact C-N 3.28Å; V56-S58 PolarHBondContact O-N 3.02Å; V56-S58 WeakPolarHBondContact CG1-OG 3.06Å |
| 57 | D | 48.3 | Very low | 47.1 | Very low | 171 Ų | 171 | 145 Ų | 145 | 91% | 0.914 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -74.1 | 82 | 168.5 | -163.2 | 5.5 | 0 | 0 | 0 | 108.5 | P55 | P55-D57 PolarHBondContact O-N 3.18Š|
| 58 | S | 53.7 | Low | 47.5 | Very low | 71 Ų | 71 | 143.6 Ų | 143.6 | 50% | 0.497 | 80% | 0.796 | S | S | . | * | | | trans | -160.3 | 91.4 | 166.1 | 67.7 | 0 | 0 | 0 | 0 | 111.1 | V56 | V56-S58 VanDerWaalsContact C-N 3.28Å; V56-S58 PolarHBondContact O-N 3.02Å; V56-S58 WeakPolarHBondContact CG1-OG 3.06Å |
| 59 | L | 48.8 | Very low | 48.1 | Very low | 165 Ų | 165 | 145.2 Ų | 145.2 | 86% | 0.864 | 80% | 0.796 | S | S | * | * | | | trans | -131.4 | 97.2 | 150.5 | -74.4 | 178.3 | 0 | 0 | 0 | 108.8 | L61 | L59-L61 PolarHBondContact O-N 3.35Å; L59-L61 VanDerWaalsContact O-N 3.1Å |
| 60 | H | 52.8 | Low | 48.6 | Very low | 181 Ų | 181 | 142.8 Ų | 142.8 | 84% | 0.838 | 79% | 0.79 | S | S | * | * | | | trans | -53 | 108.3 | 157.9 | -71.7 | -92.7 | 0 | 0 | 0 | 108.9 | A62 | H60-A62 PolarHBondContact O-N 3.24Š|
| 61 | L | 46.3 | Very low | 48.8 | Very low | 170 Ų | 170 | 136.7 Ų | 136.7 | 89% | 0.89 | 78% | 0.782 | S | S | * | * | | | trans | -84.5 | 94.3 | 161.9 | -123.7 | 73.1 | 0 | 0 | 0 | 108.5 | L59 | L59-L61 PolarHBondContact O-N 3.35Å; L59-L61 VanDerWaalsContact O-N 3.1Å |
| 62 | A | 40.7 | Very low | 49.1 | Very low | 87 Ų | 87 | 133.7 Ų | 133.7 | 72% | 0.719 | 79% | 0.787 | S | S | * | * | | | trans | -60.3 | 138.9 | 167.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | H60 | H60-A62 PolarHBondContact O-N 3.24Š|
| 63 | S | 50.4 | Low | 49.2 | Very low | 106 Ų | 106 | 132.8 Ų | 132.8 | 74% | 0.741 | 79% | 0.786 | S | S | * | * | | | trans | 38 | 109.4 | 143.8 | -160.8 | 0 | 0 | 0 | 0 | 119.2 | | |
| 64 | A | 41.8 | Very low | 49.7 | Very low | 97 Ų | 97 | 129.9 Ų | 129.9 | 80% | 0.802 | 79% | 0.786 | S | S | * | * | | | trans | -141.2 | 78.1 | 148.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | A66 | A64-A66 PolarHBondContact O-N 2.95Š|
| 65 | T | 52.6 | Low | 49.4 | Very low | 132 Ų | 132 | 127.8 Ų | 127.8 | 81% | 0.81 | 78% | 0.779 | S | S | * | * | | | trans | -69.1 | 84.5 | 158.3 | 42.6 | 0 | 0 | 0 | 0 | 109 | K67 | T65-K67 PolarHBondContact O-N 2.67Š|
| 66 | A | 50.2 | Low | 49.3 | Very low | 94 Ų | 94 | 130.6 Ų | 130.6 | 78% | 0.777 | 78% | 0.781 | S | S | * | * | | | trans | -85 | 105.6 | 165.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | A64 H68 | A64-A66 PolarHBondContact O-N 2.95Å; A66-H68 PolarHBondContact O-N 2.84Å |
| 67 | K | 52.4 | Low | 49.7 | Very low | 195 Ų | 195 | 131.5 Ų | 131.5 | 85% | 0.848 | 78% | 0.778 | S | S | * | * | | | trans | -66.3 | 100.3 | 171.4 | -65.6 | -173.1 | 179.2 | -176.4 | 0 | 108.6 | T65 V69 | T65-K67 PolarHBondContact O-N 2.67Å; K67-V69 VanDerWaalsContact C-N 3.33Å; K67-V69 PolarHBondContact O-N 2.92Å |
