| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | V | 54.4 | Low | 50.5 | Low | 173 Ų | 173 | 142.8 Ų | 142.8 | 100% | 1.048 | 74% | 0.738 | S | S | * | * | 0 | -25.5 | 0 | -178.5 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 2 | Y | 46.5 | Very low | 50.5 | Low | 221 Ų | 221 | 141.7 Ų | 141.7 | 87% | 0.867 | 73% | 0.733 | S | S | * | * | trans | -80.2 | -15.3 | 174.2 | -87.2 | -87.5 | 0 | 0 | 0 | 116.2 | ||||
| 3 | E | 48.4 | Very low | 50.3 | Low | 182 Ų | 182 | 140.6 Ų | 140.6 | 85% | 0.85 | 73% | 0.728 | S | S | * | * | H | α-helix | trans | -87 | -17.5 | 175.1 | -101.6 | 178.5 | 147.8 | 0 | 0 | 114.9 | ||
| 4 | K | 50.6 | Low | 50.1 | Low | 188 Ų | 188 | 135.6 Ų | 135.6 | 82% | 0.817 | 72% | 0.717 | S | S | * | * | H | α-helix | trans | -88.4 | -8.2 | 178.3 | -84.9 | -169.7 | 174.7 | -176 | 0 | 114.3 | ||
| 5 | L | 50.9 | Low | 50 | Low | 124 Ų | 124 | 131.6 Ų | 131.6 | 65% | 0.649 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -91.6 | -25.8 | 176.4 | -145.2 | 75.1 | 0 | 0 | 0 | 112.7 | ||
| 6 | G | 52.3 | Low | 49.8 | Very low | 45 Ų | 45 | 129.6 Ų | 129.6 | 46% | 0.464 | 70% | 0.696 | S | S | . | * | H | α-helix | trans | -71.3 | -30.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | T10 | G6-T10 PolarHBondContact O-OG1 3.48Å |
| 7 | M | 48.4 | Very low | 49.5 | Very low | 152 Ų | 152 | 128 Ų | 128 | 75% | 0.749 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -76.1 | -24.1 | 178.6 | -106.6 | 177.3 | 67.5 | 0 | 0 | 113.9 | ||
| 8 | L | 47.2 | Very low | 49.4 | Very low | 125 Ų | 125 | 126.3 Ų | 126.3 | 65% | 0.654 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -81.9 | -31.6 | -176.4 | -149.1 | 86.7 | 0 | 0 | 0 | 112.9 | ||
| 9 | V | 50.4 | Low | 49.1 | Very low | 96 Ų | 96 | 127.5 Ų | 127.5 | 58% | 0.582 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -78.3 | -30.1 | -179.9 | -178.8 | 0 | 0 | 0 | 0 | 111.4 | M11 | V9-M11 PolarHBondContact O-N 3.46Å |
| 10 | T | 53.8 | Low | 48.7 | Very low | 110 Ų | 110 | 128.7 Ų | 128.7 | 68% | 0.675 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -76.1 | -21 | -179.7 | -34.2 | 0 | 0 | 0 | 0 | 113.1 | G6 | G6-T10 PolarHBondContact O-OG1 3.48Å |
| 11 | M | 52.4 | Low | 48.4 | Very low | 155 Ų | 155 | 130.5 Ų | 130.5 | 76% | 0.764 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | -9.6 | 177.3 | -76.5 | -143.2 | 88.6 | 0 | 0 | 115.3 | V9 | V9-M11 PolarHBondContact O-N 3.46Š|
| 12 | L | 50.8 | Low | 47.9 | Very low | 129 Ų | 129 | 129.5 Ų | 129.5 | 68% | 0.675 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | -17.2 | -176.3 | -95.5 | 154 | 0 | 0 | 0 | 114.8 | ||
| 13 | L | 48.3 | Very low | 47.5 | Very low | 128 Ų | 128 | 123 Ų | 123 | 67% | 0.67 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -98.3 | -17 | -178.1 | -95.1 | 136 | 0 | 0 | 0 | 114.5 | P15 | L13-P15 VanDerWaalsContact C-CD 3.5Š|
| 14 | A | 46.9 | Very low | 46.9 | Very low | 70 Ų | 70 | 117.4 Ų | 117.4 | 58% | 0.579 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.9 | -31 | 178.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||
| 15 | P | 48.3 | Very low | 46.2 | Very low | 76 Ų | 76 | 120.2 Ų | 120.2 | 49% | 0.494 | 69% | 0.69 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.7 | -13.6 | -174.8 | 23.8 | -15.1 | 0 | 0 | 0 | 114.8 | L13 | L13-P15 VanDerWaalsContact C-CD 3.5Š|
| 16 | V | 46.3 | Very low | 45.4 | Very low | 100 Ų | 100 | 118.5 Ų | 118.5 | 61% | 0.606 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -76.8 | -27.6 | -180 | -177.6 | 0 | 0 | 0 | 0 | 111.6 | V18 | V16-V18 VanDerWaalsContact C-N 3.33Å; V16-V18 PolarHBondContact O-N 3.05Å |
| 17 | C | 46 | Very low | 44.5 | Very low | 102 Ų | 102 | 126.8 Ų | 126.8 | 69% | 0.689 | 72% | 0.718 | S | S | * | * | H | α-helix | trans | -74.4 | -15.4 | 176.4 | -77.1 | 0 | 0 | 0 | 0 | 114.5 | ||
| 18 | V | 47.6 | Very low | 43.7 | Very low | 97 Ų | 97 | 124.5 Ų | 124.5 | 59% | 0.588 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -89.7 | -22.8 | 178.8 | -179.6 | 0 | 0 | 0 | 0 | 112.2 | V16 | V16-V18 VanDerWaalsContact C-N 3.33Å; V16-V18 PolarHBondContact O-N 3.05Å |
| 19 | L | 43.1 | Very low | 42.8 | Very low | 150 Ų | 150 | 122.3 Ų | 122.3 | 79% | 0.785 | 73% | 0.731 | S | S | * | * | H | α-helix | trans | -84 | -16.1 | -175.9 | -123.8 | 92.1 | 0 | 0 | 0 | 115.4 | ||
| 20 | L | 40.8 | Very low | 41.7 | Very low | 151 Ų | 151 | 121.1 Ų | 121.1 | 79% | 0.791 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | -6.2 | 179.6 | -85.1 | 163.1 | 0 | 0 | 0 | 114.3 | ||
| 21 | M | 43.6 | Very low | 40.5 | Very low | 167 Ų | 167 | 127 Ų | 127 | 82% | 0.823 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -103.2 | 6 | -176.9 | -70.2 | -66.2 | -120.6 | 0 | 0 | 114.9 | ||
| 22 | L | 43.4 | Very low | 39.8 | Very low | 152 Ų | 152 | 124.8 Ų | 124.8 | 80% | 0.796 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -129.4 | 10.6 | -177.4 | -82.3 | 162.1 | 0 | 0 | 0 | 115.4 | G24 | L22-G24 PolarHBondContact O-N 3.36Š|
| 23 | G | 37.8 | Very low | 39.3 | Very low | 83 Ų | 83 | 124.1 Ų | 124.1 | 86% | 0.856 | 75% | 0.75 | S | S | * | * | trans | -91.5 | 33.6 | -174.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 24 | G | 36.5 | Very low | 38.5 | Very low | 65 Ų | 65 | 125.9 Ų | 125.9 | 67% | 0.67 | 76% | 0.758 | S | S | * | * | trans | -133.2 | 86.9 | 179 | 0 | 0 | 0 | 0 | 0 | 112.9 | L22 | L22-G24 PolarHBondContact O-N 3.36Š| ||
| 25 | R | 34.7 | Very low | 38.2 | Very low | 247 Ų | 247 | 127.7 Ų | 127.7 | 93% | 0.932 | 76% | 0.764 | S | S | * | * | trans | 170.6 | 136.9 | 138 | -95.2 | 167.9 | -177.1 | -164.9 | 1.7 | 113.1 | ||||
| 26 | A | 34.4 | Very low | 37.3 | Very low | 89 Ų | 89 | 131.7 Ų | 131.7 | 74% | 0.736 | 78% | 0.776 | S | S | * | * | trans | 74.9 | 107.7 | 152.2 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 27 | F | 34.3 | Very low | 36.6 | Very low | 219 Ų | 219 | 133.5 Ų | 133.5 | 96% | 0.961 | 79% | 0.787 | S | S | * | * | -145.5 | 120.8 | 126.3 | -104.5 | -79.1 | 0 | 0 | 0 | 109.6 | |||||
| 28 | A | 31.1 | Very low | 35.8 | Very low | 103 Ų | 103 | 136.5 Ų | 136.5 | 85% | 0.851 | 79% | 0.788 | S | S | * | * | trans | -101.2 | 144.2 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 29 | G | 29.1 | Very low | 34.9 | Very low | 80 Ų | 80 | 143.1 Ų | 143.1 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | trans | -173.8 | 108.5 | 167.7 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 30 | G | 26.8 | Very low | 34.1 | Very low | 71 Ų | 71 | 143 Ų | 143 | 73% | 0.732 | 80% | 0.801 | S | S | * | * | trans | -71.2 | 177.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 31 | Y | 28.8 | Very low | 33.7 | Very low | 232 Ų | 232 | 142.4 Ų | 142.4 | 91% | 0.91 | 80% | 0.795 | S | S | * | * | cis | -164.4 | -174.7 | 24.7 | -94.1 | -94.7 | 0 | 0 | 0 | 106.3 | ||||
| 32 | P | 36.9 | Very low | 33.7 | Very low | 110 Ų | 110 | 139.4 Ų | 139.4 | 71% | 0.714 | 79% | 0.788 | S | S | * | * | cis | -125.8 | 176 | -36.1 | 36.9 | -20.5 | 0 | 0 | 0 | 112.7 | ||||
| 33 | P | 40 | Very low | 33 | Very low | 114 Ų | 114 | 139.6 Ų | 139.6 | 74% | 0.74 | 79% | 0.786 | S | S | * | * | trans | -116.6 | 159.9 | 169.4 | 37.9 | -26.3 | 0 | 0 | 0 | 113.8 | ||||
| 34 | I | 31.2 | Very low | 32.6 | Very low | 166 Ų | 166 | 144.7 Ų | 144.7 | 85% | 0.851 | 79% | 0.79 | S | S | * | * | trans | 162.3 | 152.3 | 155.5 | -85.2 | 155 | 0 | 0 | 0 | 108.7 | ||||
| 35 | P | 41.9 | Very low | 32.5 | Very low | 108 Ų | 108 | 151.9 Ų | 151.9 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | cis | -129.4 | 163.1 | -7.1 | 22.3 | 1 | 0 | 0 | 0 | 117.9 | ||||
| 36 | H | 29.8 | Very low | 32.2 | Very low | 159 Ų | 159 | 143.4 Ų | 143.4 | 74% | 0.736 | 79% | 0.792 | S | S | * | * | trans | 16.3 | 139.1 | 143.3 | -75.1 | -68.4 | 0 | 0 | 0 | 123.9 | ||||
| 37 | V | 30.1 | Very low | 32.4 | Very low | 138 Ų | 138 | 145.5 Ų | 145.5 | 84% | 0.836 | 80% | 0.799 | S | S | * | * | -149.6 | 134.9 | 109.1 | -174.2 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 38 | K | 29 | Very low | 33 | Very low | 165 Ų | 165 | 142.1 Ų | 142.1 | 72% | 0.717 | 80% | 0.795 | S | S | * | * | trans | -87.6 | 149.2 | 172.2 | -75.4 | 172.2 | 172.8 | 174.6 | 0 | 111.2 | ||||
| 39 | Y | 29.2 | Very low | 32.9 | Very low | 236 Ų | 236 | 140.3 Ų | 140.3 | 93% | 0.925 | 79% | 0.787 | S | S | * | * | trans | -138.2 | 125.4 | 143.6 | -109.6 | -87.8 | 0 | 0 | 0 | 110.7 | ||||
| 40 | M | 27.4 | Very low | 33.3 | Very low | 147 Ų | 147 | 142.7 Ų | 142.7 | 72% | 0.724 | 79% | 0.788 | S | S | * | * | trans | -112.6 | 137.8 | 170.4 | -118.4 | 169.7 | 88.5 | 0 | 0 | 105 | ||||
| 41 | Q | 32.2 | Very low | 34.2 | Very low | 140 Ų | 140 | 144.5 Ų | 144.5 | 65% | 0.654 | 79% | 0.787 | S | S | * | * | 145.5 | 178.3 | 85.8 | -116.1 | -167.1 | -4.8 | 0 | 0 | 107.6 | |||||
| 42 | P | 44.2 | Very low | 34.4 | Very low | 104 Ų | 104 | 142.2 Ų | 142.2 | 68% | 0.675 | 78% | 0.782 | S | S | * | * | cis | -140.5 | 158.6 | 6 | 24 | 2.6 | 0 | 0 | 0 | 119.6 | ||||
| 43 | M | 27.1 | Very low | 34.2 | Very low | 155 Ų | 155 | 148.8 Ų | 148.8 | 76% | 0.764 | 79% | 0.793 | S | S | * | * | trans | 55.3 | 130.2 | 133.7 | -63.5 | 177.7 | 60.2 | 0 | 0 | 124.8 | ||||
| 44 | M | 29.9 | Very low | 34.3 | Very low | 190 Ų | 190 | 151.9 Ų | 151.9 | 94% | 0.936 | 80% | 0.797 | S | S | * | * | -168.3 | 153.4 | 95.7 | -112.8 | 164.5 | 154 | 0 | 0 | 113.1 | |||||
| 45 | K | 34.4 | Very low | 34.4 | Very low | 216 Ų | 216 | 147.6 Ų | 147.6 | 94% | 0.939 | 79% | 0.794 | S | S | * | * | trans | -119.8 | 149.1 | -163.3 | -128.6 | -175.1 | -172.5 | -178.8 | 0 | 111.8 | ||||
| 46 | G | 28.8 | Very low | 34.3 | Very low | 69 Ų | 69 | 153 Ų | 153 | 71% | 0.711 | 81% | 0.806 | S | S | * | * | trans | 132.8 | 158.7 | 144.5 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 47 | P | 39 | Very low | 34.4 | Very low | 134 Ų | 134 | 148.6 Ų | 148.6 | 87% | 0.87 | 80% | 0.804 | S | S | * | * | cis | -124.3 | 178.8 | -16.5 | 35.8 | -16.9 | 0 | 0 | 0 | 114.1 | ||||
| 48 | V | 45.5 | Very low | 34.4 | Very low | 147 Ų | 147 | 151.7 Ų | 151.7 | 89% | 0.891 | 81% | 0.809 | S | S | * | * | trans | -87 | 149.3 | -163.6 | 171.9 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 49 | G | 29.9 | Very low | 35 | Very low | 65 Ų | 65 | 153.9 Ų | 153.9 | 67% | 0.67 | 82% | 0.815 | S | S | * | * | trans | -127 | 153.1 | 161.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 50 | P | 37 | Very low | 35 | Very low | 130 Ų | 130 | 149.1 Ų | 149.1 | 84% | 0.844 | 81% | 0.81 | S | S | * | * | trans | -87.8 | 169.6 | -143.6 | 34.9 | -36.7 | 0 | 0 | 0 | 116.5 | ||||
| 51 | P | 45.8 | Very low | 35.3 | Very low | 110 Ų | 110 | 149 Ų | 149 | 71% | 0.714 | 81% | 0.812 | S | S | * | * | trans | -106.7 | 155.8 | -160.5 | 33.4 | -20 | 0 | 0 | 0 | 116.2 | ||||
| 52 | F | 34.2 | Very low | 35.4 | Very low | 183 Ų | 183 | 150.7 Ų | 150.7 | 80% | 0.803 | 82% | 0.822 | S | S | * | * | trans | 47.6 | 130 | 147.7 | -83.8 | -92.9 | 0 | 0 | 0 | 122.4 | ||||
| 53 | R | 31.9 | Very low | 35.3 | Very low | 249 Ų | 249 | 151.4 Ų | 151.4 | 94% | 0.94 | 83% | 0.826 | S | S | * | * | -157.6 | 121.1 | 124.5 | -127.2 | -179.1 | -166 | -164.9 | 3.3 | 112.9 | |||||
| 54 | E | 41.8 | Very low | 36.1 | Very low | 179 Ų | 179 | 149.9 Ų | 149.9 | 84% | 0.836 | 83% | 0.828 | S | S | * | * | trans | -76.6 | 147.9 | 158.5 | -71.9 | 178.1 | 151.4 | 0 | 0 | 110 | ||||
| 55 | G | 32.8 | Very low | 36.4 | Very low | 76 Ų | 76 | 149.8 Ų | 149.8 | 78% | 0.784 | 83% | 0.828 | S | S | * | * | trans | -171.3 | 115.5 | 170.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 56 | K | 39.7 | Very low | 36.6 | Very low | 220 Ų | 220 | 148.3 Ų | 148.3 | 96% | 0.957 | 83% | 0.827 | S | S | * | * | trans | -75.9 | 145.8 | 169.5 | -63.8 | 180 | 177.1 | -179.9 | 0 | 110.4 | ||||
| 57 | G | 32.6 | Very low | 37.2 | Very low | 68 Ų | 68 | 154.9 Ų | 154.9 | 70% | 0.701 | 84% | 0.835 | S | S | * | * | trans | 161.3 | 102.3 | 163 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 58 | H | 30.5 | Very low | 37.2 | Very low | 203 Ų | 203 | 151.9 Ų | 151.9 | 94% | 0.94 | 83% | 0.829 | S | S | * | * | trans | 52.9 | 139.4 | 134.4 | -72.1 | 59.7 | 0 | 0 | 0 | 123.9 | ||||
| 59 | Y | 40.9 | Very low | 36.9 | Very low | 211 Ų | 211 | 153.7 Ų | 153.7 | 83% | 0.827 | 83% | 0.828 | S | S | * | * | trans | -55.2 | 141.3 | -176.6 | -149.9 | -94.7 | 0 | 0 | 0 | 117.6 | ||||
| 60 | V | 30.1 | Very low | 37.5 | Very low | 136 Ų | 136 | 156.8 Ų | 156.8 | 82% | 0.824 | 84% | 0.836 | S | S | * | * | trans | -161.3 | 138.4 | 136.9 | -149.6 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 61 | D | 32.7 | Very low | 38 | Very low | 145 Ų | 145 | 153.8 Ų | 153.8 | 78% | 0.775 | 83% | 0.829 | S | S | * | * | trans | 4 | 146.4 | 163.8 | -78.7 | -46.2 | 0 | 0 | 0 | 125.6 | ||||
| 62 | M | 34.7 | Very low | 37.7 | Very low | 175 Ų | 175 | 154.8 Ų | 154.8 | 86% | 0.862 | 84% | 0.835 | S | S | * | * | trans | -69.8 | 157 | 169.3 | -76.2 | -169.2 | -173.4 | 0 | 0 | 114.5 | ||||
| 63 | P | 41.3 | Very low | 38.5 | Very low | 118 Ų | 118 | 155.2 Ų | 155.2 | 77% | 0.766 | 84% | 0.84 | S | S | * | * | -131.6 | 170.4 | 103.5 | 10.7 | 11.9 | 0 | 0 | 0 | 114.1 | |||||
| 64 | P | 44.9 | Very low | 39 | Very low | 124 Ų | 124 | 146.5 Ų | 146.5 | 81% | 0.805 | 83% | 0.827 | S | S | * | * | trans | -82.6 | 139.1 | -159.9 | 32.5 | -34 | 0 | 0 | 0 | 114.4 | ||||
| 65 | M | 36.2 | Very low | 38.8 | Very low | 188 Ų | 188 | 147.6 Ų | 147.6 | 93% | 0.926 | 83% | 0.829 | S | S | * | * | trans | -91.5 | 123.2 | 167.7 | -83.7 | -177.2 | 76.3 | 0 | 0 | 111.9 | ||||
| 66 | M | 38.6 | Very low | 39.6 | Very low | 185 Ų | 185 | 150.2 Ų | 150.2 | 91% | 0.911 | 83% | 0.832 | S | S | * | * | trans | 12.1 | 125.2 | 153.1 | -82.3 | 173 | 149.2 | 0 | 0 | 121 | ||||
| 67 | K | 40.4 | Very low | 39.8 | Very low | 206 Ų | 206 | 142.7 Ų | 142.7 | 90% | 0.896 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 127.2 | 161 | -169.9 | 179.7 | -172.5 | -178.6 | 0 | 110.9 | ||
| 68 | G | 39.5 | Very low | 40.1 | Very low | 71 Ų | 71 | 145.7 Ų | 145.7 | 73% | 0.732 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 143.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 69 | E | 40.3 | Very low | 41 | Very low | 186 Ų | 186 | 147.8 Ų | 147.8 | 87% | 0.869 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 155 | -172.9 | -65 | -178.5 | 135.7 | 0 | 0 | 114.4 | ||
| 70 | P | 42.6 | Very low | 41.2 | Very low | 129 Ų | 129 | 140.1 Ų | 140.1 | 84% | 0.838 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 143.5 | 171 | -19.9 | 31.9 | 0 | 0 | 0 | 113.4 | ||
| 71 | G | 46 | Very low | 41.8 | Very low | 68 Ų | 68 | 140 Ų | 140 | 70% | 0.701 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -67 | 153.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 72 | P | 39.4 | Very low | 42.5 | Very low | 131 Ų | 131 | 138 Ų | 138 | 85% | 0.851 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 147.7 | -167.1 | 28.2 | -34.6 | 0 | 0 | 0 | 114.1 | ||
| 73 | Q | 51 | Low | 42.8 | Very low | 192 Ų | 192 | 132.6 Ų | 132.6 | 90% | 0.897 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 135.7 | 176.6 | -173.1 | 176.4 | 4.9 | 0 | 0 | 112.2 | ||
| 74 | G | 43.3 | Very low | 42.9 | Very low | 65 Ų | 65 | 132.8 Ų | 132.8 | 67% | 0.67 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 144.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 75 | K | 37.2 | Very low | 43.1 | Very low | 203 Ų | 203 | 132.9 Ų | 132.9 | 88% | 0.883 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 142 | -174.3 | -64.9 | -179.4 | -178.4 | 177.4 | 0 | 111.6 | ||
| 76 | P | 50.5 | Low | 43.4 | Very low | 130 Ų | 130 | 127.4 Ų | 127.4 | 84% | 0.844 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 140.4 | 173 | -22.3 | 32.5 | 0 | 0 | 0 | 111.8 | ||
| 77 | G | 44 | Very low | 43.5 | Very low | 63 Ų | 63 | 126.6 Ų | 126.6 | 65% | 0.649 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 156.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 78 | P | 38.7 | Very low | 43.8 | Very low | 130 Ų | 130 | 122.5 Ų | 122.5 | 84% | 0.844 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -62 | 141.2 | -176.5 | 25.3 | -32.7 | 0 | 0 | 0 | 111.5 | G80 | P78-G80 PolarHBondContact O-N 3.42Š|
| 79 | R | 49.3 | Very low | 44.2 | Very low | 247 Ų | 247 | 122.6 Ų | 122.6 | 93% | 0.932 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -65 | 130.5 | 176.7 | -174.6 | 177.6 | 177.8 | -177.2 | -0.7 | 109.6 | ||
| 80 | G | 44.4 | Very low | 44.2 | Very low | 51 Ų | 51 | 123.3 Ų | 123.3 | 53% | 0.526 | 79% | 0.792 | S | S | . | * | P | Polyproline II helix | trans | -58.3 | 156.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | P78 | P78-G80 PolarHBondContact O-N 3.42Š|
| 81 | P | 41.9 | Very low | 44.5 | Very low | 132 Ų | 132 | 123 Ų | 123 | 86% | 0.857 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 148.6 | -177 | 24.4 | -32.7 | 0 | 0 | 0 | 111.8 | G83 | P81-G83 PolarHBondContact O-N 3.27Š|
| 82 | A | 47.9 | Very low | 44.4 | Very low | 103 Ų | 103 | 123.5 Ų | 123.5 | 85% | 0.851 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 135 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 83 | G | 42 | Very low | 44.8 | Very low | 62 Ų | 62 | 124.9 Ų | 124.9 | 64% | 0.639 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 153.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | P81 | P81-G83 PolarHBondContact O-N 3.27Š|
| 84 | P | 41.9 | Very low | 44.5 | Very low | 123 Ų | 123 | 119.1 Ų | 119.1 | 80% | 0.799 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 149 | 179.6 | 24.7 | -32.1 | 0 | 0 | 0 | 111.3 | ||
| 85 | P | 50.2 | Low | 44.5 | Very low | 126 Ų | 126 | 124.7 Ų | 124.7 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -57 | 139 | 176 | -21.6 | 31.9 | 0 | 0 | 0 | 111.7 | ||
| 86 | G | 42.4 | Very low | 45.3 | Very low | 73 Ų | 73 | 120.7 Ų | 120.7 | 75% | 0.753 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 144 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 87 | L | 39.6 | Very low | 45.2 | Very low | 167 Ų | 167 | 118 Ų | 118 | 87% | 0.874 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 138.6 | 178.8 | -69.3 | 170.2 | 0 | 0 | 0 | 110.7 | G89 | L87-G89 PolarHBondContact O-N 3.3Š|
| 88 | P | 48.3 | Very low | 45.1 | Very low | 120 Ų | 120 | 123.3 Ų | 123.3 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 130.2 | 173.9 | -23.2 | 32.4 | 0 | 0 | 0 | 110.8 | K90 | P88-K90 PolarHBondContact O-N 3.24Š|
| 89 | G | 47.2 | Very low | 45.8 | Very low | 73 Ų | 73 | 124.7 Ų | 124.7 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 134.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | L87 | L87-G89 PolarHBondContact O-N 3.3Š|
| 90 | K | 41.3 | Very low | 45.8 | Very low | 201 Ų | 201 | 116.3 Ų | 116.3 | 87% | 0.874 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 135.8 | 178.1 | -65.9 | -175.9 | 179.2 | -177.2 | 0 | 109.5 | P88 G92 | P88-K90 PolarHBondContact O-N 3.24Å; K90-G92 PolarHBondContact O-N 3.25Å |
| 91 | P | 48 | Very low | 45.8 | Very low | 124 Ų | 124 | 122.7 Ų | 122.7 | 81% | 0.805 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 125.3 | 172.9 | -22.2 | 31.5 | 0 | 0 | 0 | 109.8 | L93 | P91-L93 PolarHBondContact O-N 3.37Å; P91-L93 VanDerWaalsContact O-N 3.14Å |
| 92 | G | 43.3 | Very low | 46.6 | Very low | 77 Ų | 77 | 122.3 Ų | 122.3 | 79% | 0.794 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 116 | 173.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | K90 G94 | K90-G92 PolarHBondContact O-N 3.25Å; G92-G94 PolarHBondContact O-N 3.13Å |
| 93 | L | 48.5 | Very low | 46.8 | Very low | 161 Ų | 161 | 120.4 Ų | 120.4 | 84% | 0.843 | 79% | 0.79 | S | S | * | * | trans | -74.8 | 82.8 | 171.5 | -167 | 76.4 | 0 | 0 | 0 | 108.2 | P91 K95 | P91-L93 PolarHBondContact O-N 3.37Å; P91-L93 VanDerWaalsContact O-N 3.14Å; L93-K95 PolarHBondContact O-N 3.47Å; L93-K95 VanDerWaalsContact O-N 3.08Å | ||
| 94 | G | 43.9 | Very low | 47.3 | Very low | 70 Ų | 70 | 123.8 Ų | 123.8 | 72% | 0.722 | 80% | 0.8 | S | S | * | * | trans | -65.2 | 104.5 | 166.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | G92 | G92-G94 PolarHBondContact O-N 3.13Š| ||
| 95 | K | 44.5 | Very low | 48.2 | Very low | 182 Ų | 182 | 127.2 Ų | 127.2 | 79% | 0.791 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 132.2 | 169.6 | -63.2 | -176.9 | -179.2 | -176.2 | 0 | 107.7 | L93 G97 | L93-K95 PolarHBondContact O-N 3.47Å; L93-K95 VanDerWaalsContact O-N 3.08Å; K95-G97 PolarHBondContact O-N 3.35Å |
| 96 | P | 54.1 | Low | 48.3 | Very low | 120 Ų | 120 | 124 Ų | 124 | 78% | 0.779 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 135.1 | 167.8 | -23.3 | 32.5 | 0 | 0 | 0 | 109.4 | L98 | P96-L98 PolarHBondContact O-N 3.4Š|
| 97 | G | 47.1 | Very low | 48.9 | Very low | 72 Ų | 72 | 126.5 Ų | 126.5 | 74% | 0.742 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 133.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | K95 N99 | K95-G97 PolarHBondContact O-N 3.35Å; G97-N99 PolarHBondContact O-N 3.25Å |
| 98 | L | 42.6 | Very low | 49.8 | Very low | 175 Ų | 175 | 124.7 Ų | 124.7 | 92% | 0.916 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 127.9 | 173.7 | -74.6 | 160 | 0 | 0 | 0 | 108.7 | P96 G100 | P96-L98 PolarHBondContact O-N 3.4Å; L98-G100 PolarHBondContact O-N 3.32Å |
| 99 | N | 53.6 | Low | 49.8 | Very low | 160 Ų | 160 | 122.6 Ų | 122.6 | 86% | 0.856 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 129.5 | 168.6 | -97.4 | 9.8 | 0 | 0 | 0 | 108.5 | G97 Q101 | G97-N99 PolarHBondContact O-N 3.25Å; N99-Q101 PolarHBondContact O-N 3.37Å |
| 100 | G | 49 | Very low | 49.8 | Very low | 71 Ų | 71 | 129 Ų | 129 | 73% | 0.732 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 129.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | L98 | L98-G100 PolarHBondContact O-N 3.32Š|
| 101 | Q | 43.8 | Very low | 50 | Low | 184 Ų | 184 | 126.3 Ų | 126.3 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 134 | 175.6 | -69.6 | -166.3 | -22.4 | 0 | 0 | 109.2 | N99 G103 | N99-Q101 PolarHBondContact O-N 3.37Å; Q101-G103 PolarHBondContact O-N 3.18Å |
| 102 | P | 60.3 | Low | 49.9 | Very low | 125 Ų | 125 | 124 Ų | 124 | 81% | 0.812 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 130.3 | 169.6 | -23.6 | 32.9 | 0 | 0 | 0 | 109.5 | ||
| 103 | G | 51.9 | Low | 50.3 | Low | 63 Ų | 63 | 129.2 Ų | 129.2 | 65% | 0.649 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 145.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q101 Q105 | Q101-G103 PolarHBondContact O-N 3.18Å; G103-Q105 PolarHBondContact O-N 3.49Å |
| 104 | P | 52.3 | Low | 50.1 | Low | 132 Ų | 132 | 124.6 Ų | 124.6 | 86% | 0.857 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 135.7 | -179.3 | 22.5 | -31.7 | 0 | 0 | 0 | 110.6 | G106 | P104-G106 PolarHBondContact O-N 3.28Š|
| 105 | Q | 59.6 | Low | 50.2 | Low | 195 Ų | 195 | 131 Ų | 131 | 91% | 0.911 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 125.6 | 178.8 | -165.7 | 172.9 | 25.6 | 0 | 0 | 109.5 | G103 | G103-Q105 PolarHBondContact O-N 3.49Š|
| 106 | G | 52.5 | Low | 50.7 | Low | 59 Ų | 59 | 128.8 Ų | 128.8 | 61% | 0.608 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 147.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | P104 | P104-G106 PolarHBondContact O-N 3.28Š|
| 107 | P | 56 | Low | 50.4 | Low | 125 Ų | 125 | 126.6 Ų | 126.6 | 81% | 0.812 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 143.5 | -176.7 | 23 | -31.3 | 0 | 0 | 0 | 111.6 | G109 | P107-G109 PolarHBondContact O-N 3.41Š|
| 108 | P | 58.5 | Low | 50.6 | Low | 129 Ų | 129 | 131.2 Ų | 131.2 | 84% | 0.838 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -60 | 123.9 | -178 | -20.7 | 31.2 | 0 | 0 | 0 | 111.9 | ||
| 109 | G | 47.6 | Very low | 51.4 | Low | 77 Ų | 77 | 128.7 Ų | 128.7 | 79% | 0.794 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 134.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.5 | P107 | P107-G109 PolarHBondContact O-N 3.41Š|
| 110 | F | 46.6 | Very low | 51.2 | Low | 208 Ų | 208 | 124.6 Ų | 124.6 | 91% | 0.912 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 145.8 | 175.8 | -91.5 | -99.1 | 0 | 0 | 0 | 112.9 | G112 | F110-G112 PolarHBondContact O-N 3.35Š|
| 111 | T | 46.1 | Very low | 51.4 | Low | 144 Ų | 144 | 129.1 Ų | 129.1 | 88% | 0.883 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -61 | 120.3 | 178.6 | 48.5 | 0 | 0 | 0 | 0 | 112.4 | ||
| 112 | G | 46.1 | Very low | 52.1 | Low | 75 Ų | 75 | 126.1 Ų | 126.1 | 77% | 0.773 | 81% | 0.814 | S | S | * | * | trans | -161.6 | 120.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | F110 | F110-G112 PolarHBondContact O-N 3.35Š| ||
| 113 | I | 51.3 | Low | 51.7 | Low | 186 Ų | 186 | 123.6 Ų | 123.6 | 95% | 0.954 | 81% | 0.812 | S | S | * | * | trans | -61.5 | 127.2 | -178.6 | -66.7 | 158.6 | 0 | 0 | 0 | 110.9 | ||||
| 114 | G | 44.6 | Very low | 51.7 | Low | 65 Ų | 65 | 130.4 Ų | 130.4 | 67% | 0.67 | 82% | 0.823 | S | S | * | * | trans | 162.6 | 97.4 | 164.1 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 115 | K | 46.6 | Very low | 51.9 | Low | 203 Ų | 203 | 132 Ų | 132 | 88% | 0.883 | 82% | 0.823 | S | S | * | * | trans | 64.5 | 131.6 | 154.3 | -59.3 | -174.8 | -178.9 | -179.3 | 0 | 119.8 | G117 | K115-G117 PolarHBondContact O-N 3.36Š| ||
| 116 | P | 54.3 | Low | 51.5 | Low | 136 Ų | 136 | 125.2 Ų | 125.2 | 88% | 0.883 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 131.5 | 177.6 | -18.2 | 30.3 | 0 | 0 | 0 | 113 | ||
| 117 | G | 49.1 | Very low | 51.6 | Low | 75 Ų | 75 | 128.4 Ų | 128.4 | 77% | 0.773 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 149.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | K115 | K115-G117 PolarHBondContact O-N 3.36Š|
| 118 | L | 50.8 | Low | 51.5 | Low | 168 Ų | 168 | 130.1 Ų | 130.1 | 88% | 0.88 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 141.5 | 173 | -77.9 | 147.5 | 0 | 0 | 0 | 111.4 | G120 | L118-G120 PolarHBondContact O-N 3.14Š|
| 119 | P | 59.3 | Low | 50.9 | Low | 122 Ų | 122 | 127.5 Ų | 127.5 | 79% | 0.792 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 130.2 | 174.5 | -22.9 | 32.5 | 0 | 0 | 0 | 111.6 | ||
| 120 | G | 50 | Low | 50.8 | Low | 74 Ų | 74 | 132.3 Ų | 132.3 | 76% | 0.763 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 135.7 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L118 | L118-G120 PolarHBondContact O-N 3.14Š|
| 121 | L | 51.5 | Low | 51.2 | Low | 166 Ų | 166 | 128.4 Ų | 128.4 | 87% | 0.869 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 139.5 | 175.4 | -73.2 | 161.9 | 0 | 0 | 0 | 110.8 | G123 | L121-G123 PolarHBondContact O-N 3.44Š|
| 122 | P | 59 | Low | 51.2 | Low | 121 Ų | 121 | 124.7 Ų | 124.7 | 79% | 0.786 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 133.5 | 177 | -25.8 | 33.3 | 0 | 0 | 0 | 111.9 | K124 | P122-K124 PolarHBondContact O-N 3.44Š|
| 123 | G | 52.7 | Low | 51.3 | Low | 73 Ų | 73 | 128.2 Ų | 128.2 | 75% | 0.753 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 132 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L121 I125 | L121-G123 PolarHBondContact O-N 3.44Å; G123-I125 PolarHBondContact O-N 3.02Å |
| 124 | K | 51.3 | Low | 51.3 | Low | 205 Ų | 205 | 126.9 Ų | 126.9 | 89% | 0.891 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -55 | 126.9 | 176.4 | -63.2 | -176.6 | 179.9 | -175.5 | 0 | 109.1 | P122 G126 | P122-K124 PolarHBondContact O-N 3.44Å; K124-G126 PolarHBondContact O-N 3.44Å |
| 125 | I | 56.9 | Low | 51.4 | Low | 165 Ų | 165 | 127 Ų | 127 | 85% | 0.846 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 124.3 | 172.8 | -66.6 | 170 | 0 | 0 | 0 | 107.8 | G123 | G123-I125 PolarHBondContact O-N 3.02Š|
| 126 | G | 50.1 | Low | 51.4 | Low | 53 Ų | 53 | 126.5 Ų | 126.5 | 55% | 0.546 | 81% | 0.808 | S | S | . | * | P | Polyproline II helix | trans | -58.2 | 143.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | K124 N128 | K124-G126 PolarHBondContact O-N 3.44Å; G126-N128 PolarHBondContact O-N 3.44Å |
| 127 | P | 54.7 | Low | 51.4 | Low | 127 Ų | 127 | 126.9 Ų | 126.9 | 83% | 0.825 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 140.7 | 177.9 | 24.3 | -32.4 | 0 | 0 | 0 | 110.2 | G129 | P127-G129 PolarHBondContact O-N 3.44Š|
| 128 | N | 54.3 | Low | 51.3 | Low | 161 Ų | 161 | 125.8 Ų | 125.8 | 86% | 0.861 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -48.9 | 130.5 | 173.8 | -91.5 | -2.7 | 0 | 0 | 0 | 109.9 | G126 M130 | G126-N128 PolarHBondContact O-N 3.44Å; N128-M130 PolarHBondContact O-N 3.21Å |
| 129 | G | 45.3 | Very low | 51 | Low | 74 Ų | 74 | 124 Ų | 124 | 76% | 0.763 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 133.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | P127 | P127-G129 PolarHBondContact O-N 3.44Š|
| 130 | M | 46.2 | Very low | 50.8 | Low | 178 Ų | 178 | 128.6 Ų | 128.6 | 88% | 0.877 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 138.2 | 178.5 | -67.3 | 179.6 | 71.3 | 0 | 0 | 109.8 | N128 G132 | N128-M130 PolarHBondContact O-N 3.21Å; M130-G132 PolarHBondContact O-N 3.31Å |
