| 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 | M | 41.9 | Very low | 44.3 | Very low | 248 Ų | 248 | 139.1 Ų | 139.1 | 100% | 1.222 | 81% | 0.805 | S | S | * | * | 0 | 137.5 | 0 | -75.1 | 165.3 | 160 | 0 | 0 | 108.1 | |||||
| 2 | M | 45.7 | Very low | 44.1 | Very low | 164 Ų | 164 | 141.8 Ų | 141.8 | 81% | 0.808 | 81% | 0.814 | S | S | * | * | trans | -89.2 | 166.4 | 154 | -67.7 | -178.8 | 151.4 | 0 | 0 | 108 | ||||
| 3 | P | 58.1 | Low | 44.2 | Very low | 123 Ų | 123 | 145.1 Ų | 145.1 | 80% | 0.799 | 82% | 0.818 | S | S | * | * | -110 | 165.8 | 66.5 | -5.5 | 27.7 | 0 | 0 | 0 | 112.4 | |||||
| 4 | S | 44.9 | Very low | 43.8 | Very low | 87 Ų | 87 | 139.2 Ų | 139.2 | 61% | 0.608 | 81% | 0.806 | S | S | * | * | cis | 80.3 | 105.6 | 21.7 | -49 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 5 | S | 47.2 | Very low | 43.3 | Very low | 107 Ų | 107 | 142.5 Ų | 142.5 | 75% | 0.748 | 81% | 0.811 | S | S | * | * | 163.7 | 159.3 | 121.7 | -70.7 | 0 | 0 | 0 | 0 | 114 | |||||
| 6 | T | 44.3 | Very low | 42.9 | Very low | 136 Ų | 136 | 140.4 Ų | 140.4 | 83% | 0.834 | 81% | 0.808 | S | S | * | * | trans | 67.5 | 147.6 | 164.2 | 64.5 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 7 | S | 39.3 | Very low | 42.9 | Very low | 96 Ų | 96 | 143.5 Ų | 143.5 | 67% | 0.671 | 81% | 0.813 | S | S | * | * | cis | -173.9 | 160 | -19.7 | 50.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 8 | L | 38.4 | Very low | 43.4 | Very low | 139 Ų | 139 | 141.9 Ų | 141.9 | 73% | 0.728 | 81% | 0.807 | S | S | * | * | trans | 58.7 | 125.4 | 153.2 | -88 | 160.5 | 0 | 0 | 0 | 120.2 | ||||
| 9 | L | 44.5 | Very low | 43.9 | Very low | 170 Ų | 170 | 140.4 Ų | 140.4 | 89% | 0.89 | 80% | 0.803 | S | S | * | * | -163.8 | 154.7 | 111.9 | -104 | 173 | 0 | 0 | 0 | 110.5 | |||||
| 10 | E | 39.7 | Very low | 44.4 | Very low | 169 Ų | 169 | 138.9 Ų | 138.9 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | trans | -106.9 | 140.6 | -179.7 | -66.6 | 153.7 | 87 | 0 | 0 | 110.8 | ||||
| 11 | A | 43.3 | Very low | 44.7 | Very low | 91 Ų | 91 | 138.2 Ų | 138.2 | 75% | 0.752 | 80% | 0.799 | S | S | * | * | trans | -173.4 | 110.8 | 151.4 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 12 | D | 41.9 | Very low | 44.8 | Very low | 172 Ų | 172 | 134.3 Ų | 134.3 | 92% | 0.92 | 78% | 0.782 | S | S | * | * | trans | -142.4 | 120.5 | 162.2 | -167.2 | -125.7 | 0 | 0 | 0 | 107.4 | ||||
| 13 | E | 45.7 | Very low | 44.7 | Very low | 184 Ų | 184 | 133 Ų | 133 | 86% | 0.86 | 78% | 0.783 | S | S | * | * | trans | -140.5 | 111.2 | -172.4 | 54 | -174.4 | 103.9 | 0 | 0 | 108.7 | ||||
| 14 | G | 38.7 | Very low | 43.6 | Very low | 63 Ų | 63 | 136.6 Ų | 136.6 | 65% | 0.649 | 79% | 0.789 | S | S | * | * | trans | 176.6 | 116.2 | -174.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 15 | E | 35.9 | Very low | 43.3 | Very low | 188 Ų | 188 | 136.3 Ų | 136.3 | 88% | 0.879 | 79% | 0.792 | S | S | * | * | trans | -38.6 | 140.2 | -174.9 | 49 | -105.5 | 70.9 | 0 | 0 | 118.8 | ||||
| 16 | S | 36.4 | Very low | 42.7 | Very low | 110 Ų | 110 | 141.1 Ų | 141.1 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | trans | -108.5 | 120.7 | 164 | -176.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 17 | E | 43.8 | Very low | 42.3 | Very low | 193 Ų | 193 | 139.7 Ų | 139.7 | 90% | 0.902 | 80% | 0.802 | S | S | * | * | trans | -101.6 | 115.7 | 174.4 | -167.3 | 177.2 | 175.1 | 0 | 0 | 110.9 | ||||
| 18 | V | 51 | Low | 42 | Very low | 114 Ų | 114 | 138.6 Ų | 138.6 | 69% | 0.691 | 81% | 0.806 | S | S | * | * | trans | -130 | 126.1 | 173.6 | 178.6 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 19 | P | 53.1 | Low | 41.9 | Very low | 113 Ų | 113 | 141 Ų | 141 | 73% | 0.734 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 137.2 | -177 | 28.6 | -34.5 | 0 | 0 | 0 | 111.8 | ||
| 20 | P | 54.5 | Low | 41.3 | Very low | 110 Ų | 110 | 136.1 Ų | 136.1 | 71% | 0.714 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 150.4 | -177.3 | 32.5 | -35.6 | 0 | 0 | 0 | 113 | ||
| 21 | P | 50.9 | Low | 41.1 | Very low | 125 Ų | 125 | 135.8 Ų | 135.8 | 81% | 0.812 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 147.6 | 167.6 | 33.6 | -33.7 | 0 | 0 | 0 | 111 | ||
| 22 | L | 43 | Very low | 40.6 | Very low | 166 Ų | 166 | 137.5 Ų | 137.5 | 87% | 0.869 | 81% | 0.806 | S | S | * | * | trans | -123.4 | 122.2 | 170.6 | -78.9 | 174.6 | 0 | 0 | 0 | 111.6 | ||||
| 23 | V | 43.6 | Very low | 40.3 | Very low | 136 Ų | 136 | 138.4 Ų | 138.4 | 82% | 0.824 | 81% | 0.805 | S | S | * | * | trans | -129.9 | 128 | 164.2 | -78.3 | 0 | 0 | 0 | 0 | 108 | ||||
| 24 | H | 35.9 | Very low | 39.9 | Very low | 199 Ų | 199 | 136.6 Ų | 136.6 | 92% | 0.921 | 80% | 0.796 | S | S | * | * | trans | -152.8 | 158.4 | 165.8 | -105.5 | -76.6 | 0 | 0 | 0 | 109.7 | ||||
| 25 | A | 37.6 | Very low | 39.9 | Very low | 81 Ų | 81 | 142.4 Ų | 142.4 | 67% | 0.669 | 81% | 0.806 | S | S | * | * | trans | -130 | 155.2 | -161.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 26 | F | 36.3 | Very low | 39.6 | Very low | 208 Ų | 208 | 136.4 Ų | 136.4 | 91% | 0.912 | 80% | 0.795 | S | S | * | * | trans | 21.1 | 128.9 | 160.4 | -58 | -70.4 | 0 | 0 | 0 | 121.8 | ||||
| 27 | A | 35.5 | Very low | 39.4 | Very low | 106 Ų | 106 | 136.7 Ų | 136.7 | 88% | 0.876 | 80% | 0.796 | S | S | * | * | -172 | 136.8 | 130 | 0 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 28 | G | 32.8 | Very low | 38.9 | Very low | 74 Ų | 74 | 135.8 Ų | 135.8 | 76% | 0.763 | 79% | 0.792 | S | S | * | * | trans | 79.5 | 149.7 | 156.3 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 29 | M | 35.5 | Very low | 37.8 | Very low | 188 Ų | 188 | 134.1 Ų | 134.1 | 93% | 0.926 | 79% | 0.786 | S | S | * | * | cis | -154.8 | 144.4 | -4 | -52 | -175.3 | -57.8 | 0 | 0 | 111.7 | ||||
| 30 | G | 32.1 | Very low | 36.7 | Very low | 69 Ų | 69 | 137.7 Ų | 137.7 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | trans | 68.5 | 154.2 | 152.4 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 31 | L | 35.4 | Very low | 35.6 | Very low | 161 Ų | 161 | 136.4 Ų | 136.4 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | cis | -145.2 | 168.1 | -7 | -80.7 | 177.2 | 0 | 0 | 0 | 109.3 | ||||
| 32 | D | 33.1 | Very low | 35.4 | Very low | 127 Ų | 127 | 136 Ų | 136 | 68% | 0.679 | 79% | 0.789 | S | S | * | * | trans | 16.4 | 137.8 | 159.1 | -61.2 | -108 | 0 | 0 | 0 | 120.1 | ||||