| 68 | H | 48.6 | Very low | 50.3 | Low | 157 Ų | 157 | 132.4 Ų | 132.4 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | | | trans | -75.3 | 91.2 | 167.2 | -166.8 | -97.5 | 0 | 0 | 0 | 108.6 | A66 S70 | A66-H68 PolarHBondContact O-N 2.84Å; H68-S70 PolarHBondContact ND1-OG 2.82Å; H68-S70 VanDerWaalsContact O-N 3.14Å; H68-S70 PolarHBondContact O-N 2.87Å |
| 69 | V | 52.3 | Low | 50.5 | Low | 127 Ų | 127 | 133.7 Ų | 133.7 | 77% | 0.77 | 78% | 0.78 | S | S | * | * | | | trans | -66 | 108.7 | 164.2 | 176.8 | 0 | 0 | 0 | 0 | 106.4 | K67 | K67-V69 VanDerWaalsContact C-N 3.33Å; K67-V69 PolarHBondContact O-N 2.92Å |
| 70 | S | 55.4 | Low | 50.8 | Low | 83 Ų | 83 | 133.5 Ų | 133.5 | 58% | 0.58 | 78% | 0.78 | S | S | * | * | | | trans | -80.8 | 132.2 | 178.4 | -58.5 | 0 | 0 | 0 | 0 | 109.1 | H68 A72 | H68-S70 PolarHBondContact ND1-OG 2.82Å; H68-S70 VanDerWaalsContact O-N 3.14Å; H68-S70 PolarHBondContact O-N 2.87Å; S70-A72 PolarHBondContact O-N 3.49Å |
| 71 | P | 49.7 | Very low | 51.1 | Low | 121 Ų | 121 | 130.4 Ų | 130.4 | 79% | 0.786 | 77% | 0.773 | S | S | * | * | | | trans | -67 | 120.2 | 174.6 | -15.5 | 28.9 | 0 | 0 | 0 | 109.6 | A73 | P71-A73 PolarHBondContact O-N 3.36Å; P71-A73 VanDerWaalsContact O-N 3.15Å |
| 72 | A | 49.8 | Very low | 52.1 | Low | 107 Ų | 107 | 131.6 Ų | 131.6 | 88% | 0.884 | 77% | 0.771 | S | S | * | * | | | trans | -69.8 | 104.7 | 169.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | S70 | S70-A72 PolarHBondContact O-N 3.49Š|
| 73 | A | 48.6 | Very low | 53.4 | Low | 94 Ų | 94 | 135.4 Ų | 135.4 | 78% | 0.777 | 78% | 0.775 | S | S | * | * | | | trans | -100.2 | 104.6 | 158 | 0 | 0 | 0 | 0 | 0 | 107.1 | P71 Q75 | P71-A73 PolarHBondContact O-N 3.36Å; P71-A73 VanDerWaalsContact O-N 3.15Å; A73-Q75 PolarHBondContact O-N 3.3Å |
| 74 | S | 53.4 | Low | 54.2 | Low | 125 Ų | 125 | 139.4 Ų | 139.4 | 87% | 0.874 | 78% | 0.779 | S | S | * | * | | | trans | -63.3 | 106.2 | 172.6 | 48.1 | 0 | 0 | 0 | 0 | 109.9 | | |
| 75 | Q | 47.9 | Very low | 55.3 | Low | 155 Ų | 155 | 139 Ų | 139 | 72% | 0.724 | 77% | 0.77 | S | S | * | * | | | trans | -108.7 | 106.6 | 161.8 | -174.7 | 173.1 | -47.9 | 0 | 0 | 107.3 | A73 E77 | A73-Q75 PolarHBondContact O-N 3.3Å; Q75-E77 PolarHBondContact NE2-OE2 3.38Å; Q75-E77 PolarHBondContact O-N 3.5Å; Q75-E77 VanDerWaalsContact O-N 3.14Å |
| 76 | E | 50.5 | Low | 55.8 | Low | 187 Ų | 187 | 137.1 Ų | 137.1 | 87% | 0.874 | 76% | 0.762 | S | S | * | * | | | trans | -66.1 | 103.9 | 165.3 | -176.3 | 175.2 | 125.2 | 0 | 0 | 107.8 | | |
| 77 | E | 48.7 | Very low | 56.9 | Low | 136 Ų | 136 | 143.2 Ų | 143.2 | 64% | 0.636 | 77% | 0.765 | S | S | * | * | | | trans | -136.5 | 121.9 | 165.4 | -170.5 | -174.7 | 140.4 | 0 | 0 | 107.7 | Q75 P79 | Q75-E77 PolarHBondContact NE2-OE2 3.38Å; Q75-E77 PolarHBondContact O-N 3.5Å; Q75-E77 VanDerWaalsContact O-N 3.14Å; E77-P79 WeakPolarHBondContact O-CD 3.13Å |
| 78 | K | 62.5 | Low | 58.3 | Low | 191 Ų | 191 | 142.4 Ų | 142.4 | 83% | 0.83 | 76% | 0.761 | S | S | * | * | | | trans | -83.7 | 117.4 | 171.5 | -68.1 | 168.3 | 177.4 | 167.2 | 0 | 108.7 | | |
| 79 | P | 56.2 | Low | 59.9 | Low | 97 Ų | 97 | 143.9 Ų | 143.9 | 63% | 0.63 | 77% | 0.765 | S | S | * | * | | | trans | -106.2 | 95 | 154.1 | 33.2 | -31.2 | 0 | 0 | 0 | 109.9 | E77 V81 | E77-P79 WeakPolarHBondContact O-CD 3.13Å; P79-V81 PolarHBondContact O-N 3.44Å |