| 131 | P | 55.8 | Low | 50.5 | Low | 125 Ų | 125 | 128 Ų | 128 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 131.7 | 173.1 | -23.6 | 32.3 | 0 | 0 | 0 | 109.9 | V133 | P131-V133 PolarHBondContact O-N 3.28Š|
| 132 | G | 46.5 | Very low | 50.1 | Low | 67 Ų | 67 | 128.9 Ų | 128.9 | 69% | 0.691 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 134.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | M130 N134 | M130-G132 PolarHBondContact O-N 3.31Å; G132-N134 PolarHBondContact O-N 3.44Å; G132-N134 VanDerWaalsContact O-N 3.15Å |
| 133 | V | 48.1 | Very low | 49.9 | Very low | 148 Ų | 148 | 128.6 Ų | 128.6 | 90% | 0.897 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 121.8 | 178.2 | -126.3 | 0 | 0 | 0 | 0 | 108.6 | P131 G135 | P131-V133 PolarHBondContact O-N 3.28Å; V133-G135 PolarHBondContact O-N 2.91Å |
| 134 | N | 50.6 | Low | 49.5 | Very low | 158 Ų | 158 | 128.1 Ų | 128.1 | 85% | 0.845 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 126.4 | 171.8 | -82.5 | -16.6 | 0 | 0 | 0 | 107.9 | G132 E136 | G132-N134 PolarHBondContact O-N 3.44Å; G132-N134 VanDerWaalsContact O-N 3.15Å; N134-E136 PolarHBondContact O-N 2.97Å |
| 135 | G | 47.3 | Very low | 49 | Very low | 69 Ų | 69 | 124.6 Ų | 124.6 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -51 | 134 | -179.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | V133 V137 | V133-G135 PolarHBondContact O-N 2.91Å; G135-V137 PolarHBondContact O-N 3.46Å |
| 136 | E | 46.2 | Very low | 48.8 | Very low | 192 Ų | 192 | 127.4 Ų | 127.4 | 90% | 0.897 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 127.1 | -180 | -67.3 | -175.7 | 161.7 | 0 | 0 | 109.5 | N134 G138 | N134-E136 PolarHBondContact O-N 2.97Å; E136-G138 PolarHBondContact O-N 3.41Å |
| 137 | V | 54.2 | Low | 48.5 | Very low | 143 Ų | 143 | 127.9 Ų | 127.9 | 87% | 0.867 | 79% | 0.786 | S | S | * | * | trans | -57.5 | 115.9 | 172.4 | 177.3 | 0 | 0 | 0 | 0 | 106.3 | G135 | G135-V137 PolarHBondContact O-N 3.46Š| ||
| 138 | G | 46 | Very low | 47.8 | Very low | 53 Ų | 53 | 129.8 Ų | 129.8 | 55% | 0.546 | 79% | 0.789 | S | S | . | * | P | Polyproline II helix | trans | -50.4 | 144.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111 | E136 R140 | E136-G138 PolarHBondContact O-N 3.41Å; G138-R140 PolarHBondContact O-N 3.43Å |
| 139 | P | 46 | Very low | 48 | Very low | 131 Ų | 131 | 127.3 Ų | 127.3 | 85% | 0.851 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 131 | -173.1 | 21.3 | -32.2 | 0 | 0 | 0 | 109.9 | G141 | P139-G141 PolarHBondContact O-N 3.28Å; P139-G141 VanDerWaalsContact O-N 3.09Å |
| 140 | R | 54.2 | Low | 48 | Very low | 217 Ų | 217 | 126.7 Ų | 126.7 | 82% | 0.819 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 119 | 175.2 | -179.3 | 179.4 | 179.5 | 179.7 | -1.3 | 107.5 | G138 E142 | G138-R140 PolarHBondContact O-N 3.43Å; R140-E142 PolarHBondContact O-N 3.15Å |
| 141 | G | 44.7 | Very low | 47.9 | Very low | 63 Ų | 63 | 123.9 Ų | 123.9 | 65% | 0.649 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 129.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | P139 | P139-G141 PolarHBondContact O-N 3.28Å; P139-G141 VanDerWaalsContact O-N 3.09Å |
| 142 | E | 42.5 | Very low | 47.9 | Very low | 183 Ų | 183 | 124 Ų | 124 | 86% | 0.855 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 132 | -177.4 | -67.5 | -167.8 | 154.1 | 0 | 0 | 109.5 | R140 G144 | R140-E142 PolarHBondContact O-N 3.15Å; E142-G144 PolarHBondContact O-N 3.26Å; E142-G144 VanDerWaalsContact O-N 3.13Å |
| 143 | P | 54.3 | Low | 47.8 | Very low | 115 Ų | 115 | 124.1 Ų | 124.1 | 75% | 0.747 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 124.2 | 170.3 | -22.1 | 32.4 | 0 | 0 | 0 | 108.4 | ||
| 144 | G | 44 | Very low | 47.5 | Very low | 63 Ų | 63 | 123.6 Ų | 123.6 | 65% | 0.649 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -51 | 145.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | E142 R146 | E142-G144 PolarHBondContact O-N 3.26Å; E142-G144 VanDerWaalsContact O-N 3.13Å; G144-R146 PolarHBondContact O-N 3.11Å |
| 145 | P | 40.5 | Very low | 47.9 | Very low | 132 Ų | 132 | 121.8 Ų | 121.8 | 86% | 0.857 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 128.1 | -173 | 20.7 | -31.6 | 0 | 0 | 0 | 109.8 | G147 | P145-G147 PolarHBondContact O-N 3.43Å; P145-G147 VanDerWaalsContact O-N 3.15Å |
| 146 | R | 52.6 | Low | 47.9 | Very low | 223 Ų | 223 | 121.5 Ų | 121.5 | 84% | 0.842 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 121.9 | 174.8 | -175.2 | 176 | 177 | -175.2 | -3.4 | 107 | G144 L148 | G144-R146 PolarHBondContact O-N 3.11Å; R146-L148 PolarHBondContact O-N 3.36Å |
| 147 | G | 44.4 | Very low | 47.8 | Very low | 63 Ų | 63 | 118.6 Ų | 118.6 | 65% | 0.649 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -49.1 | 136.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110 | P145 | P145-G147 PolarHBondContact O-N 3.43Å; P145-G147 VanDerWaalsContact O-N 3.15Å |
| 148 | L | 40.9 | Very low | 47.3 | Very low | 167 Ų | 167 | 117.2 Ų | 117.2 | 87% | 0.874 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -48.5 | 129.8 | -178.2 | -70 | 169.8 | 0 | 0 | 0 | 109.1 | R146 G150 | R146-L148 PolarHBondContact O-N 3.36Å; L148-G150 PolarHBondContact O-N 3.4Å |
| 149 | P | 58 | Low | 47.2 | Very low | 109 Ų | 109 | 117.9 Ų | 117.9 | 71% | 0.708 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -52 | 133 | 172.3 | -22.7 | 32.2 | 0 | 0 | 0 | 108.9 | ||
| 150 | G | 44.9 | Very low | 47 | Very low | 61 Ų | 61 | 120.5 Ų | 120.5 | 63% | 0.629 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 143.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | L148 | L148-G150 PolarHBondContact O-N 3.4Š|
| 151 | P | 44.2 | Very low | 46.6 | Very low | 120 Ų | 120 | 115.6 Ų | 115.6 | 78% | 0.779 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 141.4 | -179.6 | 21.5 | -31.6 | 0 | 0 | 0 | 110 | G153 | P151-G153 PolarHBondContact O-N 3.25Š|
| 152 | P | 56.5 | Low | 46.4 | Very low | 126 Ų | 126 | 120.9 Ų | 120.9 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 134.9 | 175.4 | -23.1 | 31.9 | 0 | 0 | 0 | 110.1 | V154 | P152-V154 PolarHBondContact O-N 3.3Š|
| 153 | G | 44.5 | Very low | 46.8 | Very low | 70 Ų | 70 | 120.6 Ų | 120.6 | 72% | 0.722 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 136.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | P151 | P151-G153 PolarHBondContact O-N 3.25Š|
| 154 | V | 41.5 | Very low | 46.5 | Very low | 138 Ų | 138 | 118.5 Ų | 118.5 | 84% | 0.836 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 129 | 177.3 | -129.7 | 0 | 0 | 0 | 0 | 108.8 | P152 G156 | P152-V154 PolarHBondContact O-N 3.3Å; V154-G156 PolarHBondContact O-N 3.39Å |
| 155 | P | 58.7 | Low | 46.7 | Very low | 120 Ų | 120 | 125.3 Ų | 125.3 | 78% | 0.779 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 128.6 | 176.3 | -26.2 | 34 | 0 | 0 | 0 | 110.3 | ||
| 156 | G | 48.3 | Very low | 47 | Very low | 63 Ų | 63 | 125.1 Ų | 125.1 | 65% | 0.649 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 148.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | V154 A158 | V154-G156 PolarHBondContact O-N 3.39Å; G156-A158 PolarHBondContact O-N 3.49Å |
| 157 | P | 43.7 | Very low | 47.1 | Very low | 131 Ų | 131 | 118 Ų | 118 | 85% | 0.851 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 138.9 | 178 | 24.1 | -31.9 | 0 | 0 | 0 | 109.9 | G159 | P157-G159 PolarHBondContact O-N 3.46Š|
| 158 | A | 42.6 | Very low | 47.1 | Very low | 114 Ų | 114 | 122.9 Ų | 122.9 | 94% | 0.942 | 81% | 0.809 | S | S | * | * | trans | -57.6 | 108.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | G156 | G156-A158 PolarHBondContact O-N 3.49Š| ||
| 159 | G | 43.7 | Very low | 47.7 | Very low | 67 Ų | 67 | 120.7 Ų | 120.7 | 69% | 0.691 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -98.1 | 133.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | P157 S161 | P157-G159 PolarHBondContact O-N 3.46Å; G159-S161 PolarHBondContact O-N 3.45Å |
| 160 | L | 42.4 | Very low | 47.5 | Very low | 185 Ų | 185 | 119.1 Ų | 119.1 | 97% | 0.969 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -46.4 | 131.9 | 169.6 | -79 | 150.7 | 0 | 0 | 0 | 111.4 | ||
| 161 | S | 45.5 | Very low | 47.4 | Very low | 114 Ų | 114 | 124.5 Ų | 124.5 | 80% | 0.797 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 126.4 | -167.9 | -51 | 0 | 0 | 0 | 0 | 114 | G159 | G159-S161 PolarHBondContact O-N 3.45Š|
| 162 | L | 40 | Very low | 47.9 | Very low | 175 Ų | 175 | 129.5 Ų | 129.5 | 92% | 0.916 | 82% | 0.824 | S | S | * | * | trans | -143.2 | 126.8 | 147.9 | -88.6 | 168.1 | 0 | 0 | 0 | 109.3 | G164 | L162-G164 PolarHBondContact O-N 3.4Š| ||
| 163 | N | 51.7 | Low | 47.5 | Very low | 176 Ų | 176 | 126 Ų | 126 | 94% | 0.941 | 81% | 0.811 | S | S | * | * | trans | -55 | 123.6 | -170.1 | -92.5 | 9.5 | 0 | 0 | 0 | 114.9 | ||||
| 164 | G | 47.8 | Very low | 47.4 | Very low | 71 Ų | 71 | 128.4 Ų | 128.4 | 73% | 0.732 | 81% | 0.814 | S | S | * | * | trans | -129.8 | 130 | 159.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | L162 | L162-G164 PolarHBondContact O-N 3.4Š| ||
| 165 | K | 48.3 | Very low | 48 | Very low | 206 Ų | 206 | 127.6 Ų | 127.6 | 90% | 0.896 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -60 | 145 | -177 | -66.3 | -179 | 178.8 | -179.5 | 0 | 111.4 | G167 | K165-G167 PolarHBondContact O-N 2.66Š|
| 166 | P | 47.9 | Very low | 47.5 | Very low | 129 Ų | 129 | 125.4 Ų | 125.4 | 84% | 0.838 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 132.8 | 179.9 | -20.2 | 30.7 | 0 | 0 | 0 | 111.8 | ||
| 167 | G | 52.8 | Low | 47.2 | Very low | 72 Ų | 72 | 127.2 Ų | 127.2 | 74% | 0.742 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 135.4 | 170.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | K165 | K165-G167 PolarHBondContact O-N 2.66Š|
| 168 | L | 45.3 | Very low | 47.7 | Very low | 167 Ų | 167 | 131.6 Ų | 131.6 | 87% | 0.874 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -60 | 135.3 | 176.3 | -76.1 | 165 | 0 | 0 | 0 | 110.1 | G170 | L168-G170 PolarHBondContact O-N 2.89Š|
| 169 | P | 53.5 | Low | 47.9 | Very low | 121 Ų | 121 | 129.3 Ų | 129.3 | 79% | 0.786 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 133.9 | 175.3 | -21.8 | 31.2 | 0 | 0 | 0 | 110.9 | I171 | P169-I171 PolarHBondContact O-N 2.8Š|
| 170 | G | 53.4 | Low | 47.9 | Very low | 76 Ų | 76 | 134.7 Ų | 134.7 | 78% | 0.784 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 127.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | L168 R172 | L168-G170 PolarHBondContact O-N 2.89Å; G170-R172 PolarHBondContact O-N 3.24Å; G170-R172 VanDerWaalsContact O-N 3.12Å |
| 171 | I | 42.7 | Very low | 48.3 | Very low | 173 Ų | 173 | 131.4 Ų | 131.4 | 89% | 0.887 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 118.1 | 177.8 | 20.4 | 172.5 | 0 | 0 | 0 | 109.7 | P169 G173 | P169-I171 PolarHBondContact O-N 2.8Å; I171-G173 PolarHBondContact O-N 2.89Å |
| 172 | R | 54.2 | Low | 48.3 | Very low | 225 Ų | 225 | 129.4 Ų | 129.4 | 85% | 0.849 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 120.9 | 173.6 | -177.6 | 177 | -178.8 | 178.9 | -0.7 | 108.3 | G170 | G170-R172 PolarHBondContact O-N 3.24Å; G170-R172 VanDerWaalsContact O-N 3.12Å |
| 173 | G | 49.9 | Very low | 48.5 | Very low | 54 Ų | 54 | 129.3 Ų | 129.3 | 56% | 0.557 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 139.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | I171 | I171-G173 PolarHBondContact O-N 2.89Š|
| 174 | P | 42.6 | Very low | 48.5 | Very low | 119 Ų | 119 | 130.7 Ų | 130.7 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 140.8 | -177.1 | 23.1 | -31.7 | 0 | 0 | 0 | 109.6 | G176 | P174-G176 PolarHBondContact O-N 2.79Š|
| 175 | P | 53.4 | Low | 48.5 | Very low | 121 Ų | 121 | 130.5 Ų | 130.5 | 79% | 0.786 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 131.5 | 172.1 | -23.6 | 32.6 | 0 | 0 | 0 | 109.5 | A177 | P175-A177 PolarHBondContact O-N 3.24Š|
| 176 | G | 48.2 | Very low | 48.3 | Very low | 74 Ų | 74 | 128.7 Ų | 128.7 | 76% | 0.763 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 134.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | P174 R178 | P174-G176 PolarHBondContact O-N 2.79Å; G176-R178 PolarHBondContact O-N 3.08Å |
| 177 | A | 42.5 | Very low | 48.4 | Very low | 101 Ų | 101 | 128 Ų | 128 | 84% | 0.835 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -50 | 125.9 | -175.3 | 0 | 0 | 0 | 0 | 0 | 110 | P175 G179 | P175-A177 PolarHBondContact O-N 3.24Å; A177-G179 PolarHBondContact O-N 2.9Å; A177-G179 VanDerWaalsContact O-N 3.15Å |
| 178 | R | 52.9 | Low | 48.1 | Very low | 224 Ų | 224 | 127.4 Ų | 127.4 | 85% | 0.845 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 121.7 | 174.5 | -178.5 | 177.2 | -178.6 | 173.2 | -0.6 | 107 | G176 E180 | G176-R178 PolarHBondContact O-N 3.08Å; R178-E180 PolarHBondContact O-N 2.8Å |
| 179 | G | 47.3 | Very low | 48.1 | Very low | 65 Ų | 65 | 125.2 Ų | 125.2 | 67% | 0.67 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 131.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | A177 | A177-G179 PolarHBondContact O-N 2.9Å; A177-G179 VanDerWaalsContact O-N 3.15Å |
| 180 | E | 43.5 | Very low | 48.2 | Very low | 181 Ų | 181 | 125.4 Ų | 125.4 | 85% | 0.846 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 136.5 | -176.7 | -66.3 | -168.1 | 160.2 | 0 | 0 | 109.6 | R178 G182 | R178-E180 PolarHBondContact O-N 2.8Å; E180-G182 PolarHBondContact O-N 3.18Å |
| 181 | P | 50.7 | Low | 48.1 | Very low | 116 Ų | 116 | 125.1 Ų | 125.1 | 75% | 0.753 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -52 | 127.6 | 170.3 | -22 | 32.2 | 0 | 0 | 0 | 108.6 | L183 | P181-L183 PolarHBondContact O-N 3.37Š|
| 182 | G | 45.9 | Very low | 48.5 | Very low | 71 Ų | 71 | 126 Ų | 126 | 73% | 0.732 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 135.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | E180 K184 | E180-G182 PolarHBondContact O-N 3.18Å; G182-K184 PolarHBondContact O-N 3.3Å; G182-K184 VanDerWaalsContact O-N 3.13Å |
| 183 | L | 44.9 | Very low | 48.4 | Very low | 173 Ų | 173 | 126.9 Ų | 126.9 | 91% | 0.906 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -46.9 | 123.5 | -179.2 | -71.5 | 168 | 0 | 0 | 0 | 109.3 | P181 G185 | P181-L183 PolarHBondContact O-N 3.37Å; L183-G185 PolarHBondContact O-N 3.29Å; L183-G185 VanDerWaalsContact O-N 3.12Å |
| 184 | K | 51.1 | Low | 48.5 | Very low | 205 Ų | 205 | 127.4 Ų | 127.4 | 89% | 0.891 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 122 | 177.2 | -147.9 | 177.6 | -172 | -177.3 | 0 | 106.6 | G182 I186 | G182-K184 PolarHBondContact O-N 3.3Å; G182-K184 VanDerWaalsContact O-N 3.13Å; K184-I186 PolarHBondContact O-N 3.28Å |
| 185 | G | 46.8 | Very low | 48.8 | Very low | 67 Ų | 67 | 130 Ų | 130 | 69% | 0.691 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 130.5 | -176.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | L183 S187 | L183-G185 PolarHBondContact O-N 3.29Å; L183-G185 VanDerWaalsContact O-N 3.12Å; G185-S187 PolarHBondContact O-N 3.25Å; G185-S187 VanDerWaalsContact O-N 3.15Å |
| 186 | I | 45.3 | Very low | 48.8 | Very low | 169 Ų | 169 | 134.2 Ų | 134.2 | 87% | 0.867 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -49.4 | 122.7 | 174.7 | 37.3 | 169.9 | 0 | 0 | 0 | 108.7 | K184 G188 | K184-I186 PolarHBondContact O-N 3.28Å; I186-G188 PolarHBondContact O-N 3.4Å |
| 187 | S | 49.3 | Very low | 48.7 | Very low | 115 Ų | 115 | 133.9 Ų | 133.9 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 128.1 | 170.9 | -60.7 | 0 | 0 | 0 | 0 | 107.5 | G185 | G185-S187 PolarHBondContact O-N 3.25Å; G185-S187 VanDerWaalsContact O-N 3.15Å |
| 188 | G | 47.5 | Very low | 48.9 | Very low | 59 Ų | 59 | 138 Ų | 138 | 61% | 0.608 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 145.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | I186 | I186-G188 PolarHBondContact O-N 3.4Š|
| 189 | P | 45.1 | Very low | 48.7 | Very low | 121 Ų | 121 | 135.3 Ų | 135.3 | 79% | 0.786 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 137.9 | 177.6 | 21.8 | -31.8 | 0 | 0 | 0 | 109 | G191 | P189-G191 PolarHBondContact O-N 3.35Å; P189-G191 VanDerWaalsContact O-N 3.14Å |
| 190 | P | 54.6 | Low | 48.5 | Very low | 124 Ų | 124 | 135.6 Ų | 135.6 | 81% | 0.805 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -49.9 | 126.7 | 174.2 | -23.5 | 32.1 | 0 | 0 | 0 | 108.5 | E192 | P190-E192 PolarHBondContact O-N 2.68Š|
| 191 | G | 51.5 | Low | 49 | Very low | 71 Ų | 71 | 135.1 Ų | 135.1 | 73% | 0.732 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 132.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | P189 R193 | P189-G191 PolarHBondContact O-N 3.35Å; P189-G191 VanDerWaalsContact O-N 3.14Å; G191-R193 PolarHBondContact O-N 3.24Å |
| 192 | E | 50.4 | Low | 48.7 | Very low | 192 Ų | 192 | 133.2 Ų | 133.2 | 90% | 0.897 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 129.4 | -179.8 | -71.6 | -175 | 160.3 | 0 | 0 | 109.3 | P190 G194 | P190-E192 PolarHBondContact O-N 2.68Å; E192-G194 PolarHBondContact O-N 3.39Å |
| 193 | R | 53 | Low | 48.8 | Very low | 242 Ų | 242 | 139.3 Ų | 139.3 | 91% | 0.913 | 82% | 0.817 | S | S | * | * | trans | -58 | 112.5 | 176.6 | -178.3 | -176.8 | -71.8 | -170.1 | -1.9 | 106.6 | G191 L195 | G191-R193 PolarHBondContact O-N 3.24Å; R193-L195 PolarHBondContact O-N 2.75Å | ||
| 194 | G | 52.3 | Low | 49.1 | Very low | 66 Ų | 66 | 137 Ų | 137 | 68% | 0.68 | 81% | 0.812 | S | S | * | * | trans | -49.7 | 132.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | E192 K196 | E192-G194 PolarHBondContact O-N 3.39Å; G194-K196 PolarHBondContact O-N 3.05Å | ||
| 195 | L | 48.6 | Very low | 49.1 | Very low | 174 Ų | 174 | 130.5 Ų | 130.5 | 91% | 0.911 | 80% | 0.803 | S | S | * | * | trans | -51.4 | 131.2 | 172.6 | -67.2 | 170.5 | 0 | 0 | 0 | 107.8 | R193 G197 | R193-L195 PolarHBondContact O-N 2.75Å; L195-G197 VanDerWaalsContact C-N 3.32Å; L195-G197 PolarHBondContact O-N 3.15Å | ||
| 196 | K | 52.4 | Low | 49.2 | Very low | 209 Ų | 209 | 135.2 Ų | 135.2 | 91% | 0.909 | 81% | 0.811 | S | S | * | * | trans | -57.6 | 96.1 | 179.2 | -176.8 | -175.6 | 179.1 | -172.7 | 0 | 108.4 | G194 E198 | G194-K196 PolarHBondContact O-N 3.05Å; K196-E198 PolarHBondContact O-N 3.2Å | ||
| 197 | G | 46.3 | Very low | 49.6 | Very low | 66 Ų | 66 | 132.7 Ų | 132.7 | 68% | 0.68 | 81% | 0.806 | S | S | * | * | trans | -75.4 | 120.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 109 | L195 N199 | L195-G197 VanDerWaalsContact C-N 3.32Å; L195-G197 PolarHBondContact O-N 3.15Å; G197-N199 PolarHBondContact O-N 3.27Å | ||
| 198 | E | 47.6 | Very low | 49.7 | Very low | 189 Ų | 189 | 130.6 Ų | 130.6 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | S | Bend | trans | -56.2 | 121.6 | 155.6 | -77.1 | 179 | 137.5 | 0 | 0 | 108.1 | K196 | K196-E198 PolarHBondContact O-N 3.2Š|
| 199 | N | 47.9 | Very low | 49.7 | Very low | 166 Ų | 166 | 136.1 Ų | 136.1 | 89% | 0.888 | 82% | 0.816 | S | S | * | * | S | Bend | trans | 35.1 | 99.8 | 162.2 | -59.8 | -14.7 | 0 | 0 | 0 | 117.6 | G197 | G197-N199 PolarHBondContact O-N 3.27Š|
| 200 | G | 44.5 | Very low | 50.2 | Low | 71 Ų | 71 | 142 Ų | 142 | 73% | 0.732 | 82% | 0.822 | S | S | * | * | S | Bend | trans | 142.4 | 107.6 | 151.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | G202 | G200-G202 PolarHBondContact O-N 2.95Š|
| 201 | N | 52.3 | Low | 49.9 | Very low | 172 Ų | 172 | 138.6 Ų | 138.6 | 92% | 0.92 | 81% | 0.81 | S | S | * | * | trans | 33.8 | 75.4 | 153 | -61.3 | -12.7 | 0 | 0 | 0 | 118 | ||||
| 202 | G | 44.6 | Very low | 49.8 | Very low | 76 Ų | 76 | 141 Ų | 141 | 78% | 0.784 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -81.5 | 122.2 | 163.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | G200 | G200-G202 PolarHBondContact O-N 2.95Š|
| 203 | K | 49.5 | Very low | 50 | Low | 198 Ų | 198 | 137.7 Ų | 137.7 | 86% | 0.861 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 140.6 | 171.2 | -64.7 | -178.1 | -179.9 | -176.5 | 0 | 109.6 | G205 | K203-G205 PolarHBondContact O-N 3.26Š|
| 204 | P | 51.3 | Low | 49.7 | Very low | 126 Ų | 126 | 129.8 Ų | 129.8 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 130.1 | 173.9 | -23.6 | 32.5 | 0 | 0 | 0 | 110.5 | ||
| 205 | G | 49.8 | Very low | 49.3 | Very low | 68 Ų | 68 | 134.9 Ų | 134.9 | 70% | 0.701 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -57 | 143.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111 | K203 | K203-G205 PolarHBondContact O-N 3.26Š|
| 206 | I | 48.7 | Very low | 49.6 | Very low | 166 Ų | 166 | 136 Ų | 136 | 85% | 0.851 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -53 | 129.2 | 179.1 | -28.7 | 174.7 | 0 | 0 | 0 | 108.4 | G208 | I206-G208 PolarHBondContact O-N 3Š|
| 207 | P | 55.4 | Low | 49.4 | Very low | 116 Ų | 116 | 129.1 Ų | 129.1 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 129.8 | 175.8 | -26.6 | 33.8 | 0 | 0 | 0 | 110.3 | I209 | P207-I209 PolarHBondContact O-N 2.85Š|
| 208 | G | 50 | Low | 49.3 | Very low | 71 Ų | 71 | 133.5 Ų | 133.5 | 73% | 0.732 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 135 | 179.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | I206 R210 | I206-G208 PolarHBondContact O-N 3Å; G208-R210 PolarHBondContact O-N 2.87Å |
| 209 | I | 48.2 | Very low | 49.7 | Very low | 175 Ų | 175 | 131.3 Ų | 131.3 | 90% | 0.897 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -48 | 122.5 | 175.8 | 19.4 | 172.9 | 0 | 0 | 0 | 109.8 | P207 G211 | P207-I209 PolarHBondContact O-N 2.85Å; I209-G211 PolarHBondContact O-N 2.83Å; I209-G211 VanDerWaalsContact O-N 3.15Å |
| 210 | R | 56.1 | Low | 49.5 | Very low | 243 Ų | 243 | 126 Ų | 126 | 92% | 0.917 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 121.3 | 175.9 | -176.8 | 178 | -178.9 | 178.5 | 1.2 | 107.9 | G208 | G208-R210 PolarHBondContact O-N 2.87Š|
| 211 | G | 47.6 | Very low | 49.6 | Very low | 53 Ų | 53 | 128.4 Ų | 128.4 | 55% | 0.546 | 79% | 0.793 | S | S | . | * | P | Polyproline II helix | trans | -52.9 | 145.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | I209 | I209-G211 PolarHBondContact O-N 2.83Å; I209-G211 VanDerWaalsContact O-N 3.15Å |
| 212 | P | 48.5 | Very low | 49.6 | Very low | 121 Ų | 121 | 126.2 Ų | 126.2 | 79% | 0.786 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 147.2 | 179.5 | 21.8 | -31.7 | 0 | 0 | 0 | 110.6 | G214 | P212-G214 PolarHBondContact O-N 2.9Š|
| 213 | P | 55.9 | Low | 49.4 | Very low | 124 Ų | 124 | 126 Ų | 126 | 81% | 0.805 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 131.2 | 174.1 | -23.9 | 32.6 | 0 | 0 | 0 | 110.1 | L215 | P213-L215 PolarHBondContact O-N 2.79Š|
| 214 | G | 47.2 | Very low | 48.9 | Very low | 75 Ų | 75 | 126 Ų | 126 | 77% | 0.773 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 134.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | P212 K216 | P212-G214 PolarHBondContact O-N 2.9Å; G214-K216 PolarHBondContact O-N 3.48Å |
| 215 | L | 43.3 | Very low | 48.6 | Very low | 173 Ų | 173 | 125.5 Ų | 125.5 | 91% | 0.906 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 128.1 | 178.7 | -68.6 | 170.8 | 0 | 0 | 0 | 109.2 | P213 G217 | P213-L215 PolarHBondContact O-N 2.79Å; L215-G217 PolarHBondContact O-N 2.97Å; L215-G217 VanDerWaalsContact O-N 3.11Å |
| 216 | K | 54.1 | Low | 48.1 | Very low | 198 Ų | 198 | 126.3 Ų | 126.3 | 86% | 0.861 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 120.1 | 175.6 | -176.7 | 178.4 | 179.1 | -179.3 | 0 | 107.8 | G214 N218 | G214-K216 PolarHBondContact O-N 3.48Å; K216-N218 PolarHBondContact O-N 2.76Å |
| 217 | G | 48.4 | Very low | 47.7 | Very low | 64 Ų | 64 | 125.8 Ų | 125.8 | 66% | 0.66 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 133.2 | -177.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | L215 T219 | L215-G217 PolarHBondContact O-N 2.97Å; L215-G217 VanDerWaalsContact O-N 3.11Å; G217-T219 PolarHBondContact O-N 2.88Å |
| 218 | N | 45.3 | Very low | 46.8 | Very low | 159 Ų | 159 | 124 Ų | 124 | 85% | 0.85 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 135 | 178.9 | -64.8 | -11.6 | 0 | 0 | 0 | 109.4 | K216 G220 | K216-N218 PolarHBondContact O-N 2.76Å; N218-G220 PolarHBondContact O-N 3.29Å; N218-G220 VanDerWaalsContact O-N 3.15Å |
| 219 | T | 55.9 | Low | 46.3 | Very low | 142 Ų | 142 | 128.6 Ų | 128.6 | 87% | 0.871 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 123.1 | 173.3 | -47.7 | 0 | 0 | 0 | 0 | 108.4 | G217 | G217-T219 PolarHBondContact O-N 2.88Š|
| 220 | G | 43.8 | Very low | 46.2 | Very low | 56 Ų | 56 | 126.7 Ų | 126.7 | 58% | 0.577 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 139.9 | -178.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | N218 | N218-G220 PolarHBondContact O-N 3.29Å; N218-G220 VanDerWaalsContact O-N 3.15Å |
| 221 | P | 45.6 | Very low | 45.2 | Very low | 120 Ų | 120 | 118.8 Ų | 118.8 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 142.9 | -180 | 22.8 | -31.4 | 0 | 0 | 0 | 109.9 | G223 | P221-G223 PolarHBondContact O-N 3.34Š|
| 222 | P | 51.7 | Low | 45.2 | Very low | 126 Ų | 126 | 124.7 Ų | 124.7 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 134.1 | 172.2 | -23.6 | 32.4 | 0 | 0 | 0 | 110.3 | F224 | P222-F224 PolarHBondContact O-N 2.83Š|
| 223 | G | 41.5 | Very low | 44.6 | Very low | 71 Ų | 71 | 129.1 Ų | 129.1 | 73% | 0.732 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 137.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | P221 | P221-G223 PolarHBondContact O-N 3.34Š|
| 224 | F | 38.7 | Very low | 43.9 | Very low | 200 Ų | 200 | 126.8 Ų | 126.8 | 88% | 0.877 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 130.8 | -178.6 | -70.8 | -81.4 | 0 | 0 | 0 | 111.5 | P222 | P222-F224 PolarHBondContact O-N 2.83Š|
| 225 | P | 44.8 | Very low | 43.7 | Very low | 115 Ų | 115 | 132 Ų | 132 | 75% | 0.747 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 135.8 | 164.4 | -18.3 | 30.8 | 0 | 0 | 0 | 110 | I227 | P225-I227 PolarHBondContact O-N 2.96Š|
| 226 | G | 38.9 | Very low | 44 | Very low | 84 Ų | 84 | 133.2 Ų | 133.2 | 87% | 0.866 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 126.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 227 | I | 40.8 | Very low | 43.8 | Very low | 155 Ų | 155 | 126.6 Ų | 126.6 | 80% | 0.795 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 119.5 | -178.5 | -66.4 | 166.2 | 0 | 0 | 0 | 109.5 | P225 K229 | P225-I227 PolarHBondContact O-N 2.96Å; I227-K229 HydrophobicContact CG2-CB 4.45Å |
| 228 | G | 36 | Very low | 44.1 | Very low | 78 Ų | 78 | 129.3 Ų | 129.3 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | trans | -119 | 105.1 | 148.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 229 | K | 39.8 | Very low | 44.9 | Very low | 169 Ų | 169 | 127.9 Ų | 127.9 | 74% | 0.735 | 81% | 0.806 | S | S | * | * | trans | -139 | 139.5 | 167.2 | -70.7 | -170.8 | -179.4 | -176.3 | 0 | 106 | I227 | I227-K229 HydrophobicContact CG2-CB 4.45Š| ||
| 230 | P | 45.5 | Very low | 44.7 | Very low | 134 Ų | 134 | 124.8 Ų | 124.8 | 87% | 0.87 | 80% | 0.803 | S | S | * | * | -144.3 | 166.1 | 65.3 | 26.8 | -2.6 | 0 | 0 | 0 | 114.7 | |||||
| 231 | G | 36.2 | Very low | 44.9 | Very low | 78 Ų | 78 | 130.5 Ų | 130.5 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | cis | -156 | 168.1 | 24.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 232 | Q | 47.2 | Very low | 45.5 | Very low | 176 Ų | 176 | 134.4 Ų | 134.4 | 82% | 0.822 | 82% | 0.823 | S | S | * | * | trans | -107.7 | 138.2 | 179.2 | -86.6 | -179.8 | -20.8 | 0 | 0 | 110.8 | ||||
| 233 | K | 37.2 | Very low | 45.5 | Very low | 215 Ų | 215 | 131.7 Ų | 131.7 | 94% | 0.935 | 82% | 0.819 | S | S | * | * | trans | -171.6 | 130.6 | 140.4 | -107.9 | 179 | -177.5 | -179.6 | 0 | 107.1 | ||||
| 234 | G | 40 | Very low | 45.9 | Very low | 74 Ų | 74 | 136.1 Ų | 136.1 | 76% | 0.763 | 83% | 0.825 | S | S | * | * | cis | -163.2 | 153.7 | -6.7 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 235 | L | 42.6 | Very low | 46.6 | Very low | 184 Ų | 184 | 135.9 Ų | 135.9 | 96% | 0.963 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -100.3 | 132.9 | 173.2 | -77.5 | 166.3 | 0 | 0 | 0 | 109.5 | ||
| 236 | Q | 49.8 | Very low | 46.8 | Very low | 199 Ų | 199 | 133.3 Ų | 133.3 | 93% | 0.93 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 139.1 | 174.3 | -165.4 | 171.2 | 35.8 | 0 | 0 | 110 | ||
| 237 | G | 50.1 | Low | 47.2 | Very low | 60 Ų | 60 | 137.4 Ų | 137.4 | 62% | 0.619 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 153.7 | -163.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 238 | P | 55.2 | Low | 48 | Very low | 121 Ų | 121 | 135.9 Ų | 135.9 | 79% | 0.786 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 147.8 | 174.6 | 27.5 | -32.1 | 0 | 0 | 0 | 111.5 | G240 | P238-G240 PolarHBondContact O-N 3.45Š|