| 33 | E | 36 | Very low | 34.7 | Very low | 192 Ų | 192 | 137 Ų | 137 | 90% | 0.897 | 79% | 0.789 | S | S | * | * | -158.7 | 160.3 | 64.9 | -164.6 | 158.1 | 74.9 | 0 | 0 | 113.8 | |||||
| 34 | H | 37.6 | Very low | 33.9 | Very low | 145 Ų | 145 | 139.1 Ų | 139.1 | 67% | 0.671 | 79% | 0.79 | S | S | * | * | trans | -90.3 | 155.8 | -179 | -66.1 | -113 | 0 | 0 | 0 | 111.4 | ||||
| 35 | H | 37.8 | Very low | 34.6 | Very low | 185 Ų | 185 | 134.5 Ų | 134.5 | 86% | 0.856 | 78% | 0.778 | S | S | * | * | cis | -154.1 | 150.2 | 42.6 | -61 | 66.5 | 0 | 0 | 0 | 109.8 | ||||
| 36 | G | 30.2 | Very low | 34.2 | Very low | 63 Ų | 63 | 137.4 Ų | 137.4 | 65% | 0.649 | 78% | 0.782 | S | S | * | * | 88.7 | 99.6 | 85.9 | 0 | 0 | 0 | 0 | 0 | 113 | |||||
| 37 | S | 32.1 | Very low | 34.1 | Very low | 115 Ų | 115 | 134.4 Ų | 134.4 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | 65.3 | 136.4 | 85.7 | 71.2 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 38 | Q | 32.3 | Very low | 34 | Very low | 175 Ų | 175 | 133.5 Ų | 133.5 | 82% | 0.818 | 76% | 0.758 | S | S | * | * | cis | -168.5 | 165.8 | 9.6 | -135.2 | -172.6 | 35.7 | 0 | 0 | 111.8 | ||||
| 39 | S | 29.6 | Very low | 33.9 | Very low | 79 Ų | 79 | 136 Ų | 136 | 55% | 0.552 | 76% | 0.758 | S | S | * | * | trans | 66.2 | 137.7 | 141.5 | -58 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 40 | Q | 30 | Very low | 33.5 | Very low | 188 Ų | 188 | 131.5 Ų | 131.5 | 88% | 0.879 | 75% | 0.745 | S | S | * | * | trans | 72.7 | 131.5 | 138.2 | -81.6 | 173.5 | -70.5 | 0 | 0 | 124.1 | ||||
| 41 | A | 30.4 | Very low | 33.4 | Very low | 83 Ų | 83 | 136.7 Ų | 136.7 | 69% | 0.686 | 75% | 0.748 | S | S | * | * | trans | -86.1 | 174.8 | 147.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 42 | P | 47.7 | Very low | 33.2 | Very low | 117 Ų | 117 | 135.5 Ų | 135.5 | 76% | 0.76 | 74% | 0.738 | S | S | * | * | cis | -152.3 | -161.1 | 38.9 | 36.8 | -10 | 0 | 0 | 0 | 117.3 | ||||
| 43 | E | 27.1 | Very low | 33.1 | Very low | 185 Ų | 185 | 136.9 Ų | 136.9 | 86% | 0.864 | 74% | 0.74 | S | S | * | * | trans | 94.6 | 161.7 | 156.5 | -50.4 | -119.6 | 74.7 | 0 | 0 | 120.1 | ||||
| 44 | Q | 27.6 | Very low | 32.7 | Very low | 182 Ų | 182 | 136.1 Ų | 136.1 | 85% | 0.85 | 74% | 0.737 | S | S | * | * | trans | -119 | -161.1 | -166.7 | -56.5 | -170 | -24.3 | 0 | 0 | 110.1 | ||||
| 45 | P | 49.8 | Very low | 32.4 | Very low | 102 Ų | 102 | 137.1 Ų | 137.1 | 66% | 0.662 | 75% | 0.746 | S | S | * | * | cis | -124.8 | -141.1 | -9.2 | 36 | -11.8 | 0 | 0 | 0 | 111.3 | ||||
| 46 | D | 29.7 | Very low | 32.6 | Very low | 141 Ų | 141 | 134 Ų | 134 | 75% | 0.754 | 74% | 0.742 | S | S | * | * | cis | -164.7 | 164.9 | 5.3 | -125.8 | -8.6 | 0 | 0 | 0 | 106.5 | ||||
| 47 | E | 34.3 | Very low | 32.5 | Very low | 146 Ų | 146 | 135.2 Ų | 135.2 | 68% | 0.682 | 75% | 0.746 | S | S | * | * | cis | -161.6 | 171.1 | -16.7 | -148.2 | -72.3 | 97.6 | 0 | 0 | 106.6 | ||||
| 48 | S | 32.8 | Very low | 32.4 | Very low | 86 Ų | 86 | 136.5 Ų | 136.5 | 60% | 0.601 | 75% | 0.749 | S | S | * | * | trans | 81.4 | 135.9 | 151.2 | 85.7 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 49 | V | 31.5 | Very low | 32.2 | Very low | 126 Ų | 126 | 134.2 Ų | 134.2 | 76% | 0.764 | 75% | 0.752 | S | S | * | * | cis | -155.1 | 158.5 | -1.5 | -118.6 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 50 | S | 26.9 | Very low | 32.3 | Very low | 95 Ų | 95 | 139 Ų | 139 | 66% | 0.664 | 77% | 0.765 | S | S | * | * | trans | 93.2 | 103.9 | 144.2 | -69.2 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 51 | F | 29.6 | Very low | 32.2 | Very low | 177 Ų | 177 | 139.3 Ų | 139.3 | 78% | 0.776 | 76% | 0.764 | S | S | * | * | 77.8 | 96.5 | 129.6 | -75.7 | -86.8 | 0 | 0 | 0 | 124.7 | |||||
| 52 | H | 31.2 | Very low | 32.1 | Very low | 137 Ų | 137 | 140 Ų | 140 | 63% | 0.634 | 76% | 0.764 | S | S | * | * | 72.4 | 122 | 122.2 | -88.4 | -98 | 0 | 0 | 0 | 125.1 | |||||
| 53 | H | 31.1 | Very low | 31.5 | Very low | 156 Ų | 156 | 141.7 Ų | 141.7 | 72% | 0.722 | 77% | 0.765 | S | S | * | * | trans | 53.8 | 144.6 | 139.6 | -69.3 | -12.4 | 0 | 0 | 0 | 120.7 | ||||
| 54 | Q | 28 | Very low | 31.8 | Very low | 175 Ų | 175 | 140.9 Ų | 140.9 | 82% | 0.818 | 77% | 0.766 | S | S | * | * | cis | -153.6 | -171.9 | 13.4 | -152.4 | 149.4 | -37.4 | 0 | 0 | 112.3 | ||||
| 55 | L | 31 | Very low | 32 | Very low | 167 Ų | 167 | 135.4 Ų | 135.4 | 87% | 0.874 | 76% | 0.758 | S | S | * | * | trans | -74.7 | 165.4 | -173.9 | -78.5 | 169.4 | 0 | 0 | 0 | 115.5 | ||||
| 56 | P | 41.8 | Very low | 31.3 | Very low | 119 Ų | 119 | 137.4 Ų | 137.4 | 77% | 0.773 | 77% | 0.769 | S | S | * | * | trans | -102.1 | 164.9 | -150.9 | 39.3 | -38 | 0 | 0 | 0 | 116.4 | ||||
| 57 | A | 27.8 | Very low | 31.4 | Very low | 89 Ų | 89 | 137.3 Ų | 137.3 | 74% | 0.736 | 77% | 0.773 | S | S | * | * | trans | -152.9 | 145.8 | 162 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 58 | V | 30.9 | Very low | 31.4 | Very low | 141 Ų | 141 | 138.3 Ų | 138.3 | 86% | 0.855 | 78% | 0.782 | S | S | * | * | trans | 41 | 96.5 | 162.1 | -70.6 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 59 | S | 27.2 | Very low | 31.3 | Very low | 127 Ų | 127 | 141 Ų | 141 | 89% | 0.888 | 79% | 0.79 | S | S | * | * | trans | -95.3 | 106.5 | 156.5 | -57.4 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 60 | H | 31.5 | Very low | 31.4 | Very low | 179 Ų | 179 | 142.9 Ų | 142.9 | 83% | 0.829 | 79% | 0.794 | S | S | * | * | trans | -75.1 | 128.8 | 148.7 | -98.1 | -114.7 | 0 | 0 | 0 | 107.8 | ||||
| 61 | F | 27.9 | Very low | 31.5 | Very low | 196 Ų | 196 | 147.6 Ų | 147.6 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | -177.4 | 160.3 | 125.5 | -118.5 | -96.3 | 0 | 0 | 0 | 111.6 | |||||
| 62 | S | 29.9 | Very low | 32.6 | Very low | 96 Ų | 96 | 144.5 Ų | 144.5 | 67% | 0.671 | 80% | 0.801 | S | S | * | * | trans | -104.7 | 177.9 | 177.6 | -54.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 63 | I | 33.2 | Very low | 32.9 | Very low | 153 Ų | 153 | 145.7 Ų | 145.7 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | trans | 80 | 135.6 | 169.2 | -48.6 | 151.3 | 0 | 0 | 0 | 111.6 | ||||