| 80 | D | 56.3 | Low | 61.3 | Low | 162 Ų | 162 | 144 Ų | 144 | 87% | 0.866 | 77% | 0.766 | S | S | * | * | | | trans | -76.7 | 76 | 154 | -176.1 | 44.6 | 0 | 0 | 0 | 108.4 | | |
| 81 | V | 58.7 | Low | 62.9 | Low | 115 Ų | 115 | 146.1 Ų | 146.1 | 70% | 0.697 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -140.8 | 120.4 | 160.5 | -176.9 | 0 | 0 | 0 | 0 | 105.4 | P79 Q83 | P79-V81 PolarHBondContact O-N 3.44Å; V81-Q83 PolarHBondContact O-N 3.01Å |
| 82 | K | 66.4 | Low | 64.9 | Low | 195 Ų | 195 | 146.1 Ų | 146.1 | 85% | 0.848 | 77% | 0.773 | S | S | * | * | | | trans | -61.2 | 78.9 | 171.4 | -115 | -149.1 | -178 | -167.3 | 0 | 109.6 | K84 | K82-K84 PolarHBondContact O-N 3.31Š|
| 83 | Q | 68.2 | Low | 66.8 | Low | 168 Ų | 168 | 146.5 Ų | 146.5 | 79% | 0.785 | 77% | 0.767 | S | S | * | * | | | trans | -71.1 | 96.1 | 175.4 | -170.9 | 174.9 | -71.8 | 0 | 0 | 107.1 | V81 S85 | V81-Q83 PolarHBondContact O-N 3.01Å; Q83-S85 VanDerWaalsContact C-N 3.27Å; Q83-S85 PolarHBondContact O-N 3.27Å |
| 84 | K | 68 | Low | 68.7 | Low | 190 Ų | 190 | 150 Ų | 150 | 83% | 0.826 | 77% | 0.767 | S | S | * | * | | | trans | -63.4 | 93.6 | 168.2 | -72.9 | -175.3 | 171.8 | 179.2 | 0 | 107.5 | K82 S86 | K82-K84 PolarHBondContact O-N 3.31Å; K84-S86 VanDerWaalsContact C-N 3.26Å; K84-S86 PolarHBondContact O-N 3.38Å |
| 85 | S | 64.7 | Low | 70.3 | Confident | 88 Ų | 88 | 151.3 Ų | 151.3 | 62% | 0.615 | 76% | 0.763 | S | S | * | * | | | trans | -72.5 | 85.7 | 171.1 | 55 | 0 | 0 | 0 | 0 | 108.5 | Q83 R87 | Q83-S85 VanDerWaalsContact C-N 3.27Å; Q83-S85 PolarHBondContact O-N 3.27Å; S85-R87 PolarHBondContact O-N 2.76Å |
| 86 | S | 63.2 | Low | 72.1 | Confident | 92 Ų | 92 | 149.9 Ų | 149.9 | 64% | 0.643 | 76% | 0.759 | S | S | * | * | | | trans | -68 | 90.6 | 162.6 | 65.7 | 0 | 0 | 0 | 0 | 106.8 | K84 K88 | K84-S86 VanDerWaalsContact C-N 3.26Å; K84-S86 PolarHBondContact O-N 3.38Å; S86-K88 PolarHBondContact O-N 3.45Å |
| 87 | R | 73.2 | Confident | 73.8 | Confident | 223 Ų | 223 | 148.8 Ų | 148.8 | 84% | 0.842 | 76% | 0.757 | S | S | * | * | | | trans | -65.9 | 87.5 | 173.2 | -81.3 | -177.2 | 174.2 | 172.2 | -2 | 108.5 | S85 | S85-R87 PolarHBondContact O-N 2.76Š|
| 88 | K | 81.8 | Confident | 75.5 | Confident | 178 Ų | 178 | 147.2 Ų | 147.2 | 77% | 0.774 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 128.4 | 167.9 | -64.3 | -179.2 | -179.5 | 179.5 | 0 | 107.5 | S86 V90 | S86-K88 PolarHBondContact O-N 3.45Å; K88-V90 PolarHBondContact O-N 3Å |
| 89 | K | 82.5 | Confident | 76.8 | Confident | 187 Ų | 187 | 147.6 Ų | 147.6 | 81% | 0.813 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -72 | 119.4 | 172.3 | -59.8 | -67 | -179.1 | 169.5 | 0 | 106.9 | V91 | K89-V91 PolarHBondContact O-N 3.42Š|
| 90 | V | 81.8 | Confident | 77.9 | Confident | 129 Ų | 129 | 146.6 Ų | 146.6 | 78% | 0.782 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 121.2 | 174.8 | 179.4 | 0 | 0 | 0 | 0 | 107.2 | K88 | K88-V90 PolarHBondContact O-N 3Š|