| 239 | P | 62.1 | Low | 48.8 | Very low | 129 Ų | 129 | 135.6 Ų | 135.6 | 84% | 0.838 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 137.5 | 171 | -24.3 | 33.6 | 0 | 0 | 0 | 111.6 | ||
| 240 | G | 51.8 | Low | 49.4 | Very low | 77 Ų | 77 | 137.7 Ų | 137.7 | 79% | 0.794 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 141.2 | -170.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | P238 K242 | P238-G240 PolarHBondContact O-N 3.45Å; G240-K242 PolarHBondContact O-N 3.37Å |
| 241 | L | 48.3 | Very low | 49.4 | Very low | 175 Ų | 175 | 139.1 Ų | 139.1 | 92% | 0.916 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 127.6 | 172.7 | -65.8 | 168.3 | 0 | 0 | 0 | 109.7 | G243 | L241-G243 PolarHBondContact O-N 3.37Š|
| 242 | K | 57.5 | Low | 50.2 | Low | 202 Ų | 202 | 138.1 Ų | 138.1 | 88% | 0.878 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 124.8 | 164.4 | -174.1 | 177.8 | 178.4 | -176 | 0 | 107.2 | G240 | G240-K242 PolarHBondContact O-N 3.37Š|
| 243 | G | 52.4 | Low | 50.2 | Low | 70 Ų | 70 | 139 Ų | 139 | 72% | 0.722 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 140.6 | -169.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | L241 E245 | L241-G243 PolarHBondContact O-N 3.37Å; G243-E245 PolarHBondContact O-N 3.13Å |
| 244 | D | 48.5 | Very low | 51 | Low | 163 Ų | 163 | 134.4 Ų | 134.4 | 87% | 0.872 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 128.2 | 175.2 | -60.9 | -45.9 | 0 | 0 | 0 | 110.2 | G246 | D244-G246 PolarHBondContact O-N 3.08Š|
| 245 | E | 54.5 | Low | 51.8 | Low | 195 Ų | 195 | 134.1 Ų | 134.1 | 91% | 0.911 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 127.6 | 164.4 | -160.8 | 172.3 | -172.9 | 0 | 0 | 107.9 | G243 | G243-E245 PolarHBondContact O-N 3.13Š|
| 246 | G | 48.4 | Very low | 51.9 | Low | 61 Ų | 61 | 134.6 Ų | 134.6 | 63% | 0.629 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 143.9 | -170.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | D244 P248 | D244-G246 PolarHBondContact O-N 3.08Å; G246-P248 VanDerWaalsContact O-CD 3.25Å; G246-P248 WeakPolarHBondContact O-CD 3.35Å |
| 247 | L | 47.7 | Very low | 52.2 | Low | 171 Ų | 171 | 131.2 Ų | 131.2 | 90% | 0.895 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 120.3 | 175.3 | -69.7 | 167.7 | 0 | 0 | 0 | 110.4 | G249 | L247-G249 PolarHBondContact O-N 3.15Š|
| 248 | P | 57.3 | Low | 52.3 | Low | 123 Ų | 123 | 131.4 Ų | 131.4 | 80% | 0.799 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 132.1 | 164.9 | -22.6 | 34.3 | 0 | 0 | 0 | 109.5 | G246 | G246-P248 VanDerWaalsContact O-CD 3.25Å; G246-P248 WeakPolarHBondContact O-CD 3.35Å |
| 249 | G | 52.9 | Low | 51.9 | Low | 71 Ų | 71 | 131.6 Ų | 131.6 | 73% | 0.732 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 149.6 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113 | L247 L251 | L247-G249 PolarHBondContact O-N 3.15Å; G249-L251 PolarHBondContact O-N 3.29Å |
| 250 | K | 52.9 | Low | 51.2 | Low | 213 Ų | 213 | 132 Ų | 132 | 93% | 0.926 | 81% | 0.809 | S | S | * | * | trans | -55.3 | 113.7 | 174.9 | -66.2 | -177 | 178.8 | -176.2 | 0 | 109.5 | G252 | K250-G252 PolarHBondContact O-N 3.23Š| ||
| 251 | L | 44.8 | Very low | 51.2 | Low | 165 Ų | 165 | 132.1 Ų | 132.1 | 86% | 0.864 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 120.4 | 168.5 | -174.4 | 67.6 | 0 | 0 | 0 | 108.1 | G249 | G249-L251 PolarHBondContact O-N 3.29Š|
| 252 | G | 52.6 | Low | 51 | Low | 56 Ų | 56 | 132.6 Ų | 132.6 | 58% | 0.577 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 153.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | K250 P254 | K250-G252 PolarHBondContact O-N 3.23Å; G252-P254 VanDerWaalsContact O-CD 3.23Å; G252-P254 WeakPolarHBondContact O-CD 3.38Å |
| 253 | E | 48.1 | Very low | 50.3 | Low | 195 Ų | 195 | 132.5 Ų | 132.5 | 91% | 0.911 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 121.5 | 177.6 | -67.6 | -165.3 | 145 | 0 | 0 | 111.2 | G255 | E253-G255 PolarHBondContact O-N 3.09Š|
| 254 | P | 54.2 | Low | 50.1 | Low | 119 Ų | 119 | 132.2 Ų | 132.2 | 77% | 0.773 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 128.6 | 171.9 | -20.1 | 34.1 | 0 | 0 | 0 | 111.2 | G252 | G252-P254 VanDerWaalsContact O-CD 3.23Å; G252-P254 WeakPolarHBondContact O-CD 3.38Å |
| 255 | G | 56.5 | Low | 49.5 | Very low | 67 Ų | 67 | 132.8 Ų | 132.8 | 69% | 0.691 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 162.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | E253 | E253-G255 PolarHBondContact O-N 3.09Š|
| 256 | Q | 44.5 | Very low | 49.1 | Very low | 194 Ų | 194 | 129.5 Ų | 129.5 | 91% | 0.907 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 128.5 | -176.5 | -67.7 | 179.8 | -3.5 | 0 | 0 | 112.4 | ||
| 257 | P | 55.3 | Low | 49.2 | Very low | 129 Ų | 129 | 129.7 Ų | 129.7 | 84% | 0.838 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 132.8 | 174.5 | -22.9 | 33.9 | 0 | 0 | 0 | 113 | ||
| 258 | G | 54.1 | Low | 48.8 | Very low | 63 Ų | 63 | 127.8 Ų | 127.8 | 65% | 0.649 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 171.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 259 | P | 46.9 | Very low | 48.1 | Very low | 126 Ų | 126 | 127 Ų | 127 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 152.9 | -168 | 25.4 | -32.8 | 0 | 0 | 0 | 114.3 | ||
| 260 | P | 45.8 | Very low | 47.4 | Very low | 137 Ų | 137 | 127.2 Ų | 127.2 | 89% | 0.89 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 143.2 | -171 | -18.5 | 31.9 | 0 | 0 | 0 | 114.7 | ||
| 261 | G | 52.6 | Low | 46.7 | Very low | 80 Ų | 80 | 125.2 Ų | 125.2 | 83% | 0.825 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -94.1 | 167.2 | -171.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||
| 262 | L | 43 | Very low | 46.5 | Very low | 185 Ų | 185 | 120.6 Ų | 120.6 | 97% | 0.969 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -83 | 136.6 | 177 | -73 | 166 | 0 | 0 | 0 | 112.3 | ||
| 263 | Q | 43.4 | Very low | 45.8 | Very low | 200 Ų | 200 | 127.2 Ų | 127.2 | 94% | 0.935 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -74 | 149.3 | -178 | -170.3 | 178.2 | 23.6 | 0 | 0 | 112 | ||
| 264 | G | 47.7 | Very low | 45.8 | Very low | 64 Ų | 64 | 123.7 Ų | 123.7 | 66% | 0.66 | 81% | 0.814 | S | S | * | * | cis | 172.9 | 169.6 | -2.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 265 | L | 36.2 | Very low | 45.3 | Very low | 174 Ų | 174 | 121.2 Ų | 121.2 | 91% | 0.911 | 81% | 0.81 | S | S | * | * | trans | -146.3 | 128.8 | 154.6 | -96 | 168.9 | 0 | 0 | 0 | 109.5 | ||||
| 266 | P | 46.9 | Very low | 44.4 | Very low | 126 Ų | 126 | 126.5 Ų | 126.5 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | trans | -82 | 157.4 | 179 | 2.8 | 15.5 | 0 | 0 | 0 | 111.2 | ||||
| 267 | G | 50.1 | Low | 44.5 | Very low | 65 Ų | 65 | 124.4 Ų | 124.4 | 67% | 0.67 | 82% | 0.817 | S | S | * | * | cis | -179.9 | 162.3 | -0.5 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 268 | P | 39.5 | Very low | 44.1 | Very low | 132 Ų | 132 | 121.6 Ų | 121.6 | 86% | 0.857 | 81% | 0.811 | S | S | * | * | -141.7 | 142 | 117 | 21.1 | -0.6 | 0 | 0 | 0 | 115 | |||||
| 269 | A | 41.9 | Very low | 43.3 | Very low | 105 Ų | 105 | 126.8 Ų | 126.8 | 87% | 0.868 | 82% | 0.823 | S | S | * | * | trans | 17.8 | 97 | 158.1 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 270 | G | 39.6 | Very low | 43.8 | Very low | 77 Ų | 77 | 126 Ų | 126 | 79% | 0.794 | 82% | 0.818 | S | S | * | * | trans | -72.9 | 132.8 | 159.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 271 | L | 37.3 | Very low | 44.2 | Very low | 171 Ų | 171 | 122.8 Ų | 122.8 | 90% | 0.895 | 81% | 0.81 | S | S | * | * | trans | -113 | 70.2 | 150.1 | -163.7 | 82.2 | 0 | 0 | 0 | 107.7 | K273 | L271-K273 PolarHBondContact O-N 3.26Š| ||
| 272 | G | 40.2 | Very low | 43.7 | Very low | 67 Ų | 67 | 125.3 Ų | 125.3 | 69% | 0.691 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 123.2 | 162.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||
| 273 | K | 37.3 | Very low | 44.8 | Very low | 195 Ų | 195 | 122.1 Ų | 122.1 | 85% | 0.848 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 132.8 | 160.8 | -66 | -179.5 | -179 | -178.9 | 0 | 107.3 | L271 | L271-K273 PolarHBondContact O-N 3.26Š|
| 274 | P | 49.1 | Very low | 45.4 | Very low | 121 Ų | 121 | 115.4 Ų | 115.4 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 149 | 175.6 | -27.2 | 34.3 | 0 | 0 | 0 | 112.4 | L276 | P274-L276 PolarHBondContact O-N 3.34Š|
| 275 | G | 43.8 | Very low | 45.6 | Very low | 68 Ų | 68 | 118.5 Ų | 118.5 | 70% | 0.701 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 136.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | D277 | G275-D277 PolarHBondContact O-N 3.2Å; G275-D277 VanDerWaalsContact O-N 3.08Å |
| 276 | L | 37.8 | Very low | 46.8 | Very low | 178 Ų | 178 | 117 Ų | 117 | 93% | 0.932 | 79% | 0.79 | S | S | * | * | trans | -65.8 | 111 | 166.4 | -80.4 | 164.2 | 0 | 0 | 0 | 107 | P274 | P274-L276 PolarHBondContact O-N 3.34Š| ||
| 277 | D | 45.7 | Very low | 47.3 | Very low | 150 Ų | 150 | 113.5 Ų | 113.5 | 80% | 0.802 | 78% | 0.777 | S | S | * | * | trans | -43.8 | 142.3 | 161.7 | -68.9 | -44.7 | 0 | 0 | 0 | 109.6 | G275 L279 | G275-D277 PolarHBondContact O-N 3.2Å; G275-D277 VanDerWaalsContact O-N 3.08Å; D277-L279 PolarHBondContact O-N 3.12Å | ||
| 278 | G | 47.3 | Very low | 47.5 | Very low | 69 Ų | 69 | 116.6 Ų | 116.6 | 71% | 0.711 | 79% | 0.786 | S | S | * | * | trans | -48.9 | 133.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | P280 | G278-P280 VanDerWaalsContact O-CD 3.22Å; G278-P280 WeakPolarHBondContact O-CD 3.28Å | ||
| 279 | L | 37.6 | Very low | 48.6 | Very low | 173 Ų | 173 | 119.5 Ų | 119.5 | 91% | 0.906 | 79% | 0.785 | S | S | * | * | trans | -43.5 | 115.4 | 178.2 | -80.1 | 163.1 | 0 | 0 | 0 | 109 | D277 G281 | D277-L279 PolarHBondContact O-N 3.12Å; L279-G281 PolarHBondContact O-N 3.28Å | ||
| 280 | P | 56.6 | Low | 49.2 | Very low | 108 Ų | 108 | 117.6 Ų | 117.6 | 70% | 0.701 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 133.4 | 169.7 | -24.1 | 33.5 | 0 | 0 | 0 | 107.7 | G278 T282 | G278-P280 VanDerWaalsContact O-CD 3.22Å; G278-P280 WeakPolarHBondContact O-CD 3.28Å; P280-T282 PolarHBondContact O-N 3.38Å; P280-T282 VanDerWaalsContact O-N 3.11Å |
| 281 | G | 53.8 | Low | 49.7 | Very low | 71 Ų | 71 | 123.2 Ų | 123.2 | 73% | 0.732 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -47.4 | 126.3 | 174 | 0 | 0 | 0 | 0 | 0 | 108.3 | L279 P283 | L279-G281 PolarHBondContact O-N 3.28Å; G281-P283 WeakPolarHBondContact O-CD 3.33Å |
| 282 | T | 44 | Very low | 50.8 | Low | 133 Ų | 133 | 123.2 Ų | 123.2 | 82% | 0.816 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -49 | 121.6 | -178.8 | 46.7 | 0 | 0 | 0 | 0 | 108 | P280 G284 | P280-T282 PolarHBondContact O-N 3.38Å; P280-T282 VanDerWaalsContact O-N 3.11Å; T282-G284 PolarHBondContact O-N 3.38Å |
| 283 | P | 64.3 | Low | 51.5 | Low | 118 Ų | 118 | 123.1 Ų | 123.1 | 77% | 0.766 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 129.8 | 170.9 | -26.4 | 34.6 | 0 | 0 | 0 | 107.9 | G281 | G281-P283 WeakPolarHBondContact O-CD 3.33Š|
| 284 | G | 56.4 | Low | 52 | Low | 59 Ų | 59 | 120.7 Ų | 120.7 | 61% | 0.608 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -49 | 142 | 175.2 | 0 | 0 | 0 | 0 | 0 | 109.2 | T282 V286 | T282-G284 PolarHBondContact O-N 3.38Å; G284-V286 PolarHBondContact O-N 3.39Å; G284-V286 VanDerWaalsContact O-N 3.12Å |
| 285 | P | 52.7 | Low | 52.7 | Low | 129 Ų | 129 | 125.6 Ų | 125.6 | 84% | 0.838 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -49.9 | 126.1 | -174.9 | 20.5 | -32.2 | 0 | 0 | 0 | 109.4 | G287 | P285-G287 PolarHBondContact O-N 3.21Š|
| 286 | V | 60.8 | Low | 53.2 | Low | 141 Ų | 141 | 125.3 Ų | 125.3 | 86% | 0.855 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 118.4 | 173.3 | 172.7 | 0 | 0 | 0 | 0 | 106.5 | G284 | G284-V286 PolarHBondContact O-N 3.39Å; G284-V286 VanDerWaalsContact O-N 3.12Å |
| 287 | G | 58.4 | Low | 53.9 | Low | 53 Ų | 53 | 124.3 Ų | 124.3 | 55% | 0.546 | 77% | 0.772 | S | S | . | * | P | Polyproline II helix | trans | -51.8 | 140.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | P285 K289 | P285-G287 PolarHBondContact O-N 3.21Å; G287-K289 PolarHBondContact O-N 2.89Å; G287-K289 VanDerWaalsContact O-N 3.1Å |
| 288 | P | 53.1 | Low | 54.9 | Low | 130 Ų | 130 | 122.7 Ų | 122.7 | 84% | 0.844 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 124.3 | -175 | 22 | -32.3 | 0 | 0 | 0 | 109.4 | G290 | P288-G290 PolarHBondContact O-N 3.37Å; P288-G290 VanDerWaalsContact O-N 3.1Å |
| 289 | K | 61.9 | Low | 55.1 | Low | 194 Ų | 194 | 122.7 Ų | 122.7 | 84% | 0.843 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 118.7 | 171.2 | -178.3 | 178.8 | 178.3 | -177.4 | 0 | 106.6 | G287 E291 | G287-K289 PolarHBondContact O-N 2.89Å; G287-K289 VanDerWaalsContact O-N 3.1Å; K289-E291 PolarHBondContact O-N 3.33Å |
| 290 | G | 54.7 | Low | 55.7 | Low | 65 Ų | 65 | 122.2 Ų | 122.2 | 67% | 0.67 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -48.8 | 135.7 | 180 | 0 | 0 | 0 | 0 | 0 | 110.5 | P288 Q292 | P288-G290 PolarHBondContact O-N 3.37Å; P288-G290 VanDerWaalsContact O-N 3.1Å; G290-Q292 PolarHBondContact O-N 3.46Å; G290-Q292 VanDerWaalsContact O-N 3.17Å |
| 291 | E | 51.3 | Low | 56 | Low | 194 Ų | 194 | 122.6 Ų | 122.6 | 91% | 0.907 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 123.3 | 178.3 | -70 | -178.2 | 155.7 | 0 | 0 | 109.4 | K289 G293 | K289-E291 PolarHBondContact O-N 3.33Å; E291-G293 PolarHBondContact O-N 3.25Å |
| 292 | Q | 61 | Low | 55.8 | Low | 172 Ų | 172 | 122.7 Ų | 122.7 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 118.3 | 172.4 | 179.1 | 174.9 | -19 | 0 | 0 | 107.2 | G290 T294 | G290-Q292 PolarHBondContact O-N 3.46Å; G290-Q292 VanDerWaalsContact O-N 3.17Å; Q292-T294 PolarHBondContact O-N 2.77Å |
| 293 | G | 53.8 | Low | 56 | Low | 65 Ų | 65 | 120.7 Ų | 120.7 | 67% | 0.67 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -48.1 | 134.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | E291 R295 | E291-G293 PolarHBondContact O-N 3.25Å; G293-R295 PolarHBondContact O-N 3.22Å; G293-R295 VanDerWaalsContact O-N 3.09Å |
| 294 | T | 48.7 | Very low | 55.3 | Low | 143 Ų | 143 | 120.9 Ų | 120.9 | 88% | 0.877 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -54 | 118.8 | 179.9 | 43.3 | 0 | 0 | 0 | 0 | 109.3 | Q292 G296 | Q292-T294 PolarHBondContact O-N 2.77Å; T294-G296 PolarHBondContact O-N 3.25Å |
| 295 | R | 63.9 | Low | 54.6 | Low | 225 Ų | 225 | 121.8 Ų | 121.8 | 85% | 0.849 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 123.8 | 171.9 | -175.9 | 176.8 | -173.4 | 165.5 | 1.2 | 107 | G293 N297 | G293-R295 PolarHBondContact O-N 3.22Å; G293-R295 VanDerWaalsContact O-N 3.09Å; R295-N297 PolarHBondContact O-N 2.81Å |
| 296 | G | 54.3 | Low | 54.2 | Low | 62 Ų | 62 | 126.8 Ų | 126.8 | 64% | 0.639 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 135 | 175.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | T294 | T294-G296 PolarHBondContact O-N 3.25Š|
| 297 | N | 51 | Low | 53.3 | Low | 156 Ų | 156 | 123.7 Ų | 123.7 | 83% | 0.834 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -47.8 | 129.5 | -179.9 | -68.9 | -24.3 | 0 | 0 | 0 | 110 | R295 G299 | R295-N297 PolarHBondContact O-N 2.81Å; N297-G299 PolarHBondContact O-N 3.19Å |
| 298 | P | 66.3 | Low | 52.7 | Low | 116 Ų | 116 | 130.5 Ų | 130.5 | 75% | 0.753 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 134.7 | 168.7 | -23.2 | 33 | 0 | 0 | 0 | 109.7 | I300 | P298-I300 PolarHBondContact O-N 2.87Š|
| 299 | G | 51.7 | Low | 52.5 | Low | 69 Ų | 69 | 130.9 Ų | 130.9 | 71% | 0.711 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -54 | 136.9 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | N297 P301 | N297-G299 PolarHBondContact O-N 3.19Å; G299-P301 WeakPolarHBondContact O-CD 3.2Å |
| 300 | I | 51.3 | Low | 51.6 | Low | 163 Ų | 163 | 125.1 Ų | 125.1 | 84% | 0.836 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 123.7 | 178.8 | -48.2 | 169.4 | 0 | 0 | 0 | 108.3 | P298 G302 | P298-I300 PolarHBondContact O-N 2.87Å; I300-G302 PolarHBondContact O-N 3.23Å |
| 301 | P | 61.7 | Low | 51.2 | Low | 116 Ų | 116 | 130.5 Ų | 130.5 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 127 | 170.8 | -24.4 | 34.1 | 0 | 0 | 0 | 109.8 | G299 A303 | G299-P301 WeakPolarHBondContact O-CD 3.2Å; P301-A303 PolarHBondContact O-N 2.89Å |
| 302 | G | 51 | Low | 51 | Low | 73 Ų | 73 | 129.3 Ų | 129.3 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -57 | 136.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | I300 | I300-G302 PolarHBondContact O-N 3.23Š|
| 303 | A | 48.2 | Very low | 50.5 | Low | 92 Ų | 92 | 124.2 Ų | 124.2 | 76% | 0.76 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 139.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | P301 G305 | P301-A303 PolarHBondContact O-N 2.89Å; A303-G305 PolarHBondContact O-N 3.49Å |
| 304 | P | 49.5 | Very low | 50.6 | Low | 121 Ų | 121 | 127.5 Ų | 127.5 | 79% | 0.786 | 81% | 0.806 | S | S | * | * | trans | -58.4 | 112.1 | 172.5 | -22.5 | 32.7 | 0 | 0 | 0 | 110.6 | Y306 | P304-Y306 PolarHBondContact O-N 2.82Š| ||
| 305 | G | 41 | Very low | 50.8 | Low | 78 Ų | 78 | 130.3 Ų | 130.3 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -70.7 | 109.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | A303 G307 | A303-G305 PolarHBondContact O-N 3.49Å; G305-G307 PolarHBondContact O-N 3.48Å; G305-G307 VanDerWaalsContact O-N 3.17Å | ||
| 306 | Y | 45 | Very low | 50.1 | Low | 234 Ų | 234 | 122.9 Ų | 122.9 | 92% | 0.918 | 80% | 0.8 | S | S | * | * | trans | -75.3 | 91.9 | 158.9 | -87.2 | -90.6 | 0 | 0 | 0 | 108.9 | P304 K308 | P304-Y306 PolarHBondContact O-N 2.82Å; Y306-K308 PolarHBondContact O-N 2.95Å | ||
| 307 | G | 42 | Very low | 49.9 | Very low | 76 Ų | 76 | 128.8 Ų | 128.8 | 78% | 0.784 | 81% | 0.811 | S | S | * | * | trans | -80.5 | 108.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | G305 | G305-G307 PolarHBondContact O-N 3.48Å; G305-G307 VanDerWaalsContact O-N 3.17Å | ||
| 308 | K | 45 | Very low | 49.9 | Very low | 197 Ų | 197 | 130.5 Ų | 130.5 | 86% | 0.857 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -75.5 | 138.4 | 152.7 | -65.5 | -177.7 | -179.1 | -177.7 | 0 | 107.8 | Y306 G310 | Y306-K308 PolarHBondContact O-N 2.95Å; K308-G310 PolarHBondContact O-N 2.73Å; K308-G310 VanDerWaalsContact O-N 3.15Å |
| 309 | P | 49.7 | Very low | 49 | Very low | 138 Ų | 138 | 128.5 Ų | 128.5 | 90% | 0.896 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 118.1 | -179.5 | -21.2 | 31.7 | 0 | 0 | 0 | 111.5 | ||
| 310 | G | 43.1 | Very low | 48.7 | Very low | 73 Ų | 73 | 133.8 Ų | 133.8 | 75% | 0.753 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 140.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | K308 | K308-G310 PolarHBondContact O-N 2.73Å; K308-G310 VanDerWaalsContact O-N 3.15Å |
| 311 | L | 46 | Very low | 48.6 | Very low | 177 Ų | 177 | 129.2 Ų | 129.2 | 93% | 0.927 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 145.7 | 172.2 | -80.9 | 138.4 | 0 | 0 | 0 | 112.4 | G313 | L311-G313 PolarHBondContact O-N 2.8Š|
| 312 | N | 47.8 | Very low | 47.8 | Very low | 170 Ų | 170 | 127.6 Ų | 127.6 | 91% | 0.909 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -50 | 121.7 | 175.9 | -104.6 | 11.8 | 0 | 0 | 0 | 112.1 | ||
| 313 | G | 49.7 | Very low | 47.4 | Very low | 65 Ų | 65 | 133.7 Ų | 133.7 | 67% | 0.67 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 147.1 | 168.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L311 | L311-G313 PolarHBondContact O-N 2.8Š|
| 314 | P | 56.2 | Low | 47.5 | Very low | 133 Ų | 133 | 135 Ų | 135 | 86% | 0.864 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 142.2 | 176.3 | 28.2 | -32.3 | 0 | 0 | 0 | 111.2 | G316 | P314-G316 PolarHBondContact O-N 2.8Š|
| 315 | K | 52.6 | Low | 47.2 | Very low | 202 Ų | 202 | 133.2 Ų | 133.2 | 88% | 0.878 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 122.7 | 178.7 | -177.9 | 178.7 | 179.2 | 179.8 | 0 | 111.3 | ||
| 316 | G | 49.6 | Very low | 47.3 | Very low | 70 Ų | 70 | 136.2 Ų | 136.2 | 72% | 0.722 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 135.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | P314 | P314-G316 PolarHBondContact O-N 2.8Š|
| 317 | E | 49.5 | Very low | 47.3 | Very low | 186 Ų | 186 | 131 Ų | 131 | 87% | 0.869 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 148.8 | 178.7 | -68.7 | -177.5 | 153.5 | 0 | 0 | 112.5 | ||
| 318 | K | 51.1 | Low | 47.2 | Very low | 191 Ų | 191 | 131.1 Ų | 131.1 | 83% | 0.83 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 132.1 | 179.3 | -170.2 | 179.1 | -173.7 | -179.5 | 0 | 110 | ||
| 319 | G | 48 | Very low | 46.9 | Very low | 74 Ų | 74 | 129.9 Ų | 129.9 | 76% | 0.763 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 135.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 320 | H | 45 | Very low | 46.6 | Very low | 181 Ų | 181 | 133.5 Ų | 133.5 | 84% | 0.838 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -84.6 | 138.2 | 173.7 | -70.4 | 73.8 | 0 | 0 | 0 | 110 | ||
| 321 | G | 49.7 | Very low | 46.8 | Very low | 66 Ų | 66 | 133.4 Ų | 133.4 | 68% | 0.68 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 147.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 322 | G | 44.9 | Very low | 46.3 | Very low | 83 Ų | 83 | 134.5 Ų | 134.5 | 86% | 0.856 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 145.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 323 | F | 42.3 | Very low | 45.9 | Very low | 201 Ų | 201 | 136 Ų | 136 | 88% | 0.882 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -92.3 | 149.8 | 175.6 | -73.4 | -81.2 | 0 | 0 | 0 | 112.3 | ||
| 324 | P | 49.1 | Very low | 45.7 | Very low | 119 Ų | 119 | 136.3 Ų | 136.3 | 77% | 0.773 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -73 | 147.4 | -177.9 | -12.8 | 29.2 | 0 | 0 | 0 | 113.7 | ||
| 325 | G | 44.3 | Very low | 44.9 | Very low | 84 Ų | 84 | 138 Ų | 138 | 87% | 0.866 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -83.5 | 140.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 326 | V | 43.1 | Very low | 44.2 | Very low | 141 Ų | 141 | 135.3 Ų | 135.3 | 86% | 0.855 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -94.6 | 155.7 | -177.2 | -107.6 | 0 | 0 | 0 | 0 | 112.6 | ||
| 327 | P | 44.9 | Very low | 44.1 | Very low | 124 Ų | 124 | 135.1 Ų | 135.1 | 81% | 0.805 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 157.6 | -169.7 | -16.4 | 31.1 | 0 | 0 | 0 | 115.6 | ||
| 328 | G | 40.5 | Very low | 44.2 | Very low | 79 Ų | 79 | 132.5 Ų | 132.5 | 81% | 0.814 | 83% | 0.83 | S | S | * | * | trans | -104.8 | 138.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 329 | D | 38.4 | Very low | 43.8 | Very low | 170 Ų | 170 | 131.7 Ų | 131.7 | 91% | 0.909 | 83% | 0.833 | S | S | * | * | trans | -91.3 | 153.7 | -178.7 | -74.4 | -38.8 | 0 | 0 | 0 | 114.2 | ||||
| 330 | K | 43.7 | Very low | 43.7 | Very low | 214 Ų | 214 | 131.4 Ų | 131.4 | 93% | 0.93 | 83% | 0.83 | S | S | * | * | trans | -86.5 | 146.9 | -176.5 | -174.9 | -179.6 | 179.3 | -177.4 | 0 | 111.6 | ||||
| 331 | G | 46.1 | Very low | 43.8 | Very low | 71 Ų | 71 | 127.6 Ų | 127.6 | 73% | 0.732 | 83% | 0.83 | S | S | * | * | trans | -92.5 | -171.6 | -165.2 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 332 | E | 35.4 | Very low | 43.7 | Very low | 201 Ų | 201 | 130.5 Ų | 130.5 | 94% | 0.939 | 84% | 0.837 | S | S | * | * | trans | -138.5 | 154.1 | 176.3 | -74.5 | -169.3 | 151.4 | 0 | 0 | 113.2 | ||||
| 333 | Q | 39.7 | Very low | 43.9 | Very low | 202 Ų | 202 | 130.1 Ų | 130.1 | 94% | 0.944 | 83% | 0.833 | S | S | * | * | trans | -71.6 | 153 | -177.2 | -74.2 | 172.3 | -49.3 | 0 | 0 | 113.7 | ||||
| 334 | G | 45.2 | Very low | 44 | Very low | 71 Ų | 71 | 128.8 Ų | 128.8 | 73% | 0.732 | 83% | 0.834 | S | S | * | * | trans | -113.6 | 168 | -176.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 335 | I | 40.1 | Very low | 43.8 | Very low | 169 Ų | 169 | 131.2 Ų | 131.2 | 87% | 0.867 | 84% | 0.84 | S | S | * | * | trans | -152.8 | 147 | 149.3 | -22 | 170.5 | 0 | 0 | 0 | 111.4 | ||||
| 336 | V | 37 | Very low | 44 | Very low | 144 Ų | 144 | 130.7 Ų | 130.7 | 87% | 0.873 | 84% | 0.835 | S | S | * | * | trans | 88.5 | 114.9 | 168.1 | -164.4 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 337 | G | 47.8 | Very low | 44.3 | Very low | 67 Ų | 67 | 132.6 Ų | 132.6 | 69% | 0.691 | 84% | 0.835 | S | S | * | * | trans | -107.5 | -166.3 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 338 | P | 51.7 | Low | 44.8 | Very low | 130 Ų | 130 | 132.8 Ų | 132.8 | 84% | 0.844 | 84% | 0.836 | S | S | * | * | cis | -126.6 | 132.4 | -6.9 | 35.5 | -17.8 | 0 | 0 | 0 | 113.4 | ||||
| 339 | I | 42.9 | Very low | 45.3 | Very low | 175 Ų | 175 | 132.2 Ų | 132.2 | 90% | 0.897 | 83% | 0.83 | S | S | * | * | S | Bend | trans | -128.2 | 126.4 | 163.3 | -72.6 | 176.5 | 0 | 0 | 0 | 107.9 | ||
| 340 | G | 45.4 | Very low | 45.9 | Very low | 68 Ų | 68 | 130.2 Ų | 130.2 | 70% | 0.701 | 83% | 0.826 | S | S | * | * | S | Bend | trans | 44.8 | 109.8 | 157.7 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||
| 341 | A | 48.6 | Very low | 46.3 | Very low | 101 Ų | 101 | 129 Ų | 129 | 84% | 0.835 | 82% | 0.824 | S | S | * | * | trans | -43.4 | 122.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | G343 | A341-G343 PolarHBondContact O-N 3.17Š| ||
| 342 | P | 47.3 | Very low | 46.4 | Very low | 127 Ų | 127 | 128.9 Ų | 128.9 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | trans | -60.3 | 132.2 | 169 | -21.9 | 32.9 | 0 | 0 | 0 | 111.1 | ||||
| 343 | G | 49.3 | Very low | 47 | Very low | 75 Ų | 75 | 127.6 Ų | 127.6 | 77% | 0.773 | 82% | 0.82 | S | S | * | * | trans | -65.5 | 142.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | A341 | A341-G343 PolarHBondContact O-N 3.17Š| ||
| 344 | L | 44.3 | Very low | 47.6 | Very low | 173 Ų | 173 | 127 Ų | 127 | 91% | 0.906 | 82% | 0.817 | S | S | * | * | trans | -29.3 | 135.1 | 177.3 | -62.8 | 160.8 | 0 | 0 | 0 | 116.2 | G346 | L344-G346 PolarHBondContact O-N 2.84Š| ||
| 345 | D | 43.5 | Very low | 48 | Very low | 169 Ų | 169 | 126.2 Ų | 126.2 | 90% | 0.904 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 126.9 | 165.1 | -77.7 | -35.8 | 0 | 0 | 0 | 111 | ||
| 346 | G | 48.8 | Very low | 48.8 | Very low | 74 Ų | 74 | 124.5 Ų | 124.5 | 76% | 0.763 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 134.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | L344 | L344-G346 PolarHBondContact O-N 2.84Š|
| 347 | Q | 50.2 | Low | 49.6 | Very low | 180 Ų | 180 | 126.4 Ų | 126.4 | 84% | 0.841 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 148.9 | 178 | -63.3 | -173.4 | -5.2 | 0 | 0 | 112.4 | G349 | Q347-G349 PolarHBondContact O-N 2.91Š|
| 348 | P | 55 | Low | 49.7 | Very low | 129 Ų | 129 | 126.3 Ų | 126.3 | 84% | 0.838 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -51 | 128.6 | 168.3 | -24 | 32.8 | 0 | 0 | 0 | 110.9 | ||
| 349 | G | 51.3 | Low | 49.5 | Very low | 66 Ų | 66 | 128 Ų | 128 | 68% | 0.68 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 145 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112 | Q347 | Q347-G349 PolarHBondContact O-N 2.91Š|
| 350 | P | 51.8 | Low | 50.5 | Low | 129 Ų | 129 | 125.5 Ų | 125.5 | 84% | 0.838 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 144.8 | 175.6 | 25.6 | -32.7 | 0 | 0 | 0 | 111 | G352 | P350-G352 PolarHBondContact O-N 2.89Š|
| 351 | Q | 50.2 | Low | 50.6 | Low | 189 Ų | 189 | 125.8 Ų | 125.8 | 88% | 0.883 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 133 | 174.2 | -176.6 | 179.7 | -26.6 | 0 | 0 | 111.4 | I353 | Q351-I353 PolarHBondContact O-N 2.89Š|
| 352 | G | 48.4 | Very low | 50.5 | Low | 68 Ų | 68 | 130.8 Ų | 130.8 | 70% | 0.701 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -57 | 131.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | P350 Q354 | P350-G352 PolarHBondContact O-N 2.89Å; G352-Q354 PolarHBondContact O-N 3.2Å |
| 353 | I | 47.7 | Very low | 50.4 | Low | 173 Ų | 173 | 134.2 Ų | 134.2 | 89% | 0.887 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 125.4 | 164 | 39 | 171.2 | 0 | 0 | 0 | 109.1 | Q351 G355 | Q351-I353 PolarHBondContact O-N 2.89Å; I353-G355 PolarHBondContact O-N 2.95Å |
| 354 | Q | 52.9 | Low | 50 | Low | 189 Ų | 189 | 134.1 Ų | 134.1 | 88% | 0.883 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -58 | 127.8 | 172.6 | -173.8 | 175.2 | 13.2 | 0 | 0 | 109.5 | G352 | G352-Q354 PolarHBondContact O-N 3.2Š|
| 355 | G | 54.3 | Low | 50.1 | Low | 56 Ų | 56 | 134 Ų | 134 | 58% | 0.577 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 146.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | I353 M357 | I353-G355 PolarHBondContact O-N 2.95Å; G355-M357 PolarHBondContact O-N 2.84Å |
| 356 | P | 56.2 | Low | 50 | Low | 132 Ų | 132 | 132.1 Ų | 132.1 | 86% | 0.857 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 125.8 | 171.4 | 25.2 | -31.6 | 0 | 0 | 0 | 109.3 | ||