| 64 | L | 35.1 | Very low | 33.5 | Very low | 169 Ų | 169 | 144.5 Ų | 144.5 | 89% | 0.885 | 82% | 0.817 | S | S | * | * | cis | -111.7 | 173.1 | 8 | -59.1 | 155.8 | 0 | 0 | 0 | 110.4 | ||||
| 65 | G | 31.5 | Very low | 33.7 | Very low | 67 Ų | 67 | 143.6 Ų | 143.6 | 69% | 0.691 | 82% | 0.817 | S | S | * | * | cis | 176.2 | 146.8 | -1.9 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 66 | T | 33.6 | Very low | 33.5 | Very low | 144 Ų | 144 | 144.5 Ų | 144.5 | 88% | 0.883 | 82% | 0.817 | S | S | * | * | -153.1 | 153.3 | 79.7 | 43.9 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 67 | V | 31.9 | Very low | 33 | Very low | 138 Ų | 138 | 147.7 Ų | 147.7 | 84% | 0.836 | 81% | 0.813 | S | S | * | * | trans | -143.7 | 130.6 | 177.1 | 175.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 68 | L | 35.9 | Very low | 34.1 | Very low | 168 Ų | 168 | 148.7 Ų | 148.7 | 88% | 0.88 | 81% | 0.812 | S | S | * | * | trans | -143.9 | 152 | 158.9 | -62.7 | 173.6 | 0 | 0 | 0 | 104.9 | ||||
| 69 | D | 30.3 | Very low | 35.3 | Very low | 142 Ų | 142 | 146.8 Ų | 146.8 | 76% | 0.759 | 80% | 0.802 | S | S | * | * | cis | -146.9 | -162.5 | 14 | -161.9 | 2.7 | 0 | 0 | 0 | 111.7 | ||||
| 70 | L | 32.4 | Very low | 35.6 | Very low | 165 Ų | 165 | 146 Ų | 146 | 86% | 0.864 | 80% | 0.797 | S | S | * | * | trans | -87.8 | -170.5 | -156.1 | -70.4 | 160.8 | 0 | 0 | 0 | 119.2 | ||||
| 71 | K | 29.9 | Very low | 35.6 | Very low | 194 Ų | 194 | 140.3 Ų | 140.3 | 84% | 0.843 | 79% | 0.787 | S | S | * | * | trans | -161.8 | 159 | -162.6 | 169.4 | 178.2 | 179.4 | 172.4 | 0 | 109.2 | ||||
| 72 | P | 51.9 | Low | 35.7 | Very low | 113 Ų | 113 | 138.6 Ų | 138.6 | 73% | 0.734 | 79% | 0.787 | S | S | * | * | cis | -131.6 | -166.1 | -10.2 | 37.8 | -16.8 | 0 | 0 | 0 | 116.4 | ||||
| 73 | L | 37.7 | Very low | 35.9 | Very low | 161 Ų | 161 | 142.4 Ų | 142.4 | 84% | 0.843 | 79% | 0.794 | S | S | * | * | trans | -47.9 | 164.8 | 171 | -51 | 169.6 | 0 | 0 | 0 | 117.7 | ||||
| 74 | P | 44.8 | Very low | 35.9 | Very low | 132 Ų | 132 | 138.8 Ų | 138.8 | 86% | 0.857 | 79% | 0.787 | S | S | * | * | -154.4 | -173.5 | 79.6 | 42.7 | -21.3 | 0 | 0 | 0 | 119.7 | |||||
| 75 | L | 32.1 | Very low | 35.5 | Very low | 156 Ų | 156 | 138.5 Ų | 138.5 | 82% | 0.817 | 79% | 0.786 | S | S | * | * | trans | -64.7 | 163.4 | -175 | -86.3 | 153.8 | 0 | 0 | 0 | 119.8 | ||||
| 76 | H | 27.2 | Very low | 35.5 | Very low | 186 Ų | 186 | 144.9 Ų | 144.9 | 86% | 0.861 | 80% | 0.795 | S | S | * | * | -156.5 | 158.3 | 118.4 | -131.5 | -91.5 | 0 | 0 | 0 | 116.7 | |||||
| 77 | R | 30.5 | Very low | 35.2 | Very low | 186 Ų | 186 | 143.8 Ų | 143.8 | 70% | 0.702 | 79% | 0.788 | S | S | * | * | trans | -135.8 | 155.3 | 176.2 | -153 | -153.1 | 162.6 | -176.5 | -4.8 | 110.7 | ||||
| 78 | P | 50.3 | Low | 35.2 | Very low | 109 Ų | 109 | 141.1 Ų | 141.1 | 71% | 0.708 | 78% | 0.781 | S | S | * | * | -143.4 | -155.1 | 104.7 | 37.6 | -17.8 | 0 | 0 | 0 | 110.6 | |||||
| 79 | P | 56.7 | Low | 34.9 | Very low | 101 Ų | 101 | 140.9 Ų | 140.9 | 66% | 0.656 | 78% | 0.775 | S | S | * | * | cis | -130.3 | -108 | -2.4 | 40.2 | -17.6 | 0 | 0 | 0 | 114.6 | ||||
| 80 | S | 34.4 | Very low | 34.9 | Very low | 110 Ų | 110 | 141.1 Ų | 141.1 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | trans | -140.9 | 160.4 | -143.9 | 52.7 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 81 | G | 29.6 | Very low | 35 | Very low | 60 Ų | 60 | 141.2 Ų | 141.2 | 62% | 0.619 | 77% | 0.772 | S | S | * | * | cis | 174.5 | 170.6 | -3.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 82 | D | 31.9 | Very low | 35.1 | Very low | 160 Ų | 160 | 139.7 Ų | 139.7 | 86% | 0.856 | 77% | 0.768 | S | S | * | * | trans | 60.9 | 149.4 | 154.6 | -43.5 | -37.3 | 0 | 0 | 0 | 119.9 | ||||
| 83 | E | 32.5 | Very low | 34.2 | Very low | 177 Ų | 177 | 141.2 Ų | 141.2 | 83% | 0.827 | 77% | 0.769 | S | S | * | * | cis | -157.4 | 169.5 | -6.7 | -135.9 | -158 | 119.7 | 0 | 0 | 113.4 | ||||
| 84 | A | 32.8 | Very low | 34 | Very low | 76 Ų | 76 | 142.5 Ų | 142.5 | 63% | 0.628 | 77% | 0.771 | S | S | * | * | trans | 53.5 | 125.5 | 147.1 | 0 | 0 | 0 | 0 | 0 | 126.2 | ||||
| 85 | N | 28.3 | Very low | 33.3 | Very low | 163 Ų | 163 | 139.5 Ų | 139.5 | 87% | 0.872 | 76% | 0.764 | S | S | * | * | trans | 12.4 | 140.2 | 137.5 | -64.2 | -21.3 | 0 | 0 | 0 | 123.1 | ||||
| 86 | K | 30 | Very low | 33.3 | Very low | 202 Ų | 202 | 140.3 Ų | 140.3 | 88% | 0.878 | 77% | 0.767 | S | S | * | * | -165.5 | 161.6 | 105.8 | -142.6 | 173.4 | 175.9 | -177.9 | 0 | 115.3 | |||||
| 87 | T | 28.2 | Very low | 33.4 | Very low | 121 Ų | 121 | 136.3 Ų | 136.3 | 74% | 0.742 | 77% | 0.766 | S | S | * | * | trans | -100.9 | 151.8 | 173.2 | 49.7 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 88 | A | 31.6 | Very low | 33.4 | Very low | 82 Ų | 82 | 131.7 Ų | 131.7 | 68% | 0.678 | 77% | 0.768 | S | S | * | * | trans | 178.2 | 141.5 | 160.1 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 89 | E | 30.2 | Very low | 32.4 | Very low | 163 Ų | 163 | 132.7 Ų | 132.7 | 76% | 0.762 | 77% | 0.772 | S | S | * | * | cis | 70.6 | 127 | 35 | 95.9 | -152.6 | 67 | 0 | 0 | 112.9 | ||||
| 90 | D | 30.8 | Very low | 31.1 | Very low | 147 Ų | 147 | 132.9 Ų | 132.9 | 79% | 0.786 | 78% | 0.776 | S | S | * | * | cis | -161.1 | 179.1 | 0 | -128.7 | -28.7 | 0 | 0 | 0 | 113.5 | ||||
| 91 | E | 34 | Very low | 30.9 | Very low | 166 Ų | 166 | 133 Ų | 133 | 78% | 0.776 | 78% | 0.777 | S | S | * | * | trans | 62.6 | 121.9 | 154 | -73.4 | -174.4 | 161.1 | 0 | 0 | 126.2 | ||||
| 92 | E | 30.8 | Very low | 30.7 | Very low | 162 Ų | 162 | 134 Ų | 134 | 76% | 0.757 | 79% | 0.787 | S | S | * | * | 63.5 | 154.8 | 128.1 | -122.3 | -172.1 | 98.4 | 0 | 0 | 127.3 | |||||
| 93 | L | 34.5 | Very low | 30.6 | Very low | 146 Ų | 146 | 130.4 Ų | 130.4 | 76% | 0.764 | 78% | 0.779 | S | S | * | * | trans | 94.6 | 147.7 | 153.3 | -88 | 158.2 | 0 | 0 | 0 | 122.8 | ||||
| 94 | E | 32.4 | Very low | 30.5 | Very low | 188 Ų | 188 | 129.5 Ų | 129.5 | 88% | 0.879 | 78% | 0.779 | S | S | * | * | trans | -80.4 | 168.2 | -172.5 | -56 | -173.1 | 100.9 | 0 | 0 | 113.9 | ||||
| 95 | G | 30 | Very low | 30.6 | Very low | 68 Ų | 68 | 133.4 Ų | 133.4 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | trans | 167.2 | 86.3 | 155.3 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 96 | I | 32.2 | Very low | 30.8 | Very low | 173 Ų | 173 | 129.4 Ų | 129.4 | 89% | 0.887 | 78% | 0.779 | S | S | * | * | trans | 34.4 | 123 | 144.3 | -39.6 | 178.7 | 0 | 0 | 0 | 118.9 | ||||