| 91 | V | 89.8 | Confident | 78.8 | Confident | 128 Ų | 128 | 142.6 Ų | 142.6 | 78% | 0.776 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 121.1 | 171.8 | 177.6 | 0 | 0 | 0 | 0 | 107.5 | K89 | K89-V91 PolarHBondContact O-N 3.42Š|
| 92 | V | 90.4 | Very high | 79.7 | Confident | 122 Ų | 122 | 142.8 Ų | 142.8 | 74% | 0.739 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 122.2 | 176.2 | -178.7 | 0 | 0 | 0 | 0 | 108.2 | | |
| 93 | P | 90.1 | Very high | 79.7 | Confident | 115 Ų | 115 | 140.4 Ų | 140.4 | 75% | 0.747 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 140.4 | 174.7 | -20.6 | 32.7 | 0 | 0 | 0 | 111.4 | | |
| 94 | Q | 88.1 | Confident | 79.7 | Confident | 166 Ų | 166 | 138.5 Ų | 138.5 | 78% | 0.776 | 73% | 0.727 | S | S | * | * | | | trans | -106.3 | 132.7 | 174.5 | -173.1 | 174.8 | 3.1 | 0 | 0 | 109.8 | I96 | Q94-I96 HydrophobicContact CG-CG1 4.26Š|
| 95 | I | 86.6 | Confident | 79.4 | Confident | 154 Ų | 154 | 137.2 Ų | 137.2 | 79% | 0.79 | 73% | 0.728 | S | S | * | * | | | trans | -110.6 | 125.1 | 173.7 | -57.3 | 173.8 | 0 | 0 | 0 | 107.6 | | |
| 96 | I | 86.4 | Confident | 78.6 | Confident | 125 Ų | 125 | 139.4 Ų | 139.4 | 64% | 0.641 | 74% | 0.738 | S | S | * | * | | | trans | -111.4 | 119.7 | 178.6 | -56.2 | 175.2 | 0 | 0 | 0 | 108 | Q94 T98 | Q94-I96 HydrophobicContact CG-CG1 4.26Å; I96-T98 HydrophobicContact CG2-CG2 4.1Å |
| 97 | I | 86.1 | Confident | 78.7 | Confident | 163 Ų | 163 | 141.2 Ų | 141.2 | 84% | 0.836 | 75% | 0.751 | S | S | * | * | | | trans | -94.8 | 113.6 | 174.1 | -56.2 | 174.7 | 0 | 0 | 0 | 107.7 | | |
| 98 | T | 83.9 | Confident | 78.1 | Confident | 103 Ų | 103 | 133.6 Ų | 133.6 | 63% | 0.632 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -100.2 | 150.9 | 173.6 | 57.4 | 0 | 0 | 0 | 0 | 110.2 | I96 | I96-T98 HydrophobicContact CG2-CG2 4.1Š|
| 99 | R | 90.9 | Very high | 77.2 | Confident | 199 Ų | 199 | 131.1 Ų | 131.1 | 75% | 0.751 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 145.2 | 167.9 | -178.7 | 178.9 | 171.7 | -117.8 | -5.9 | 109.4 | N102 | R99-N102 PolarHBondContact NH2-ND2 3.47Å; R99-N102 PolarHBondContact NH1-ND2 3.18Å; R99-N102 PolarHBondContact NH2-OD1 3.25Å |
| 100 | A | 78.1 | Confident | 75.8 | Confident | 77 Ų | 77 | 127.1 Ų | 127.1 | 64% | 0.636 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 137.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 101 | S | 76.1 | Confident | 75 | Confident | 78 Ų | 78 | 127.4 Ų | 127.4 | 55% | 0.545 | 75% | 0.75 | S | S | . | * | P | Polyproline II helix | trans | -68.1 | 143.4 | 171.3 | -171.8 | 0 | 0 | 0 | 0 | 109.8 | E103 | S101-E103 WeakPolarHBondContact OG-CG 3.41Å; S101-E103 PolarHBondContact OG-N 3.46Å; S101-E103 PolarHBondContact OG-OE1 3.32Å |
| 102 | N | 77.2 | Confident | 73.3 | Confident | 119 Ų | 119 | 125 Ų | 125 | 64% | 0.636 | 75% | 0.751 | S | S | * | * | | | trans | -101.4 | 11.2 | 176 | -37 | -66.4 | 0 | 0 | 0 | 111.3 | R99 | R99-N102 PolarHBondContact NH2-ND2 3.47Å; R99-N102 PolarHBondContact NH1-ND2 3.18Å; R99-N102 PolarHBondContact NH2-OD1 3.25Å |