| 357 | M | 53.2 | Low | 49.8 | Very low | 185 Ų | 185 | 131.8 Ų | 131.8 | 91% | 0.911 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 134.4 | 172.3 | 179.8 | 167.2 | 47.1 | 0 | 0 | 110.2 | G355 | G355-M357 PolarHBondContact O-N 2.84Š|
| 358 | G | 50 | Low | 50 | Low | 64 Ų | 64 | 131.5 Ų | 131.5 | 66% | 0.66 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 147.4 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 359 | L | 49.3 | Very low | 49 | Very low | 166 Ų | 166 | 135.6 Ų | 135.6 | 87% | 0.869 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 130.7 | 171 | -70.7 | 166.2 | 0 | 0 | 0 | 110.3 | ||
| 360 | P | 62.7 | Low | 48.7 | Very low | 123 Ų | 123 | 135.9 Ų | 135.9 | 80% | 0.799 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 138.9 | 169.3 | -23.4 | 33.8 | 0 | 0 | 0 | 111.9 | ||
| 361 | G | 48.6 | Very low | 48.8 | Very low | 74 Ų | 74 | 139.1 Ų | 139.1 | 76% | 0.763 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 143.1 | -168.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 362 | K | 44.7 | Very low | 48 | Very low | 205 Ų | 205 | 138.8 Ų | 138.8 | 89% | 0.891 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -80 | 126.9 | 175 | -49.2 | -179.3 | -175.3 | -175.9 | 0 | 109.1 | ||
| 363 | H | 46.2 | Very low | 47.8 | Very low | 199 Ų | 199 | 138.8 Ų | 138.8 | 92% | 0.921 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 139.5 | 169.4 | -98.7 | 66.1 | 0 | 0 | 0 | 110.8 | ||
| 364 | G | 40.5 | Very low | 48.7 | Very low | 73 Ų | 73 | 137 Ų | 137 | 75% | 0.753 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 156.5 | -165 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 365 | M | 46.5 | Very low | 47.8 | Very low | 172 Ų | 172 | 138.3 Ų | 138.3 | 85% | 0.847 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 152.6 | 172.3 | -71.3 | 178.3 | 51.8 | 0 | 0 | 113 | ||
| 366 | P | 42.5 | Very low | 47.4 | Very low | 128 Ų | 128 | 138.7 Ų | 138.7 | 83% | 0.831 | 83% | 0.83 | S | S | * | * | trans | -109.7 | 136.3 | 141.1 | -6.5 | 26.4 | 0 | 0 | 0 | 113 | ||||
| 367 | G | 43.8 | Very low | 47.5 | Very low | 67 Ų | 67 | 138.5 Ų | 138.5 | 69% | 0.691 | 83% | 0.829 | S | S | * | * | trans | -90.4 | -169.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 368 | L | 54.3 | Low | 46.8 | Very low | 174 Ų | 174 | 135.7 Ų | 135.7 | 91% | 0.911 | 83% | 0.825 | S | S | * | * | cis | -177.1 | 140.9 | -14.6 | -115.7 | 173.3 | 0 | 0 | 0 | 105.5 | ||||
| 369 | K | 34.3 | Very low | 46.6 | Very low | 216 Ų | 216 | 136.2 Ų | 136.2 | 94% | 0.939 | 83% | 0.83 | S | S | * | * | trans | -174.5 | 138 | 155 | -157 | 171.7 | -177.4 | -179.4 | 0 | 109.6 | ||||
| 370 | G | 44.5 | Very low | 46.6 | Very low | 72 Ų | 72 | 136.9 Ų | 136.9 | 74% | 0.742 | 83% | 0.834 | S | S | * | * | cis | -178.6 | 148.8 | -6.8 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 371 | E | 55 | Low | 45.7 | Very low | 197 Ų | 197 | 137.2 Ų | 137.2 | 92% | 0.921 | 84% | 0.836 | S | S | * | * | trans | -74 | 161.2 | -162.3 | -56.8 | 168.6 | 142.4 | 0 | 0 | 117.3 | ||||
| 372 | L | 33.3 | Very low | 45.4 | Very low | 182 Ų | 182 | 137.1 Ų | 137.1 | 95% | 0.953 | 84% | 0.835 | S | S | * | * | trans | -154.1 | 132 | 135.6 | -157.1 | 78 | 0 | 0 | 0 | 110.8 | ||||
| 373 | G | 44 | Very low | 45.9 | Very low | 68 Ų | 68 | 136 Ų | 136 | 70% | 0.701 | 84% | 0.838 | S | S | * | * | trans | -91.1 | -142.8 | -171.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 374 | P | 65.8 | Low | 45.5 | Very low | 136 Ų | 136 | 136.7 Ų | 136.7 | 88% | 0.883 | 84% | 0.838 | S | S | * | * | -115.9 | 163.1 | -113.6 | 30.8 | -15.3 | 0 | 0 | 0 | 113.8 | |||||
| 375 | K | 33.7 | Very low | 45.6 | Very low | 215 Ų | 215 | 136.3 Ų | 136.3 | 94% | 0.935 | 83% | 0.834 | S | S | * | * | trans | -151.8 | 136.4 | 158 | -154.5 | 170.9 | -178.7 | 178 | 0 | 113.1 | ||||
| 376 | G | 45.6 | Very low | 46 | Very low | 64 Ų | 64 | 136.1 Ų | 136.1 | 66% | 0.66 | 84% | 0.837 | S | S | * | * | trans | -84 | -169.1 | -168.9 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 377 | P | 59 | Low | 45.8 | Very low | 128 Ų | 128 | 139.6 Ų | 139.6 | 83% | 0.831 | 84% | 0.842 | S | S | * | * | trans | -93.2 | 154.9 | -155.1 | 37 | -34.6 | 0 | 0 | 0 | 113.8 | ||||
| 378 | P | 38.9 | Very low | 46 | Very low | 127 Ų | 127 | 139.4 Ų | 139.4 | 83% | 0.825 | 84% | 0.84 | S | S | * | * | trans | -138.4 | 132 | 141.1 | 14.2 | 8.3 | 0 | 0 | 0 | 115.8 | ||||
| 379 | G | 44.3 | Very low | 45.9 | Very low | 75 Ų | 75 | 137.4 Ų | 137.4 | 77% | 0.773 | 84% | 0.838 | S | S | * | * | trans | 43.9 | 128.5 | 132.8 | 0 | 0 | 0 | 0 | 0 | 124 | ||||
| 380 | L | 50.6 | Low | 46.5 | Very low | 180 Ų | 180 | 133 Ų | 133 | 94% | 0.942 | 83% | 0.834 | S | S | * | * | trans | -63 | 140 | 166.8 | -67.8 | 157 | 0 | 0 | 0 | 113.7 | ||||
| 381 | P | 42.5 | Very low | 46.5 | Very low | 129 Ų | 129 | 133.1 Ų | 133.1 | 84% | 0.838 | 84% | 0.835 | S | S | * | * | trans | -124.1 | 148 | 134.4 | -1.7 | 23 | 0 | 0 | 0 | 113.3 | ||||
| 382 | G | 42.5 | Very low | 46.1 | Very low | 73 Ų | 73 | 132.1 Ų | 132.1 | 75% | 0.753 | 83% | 0.834 | S | S | * | * | trans | -91.6 | 169.5 | -167.6 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 383 | L | 55.1 | Low | 47.1 | Very low | 181 Ų | 181 | 129.1 Ų | 129.1 | 95% | 0.948 | 83% | 0.826 | S | S | * | * | trans | 42 | 116.7 | 150.9 | -66.6 | 164.9 | 0 | 0 | 0 | 119.8 | ||||
| 384 | K | 39.3 | Very low | 47.2 | Very low | 213 Ų | 213 | 129.6 Ų | 129.6 | 93% | 0.926 | 83% | 0.83 | S | S | * | * | trans | -127.8 | 127.3 | 143.5 | -167.4 | 172.9 | -178.4 | 179.7 | 0 | 109.2 | ||||
| 385 | G | 42.5 | Very low | 46.3 | Very low | 65 Ų | 65 | 134.6 Ų | 134.6 | 67% | 0.67 | 83% | 0.831 | S | S | * | * | trans | -80.7 | -179.7 | -164.3 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 386 | D | 53.9 | Low | 47.6 | Very low | 169 Ų | 169 | 130.6 Ų | 130.6 | 90% | 0.904 | 83% | 0.827 | S | S | * | * | trans | -66.2 | 146.9 | -158.5 | -54.2 | -62.4 | 0 | 0 | 0 | 116.5 | ||||
| 387 | Q | 39.8 | Very low | 47.7 | Very low | 200 Ų | 200 | 131.1 Ų | 131.1 | 94% | 0.935 | 83% | 0.833 | S | S | * | * | trans | -127.6 | 134.1 | 155.7 | -160.6 | 172.7 | 1.4 | 0 | 0 | 109.2 | ||||
| 388 | G | 47.2 | Very low | 47 | Very low | 63 Ų | 63 | 134.8 Ų | 134.8 | 65% | 0.649 | 84% | 0.836 | S | S | * | * | trans | -72.3 | -177.4 | -151.2 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 389 | P | 52.9 | Low | 48.3 | Very low | 133 Ų | 133 | 134.9 Ų | 134.9 | 86% | 0.864 | 84% | 0.836 | S | S | * | * | trans | -79.9 | 143.2 | -165.9 | 33.4 | -33.6 | 0 | 0 | 0 | 111.8 | ||||
| 390 | S | 45.8 | Very low | 48.6 | Very low | 124 Ų | 124 | 135.1 Ų | 135.1 | 87% | 0.867 | 84% | 0.839 | S | S | * | * | trans | -139.6 | 117.7 | 168.5 | -79.4 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 391 | G | 44 | Very low | 48.5 | Very low | 73 Ų | 73 | 136.4 Ų | 136.4 | 75% | 0.753 | 84% | 0.84 | S | S | * | * | trans | 55.3 | 125.1 | 149.4 | 0 | 0 | 0 | 0 | 0 | 120.3 | P393 | G391-P393 WeakPolarHBondContact O-CD 3.15Š| ||
| 392 | I | 47.8 | Very low | 49.1 | Very low | 176 Ų | 176 | 140.3 Ų | 140.3 | 90% | 0.903 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -98.1 | 118.3 | 166.2 | -50.2 | 168.1 | 0 | 0 | 0 | 109.3 | ||
| 393 | P | 53.3 | Low | 49.4 | Very low | 120 Ų | 120 | 140.1 Ų | 140.1 | 78% | 0.779 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -92.1 | 149.3 | 163.2 | -13.8 | 32 | 0 | 0 | 0 | 113.5 | G391 | G391-P393 WeakPolarHBondContact O-CD 3.15Š|
| 394 | G | 45.7 | Very low | 49.2 | Very low | 77 Ų | 77 | 140 Ų | 140 | 79% | 0.794 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -80 | 173.1 | -156.9 | 0 | 0 | 0 | 0 | 0 | 120 | ||
| 395 | R | 48.7 | Very low | 49.8 | Very low | 242 Ų | 242 | 135.2 Ų | 135.2 | 91% | 0.913 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -79 | 137 | -176.2 | -71.2 | -178.6 | 175.3 | -158.2 | -1.3 | 113.9 | ||
| 396 | P | 60.8 | Low | 50.5 | Low | 131 Ų | 131 | 135.2 Ų | 135.2 | 85% | 0.851 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 149.8 | 159.8 | -17.9 | 32.8 | 0 | 0 | 0 | 113.7 | ||
| 397 | G | 47.5 | Very low | 50.6 | Low | 75 Ų | 75 | 133.5 Ų | 133.5 | 77% | 0.773 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -89.4 | 173.4 | -166.4 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||
| 398 | F | 44.8 | Very low | 51 | Low | 204 Ų | 204 | 131.9 Ų | 131.9 | 90% | 0.895 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 138.9 | -174.7 | -72.3 | -90.2 | 0 | 0 | 0 | 114.4 | ||
| 399 | P | 64.6 | Low | 51.3 | Low | 129 Ų | 129 | 131.6 Ų | 131.6 | 84% | 0.838 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -76 | 141.3 | 161.1 | -15.8 | 31.3 | 0 | 0 | 0 | 113 | ||
| 400 | G | 51.6 | Low | 51.3 | Low | 81 Ų | 81 | 131.8 Ų | 131.8 | 84% | 0.835 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 168.7 | -165.1 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||
| 401 | E | 48.7 | Very low | 51.3 | Low | 206 Ų | 206 | 133.9 Ų | 133.9 | 96% | 0.963 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 140.6 | -177.1 | -70.2 | 177.8 | 141.7 | 0 | 0 | 114.2 | ||
| 402 | K | 54 | Low | 51.5 | Low | 211 Ų | 211 | 133.3 Ų | 133.3 | 92% | 0.917 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -97.5 | 130.7 | 169.6 | -148.8 | 177.6 | -168.7 | 179.6 | 0 | 109.3 | ||
| 403 | G | 50.2 | Low | 51.6 | Low | 69 Ų | 69 | 134.9 Ų | 134.9 | 71% | 0.711 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 160.9 | -165.5 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||
| 404 | I | 50 | Low | 51.7 | Low | 178 Ų | 178 | 135.4 Ų | 135.4 | 91% | 0.913 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 125.7 | -177.3 | -22.4 | 171.2 | 0 | 0 | 0 | 110.1 | ||
| 405 | S | 52.8 | Low | 51.8 | Low | 114 Ų | 114 | 134.7 Ų | 134.7 | 80% | 0.797 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -89.3 | 139.7 | 168.5 | -64.1 | 0 | 0 | 0 | 0 | 110.3 | ||
| 406 | G | 55.7 | Low | 51.8 | Low | 65 Ų | 65 | 129.6 Ų | 129.6 | 67% | 0.67 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 168.4 | -173.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | N408 | G406-N408 PolarHBondContact O-N 3.17Š|
| 407 | P | 57.1 | Low | 51.2 | Low | 133 Ų | 133 | 133.4 Ų | 133.4 | 86% | 0.864 | 82% | 0.82 | S | S | * | * | trans | -76 | 113.8 | -175.5 | 30.1 | -31.1 | 0 | 0 | 0 | 110.8 | ||||
| 408 | N | 48.5 | Very low | 51.1 | Low | 166 Ų | 166 | 132.9 Ų | 132.9 | 89% | 0.888 | 81% | 0.814 | S | S | * | * | trans | -77.9 | 136.6 | 165.1 | -94.7 | -3.4 | 0 | 0 | 0 | 110.3 | G406 | G406-N408 PolarHBondContact O-N 3.17Š| ||
| 409 | G | 53.3 | Low | 51.2 | Low | 56 Ų | 56 | 132.4 Ų | 132.4 | 58% | 0.577 | 81% | 0.814 | S | S | * | * | trans | -64.6 | 175 | -174.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | I411 | G409-I411 PolarHBondContact O-N 2.75Å; G409-I411 VanDerWaalsContact O-N 3.14Å | ||
| 410 | P | 52 | Low | 50.3 | Low | 138 Ų | 138 | 129.8 Ų | 129.8 | 90% | 0.896 | 80% | 0.797 | S | S | * | * | trans | -66.2 | 115.6 | -172.1 | 27.4 | -32.6 | 0 | 0 | 0 | 110.9 | ||||
| 411 | I | 46.4 | Very low | 49.9 | Very low | 168 Ų | 168 | 127.2 Ų | 127.2 | 86% | 0.862 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 127.2 | 168.9 | -72.1 | 173.2 | 0 | 0 | 0 | 108.6 | G409 | G409-I411 PolarHBondContact O-N 2.75Å; G409-I411 VanDerWaalsContact O-N 3.14Å |
| 412 | G | 48.8 | Very low | 49.9 | Very low | 60 Ų | 60 | 126.1 Ų | 126.1 | 62% | 0.619 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 155.4 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | P414 | G412-P414 WeakPolarHBondContact O-CD 2.91Š|
| 413 | K | 48.6 | Very low | 49.3 | Very low | 209 Ų | 209 | 123.4 Ų | 123.4 | 91% | 0.909 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 124.3 | 179.7 | -61.2 | -179.5 | -178.8 | -177.6 | 0 | 111.2 | G415 | K413-G415 PolarHBondContact O-N 3.14Š|
| 414 | P | 55.4 | Low | 49 | Very low | 131 Ų | 131 | 123.5 Ų | 123.5 | 85% | 0.851 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 130.9 | 166.6 | -22 | 33.9 | 0 | 0 | 0 | 110.7 | G412 | G412-P414 WeakPolarHBondContact O-CD 2.91Š|
| 415 | G | 49.5 | Very low | 48.6 | Very low | 62 Ų | 62 | 124 Ų | 124 | 64% | 0.639 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 159.6 | -178 | 0 | 0 | 0 | 0 | 0 | 113.8 | K413 K417 | K413-G415 PolarHBondContact O-N 3.14Å; G415-K417 PolarHBondContact O-N 3.21Å |
| 416 | P | 48.5 | Very low | 48.2 | Very low | 136 Ų | 136 | 125 Ų | 125 | 88% | 0.883 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 124.7 | -176.4 | 27.1 | -33.1 | 0 | 0 | 0 | 110.7 | G418 | P416-G418 PolarHBondContact O-N 3.41Š|
| 417 | K | 46.9 | Very low | 47.8 | Very low | 211 Ų | 211 | 125.4 Ų | 125.4 | 92% | 0.917 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 120.4 | 173.6 | -168.9 | 174.6 | -179.3 | 179.3 | 0 | 108.6 | G415 | G415-K417 PolarHBondContact O-N 3.21Š|
| 418 | G | 46.8 | Very low | 47.2 | Very low | 63 Ų | 63 | 126.5 Ų | 126.5 | 65% | 0.649 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 150.4 | -168.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | P416 P420 | P416-G418 PolarHBondContact O-N 3.41Å; G418-P420 WeakPolarHBondContact O-CD 2.76Å |
| 419 | E | 45.8 | Very low | 46.9 | Very low | 194 Ų | 194 | 125.1 Ų | 125.1 | 91% | 0.907 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 130.9 | 177.6 | -61.7 | -178.6 | 159.1 | 0 | 0 | 111.7 | ||
| 420 | P | 46.7 | Very low | 46.6 | Very low | 74 Ų | 74 | 126 Ų | 126 | 48% | 0.481 | 78% | 0.776 | S | S | . | * | P | Polyproline II helix | trans | -98.3 | 128 | 149.7 | 26.7 | -9.3 | 0 | 0 | 0 | 104.4 | G418 G445 | G418-P420 WeakPolarHBondContact O-CD 2.76Å; P420-G445 VanDerWaalsContact CA-N 3.31Å; P420-G445 VanDerWaalsContact CB-N 3.25Å; P420-G445 CarbonylContact O-C 3.54Å; P420-G445 WeakPolarHBondContact O-CA 3.46Å; P420-G445 PolarHBondContact O-N 3.02Å; P420-G445 VanDerWaalsContact O-O 3.13Å |
| 421 | G | 43.2 | Very low | 46.3 | Very low | 28 Ų | 28 | 128.1 Ų | 128.1 | 29% | 0.289 | 78% | 0.778 | S | S | . | * | trans | -132.3 | 125.8 | -168.2 | 0 | 0 | 0 | 0 | 0 | 122 | I444 | G421-I444 VanDerWaalsContact N-CA 3.27Å; G421-I444 VanDerWaalsContact N-CG1 3.33Å; G421-I444 WeakPolarHBondContact O-CB 3.45Å; G421-I444 WeakPolarHBondContact O-CD1 3.26Å; G421-I444 WeakPolarHBondContact O-CG1 3.04Å; G421-I444 WeakPolarHBondContact O-CG2 3.46Å | ||
| 422 | Q | 47.3 | Very low | 46 | Very low | 182 Ų | 182 | 127 Ų | 127 | 85% | 0.85 | 78% | 0.779 | S | S | * | * | trans | 66.9 | 98.9 | 164.7 | -64.7 | -173.6 | 0.2 | 0 | 0 | 121 | I444 | Q422-I444 WeakPolarHBondContact O-CG2 2.81Š| ||
| 423 | I | 41.1 | Very low | 45.9 | Very low | 155 Ų | 155 | 127.5 Ų | 127.5 | 80% | 0.795 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -95.5 | 125.5 | 151.3 | -68.3 | 172.3 | 0 | 0 | 0 | 108.4 | I444 | I423-I444 HydrophobicContact CG1-CG2 4.15Š|
| 424 | G | 44.3 | Very low | 45.6 | Very low | 70 Ų | 70 | 123 Ų | 123 | 72% | 0.722 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 172.5 | -175.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 425 | Q | 41.9 | Very low | 45.5 | Very low | 189 Ų | 189 | 122.9 Ų | 122.9 | 88% | 0.883 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 148.8 | -177.5 | -66.6 | 177.8 | -4.5 | 0 | 0 | 114 | G427 | Q425-G427 PolarHBondContact O-N 3.32Š|
| 426 | P | 44.2 | Very low | 45.1 | Very low | 135 Ų | 135 | 123.3 Ų | 123.3 | 88% | 0.877 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 123.7 | 168.5 | -13.9 | 28.4 | 0 | 0 | 0 | 111.5 | ||
| 427 | G | 48.3 | Very low | 44.9 | Very low | 73 Ų | 73 | 123.4 Ų | 123.4 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -97.6 | 155.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q425 | Q425-G427 PolarHBondContact O-N 3.32Š|
| 428 | N | 42.8 | Very low | 44.9 | Very low | 157 Ų | 157 | 121.3 Ų | 121.3 | 84% | 0.84 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 157.1 | 176.3 | -70.1 | -32.5 | 0 | 0 | 0 | 113.6 | G430 | N428-G430 PolarHBondContact O-N 2.93Š|
| 429 | P | 43.8 | Very low | 44.8 | Very low | 136 Ų | 136 | 122 Ų | 122 | 88% | 0.883 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 133.5 | -179.5 | -19.5 | 30.7 | 0 | 0 | 0 | 112.8 | ||
| 430 | G | 46.2 | Very low | 44.6 | Very low | 76 Ų | 76 | 120 Ų | 120 | 78% | 0.784 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -98.9 | 142.5 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | N428 | N428-G430 PolarHBondContact O-N 2.93Š|
| 431 | L | 45.3 | Very low | 44.5 | Very low | 181 Ų | 181 | 121 Ų | 121 | 95% | 0.948 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 147 | 167.3 | -81.2 | 159.9 | 0 | 0 | 0 | 111.7 | ||
| 432 | T | 40.8 | Very low | 44.4 | Very low | 144 Ų | 144 | 123 Ų | 123 | 88% | 0.883 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 135 | -177.1 | -46.5 | 0 | 0 | 0 | 0 | 114.1 | ||
| 433 | G | 45.6 | Very low | 44.2 | Very low | 72 Ų | 72 | 123.7 Ų | 123.7 | 74% | 0.742 | 81% | 0.808 | S | S | * | * | trans | -146.5 | 133.2 | 156.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 434 | S | 42.4 | Very low | 44.5 | Very low | 114 Ų | 114 | 120.5 Ų | 120.5 | 80% | 0.797 | 79% | 0.792 | S | S | * | * | trans | -87.9 | 179.8 | -167.2 | 64.1 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 435 | P | 54.7 | Low | 44.5 | Very low | 129 Ų | 129 | 118 Ų | 118 | 84% | 0.838 | 77% | 0.767 | S | S | * | * | -114.6 | 168.5 | -108 | 14.4 | 10.5 | 0 | 0 | 0 | 114 | |||||
| 436 | G | 39.6 | Very low | 44.6 | Very low | 71 Ų | 71 | 115.4 Ų | 115.4 | 73% | 0.732 | 76% | 0.764 | S | S | * | * | trans | 173.9 | 145.6 | 161.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 437 | P | 45.6 | Very low | 45.2 | Very low | 137 Ų | 137 | 115 Ų | 115 | 89% | 0.89 | 76% | 0.761 | S | S | * | * | trans | -94.7 | 155.7 | -138.6 | 35.2 | -34.5 | 0 | 0 | 0 | 117.2 | ||||
| 438 | K | 46.8 | Very low | 45.4 | Very low | 168 Ų | 168 | 114.9 Ų | 114.9 | 73% | 0.73 | 76% | 0.759 | S | S | * | * | trans | -33.4 | 135.9 | 172.5 | -166.4 | -179.6 | -179.2 | -160.5 | 0 | 118.4 | E440 | K438-E440 HydrophobicContact CD-CG 4.45Å; K438-E440 WeakPolarHBondContact CE-OE1 3.1Å; K438-E440 HydrophobicContact CG-CG 4.36Å; K438-E440 IonicContact NZ-OE1 2.68Å; K438-E440 PolarHBondContact NZ-OE1 3.3Å | ||
| 439 | G | 44.2 | Very low | 45.7 | Very low | 77 Ų | 77 | 113.7 Ų | 113.7 | 79% | 0.794 | 76% | 0.76 | S | S | * | * | trans | -134.6 | 127.7 | 150.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 440 | E | 41.5 | Very low | 45.8 | Very low | 152 Ų | 152 | 118.1 Ų | 118.1 | 71% | 0.71 | 76% | 0.759 | S | S | * | * | trans | -77.4 | 126.7 | -168.5 | -69.8 | 174.7 | 157.1 | 0 | 0 | 113.1 | K438 | K438-E440 HydrophobicContact CD-CG 4.45Å; K438-E440 WeakPolarHBondContact CE-OE1 3.1Å; K438-E440 HydrophobicContact CG-CG 4.36Å; K438-E440 IonicContact NZ-OE1 2.68Å; K438-E440 PolarHBondContact NZ-OE1 3.3Å | ||
| 441 | A | 44.8 | Very low | 46 | Very low | 94 Ų | 94 | 117.5 Ų | 117.5 | 78% | 0.777 | 75% | 0.754 | S | S | * | * | 83.7 | 111.3 | 99.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 442 | G | 42 | Very low | 45.8 | Very low | 72 Ų | 72 | 118.3 Ų | 118.3 | 74% | 0.742 | 75% | 0.752 | S | S | * | * | trans | -139.9 | 121.7 | 161.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 443 | F | 43.2 | Very low | 46 | Very low | 196 Ų | 196 | 116.7 Ų | 116.7 | 86% | 0.86 | 75% | 0.747 | S | S | * | * | trans | -77.3 | 141.4 | -175.2 | -84.9 | -89.9 | 0 | 0 | 0 | 113.1 | ||||
| 444 | I | 46 | Very low | 46.1 | Very low | 87 Ų | 87 | 116.5 Ų | 116.5 | 45% | 0.446 | 75% | 0.745 | S | S | . | * | trans | -115.8 | 159.6 | -179.2 | -102 | 166.1 | 0 | 0 | 0 | 105 | G421 Q422 I423 | G421-I444 VanDerWaalsContact N-CA 3.27Å; G421-I444 VanDerWaalsContact N-CG1 3.33Å; G421-I444 WeakPolarHBondContact O-CB 3.45Å; G421-I444 WeakPolarHBondContact O-CD1 3.26Å; G421-I444 WeakPolarHBondContact O-CG1 3.04Å; G421-I444 WeakPolarHBondContact O-CG2 3.46Å; Q422-I444 WeakPolarHBondContact O-CG2 2.81Å; I423-I444 HydrophobicContact CG1-CG2 4.15Å | ||
| 445 | G | 44.3 | Very low | 46.1 | Very low | 19 Ų | 19 | 118.9 Ų | 118.9 | 20% | 0.196 | 75% | 0.747 | C | S | . | * | trans | -135.2 | 169.3 | -146.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | P420 | P420-G445 VanDerWaalsContact CA-N 3.31Å; P420-G445 VanDerWaalsContact CB-N 3.25Å; P420-G445 CarbonylContact O-C 3.54Å; P420-G445 WeakPolarHBondContact O-CA 3.46Å; P420-G445 PolarHBondContact O-N 3.02Å; P420-G445 VanDerWaalsContact O-O 3.13Å | ||
| 446 | T | 44.9 | Very low | 46.2 | Very low | 134 Ų | 134 | 118.5 Ų | 118.5 | 82% | 0.822 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -98.7 | 134 | -162.5 | 49.6 | 0 | 0 | 0 | 0 | 111.5 | ||
| 447 | P | 57 | Low | 46.6 | Very low | 127 Ų | 127 | 118.6 Ų | 118.6 | 83% | 0.825 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 149.3 | 175.2 | -27.4 | 34.6 | 0 | 0 | 0 | 114.7 | ||
| 448 | G | 52.7 | Low | 46.6 | Very low | 69 Ų | 69 | 120.4 Ų | 120.4 | 71% | 0.711 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 152.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 449 | P | 49.2 | Very low | 46.8 | Very low | 132 Ų | 132 | 121.4 Ų | 121.4 | 86% | 0.857 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 136.7 | 177 | 26.4 | -32.2 | 0 | 0 | 0 | 112.1 | G451 | P449-G451 PolarHBondContact O-N 3.15Š|
| 450 | R | 45.6 | Very low | 47.2 | Very low | 229 Ų | 229 | 120.2 Ų | 120.2 | 86% | 0.864 | 74% | 0.741 | S | S | * | * | trans | -42.6 | 120.4 | 170 | -174.7 | 176.8 | -177.9 | 169.5 | 0.7 | 111.7 | ||||
| 451 | G | 50.3 | Low | 48 | Very low | 64 Ų | 64 | 119.2 Ų | 119.2 | 66% | 0.66 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 142.2 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111 | P449 S453 | P449-G451 PolarHBondContact O-N 3.15Å; G451-S453 PolarHBondContact O-N 3.19Å |
| 452 | Q | 40.5 | Very low | 48.6 | Very low | 198 Ų | 198 | 123.6 Ų | 123.6 | 93% | 0.925 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 135.5 | 170.4 | -75.4 | 176.3 | -19.8 | 0 | 0 | 110 | G454 | Q452-G454 PolarHBondContact O-N 3.36Š|
| 453 | S | 44.3 | Very low | 49.3 | Very low | 110 Ų | 110 | 122.6 Ų | 122.6 | 77% | 0.769 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 126.9 | 174.8 | -49.9 | 0 | 0 | 0 | 0 | 110.7 | G451 | G451-S453 PolarHBondContact O-N 3.19Š|
| 454 | G | 47.7 | Very low | 50.1 | Low | 68 Ų | 68 | 119.4 Ų | 119.4 | 70% | 0.701 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 145.5 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q452 | Q452-G454 PolarHBondContact O-N 3.36Š|
| 455 | I | 42.7 | Very low | 50.7 | Low | 164 Ų | 164 | 124 Ų | 124 | 84% | 0.841 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 128.2 | 170 | -52 | 167.6 | 0 | 0 | 0 | 107.7 | G457 | I455-G457 PolarHBondContact O-N 3.38Š|
| 456 | P | 56.9 | Low | 51.2 | Low | 121 Ų | 121 | 125.6 Ų | 125.6 | 79% | 0.786 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 127.2 | 171.2 | -24.9 | 33.9 | 0 | 0 | 0 | 110.2 | ||
| 457 | G | 48.5 | Very low | 51.8 | Low | 72 Ų | 72 | 125.4 Ų | 125.4 | 74% | 0.742 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 142.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | I455 Q459 | I455-G457 PolarHBondContact O-N 3.38Å; G457-Q459 PolarHBondContact O-N 3.28Å |
| 458 | L | 44.7 | Very low | 52 | Low | 176 Ų | 176 | 128.1 Ų | 128.1 | 92% | 0.921 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 125.4 | 167.3 | -75.6 | 161.6 | 0 | 0 | 0 | 108.8 | G460 | L458-G460 PolarHBondContact O-N 3.28Š|
| 459 | Q | 50.9 | Low | 51.8 | Low | 188 Ų | 188 | 127.8 Ų | 127.8 | 88% | 0.879 | 78% | 0.781 | S | S | * | * | trans | -56.6 | 115.1 | 173.9 | -172.8 | 174.1 | 8 | 0 | 0 | 108.1 | G457 | G457-Q459 PolarHBondContact O-N 3.28Š| ||
| 460 | G | 54.4 | Low | 52 | Low | 52 Ų | 52 | 125.9 Ų | 125.9 | 54% | 0.536 | 78% | 0.777 | S | S | . | * | P | Polyproline II helix | trans | -57.9 | 150.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | L458 M462 | L458-G460 PolarHBondContact O-N 3.28Å; G460-M462 PolarHBondContact O-N 3.18Å |
| 461 | P | 57 | Low | 53 | Low | 132 Ų | 132 | 120.7 Ų | 120.7 | 86% | 0.857 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 129.9 | 175.4 | 23.2 | -32.2 | 0 | 0 | 0 | 109 | G463 | P461-G463 PolarHBondContact O-N 3.27Å; P461-G463 VanDerWaalsContact O-N 3.15Å |
| 462 | M | 57.8 | Low | 53.2 | Low | 185 Ų | 185 | 120.7 Ų | 120.7 | 91% | 0.911 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 122.2 | 177.5 | -171.4 | 169 | 66.3 | 0 | 0 | 108.8 | G460 | G460-M462 PolarHBondContact O-N 3.18Š|
| 463 | G | 56.8 | Low | 54.1 | Low | 52 Ų | 52 | 117.5 Ų | 117.5 | 54% | 0.536 | 77% | 0.769 | S | S | . | * | P | Polyproline II helix | trans | -57.4 | 149.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | P461 M465 | P461-G463 PolarHBondContact O-N 3.27Å; P461-G463 VanDerWaalsContact O-N 3.15Å; G463-M465 PolarHBondContact O-N 3.32Å |
| 464 | P | 59.3 | Low | 54.7 | Low | 128 Ų | 128 | 123.9 Ų | 123.9 | 83% | 0.831 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 132.6 | 177.5 | 23.6 | -32.3 | 0 | 0 | 0 | 109.4 | G466 | P464-G466 PolarHBondContact O-N 3.2Å; P464-G466 VanDerWaalsContact O-N 3.15Å |
| 465 | M | 58.8 | Low | 55 | Low | 185 Ų | 185 | 123.9 Ų | 123.9 | 91% | 0.911 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 121.7 | 175 | -174.3 | 170.7 | 67.2 | 0 | 0 | 108.8 | G463 | G463-M465 PolarHBondContact O-N 3.32Š|
| 466 | G | 56.2 | Low | 55.5 | Low | 52 Ų | 52 | 125.4 Ų | 125.4 | 54% | 0.536 | 78% | 0.78 | S | S | . | * | P | Polyproline II helix | trans | -56.6 | 146 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | P464 Q468 | P464-G466 PolarHBondContact O-N 3.2Å; P464-G466 VanDerWaalsContact O-N 3.15Å; G466-Q468 PolarHBondContact O-N 3.27Å |
| 467 | P | 57.4 | Low | 55.3 | Low | 130 Ų | 130 | 124.4 Ų | 124.4 | 84% | 0.844 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 133.3 | 179 | 23.2 | -32 | 0 | 0 | 0 | 109.5 | G469 | P467-G469 PolarHBondContact O-N 3.46Å; P467-G469 VanDerWaalsContact O-N 3.14Å |
| 468 | Q | 59.9 | Low | 55.4 | Low | 184 Ų | 184 | 124.5 Ų | 124.5 | 86% | 0.86 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -49.1 | 120.9 | 175.8 | -178.8 | 177 | -20.4 | 0 | 0 | 109.1 | G466 A470 | G466-Q468 PolarHBondContact O-N 3.27Å; Q468-A470 PolarHBondContact O-N 3.38Å |
| 469 | G | 49.5 | Very low | 55.7 | Low | 62 Ų | 62 | 124 Ų | 124 | 64% | 0.639 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 133.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | P467 | P467-G469 PolarHBondContact O-N 3.46Å; P467-G469 VanDerWaalsContact O-N 3.14Å |
| 470 | A | 52.2 | Low | 56 | Low | 92 Ų | 92 | 121.1 Ų | 121.1 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 137.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | Q468 G472 | Q468-A470 PolarHBondContact O-N 3.38Å; A470-G472 PolarHBondContact O-N 3.48Å |
| 471 | P | 67.2 | Low | 55.7 | Low | 119 Ų | 119 | 121.8 Ų | 121.8 | 77% | 0.773 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 126.4 | 174.5 | -24.4 | 32.7 | 0 | 0 | 0 | 109.7 | ||
| 472 | G | 55.6 | Low | 55.4 | Low | 64 Ų | 64 | 121.4 Ų | 121.4 | 66% | 0.66 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -56 | 141.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | A470 R474 | A470-G472 PolarHBondContact O-N 3.48Å; G472-R474 PolarHBondContact O-N 3.5Å |
| 473 | P | 57.5 | Low | 55 | Low | 131 Ų | 131 | 119 Ų | 119 | 85% | 0.851 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 131.3 | 179.9 | 23.1 | -31.9 | 0 | 0 | 0 | 109.4 | G475 | P473-G475 PolarHBondContact O-N 2.92Å; P473-G475 VanDerWaalsContact O-N 3.13Å |
| 474 | R | 58.4 | Low | 54.5 | Low | 244 Ų | 244 | 119.9 Ų | 119.9 | 92% | 0.921 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 119.1 | 175.3 | -175.4 | 178.4 | -174.5 | 172.2 | 1.3 | 107.9 | G472 E476 | G472-R474 PolarHBondContact O-N 3.5Å; R474-E476 PolarHBondContact O-N 2.86Å |
| 475 | G | 53.5 | Low | 53.5 | Low | 68 Ų | 68 | 122.5 Ų | 122.5 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 132.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | P473 | P473-G475 PolarHBondContact O-N 2.92Å; P473-G475 VanDerWaalsContact O-N 3.13Å |
| 476 | E | 52.5 | Low | 52.9 | Low | 196 Ų | 196 | 116.9 Ų | 116.9 | 92% | 0.916 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 139 | 175.9 | -70.9 | -176.7 | 160.7 | 0 | 0 | 110.3 | R474 G478 | R474-E476 PolarHBondContact O-N 2.86Å; E476-G478 PolarHBondContact O-N 2.85Å |
| 477 | A | 53.9 | Low | 52.1 | Low | 100 Ų | 100 | 124.5 Ų | 124.5 | 83% | 0.826 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 122 | 178.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||