| 97 | A | 30.4 | Very low | 31 | Very low | 102 Ų | 102 | 129 Ų | 129 | 84% | 0.843 | 78% | 0.777 | S | S | * | * | trans | -75.3 | 138.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 98 | A | 28.9 | Very low | 31 | Very low | 90 Ų | 90 | 127.1 Ų | 127.1 | 74% | 0.744 | 77% | 0.774 | S | S | * | * | trans | -157.5 | 111.7 | 155.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 99 | T | 30.2 | Very low | 30.9 | Very low | 129 Ų | 129 | 131.4 Ų | 131.4 | 79% | 0.791 | 78% | 0.779 | S | S | * | * | trans | 24.4 | 121.3 | 144.2 | 58.4 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 100 | S | 30.4 | Very low | 30.8 | Very low | 106 Ų | 106 | 132.8 Ų | 132.8 | 74% | 0.741 | 78% | 0.778 | S | S | * | * | trans | 93 | 154.9 | 133.1 | 85.9 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 101 | S | 28.9 | Very low | 30.5 | Very low | 112 Ų | 112 | 131.7 Ų | 131.7 | 78% | 0.783 | 77% | 0.772 | S | S | * | * | trans | 89.5 | 75.6 | 146 | -54.7 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 102 | G | 26.1 | Very low | 30.2 | Very low | 81 Ų | 81 | 131.8 Ų | 131.8 | 84% | 0.835 | 77% | 0.772 | S | S | * | * | trans | 74.7 | 174.9 | 140.5 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 103 | A | 29.5 | Very low | 29.9 | Very low | 84 Ų | 84 | 131.1 Ų | 131.1 | 69% | 0.694 | 77% | 0.769 | S | S | * | * | cis | -162.8 | -169.9 | 0.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 104 | L | 30.3 | Very low | 29.9 | Very low | 158 Ų | 158 | 131.3 Ų | 131.3 | 83% | 0.827 | 77% | 0.77 | S | S | * | * | trans | 73 | 144.4 | 168.7 | -38 | -178.8 | 0 | 0 | 0 | 114 | ||||
| 105 | L | 35.6 | Very low | 30.8 | Very low | 158 Ų | 158 | 127.2 Ų | 127.2 | 83% | 0.827 | 76% | 0.759 | S | S | * | * | cis | -161.9 | -179.2 | -15.4 | -141 | 67.5 | 0 | 0 | 0 | 105.9 | ||||
| 106 | A | 32 | Very low | 30.6 | Very low | 80 Ų | 80 | 130.1 Ų | 130.1 | 66% | 0.661 | 77% | 0.769 | S | S | * | * | cis | -161.9 | -175.6 | 1.1 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 107 | K | 33.2 | Very low | 30.2 | Very low | 192 Ų | 192 | 125.4 Ų | 125.4 | 84% | 0.835 | 76% | 0.763 | S | S | * | * | cis | -161.8 | 157.6 | -9.9 | -151.1 | 175.1 | -179.1 | 171.9 | 0 | 108.8 | ||||
| 108 | A | 30 | Very low | 30.2 | Very low | 82 Ų | 82 | 130 Ų | 130 | 68% | 0.678 | 77% | 0.767 | S | S | * | * | trans | 61.9 | 130.3 | 157.5 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 109 | H | 29 | Very low | 30.1 | Very low | 172 Ų | 172 | 131.9 Ų | 131.9 | 80% | 0.796 | 78% | 0.775 | S | S | * | * | cis | -149 | 173.8 | 40 | -95.8 | -122.3 | 0 | 0 | 0 | 110.3 | ||||
| 110 | R | 27 | Very low | 30 | Very low | 193 Ų | 193 | 129.2 Ų | 129.2 | 73% | 0.728 | 77% | 0.773 | S | S | * | * | cis | -174.4 | 121.3 | -32.8 | 169.7 | 176.2 | 166.7 | 154.8 | -5.2 | 107.9 | ||||
| 111 | N | 25.9 | Very low | 29.9 | Very low | 123 Ų | 123 | 130.7 Ų | 130.7 | 66% | 0.658 | 78% | 0.778 | S | S | * | * | trans | 63.8 | 131.4 | 168.8 | -62.1 | 22.8 | 0 | 0 | 0 | 116.1 | ||||
| 112 | Q | 26.1 | Very low | 29.8 | Very low | 168 Ų | 168 | 132 Ų | 132 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | cis | 70.5 | 143.1 | 31.3 | -49.6 | -179.6 | 0 | 0 | 0 | 112.8 | ||||
| 113 | H | 25.5 | Very low | 29.8 | Very low | 148 Ų | 148 | 136.7 Ų | 136.7 | 69% | 0.685 | 78% | 0.783 | S | S | * | * | cis | -160 | 157.8 | 3.7 | -139.9 | -128.8 | 0 | 0 | 0 | 106.5 | ||||
| 114 | L | 34.8 | Very low | 29.5 | Very low | 150 Ų | 150 | 140.6 Ų | 140.6 | 79% | 0.785 | 79% | 0.787 | S | S | * | * | 31.1 | 161.8 | 74.2 | -85.2 | 99.4 | 0 | 0 | 0 | 116.8 | |||||
| 115 | P | 49.9 | Very low | 29.8 | Very low | 102 Ų | 102 | 138.2 Ų | 138.2 | 66% | 0.662 | 78% | 0.781 | S | S | * | * | cis | -125.8 | -160.5 | -19.4 | 40.7 | -23.8 | 0 | 0 | 0 | 110.9 | ||||
| 116 | S | 26 | Very low | 30.1 | Very low | 129 Ų | 129 | 135.9 Ų | 135.9 | 90% | 0.902 | 78% | 0.775 | S | S | * | * | trans | -162.8 | 144.9 | 136.3 | -83.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 117 | G | 24.8 | Very low | 30 | Very low | 74 Ų | 74 | 141 Ų | 141 | 76% | 0.763 | 79% | 0.785 | S | S | * | * | trans | -169 | 158.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 118 | Q | 29.9 | Very low | 29.8 | Very low | 199 Ų | 199 | 138.4 Ų | 138.4 | 93% | 0.93 | 79% | 0.785 | S | S | * | * | trans | -161.2 | 146.3 | 175.6 | -140 | 173.6 | 66 | 0 | 0 | 114.1 | ||||
| 119 | S | 28 | Very low | 29.7 | Very low | 129 Ų | 129 | 141.9 Ų | 141.9 | 90% | 0.902 | 79% | 0.788 | S | S | * | * | trans | 73.4 | 151.5 | 163.8 | -149.8 | 0 | 0 | 0 | 0 | 119 | ||||
| 120 | G | 27.2 | Very low | 29.8 | Very low | 74 Ų | 74 | 138 Ų | 138 | 76% | 0.763 | 78% | 0.776 | S | S | * | * | trans | 125.1 | 92.9 | 170.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 121 | T | 27.4 | Very low | 29.9 | Very low | 136 Ų | 136 | 135.5 Ų | 135.5 | 83% | 0.834 | 78% | 0.782 | S | S | * | * | trans | -94.6 | 134.1 | 169.2 | 37.7 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 122 | V | 26.7 | Very low | 30 | Very low | 140 Ų | 140 | 135.8 Ų | 135.8 | 85% | 0.848 | 78% | 0.783 | S | S | * | * | trans | 31 | 131.6 | 142.3 | -170.9 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 123 | M | 26 | Very low | 30.1 | Very low | 180 Ų | 180 | 135.8 Ų | 135.8 | 89% | 0.887 | 79% | 0.787 | S | S | * | * | trans | 117.2 | 152.4 | 151.9 | -144.1 | 157.9 | -171.7 | 0 | 0 | 116.7 | ||||
| 124 | E | 23.7 | Very low | 30.3 | Very low | 166 Ų | 166 | 138.3 Ų | 138.3 | 78% | 0.776 | 79% | 0.792 | S | S | * | * | trans | -54.9 | 173.1 | 174.7 | -117.8 | -154.2 | 114.2 | 0 | 0 | 114.4 | ||||
| 125 | P | 37 | Very low | 30.2 | Very low | 108 Ų | 108 | 136.9 Ų | 136.9 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | cis | -135.7 | -123.7 | 11.4 | 38.1 | -12 | 0 | 0 | 0 | 114.2 | ||||
| 126 | P | 41.7 | Very low | 29.1 | Very low | 108 Ų | 108 | 135.1 Ų | 135.1 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | trans | -127.1 | -165.5 | -142.8 | 33.4 | -5.7 | 0 | 0 | 0 | 116.6 | ||||
| 127 | H | 30.6 | Very low | 29.2 | Very low | 188 Ų | 188 | 135.4 Ų | 135.4 | 87% | 0.87 | 78% | 0.777 | S | S | * | * | trans | -50 | 134.2 | -173.8 | -42.4 | -92.2 | 0 | 0 | 0 | 118.9 | ||||