| 103 | E | 65.9 | Low | 71.8 | Confident | 144 Ų | 144 | 123.1 Ų | 123.1 | 67% | 0.673 | 74% | 0.743 | S | S | * | * | | | trans | -87.1 | 128.1 | -173.7 | 77.6 | -154.8 | 132.8 | 0 | 0 | 111.9 | S101 L105 | S101-E103 WeakPolarHBondContact OG-CG 3.41Å; S101-E103 PolarHBondContact OG-N 3.46Å; S101-E103 PolarHBondContact OG-OE1 3.32Å; E103-L105 PolarHBondContact O-N 3.3Å |
| 104 | T | 69.1 | Low | 70.5 | Confident | 129 Ų | 129 | 125.6 Ų | 125.6 | 79% | 0.791 | 75% | 0.75 | S | S | * | * | | | trans | -70.5 | 119.8 | 166.9 | -50.6 | 0 | 0 | 0 | 0 | 107.4 | T106 | T104-T106 PolarHBondContact O-N 2.76Š|
| 105 | L | 60.9 | Low | 69.7 | Low | 162 Ų | 162 | 124.8 Ų | 124.8 | 85% | 0.848 | 75% | 0.746 | S | S | * | * | | | trans | -51.1 | 94.6 | -174.5 | -62.8 | 174 | 0 | 0 | 0 | 112.6 | E103 | E103-L105 PolarHBondContact O-N 3.3Š|
| 106 | T | 49.5 | Very low | 68.9 | Low | 134 Ų | 134 | 125.8 Ų | 125.8 | 82% | 0.822 | 75% | 0.748 | S | S | * | * | | | trans | -91.4 | 104.9 | 159.4 | 48 | 0 | 0 | 0 | 0 | 106.5 | T104 G108 | T104-T106 PolarHBondContact O-N 2.76Å; T106-G108 PolarHBondContact O-N 3.14Å |
| 107 | S | 64.8 | Low | 68.3 | Low | 131 Ų | 131 | 130.8 Ų | 130.8 | 92% | 0.916 | 76% | 0.758 | S | S | * | * | | | trans | -49.2 | 133.8 | 177.7 | -74.4 | 0 | 0 | 0 | 0 | 111.8 | | |
| 108 | G | 60.7 | Low | 68 | Low | 63 Ų | 63 | 128.9 Ų | 128.9 | 65% | 0.649 | 76% | 0.755 | S | S | * | * | | | trans | 165.6 | 70.3 | 171.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | T106 | T106-G108 PolarHBondContact O-N 3.14Š|
| 109 | S | 62.3 | Low | 67.6 | Low | 125 Ų | 125 | 131.8 Ų | 131.8 | 87% | 0.874 | 76% | 0.764 | S | S | * | * | | | trans | 53.6 | 125.9 | 142.6 | 54.6 | 0 | 0 | 0 | 0 | 121.2 | | |
| 110 | S | 52.7 | Low | 66.9 | Low | 103 Ų | 103 | 132 Ų | 132 | 72% | 0.72 | 77% | 0.766 | S | S | * | * | | | trans | -150.2 | 123.3 | 130.8 | -171.6 | 0 | 0 | 0 | 0 | 110.4 | G112 | S110-G112 PolarHBondContact O-N 2.85Å; S110-G112 VanDerWaalsContact O-N 3.14Å |
| 111 | S | 64.9 | Low | 66.9 | Low | 135 Ų | 135 | 135.6 Ų | 135.6 | 94% | 0.944 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.7 | 106.5 | 174.8 | -85.5 | 0 | 0 | 0 | 0 | 109.1 | | |
| 112 | G | 55.3 | Low | 66.9 | Low | 77 Ų | 77 | 139.9 Ų | 139.9 | 79% | 0.794 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 145.7 | 1.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115 | S110 D114 | S110-G112 PolarHBondContact O-N 2.85Å; S110-G112 VanDerWaalsContact O-N 3.14Å; G112-D114 PolarHBondContact O-N 3.14Å |
| 113 | S | 58.5 | Low | 66.9 | Low | 83 Ų | 83 | 142.1 Ų | 142.1 | 58% | 0.58 | 79% | 0.787 | S | S | * | * | | | trans | -76.5 | 124.3 | 173 | 63.2 | 0 | 0 | 0 | 0 | 110.1 | Q115 | S113-Q115 PolarHBondContact O-N 3.47Š|
| 114 | D | 61.6 | Low | 67.6 | Low | 167 Ų | 167 | 143 Ų | 143 | 89% | 0.893 | 80% | 0.796 | S | S | * | * | | | trans | -55.3 | 89.9 | 150.4 | -79 | -35.3 | 0 | 0 | 0 | 106.5 | G112 Q116 | G112-D114 PolarHBondContact O-N 3.14Å; D114-Q116 PolarHBondContact O-N 2.65Å |