| 478 | G | 48.9 | Very low | 51.8 | Low | 74 Ų | 74 | 127 Ų | 127 | 76% | 0.763 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 136.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | E476 | E476-G478 PolarHBondContact O-N 2.85Š|
| 479 | L | 51 | Low | 51.4 | Low | 167 Ų | 167 | 121.2 Ų | 121.2 | 87% | 0.874 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 140.9 | 177.4 | -72.3 | 166.5 | 0 | 0 | 0 | 111.1 | G481 | L479-G481 PolarHBondContact O-N 2.95Š|
| 480 | P | 57.4 | Low | 51.2 | Low | 127 Ų | 127 | 126.1 Ų | 126.1 | 83% | 0.825 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 128.1 | 178.5 | -20.7 | 31.6 | 0 | 0 | 0 | 112 | ||
| 481 | G | 49.3 | Very low | 51.2 | Low | 66 Ų | 66 | 131.7 Ų | 131.7 | 68% | 0.68 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 148.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | L479 | L479-G481 PolarHBondContact O-N 2.95Š|
| 482 | P | 50.8 | Low | 50.6 | Low | 123 Ų | 123 | 129.1 Ų | 129.1 | 80% | 0.799 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 154.6 | -176.2 | 30.4 | -33.4 | 0 | 0 | 0 | 112.4 | ||
| 483 | P | 48.1 | Very low | 50.2 | Low | 134 Ų | 134 | 131.8 Ų | 131.8 | 87% | 0.87 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 124.4 | -171.2 | -6.4 | 24.2 | 0 | 0 | 0 | 113.4 | ||
| 484 | G | 46.3 | Very low | 50.3 | Low | 71 Ų | 71 | 133.9 Ų | 133.9 | 73% | 0.732 | 82% | 0.821 | S | S | * | * | trans | 78.8 | 120.4 | 134.6 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 485 | L | 39.4 | Very low | 50.4 | Low | 183 Ų | 183 | 124.8 Ų | 124.8 | 96% | 0.958 | 80% | 0.804 | S | S | * | * | -159 | 131.8 | 128.2 | -143.6 | 84.5 | 0 | 0 | 0 | 109.6 | |||||
| 486 | G | 46 | Very low | 50.4 | Low | 68 Ų | 68 | 127.8 Ų | 127.8 | 70% | 0.701 | 81% | 0.811 | S | S | * | * | trans | -79.4 | 163.9 | -166.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 487 | K | 39.9 | Very low | 51.2 | Low | 211 Ų | 211 | 127 Ų | 127 | 92% | 0.917 | 81% | 0.807 | S | S | * | * | -167.3 | 133.1 | 128.9 | -99.4 | 171.5 | -170.3 | -173.1 | 0 | 108.5 | G489 | K487-G489 PolarHBondContact O-N 2.83Š| |||
| 488 | L | 51.3 | Low | 51.4 | Low | 183 Ų | 183 | 124.8 Ų | 124.8 | 96% | 0.958 | 79% | 0.794 | S | S | * | * | trans | -60.1 | 126 | 179.2 | -174.7 | 73 | 0 | 0 | 0 | 110 | ||||
| 489 | G | 51.3 | Low | 51.9 | Low | 63 Ų | 63 | 127 Ų | 127 | 65% | 0.649 | 80% | 0.795 | S | S | * | * | trans | -140.3 | 139.5 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | K487 | K487-G489 PolarHBondContact O-N 2.83Š| ||
| 490 | D | 45.2 | Very low | 52.9 | Low | 165 Ų | 165 | 125 Ų | 125 | 88% | 0.882 | 79% | 0.792 | S | S | * | * | trans | -52.2 | 139.9 | -160.4 | -61.6 | -57 | 0 | 0 | 0 | 115.9 | G492 | D490-G492 PolarHBondContact O-N 2.95Š| ||
| 491 | K | 52.6 | Low | 53 | Low | 209 Ų | 209 | 122.4 Ų | 122.4 | 91% | 0.909 | 79% | 0.789 | S | S | * | * | trans | -64.3 | 105.7 | 178.6 | -172.3 | 178.1 | -170 | 176.6 | 0 | 109.9 | S493 | K491-S493 PolarHBondContact O-N 2.88Š| ||
| 492 | G | 54.4 | Low | 53.6 | Low | 65 Ų | 65 | 128.8 Ų | 128.8 | 67% | 0.67 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 134.2 | 168 | 0 | 0 | 0 | 0 | 0 | 111.1 | D490 M494 | D490-G492 PolarHBondContact O-N 2.95Å; G492-M494 PolarHBondContact O-N 3.29Å |
| 493 | S | 47.4 | Very low | 54.5 | Low | 120 Ų | 120 | 128.9 Ų | 128.9 | 84% | 0.839 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 131.1 | 176.5 | 50.3 | 0 | 0 | 0 | 0 | 111 | K491 G495 | K491-S493 PolarHBondContact O-N 2.88Å; S493-G495 PolarHBondContact O-N 3.44Å |
| 494 | M | 59.4 | Low | 55.1 | Low | 174 Ų | 174 | 125.4 Ų | 125.4 | 86% | 0.857 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 124.8 | 177.7 | -158.7 | 168.4 | 72.8 | 0 | 0 | 109.5 | G492 | G492-M494 PolarHBondContact O-N 3.29Š|
| 495 | G | 59.8 | Low | 55.8 | Low | 53 Ų | 53 | 128.1 Ų | 128.1 | 55% | 0.546 | 79% | 0.791 | S | S | . | * | P | Polyproline II helix | trans | -56.8 | 147.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | S493 Q497 | S493-G495 PolarHBondContact O-N 3.44Å; G495-Q497 PolarHBondContact O-N 2.89Å |
| 496 | P | 54.2 | Low | 57.2 | Low | 132 Ų | 132 | 125 Ų | 125 | 86% | 0.857 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -57 | 128.5 | -176.3 | 23.3 | -32.3 | 0 | 0 | 0 | 110 | G498 | P496-G498 PolarHBondContact O-N 2.85Š|
| 497 | Q | 67.6 | Low | 57.8 | Low | 179 Ų | 179 | 125 Ų | 125 | 84% | 0.836 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 125 | 175.2 | -173.8 | 175 | 2.4 | 0 | 0 | 108.7 | G495 | G495-Q497 PolarHBondContact O-N 2.89Š|
| 498 | G | 59.8 | Low | 58.3 | Low | 53 Ų | 53 | 123.5 Ų | 123.5 | 55% | 0.546 | 79% | 0.786 | S | S | . | * | P | Polyproline II helix | trans | -56.7 | 146.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | P496 | P496-G498 PolarHBondContact O-N 2.85Š|
| 499 | P | 57.8 | Low | 59.1 | Low | 121 Ų | 121 | 122.3 Ų | 122.3 | 79% | 0.786 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 141.3 | -176.9 | 23 | -32.4 | 0 | 0 | 0 | 110.5 | G501 | P499-G501 PolarHBondContact O-N 2.83Š|
| 500 | P | 72.4 | Confident | 59.4 | Low | 125 Ų | 125 | 122.7 Ų | 122.7 | 81% | 0.812 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -51 | 134.1 | 175 | -25.9 | 33.6 | 0 | 0 | 0 | 110.8 | K502 | P500-K502 PolarHBondContact O-N 2.86Š|
| 501 | G | 60.7 | Low | 59.9 | Low | 73 Ų | 73 | 123.4 Ų | 123.4 | 75% | 0.753 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 135.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | P499 | P499-G501 PolarHBondContact O-N 2.83Š|
| 502 | K | 60.6 | Low | 60.8 | Low | 199 Ų | 199 | 119.3 Ų | 119.3 | 87% | 0.865 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 134.6 | 177.4 | -66.8 | -175.1 | 179.5 | -175.1 | 0 | 109.3 | P500 G504 | P500-K502 PolarHBondContact O-N 2.86Å; K502-G504 PolarHBondContact O-N 2.99Å |
| 503 | P | 69.9 | Low | 61.2 | Low | 126 Ų | 126 | 119.2 Ų | 119.2 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 136.2 | 172.5 | -26.1 | 33.9 | 0 | 0 | 0 | 110.2 | ||
| 504 | G | 60.4 | Low | 62 | Low | 61 Ų | 61 | 119.2 Ų | 119.2 | 63% | 0.629 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 147.7 | 175 | 0 | 0 | 0 | 0 | 0 | 110.4 | K502 S506 | K502-G504 PolarHBondContact O-N 2.99Å; G504-S506 PolarHBondContact O-N 3.07Å |
| 505 | P | 62.3 | Low | 62.5 | Low | 127 Ų | 127 | 116.9 Ų | 116.9 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 138.2 | 176.1 | 24.3 | -32.4 | 0 | 0 | 0 | 109.8 | G507 | P505-G507 PolarHBondContact O-N 2.81Š|
| 506 | S | 67.5 | Low | 62.5 | Low | 119 Ų | 119 | 117.3 Ų | 117.3 | 83% | 0.832 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 132.6 | 174.5 | -58.3 | 0 | 0 | 0 | 0 | 110 | G504 L508 | G504-S506 PolarHBondContact O-N 3.07Å; S506-L508 PolarHBondContact O-N 3.39Å |
| 507 | G | 59.3 | Low | 62.7 | Low | 68 Ų | 68 | 117 Ų | 117 | 70% | 0.701 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 137.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | P505 N509 | P505-G507 PolarHBondContact O-N 2.81Å; G507-N509 PolarHBondContact O-N 3.03Å |
| 508 | L | 51.4 | Low | 62.8 | Low | 178 Ų | 178 | 114.5 Ų | 114.5 | 93% | 0.932 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 123.8 | 174.9 | -73.4 | 164 | 0 | 0 | 0 | 109 | S506 G510 | S506-L508 PolarHBondContact O-N 3.39Å; L508-G510 PolarHBondContact O-N 3.01Å |
| 509 | N | 66.9 | Low | 62.8 | Low | 159 Ų | 159 | 115 Ų | 115 | 85% | 0.85 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 130.5 | 171.3 | -80.8 | -11.7 | 0 | 0 | 0 | 109 | G507 M511 | G507-N509 PolarHBondContact O-N 3.03Å; N509-M511 PolarHBondContact O-N 2.81Å |
| 510 | G | 57.6 | Low | 62.6 | Low | 71 Ų | 71 | 115.1 Ų | 115.1 | 73% | 0.732 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 136.2 | 177 | 0 | 0 | 0 | 0 | 0 | 110.6 | L508 | L508-G510 PolarHBondContact O-N 3.01Š|
| 511 | M | 56.2 | Low | 62.2 | Low | 179 Ų | 179 | 115.4 Ų | 115.4 | 88% | 0.882 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 134.9 | 176.1 | -68.5 | -176.7 | 67.2 | 0 | 0 | 109.7 | N509 G513 | N509-M511 PolarHBondContact O-N 2.81Å; M511-G513 PolarHBondContact O-N 2.84Å |
| 512 | P | 71.7 | Confident | 61.9 | Low | 123 Ų | 123 | 114.8 Ų | 114.8 | 80% | 0.799 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 137.7 | 171 | -25.5 | 33.9 | 0 | 0 | 0 | 110.5 | ||
| 513 | G | 63 | Low | 61.5 | Low | 63 Ų | 63 | 111.2 Ų | 111.2 | 65% | 0.649 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 148.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | M511 | M511-G513 PolarHBondContact O-N 2.84Š|
| 514 | P | 63.2 | Low | 60.3 | Low | 120 Ų | 120 | 111.1 Ų | 111.1 | 78% | 0.779 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 145.4 | 177.1 | 24.9 | -32.9 | 0 | 0 | 0 | 110.8 | ||
| 515 | P | 69.9 | Low | 59.3 | Low | 126 Ų | 126 | 111.8 Ų | 111.8 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 142.3 | 173.7 | -25 | 33.6 | 0 | 0 | 0 | 111.7 | ||
| 516 | G | 60.4 | Low | 58.2 | Low | 62 Ų | 62 | 113.7 Ų | 113.7 | 64% | 0.639 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 151.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||
| 517 | P | 59 | Low | 56.9 | Low | 124 Ų | 124 | 111.6 Ų | 111.6 | 81% | 0.805 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 145.5 | 178 | 25.2 | -32.8 | 0 | 0 | 0 | 111.1 | ||
| 518 | P | 69.6 | Low | 55.7 | Low | 128 Ų | 128 | 116.4 Ų | 116.4 | 83% | 0.831 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -55 | 142 | 175 | -24.4 | 33.4 | 0 | 0 | 0 | 112.1 | ||
| 519 | G | 58.1 | Low | 55 | Low | 63 Ų | 63 | 115.1 Ų | 115.1 | 65% | 0.649 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 152.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 520 | P | 54.1 | Low | 53.4 | Low | 123 Ų | 123 | 113.3 Ų | 113.3 | 80% | 0.799 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 144.9 | 178.9 | 24.8 | -32.8 | 0 | 0 | 0 | 111.1 | G522 | P520-G522 PolarHBondContact O-N 3.06Š|
| 521 | P | 63.6 | Low | 52.2 | Low | 131 Ų | 131 | 114.8 Ų | 114.8 | 85% | 0.851 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 136.2 | 175.9 | -24.2 | 33.1 | 0 | 0 | 0 | 111.8 | ||
| 522 | G | 55.4 | Low | 51 | Low | 61 Ų | 61 | 111.6 Ų | 111.6 | 63% | 0.629 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 154.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | P520 | P520-G522 PolarHBondContact O-N 3.06Š|
| 523 | P | 51.7 | Low | 48.9 | Very low | 124 Ų | 124 | 108.9 Ų | 108.9 | 81% | 0.805 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 148.5 | 177.9 | 24.5 | -32.6 | 0 | 0 | 0 | 111.3 | G525 | P523-G525 PolarHBondContact O-N 2.97Š|
| 524 | P | 44.8 | Very low | 47.7 | Very low | 123 Ų | 123 | 112.8 Ų | 112.8 | 80% | 0.799 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 126.7 | 180 | -21.9 | 31.9 | 0 | 0 | 0 | 111.7 | N526 | P524-N526 PolarHBondContact O-N 3.5Š|
| 525 | G | 40.1 | Very low | 46.3 | Very low | 76 Ų | 76 | 113.7 Ų | 113.7 | 78% | 0.784 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 125.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | P523 G527 | P523-G525 PolarHBondContact O-N 2.97Å; G525-G527 PolarHBondContact O-N 3.47Å; G525-G527 VanDerWaalsContact O-N 3.14Å |
| 526 | N | 38.8 | Very low | 44.8 | Very low | 166 Ų | 166 | 115.7 Ų | 115.7 | 89% | 0.888 | 80% | 0.8 | S | S | * | * | trans | -61.5 | 114.7 | 169.5 | -84 | -4.3 | 0 | 0 | 0 | 109.2 | P524 Q528 | P524-N526 PolarHBondContact O-N 3.5Å; N526-Q528 PolarHBondContact O-N 3.46Å; N526-Q528 VanDerWaalsContact O-N 3.12Å | ||
| 527 | G | 40.8 | Very low | 43.5 | Very low | 76 Ų | 76 | 116 Ų | 116 | 78% | 0.784 | 80% | 0.803 | S | S | * | * | trans | -66.8 | 106.6 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | G525 | G525-G527 PolarHBondContact O-N 3.47Å; G525-G527 VanDerWaalsContact O-N 3.14Å | ||
| 528 | Q | 33 | Very low | 42.3 | Very low | 169 Ų | 169 | 113.6 Ų | 113.6 | 79% | 0.79 | 80% | 0.801 | S | S | * | * | trans | -130.8 | 93.6 | 147.5 | -75.9 | -170.7 | -7.4 | 0 | 0 | 108 | N526 V530 | N526-Q528 PolarHBondContact O-N 3.46Å; N526-Q528 VanDerWaalsContact O-N 3.12Å; Q528-V530 PolarHBondContact O-N 3.12Å; Q528-V530 VanDerWaalsContact O-N 3.13Å | ||
| 529 | T | 37.5 | Very low | 40.5 | Very low | 150 Ų | 150 | 116.6 Ų | 116.6 | 92% | 0.92 | 81% | 0.809 | S | S | * | * | trans | -61.8 | 102.9 | 154.9 | 32.1 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 530 | V | 32.7 | Very low | 39.3 | Very low | 122 Ų | 122 | 117.5 Ų | 117.5 | 74% | 0.739 | 82% | 0.817 | S | S | * | * | trans | -119.4 | 122.3 | 157.5 | -95.1 | 0 | 0 | 0 | 0 | 107.7 | Q528 A532 | Q528-V530 PolarHBondContact O-N 3.12Å; Q528-V530 VanDerWaalsContact O-N 3.13Å; V530-A532 PolarHBondContact O-N 3.14Å | ||
| 531 | A | 32.8 | Very low | 38.2 | Very low | 102 Ų | 102 | 115.4 Ų | 115.4 | 84% | 0.843 | 82% | 0.818 | S | S | * | * | trans | -53.9 | 127.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | G533 | A531-G533 PolarHBondContact O-N 3.15Š| ||
| 532 | A | 30.9 | Very low | 36.7 | Very low | 111 Ų | 111 | 118.4 Ų | 118.4 | 92% | 0.917 | 82% | 0.821 | S | S | * | * | trans | -72 | 94.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | V530 | V530-A532 PolarHBondContact O-N 3.14Š| ||
| 533 | G | 27.8 | Very low | 35.8 | Very low | 67 Ų | 67 | 124.7 Ų | 124.7 | 69% | 0.691 | 83% | 0.834 | S | S | * | * | trans | -88.2 | 135.3 | 149.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | A531 | A531-G533 PolarHBondContact O-N 3.15Š| ||
| 534 | V | 37.4 | Very low | 35 | Very low | 144 Ų | 144 | 125.2 Ų | 125.2 | 87% | 0.873 | 84% | 0.835 | S | S | * | * | trans | -56 | 128.8 | 176.1 | 176.9 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 535 | T | 32.9 | Very low | 34.9 | Very low | 139 Ų | 139 | 125.4 Ų | 125.4 | 85% | 0.853 | 84% | 0.836 | S | S | * | * | trans | -162.5 | 140.1 | 141.4 | 41.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 536 | D | 39.3 | Very low | 34.6 | Very low | 169 Ų | 169 | 125.4 Ų | 125.4 | 90% | 0.904 | 84% | 0.836 | S | S | * | * | trans | -61.3 | 162.7 | 169.7 | -170.8 | 20 | 0 | 0 | 0 | 113.7 | ||||
| 537 | G | 32.6 | Very low | 34.8 | Very low | 68 Ų | 68 | 124.8 Ų | 124.8 | 70% | 0.701 | 83% | 0.833 | S | S | * | * | trans | 120.5 | 104.8 | 167.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 538 | G | 33.5 | Very low | 34.6 | Very low | 74 Ų | 74 | 133 Ų | 133 | 76% | 0.763 | 84% | 0.84 | S | S | * | * | trans | -73.2 | 179.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 539 | L | 33.6 | Very low | 35.2 | Very low | 191 Ų | 191 | 135 Ų | 135 | 100% | 1 | 85% | 0.846 | S | S | * | * | trans | -177.2 | 136.5 | 150.3 | -93 | 170.6 | 0 | 0 | 0 | 107.9 | ||||
| 540 | G | 32 | Very low | 35.1 | Very low | 81 Ų | 81 | 130.6 Ų | 130.6 | 84% | 0.835 | 83% | 0.83 | S | S | * | * | trans | -106.8 | -166.4 | -168.3 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 541 | G | 31 | Very low | 35.2 | Very low | 79 Ų | 79 | 130.4 Ų | 130.4 | 81% | 0.814 | 83% | 0.831 | S | S | * | * | trans | 104.1 | 128.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 542 | E | 31.1 | Very low | 35.6 | Very low | 194 Ų | 194 | 129.9 Ų | 129.9 | 91% | 0.907 | 83% | 0.827 | S | S | * | * | cis | -142.2 | 141.3 | 30.7 | -82.7 | 174.7 | 116.8 | 0 | 0 | 112.8 | ||||
| 543 | E | 37.3 | Very low | 36.1 | Very low | 193 Ų | 193 | 135.2 Ų | 135.2 | 90% | 0.902 | 83% | 0.825 | S | S | * | * | trans | -77.1 | 140.9 | 159.4 | -87.1 | 178.3 | 144.7 | 0 | 0 | 110.6 | ||||
| 544 | V | 35.2 | Very low | 36.6 | Very low | 136 Ų | 136 | 137.8 Ų | 137.8 | 82% | 0.824 | 83% | 0.828 | S | S | * | * | trans | -120.2 | 124.1 | 160.3 | -178.1 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 545 | P | 41.7 | Very low | 36.9 | Very low | 126 Ų | 126 | 139.7 Ų | 139.7 | 82% | 0.818 | 83% | 0.827 | S | S | * | * | trans | -84.7 | 137.6 | -175 | 32.9 | -31.8 | 0 | 0 | 0 | 111.2 | ||||
| 546 | G | 34 | Very low | 37.4 | Very low | 77 Ų | 77 | 138.8 Ų | 138.8 | 79% | 0.794 | 82% | 0.821 | S | S | * | * | trans | -178.3 | 91.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | R548 | G546-R548 PolarHBondContact O-N 3.29Š| ||
| 547 | D | 43.1 | Very low | 38.1 | Very low | 153 Ų | 153 | 133.6 Ų | 133.6 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -49.4 | 124.1 | 172.8 | -112.4 | -34.5 | 0 | 0 | 0 | 113.6 | ||||
| 548 | R | 37.7 | Very low | 39.2 | Very low | 248 Ų | 248 | 133.2 Ų | 133.2 | 94% | 0.936 | 78% | 0.78 | S | S | * | * | trans | -165.4 | 100.2 | 144.9 | -104.5 | 171.2 | -158.8 | -167.1 | 5.8 | 109.4 | G546 G550 | G546-R548 PolarHBondContact O-N 3.29Å; R548-G550 PolarHBondContact O-N 3.29Å | ||
| 549 | K | 45.1 | Very low | 40 | Very low | 212 Ų | 212 | 133.7 Ų | 133.7 | 92% | 0.922 | 78% | 0.776 | S | S | * | * | trans | -61.3 | 101 | 165.7 | -73.5 | 179.9 | 177 | 176.6 | 0 | 109.6 | ||||
| 550 | G | 34.9 | Very low | 41 | Very low | 56 Ų | 56 | 129 Ų | 129 | 58% | 0.577 | 76% | 0.76 | S | S | * | * | trans | -111.3 | 158.1 | 160.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | R548 A552 | R548-G550 PolarHBondContact O-N 3.29Å; G550-A552 PolarHBondContact O-N 3.3Å | ||
| 551 | P | 35.2 | Very low | 42.6 | Very low | 118 Ų | 118 | 129.6 Ų | 129.6 | 77% | 0.766 | 74% | 0.743 | S | S | * | * | trans | -62.7 | 136.7 | -174.3 | 23.4 | -26.4 | 0 | 0 | 0 | 110.7 | Y553 | P551-Y553 PolarHBondContact O-N 3.37Š| ||
| 552 | A | 42 | Very low | 45 | Very low | 92 Ų | 92 | 127.1 Ų | 127.1 | 76% | 0.76 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -67.9 | 85.8 | -169.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | G550 | G550-A552 PolarHBondContact O-N 3.3Š|
| 553 | Y | 40.3 | Very low | 47.9 | Very low | 222 Ų | 222 | 117.9 Ų | 117.9 | 87% | 0.871 | 67% | 0.672 | S | S | * | * | trans | -145.6 | 48.3 | 162.5 | -61.8 | -78.7 | 0 | 0 | 0 | 111.2 | P551 | P551-Y553 PolarHBondContact O-N 3.37Š| ||
| 554 | T | 38.9 | Very low | 50.7 | Low | 122 Ų | 122 | 109.5 Ų | 109.5 | 75% | 0.748 | 64% | 0.636 | S | S | * | * | trans | -135.1 | 55.6 | 172.8 | -27 | 0 | 0 | 0 | 0 | 110.2 | V556 | T554-V556 VanDerWaalsContact C-N 3.3Å; T554-V556 HydrophobicContact CG2-CG2 4.18Å; T554-V556 PolarHBondContact O-N 3.41Å; T554-V556 VanDerWaalsContact O-N 3.11Å | ||
| 555 | Q | 43.9 | Very low | 53.7 | Low | 183 Ų | 183 | 103.2 Ų | 103.2 | 86% | 0.855 | 60% | 0.597 | S | S | * | * | trans | -72.1 | 99 | 154.3 | -121.2 | 170 | -5.8 | 0 | 0 | 105.7 | L557 | Q555-L557 PolarHBondContact O-N 3.24Š| ||
| 556 | V | 43.5 | Very low | 56.4 | Low | 120 Ų | 120 | 99 Ų | 99 | 73% | 0.727 | 57% | 0.57 | S | S | * | * | trans | -63.1 | 90.4 | 167 | -180 | 0 | 0 | 0 | 0 | 105.7 | T554 S558 | T554-V556 VanDerWaalsContact C-N 3.3Å; T554-V556 HydrophobicContact CG2-CG2 4.18Å; T554-V556 PolarHBondContact O-N 3.41Å; T554-V556 VanDerWaalsContact O-N 3.11Å; V556-S558 VanDerWaalsContact C-N 3.32Å; V556-S558 PolarHBondContact O-N 3.09Å | ||
| 557 | L | 54.2 | Low | 59.4 | Low | 60 Ų | 60 | 95.4 Ų | 95.4 | 31% | 0.314 | 53% | 0.532 | S | S | . | . | trans | -59.3 | 104.9 | 166 | -77.8 | 167.5 | 0 | 0 | 0 | 105.2 | Q555 L561 L687 P690 | Q555-L557 PolarHBondContact O-N 3.24Å; L557-L561 HydrophobicContact CD2-CB 4.1Å; L557-L687 HydrophobicContact CD1-CD2 4.26Å; L557-P690 HydrophobicContact CD1-CB 4.13Å; L557-P690 HydrophobicContact CD1-CG 3.72Å | ||
| 558 | S | 55.1 | Low | 62 | Low | 60 Ų | 60 | 88.3 Ų | 88.3 | 42% | 0.42 | 49% | 0.494 | S | S | . | . | trans | -47.9 | 145.9 | 170.7 | 177.3 | 0 | 0 | 0 | 0 | 108.7 | V556 S560 L561 A562 | V556-S558 VanDerWaalsContact C-N 3.32Å; V556-S558 PolarHBondContact O-N 3.09Å; S558-S560 PolarHBondContact O-N 3.36Å; S558-S560 PolarHBondContact OG-N 3.18Å; S558-L561 WeakPolarHBondContact O-CA 3.29Å; S558-L561 WeakPolarHBondContact O-CB 3.44Å; S558-L561 PolarHBondContact O-N 3.37Å; S558-A562 PolarHBondContact O-N 3.17Å | ||
| 559 | A | 50.8 | Low | 64.9 | Low | 84 Ų | 84 | 76.6 Ų | 76.6 | 69% | 0.694 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.4 | -17.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | L561 | A559-L561 VanDerWaalsContact C-N 3.34Š|
| 560 | S | 54.6 | Low | 67.3 | Low | 94 Ų | 94 | 68.9 Ų | 68.9 | 66% | 0.657 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.2 | -12.5 | 171.1 | -164.7 | 0 | 0 | 0 | 0 | 114.5 | S558 | S558-S560 PolarHBondContact O-N 3.36Å; S558-S560 PolarHBondContact OG-N 3.18Å |
| 561 | L | 65.6 | Low | 70.1 | Confident | 92 Ų | 92 | 70 Ų | 70 | 48% | 0.482 | 42% | 0.417 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.6 | -15.7 | -176.7 | -82.7 | 156.9 | 0 | 0 | 0 | 113.2 | L557 S558 A559 P563 Q590 | L557-L561 HydrophobicContact CD2-CB 4.1Å; S558-L561 WeakPolarHBondContact O-CA 3.29Å; S558-L561 WeakPolarHBondContact O-CB 3.44Å; S558-L561 PolarHBondContact O-N 3.37Å; A559-L561 VanDerWaalsContact C-N 3.34Å; L561-P563 WeakPolarHBondContact O-CD 3.36Å; L561-Q590 PolarHBondContact O-NE2 3.34Å |
| 562 | A | 81.6 | Confident | 73 | Confident | 27 Ų | 27 | 66.9 Ų | 66.9 | 22% | 0.223 | 40% | 0.396 | C | S | . | . | S | Bend | trans | -79.4 | 124 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | S558 A564 | S558-A562 PolarHBondContact O-N 3.17Å; A562-A564 PolarHBondContact O-N 3.12Å; A562-A564 VanDerWaalsContact O-N 3.17Å |
| 563 | P | 91.4 | Very high | 75.6 | Confident | 0 Ų | 0 | 67.4 Ų | 67.4 | 0% | 0 | 38% | 0.382 | C | S | . | . | trans | -63.2 | 119.3 | 178.5 | -20.8 | 32.2 | 0 | 0 | 0 | 110.7 | L561 P603 L604 Y608 F686 L687 | L561-P563 WeakPolarHBondContact O-CD 3.36Å; P563-P603 HydrophobicContact CB-CG 3.52Å; P563-P603 HydrophobicContact CG-CG 3.33Å; P563-L604 HydrophobicContact CG-CB 4.44Å; P563-L604 HydrophobicContact CG-CD1 3.88Å; P563-L604 HydrophobicContact CG-CG 4.28Å; P563-Y608 HydrophobicContact CB-CE1 4.19Å; P563-F686 WeakPolarHBondContact O-CA 3.23Å; P563-L687 PolarHBondContact O-N 3.36Å | ||
| 564 | A | 96 | Very high | 78.3 | Confident | 18 Ų | 18 | 57.3 Ų | 57.3 | 15% | 0.149 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -152 | 149.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | A562 Y587 G589 G685 F686 | A562-A564 PolarHBondContact O-N 3.12Å; A562-A564 VanDerWaalsContact O-N 3.17Å; A564-Y587 HydrophobicContact CB-CD1 4.24Å; A564-Y587 HydrophobicContact CB-CE1 3.74Å; A564-Y587 WeakPolarHBondContact O-CD1 3.3Å; A564-Y587 VanDerWaalsContact O-CE1 3.26Å; A564-Y587 WeakPolarHBondContact O-CE1 3.47Å; A564-G589 PolarHBondContact O-N 3.42Å; A564-G685 CarbonylContact C-O 3.59Å; A564-G685 VanDerWaalsContact CA-O 3.24Å; A564-G685 WeakPolarHBondContact CA-O 3.37Å; A564-F686 HydrophobicContact CB-CB 3.51Å |
| 565 | F | 97.8 | Very high | 81 | Confident | 3 Ų | 3 | 55.6 Ų | 55.6 | 1% | 0.013 | 33% | 0.334 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.1 | 158.4 | 175 | 77.6 | -79.2 | 0 | 0 | 0 | 111.6 | A567 Y587 Y593 F600 F610 F683 S684 G685 | F565-A567 HydrophobicContact CD2-CB 4.49Å; F565-Y587 CarbonylContact C-O 3.57Å; F565-Y587 WeakPolarHBondContact CA-O 3.44Å; F565-Y593 HydrophobicContact CB-CG 4.43Å; F565-Y593 HydrophobicContact CD2-CD1 4.06Å; F565-Y593 AromaticContact CD2-CD2 3.65Å; F565-Y593 HydrophobicContact CD2-CD2 3.65Å; F565-Y593 HydrophobicContact CD2-CE2 4.38Å; F565-Y593 AromaticContact CD2-CG 3.47Å; F565-Y593 HydrophobicContact CD2-CG 3.47Å; F565-Y593 VanDerWaalsContact CD2-CG 3.47Å; F565-Y593 AromaticContact CE2-CD2 3.46Å; F565-Y593 HydrophobicContact CE2-CD2 3.46Å; F565-Y593 VanDerWaalsContact CE2-CD2 3.46Å; F565-Y593 AromaticContact CE2-CE2 3.95Å; F565-Y593 HydrophobicContact CE2-CE2 3.95Å; F565-Y593 AromaticContact CE2-CG 3.82Å; F565-Y593 HydrophobicContact CE2-CG 3.82Å; F565-Y593 VanDerWaalsContact CG-CB 3.47Å; F565-Y593 HydrophobicContact CG-CD2 4.31Å; F565-Y593 AromaticContact CG-CG 3.94Å; F565-Y593 HydrophobicContact CG-CG 3.94Å; F565-Y593 AromaticContact CZ-CD2 3.96Å; F565-Y593 HydrophobicContact CZ-CD2 3.96Å; F565-F600 AromaticContact CD1-CD2 3.35Å; F565-F600 HydrophobicContact CD1-CD2 3.35Å; F565-F600 AromaticContact CD1-CE2 3.83Å; F565-F600 HydrophobicContact CD1-CE2 3.83Å; F565-F600 HydrophobicContact CD1-CG 4.17Å; F565-F600 HydrophobicContact CE1-CB 3.83Å; F565-F600 AromaticContact CE1-CD2 3.37Å; F565-F600 HydrophobicContact CE1-CD2 3.37Å; F565-F600 HydrophobicContact CE1-CE2 4.08Å; F565-F600 AromaticContact CE1-CG 3.71Å; F565-F600 HydrophobicContact CE1-CG 3.71Å; F565-F600 HydrophobicContact CG-CD2 4.38Å; F565-F600 HydrophobicContact CZ-CB 4.15Å; F565-F600 HydrophobicContact CZ-CD2 4.42Å; F565-F610 HydrophobicContact CE1-CD1 4.26Å; F565-F610 AromaticContact CE1-CE1 3.91Å; F565-F610 HydrophobicContact CE1-CE1 3.91Å; F565-F610 HydrophobicContact CZ-CD1 4.39Å; F565-F610 HydrophobicContact CZ-CE1 4.35Å; F565-F683 AromaticContact CE2-CD1 3.64Å; F565-F683 HydrophobicContact CE2-CD1 3.64Å; F565-F683 AromaticContact CE2-CE1 3.9Å; F565-F683 HydrophobicContact CE2-CE1 3.9Å; F565-F683 HydrophobicContact CE2-CG 4.03Å; F565-F683 HydrophobicContact CE2-CZ 4.49Å; F565-F683 WeakPolarHBondContact CE2-O 3.33Å; F565-F683 AromaticContact CZ-CD1 3.73Å; F565-F683 HydrophobicContact CZ-CD1 3.73Å; F565-F683 HydrophobicContact CZ-CD2 4.37Å; F565-F683 AromaticContact CZ-CE1 3.5Å; F565-F683 HydrophobicContact CZ-CE1 3.5Å; F565-F683 HydrophobicContact CZ-CE2 4.18Å; F565-F683 HydrophobicContact CZ-CG 4.17Å; F565-F683 AromaticContact CZ-CZ 3.75Å; F565-F683 HydrophobicContact CZ-CZ 3.75Å; F565-S684 WeakPolarHBondContact O-CA 3.23Å; F565-G685 WeakPolarHBondContact CD1-O 3.22Å; F565-G685 PolarHBondContact N-O 3.46Å; F565-G685 PolarHBondContact O-N 3.43Å; F565-G685 VanDerWaalsContact O-N 3.07Å |
| 566 | T | 98.4 | Very high | 83.5 | Confident | 39 Ų | 39 | 48.1 Ų | 48.1 | 24% | 0.239 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.6 | 124.3 | 163.7 | -70.1 | 0 | 0 | 0 | 0 | 107.3 | T585 L586 Y587 F683 S684 | T566-T585 CarbonylContact O-C 3.57Å; T566-L586 HydrophobicContact CG2-CB 4.17Å; T566-L586 HydrophobicContact CG2-CD1 3.97Å; T566-L586 HydrophobicContact CG2-CG 4.33Å; T566-L586 PolarHBondContact O-N 2.83Å; T566-Y587 PolarHBondContact N-O 3.37Å; T566-Y587 PolarHBondContact O-N 3.36Å; T566-F683 WeakPolarHBondContact CA-O 3.37Å; T566-S684 WeakPolarHBondContact CB-OG 3.36Å; T566-S684 VanDerWaalsContact CG2-OG 3.28Å; T566-S684 WeakPolarHBondContact CG2-OG 3.33Å; T566-S684 WeakPolarHBondContact OG1-CB 3.15Å; T566-S684 PolarHBondContact OG1-OG 3.49Å |
| 567 | A | 98.1 | Very high | 85.9 | Confident | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 147.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | F565 F582 R584 T585 Y593 S682 F683 | F565-A567 HydrophobicContact CD2-CB 4.49Å; A567-F582 HydrophobicContact CB-CB 3.5Å; A567-F582 VanDerWaalsContact CB-CB 3.5Å; A567-F582 HydrophobicContact CB-CG 4.49Å; A567-R584 CarbonylContact C-O 3.59Å; A567-R584 WeakPolarHBondContact CA-O 3.45Å; A567-T585 HydrophobicContact CB-CG2 4.2Å; A567-Y593 HydrophobicContact CB-CD1 4Å; A567-Y593 HydrophobicContact CB-CE1 3.48Å; A567-Y593 VanDerWaalsContact CB-CE1 3.48Å; A567-S682 CarbonylContact O-C 2.95Å; A567-S682 VanDerWaalsContact O-CA 3.28Å; A567-S682 WeakPolarHBondContact O-CA 3.32Å; A567-F683 PolarHBondContact N-O 3.29Å; A567-F683 PolarHBondContact O-N 3.28Å |
| 568 | I | 98.2 | Very high | 87.9 | Confident | 5 Ų | 5 | 47.2 Ų | 47.2 | 3% | 0.026 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 148.4 | 177 | 62.6 | 170.5 | 0 | 0 | 0 | 109.6 | F582 D583 R584 L586 H680 S681 | I568-F582 CarbonylContact O-C 3.53Å; I568-D583 PolarHBondContact O-N 2.8Å; I568-R584 HydrophobicContact CD1-CB 4.48Å; I568-R584 HydrophobicContact CD1-CG 4.26Å; I568-R584 HydrophobicContact CG1-CB 3.84Å; I568-R584 HydrophobicContact CG1-CG 4.01Å; I568-R584 WeakPolarHBondContact CG1-O 3.37Å; I568-R584 PolarHBondContact N-O 2.97Å; I568-R584 PolarHBondContact O-N 3.07Å; I568-R584 VanDerWaalsContact O-N 3.15Å; I568-L586 HydrophobicContact CD1-CD2 4.19Å; I568-L586 HydrophobicContact CG1-CD2 4.45Å; I568-L586 HydrophobicContact CG2-CD1 3.87Å; I568-L586 HydrophobicContact CG2-CG 4.14Å; I568-H680 HydrophobicContact CG2-CB 4.23Å; I568-S681 WeakPolarHBondContact CA-O 3.03Å |
| 569 | L | 98.1 | Very high | 89.9 | Confident | 1 Ų | 1 | 45.8 Ų | 45.8 | 1% | 0.005 | 29% | 0.291 | C | S | . | . | trans | -87.8 | 128.9 | 174.5 | -178.1 | 66.4 | 0 | 0 | 0 | 108.2 | T571 P574 I580 K581 F582 L673 S675 S681 | L569-T571 WeakPolarHBondContact CD2-O 2.96Å; L569-T571 WeakPolarHBondContact CG-O 3.45Å; L569-P574 HydrophobicContact CD2-CG 3.84Å; L569-I580 HydrophobicContact CD1-CG2 4.28Å; L569-I580 HydrophobicContact CD2-CG2 4.36Å; L569-K581 VanDerWaalsContact CD1-O 3.28Å; L569-K581 WeakPolarHBondContact CD1-O 3.44Å; L569-F582 HydrophobicContact CB-CD1 3.75Å; L569-F582 HydrophobicContact CB-CE1 4.13Å; L569-L673 HydrophobicContact CD2-CD2 3.87Å; L569-L673 HydrophobicContact CD2-CG 3.99Å; L569-S675 VanDerWaalsContact O-CB 3.23Å; L569-S675 WeakPolarHBondContact O-CB 3.48Å; L569-S675 PolarHBondContact O-OG 3.27Å; L569-S681 PolarHBondContact N-O 3.49Å | ||