| 128 | V | 27.9 | Very low | 29.4 | Very low | 138 Ų | 138 | 139.5 Ų | 139.5 | 84% | 0.836 | 78% | 0.776 | S | S | * | * | trans | -172.5 | 156.4 | 140.6 | 106.5 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 129 | E | 28.9 | Very low | 29.6 | Very low | 155 Ų | 155 | 139.1 Ų | 139.1 | 72% | 0.724 | 77% | 0.766 | S | S | * | * | cis | -144.9 | 173.1 | 4.5 | -126.6 | -162.4 | -83 | 0 | 0 | 107.4 | ||||
| 130 | T | 31.3 | Very low | 29.5 | Very low | 91 Ų | 91 | 139.6 Ų | 139.6 | 56% | 0.558 | 76% | 0.759 | S | S | * | * | cis | -122.4 | -109.7 | -3.4 | -43.4 | 0 | 0 | 0 | 0 | 110.2 | L132 | T130-L132 HydrophobicContact CG2-CG 4.3Š| ||
| 131 | V | 27.9 | Very low | 29.6 | Very low | 139 Ų | 139 | 142.8 Ų | 142.8 | 84% | 0.842 | 76% | 0.758 | S | S | * | * | cis | -136.7 | 159.9 | 1.7 | -173.5 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 132 | L | 28.5 | Very low | 29.7 | Very low | 129 Ų | 129 | 141 Ų | 141 | 68% | 0.675 | 75% | 0.751 | S | S | * | * | trans | -95.1 | 151.1 | -164.6 | -70.8 | 163.6 | 0 | 0 | 0 | 112.8 | T130 | T130-L132 HydrophobicContact CG2-CG 4.3Š| ||
| 133 | L | 28 | Very low | 29.8 | Very low | 168 Ų | 168 | 138 Ų | 138 | 88% | 0.88 | 75% | 0.749 | S | S | * | * | cis | -135.6 | 155.4 | 43.3 | -72.4 | 157.6 | 0 | 0 | 0 | 115.1 | ||||
| 134 | Y | 30 | Very low | 30.2 | Very low | 201 Ų | 201 | 136.6 Ų | 136.6 | 79% | 0.788 | 75% | 0.75 | S | S | * | * | trans | -86.5 | 166 | 178.4 | -114.7 | -118.6 | 0 | 0 | 0 | 113.1 | ||||
| 135 | N | 32.6 | Very low | 30.4 | Very low | 121 Ų | 121 | 132.1 Ų | 132.1 | 65% | 0.647 | 75% | 0.748 | S | S | * | * | cis | -98.7 | -150.3 | 10.8 | -56.5 | 6.4 | 0 | 0 | 0 | 114 | D137 | N135-D137 VanDerWaalsContact CB-OD2 3.29Å; N135-D137 WeakPolarHBondContact CB-OD2 3.39Å; N135-D137 PolarHBondContact ND2-OD2 3.04Å | ||
| 136 | G | 26.3 | Very low | 30.1 | Very low | 65 Ų | 65 | 131 Ų | 131 | 67% | 0.67 | 76% | 0.757 | S | S | * | * | cis | 169.2 | -179.4 | 10.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 137 | D | 29.2 | Very low | 29.6 | Very low | 134 Ų | 134 | 129.8 Ų | 129.8 | 72% | 0.717 | 76% | 0.764 | S | S | * | * | cis | -151.1 | -119.3 | -12.4 | -76.6 | 123.5 | 0 | 0 | 0 | 109.8 | N135 | N135-D137 VanDerWaalsContact CB-OD2 3.29Å; N135-D137 WeakPolarHBondContact CB-OD2 3.39Å; N135-D137 PolarHBondContact ND2-OD2 3.04Å | ||
| 138 | E | 28 | Very low | 29.7 | Very low | 161 Ų | 161 | 127.2 Ų | 127.2 | 75% | 0.752 | 77% | 0.767 | S | S | * | * | trans | -141.2 | 162.1 | -172.7 | -64.3 | -162 | 92 | 0 | 0 | 112.8 | ||||
| 139 | R | 33.9 | Very low | 30 | Very low | 191 Ų | 191 | 125.6 Ų | 125.6 | 72% | 0.721 | 77% | 0.768 | S | S | * | * | cis | -172.8 | 163.2 | -20.3 | -103.5 | -166.6 | -158.5 | -144.2 | -2.2 | 109.5 | ||||
| 140 | D | 27.8 | Very low | 30.2 | Very low | 139 Ų | 139 | 126.1 Ų | 126.1 | 74% | 0.743 | 78% | 0.775 | S | S | * | * | trans | 59 | 168.4 | 161.1 | -51.3 | -37.2 | 0 | 0 | 0 | 116.7 | ||||
| 141 | D | 28.3 | Very low | 31.6 | Very low | 141 Ų | 141 | 127.1 Ų | 127.1 | 75% | 0.754 | 78% | 0.783 | S | S | * | * | cis | -140.8 | 179.1 | 4.2 | -175.4 | -123.9 | 0 | 0 | 0 | 112.6 | ||||
| 142 | S | 29.3 | Very low | 33.3 | Very low | 98 Ų | 98 | 125.9 Ų | 125.9 | 69% | 0.685 | 78% | 0.778 | S | S | * | * | trans | -50.9 | 164.9 | 174.6 | 73.3 | 0 | 0 | 0 | 0 | 119 | ||||
| 143 | G | 29.5 | Very low | 33.6 | Very low | 77 Ų | 77 | 124.3 Ų | 124.3 | 79% | 0.794 | 78% | 0.783 | S | S | * | * | trans | -169.6 | 99.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 144 | V | 33.2 | Very low | 33.8 | Very low | 150 Ų | 150 | 120.5 Ų | 120.5 | 91% | 0.909 | 78% | 0.776 | S | S | * | * | trans | -77.1 | 120.7 | -172.8 | 170.8 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 145 | G | 29.2 | Very low | 34.1 | Very low | 72 Ų | 72 | 116.1 Ų | 116.1 | 74% | 0.742 | 78% | 0.775 | S | S | * | * | 76.2 | 153.3 | 119.2 | 0 | 0 | 0 | 0 | 0 | 123.2 | |||||
| 146 | G | 30.1 | Very low | 34.1 | Very low | 85 Ų | 85 | 119.2 Ų | 119.2 | 88% | 0.876 | 79% | 0.788 | S | S | * | * | trans | 107.7 | 144.7 | 140.6 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 147 | G | 31.3 | Very low | 34.9 | Very low | 83 Ų | 83 | 122.2 Ų | 122.2 | 86% | 0.856 | 79% | 0.793 | S | S | * | * | trans | 100.6 | 97.5 | 144.7 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 148 | S | 32.9 | Very low | 35.1 | Very low | 133 Ų | 133 | 124.3 Ų | 124.3 | 93% | 0.93 | 80% | 0.8 | S | S | * | * | trans | -77.6 | 124.6 | 163.3 | -52.6 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 149 | A | 33.4 | Very low | 35.6 | Very low | 105 Ų | 105 | 124.1 Ų | 124.1 | 87% | 0.868 | 80% | 0.803 | S | S | * | * | trans | -162.1 | 124.7 | 151.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 150 | L | 33.6 | Very low | 36.7 | Very low | 166 Ų | 166 | 120.1 Ų | 120.1 | 87% | 0.869 | 80% | 0.803 | S | S | * | * | trans | -99.1 | 175.8 | 168.6 | -82.7 | 167 | 0 | 0 | 0 | 109.2 | ||||
| 151 | P | 61.2 | Low | 38 | Very low | 111 Ų | 111 | 119.3 Ų | 119.3 | 72% | 0.721 | 81% | 0.805 | S | S | * | * | cis | -134.7 | -127.1 | -32 | 37.9 | -17.1 | 0 | 0 | 0 | 108.6 | ||||
| 152 | P | 64 | Low | 38.1 | Very low | 114 Ų | 114 | 115.8 Ų | 115.8 | 74% | 0.74 | 80% | 0.802 | S | S | * | * | -118.9 | 169.7 | -52.9 | 36.4 | -23.2 | 0 | 0 | 0 | 113.1 | |||||
| 153 | A | 32.9 | Very low | 38.3 | Very low | 95 Ų | 95 | 117.2 Ų | 117.2 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | 168.4 | 140.3 | 117.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 154 | A | 33.9 | Very low | 38.7 | Very low | 88 Ų | 88 | 124.4 Ų | 124.4 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | trans | 50 | 124.5 | 144.7 | 0 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 155 | S | 35.8 | Very low | 39.1 | Very low | 109 Ų | 109 | 120.6 Ų | 120.6 | 76% | 0.762 | 80% | 0.802 | S | S | * | * | trans | 60.9 | 123.2 | 146.5 | 62.5 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 156 | M | 33.2 | Very low | 39.2 | Very low | 187 Ų | 187 | 126.3 Ų | 126.3 | 92% | 0.921 | 81% | 0.81 | S | S | * | * | -160.5 | 162.1 | 113 | -99.4 | -64.9 | 175.6 | 0 | 0 | 109.6 | |||||