| 115 | Q | 71.7 | Confident | 67.9 | Low | 150 Ų | 150 | 145.5 Ų | 145.5 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | | | trans | -50.3 | 119 | -178 | 179.7 | 64.6 | 40.2 | 0 | 0 | 107.8 | S113 R117 | S113-Q115 PolarHBondContact O-N 3.47Å; Q115-R117 PolarHBondContact O-N 3.37Å |
| 116 | Q | 69.5 | Low | 68.9 | Low | 175 Ų | 175 | 140.2 Ų | 140.2 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | | | trans | -54.5 | 107.9 | 176.6 | -73.2 | -173.9 | -29.6 | 0 | 0 | 108.1 | D114 | D114-Q116 PolarHBondContact O-N 2.65Š|
| 117 | R | 74.8 | Confident | 70.6 | Confident | 229 Ų | 229 | 140 Ų | 140 | 86% | 0.864 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -100.5 | 123.8 | -179.9 | 62.5 | -177 | -130.7 | 179.9 | 3.7 | 108.4 | Q115 I119 | Q115-R117 PolarHBondContact O-N 3.37Å; R117-I119 PolarHBondContact O-N 3.38Å |
| 118 | T | 79.3 | Confident | 71.2 | Confident | 124 Ų | 124 | 142.1 Ų | 142.1 | 76% | 0.761 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 131.3 | 170.4 | -50.8 | 0 | 0 | 0 | 0 | 108.9 | R120 | T118-R120 PolarHBondContact O-N 3.11Å; T118-R120 VanDerWaalsContact O-N 3.14Å |
| 119 | I | 76.7 | Confident | 72 | Confident | 163 Ų | 163 | 150.5 Ų | 150.5 | 84% | 0.836 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 117 | 172.5 | -61 | 171.8 | 0 | 0 | 0 | 107.3 | R117 | R117-I119 PolarHBondContact O-N 3.38Š|
| 120 | R | 75.1 | Confident | 72.9 | Confident | 205 Ų | 205 | 155.5 Ų | 155.5 | 77% | 0.774 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -102.6 | 118.7 | 171.2 | -65.4 | -176.9 | -179.7 | -175.8 | -0.1 | 107.1 | T118 Q122 | T118-R120 PolarHBondContact O-N 3.11Å; T118-R120 VanDerWaalsContact O-N 3.14Å; R120-Q122 HydrophobicContact CB-CG 4.47Å; R120-Q122 PolarHBondContact O-N 3.4Å; R120-Q122 VanDerWaalsContact O-N 3.09Å |
| 121 | E | 77.8 | Confident | 74.2 | Confident | 151 Ų | 151 | 158.5 Ų | 158.5 | 71% | 0.706 | 78% | 0.78 | S | S | * | * | | | trans | -71.2 | 97.8 | 166.8 | -167.1 | 175.7 | 177.2 | 0 | 0 | 106.4 | W125 | E121-W125 PolarHBondContact OE1-NE1 3.35Š|
| 122 | Q | 76.7 | Confident | 75 | Confident | 169 Ų | 169 | 163.4 Ų | 163.4 | 79% | 0.79 | 78% | 0.778 | S | S | * | * | | | trans | -93.1 | -0.8 | -176.6 | -98.8 | -135.2 | 46.6 | 0 | 0 | 113.4 | R120 | R120-Q122 HydrophobicContact CB-CG 4.47Å; R120-Q122 PolarHBondContact O-N 3.4Å; R120-Q122 VanDerWaalsContact O-N 3.09Å |
| 123 | E | 78.4 | Confident | 75.8 | Confident | 166 Ų | 166 | 166.4 Ų | 166.4 | 78% | 0.776 | 78% | 0.775 | S | S | * | * | | | trans | -106.8 | 105 | -175.7 | -74.3 | 163.6 | -173.9 | 0 | 0 | 109.1 | W125 | E123-W125 PolarHBondContact O-N 3.09Š|
| 124 | D | 79.4 | Confident | 76.2 | Confident | 161 Ų | 161 | 166.3 Ų | 166.3 | 86% | 0.861 | 77% | 0.773 | S | S | * | * | | | trans | -59 | 123.1 | 163.6 | -71.1 | -37.9 | 0 | 0 | 0 | 107.6 | G126 | D124-G126 PolarHBondContact O-N 2.79Š|
| 125 | W | 76.1 | Confident | 76.5 | Confident | 183 Ų | 183 | 164.1 Ų | 164.1 | 69% | 0.693 | 77% | 0.771 | S | S | * | * | | | trans | -49.6 | 108.5 | 174.8 | -68.8 | 89.7 | 0 | 0 | 0 | 108.9 | E121 E123 Y128 | E121-W125 PolarHBondContact OE1-NE1 3.35Å; E123-W125 PolarHBondContact O-N 3.09Å; W125-Y128 VanDerWaalsContact CE3-OH 3.26Å; W125-Y128 HydrophobicContact CB-CE2 4.04Å |