| 570 | T | 94.8 | Very high | 92.2 | Very high | 50 Ų | 50 | 41.8 Ų | 41.8 | 31% | 0.307 | 26% | 0.258 | S | S | . | . | trans | -98.7 | -22.7 | 178.1 | 69.1 | 0 | 0 | 0 | 0 | 112.8 | D583 R584 | T570-D583 WeakPolarHBondContact CB-OD2 3.23Å; T570-D583 WeakPolarHBondContact CG2-OD2 3.35Å; T570-D583 PolarHBondContact N-OD1 2.99Å; T570-D583 PolarHBondContact OG1-OD1 3.36Å; T570-D583 PolarHBondContact OG1-OD2 3.1Å; T570-R584 HydrophobicContact CG2-CB 3.82Å | ||
| 571 | T | 93.4 | Very high | 94.3 | Very high | 80 Ų | 80 | 42.7 Ų | 42.7 | 49% | 0.491 | 25% | 0.25 | S | S | . | . | S | Bend | trans | -105 | 128.9 | -178.3 | 53.5 | 0 | 0 | 0 | 0 | 111.1 | L569 | L569-T571 WeakPolarHBondContact CD2-O 2.96Å; L569-T571 WeakPolarHBondContact CG-O 3.45Å |
| 572 | P | 96.8 | Very high | 95.8 | Very high | 53 Ų | 53 | 38.3 Ų | 38.3 | 34% | 0.344 | 23% | 0.227 | S | C | . | . | S | Bend | trans | -73.8 | 157.5 | 176.3 | 31.5 | -34.4 | 0 | 0 | 0 | 110.7 | Y674 S675 | P572-Y674 HydrophobicContact CB-CD2 3.67Å; P572-Y674 HydrophobicContact CB-CE2 3.92Å; P572-S675 WeakPolarHBondContact CB-O 3.42Å; P572-S675 WeakPolarHBondContact CD-O 3.01Å |
| 573 | F | 96.8 | Very high | 96.5 | Very high | 102 Ų | 102 | 40.2 Ų | 40.2 | 45% | 0.447 | 23% | 0.234 | S | C | . | . | S | Bend | trans | 55.5 | 57.5 | 174 | -44.3 | -62.1 | 0 | 0 | 0 | 113.8 | K617 L673 Y674 | F573-K617 WeakPolarHBondContact CE1-O 3.49Å; F573-L673 WeakPolarHBondContact CA-O 3.36Å; F573-L673 WeakPolarHBondContact CD1-O 3.39Å; F573-L673 PolarHBondContact N-O 2.83Å; F573-Y674 HydrophobicContact CE1-CD2 4.28Å; F573-Y674 HydrophobicContact CE2-CD2 4.15Å; F573-Y674 HydrophobicContact CE2-CE2 4.44Å; F573-Y674 AromaticContact CZ-CD2 3.74Å; F573-Y674 HydrophobicContact CZ-CD2 3.74Å; F573-Y674 HydrophobicContact CZ-CE2 4.33Å |
| 574 | P | 96.7 | Very high | 96.7 | Very high | 11 Ų | 11 | 46.2 Ų | 46.2 | 7% | 0.071 | 26% | 0.256 | C | S | . | . | P | Polyproline II helix | trans | -62.8 | 160.1 | 175 | 28.6 | -32.8 | 0 | 0 | 0 | 110.8 | L569 I580 M665 L673 | L569-P574 HydrophobicContact CD2-CG 3.84Å; P574-I580 HydrophobicContact CB-CG2 4.43Å; P574-I580 HydrophobicContact CG-CG1 4.37Å; P574-I580 HydrophobicContact CG-CG2 4.03Å; P574-M665 HydrophobicContact CG-CE 3.8Å; P574-M665 WeakPolarHBondContact O-CE 3.28Å; P574-L673 HydrophobicContact CG-CB 4.48Å; P574-L673 HydrophobicContact CG-CD2 3.67Å; P574-L673 HydrophobicContact CG-CG 4.25Å |
| 575 | P | 95.8 | Very high | 96.8 | Very high | 86 Ų | 86 | 48 Ų | 48 | 56% | 0.558 | 27% | 0.266 | S | S | * | . | P | Polyproline II helix | trans | -61.4 | 140.1 | -179.2 | 25.1 | -34.2 | 0 | 0 | 0 | 112 | L578 | P575-L578 HydrophobicContact CB-CD1 4.46Å; P575-L578 HydrophobicContact CG-CD1 4.41Å |
| 576 | S | 95.7 | Very high | 96.7 | Very high | 25 Ų | 25 | 53.1 Ų | 53.1 | 18% | 0.175 | 29% | 0.292 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.3 | 167.1 | 171.5 | -49.2 | 0 | 0 | 0 | 0 | 111.3 | L578 S667 N671 | S576-L578 PolarHBondContact O-N 2.84Å; S576-S667 PolarHBondContact OG-O 2.89Å; S576-N671 WeakPolarHBondContact OG-CB 3.3Å |
| 577 | A | 94.3 | Very high | 96.5 | Very high | 64 Ų | 64 | 56.1 Ų | 56.1 | 53% | 0.529 | 30% | 0.3 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 61.6 | 8.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | Q664 M665 | A577-Q664 PolarHBondContact O-NE2 2.89Å; A577-Q664 VanDerWaalsContact O-NE2 3.12Å; A577-M665 PolarHBondContact N-O 2.83Å |
| 578 | L | 96.2 | Very high | 96.4 | Very high | 98 Ų | 98 | 57.5 Ų | 57.5 | 51% | 0.513 | 31% | 0.307 | S | S | . | . | S | Bend | trans | -129.2 | 157 | 174.5 | -65.8 | 174.7 | 0 | 0 | 0 | 110.3 | P575 S576 I580 Q664 | P575-L578 HydrophobicContact CB-CD1 4.46Å; P575-L578 HydrophobicContact CG-CD1 4.41Å; S576-L578 PolarHBondContact O-N 2.84Å; L578-I580 PolarHBondContact O-N 3.22Å; L578-Q664 WeakPolarHBondContact O-CG 3.43Å |
| 579 | P | 98.1 | Very high | 95.6 | Very high | 29 Ų | 29 | 59 Ų | 59 | 19% | 0.188 | 32% | 0.324 | C | S | . | . | B | Isolated β-bridge | trans | -53.5 | 131.8 | 169.1 | -25.1 | 33.7 | 0 | 0 | 0 | 111.6 | K581 T597 I599 W662 | P579-K581 PolarHBondContact O-N 3.36Å; P579-T597 WeakPolarHBondContact CB-O 3.43Å; P579-I599 HydrophobicContact CB-CG1 4.19Å; P579-I599 HydrophobicContact CG-CD1 4.28Å; P579-I599 HydrophobicContact CG-CG1 4.24Å; P579-W662 HydrophobicContact CB-CB 4.17Å; P579-W662 HydrophobicContact CB-CG 3.95Å; P579-W662 HydrophobicContact CG-CD2 4.45Å; P579-W662 HydrophobicContact CG-CG 4.08Å |
| 580 | I | 98.3 | Very high | 95 | Very high | 1 Ų | 1 | 62 Ų | 62 | 1% | 0.005 | 34% | 0.338 | C | S | . | . | trans | -72.6 | 121.8 | 177.1 | -63.7 | 160.4 | 0 | 0 | 0 | 108.2 | L569 P574 L578 F582 G598 V623 V663 M665 L673 | L569-I580 HydrophobicContact CD1-CG2 4.28Å; L569-I580 HydrophobicContact CD2-CG2 4.36Å; P574-I580 HydrophobicContact CB-CG2 4.43Å; P574-I580 HydrophobicContact CG-CG1 4.37Å; P574-I580 HydrophobicContact CG-CG2 4.03Å; L578-I580 PolarHBondContact O-N 3.22Å; I580-F582 HydrophobicContact CB-CD2 4.45Å; I580-F582 HydrophobicContact CB-CE2 3.81Å; I580-F582 HydrophobicContact CB-CZ 4.21Å; I580-F582 HydrophobicContact CG2-CD2 4.04Å; I580-F582 HydrophobicContact CG2-CE1 4.23Å; I580-F582 HydrophobicContact CG2-CE2 3.58Å; I580-F582 HydrophobicContact CG2-CZ 3.66Å; I580-F582 WeakPolarHBondContact O-CD2 3.18Å; I580-F582 PolarHBondContact O-N 3.31Å; I580-G598 WeakPolarHBondContact O-CA 3.24Å; I580-V623 HydrophobicContact CD1-CG1 4.41Å; I580-V663 WeakPolarHBondContact CB-O 3.43Å; I580-V663 HydrophobicContact CD1-CB 4.3Å; I580-V663 HydrophobicContact CD1-CG1 3.91Å; I580-V663 PolarHBondContact N-O 3.09Å; I580-M665 HydrophobicContact CD1-CG 4.29Å; I580-M665 HydrophobicContact CG1-CE 4.46Å; I580-L673 HydrophobicContact CD1-CD2 3.65Å; I580-L673 HydrophobicContact CG1-CD2 4.31Å; I580-L673 HydrophobicContact CG2-CD2 4.13Å | ||
| 581 | K | 98.1 | Very high | 94.8 | Very high | 113 Ų | 113 | 66 Ų | 66 | 49% | 0.491 | 36% | 0.358 | S | S | . | . | trans | -86.2 | 90 | 179.3 | -57.8 | -176.5 | -176.6 | -160.9 | 0 | 109.9 | L569 P579 D583 S596 | L569-K581 VanDerWaalsContact CD1-O 3.28Å; L569-K581 WeakPolarHBondContact CD1-O 3.44Å; P579-K581 PolarHBondContact O-N 3.36Å; K581-D583 PolarHBondContact O-N 3.35Å; K581-S596 WeakPolarHBondContact CD-O 3.36Å; K581-S596 WeakPolarHBondContact CE-O 3.39Å; K581-S596 PolarHBondContact NZ-O 2.77Å | ||
| 582 | F | 98 | Very high | 94.9 | Very high | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 34% | 0.34 | C | S | . | . | trans | -70.5 | 99.3 | 166.1 | -54.8 | -96.4 | 0 | 0 | 0 | 107.3 | A567 I568 L569 I580 Y593 M614 V663 F683 | A567-F582 HydrophobicContact CB-CB 3.5Å; A567-F582 VanDerWaalsContact CB-CB 3.5Å; A567-F582 HydrophobicContact CB-CG 4.49Å; I568-F582 CarbonylContact O-C 3.53Å; L569-F582 HydrophobicContact CB-CD1 3.75Å; L569-F582 HydrophobicContact CB-CE1 4.13Å; I580-F582 HydrophobicContact CB-CD2 4.45Å; I580-F582 HydrophobicContact CB-CE2 3.81Å; I580-F582 HydrophobicContact CB-CZ 4.21Å; I580-F582 HydrophobicContact CG2-CD2 4.04Å; I580-F582 HydrophobicContact CG2-CE1 4.23Å; I580-F582 HydrophobicContact CG2-CE2 3.58Å; I580-F582 HydrophobicContact CG2-CZ 3.66Å; I580-F582 WeakPolarHBondContact O-CD2 3.18Å; I580-F582 PolarHBondContact O-N 3.31Å; F582-Y593 WeakPolarHBondContact CA-OH 3.14Å; F582-Y593 VanDerWaalsContact CB-OH 3.23Å; F582-Y593 WeakPolarHBondContact CB-OH 3.08Å; F582-Y593 PolarHBondContact N-OH 2.9Å; F582-Y593 WeakPolarHBondContact O-CE1 3.17Å; F582-Y593 PolarHBondContact O-OH 2.87Å; F582-M614 HydrophobicContact CE1-CE 3.65Å; F582-M614 HydrophobicContact CE1-SD 4.29Å; F582-M614 HydrophobicContact CZ-CE 3.48Å; F582-M614 VanDerWaalsContact CZ-CE 3.48Å; F582-M614 HydrophobicContact CZ-SD 4.2Å; F582-V663 HydrophobicContact CE2-CB 4.28Å; F582-F683 HydrophobicContact CD1-CB 4.07Å; F582-F683 HydrophobicContact CD2-CB 3.67Å; F582-F683 HydrophobicContact CD2-CD1 4.03Å; F582-F683 HydrophobicContact CD2-CG 4.32Å; F582-F683 HydrophobicContact CE1-CB 3.93Å; F582-F683 HydrophobicContact CE2-CB 3.5Å; F582-F683 AromaticContact CE2-CD1 3.99Å; F582-F683 HydrophobicContact CE2-CD1 3.99Å; F582-F683 HydrophobicContact CE2-CG 4.06Å; F582-F683 HydrophobicContact CG-CB 3.98Å; F582-F683 HydrophobicContact CZ-CB 3.66Å | ||
| 583 | D | 95.9 | Very high | 95 | Very high | 66 Ų | 66 | 60.5 Ų | 60.5 | 35% | 0.353 | 32% | 0.324 | S | S | . | . | trans | -83.7 | -15.7 | -161.7 | 58.6 | -70.2 | 0 | 0 | 0 | 113.7 | I568 T570 K581 | I568-D583 PolarHBondContact O-N 2.8Å; T570-D583 WeakPolarHBondContact CB-OD2 3.23Å; T570-D583 WeakPolarHBondContact CG2-OD2 3.35Å; T570-D583 PolarHBondContact N-OD1 2.99Å; T570-D583 PolarHBondContact OG1-OD1 3.36Å; T570-D583 PolarHBondContact OG1-OD2 3.1Å; K581-D583 PolarHBondContact O-N 3.35Å | ||
| 584 | R | 96.3 | Very high | 95 | Very high | 126 Ų | 126 | 57.6 Ų | 57.6 | 48% | 0.475 | 32% | 0.316 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.6 | 111.7 | 179.3 | 177.7 | 173.6 | 176.8 | -162.5 | 4.7 | 111.2 | A567 I568 T570 | A567-R584 CarbonylContact C-O 3.59Å; A567-R584 WeakPolarHBondContact CA-O 3.45Å; I568-R584 HydrophobicContact CD1-CB 4.48Å; I568-R584 HydrophobicContact CD1-CG 4.26Å; I568-R584 HydrophobicContact CG1-CB 3.84Å; I568-R584 HydrophobicContact CG1-CG 4.01Å; I568-R584 WeakPolarHBondContact CG1-O 3.37Å; I568-R584 PolarHBondContact N-O 2.97Å; I568-R584 PolarHBondContact O-N 3.07Å; I568-R584 VanDerWaalsContact O-N 3.15Å; T570-R584 HydrophobicContact CG2-CB 3.82Å |
| 585 | T | 96.4 | Very high | 95 | Very high | 57 Ų | 57 | 59.7 Ų | 59.7 | 35% | 0.35 | 33% | 0.329 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.9 | 130.6 | 173.8 | 49.3 | 0 | 0 | 0 | 0 | 111.4 | T566 A567 N588 Y593 T595 | T566-T585 CarbonylContact O-C 3.57Å; A567-T585 HydrophobicContact CB-CG2 4.2Å; T585-N588 HydrophobicContact CG2-CB 4.1Å; T585-Y593 HydrophobicContact CG2-CD1 3.96Å; T585-Y593 HydrophobicContact CG2-CE1 4.35Å; T585-T595 HydrophobicContact CG2-CG2 3.58Å |
| 586 | L | 95.9 | Very high | 95 | Very high | 109 Ų | 109 | 59.4 Ų | 59.4 | 57% | 0.571 | 33% | 0.329 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -86 | -34 | 165.6 | -57.1 | -175.5 | 0 | 0 | 0 | 111.1 | T566 I568 | T566-L586 HydrophobicContact CG2-CB 4.17Å; T566-L586 HydrophobicContact CG2-CD1 3.97Å; T566-L586 HydrophobicContact CG2-CG 4.33Å; T566-L586 PolarHBondContact O-N 2.83Å; I568-L586 HydrophobicContact CD1-CD2 4.19Å; I568-L586 HydrophobicContact CG1-CD2 4.45Å; I568-L586 HydrophobicContact CG2-CD1 3.87Å; I568-L586 HydrophobicContact CG2-CG 4.14Å |
| 587 | Y | 95.7 | Very high | 95.1 | Very high | 102 Ų | 102 | 60.9 Ų | 60.9 | 40% | 0.4 | 34% | 0.337 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.5 | 142.1 | 175.6 | -178.5 | -94.6 | 0 | 0 | 0 | 109.4 | A564 F565 T566 G589 | A564-Y587 HydrophobicContact CB-CD1 4.24Å; A564-Y587 HydrophobicContact CB-CE1 3.74Å; A564-Y587 WeakPolarHBondContact O-CD1 3.3Å; A564-Y587 VanDerWaalsContact O-CE1 3.26Å; A564-Y587 WeakPolarHBondContact O-CE1 3.47Å; F565-Y587 CarbonylContact C-O 3.57Å; F565-Y587 WeakPolarHBondContact CA-O 3.44Å; T566-Y587 PolarHBondContact N-O 3.37Å; T566-Y587 PolarHBondContact O-N 3.36Å; Y587-G589 VanDerWaalsContact CE1-N 3.34Å |
| 588 | N | 94.7 | Very high | 95.3 | Very high | 29 Ų | 29 | 57.9 Ų | 57.9 | 16% | 0.155 | 31% | 0.312 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -157.2 | 63.5 | 177.8 | -162.8 | 8.8 | 0 | 0 | 0 | 110.5 | T585 Q590 N591 A592 Y593 | T585-N588 HydrophobicContact CG2-CB 4.1Å; N588-Q590 PolarHBondContact O-N 3.38Å; N588-N591 PolarHBondContact O-N 2.84Å; N588-N591 WeakPolarHBondContact OD1-CA 3.21Å; N588-A592 PolarHBondContact OD1-N 3.06Å; N588-Y593 PolarHBondContact ND2-O 2.79Å; N588-Y593 PolarHBondContact OD1-N 2.83Å |
| 589 | G | 81.6 | Confident | 95.4 | Very high | 36 Ų | 36 | 54.5 Ų | 54.5 | 37% | 0.371 | 29% | 0.294 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.3 | -19.2 | -163.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | A564 Y587 | A564-G589 PolarHBondContact O-N 3.42Å; Y587-G589 VanDerWaalsContact CE1-N 3.34Å |
| 590 | Q | 85.3 | Confident | 95.4 | Very high | 66 Ų | 66 | 53.1 Ų | 53.1 | 31% | 0.308 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -128.7 | 13.6 | 175.2 | -70.8 | -147.2 | -11.2 | 0 | 0 | 114 | L561 N588 A592 | L561-Q590 PolarHBondContact O-NE2 3.34Å; N588-Q590 PolarHBondContact O-N 3.38Å; Q590-A592 PolarHBondContact O-N 2.78Å |
| 591 | N | 91.7 | Very high | 95.4 | Very high | 134 Ų | 134 | 55.8 Ų | 55.8 | 72% | 0.717 | 30% | 0.302 | S | S | * | . | S | Bend | trans | 51.9 | 26.1 | -172.6 | -61.8 | -44.6 | 0 | 0 | 0 | 113.9 | N588 Y593 | N588-N591 PolarHBondContact O-N 2.84Å; N588-N591 WeakPolarHBondContact OD1-CA 3.21Å; N591-Y593 VanDerWaalsContact C-N 3.26Å; N591-Y593 PolarHBondContact O-N 3.16Å |
| 592 | A | 95 | Very high | 95.4 | Very high | 13 Ų | 13 | 50.5 Ų | 50.5 | 11% | 0.107 | 28% | 0.279 | C | S | . | . | trans | -71.9 | -22.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | N588 Q590 F600 T601 P603 | N588-A592 PolarHBondContact OD1-N 3.06Å; Q590-A592 PolarHBondContact O-N 2.78Å; A592-F600 HydrophobicContact CB-CD2 3.92Å; A592-F600 HydrophobicContact CB-CE2 3.49Å; A592-F600 VanDerWaalsContact CB-CE2 3.49Å; A592-F600 HydrophobicContact CB-CZ 4.25Å; A592-F600 WeakPolarHBondContact O-CA 3.45Å; A592-T601 PolarHBondContact O-N 3.13Å; A592-P603 HydrophobicContact CB-CG 4.13Å | ||
| 593 | Y | 98 | Very high | 95.2 | Very high | 4 Ų | 4 | 52.3 Ų | 52.3 | 2% | 0.016 | 29% | 0.29 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.2 | 130.3 | 170.8 | 177.2 | -96.1 | 0 | 0 | 0 | 111.1 | F565 A567 F582 T585 N588 N591 T595 G598 F600 F683 | F565-Y593 HydrophobicContact CB-CG 4.43Å; F565-Y593 HydrophobicContact CD2-CD1 4.06Å; F565-Y593 AromaticContact CD2-CD2 3.65Å; F565-Y593 HydrophobicContact CD2-CD2 3.65Å; F565-Y593 HydrophobicContact CD2-CE2 4.38Å; F565-Y593 AromaticContact CD2-CG 3.47Å; F565-Y593 HydrophobicContact CD2-CG 3.47Å; F565-Y593 VanDerWaalsContact CD2-CG 3.47Å; F565-Y593 AromaticContact CE2-CD2 3.46Å; F565-Y593 HydrophobicContact CE2-CD2 3.46Å; F565-Y593 VanDerWaalsContact CE2-CD2 3.46Å; F565-Y593 AromaticContact CE2-CE2 3.95Å; F565-Y593 HydrophobicContact CE2-CE2 3.95Å; F565-Y593 AromaticContact CE2-CG 3.82Å; F565-Y593 HydrophobicContact CE2-CG 3.82Å; F565-Y593 VanDerWaalsContact CG-CB 3.47Å; F565-Y593 HydrophobicContact CG-CD2 4.31Å; F565-Y593 AromaticContact CG-CG 3.94Å; F565-Y593 HydrophobicContact CG-CG 3.94Å; F565-Y593 AromaticContact CZ-CD2 3.96Å; F565-Y593 HydrophobicContact CZ-CD2 3.96Å; A567-Y593 HydrophobicContact CB-CD1 4Å; A567-Y593 HydrophobicContact CB-CE1 3.48Å; A567-Y593 VanDerWaalsContact CB-CE1 3.48Å; F582-Y593 WeakPolarHBondContact CA-OH 3.14Å; F582-Y593 VanDerWaalsContact CB-OH 3.23Å; F582-Y593 WeakPolarHBondContact CB-OH 3.08Å; F582-Y593 PolarHBondContact N-OH 2.9Å; F582-Y593 WeakPolarHBondContact O-CE1 3.17Å; F582-Y593 PolarHBondContact O-OH 2.87Å; T585-Y593 HydrophobicContact CG2-CD1 3.96Å; T585-Y593 HydrophobicContact CG2-CE1 4.35Å; N588-Y593 PolarHBondContact ND2-O 2.79Å; N588-Y593 PolarHBondContact OD1-N 2.83Å; N591-Y593 VanDerWaalsContact C-N 3.26Å; N591-Y593 PolarHBondContact O-N 3.16Å; Y593-T595 HydrophobicContact CD1-CG2 4.31Å; Y593-T595 HydrophobicContact CE1-CG2 3.94Å; Y593-G598 WeakPolarHBondContact OH-CA 3.19Å; Y593-F600 HydrophobicContact CD2-CB 4.26Å; Y593-F683 HydrophobicContact CE2-CD1 4.16Å; Y593-F683 HydrophobicContact CE2-CE1 4.4Å |
| 594 | S | 97.8 | Very high | 95.1 | Very high | 40 Ų | 40 | 52 Ų | 52 | 28% | 0.28 | 29% | 0.288 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.1 | 113.5 | -179.9 | 170.7 | 0 | 0 | 0 | 0 | 111.1 | S596 T597 G598 I599 | S594-S596 VanDerWaalsContact C-N 3.28Å; S594-S596 PolarHBondContact O-N 2.85Å; S594-S596 PolarHBondContact OG-OG 3.22Å; S594-S596 VanDerWaalsContact OG-OG 3.1Å; S594-T597 WeakPolarHBondContact CB-OG1 3.49Å; S594-T597 PolarHBondContact O-N 3.38Å; S594-T597 PolarHBondContact O-OG1 2.97Å; S594-T597 PolarHBondContact OG-OG1 3.13Å; S594-G598 WeakPolarHBondContact O-CA 3.28Å; S594-G598 PolarHBondContact O-N 3.15Å; S594-I599 PolarHBondContact N-O 3.12Å |
| 595 | T | 96.8 | Very high | 95.1 | Very high | 56 Ų | 56 | 48 Ų | 48 | 34% | 0.344 | 28% | 0.279 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.4 | -25.4 | 179.1 | 52.4 | 0 | 0 | 0 | 0 | 113.4 | T585 Y593 T597 | T585-T595 HydrophobicContact CG2-CG2 3.58Å; Y593-T595 HydrophobicContact CD1-CG2 4.31Å; Y593-T595 HydrophobicContact CE1-CG2 3.94Å; T595-T597 VanDerWaalsContact C-N 3.33Å |
| 596 | S | 96.5 | Very high | 95.1 | Very high | 79 Ų | 79 | 45.2 Ų | 45.2 | 55% | 0.552 | 26% | 0.263 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -26.5 | 179.2 | 60.2 | 0 | 0 | 0 | 0 | 112.6 | K581 S594 | K581-S596 WeakPolarHBondContact CD-O 3.36Å; K581-S596 WeakPolarHBondContact CE-O 3.39Å; K581-S596 PolarHBondContact NZ-O 2.77Å; S594-S596 VanDerWaalsContact C-N 3.28Å; S594-S596 PolarHBondContact O-N 2.85Å; S594-S596 PolarHBondContact OG-OG 3.22Å; S594-S596 VanDerWaalsContact OG-OG 3.1Å |
| 597 | T | 97.6 | Very high | 95.2 | Very high | 57 Ų | 57 | 42 Ų | 42 | 35% | 0.35 | 25% | 0.247 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -109.5 | -29.4 | -177.6 | 61 | 0 | 0 | 0 | 0 | 113.3 | P579 S594 T595 I599 | P579-T597 WeakPolarHBondContact CB-O 3.43Å; S594-T597 WeakPolarHBondContact CB-OG1 3.49Å; S594-T597 PolarHBondContact O-N 3.38Å; S594-T597 PolarHBondContact O-OG1 2.97Å; S594-T597 PolarHBondContact OG-OG1 3.13Å; T595-T597 VanDerWaalsContact C-N 3.33Å; T597-I599 PolarHBondContact OG1-N 3.36Å |
| 598 | G | 97.7 | Very high | 95.3 | Very high | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 23% | 0.228 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 83.5 | 11.8 | -171.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | I580 Y593 S594 W662 | I580-G598 WeakPolarHBondContact O-CA 3.24Å; Y593-G598 WeakPolarHBondContact OH-CA 3.19Å; S594-G598 WeakPolarHBondContact O-CA 3.28Å; S594-G598 PolarHBondContact O-N 3.15Å; G598-W662 WeakPolarHBondContact O-CB 3.2Å |
| 599 | I | 98.5 | Very high | 95.5 | Very high | 28 Ų | 28 | 39.2 Ų | 39.2 | 14% | 0.144 | 24% | 0.235 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.9 | 136.1 | -170.7 | -58.5 | 174 | 0 | 0 | 0 | 110.1 | P579 S594 T597 E660 W662 | P579-I599 HydrophobicContact CB-CG1 4.19Å; P579-I599 HydrophobicContact CG-CD1 4.28Å; P579-I599 HydrophobicContact CG-CG1 4.24Å; S594-I599 PolarHBondContact N-O 3.12Å; T597-I599 PolarHBondContact OG1-N 3.36Å; I599-E660 HydrophobicContact CG2-CB 3.81Å; I599-E660 HydrophobicContact CG2-CG 3.99Å; I599-W662 HydrophobicContact CG1-CB 4.18Å; I599-W662 HydrophobicContact CG2-CE3 4.48Å |
| 600 | F | 98.5 | Very high | 96.3 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 22% | 0.217 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -94.4 | 126.3 | 164.7 | 172.5 | -93.3 | 0 | 0 | 0 | 109.4 | F565 A592 Y593 A602 Y608 F610 L655 E660 V661 | F565-F600 AromaticContact CD1-CD2 3.35Å; F565-F600 HydrophobicContact CD1-CD2 3.35Å; F565-F600 AromaticContact CD1-CE2 3.83Å; F565-F600 HydrophobicContact CD1-CE2 3.83Å; F565-F600 HydrophobicContact CD1-CG 4.17Å; F565-F600 HydrophobicContact CE1-CB 3.83Å; F565-F600 AromaticContact CE1-CD2 3.37Å; F565-F600 HydrophobicContact CE1-CD2 3.37Å; F565-F600 HydrophobicContact CE1-CE2 4.08Å; F565-F600 AromaticContact CE1-CG 3.71Å; F565-F600 HydrophobicContact CE1-CG 3.71Å; F565-F600 HydrophobicContact CG-CD2 4.38Å; F565-F600 HydrophobicContact CZ-CB 4.15Å; F565-F600 HydrophobicContact CZ-CD2 4.42Å; A592-F600 HydrophobicContact CB-CD2 3.92Å; A592-F600 HydrophobicContact CB-CE2 3.49Å; A592-F600 VanDerWaalsContact CB-CE2 3.49Å; A592-F600 HydrophobicContact CB-CZ 4.25Å; A592-F600 WeakPolarHBondContact O-CA 3.45Å; Y593-F600 HydrophobicContact CD2-CB 4.26Å; F600-A602 HydrophobicContact CE1-CB 4.06Å; F600-Y608 HydrophobicContact CE1-CD1 4.15Å; F600-Y608 HydrophobicContact CE1-CE1 4.05Å; F600-Y608 AromaticContact CZ-CD1 3.97Å; F600-Y608 HydrophobicContact CZ-CD1 3.97Å; F600-Y608 AromaticContact CZ-CE1 3.61Å; F600-Y608 HydrophobicContact CZ-CE1 3.61Å; F600-F610 HydrophobicContact CB-CE1 4.43Å; F600-F610 AromaticContact CD1-CE1 3.79Å; F600-F610 HydrophobicContact CD1-CE1 3.79Å; F600-F610 AromaticContact CD1-CZ 3.66Å; F600-F610 HydrophobicContact CD1-CZ 3.66Å; F600-F610 HydrophobicContact CE1-CE1 4.23Å; F600-F610 AromaticContact CE1-CZ 3.8Å; F600-F610 HydrophobicContact CE1-CZ 3.8Å; F600-F610 HydrophobicContact CG-CE1 4.08Å; F600-F610 HydrophobicContact CG-CZ 4.41Å; F600-L655 HydrophobicContact CD1-CD1 4.41Å; F600-L655 HydrophobicContact CE1-CD1 3.94Å; F600-E660 CarbonylContact O-C 3.58Å; F600-E660 VanDerWaalsContact O-CA 3.3Å; F600-E660 WeakPolarHBondContact O-CA 3.36Å; F600-V661 WeakPolarHBondContact CB-O 3.15Å; F600-V661 HydrophobicContact CD1-CB 4.28Å; F600-V661 PolarHBondContact N-O 3.13Å; F600-V661 PolarHBondContact O-N 3.12Å |
| 601 | T | 98.2 | Very high | 96.9 | Very high | 57 Ų | 57 | 34.9 Ų | 34.9 | 35% | 0.35 | 21% | 0.207 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 122.1 | 173.5 | -53 | 0 | 0 | 0 | 0 | 108.5 | A592 P603 D659 | A592-T601 PolarHBondContact O-N 3.13Å; T601-P603 WeakPolarHBondContact O-CD 3.3Å; T601-D659 WeakPolarHBondContact CA-O 3.22Å |
| 602 | A | 97 | Very high | 97.3 | Very high | 1 Ų | 1 | 28.5 Ų | 28.5 | 1% | 0.008 | 17% | 0.173 | C | C | . | . | trans | -66.6 | 115.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | F600 L604 Y608 L655 K656 G658 D659 | F600-A602 HydrophobicContact CE1-CB 4.06Å; A602-L604 VanDerWaalsContact C-N 3.29Å; A602-Y608 HydrophobicContact CB-CE2 4.38Å; A602-L655 HydrophobicContact CB-CB 3.97Å; A602-L655 HydrophobicContact CB-CD1 3.92Å; A602-K656 WeakPolarHBondContact CB-O 3.46Å; A602-G658 PolarHBondContact O-N 3.24Å; A602-D659 HydrophobicContact CB-CB 4.49Å; A602-D659 PolarHBondContact N-O 3.2Å | ||
| 603 | P | 94.6 | Very high | 97.4 | Very high | 38 Ų | 38 | 31.7 Ų | 31.7 | 25% | 0.247 | 19% | 0.185 | C | C | . | . | S | Bend | trans | -83.1 | -10.4 | 178.4 | 35.9 | -36.9 | 0 | 0 | 0 | 112.2 | P563 A592 T601 | P563-P603 HydrophobicContact CB-CG 3.52Å; P563-P603 HydrophobicContact CG-CG 3.33Å; A592-P603 HydrophobicContact CB-CG 4.13Å; T601-P603 WeakPolarHBondContact O-CD 3.3Å |
| 604 | L | 94.4 | Very high | 97.4 | Very high | 60 Ų | 60 | 31.5 Ų | 31.5 | 31% | 0.314 | 18% | 0.184 | S | C | . | . | S | Bend | trans | -140.8 | 148.1 | -179.8 | -67.3 | 173.1 | 0 | 0 | 0 | 109.2 | P563 A602 Y608 L687 | P563-L604 HydrophobicContact CG-CB 4.44Å; P563-L604 HydrophobicContact CG-CD1 3.88Å; P563-L604 HydrophobicContact CG-CG 4.28Å; A602-L604 VanDerWaalsContact C-N 3.29Å; L604-Y608 WeakPolarHBondContact O-CE2 3.48Å; L604-Y608 PolarHBondContact O-OH 3.31Å; L604-L687 HydrophobicContact CD1-CD2 4.5Å |
| 605 | S | 96.2 | Very high | 97.5 | Very high | 41 Ų | 41 | 31.5 Ų | 31.5 | 29% | 0.287 | 18% | 0.18 | S | C | . | . | trans | -75.2 | 137.3 | 170.8 | -59.9 | 0 | 0 | 0 | 0 | 109.9 | L655 E657 T691 | S605-L655 CarbonylContact C-O 3.6Å; S605-L655 WeakPolarHBondContact CA-O 3.43Å; S605-E657 PolarHBondContact OG-N 3.15Å; S605-T691 PolarHBondContact O-N 3.44Å; S605-T691 VanDerWaalsContact O-N 3.08Å | ||
| 606 | G | 95.9 | Very high | 97.5 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 16% | 0.163 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | 167.4 | -178.5 | -179 | 0 | 0 | 0 | 0 | 0 | 114.5 | Y608 E654 L655 C689 T691 | G606-Y608 WeakPolarHBondContact O-CD2 3.37Å; G606-E654 CarbonylContact O-C 3.51Å; G606-L655 PolarHBondContact N-O 3.15Å; G606-L655 PolarHBondContact O-N 3.37Å; G606-C689 CarbonylContact C-O 3.48Å; G606-C689 WeakPolarHBondContact CA-O 3.4Å; G606-T691 VanDerWaalsContact CA-OG1 3.28Å; G606-T691 WeakPolarHBondContact CA-OG1 3.41Å; G606-T691 PolarHBondContact N-OG1 3.48Å |
| 607 | V | 97.8 | Very high | 97.5 | Very high | 41 Ų | 41 | 28.7 Ų | 28.7 | 25% | 0.248 | 15% | 0.153 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -90.9 | 122.5 | 172.4 | -178.1 | 0 | 0 | 0 | 0 | 108.7 | V652 L688 C689 T691 | V607-V652 HydrophobicContact CG1-CG1 3.26Å; V607-L688 HydrophobicContact CG1-CD1 4.19Å; V607-L688 WeakPolarHBondContact O-CA 3.47Å; V607-L688 WeakPolarHBondContact O-CB 3.43Å; V607-L688 PolarHBondContact O-N 3.47Å; V607-C689 HydrophobicContact CB-CB 4.5Å; V607-C689 PolarHBondContact N-O 3.19Å; V607-C689 PolarHBondContact O-N 3.37Å; V607-T691 HydrophobicContact CG2-CG2 4.4Å |
| 608 | Y | 98 | Very high | 97.4 | Very high | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 16% | 0.158 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.3 | 145.2 | -179.3 | -73.6 | -99 | 0 | 0 | 0 | 111.1 | P563 F600 A602 L604 G606 F610 V652 L653 L655 F686 L687 | P563-Y608 HydrophobicContact CB-CE1 4.19Å; F600-Y608 HydrophobicContact CE1-CD1 4.15Å; F600-Y608 HydrophobicContact CE1-CE1 4.05Å; F600-Y608 AromaticContact CZ-CD1 3.97Å; F600-Y608 HydrophobicContact CZ-CD1 3.97Å; F600-Y608 AromaticContact CZ-CE1 3.61Å; F600-Y608 HydrophobicContact CZ-CE1 3.61Å; A602-Y608 HydrophobicContact CB-CE2 4.38Å; L604-Y608 WeakPolarHBondContact O-CE2 3.48Å; L604-Y608 PolarHBondContact O-OH 3.31Å; G606-Y608 WeakPolarHBondContact O-CD2 3.37Å; Y608-F610 VanDerWaalsContact CB-CE2 3.44Å; Y608-F610 HydrophobicContact CD1-CZ 4.49Å; Y608-F610 HydrophobicContact CG-CE2 4.31Å; Y608-F610 HydrophobicContact CG-CZ 4.44Å; Y608-V652 CarbonylContact O-C 3.51Å; Y608-V652 VanDerWaalsContact O-CA 3.29Å; Y608-V652 WeakPolarHBondContact O-CA 3.34Å; Y608-L653 PolarHBondContact N-O 3.28Å; Y608-L653 PolarHBondContact O-N 3.4Å; Y608-L655 HydrophobicContact CD1-CD1 4.45Å; Y608-L655 HydrophobicContact CD2-CB 3.72Å; Y608-L655 HydrophobicContact CD2-CD1 3.6Å; Y608-L655 HydrophobicContact CD2-CG 3.7Å; Y608-L655 HydrophobicContact CE2-CB 3.93Å; Y608-L655 HydrophobicContact CE2-CD1 4.12Å; Y608-L655 HydrophobicContact CE2-CG 4.34Å; Y608-L655 HydrophobicContact CG-CD1 3.79Å; Y608-L655 HydrophobicContact CG-CG 4.24Å; Y608-F686 CarbonylContact C-O 3.48Å; Y608-F686 WeakPolarHBondContact CA-O 3.25Å; Y608-L687 HydrophobicContact CD1-CB 4.09Å; Y608-L687 HydrophobicContact CD1-CD1 4.42Å; Y608-L687 HydrophobicContact CD2-CD1 4Å; Y608-L687 HydrophobicContact CE1-CB 3.67Å; Y608-L687 HydrophobicContact CE1-CD1 4.02Å; Y608-L687 HydrophobicContact CE1-CG 4.43Å; Y608-L687 HydrophobicContact CE2-CD1 3.58Å; Y608-L687 HydrophobicContact CG-CD1 4.41Å |
| 609 | Y | 98.5 | Very high | 97.3 | Very high | 73 Ų | 73 | 30.8 Ų | 30.8 | 29% | 0.286 | 18% | 0.175 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -105 | 129.1 | 167.5 | 179.8 | -98.1 | 0 | 0 | 0 | 109.6 | A611 S650 V652 G685 F686 | Y609-A611 HydrophobicContact CE1-CB 3.68Å; Y609-S650 WeakPolarHBondContact OH-CB 3.28Å; Y609-S650 PolarHBondContact OH-OG 3.23Å; Y609-V652 HydrophobicContact CD2-CG2 3.87Å; Y609-G685 CarbonylContact O-C 3.53Å; Y609-G685 WeakPolarHBondContact O-CA 3.35Å; Y609-F686 HydrophobicContact CD1-CD1 4.21Å; Y609-F686 AromaticContact CD1-CE1 3.4Å; Y609-F686 HydrophobicContact CD1-CE1 3.4Å; Y609-F686 AromaticContact CD1-CZ 3.74Å; Y609-F686 HydrophobicContact CD1-CZ 3.74Å; Y609-F686 HydrophobicContact CE1-CE1 4.2Å; Y609-F686 HydrophobicContact CG-CE1 4.16Å; Y609-F686 HydrophobicContact CG-CZ 4.14Å; Y609-F686 PolarHBondContact N-O 3.05Å; Y609-F686 PolarHBondContact O-N 3.32Å |
| 610 | F | 98.6 | Very high | 97.2 | Very high | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 18% | 0.178 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.1 | 140.4 | 173.4 | -66.5 | -86.9 | 0 | 0 | 0 | 110 | F565 F600 Y608 L625 S650 A651 L653 L655 V661 F683 S684 | F565-F610 HydrophobicContact CE1-CD1 4.26Å; F565-F610 AromaticContact CE1-CE1 3.91Å; F565-F610 HydrophobicContact CE1-CE1 3.91Å; F565-F610 HydrophobicContact CZ-CD1 4.39Å; F565-F610 HydrophobicContact CZ-CE1 4.35Å; F600-F610 HydrophobicContact CB-CE1 4.43Å; F600-F610 AromaticContact CD1-CE1 3.79Å; F600-F610 HydrophobicContact CD1-CE1 3.79Å; F600-F610 AromaticContact CD1-CZ 3.66Å; F600-F610 HydrophobicContact CD1-CZ 3.66Å; F600-F610 HydrophobicContact CE1-CE1 4.23Å; F600-F610 AromaticContact CE1-CZ 3.8Å; F600-F610 HydrophobicContact CE1-CZ 3.8Å; F600-F610 HydrophobicContact CG-CE1 4.08Å; F600-F610 HydrophobicContact CG-CZ 4.41Å; Y608-F610 VanDerWaalsContact CB-CE2 3.44Å; Y608-F610 HydrophobicContact CD1-CZ 4.49Å; Y608-F610 HydrophobicContact CG-CE2 4.31Å; Y608-F610 HydrophobicContact CG-CZ 4.44Å; F610-L625 HydrophobicContact CB-CD1 4.4Å; F610-L625 HydrophobicContact CB-CD2 3.97Å; F610-S650 CarbonylContact O-C 3.56Å; F610-S650 WeakPolarHBondContact O-CA 3.16Å; F610-S650 WeakPolarHBondContact O-CB 3.47Å; F610-A651 PolarHBondContact N-O 3.36Å; F610-A651 PolarHBondContact O-N 3.11Å; F610-L653 HydrophobicContact CD2-CB 4.36Å; F610-L653 HydrophobicContact CD2-CD1 3.81Å; F610-L653 HydrophobicContact CD2-CG 4.13Å; F610-L653 HydrophobicContact CE2-CB 4.27Å; F610-L653 HydrophobicContact CE2-CD1 4.01Å; F610-L653 HydrophobicContact CE2-CG 4.44Å; F610-L655 HydrophobicContact CE2-CD1 3.83Å; F610-L655 HydrophobicContact CZ-CD1 3.76Å; F610-V661 HydrophobicContact CD1-CG1 3.93Å; F610-V661 HydrophobicContact CD2-CG1 4.22Å; F610-V661 HydrophobicContact CE1-CB 3.97Å; F610-V661 HydrophobicContact CE1-CG1 3.71Å; F610-V661 HydrophobicContact CE1-CG2 4.45Å; F610-V661 HydrophobicContact CE2-CB 4.37Å; F610-V661 HydrophobicContact CE2-CG1 4.03Å; F610-V661 HydrophobicContact CE2-CG2 4.04Å; F610-V661 HydrophobicContact CG-CG1 4.17Å; F610-V661 HydrophobicContact CZ-CB 3.82Å; F610-V661 HydrophobicContact CZ-CG1 3.78Å; F610-V661 HydrophobicContact CZ-CG2 3.79Å; F610-F683 HydrophobicContact CB-CE2 4.22Å; F610-F683 AromaticContact CD1-CE2 3.84Å; F610-F683 HydrophobicContact CD1-CE2 3.84Å; F610-F683 AromaticContact CD1-CZ 3.79Å; F610-F683 HydrophobicContact CD1-CZ 3.79Å; F610-F683 HydrophobicContact CE1-CZ 4.36Å; F610-F683 HydrophobicContact CG-CE2 4.46Å; F610-S684 WeakPolarHBondContact CA-O 3.48Å |