| 157 | V | 43.3 | Very low | 39.9 | Very low | 127 Ų | 127 | 128 Ų | 128 | 77% | 0.77 | 81% | 0.808 | S | S | * | * | trans | -108.5 | 132.9 | 175.4 | 169.9 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 158 | M | 33.4 | Very low | 39.8 | Very low | 179 Ų | 179 | 127.4 Ų | 127.4 | 88% | 0.882 | 80% | 0.802 | S | S | * | * | trans | -169.3 | 158.5 | 144 | -128 | 57.1 | 162.8 | 0 | 0 | 112.5 | ||||
| 159 | L | 38.2 | Very low | 40.7 | Very low | 156 Ų | 156 | 130.9 Ų | 130.9 | 82% | 0.817 | 80% | 0.8 | S | S | * | * | trans | -135.1 | 168.1 | 171.9 | -87.3 | 168.7 | 0 | 0 | 0 | 106.7 | ||||
| 160 | P | 57.2 | Low | 41.2 | Very low | 108 Ų | 108 | 134.9 Ų | 134.9 | 70% | 0.701 | 80% | 0.801 | S | S | * | * | cis | -127.7 | -132.7 | -24 | 40.4 | -21.2 | 0 | 0 | 0 | 107.7 | ||||
| 161 | P | 54.2 | Low | 41.6 | Very low | 121 Ų | 121 | 131.1 Ų | 131.1 | 79% | 0.786 | 79% | 0.794 | S | S | * | * | cis | -118.1 | 167.6 | -44.6 | 36.6 | -23.4 | 0 | 0 | 0 | 112.7 | ||||
| 162 | G | 29.5 | Very low | 40.6 | Very low | 68 Ų | 68 | 132.6 Ų | 132.6 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | trans | -173.1 | 115.8 | 169.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 163 | V | 34.8 | Very low | 39.8 | Very low | 127 Ų | 127 | 133.2 Ų | 133.2 | 77% | 0.77 | 78% | 0.784 | S | S | * | * | trans | 33.1 | 111.5 | 147.6 | -159.5 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 164 | Y | 37.3 | Very low | 40.3 | Very low | 228 Ų | 228 | 133.1 Ų | 133.1 | 89% | 0.894 | 78% | 0.778 | S | S | * | * | -170.1 | 155.5 | 103.7 | -112.4 | -80.4 | 0 | 0 | 0 | 110.6 | |||||
| 165 | G | 42.8 | Very low | 40.9 | Very low | 71 Ų | 71 | 135.7 Ų | 135.7 | 73% | 0.732 | 78% | 0.779 | S | S | * | * | trans | -134.4 | 114.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 166 | E | 30.8 | Very low | 41.6 | Very low | 192 Ų | 192 | 134.6 Ų | 134.6 | 90% | 0.897 | 76% | 0.763 | S | S | * | * | trans | -145 | 156.5 | 159.9 | -149.7 | -178 | 138.5 | 0 | 0 | 109.1 | G168 | E166-G168 PolarHBondContact O-N 2.9Š| ||
| 167 | S | 45.2 | Very low | 42.4 | Very low | 120 Ų | 120 | 131.5 Ų | 131.5 | 84% | 0.839 | 76% | 0.756 | S | S | * | * | trans | -90 | 105.2 | -166.7 | 51.6 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 168 | G | 29.2 | Very low | 42.9 | Very low | 70 Ų | 70 | 137.1 Ų | 137.1 | 72% | 0.722 | 76% | 0.763 | S | S | * | * | trans | -112.4 | 121.5 | 168.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | E166 | E166-G168 PolarHBondContact O-N 2.9Š| ||
| 169 | F | 50.2 | Low | 44.2 | Very low | 206 Ų | 206 | 138 Ų | 138 | 90% | 0.904 | 76% | 0.756 | S | S | * | * | trans | -76 | 169 | 157.2 | -110.6 | -114.5 | 0 | 0 | 0 | 109.6 | ||||
| 170 | E | 45.5 | Very low | 45.3 | Very low | 190 Ų | 190 | 139.3 Ų | 139.3 | 89% | 0.888 | 76% | 0.756 | S | S | * | * | S | Bend | trans | 61.8 | 69.7 | 174.5 | -72.3 | -71.8 | 89.6 | 0 | 0 | 116.7 | ||
| 171 | A | 41.3 | Very low | 45.7 | Very low | 87 Ų | 87 | 139.1 Ų | 139.1 | 72% | 0.719 | 76% | 0.756 | S | S | * | * | trans | -150.5 | -31 | 163.8 | 0 | 0 | 0 | 0 | 0 | 115 | H173 | A171-H173 PolarHBondContact O-N 3.38Š| ||
| 172 | E | 40.7 | Very low | 47.2 | Very low | 141 Ų | 141 | 138.1 Ų | 138.1 | 66% | 0.659 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | 61.9 | -170.5 | -96.6 | -66.6 | 112.5 | 0 | 0 | 114.4 | ||
| 173 | H | 46.7 | Very low | 50.1 | Low | 127 Ų | 127 | 140.2 Ų | 140.2 | 59% | 0.588 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.9 | -11.2 | 171.4 | -145 | -86 | 0 | 0 | 0 | 115.2 | A171 K235 | A171-H173 PolarHBondContact O-N 3.38Å; H173-K235 PolarHBondContact CD2-NZ 3.11Å; H173-K235 VanDerWaalsContact CD2-NZ 3.34Å; H173-K235 WeakPolarHBondContact NE2-CE 3.45Å; H173-K235 PolarHBondContact NE2-NZ 3.37Å |
| 174 | S | 43.4 | Very low | 52.8 | Low | 93 Ų | 93 | 136.6 Ų | 136.6 | 65% | 0.65 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -101.5 | -14.4 | -168.2 | -59.9 | 0 | 0 | 0 | 0 | 115.7 | T177 | S174-T177 PolarHBondContact O-OG1 2.85Š|
| 175 | L | 47.1 | Very low | 55.6 | Low | 143 Ų | 143 | 130.7 Ų | 130.7 | 75% | 0.749 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -94 | -7.5 | -174 | -63.1 | -175.6 | 0 | 0 | 0 | 115.3 | ||
| 176 | L | 50.2 | Low | 58.1 | Low | 85 Ų | 85 | 130.3 Ų | 130.3 | 45% | 0.445 | 69% | 0.689 | S | S | . | * | S | Bend | trans | -82.8 | -11.9 | 176.9 | -75.8 | 169.6 | 0 | 0 | 0 | 114 | R178 R179 | L176-R178 PolarHBondContact O-N 2.77Å; L176-R179 PolarHBondContact O-N 3.38Å |
| 177 | T | 50 | Low | 61.1 | Low | 123 Ų | 123 | 125.2 Ų | 125.2 | 76% | 0.755 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.9 | 1.7 | -167.9 | -30 | 0 | 0 | 0 | 0 | 115.7 | S174 | S174-T177 PolarHBondContact O-OG1 2.85Š|
| 178 | R | 52.8 | Low | 63.6 | Low | 244 Ų | 244 | 119.7 Ų | 119.7 | 92% | 0.921 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118 | 1.7 | 173.4 | -152.3 | 175.6 | -173.9 | -102.6 | 1.1 | 114.5 | L176 | L176-R178 PolarHBondContact O-N 2.77Š|
| 179 | R | 60.8 | Low | 66.7 | Low | 197 Ų | 197 | 119.4 Ų | 119.4 | 74% | 0.743 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -79.6 | 153.3 | 163.2 | -67 | -177.3 | 175.7 | 165.3 | -0.2 | 108.3 | L176 | L176-R179 PolarHBondContact O-N 3.38Š|
| 180 | K | 61.9 | Low | 68.9 | Low | 185 Ų | 185 | 109.9 Ų | 109.9 | 80% | 0.804 | 58% | 0.584 | S | S | * | * | trans | -52.9 | 148.5 | 172.3 | -97.5 | 77.2 | 171.4 | -174 | 0 | 108.7 | V182 | K180-V182 PolarHBondContact O-N 3.15Š| ||
| 181 | S | 66.3 | Low | 71.2 | Confident | 103 Ų | 103 | 105.5 Ų | 105.5 | 72% | 0.72 | 57% | 0.572 | S | S | * | * | trans | -67.4 | 74.6 | 172.1 | 57.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 182 | V | 85.1 | Confident | 73.6 | Confident | 101 Ų | 101 | 103 Ų | 103 | 61% | 0.612 | 55% | 0.549 | S | S | * | . | P | Polyproline II helix | trans | -65.2 | 137.6 | 173.3 | 175.2 | 0 | 0 | 0 | 0 | 108.1 | K180 T184 | K180-V182 PolarHBondContact O-N 3.15Å; V182-T184 PolarHBondContact O-N 2.78Å |
| 183 | N | 89.3 | Confident | 76.1 | Confident | 112 Ų | 112 | 100.3 Ų | 100.3 | 60% | 0.599 | 55% | 0.546 | S | S | * | . | P | Polyproline II helix | trans | -68.3 | 117.4 | 175.1 | 44.9 | -9.5 | 0 | 0 | 0 | 110.4 | T232 G233 | N183-T232 HydrophobicContact CB-CG2 4.42Å; N183-G233 CarbonylContact C-O 3.3Å; N183-G233 WeakPolarHBondContact CA-O 3.29Å |