| 126 | G | 82 | Confident | 76.3 | Confident | 51 Ų | 51 | 160.8 Ų | 160.8 | 53% | 0.526 | 76% | 0.761 | S | S | . | * | | | trans | -58 | 161 | -177.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | D124 Y128 | D124-G126 PolarHBondContact O-N 2.79Å; G126-Y128 PolarHBondContact O-N 3.13Å |
| 127 | P | 84.2 | Confident | 76.1 | Confident | 128 Ų | 128 | 155.8 Ų | 155.8 | 83% | 0.831 | 75% | 0.75 | S | S | * | * | | | trans | -51.7 | 112.2 | -177 | -25.9 | 33.3 | 0 | 0 | 0 | 111.9 | R129 | P127-R129 PolarHBondContact O-N 2.93Å; P127-R129 VanDerWaalsContact O-N 3.13Å |
| 128 | Y | 77.9 | Confident | 75.7 | Confident | 176 Ų | 176 | 151.2 Ų | 151.2 | 69% | 0.69 | 74% | 0.742 | S | S | * | * | | | trans | -59.8 | 116.9 | 178.1 | -83.6 | -88.2 | 0 | 0 | 0 | 109.8 | W125 G126 R130 | W125-Y128 VanDerWaalsContact CE3-OH 3.26Å; W125-Y128 HydrophobicContact CB-CE2 4.04Å; G126-Y128 PolarHBondContact O-N 3.13Å; Y128-R130 PolarHBondContact O-N 2.85Å |
| 129 | R | 77.4 | Confident | 75.2 | Confident | 240 Ų | 240 | 148.6 Ų | 148.6 | 91% | 0.906 | 73% | 0.733 | S | S | * | * | | | trans | -74 | 108.9 | 174.1 | -68.5 | -172.5 | 178.8 | -130.5 | 0.9 | 109 | P127 | P127-R129 PolarHBondContact O-N 2.93Å; P127-R129 VanDerWaalsContact O-N 3.13Å |
| 130 | R | 80.5 | Confident | 74.9 | Confident | 229 Ų | 229 | 150 Ų | 150 | 86% | 0.864 | 73% | 0.729 | S | S | * | * | | | trans | -79.2 | 126 | 174.1 | -62.8 | -178.3 | 66.1 | -168.1 | -0.1 | 110 | Y128 R132 | Y128-R130 PolarHBondContact O-N 2.85Å; R130-R132 PolarHBondContact O-N 3.22Å |
| 131 | H | 79.6 | Confident | 74.5 | Confident | 167 Ų | 167 | 144.4 Ų | 144.4 | 77% | 0.773 | 72% | 0.721 | S | S | * | * | | | trans | -68.8 | 113.6 | 166.8 | -66.3 | -84.9 | 0 | 0 | 0 | 108.6 | N133 | H131-N133 PolarHBondContact O-N 3.2Š|
| 132 | R | 83.4 | Confident | 74.1 | Confident | 237 Ų | 237 | 142 Ų | 142 | 89% | 0.894 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -71 | -18.7 | -177.8 | -91.6 | -148 | 176.1 | 136.5 | -0.8 | 114.2 | R130 | R130-R132 PolarHBondContact O-N 3.22Š|
| 133 | N | 70.4 | Confident | 73.8 | Confident | 140 Ų | 140 | 145.2 Ų | 145.2 | 75% | 0.749 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -135.8 | 96.8 | 175 | -61.1 | -37.6 | 0 | 0 | 0 | 107.8 | H131 S135 | H131-N133 PolarHBondContact O-N 3.2Å; N133-S135 PolarHBondContact O-N 3.23Å |
| 134 | P | 68.9 | Low | 73.2 | Confident | 81 Ų | 81 | 145.8 Ų | 145.8 | 53% | 0.526 | 73% | 0.733 | S | S | . | * | | | trans | -61.6 | 137.4 | 164.1 | 28.1 | -31.7 | 0 | 0 | 0 | 107.4 | T136 A137 | P134-T136 PolarHBondContact O-N 3.2Å; P134-A137 VanDerWaalsContact O-N 3.11Å; P134-A137 PolarHBondContact O-N 3.42Å |
| 135 | S | 67.4 | Low | 72.3 | Confident | 121 Ų | 121 | 148.2 Ų | 148.2 | 85% | 0.846 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.6 | -9 | -178.5 | -170 | 0 | 0 | 0 | 0 | 114.2 | N133 | N133-S135 PolarHBondContact O-N 3.23Š|