| 611 | A | 98.6 | Very high | 97.2 | Very high | 11 Ų | 11 | 30.9 Ų | 30.9 | 9% | 0.091 | 18% | 0.178 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -140.7 | 144.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | Y609 G649 F683 S684 | Y609-A611 HydrophobicContact CE1-CB 3.68Å; A611-G649 CarbonylContact C-O 3.14Å; A611-G649 WeakPolarHBondContact CA-O 3.49Å; A611-F683 WeakPolarHBondContact O-CD2 3.35Å; A611-S684 PolarHBondContact N-O 3.15Å; A611-S684 PolarHBondContact O-N 3.08Å; A611-S684 VanDerWaalsContact O-O 3.11Å |
| 612 | Y | 98.6 | Very high | 97.2 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 18% | 0.177 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -140.1 | 142.2 | 177.5 | 55.6 | -95.1 | 0 | 0 | 0 | 110.5 | M614 V623 L625 T633 T635 S648 G649 V663 S682 | Y612-M614 HydrophobicContact CD2-CE 4.22Å; Y612-M614 HydrophobicContact CD2-CG 4.26Å; Y612-M614 HydrophobicContact CG-CE 4.31Å; Y612-V623 HydrophobicContact CD2-CG2 4.37Å; Y612-V623 HydrophobicContact CE2-CG2 3.74Å; Y612-L625 HydrophobicContact CD1-CD1 4.47Å; Y612-L625 HydrophobicContact CE1-CB 3.93Å; Y612-L625 HydrophobicContact CE1-CD1 4.5Å; Y612-T633 HydrophobicContact CE1-CG2 4.24Å; Y612-T635 PolarHBondContact OH-OG1 3.09Å; Y612-S648 VanDerWaalsContact O-CA 3.3Å; Y612-S648 WeakPolarHBondContact O-CA 3.33Å; Y612-G649 WeakPolarHBondContact CD1-O 3.4Å; Y612-G649 PolarHBondContact N-O 3.34Å; Y612-G649 PolarHBondContact O-N 3.27Å; Y612-V663 HydrophobicContact CD1-CG2 4.12Å; Y612-V663 HydrophobicContact CG-CG2 4.27Å; Y612-S682 CarbonylContact C-O 3.41Å; Y612-S682 VanDerWaalsContact CA-O 3.27Å; Y612-S682 WeakPolarHBondContact CA-O 3.5Å |
| 613 | H | 98.4 | Very high | 97.3 | Very high | 80 Ų | 80 | 32.2 Ų | 32.2 | 37% | 0.37 | 18% | 0.176 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 120.2 | 179.7 | -57.7 | -76.5 | 0 | 0 | 0 | 108.2 | S648 S681 S682 | H613-S648 PolarHBondContact ND1-OG 2.79Å; H613-S681 CarbonylContact O-C 3.57Å; H613-S681 WeakPolarHBondContact O-CA 3.3Å; H613-S682 PolarHBondContact N-O 3.17Å; H613-S682 PolarHBondContact O-N 3.46Å |
| 614 | M | 98.1 | Very high | 97.4 | Very high | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 16% | 0.164 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -119.6 | 136.9 | -175.1 | -59 | -61.1 | 131.2 | 0 | 0 | 109.3 | F582 Y612 L621 Q646 A647 L673 S681 S682 | F582-M614 HydrophobicContact CE1-CE 3.65Å; F582-M614 HydrophobicContact CE1-SD 4.29Å; F582-M614 HydrophobicContact CZ-CE 3.48Å; F582-M614 VanDerWaalsContact CZ-CE 3.48Å; F582-M614 HydrophobicContact CZ-SD 4.2Å; Y612-M614 HydrophobicContact CD2-CE 4.22Å; Y612-M614 HydrophobicContact CD2-CG 4.26Å; Y612-M614 HydrophobicContact CG-CE 4.31Å; M614-L621 HydrophobicContact CB-CD2 3.37Å; M614-L621 HydrophobicContact CG-CD2 3.99Å; M614-Q646 CarbonylContact O-C 3.59Å; M614-Q646 WeakPolarHBondContact O-CA 3.35Å; M614-Q646 PolarHBondContact O-NE2 2.94Å; M614-Q646 VanDerWaalsContact O-NE2 3.16Å; M614-A647 PolarHBondContact N-O 3.1Å; M614-A647 PolarHBondContact O-N 2.56Å; M614-L673 HydrophobicContact CB-CD1 3.68Å; M614-L673 HydrophobicContact CG-CD1 3.92Å; M614-L673 HydrophobicContact SD-CD1 3.28Å; M614-L673 WeakPolarHBondContact SD-CD1 3.27Å; M614-L673 HydrophobicContact SD-CD2 3.93Å; M614-L673 HydrophobicContact SD-CG 4.28Å; M614-S681 WeakPolarHBondContact CA-OG 3.39Å; M614-S682 WeakPolarHBondContact CE-O 3.43Å |
| 615 | H | 98.3 | Very high | 97.6 | Very high | 39 Ų | 39 | 27.5 Ų | 27.5 | 18% | 0.181 | 15% | 0.149 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -93.7 | 139.8 | 167.2 | -70.8 | -80.3 | 0 | 0 | 0 | 110.1 | D645 Y674 I679 H680 S681 | H615-D645 WeakPolarHBondContact CA-O 3.42Å; H615-Y674 WeakPolarHBondContact CB-O 3.35Å; H615-Y674 PolarHBondContact O-N 3.45Å; H615-I679 HydrophobicContact CB-CG2 3.94Å; H615-I679 WeakPolarHBondContact CD2-CG2 3.43Å; H615-H680 PolarHBondContact CD2-O 3.3Å; H615-S681 PolarHBondContact N-OG 2.77Å |
| 616 | V | 98 | Very high | 97.7 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 14% | 0.141 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 121.7 | -172.3 | -172.9 | 0 | 0 | 0 | 0 | 109.8 | L621 D637 M644 D645 A647 G672 | V616-L621 HydrophobicContact CB-CB 4.4Å; V616-L621 HydrophobicContact CG1-CB 3.87Å; V616-L621 HydrophobicContact CG2-CB 3.76Å; V616-L621 HydrophobicContact CG2-CD2 3.75Å; V616-L621 HydrophobicContact CG2-CG 4.41Å; V616-D637 HydrophobicContact CG2-CB 4.02Å; V616-M644 WeakPolarHBondContact O-CA 3.39Å; V616-M644 WeakPolarHBondContact O-CG 3.21Å; V616-D645 HydrophobicContact CB-CB 4.17Å; V616-D645 PolarHBondContact N-O 3.27Å; V616-D645 PolarHBondContact O-N 3.45Å; V616-D645 VanDerWaalsContact O-N 3.09Å; V616-A647 HydrophobicContact CG2-CB 4.07Å; V616-G672 CarbonylContact C-O 3.56Å; V616-G672 WeakPolarHBondContact CA-O 3.38Å |
| 617 | K | 97.1 | Very high | 97.9 | Very high | 76 Ų | 76 | 29.7 Ų | 29.7 | 33% | 0.33 | 15% | 0.153 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -150.8 | 145 | 178.8 | -164.6 | 179.1 | 178.2 | 178.8 | 0 | 111.5 | F573 T619 Y639 G672 Y674 | F573-K617 WeakPolarHBondContact CE1-O 3.49Å; K617-T619 VanDerWaalsContact C-N 3.27Å; K617-T619 PolarHBondContact O-N 3.22Å; K617-T619 VanDerWaalsContact O-N 3.09Å; K617-Y639 HydrophobicContact CG-CE2 4.29Å; K617-G672 PolarHBondContact N-O 2.55Å; K617-G672 WeakPolarHBondContact O-CA 3.41Å; K617-Y674 HydrophobicContact CB-CD1 4.25Å; K617-Y674 HydrophobicContact CB-CD2 4.14Å; K617-Y674 HydrophobicContact CB-CG 3.76Å; K617-Y674 HydrophobicContact CD-CD1 3.86Å; K617-Y674 HydrophobicContact CD-CD2 3.8Å; K617-Y674 HydrophobicContact CD-CE1 3.82Å; K617-Y674 HydrophobicContact CD-CE2 3.8Å; K617-Y674 HydrophobicContact CD-CG 3.84Å; K617-Y674 HydrophobicContact CG-CG 4.47Å; K617-Y674 PolarHBondContact NZ-OH 3.04Å |
| 618 | G | 94.5 | Very high | 97.8 | Very high | 45 Ų | 45 | 30.8 Ų | 30.8 | 46% | 0.464 | 16% | 0.158 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | 86.9 | -54.8 | 171.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y639 | G618-Y639 WeakPolarHBondContact O-CD1 3.18Å; G618-Y639 WeakPolarHBondContact O-CE1 3.28Å |
| 619 | T | 95.4 | Very high | 97.7 | Very high | 57 Ų | 57 | 36.7 Ų | 36.7 | 35% | 0.35 | 19% | 0.189 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -134.2 | 166.7 | 174.9 | 55.3 | 0 | 0 | 0 | 0 | 109.7 | K617 Y639 N671 G672 | K617-T619 VanDerWaalsContact C-N 3.27Å; K617-T619 PolarHBondContact O-N 3.22Å; K617-T619 VanDerWaalsContact O-N 3.09Å; T619-Y639 WeakPolarHBondContact O-CB 3.45Å; T619-N671 PolarHBondContact OG1-OD1 3.16Å; T619-N671 VanDerWaalsContact OG1-OD1 3.13Å; T619-G672 WeakPolarHBondContact O-CA 3.42Å; T619-G672 WeakPolarHBondContact OG1-CA 3.2Å; T619-G672 PolarHBondContact OG1-N 3.24Å |
| 620 | S | 97.2 | Very high | 97.7 | Very high | 29 Ų | 29 | 37.8 Ų | 37.8 | 20% | 0.203 | 20% | 0.203 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -59.1 | 157.3 | 171.8 | -58.5 | 0 | 0 | 0 | 0 | 110.6 | Y636 D637 Y639 A670 N671 G672 | S620-Y636 WeakPolarHBondContact CB-OH 3.48Å; S620-Y636 PolarHBondContact OG-OH 2.88Å; S620-D637 CarbonylContact C-O 3.57Å; S620-D637 WeakPolarHBondContact CA-O 3.47Å; S620-D637 WeakPolarHBondContact CB-O 3.38Å; S620-Y639 PolarHBondContact OG-N 3.24Å; S620-A670 CarbonylContact O-C 3.45Å; S620-A670 WeakPolarHBondContact O-CA 3.47Å; S620-N671 PolarHBondContact O-N 3.07Å; S620-G672 PolarHBondContact O-N 3.28Å |
| 621 | L | 98.2 | Very high | 97.5 | Very high | 1 Ų | 1 | 39.8 Ų | 39.8 | 1% | 0.005 | 22% | 0.216 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.1 | 130.6 | 178.3 | -179.8 | 65.5 | 0 | 0 | 0 | 110.2 | M614 V616 V623 Y636 D637 A647 M665 L673 | M614-L621 HydrophobicContact CB-CD2 3.37Å; M614-L621 HydrophobicContact CG-CD2 3.99Å; V616-L621 HydrophobicContact CB-CB 4.4Å; V616-L621 HydrophobicContact CG1-CB 3.87Å; V616-L621 HydrophobicContact CG2-CB 3.76Å; V616-L621 HydrophobicContact CG2-CD2 3.75Å; V616-L621 HydrophobicContact CG2-CG 4.41Å; L621-V623 HydrophobicContact CD1-CG1 3.66Å; L621-V623 HydrophobicContact CD2-CG1 4.22Å; L621-V623 HydrophobicContact CG-CG1 3.96Å; L621-Y636 CarbonylContact O-C 3.54Å; L621-Y636 VanDerWaalsContact O-CA 3.3Å; L621-Y636 WeakPolarHBondContact O-CA 3.48Å; L621-Y636 WeakPolarHBondContact O-CD2 3.37Å; L621-D637 PolarHBondContact N-O 3.03Å; L621-D637 PolarHBondContact O-N 2.81Å; L621-A647 HydrophobicContact CD2-CB 4.3Å; L621-M665 HydrophobicContact CD1-CG 4.29Å; L621-M665 HydrophobicContact CD1-SD 3.94Å; L621-L673 HydrophobicContact CD1-CB 3.73Å; L621-L673 HydrophobicContact CD2-CD1 4.42Å |
| 622 | W | 98.1 | Very high | 97.4 | Very high | 85 Ų | 85 | 41.6 Ų | 41.6 | 32% | 0.322 | 23% | 0.231 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -129.3 | 113.5 | 166.9 | -173.9 | 27.9 | 0 | 0 | 0 | 109.6 | Y634 Y636 M665 P666 A670 | W622-Y634 AromaticContact CE2-CD1 3.88Å; W622-Y634 AromaticContact CZ2-CD1 3.94Å; W622-Y634 HydrophobicContact CZ2-CD1 3.94Å; W622-Y634 AromaticContact CZ2-CE1 3.86Å; W622-Y634 HydrophobicContact CZ2-CE1 3.86Å; W622-Y634 AromaticContact NE1-CD1 3.38Å; W622-Y634 AromaticContact NE1-CG 3.99Å; W622-Y636 HydrophobicContact CB-CD2 3.82Å; W622-Y636 HydrophobicContact CB-CE2 4.36Å; W622-Y636 HydrophobicContact CG-CD2 4.19Å; W622-M665 WeakPolarHBondContact O-CA 3.42Å; W622-M665 WeakPolarHBondContact O-CG 3.32Å; W622-P666 HydrophobicContact CD2-CB 4.46Å; W622-P666 HydrophobicContact CD2-CG 4.09Å; W622-P666 HydrophobicContact CE3-CB 4.08Å; W622-P666 HydrophobicContact CE3-CG 4.21Å; W622-P666 HydrophobicContact CH2-CB 3.91Å; W622-P666 HydrophobicContact CH2-CG 4.22Å; W622-P666 HydrophobicContact CZ2-CB 4.29Å; W622-P666 HydrophobicContact CZ2-CG 4.09Å; W622-P666 HydrophobicContact CZ3-CB 3.8Å; W622-P666 HydrophobicContact CZ3-CG 4.28Å; W622-P666 VanDerWaalsContact O-CD 3.27Å; W622-P666 WeakPolarHBondContact O-CD 3.19Å; W622-A670 HydrophobicContact CB-CB 3.54Å; W622-A670 PolarHBondContact N-O 2.79Å |
| 623 | V | 97.9 | Very high | 97.3 | Very high | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 24% | 0.242 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -122 | 149.3 | 178 | -67 | 0 | 0 | 0 | 0 | 110.4 | I580 Y612 L621 Y634 T635 V663 M665 | I580-V623 HydrophobicContact CD1-CG1 4.41Å; Y612-V623 HydrophobicContact CD2-CG2 4.37Å; Y612-V623 HydrophobicContact CE2-CG2 3.74Å; L621-V623 HydrophobicContact CD1-CG1 3.66Å; L621-V623 HydrophobicContact CD2-CG1 4.22Å; L621-V623 HydrophobicContact CG-CG1 3.96Å; V623-Y634 WeakPolarHBondContact O-CA 3.41Å; V623-T635 PolarHBondContact N-O 3.33Å; V623-T635 PolarHBondContact O-N 2.9Å; V623-V663 HydrophobicContact CB-CG1 4.02Å; V623-V663 HydrophobicContact CG1-CG1 4.41Å; V623-M665 HydrophobicContact CG1-CG 3.72Å |
| 624 | A | 98.1 | Very high | 97.3 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 25% | 0.247 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.3 | 143.2 | 168.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | Y626 P631 T633 Y634 V663 Q664 P666 | A624-Y626 HydrophobicContact CB-CD2 4.07Å; A624-Y626 HydrophobicContact CB-CE2 3.53Å; A624-P631 HydrophobicContact CB-CB 4.21Å; A624-T633 CarbonylContact C-O 3.52Å; A624-T633 WeakPolarHBondContact CA-O 3.35Å; A624-T633 WeakPolarHBondContact CB-O 3.45Å; A624-Y634 HydrophobicContact CB-CD1 3.43Å; A624-Y634 VanDerWaalsContact CB-CD1 3.43Å; A624-Y634 HydrophobicContact CB-CE1 3.58Å; A624-Y634 HydrophobicContact CB-CG 4.3Å; A624-V663 WeakPolarHBondContact O-CA 3.35Å; A624-Q664 PolarHBondContact N-O 3.17Å; A624-Q664 PolarHBondContact O-N 3.1Å; A624-P666 HydrophobicContact CB-CG 4.17Å |
| 625 | L | 98.6 | Very high | 97.3 | Very high | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 123.4 | 164.7 | -176.6 | 72.6 | 0 | 0 | 0 | 107.5 | F610 Y612 P631 A632 T633 A651 L653 V661 W662 V663 F683 | F610-L625 HydrophobicContact CB-CD1 4.4Å; F610-L625 HydrophobicContact CB-CD2 3.97Å; Y612-L625 HydrophobicContact CD1-CD1 4.47Å; Y612-L625 HydrophobicContact CE1-CB 3.93Å; Y612-L625 HydrophobicContact CE1-CD1 4.5Å; L625-P631 CarbonylContact O-C 3.59Å; L625-A632 PolarHBondContact O-N 2.78Å; L625-T633 HydrophobicContact CB-CG2 3.63Å; L625-T633 HydrophobicContact CD2-CG2 4.12Å; L625-T633 PolarHBondContact N-O 3.36Å; L625-T633 PolarHBondContact O-N 2.86Å; L625-A651 HydrophobicContact CD2-CB 3.78Å; L625-L653 HydrophobicContact CD2-CD1 3.92Å; L625-V661 HydrophobicContact CD1-CG1 3.72Å; L625-V661 HydrophobicContact CG-CG1 4.19Å; L625-W662 CarbonylContact C-O 3.5Å; L625-W662 WeakPolarHBondContact CA-O 3.36Å; L625-V663 HydrophobicContact CD1-CG2 3.9Å; L625-F683 HydrophobicContact CD1-CE2 3.72Å; L625-F683 HydrophobicContact CD1-CZ 3.79Å |
| 626 | Y | 98.5 | Very high | 97.3 | Very high | 28 Ų | 28 | 50.4 Ų | 50.4 | 11% | 0.11 | 27% | 0.268 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.3 | 143 | 179.2 | -75.7 | -98.7 | 0 | 0 | 0 | 110.5 | A624 V630 P631 V661 W662 Q664 | A624-Y626 HydrophobicContact CB-CD2 4.07Å; A624-Y626 HydrophobicContact CB-CE2 3.53Å; Y626-V630 CarbonylContact C-O 3.59Å; Y626-V630 WeakPolarHBondContact CA-O 3.35Å; Y626-P631 HydrophobicContact CD1-CB 4.24Å; Y626-P631 HydrophobicContact CE1-CB 3.95Å; Y626-P631 HydrophobicContact CE1-CG 4.22Å; Y626-V661 VanDerWaalsContact O-CA 3.23Å; Y626-V661 WeakPolarHBondContact O-CA 3.39Å; Y626-V661 WeakPolarHBondContact O-CG1 3.26Å; Y626-W662 HydrophobicContact CD1-CZ2 4.15Å; Y626-W662 AromaticContact CD2-NE1 3.78Å; Y626-W662 AromaticContact CG-CE2 3.82Å; Y626-W662 AromaticContact CG-CZ2 3.95Å; Y626-W662 HydrophobicContact CG-CZ2 3.95Å; Y626-W662 AromaticContact CG-NE1 3.79Å; Y626-W662 PolarHBondContact N-O 3.04Å; Y626-W662 PolarHBondContact O-N 3.1Å; Y626-W662 VanDerWaalsContact O-N 3.17Å; Y626-Q664 HydrophobicContact CD2-CB 3.96Å; Y626-Q664 HydrophobicContact CE2-CB 3.78Å; Y626-Q664 HydrophobicContact CE2-CG 4.11Å |
| 627 | K | 98.3 | Very high | 97.3 | Very high | 59 Ų | 59 | 51.9 Ų | 51.9 | 26% | 0.257 | 28% | 0.276 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 118.4 | 163.5 | 178.1 | -170.4 | 172.4 | -177.6 | 0 | 107.6 | N629 V630 L653 E654 L655 D659 E660 | K627-N629 VanDerWaalsContact C-N 3.3Å; K627-N629 PolarHBondContact O-N 3.43Å; K627-V630 PolarHBondContact N-O 3.05Å; K627-V630 WeakPolarHBondContact O-CA 3.27Å; K627-V630 WeakPolarHBondContact O-CB 3.39Å; K627-V630 PolarHBondContact O-N 3.44Å; K627-L653 HydrophobicContact CB-CD1 4.36Å; K627-E654 PolarHBondContact NZ-O 3.24Å; K627-L655 HydrophobicContact CD-CD2 3.7Å; K627-L655 HydrophobicContact CG-CD2 3.91Å; K627-D659 WeakPolarHBondContact CE-OD2 3.37Å; K627-D659 IonicContact NZ-OD2 3.27Å; K627-D659 PolarHBondContact NZ-OD2 3.23Å; K627-E660 CarbonylContact C-O 3.58Å; K627-E660 WeakPolarHBondContact CA-O 3.19Å |
| 628 | N | 97.3 | Very high | 97.3 | Very high | 64 Ų | 64 | 53.9 Ų | 53.9 | 34% | 0.342 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 47.9 | 47.8 | 178.5 | -61.7 | -15.8 | 0 | 0 | 0 | 113.6 | V630 D659 E660 | N628-V630 PolarHBondContact O-N 3.42Å; N628-D659 VanDerWaalsContact ND2-CG 3.27Å; N628-D659 PolarHBondContact ND2-OD1 3.39Å; N628-D659 WeakPolarHBondContact OD1-CA 3.42Å; N628-E660 PolarHBondContact N-O 2.84Å; N628-E660 PolarHBondContact OD1-N 3.28Å; N628-E660 PolarHBondContact OD1-O 3.29Å |
| 629 | N | 95.5 | Very high | 97.4 | Very high | 123 Ų | 123 | 54.2 Ų | 54.2 | 66% | 0.658 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.2 | 2.5 | -176.2 | -56.5 | -69.8 | 0 | 0 | 0 | 115.8 | K627 W662 | K627-N629 VanDerWaalsContact C-N 3.3Å; K627-N629 PolarHBondContact O-N 3.43Å; N629-W662 HydrophobicContact CB-CH2 4.24Å; N629-W662 VanDerWaalsContact OD1-CH2 3.28Å; N629-W662 WeakPolarHBondContact OD1-CH2 3.41Å |
| 630 | V | 97.3 | Very high | 97.4 | Very high | 96 Ų | 96 | 58.3 Ų | 58.3 | 58% | 0.582 | 29% | 0.287 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 123.3 | 173.1 | -176.7 | 0 | 0 | 0 | 0 | 109.2 | Y626 K627 N628 A632 | Y626-V630 CarbonylContact C-O 3.59Å; Y626-V630 WeakPolarHBondContact CA-O 3.35Å; K627-V630 PolarHBondContact N-O 3.05Å; K627-V630 WeakPolarHBondContact O-CA 3.27Å; K627-V630 WeakPolarHBondContact O-CB 3.39Å; K627-V630 PolarHBondContact O-N 3.44Å; N628-V630 PolarHBondContact O-N 3.42Å; V630-A632 PolarHBondContact O-N 3.06Å |
| 631 | P | 96.4 | Very high | 97.2 | Very high | 43 Ų | 43 | 66.1 Ų | 66.1 | 28% | 0.279 | 32% | 0.317 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.4 | 120.5 | 175.5 | 25.7 | -30.1 | 0 | 0 | 0 | 109.8 | A624 L625 Y626 Y634 | A624-P631 HydrophobicContact CB-CB 4.21Å; L625-P631 CarbonylContact O-C 3.59Å; Y626-P631 HydrophobicContact CD1-CB 4.24Å; Y626-P631 HydrophobicContact CE1-CB 3.95Å; Y626-P631 HydrophobicContact CE1-CG 4.22Å; P631-Y634 HydrophobicContact CB-CE1 4Å; P631-Y634 HydrophobicContact CB-CE2 4.03Å; P631-Y634 WeakPolarHBondContact CB-OH 3.22Å; P631-Y634 HydrophobicContact CG-CE2 4.29Å; P631-Y634 WeakPolarHBondContact CG-OH 3.5Å |
| 632 | A | 96 | Very high | 96.9 | Very high | 48 Ų | 48 | 69.2 Ų | 69.2 | 40% | 0.397 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.7 | -36.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L625 V630 L653 | L625-A632 PolarHBondContact O-N 2.78Å; V630-A632 PolarHBondContact O-N 3.06Å; A632-L653 HydrophobicContact CB-CD1 4.38Å; A632-L653 HydrophobicContact CB-CD2 3.77Å |
| 633 | T | 96.7 | Very high | 96.7 | Very high | 39 Ų | 39 | 73.3 Ų | 73.3 | 24% | 0.239 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.8 | 154.4 | 174.1 | -177.8 | 0 | 0 | 0 | 0 | 110.8 | Y612 A624 L625 A651 | Y612-T633 HydrophobicContact CE1-CG2 4.24Å; A624-T633 CarbonylContact C-O 3.52Å; A624-T633 WeakPolarHBondContact CA-O 3.35Å; A624-T633 WeakPolarHBondContact CB-O 3.45Å; L625-T633 HydrophobicContact CB-CG2 3.63Å; L625-T633 HydrophobicContact CD2-CG2 4.12Å; L625-T633 PolarHBondContact N-O 3.36Å; L625-T633 PolarHBondContact O-N 2.86Å; T633-A651 HydrophobicContact CG2-CB 4.18Å |
| 634 | Y | 97.7 | Very high | 96.6 | Very high | 120 Ų | 120 | 77.5 Ų | 77.5 | 47% | 0.471 | 39% | 0.387 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.6 | 139.4 | 173.7 | -62.5 | -84.5 | 0 | 0 | 0 | 110.2 | W622 V623 A624 P631 P666 | W622-Y634 AromaticContact CE2-CD1 3.88Å; W622-Y634 AromaticContact CZ2-CD1 3.94Å; W622-Y634 HydrophobicContact CZ2-CD1 3.94Å; W622-Y634 AromaticContact CZ2-CE1 3.86Å; W622-Y634 HydrophobicContact CZ2-CE1 3.86Å; W622-Y634 AromaticContact NE1-CD1 3.38Å; W622-Y634 AromaticContact NE1-CG 3.99Å; V623-Y634 WeakPolarHBondContact O-CA 3.41Å; A624-Y634 HydrophobicContact CB-CD1 3.43Å; A624-Y634 VanDerWaalsContact CB-CD1 3.43Å; A624-Y634 HydrophobicContact CB-CE1 3.58Å; A624-Y634 HydrophobicContact CB-CG 4.3Å; P631-Y634 HydrophobicContact CB-CE1 4Å; P631-Y634 HydrophobicContact CB-CE2 4.03Å; P631-Y634 WeakPolarHBondContact CB-OH 3.22Å; P631-Y634 HydrophobicContact CG-CE2 4.29Å; P631-Y634 WeakPolarHBondContact CG-OH 3.5Å; Y634-P666 HydrophobicContact CE1-CG 4.37Å |
| 635 | T | 98.3 | Very high | 96.6 | Very high | 20 Ų | 20 | 81.3 Ų | 81.3 | 12% | 0.123 | 41% | 0.407 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.7 | 129.2 | 168.3 | -64 | 0 | 0 | 0 | 0 | 108.4 | Y612 V623 A647 | Y612-T635 PolarHBondContact OH-OG1 3.09Å; V623-T635 PolarHBondContact N-O 3.33Å; V623-T635 PolarHBondContact O-N 2.9Å; T635-A647 HydrophobicContact CG2-CB 3.89Å |
| 636 | Y | 98.1 | Very high | 96.5 | Very high | 125 Ų | 125 | 85 Ų | 85 | 49% | 0.49 | 42% | 0.424 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123 | 140.5 | 176.1 | -177.9 | -102.8 | 0 | 0 | 0 | 109.6 | S620 L621 W622 E638 A670 | S620-Y636 WeakPolarHBondContact CB-OH 3.48Å; S620-Y636 PolarHBondContact OG-OH 2.88Å; L621-Y636 CarbonylContact O-C 3.54Å; L621-Y636 VanDerWaalsContact O-CA 3.3Å; L621-Y636 WeakPolarHBondContact O-CA 3.48Å; L621-Y636 WeakPolarHBondContact O-CD2 3.37Å; W622-Y636 HydrophobicContact CB-CD2 3.82Å; W622-Y636 HydrophobicContact CB-CE2 4.36Å; W622-Y636 HydrophobicContact CG-CD2 4.19Å; Y636-E638 HydrophobicContact CD1-CG 4.35Å; Y636-E638 HydrophobicContact CE1-CG 3.41Å; Y636-E638 VanDerWaalsContact CE1-CG 3.41Å; Y636-A670 HydrophobicContact CE2-CB 4.24Å |
| 637 | D | 97.9 | Very high | 96.5 | Very high | 31 Ų | 31 | 84 Ų | 84 | 17% | 0.166 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.6 | 139.8 | 175 | -167.6 | 5.6 | 0 | 0 | 0 | 110.9 | V616 S620 L621 A647 | V616-D637 HydrophobicContact CG2-CB 4.02Å; S620-D637 CarbonylContact C-O 3.57Å; S620-D637 WeakPolarHBondContact CA-O 3.47Å; S620-D637 WeakPolarHBondContact CB-O 3.38Å; L621-D637 PolarHBondContact N-O 3.03Å; L621-D637 PolarHBondContact O-N 2.81Å; D637-A647 HydrophobicContact CB-CB 3.62Å |
| 638 | E | 97 | Very high | 96.5 | Very high | 118 Ų | 118 | 83.7 Ų | 83.7 | 55% | 0.551 | 43% | 0.427 | S | S | * | . | P | Polyproline II helix | trans | -95.3 | 122.9 | -173.5 | -70.1 | -172.6 | 171.4 | 0 | 0 | 111.4 | Y636 K640 | Y636-E638 HydrophobicContact CD1-CG 4.35Å; Y636-E638 HydrophobicContact CE1-CG 3.41Å; Y636-E638 VanDerWaalsContact CE1-CG 3.41Å; E638-K640 PolarHBondContact O-N 2.91Å |
| 639 | Y | 96.5 | Very high | 96.5 | Very high | 53 Ų | 53 | 81.2 Ų | 81.2 | 21% | 0.208 | 42% | 0.417 | C | S | . | . | P | Polyproline II helix | trans | -78.6 | 120.3 | 174.8 | 176.5 | -110.1 | 0 | 0 | 0 | 111.6 | K617 G618 T619 S620 G642 Y643 | K617-Y639 HydrophobicContact CG-CE2 4.29Å; G618-Y639 WeakPolarHBondContact O-CD1 3.18Å; G618-Y639 WeakPolarHBondContact O-CE1 3.28Å; T619-Y639 WeakPolarHBondContact O-CB 3.45Å; S620-Y639 PolarHBondContact OG-N 3.24Å; Y639-G642 PolarHBondContact OH-N 2.67Å; Y639-Y643 WeakPolarHBondContact CD2-O 3.12Å; Y639-Y643 WeakPolarHBondContact CE2-O 3.23Å |
| 640 | K | 94.8 | Very high | 96.6 | Very high | 143 Ų | 143 | 78.2 Ų | 78.2 | 62% | 0.622 | 41% | 0.406 | S | S | * | . | P | Polyproline II helix | trans | -91.1 | 124.5 | 167.6 | -68.7 | 176.2 | -175.5 | 167.3 | 0 | 109.7 | E638 G642 Y643 | E638-K640 PolarHBondContact O-N 2.91Å; K640-G642 PolarHBondContact O-N 3.4Å; K640-G642 VanDerWaalsContact O-N 3.14Å; K640-Y643 HydrophobicContact CB-CD2 4.33Å; K640-Y643 PolarHBondContact O-N 2.9Å |
| 641 | K | 93.8 | Very high | 96.7 | Very high | 192 Ų | 192 | 74.5 Ų | 74.5 | 84% | 0.835 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.3 | 121.8 | -177.9 | -171.8 | 177.7 | -178.2 | 179 | 0 | 111.6 | Y643 | K641-Y643 WeakPolarHBondContact O-CD2 3.28Š|
| 642 | G | 92.1 | Very high | 96.7 | Very high | 66 Ų | 66 | 76.7 Ų | 76.7 | 68% | 0.68 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 89.7 | -7.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | Y639 K640 | Y639-G642 PolarHBondContact OH-N 2.67Å; K640-G642 PolarHBondContact O-N 3.4Å; K640-G642 VanDerWaalsContact O-N 3.14Å |
| 643 | Y | 94.4 | Very high | 96.8 | Very high | 171 Ų | 171 | 75.3 Ų | 75.3 | 67% | 0.671 | 38% | 0.383 | S | S | * | . | trans | -120.2 | 117.3 | -177.5 | -61.9 | -86.6 | 0 | 0 | 0 | 110.2 | Y639 K640 K641 | Y639-Y643 WeakPolarHBondContact CD2-O 3.12Å; Y639-Y643 WeakPolarHBondContact CE2-O 3.23Å; K640-Y643 HydrophobicContact CB-CD2 4.33Å; K640-Y643 PolarHBondContact O-N 2.9Å; K641-Y643 WeakPolarHBondContact O-CD2 3.28Å | ||
| 644 | M | 95.3 | Very high | 96.9 | Very high | 89 Ų | 89 | 79.9 Ų | 79.9 | 44% | 0.438 | 40% | 0.402 | S | S | . | . | trans | -77.9 | 135.4 | 172.6 | -174.6 | 175.5 | 75.1 | 0 | 0 | 109.2 | V616 Y674 I679 | V616-M644 WeakPolarHBondContact O-CA 3.39Å; V616-M644 WeakPolarHBondContact O-CG 3.21Å; M644-Y674 HydrophobicContact SD-CD1 3.83Å; M644-Y674 HydrophobicContact SD-CE1 4.12Å; M644-I679 HydrophobicContact CE-CD1 3.92Å; M644-I679 HydrophobicContact CE-CG2 4.21Å; M644-I679 HydrophobicContact SD-CD1 4Å; M644-I679 HydrophobicContact SD-CG2 4.2Å | ||
| 645 | D | 97.4 | Very high | 96.9 | Very high | 79 Ų | 79 | 74.2 Ų | 74.2 | 42% | 0.422 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.7 | 178 | 178 | -141.1 | -27.5 | 0 | 0 | 0 | 111.7 | H615 V616 | H615-D645 WeakPolarHBondContact CA-O 3.42Å; V616-D645 HydrophobicContact CB-CB 4.17Å; V616-D645 PolarHBondContact N-O 3.27Å; V616-D645 PolarHBondContact O-N 3.45Å; V616-D645 VanDerWaalsContact O-N 3.09Å |
| 646 | Q | 97.8 | Very high | 96.9 | Very high | 77 Ų | 77 | 80.4 Ų | 80.4 | 36% | 0.36 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.7 | 116 | -179.4 | -163.9 | -70.3 | -69.9 | 0 | 0 | 110.6 | M614 S648 | M614-Q646 CarbonylContact O-C 3.59Å; M614-Q646 WeakPolarHBondContact O-CA 3.35Å; M614-Q646 PolarHBondContact O-NE2 2.94Å; M614-Q646 VanDerWaalsContact O-NE2 3.16Å; Q646-S648 VanDerWaalsContact CD-OG 3.29Å; Q646-S648 PolarHBondContact NE2-OG 3.15Å; Q646-S648 PolarHBondContact OE1-OG 3.17Å |
| 647 | A | 97.5 | Very high | 96.8 | Very high | 7 Ų | 7 | 81.2 Ų | 81.2 | 6% | 0.058 | 41% | 0.413 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.4 | 128.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111 | M614 V616 L621 T635 D637 | M614-A647 PolarHBondContact N-O 3.1Å; M614-A647 PolarHBondContact O-N 2.56Å; V616-A647 HydrophobicContact CG2-CB 4.07Å; L621-A647 HydrophobicContact CD2-CB 4.3Å; T635-A647 HydrophobicContact CG2-CB 3.89Å; D637-A647 HydrophobicContact CB-CB 3.62Å |
| 648 | S | 98.3 | Very high | 96.7 | Very high | 53 Ų | 53 | 81.9 Ų | 81.9 | 37% | 0.371 | 43% | 0.427 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.6 | 150.6 | 177.7 | -60.6 | 0 | 0 | 0 | 0 | 111.1 | Y612 H613 Q646 | Y612-S648 VanDerWaalsContact O-CA 3.3Å; Y612-S648 WeakPolarHBondContact O-CA 3.33Å; H613-S648 PolarHBondContact ND1-OG 2.79Å; Q646-S648 VanDerWaalsContact CD-OG 3.29Å; Q646-S648 PolarHBondContact NE2-OG 3.15Å; Q646-S648 PolarHBondContact OE1-OG 3.17Å |
| 649 | G | 97.7 | Very high | 96.8 | Very high | 13 Ų | 13 | 77.3 Ų | 77.3 | 13% | 0.134 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147 | 153.2 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | A611 Y612 | A611-G649 CarbonylContact C-O 3.14Å; A611-G649 WeakPolarHBondContact CA-O 3.49Å; Y612-G649 WeakPolarHBondContact CD1-O 3.4Å; Y612-G649 PolarHBondContact N-O 3.34Å; Y612-G649 PolarHBondContact O-N 3.27Å |
| 650 | S | 98.1 | Very high | 96.9 | Very high | 60 Ų | 60 | 78.3 Ų | 78.3 | 42% | 0.42 | 41% | 0.413 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.2 | 155.9 | 172.5 | 61.4 | 0 | 0 | 0 | 0 | 111.1 | Y609 F610 | Y609-S650 WeakPolarHBondContact OH-CB 3.28Å; Y609-S650 PolarHBondContact OH-OG 3.23Å; F610-S650 CarbonylContact O-C 3.56Å; F610-S650 WeakPolarHBondContact O-CA 3.16Å; F610-S650 WeakPolarHBondContact O-CB 3.47Å |
| 651 | A | 98.1 | Very high | 97.1 | Very high | 18 Ų | 18 | 71.5 Ų | 71.5 | 15% | 0.149 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -151 | 146.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | F610 L625 T633 L653 | F610-A651 PolarHBondContact N-O 3.36Å; F610-A651 PolarHBondContact O-N 3.11Å; L625-A651 HydrophobicContact CD2-CB 3.78Å; T633-A651 HydrophobicContact CG2-CB 4.18Å; A651-L653 HydrophobicContact CB-CD2 4.17Å; A651-L653 HydrophobicContact CB-CG 4.34Å |
| 652 | V | 98.3 | Very high | 97.3 | Very high | 88 Ų | 88 | 62.7 Ų | 62.7 | 53% | 0.533 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.6 | 122.2 | 167 | 177.5 | 0 | 0 | 0 | 0 | 107.5 | V607 Y608 Y609 L688 | V607-V652 HydrophobicContact CG1-CG1 3.26Å; Y608-V652 CarbonylContact O-C 3.51Å; Y608-V652 VanDerWaalsContact O-CA 3.29Å; Y608-V652 WeakPolarHBondContact O-CA 3.34Å; Y609-V652 HydrophobicContact CD2-CG2 3.87Å; V652-L688 HydrophobicContact CG1-CD1 4.19Å; V652-L688 HydrophobicContact CG2-CD1 4.23Å |