| 184 | T | 93 | Very high | 78.3 | Confident | 51 Ų | 51 | 99.4 Ų | 99.4 | 31% | 0.313 | 54% | 0.542 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.6 | 144.5 | 175.3 | 50.5 | 0 | 0 | 0 | 0 | 110.4 | V182 T232 G233 K235 | V182-T184 PolarHBondContact O-N 2.78Å; T184-T232 WeakPolarHBondContact O-CA 3.35Å; T184-G233 PolarHBondContact N-O 2.86Å; T184-G233 PolarHBondContact O-N 3.37Å; T184-G233 VanDerWaalsContact O-N 3.15Å; T184-G233 PolarHBondContact OG1-O 3.06Å; T184-K235 HydrophobicContact CG2-CB 4.31Å; T184-K235 HydrophobicContact CG2-CG 4.39Å; T184-K235 WeakPolarHBondContact OG1-CA 3.43Å |
| 185 | T | 95 | Very high | 80.7 | Confident | 104 Ų | 104 | 95.8 Ų | 95.8 | 64% | 0.638 | 52% | 0.515 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -110.4 | 134.2 | 172.7 | 49.3 | 0 | 0 | 0 | 0 | 110.1 | V231 T232 | T185-V231 CarbonylContact C-O 3.55Å; T185-V231 WeakPolarHBondContact CA-O 3.25Å; T185-T232 HydrophobicContact CG2-CG2 3.85Å |
| 186 | E | 95.4 | Very high | 82.9 | Confident | 63 Ų | 63 | 89.6 Ų | 89.6 | 29% | 0.294 | 48% | 0.483 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.7 | 142.1 | 177.7 | -167.6 | 170.6 | -156 | 0 | 0 | 111.7 | V231 V238 K242 | E186-V231 PolarHBondContact N-O 3.05Å; E186-V231 PolarHBondContact O-N 2.92Å; E186-V238 HydrophobicContact CB-CG1 3.59Å; E186-K242 HydrophobicContact CG-CD 4.24Å; E186-K242 VanDerWaalsContact OE1-CD 3.3Å; E186-K242 WeakPolarHBondContact OE1-CD 3.25Å; E186-K242 IonicContact OE1-NZ 2.71Å; E186-K242 PolarHBondContact OE1-NZ 2.91Å; E186-K242 WeakPolarHBondContact OE2-CD 3.38Å |
| 187 | C | 94.8 | Very high | 85 | Confident | 85 Ų | 85 | 88.4 Ų | 88.4 | 57% | 0.574 | 49% | 0.485 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 129.3 | 178.2 | -66.7 | 0 | 0 | 0 | 0 | 110.5 | V228 F229 | C187-V228 HydrophobicContact CB-CG1 3.79Å; C187-F229 WeakPolarHBondContact CA-O 3.41Å |
| 188 | V | 96.3 | Very high | 87.1 | Confident | 3 Ų | 3 | 85.6 Ų | 85.6 | 2% | 0.018 | 46% | 0.463 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.5 | 102.9 | -177.9 | -169.5 | 0 | 0 | 0 | 0 | 109.2 | V228 F229 V231 K242 I245 L246 | V188-V228 WeakPolarHBondContact O-CA 3.39Å; V188-F229 HydrophobicContact CB-CB 4.48Å; V188-F229 PolarHBondContact N-O 3.13Å; V188-F229 PolarHBondContact O-N 3.42Å; V188-V231 HydrophobicContact CG2-CG2 3.86Å; V188-K242 HydrophobicContact CG1-CG 4.26Å; V188-K242 HydrophobicContact CG2-CB 3.8Å; V188-K242 HydrophobicContact CG2-CD 4.22Å; V188-K242 HydrophobicContact CG2-CG 3.84Å; V188-I245 HydrophobicContact CB-CG2 4.29Å; V188-I245 HydrophobicContact CG1-CB 4.04Å; V188-I245 HydrophobicContact CG1-CG2 3.61Å; V188-L246 HydrophobicContact CG1-CD1 4.43Å; V188-L246 HydrophobicContact CG1-CD2 3.86Å; V188-L246 HydrophobicContact CG1-CG 3.8Å |
| 189 | A | 95.9 | Very high | 89.1 | Confident | 64 Ų | 64 | 74.3 Ų | 74.3 | 53% | 0.529 | 42% | 0.421 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.5 | 144.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | V228 L246 | A189-V228 HydrophobicContact CB-CG2 4.02Å; A189-L246 WeakPolarHBondContact O-CD2 3.39Å |
| 190 | V | 95.6 | Very high | 90.8 | Very high | 7 Ų | 7 | 66.2 Ų | 66.2 | 4% | 0.042 | 39% | 0.394 | C | S | . | . | trans | -130.8 | 141.7 | -177.6 | 167 | 0 | 0 | 0 | 0 | 109 | S192 H195 V196 I199 P227 F229 I245 A249 | V190-S192 VanDerWaalsContact C-N 3.26Å; V190-S192 PolarHBondContact O-N 2.83Å; V190-H195 HydrophobicContact CG1-CB 3.46Å; V190-H195 VanDerWaalsContact CG1-CB 3.46Å; V190-V196 HydrophobicContact CB-CG2 4.14Å; V190-V196 HydrophobicContact CG1-CG2 4Å; V190-I199 HydrophobicContact CG1-CD1 4.04Å; V190-I199 HydrophobicContact CG2-CD1 4.16Å; V190-P227 PolarHBondContact N-O 2.8Å; V190-P227 WeakPolarHBondContact O-CB 3.39Å; V190-P227 WeakPolarHBondContact O-CG 3.27Å; V190-F229 HydrophobicContact CG2-CD2 3.91Å; V190-F229 HydrophobicContact CG2-CE2 3.94Å; V190-I245 HydrophobicContact CG2-CG2 3.72Å; V190-A249 HydrophobicContact CG1-CB 4.01Å; V190-A249 HydrophobicContact CG2-CB 4.37Å | ||
| 191 | P | 92.9 | Very high | 92.3 | Very high | 98 Ų | 98 | 58.3 Ų | 58.3 | 64% | 0.636 | 36% | 0.364 | S | S | * | . | S | Bend | trans | -63.8 | -20.8 | -165.3 | -26.3 | 36.1 | 0 | 0 | 0 | 116.5 | ||
| 192 | S | 92.4 | Very high | 93.6 | Very high | 35 Ų | 35 | 64.3 Ų | 64.3 | 25% | 0.245 | 37% | 0.371 | C | S | . | . | trans | -155.5 | 162.1 | 173 | 78 | 0 | 0 | 0 | 0 | 112.5 | V190 E194 H195 V196 | V190-S192 VanDerWaalsContact C-N 3.26Å; V190-S192 PolarHBondContact O-N 2.83Å; S192-E194 PolarHBondContact O-N 2.82Å; S192-E194 PolarHBondContact OG-N 2.86Å; S192-H195 PolarHBondContact O-N 2.74Å; S192-H195 PolarHBondContact OG-N 2.98Å; S192-H195 PolarHBondContact OG-ND1 2.83Å; S192-V196 PolarHBondContact O-N 3.47Å | ||
| 193 | S | 92.8 | Very high | 93.9 | Very high | 84 Ų | 84 | 67.9 Ų | 67.9 | 59% | 0.587 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -63.5 | -19.2 | 171.2 | 52.6 | 0 | 0 | 0 | 0 | 113.5 | A197 | S193-A197 PolarHBondContact O-N 2.85Å; S193-A197 VanDerWaalsContact O-N 3.15Å |
| 194 | E | 93 | Very high | 94.1 | Very high | 108 Ų | 108 | 63.2 Ų | 63.2 | 51% | 0.505 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -75.6 | -42.8 | 175 | -136.2 | -171.5 | 149.7 | 0 | 0 | 111.4 | S192 V196 A197 E198 R256 | S192-E194 PolarHBondContact O-N 2.82Å; S192-E194 PolarHBondContact OG-N 2.86Å; E194-V196 VanDerWaalsContact C-N 3.29Å; E194-V196 PolarHBondContact O-N 3.4Å; E194-A197 WeakPolarHBondContact O-CB 3.18Å; E194-A197 PolarHBondContact O-N 3.37Å; E194-A197 VanDerWaalsContact O-N 3.1Å; E194-E198 PolarHBondContact O-N 2.81Å; E194-R256 VanDerWaalsContact CD-CZ 3.46Å; E194-R256 IonicContact OE1-CZ 3.54Å; E194-R256 IonicContact OE1-NH1 3.67Å; E194-R256 PolarHBondContact OE1-NH1 2.84Å; E194-R256 VanDerWaalsContact OE1-NH1 3.1Å; E194-R256 IonicContact OE1-NH2 3.49Å; E194-R256 PolarHBondContact OE1-NH2 3.32Å; E194-R256 IonicContact OE2-CZ 3.38Å; E194-R256 IonicContact OE2-NH1 2.76Å; E194-R256 PolarHBondContact OE2-NH1 2.61Å; E194-R256 IonicContact OE2-NH2 3.55Å |