| 136 | T | 66.7 | Low | 70.8 | Confident | 81 Ų | 81 | 152.4 Ų | 152.4 | 50% | 0.497 | 76% | 0.764 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.2 | -17.2 | 178.1 | -18.9 | 0 | 0 | 0 | 0 | 114.6 | P134 D138 A139 Y140 | P134-T136 PolarHBondContact O-N 3.2Å; T136-D138 PolarHBondContact O-N 3.31Å; T136-A139 WeakPolarHBondContact O-CB 3.2Å; T136-A139 PolarHBondContact O-N 3.5Å; T136-Y140 HydrophobicContact CG2-CE2 4.26Å |
| 137 | A | 65.1 | Low | 70.3 | Confident | 70 Ų | 70 | 157.5 Ų | 157.5 | 58% | 0.579 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -64.3 | -38 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | P134 A139 | P134-A137 VanDerWaalsContact O-N 3.11Å; P134-A137 PolarHBondContact O-N 3.42Å; A137-A139 VanDerWaalsContact C-N 3.31Å; A137-A139 PolarHBondContact O-N 3.43Å |
| 138 | D | 66.8 | Low | 69.5 | Low | 133 Ų | 133 | 159.1 Ų | 159.1 | 71% | 0.711 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -75.5 | -15.8 | 177.4 | -93.7 | -17.5 | 0 | 0 | 0 | 113.7 | T136 Y140 S141 | T136-D138 PolarHBondContact O-N 3.31Å; D138-Y140 PolarHBondContact O-N 3.46Å; D138-S141 PolarHBondContact O-N 3.17Å; D138-S141 PolarHBondContact O-OG 3.47Å |
| 139 | A | 69.1 | Low | 69.1 | Low | 68 Ų | 68 | 158.1 Ų | 158.1 | 56% | 0.562 | 78% | 0.777 | S | S | * | * | G | 310 helix | trans | -68.3 | -16.6 | -178 | 0 | 0 | 0 | 0 | 0 | 113.3 | T136 A137 | T136-A139 WeakPolarHBondContact O-CB 3.2Å; T136-A139 PolarHBondContact O-N 3.5Å; A137-A139 VanDerWaalsContact C-N 3.31Å; A137-A139 PolarHBondContact O-N 3.43Å |
| 140 | Y | 69.3 | Low | 68.6 | Low | 194 Ų | 194 | 153.3 Ų | 153.3 | 76% | 0.761 | 77% | 0.77 | S | S | * | * | G | 310 helix | trans | -113.6 | 1.9 | -177 | -64 | -81.7 | 0 | 0 | 0 | 113.7 | T136 D138 S142 | T136-Y140 HydrophobicContact CG2-CE2 4.26Å; D138-Y140 PolarHBondContact O-N 3.46Å; Y140-S142 PolarHBondContact O-N 3.43Å |
| 141 | S | 68.4 | Low | 67.8 | Low | 86 Ų | 86 | 148.6 Ų | 148.6 | 60% | 0.601 | 76% | 0.764 | S | S | * | * | | | trans | -77.5 | -3.2 | -176 | 59.7 | 0 | 0 | 0 | 0 | 114.3 | D138 R143 | D138-S141 PolarHBondContact O-N 3.17Å; D138-S141 PolarHBondContact O-OG 3.47Å; S141-R143 PolarHBondContact O-N 3.28Å |
| 142 | S | 69.3 | Low | 67.1 | Low | 102 Ų | 102 | 147.3 Ų | 147.3 | 71% | 0.713 | 76% | 0.763 | S | S | * | * | | | trans | -93.2 | 70.3 | 179.5 | 68.3 | 0 | 0 | 0 | 0 | 113.7 | Y140 | Y140-S142 PolarHBondContact O-N 3.43Š|
| 143 | R | 69.3 | Low | 65.9 | Low | 236 Ų | 236 | 140.9 Ų | 140.9 | 89% | 0.891 | 75% | 0.754 | S | S | * | * | | | trans | -147.6 | 50.5 | 161.4 | -69.5 | -152.8 | -152.5 | -108.9 | 9.7 | 114 | S141 | S141-R143 PolarHBondContact O-N 3.28Š|
| 144 | L | 65.8 | Low | 65.6 | Low | 177 Ų | 177 | 141 Ų | 141 | 93% | 0.927 | 75% | 0.754 | S | S | * | * | | | trans | -134.7 | 75.7 | 163.9 | -92.8 | 150.4 | 0 | 0 | 0 | 108.7 | | |
| 145 | K | 60.1 | Low | 65.3 | Low | 212 Ų | 212 | 146 Ų | 146 | 92% | 0.922 | 77% | 0.773 | S | S | * | * | | | trans | -150.1 | 90 | 159.9 | -102.2 | -176.2 | 179 | -179.9 | 0 | 106.8 | | |
| 146 | E | 46 | Very low | 65.1 | Low | 272 Ų | 272 | 148.3 Ų | 148.3 | 100% | 1.271 | 77% | 0.767 | S | S | * | * | | | trans | -170.2 | 0 | 130.4 | -165.1 | 169.5 | 174.9 | 0 | 0 | 108.5 | | |