| 653 | L | 97.9 | Very high | 97.6 | Very high | 20 Ų | 20 | 59.6 Ų | 59.6 | 11% | 0.105 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.3 | 127.1 | -177.7 | -56.3 | 179.6 | 0 | 0 | 0 | 109.5 | Y608 F610 L625 K627 A632 A651 L655 V661 | Y608-L653 PolarHBondContact N-O 3.28Å; Y608-L653 PolarHBondContact O-N 3.4Å; F610-L653 HydrophobicContact CD2-CB 4.36Å; F610-L653 HydrophobicContact CD2-CD1 3.81Å; F610-L653 HydrophobicContact CD2-CG 4.13Å; F610-L653 HydrophobicContact CE2-CB 4.27Å; F610-L653 HydrophobicContact CE2-CD1 4.01Å; F610-L653 HydrophobicContact CE2-CG 4.44Å; L625-L653 HydrophobicContact CD2-CD1 3.92Å; K627-L653 HydrophobicContact CB-CD1 4.36Å; A632-L653 HydrophobicContact CB-CD1 4.38Å; A632-L653 HydrophobicContact CB-CD2 3.77Å; A651-L653 HydrophobicContact CB-CD2 4.17Å; A651-L653 HydrophobicContact CB-CG 4.34Å; L653-L655 HydrophobicContact CB-CD2 3.96Å; L653-L655 HydrophobicContact CB-CG 4.39Å; L653-V661 HydrophobicContact CD1-CG1 4.2Å; L653-V661 HydrophobicContact CD1-CG2 4.29Å |
| 654 | E | 97.9 | Very high | 97.8 | Very high | 135 Ų | 135 | 52.7 Ų | 52.7 | 63% | 0.631 | 29% | 0.287 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -76.2 | 123.1 | 164.6 | -174.3 | -179 | -177.1 | 0 | 0 | 108.4 | G606 K627 | G606-E654 CarbonylContact O-C 3.51Å; K627-E654 PolarHBondContact NZ-O 3.24Å |
| 655 | L | 98 | Very high | 97.9 | Very high | 1 Ų | 1 | 48.5 Ų | 48.5 | 1% | 0.005 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.7 | 143.2 | -178.2 | -57.5 | -174.1 | 0 | 0 | 0 | 110.1 | F600 A602 S605 G606 Y608 F610 K627 L653 D659 V661 | F600-L655 HydrophobicContact CD1-CD1 4.41Å; F600-L655 HydrophobicContact CE1-CD1 3.94Å; A602-L655 HydrophobicContact CB-CB 3.97Å; A602-L655 HydrophobicContact CB-CD1 3.92Å; S605-L655 CarbonylContact C-O 3.6Å; S605-L655 WeakPolarHBondContact CA-O 3.43Å; G606-L655 PolarHBondContact N-O 3.15Å; G606-L655 PolarHBondContact O-N 3.37Å; Y608-L655 HydrophobicContact CD1-CD1 4.45Å; Y608-L655 HydrophobicContact CD2-CB 3.72Å; Y608-L655 HydrophobicContact CD2-CD1 3.6Å; Y608-L655 HydrophobicContact CD2-CG 3.7Å; Y608-L655 HydrophobicContact CE2-CB 3.93Å; Y608-L655 HydrophobicContact CE2-CD1 4.12Å; Y608-L655 HydrophobicContact CE2-CG 4.34Å; Y608-L655 HydrophobicContact CG-CD1 3.79Å; Y608-L655 HydrophobicContact CG-CG 4.24Å; F610-L655 HydrophobicContact CE2-CD1 3.83Å; F610-L655 HydrophobicContact CZ-CD1 3.76Å; K627-L655 HydrophobicContact CD-CD2 3.7Å; K627-L655 HydrophobicContact CG-CD2 3.91Å; L653-L655 HydrophobicContact CB-CD2 3.96Å; L653-L655 HydrophobicContact CB-CG 4.39Å; L655-D659 WeakPolarHBondContact CA-OD2 3.13Å; L655-D659 HydrophobicContact CB-CB 4.12Å; L655-D659 HydrophobicContact CD2-CB 4.15Å; L655-V661 HydrophobicContact CD1-CG2 3.72Å; L655-V661 HydrophobicContact CD2-CG2 3.77Å; L655-V661 HydrophobicContact CG-CG2 4.43Å |
| 656 | K | 97.7 | Very high | 97.8 | Very high | 149 Ų | 149 | 46.5 Ų | 46.5 | 65% | 0.648 | 26% | 0.257 | S | S | * | . | trans | -91.9 | 158.1 | 165 | -64 | -177.5 | -179 | -178.2 | 0 | 109.7 | A602 G658 D659 | A602-K656 WeakPolarHBondContact CB-O 3.46Å; K656-G658 PolarHBondContact O-N 3.23Å; K656-D659 PolarHBondContact N-OD2 3.45Å; K656-D659 VanDerWaalsContact O-CB 3.26Å; K656-D659 WeakPolarHBondContact O-CB 3.08Å; K656-D659 PolarHBondContact O-N 3.31Å | ||
| 657 | E | 96.2 | Very high | 97.5 | Very high | 142 Ų | 142 | 44 Ų | 44 | 66% | 0.664 | 25% | 0.248 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -52.6 | 127.7 | 170 | -171.7 | 179.4 | 172 | 0 | 0 | 110.4 | S605 | S605-E657 PolarHBondContact OG-N 3.15Š|
| 658 | G | 96.7 | Very high | 97.3 | Very high | 45 Ų | 45 | 49.1 Ų | 49.1 | 46% | 0.464 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 87.7 | -7.5 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | A602 K656 | A602-G658 PolarHBondContact O-N 3.24Å; K656-G658 PolarHBondContact O-N 3.23Å |
| 659 | D | 98.3 | Very high | 97 | Very high | 22 Ų | 22 | 54.5 Ų | 54.5 | 12% | 0.118 | 29% | 0.294 | C | S | . | . | trans | -63.1 | 140.3 | 173.2 | -80.6 | -9.1 | 0 | 0 | 0 | 110.6 | T601 A602 K627 N628 L655 K656 | T601-D659 WeakPolarHBondContact CA-O 3.22Å; A602-D659 HydrophobicContact CB-CB 4.49Å; A602-D659 PolarHBondContact N-O 3.2Å; K627-D659 WeakPolarHBondContact CE-OD2 3.37Å; K627-D659 IonicContact NZ-OD2 3.27Å; K627-D659 PolarHBondContact NZ-OD2 3.23Å; N628-D659 VanDerWaalsContact ND2-CG 3.27Å; N628-D659 PolarHBondContact ND2-OD1 3.39Å; N628-D659 WeakPolarHBondContact OD1-CA 3.42Å; L655-D659 WeakPolarHBondContact CA-OD2 3.13Å; L655-D659 HydrophobicContact CB-CB 4.12Å; L655-D659 HydrophobicContact CD2-CB 4.15Å; K656-D659 PolarHBondContact N-OD2 3.45Å; K656-D659 VanDerWaalsContact O-CB 3.26Å; K656-D659 WeakPolarHBondContact O-CB 3.08Å; K656-D659 PolarHBondContact O-N 3.31Å | ||
| 660 | E | 98.5 | Very high | 96.8 | Very high | 74 Ų | 74 | 54.3 Ų | 54.3 | 35% | 0.346 | 29% | 0.291 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.5 | 137.1 | -178.2 | -66.6 | -174.7 | 149.8 | 0 | 0 | 111.6 | I599 F600 K627 N628 W662 | I599-E660 HydrophobicContact CG2-CB 3.81Å; I599-E660 HydrophobicContact CG2-CG 3.99Å; F600-E660 CarbonylContact O-C 3.58Å; F600-E660 VanDerWaalsContact O-CA 3.3Å; F600-E660 WeakPolarHBondContact O-CA 3.36Å; K627-E660 CarbonylContact C-O 3.58Å; K627-E660 WeakPolarHBondContact CA-O 3.19Å; N628-E660 PolarHBondContact N-O 2.84Å; N628-E660 PolarHBondContact OD1-N 3.28Å; N628-E660 PolarHBondContact OD1-O 3.29Å; E660-W662 HydrophobicContact CB-CE3 4.3Å; E660-W662 HydrophobicContact CB-CZ3 3.97Å |
| 661 | V | 98.7 | Very high | 96.8 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.3 | 133.8 | 178.3 | -177.4 | 0 | 0 | 0 | 0 | 110.8 | F600 F610 L625 Y626 L653 L655 F683 | F600-V661 WeakPolarHBondContact CB-O 3.15Å; F600-V661 HydrophobicContact CD1-CB 4.28Å; F600-V661 PolarHBondContact N-O 3.13Å; F600-V661 PolarHBondContact O-N 3.12Å; F610-V661 HydrophobicContact CD1-CG1 3.93Å; F610-V661 HydrophobicContact CD2-CG1 4.22Å; F610-V661 HydrophobicContact CE1-CB 3.97Å; F610-V661 HydrophobicContact CE1-CG1 3.71Å; F610-V661 HydrophobicContact CE1-CG2 4.45Å; F610-V661 HydrophobicContact CE2-CB 4.37Å; F610-V661 HydrophobicContact CE2-CG1 4.03Å; F610-V661 HydrophobicContact CE2-CG2 4.04Å; F610-V661 HydrophobicContact CG-CG1 4.17Å; F610-V661 HydrophobicContact CZ-CB 3.82Å; F610-V661 HydrophobicContact CZ-CG1 3.78Å; F610-V661 HydrophobicContact CZ-CG2 3.79Å; L625-V661 HydrophobicContact CD1-CG1 3.72Å; L625-V661 HydrophobicContact CG-CG1 4.19Å; Y626-V661 VanDerWaalsContact O-CA 3.23Å; Y626-V661 WeakPolarHBondContact O-CA 3.39Å; Y626-V661 WeakPolarHBondContact O-CG1 3.26Å; L653-V661 HydrophobicContact CD1-CG1 4.2Å; L653-V661 HydrophobicContact CD1-CG2 4.29Å; L655-V661 HydrophobicContact CD1-CG2 3.72Å; L655-V661 HydrophobicContact CD2-CG2 3.77Å; L655-V661 HydrophobicContact CG-CG2 4.43Å; V661-F683 HydrophobicContact CG1-CZ 4.31Å |
| 662 | W | 98.7 | Very high | 96.7 | Very high | 8 Ų | 8 | 52.8 Ų | 52.8 | 3% | 0.03 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -153.3 | 167.6 | 177.2 | 67.3 | 96.4 | 0 | 0 | 0 | 112.2 | P579 G598 I599 L625 Y626 N629 E660 Q664 | P579-W662 HydrophobicContact CB-CB 4.17Å; P579-W662 HydrophobicContact CB-CG 3.95Å; P579-W662 HydrophobicContact CG-CD2 4.45Å; P579-W662 HydrophobicContact CG-CG 4.08Å; G598-W662 WeakPolarHBondContact O-CB 3.2Å; I599-W662 HydrophobicContact CG1-CB 4.18Å; I599-W662 HydrophobicContact CG2-CE3 4.48Å; L625-W662 CarbonylContact C-O 3.5Å; L625-W662 WeakPolarHBondContact CA-O 3.36Å; Y626-W662 HydrophobicContact CD1-CZ2 4.15Å; Y626-W662 AromaticContact CD2-NE1 3.78Å; Y626-W662 AromaticContact CG-CE2 3.82Å; Y626-W662 AromaticContact CG-CZ2 3.95Å; Y626-W662 HydrophobicContact CG-CZ2 3.95Å; Y626-W662 AromaticContact CG-NE1 3.79Å; Y626-W662 PolarHBondContact N-O 3.04Å; Y626-W662 PolarHBondContact O-N 3.1Å; Y626-W662 VanDerWaalsContact O-N 3.17Å; N629-W662 HydrophobicContact CB-CH2 4.24Å; N629-W662 VanDerWaalsContact OD1-CH2 3.28Å; N629-W662 WeakPolarHBondContact OD1-CH2 3.41Å; E660-W662 HydrophobicContact CB-CE3 4.3Å; E660-W662 HydrophobicContact CB-CZ3 3.97Å; W662-Q664 VanDerWaalsContact NE1-OE1 3.07Å |
| 663 | V | 98.5 | Very high | 96.7 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 25% | 0.25 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.2 | 137.7 | 170.7 | -171.6 | 0 | 0 | 0 | 0 | 109 | I580 F582 Y612 V623 A624 L625 F683 | I580-V663 WeakPolarHBondContact CB-O 3.43Å; I580-V663 HydrophobicContact CD1-CB 4.3Å; I580-V663 HydrophobicContact CD1-CG1 3.91Å; I580-V663 PolarHBondContact N-O 3.09Å; F582-V663 HydrophobicContact CE2-CB 4.28Å; Y612-V663 HydrophobicContact CD1-CG2 4.12Å; Y612-V663 HydrophobicContact CG-CG2 4.27Å; V623-V663 HydrophobicContact CB-CG1 4.02Å; V623-V663 HydrophobicContact CG1-CG1 4.41Å; A624-V663 WeakPolarHBondContact O-CA 3.35Å; L625-V663 HydrophobicContact CD1-CG2 3.9Å; V663-F683 HydrophobicContact CG2-CD1 4.07Å; V663-F683 HydrophobicContact CG2-CD2 3.7Å; V663-F683 HydrophobicContact CG2-CE1 4.09Å; V663-F683 HydrophobicContact CG2-CE2 3.71Å; V663-F683 HydrophobicContact CG2-CG 3.88Å; V663-F683 HydrophobicContact CG2-CZ 3.91Å |
| 664 | Q | 97.8 | Very high | 96.7 | Very high | 27 Ų | 27 | 49.4 Ų | 49.4 | 13% | 0.126 | 25% | 0.252 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.4 | 146.9 | 179.8 | 162.9 | 175.1 | -15.9 | 0 | 0 | 110.8 | A577 L578 A624 Y626 W662 P666 | A577-Q664 PolarHBondContact O-NE2 2.89Å; A577-Q664 VanDerWaalsContact O-NE2 3.12Å; L578-Q664 WeakPolarHBondContact O-CG 3.43Å; A624-Q664 PolarHBondContact N-O 3.17Å; A624-Q664 PolarHBondContact O-N 3.1Å; Y626-Q664 HydrophobicContact CD2-CB 3.96Å; Y626-Q664 HydrophobicContact CE2-CB 3.78Å; Y626-Q664 HydrophobicContact CE2-CG 4.11Å; W662-Q664 VanDerWaalsContact NE1-OE1 3.07Å; Q664-P666 WeakPolarHBondContact O-CD 3.46Å |
| 665 | M | 97.6 | Very high | 96.7 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 22% | 0.222 | C | C | . | . | trans | -86.4 | 115.9 | 168.1 | -67.9 | 172 | -64.9 | 0 | 0 | 109.3 | P574 A577 I580 L621 W622 V623 S667 N671 L673 | P574-M665 HydrophobicContact CG-CE 3.8Å; P574-M665 WeakPolarHBondContact O-CE 3.28Å; A577-M665 PolarHBondContact N-O 2.83Å; I580-M665 HydrophobicContact CD1-CG 4.29Å; I580-M665 HydrophobicContact CG1-CE 4.46Å; L621-M665 HydrophobicContact CD1-CG 4.29Å; L621-M665 HydrophobicContact CD1-SD 3.94Å; W622-M665 WeakPolarHBondContact O-CA 3.42Å; W622-M665 WeakPolarHBondContact O-CG 3.32Å; V623-M665 HydrophobicContact CG1-CG 3.72Å; M665-S667 VanDerWaalsContact C-N 3.27Å; M665-S667 PolarHBondContact O-N 3.14Å; M665-N671 HydrophobicContact CE-CB 4.39Å; M665-N671 VanDerWaalsContact SD-CA 3.52Å; M665-N671 HydrophobicContact SD-CB 3.87Å; M665-L673 HydrophobicContact CE-CB 4.42Å; M665-L673 HydrophobicContact SD-CB 3.78Å; M665-L673 HydrophobicContact SD-CD2 4.47Å | ||
| 666 | P | 94.8 | Very high | 96.5 | Very high | 37 Ų | 37 | 44.5 Ų | 44.5 | 24% | 0.24 | 23% | 0.231 | C | C | . | . | S | Bend | trans | -70.6 | -21.9 | -176.8 | -19.3 | 33 | 0 | 0 | 0 | 114 | W622 A624 Y634 Q664 | W622-P666 HydrophobicContact CD2-CB 4.46Å; W622-P666 HydrophobicContact CD2-CG 4.09Å; W622-P666 HydrophobicContact CE3-CB 4.08Å; W622-P666 HydrophobicContact CE3-CG 4.21Å; W622-P666 HydrophobicContact CH2-CB 3.91Å; W622-P666 HydrophobicContact CH2-CG 4.22Å; W622-P666 HydrophobicContact CZ2-CB 4.29Å; W622-P666 HydrophobicContact CZ2-CG 4.09Å; W622-P666 HydrophobicContact CZ3-CB 3.8Å; W622-P666 HydrophobicContact CZ3-CG 4.28Å; W622-P666 VanDerWaalsContact O-CD 3.27Å; W622-P666 WeakPolarHBondContact O-CD 3.19Å; A624-P666 HydrophobicContact CB-CG 4.17Å; Y634-P666 HydrophobicContact CE1-CG 4.37Å; Q664-P666 WeakPolarHBondContact O-CD 3.46Å |
| 667 | S | 92.6 | Very high | 96.2 | Very high | 25 Ų | 25 | 43.8 Ų | 43.8 | 18% | 0.175 | 23% | 0.231 | C | C | . | . | trans | -134.6 | 147.7 | -174.1 | -179.8 | 0 | 0 | 0 | 0 | 111.5 | S576 M665 Q669 | S576-S667 PolarHBondContact OG-O 2.89Å; M665-S667 VanDerWaalsContact C-N 3.27Å; M665-S667 PolarHBondContact O-N 3.14Å; S667-Q669 VanDerWaalsContact C-N 3.33Å; S667-Q669 PolarHBondContact OG-N 2.99Å; S667-Q669 VanDerWaalsContact OG-N 3.17Å | ||
| 668 | D | 92.3 | Very high | 95.9 | Very high | 114 Ų | 114 | 46.2 Ų | 46.2 | 61% | 0.61 | 24% | 0.235 | S | C | * | . | S | Bend | trans | -76.8 | -19.8 | 171.4 | 63 | -18.2 | 0 | 0 | 0 | 112.7 | A670 N671 | D668-A670 VanDerWaalsContact C-N 3.25Å; D668-A670 PolarHBondContact O-N 3.31Å; D668-N671 PolarHBondContact O-ND2 3.15Å; D668-N671 PolarHBondContact O-OD1 2.82Å |
| 669 | Q | 91.9 | Very high | 95.9 | Very high | 167 Ų | 167 | 46.2 Ų | 46.2 | 78% | 0.78 | 22% | 0.224 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -70.9 | -21.9 | 178 | -62.1 | -175 | -19.7 | 0 | 0 | 113.2 | S667 | S667-Q669 VanDerWaalsContact C-N 3.33Å; S667-Q669 PolarHBondContact OG-N 2.99Å; S667-Q669 VanDerWaalsContact OG-N 3.17Å |
| 670 | A | 95.1 | Very high | 95.8 | Very high | 8 Ų | 8 | 48.8 Ų | 48.8 | 7% | 0.066 | 24% | 0.235 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -132.7 | 59 | -176.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | S620 W622 Y636 D668 | S620-A670 CarbonylContact O-C 3.45Å; S620-A670 WeakPolarHBondContact O-CA 3.47Å; W622-A670 HydrophobicContact CB-CB 3.54Å; W622-A670 PolarHBondContact N-O 2.79Å; Y636-A670 HydrophobicContact CE2-CB 4.24Å; D668-A670 VanDerWaalsContact C-N 3.25Å; D668-A670 PolarHBondContact O-N 3.31Å |
| 671 | N | 96.5 | Very high | 95.8 | Very high | 47 Ų | 47 | 45.3 Ų | 45.3 | 25% | 0.251 | 22% | 0.219 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.3 | 26.5 | -173.6 | 67.9 | -9.3 | 0 | 0 | 0 | 114.1 | S576 T619 S620 M665 D668 L673 | S576-N671 WeakPolarHBondContact OG-CB 3.3Å; T619-N671 PolarHBondContact OG1-OD1 3.16Å; T619-N671 VanDerWaalsContact OG1-OD1 3.13Å; S620-N671 PolarHBondContact O-N 3.07Å; M665-N671 HydrophobicContact CE-CB 4.39Å; M665-N671 VanDerWaalsContact SD-CA 3.52Å; M665-N671 HydrophobicContact SD-CB 3.87Å; D668-N671 PolarHBondContact O-ND2 3.15Å; D668-N671 PolarHBondContact O-OD1 2.82Å; N671-L673 PolarHBondContact O-N 3.36Å |
| 672 | G | 97.1 | Very high | 95.8 | Very high | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 23% | 0.225 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -71.5 | 32 | -175.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | V616 K617 T619 S620 Y674 | V616-G672 CarbonylContact C-O 3.56Å; V616-G672 WeakPolarHBondContact CA-O 3.38Å; K617-G672 PolarHBondContact N-O 2.55Å; K617-G672 WeakPolarHBondContact O-CA 3.41Å; T619-G672 WeakPolarHBondContact O-CA 3.42Å; T619-G672 WeakPolarHBondContact OG1-CA 3.2Å; T619-G672 PolarHBondContact OG1-N 3.24Å; S620-G672 PolarHBondContact O-N 3.28Å; G672-Y674 PolarHBondContact O-N 3.03Å |
| 673 | L | 98.1 | Very high | 95.8 | Very high | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 22% | 0.223 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -73.7 | 115.6 | -179.3 | 178.4 | 55.3 | 0 | 0 | 0 | 110.2 | L569 F573 P574 I580 M614 L621 M665 N671 S681 | L569-L673 HydrophobicContact CD2-CD2 3.87Å; L569-L673 HydrophobicContact CD2-CG 3.99Å; F573-L673 WeakPolarHBondContact CA-O 3.36Å; F573-L673 WeakPolarHBondContact CD1-O 3.39Å; F573-L673 PolarHBondContact N-O 2.83Å; P574-L673 HydrophobicContact CG-CB 4.48Å; P574-L673 HydrophobicContact CG-CD2 3.67Å; P574-L673 HydrophobicContact CG-CG 4.25Å; I580-L673 HydrophobicContact CD1-CD2 3.65Å; I580-L673 HydrophobicContact CG1-CD2 4.31Å; I580-L673 HydrophobicContact CG2-CD2 4.13Å; M614-L673 HydrophobicContact CB-CD1 3.68Å; M614-L673 HydrophobicContact CG-CD1 3.92Å; M614-L673 HydrophobicContact SD-CD1 3.28Å; M614-L673 WeakPolarHBondContact SD-CD1 3.27Å; M614-L673 HydrophobicContact SD-CD2 3.93Å; M614-L673 HydrophobicContact SD-CG 4.28Å; L621-L673 HydrophobicContact CD1-CB 3.73Å; L621-L673 HydrophobicContact CD2-CD1 4.42Å; M665-L673 HydrophobicContact CE-CB 4.42Å; M665-L673 HydrophobicContact SD-CB 3.78Å; M665-L673 HydrophobicContact SD-CD2 4.47Å; N671-L673 PolarHBondContact O-N 3.36Å; L673-S681 WeakPolarHBondContact CD1-OG 3.38Å |
| 674 | Y | 98 | Very high | 95.8 | Very high | 37 Ų | 37 | 46.9 Ų | 46.9 | 15% | 0.145 | 23% | 0.231 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -111.6 | 138.6 | -176.4 | -169.9 | -114 | 0 | 0 | 0 | 111.5 | P572 F573 H615 K617 M644 G672 T676 I679 S681 | P572-Y674 HydrophobicContact CB-CD2 3.67Å; P572-Y674 HydrophobicContact CB-CE2 3.92Å; F573-Y674 HydrophobicContact CE1-CD2 4.28Å; F573-Y674 HydrophobicContact CE2-CD2 4.15Å; F573-Y674 HydrophobicContact CE2-CE2 4.44Å; F573-Y674 AromaticContact CZ-CD2 3.74Å; F573-Y674 HydrophobicContact CZ-CD2 3.74Å; F573-Y674 HydrophobicContact CZ-CE2 4.33Å; H615-Y674 WeakPolarHBondContact CB-O 3.35Å; H615-Y674 PolarHBondContact O-N 3.45Å; K617-Y674 HydrophobicContact CB-CD1 4.25Å; K617-Y674 HydrophobicContact CB-CD2 4.14Å; K617-Y674 HydrophobicContact CB-CG 3.76Å; K617-Y674 HydrophobicContact CD-CD1 3.86Å; K617-Y674 HydrophobicContact CD-CD2 3.8Å; K617-Y674 HydrophobicContact CD-CE1 3.82Å; K617-Y674 HydrophobicContact CD-CE2 3.8Å; K617-Y674 HydrophobicContact CD-CG 3.84Å; K617-Y674 HydrophobicContact CG-CG 4.47Å; K617-Y674 PolarHBondContact NZ-OH 3.04Å; M644-Y674 HydrophobicContact SD-CD1 3.83Å; M644-Y674 HydrophobicContact SD-CE1 4.12Å; G672-Y674 PolarHBondContact O-N 3.03Å; Y674-T676 HydrophobicContact CE1-CG2 3.85Å; Y674-T676 HydrophobicContact CE2-CG2 4.18Å; Y674-T676 WeakPolarHBondContact OH-CG2 3.41Å; Y674-I679 HydrophobicContact CD1-CG2 4.33Å; Y674-I679 HydrophobicContact CE1-CD1 3.95Å; Y674-S681 PolarHBondContact O-OG 3.29Å |
| 675 | S | 97.6 | Very high | 95.8 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 23% | 0.225 | C | C | . | . | trans | -157.5 | 149.7 | 172.7 | -152.6 | 0 | 0 | 0 | 0 | 110.5 | L569 P572 I679 S681 | L569-S675 VanDerWaalsContact O-CB 3.23Å; L569-S675 WeakPolarHBondContact O-CB 3.48Å; L569-S675 PolarHBondContact O-OG 3.27Å; P572-S675 WeakPolarHBondContact CB-O 3.42Å; P572-S675 WeakPolarHBondContact CD-O 3.01Å; S675-I679 CarbonylContact C-O 3.58Å; S675-I679 WeakPolarHBondContact CA-O 3.44Å; S675-I679 PolarHBondContact OG-O 3.27Å; S675-I679 VanDerWaalsContact OG-O 3.1Å; S675-S681 PolarHBondContact OG-N 3.35Å | ||
| 676 | T | 94.6 | Very high | 95.8 | Very high | 32 Ų | 32 | 49.9 Ų | 49.9 | 20% | 0.196 | 24% | 0.244 | C | C | . | . | trans | -146.7 | -177.2 | 177.3 | 71 | 0 | 0 | 0 | 0 | 110.3 | Y674 Y678 I679 H680 | Y674-T676 HydrophobicContact CE1-CG2 3.85Å; Y674-T676 HydrophobicContact CE2-CG2 4.18Å; Y674-T676 WeakPolarHBondContact OH-CG2 3.41Å; T676-Y678 PolarHBondContact O-N 2.94Å; T676-Y678 PolarHBondContact OG1-N 3.27Å; T676-Y678 VanDerWaalsContact OG1-N 3.16Å; T676-I679 PolarHBondContact N-O 3.14Å; T676-I679 VanDerWaalsContact O-O 3.14Å; T676-I679 PolarHBondContact OG1-N 3.14Å; T676-H680 PolarHBondContact O-ND1 3.21Å | ||
| 677 | E | 90.1 | Very high | 95.9 | Very high | 135 Ų | 135 | 48.9 Ų | 48.9 | 63% | 0.631 | 24% | 0.236 | S | C | * | . | S | Bend | trans | -64 | -17.7 | 171.6 | -160.2 | -176.6 | 162.6 | 0 | 0 | 113.6 | H680 | E677-H680 PolarHBondContact O-CE1 3.11Š|
| 678 | Y | 91.3 | Very high | 96 | Very high | 192 Ų | 192 | 52 Ų | 52 | 75% | 0.753 | 25% | 0.25 | S | S | * | . | S | Bend | trans | -116.7 | -14.9 | -177.9 | -53.1 | -67.1 | 0 | 0 | 0 | 113.9 | T676 | T676-Y678 PolarHBondContact O-N 2.94Å; T676-Y678 PolarHBondContact OG1-N 3.27Å; T676-Y678 VanDerWaalsContact OG1-N 3.16Å |
| 679 | I | 95.4 | Very high | 96 | Very high | 46 Ų | 46 | 49.8 Ų | 49.8 | 24% | 0.236 | 24% | 0.243 | C | C | . | . | S | Bend | trans | -126.9 | 106.6 | -178.3 | -64 | 166.1 | 0 | 0 | 0 | 106.6 | H615 M644 Y674 S675 T676 | H615-I679 HydrophobicContact CB-CG2 3.94Å; H615-I679 WeakPolarHBondContact CD2-CG2 3.43Å; M644-I679 HydrophobicContact CE-CD1 3.92Å; M644-I679 HydrophobicContact CE-CG2 4.21Å; M644-I679 HydrophobicContact SD-CD1 4Å; M644-I679 HydrophobicContact SD-CG2 4.2Å; Y674-I679 HydrophobicContact CD1-CG2 4.33Å; Y674-I679 HydrophobicContact CE1-CD1 3.95Å; S675-I679 CarbonylContact C-O 3.58Å; S675-I679 WeakPolarHBondContact CA-O 3.44Å; S675-I679 PolarHBondContact OG-O 3.27Å; S675-I679 VanDerWaalsContact OG-O 3.1Å; T676-I679 PolarHBondContact N-O 3.14Å; T676-I679 VanDerWaalsContact O-O 3.14Å; T676-I679 PolarHBondContact OG1-N 3.14Å |
| 680 | H | 96.4 | Very high | 96 | Very high | 76 Ų | 76 | 45.2 Ų | 45.2 | 35% | 0.352 | 23% | 0.228 | S | C | . | . | trans | -102.9 | 112.6 | -168.1 | -57.8 | -47 | 0 | 0 | 0 | 111.7 | I568 H615 T676 E677 | I568-H680 HydrophobicContact CG2-CB 4.23Å; H615-H680 PolarHBondContact CD2-O 3.3Å; T676-H680 PolarHBondContact O-ND1 3.21Å; E677-H680 PolarHBondContact O-CE1 3.11Å | ||
| 681 | S | 98.4 | Very high | 95.6 | Very high | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 26% | 0.263 | C | S | . | . | trans | -79.6 | 129.7 | 155.9 | -69.1 | 0 | 0 | 0 | 0 | 109.1 | I568 L569 H613 M614 H615 L673 Y674 S675 | I568-S681 WeakPolarHBondContact CA-O 3.03Å; L569-S681 PolarHBondContact N-O 3.49Å; H613-S681 CarbonylContact O-C 3.57Å; H613-S681 WeakPolarHBondContact O-CA 3.3Å; M614-S681 WeakPolarHBondContact CA-OG 3.39Å; H615-S681 PolarHBondContact N-OG 2.77Å; L673-S681 WeakPolarHBondContact CD1-OG 3.38Å; Y674-S681 PolarHBondContact O-OG 3.29Å; S675-S681 PolarHBondContact OG-N 3.35Å | ||
| 682 | S | 98.5 | Very high | 95.6 | Very high | 18 Ų | 18 | 51.2 Ų | 51.2 | 13% | 0.126 | 26% | 0.263 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.2 | 154.1 | -170.1 | 67.3 | 0 | 0 | 0 | 0 | 113 | A567 Y612 H613 M614 | A567-S682 CarbonylContact O-C 2.95Å; A567-S682 VanDerWaalsContact O-CA 3.28Å; A567-S682 WeakPolarHBondContact O-CA 3.32Å; Y612-S682 CarbonylContact C-O 3.41Å; Y612-S682 VanDerWaalsContact CA-O 3.27Å; Y612-S682 WeakPolarHBondContact CA-O 3.5Å; H613-S682 PolarHBondContact N-O 3.17Å; H613-S682 PolarHBondContact O-N 3.46Å; M614-S682 WeakPolarHBondContact CE-O 3.43Å |
| 683 | F | 98.7 | Very high | 95.5 | Very high | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.5 | 129.8 | 173.1 | 178 | -141.8 | 0 | 0 | 0 | 109.5 | F565 T566 A567 F582 Y593 F610 A611 L625 V661 V663 | F565-F683 AromaticContact CE2-CD1 3.64Å; F565-F683 HydrophobicContact CE2-CD1 3.64Å; F565-F683 AromaticContact CE2-CE1 3.9Å; F565-F683 HydrophobicContact CE2-CE1 3.9Å; F565-F683 HydrophobicContact CE2-CG 4.03Å; F565-F683 HydrophobicContact CE2-CZ 4.49Å; F565-F683 WeakPolarHBondContact CE2-O 3.33Å; F565-F683 AromaticContact CZ-CD1 3.73Å; F565-F683 HydrophobicContact CZ-CD1 3.73Å; F565-F683 HydrophobicContact CZ-CD2 4.37Å; F565-F683 AromaticContact CZ-CE1 3.5Å; F565-F683 HydrophobicContact CZ-CE1 3.5Å; F565-F683 HydrophobicContact CZ-CE2 4.18Å; F565-F683 HydrophobicContact CZ-CG 4.17Å; F565-F683 AromaticContact CZ-CZ 3.75Å; F565-F683 HydrophobicContact CZ-CZ 3.75Å; T566-F683 WeakPolarHBondContact CA-O 3.37Å; A567-F683 PolarHBondContact N-O 3.29Å; A567-F683 PolarHBondContact O-N 3.28Å; F582-F683 HydrophobicContact CD1-CB 4.07Å; F582-F683 HydrophobicContact CD2-CB 3.67Å; F582-F683 HydrophobicContact CD2-CD1 4.03Å; F582-F683 HydrophobicContact CD2-CG 4.32Å; F582-F683 HydrophobicContact CE1-CB 3.93Å; F582-F683 HydrophobicContact CE2-CB 3.5Å; F582-F683 AromaticContact CE2-CD1 3.99Å; F582-F683 HydrophobicContact CE2-CD1 3.99Å; F582-F683 HydrophobicContact CE2-CG 4.06Å; F582-F683 HydrophobicContact CG-CB 3.98Å; F582-F683 HydrophobicContact CZ-CB 3.66Å; Y593-F683 HydrophobicContact CE2-CD1 4.16Å; Y593-F683 HydrophobicContact CE2-CE1 4.4Å; F610-F683 HydrophobicContact CB-CE2 4.22Å; F610-F683 AromaticContact CD1-CE2 3.84Å; F610-F683 HydrophobicContact CD1-CE2 3.84Å; F610-F683 AromaticContact CD1-CZ 3.79Å; F610-F683 HydrophobicContact CD1-CZ 3.79Å; F610-F683 HydrophobicContact CE1-CZ 4.36Å; F610-F683 HydrophobicContact CG-CE2 4.46Å; A611-F683 WeakPolarHBondContact O-CD2 3.35Å; L625-F683 HydrophobicContact CD1-CE2 3.72Å; L625-F683 HydrophobicContact CD1-CZ 3.79Å; V661-F683 HydrophobicContact CG1-CZ 4.31Å; V663-F683 HydrophobicContact CG2-CD1 4.07Å; V663-F683 HydrophobicContact CG2-CD2 3.7Å; V663-F683 HydrophobicContact CG2-CE1 4.09Å; V663-F683 HydrophobicContact CG2-CE2 3.71Å; V663-F683 HydrophobicContact CG2-CG 3.88Å; V663-F683 HydrophobicContact CG2-CZ 3.91Å |
| 684 | S | 98.6 | Very high | 95.4 | Very high | 24 Ų | 24 | 56.8 Ų | 56.8 | 17% | 0.168 | 29% | 0.292 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.5 | 148.5 | -175.5 | -62.2 | 0 | 0 | 0 | 0 | 110.3 | F565 T566 F610 A611 | F565-S684 WeakPolarHBondContact O-CA 3.23Å; T566-S684 WeakPolarHBondContact CB-OG 3.36Å; T566-S684 VanDerWaalsContact CG2-OG 3.28Å; T566-S684 WeakPolarHBondContact CG2-OG 3.33Å; T566-S684 WeakPolarHBondContact OG1-CB 3.15Å; T566-S684 PolarHBondContact OG1-OG 3.49Å; F610-S684 WeakPolarHBondContact CA-O 3.48Å; A611-S684 PolarHBondContact N-O 3.15Å; A611-S684 PolarHBondContact O-N 3.08Å; A611-S684 VanDerWaalsContact O-O 3.11Å |
| 685 | G | 98.1 | Very high | 95.2 | Very high | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 30% | 0.301 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -155.5 | 146.5 | 172 | 0 | 0 | 0 | 0 | 0 | 111.6 | A564 F565 Y609 | A564-G685 CarbonylContact C-O 3.59Å; A564-G685 VanDerWaalsContact CA-O 3.24Å; A564-G685 WeakPolarHBondContact CA-O 3.37Å; F565-G685 WeakPolarHBondContact CD1-O 3.22Å; F565-G685 PolarHBondContact N-O 3.46Å; F565-G685 PolarHBondContact O-N 3.43Å; F565-G685 VanDerWaalsContact O-N 3.07Å; Y609-G685 CarbonylContact O-C 3.53Å; Y609-G685 WeakPolarHBondContact O-CA 3.35Å |
| 686 | F | 97.3 | Very high | 95.1 | Very high | 89 Ų | 89 | 61.6 Ų | 61.6 | 39% | 0.39 | 32% | 0.32 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -152 | 152.1 | 176.6 | 62 | -88.8 | 0 | 0 | 0 | 112.4 | P563 A564 Y608 Y609 L688 | P563-F686 WeakPolarHBondContact O-CA 3.23Å; A564-F686 HydrophobicContact CB-CB 3.51Å; Y608-F686 CarbonylContact C-O 3.48Å; Y608-F686 WeakPolarHBondContact CA-O 3.25Å; Y609-F686 HydrophobicContact CD1-CD1 4.21Å; Y609-F686 AromaticContact CD1-CE1 3.4Å; Y609-F686 HydrophobicContact CD1-CE1 3.4Å; Y609-F686 AromaticContact CD1-CZ 3.74Å; Y609-F686 HydrophobicContact CD1-CZ 3.74Å; Y609-F686 HydrophobicContact CE1-CE1 4.2Å; Y609-F686 HydrophobicContact CG-CE1 4.16Å; Y609-F686 HydrophobicContact CG-CZ 4.14Å; Y609-F686 PolarHBondContact N-O 3.05Å; Y609-F686 PolarHBondContact O-N 3.32Å; F686-L688 HydrophobicContact CD2-CD2 4.27Å; F686-L688 HydrophobicContact CE2-CD2 3.49Å; F686-L688 VanDerWaalsContact CE2-CD2 3.49Å; F686-L688 HydrophobicContact CE2-CG 4.23Å; F686-L688 HydrophobicContact CZ-CD2 4.19Å; F686-L688 PolarHBondContact O-N 3.46Å |
| 687 | L | 96.4 | Very high | 95.1 | Very high | 16 Ų | 16 | 63.6 Ų | 63.6 | 8% | 0.084 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.4 | 124.1 | 173.4 | -179.7 | 67.9 | 0 | 0 | 0 | 110.3 | L557 P563 L604 Y608 P690 | L557-L687 HydrophobicContact CD1-CD2 4.26Å; P563-L687 PolarHBondContact O-N 3.36Å; L604-L687 HydrophobicContact CD1-CD2 4.5Å; Y608-L687 HydrophobicContact CD1-CB 4.09Å; Y608-L687 HydrophobicContact CD1-CD1 4.42Å; Y608-L687 HydrophobicContact CD2-CD1 4Å; Y608-L687 HydrophobicContact CE1-CB 3.67Å; Y608-L687 HydrophobicContact CE1-CD1 4.02Å; Y608-L687 HydrophobicContact CE1-CG 4.43Å; Y608-L687 HydrophobicContact CE2-CD1 3.58Å; Y608-L687 HydrophobicContact CG-CD1 4.41Å; L687-P690 HydrophobicContact CD2-CB 4.25Å |
| 688 | L | 94.7 | Very high | 95.4 | Very high | 90 Ų | 90 | 58.5 Ų | 58.5 | 47% | 0.471 | 31% | 0.307 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.4 | -48 | 171.4 | -71.7 | 171.4 | 0 | 0 | 0 | 111.6 | V607 V652 F686 | V607-L688 HydrophobicContact CG1-CD1 4.19Å; V607-L688 WeakPolarHBondContact O-CA 3.47Å; V607-L688 WeakPolarHBondContact O-CB 3.43Å; V607-L688 PolarHBondContact O-N 3.47Å; V652-L688 HydrophobicContact CG1-CD1 4.19Å; V652-L688 HydrophobicContact CG2-CD1 4.23Å; F686-L688 HydrophobicContact CD2-CD2 4.27Å; F686-L688 HydrophobicContact CE2-CD2 3.49Å; F686-L688 VanDerWaalsContact CE2-CD2 3.49Å; F686-L688 HydrophobicContact CE2-CG 4.23Å; F686-L688 HydrophobicContact CZ-CD2 4.19Å; F686-L688 PolarHBondContact O-N 3.46Å |
| 689 | C | 93.3 | Very high | 95.8 | Very high | 68 Ų | 68 | 48.2 Ų | 48.2 | 46% | 0.459 | 27% | 0.272 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -150 | 119.7 | -174.6 | -173.5 | 0 | 0 | 0 | 0 | 109.9 | G606 V607 | G606-C689 CarbonylContact C-O 3.48Å; G606-C689 WeakPolarHBondContact CA-O 3.4Å; V607-C689 HydrophobicContact CB-CB 4.5Å; V607-C689 PolarHBondContact N-O 3.19Å; V607-C689 PolarHBondContact O-N 3.37Å |
| 690 | P | 91.9 | Very high | 95.8 | Very high | 71 Ų | 71 | 48.4 Ų | 48.4 | 46% | 0.461 | 28% | 0.275 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.8 | 147.7 | 171.5 | 30.9 | -36.2 | 0 | 0 | 0 | 110.5 | L557 L687 | L557-P690 HydrophobicContact CD1-CB 4.13Å; L557-P690 HydrophobicContact CD1-CG 3.72Å; L687-P690 HydrophobicContact CD2-CB 4.25Å |
| 691 | T | 87.1 | Confident | 95.7 | Very high | 129 Ų | 129 | 45.9 Ų | 45.9 | 79% | 0.791 | 27% | 0.268 | S | S | * | . | trans | -129.7 | 0 | -179.3 | 56.9 | 0 | 0 | 0 | 0 | 112.6 | S605 G606 V607 | S605-T691 PolarHBondContact O-N 3.44Å; S605-T691 VanDerWaalsContact O-N 3.08Å; G606-T691 VanDerWaalsContact CA-OG1 3.28Å; G606-T691 WeakPolarHBondContact CA-OG1 3.41Å; G606-T691 PolarHBondContact N-OG1 3.48Å; V607-T691 HydrophobicContact CG2-CG2 4.4Å |
Retrieved 691 of 691 residues in 746.6 ms
(Link to these results)