| 195 | H | 93.9 | Very high | 94.2 | Very high | 17 Ų | 17 | 64.2 Ų | 64.2 | 8% | 0.079 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -61 | -38.7 | 170.7 | -64 | 118.9 | 0 | 0 | 0 | 111.4 | V190 S192 A197 E198 I199 S253 R256 | V190-H195 HydrophobicContact CG1-CB 3.46Å; V190-H195 VanDerWaalsContact CG1-CB 3.46Å; S192-H195 PolarHBondContact O-N 2.74Å; S192-H195 PolarHBondContact OG-N 2.98Å; S192-H195 PolarHBondContact OG-ND1 2.83Å; H195-A197 VanDerWaalsContact C-N 3.33Å; H195-A197 PolarHBondContact O-N 2.78Å; H195-E198 PolarHBondContact O-N 3.26Å; H195-I199 WeakPolarHBondContact O-CB 3.41Å; H195-I199 WeakPolarHBondContact O-CD1 3.5Å; H195-I199 WeakPolarHBondContact O-CG1 3.45Å; H195-I199 PolarHBondContact O-N 2.9Å; H195-S253 PolarHBondContact CE1-OG 2.92Å; H195-S253 PolarHBondContact NE2-OG 3.12Å; H195-R256 VanDerWaalsContact NE2-CD 3.31Å; H195-R256 WeakPolarHBondContact NE2-CD 3.47Å |
| 196 | V | 94.6 | Very high | 94.3 | Very high | 13 Ų | 13 | 63.8 Ų | 63.8 | 8% | 0.079 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -56.4 | -46.1 | 171.4 | 171 | 0 | 0 | 0 | 0 | 111.1 | V190 S192 E194 E198 I199 V200 T220 P221 P227 F229 | V190-V196 HydrophobicContact CB-CG2 4.14Å; V190-V196 HydrophobicContact CG1-CG2 4Å; S192-V196 PolarHBondContact O-N 3.47Å; E194-V196 VanDerWaalsContact C-N 3.29Å; E194-V196 PolarHBondContact O-N 3.4Å; V196-E198 PolarHBondContact O-N 3.46Å; V196-I199 PolarHBondContact O-N 3.31Å; V196-V200 HydrophobicContact CG1-CG2 4.38Å; V196-V200 WeakPolarHBondContact O-CB 3.32Å; V196-V200 WeakPolarHBondContact O-CG2 3.48Å; V196-V200 PolarHBondContact O-N 3.36Å; V196-T220 HydrophobicContact CG1-CG2 4.38Å; V196-P221 HydrophobicContact CG1-CG 4.05Å; V196-P221 HydrophobicContact CG2-CG 4.49Å; V196-P227 HydrophobicContact CG2-CB 3.52Å; V196-F229 HydrophobicContact CB-CE2 4.37Å; V196-F229 HydrophobicContact CB-CZ 4.26Å; V196-F229 HydrophobicContact CG1-CE1 4.37Å; V196-F229 HydrophobicContact CG1-CE2 4.27Å; V196-F229 HydrophobicContact CG1-CZ 3.78Å; V196-F229 HydrophobicContact CG2-CE2 3.92Å; V196-F229 HydrophobicContact CG2-CZ 4.27Å |
| 197 | A | 94 | Very high | 94.3 | Very high | 60 Ų | 60 | 61 Ų | 61 | 50% | 0.496 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -64 | -38.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | S193 E194 H195 V200 G201 | S193-A197 PolarHBondContact O-N 2.85Å; S193-A197 VanDerWaalsContact O-N 3.15Å; E194-A197 WeakPolarHBondContact O-CB 3.18Å; E194-A197 PolarHBondContact O-N 3.37Å; E194-A197 VanDerWaalsContact O-N 3.1Å; H195-A197 VanDerWaalsContact C-N 3.33Å; H195-A197 PolarHBondContact O-N 2.78Å; A197-V200 PolarHBondContact O-N 2.89Å; A197-G201 PolarHBondContact O-N 2.96Å |
| 198 | E | 93.9 | Very high | 94.4 | Very high | 63 Ų | 63 | 63 Ų | 63 | 29% | 0.294 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -72.4 | -32.6 | 178 | -71.3 | -178.3 | 154.8 | 0 | 0 | 113.3 | E194 H195 V196 K206 F252 R256 | E194-E198 PolarHBondContact O-N 2.81Å; H195-E198 PolarHBondContact O-N 3.26Å; V196-E198 PolarHBondContact O-N 3.46Å; E198-K206 VanDerWaalsContact O-CD 3.26Å; E198-K206 WeakPolarHBondContact O-CD 3.4Å; E198-K206 WeakPolarHBondContact O-CE 3.44Å; E198-K206 PolarHBondContact O-NZ 2.86Å; E198-F252 HydrophobicContact CB-CD2 3.84Å; E198-F252 HydrophobicContact CB-CE2 4.09Å; E198-F252 HydrophobicContact CB-CG 4.14Å; E198-R256 IonicContact OE1-CZ 3.51Å; E198-R256 IonicContact OE1-NE 2.83Å; E198-R256 PolarHBondContact OE1-NE 3.32Å; E198-R256 IonicContact OE1-NH2 2.61Å; E198-R256 PolarHBondContact OE1-NH2 3.22Å; E198-R256 IonicContact OE2-CZ 3.1Å; E198-R256 IonicContact OE2-NE 3.34Å; E198-R256 PolarHBondContact OE2-NE 2.99Å; E198-R256 IonicContact OE2-NH2 2.75Å; E198-R256 PolarHBondContact OE2-NH2 3.1Å |
| 199 | I | 95.1 | Very high | 94.4 | Very high | 7 Ų | 7 | 65.8 Ų | 65.8 | 4% | 0.036 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -71.3 | -40 | 172 | -67.9 | 163.5 | 0 | 0 | 0 | 110.8 | V190 H195 V196 K206 F229 I245 A248 A249 F252 | V190-I199 HydrophobicContact CG1-CD1 4.04Å; V190-I199 HydrophobicContact CG2-CD1 4.16Å; H195-I199 WeakPolarHBondContact O-CB 3.41Å; H195-I199 WeakPolarHBondContact O-CD1 3.5Å; H195-I199 WeakPolarHBondContact O-CG1 3.45Å; H195-I199 PolarHBondContact O-N 2.9Å; V196-I199 PolarHBondContact O-N 3.31Å; I199-K206 WeakPolarHBondContact O-CB 3.3Å; I199-F229 HydrophobicContact CB-CE2 4.49Å; I199-F229 HydrophobicContact CB-CZ 4.22Å; I199-F229 HydrophobicContact CD1-CE2 4.26Å; I199-F229 HydrophobicContact CG2-CE2 4.14Å; I199-F229 HydrophobicContact CG2-CZ 3.84Å; I199-I245 HydrophobicContact CD1-CG2 4.42Å; I199-A248 HydrophobicContact CG1-CB 4.02Å; I199-A249 HydrophobicContact CD1-CB 4.02Å; I199-F252 HydrophobicContact CG1-CD2 3.98Å; I199-F252 HydrophobicContact CG1-CE2 3.82Å |
| 200 | V | 95.4 | Very high | 94.4 | Very high | 28 Ų | 28 | 64 Ų | 64 | 17% | 0.17 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -66.2 | -44.2 | 176 | 168.5 | 0 | 0 | 0 | 0 | 111.6 | V196 A197 G204 K206 I207 T220 F229 | V196-V200 HydrophobicContact CG1-CG2 4.38Å; V196-V200 WeakPolarHBondContact O-CB 3.32Å; V196-V200 WeakPolarHBondContact O-CG2 3.48Å; V196-V200 PolarHBondContact O-N 3.36Å; A197-V200 PolarHBondContact O-N 2.89Å; V200-G204 CarbonylContact O-C 3.43Å; V200-G204 VanDerWaalsContact O-C 3.3Å; V200-G204 VanDerWaalsContact O-CA 3.31Å; V200-G204 WeakPolarHBondContact O-CA 3.36Å; V200-K206 PolarHBondContact O-N 3.41Å; V200-I207 HydrophobicContact CB-CG2 4.39Å; V200-I207 HydrophobicContact CG1-CG2 4.03Å; V200-I207 HydrophobicContact CG2-CG2 4.39Å; V200-I207 PolarHBondContact O-N 3.28Å; V200-T220 HydrophobicContact CG2-CG2 3.51Å; V200-F229 HydrophobicContact CG2-CE1 4.06Å; V200-F229 HydrophobicContact CG2-CZ 4.15Å |
| 201 | G | 94.1 | Very high | 94.5 | Very high | 18 Ų | 18 | 67.3 Ų | 67.3 | 19% | 0.186 | 36% | 0.36 | C | S | . | . | trans | 74.2 | 169.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | A197 Q203 G204 | A197-G201 PolarHBondContact O-N 2.96Å; G201-Q203 PolarHBondContact O-N 3.1Å; G201-G204 PolarHBondContact O-N 2.72Å | ||
| 202 | R | 93.2 | Very high | 94.6 | Very high | 230 Ų | 230 | 66.1 Ų | 66.1 | 87% | 0.868 | 36% | 0.358 | S | S | * | . | G | 310 helix | trans | -57.7 | 131.1 | 179.6 | -62.7 | -178.4 | -179.7 | -178.5 | -0.4 | 110.2 | G204 C205 | R202-G204 PolarHBondContact O-N 2.75Å; R202-C205 WeakPolarHBondContact O-CB 3.21Å; R202-C205 PolarHBondContact O-N 3.43Å; R202-C205 PolarHBondContact O-SG 3.15Å |
| 203 | Q | 91.6 | Very high | 94.8 | Very high | 176 Ų | 176 | 70.4 Ų | 70.4 | 82% | 0.822 | 37% | 0.372 | S | S | * | . | G | 310 helix | trans | 52.3 | 22.9 | -174.9 | -48.2 | -58.9 | 52.8 | 0 | 0 | 115.4 | G201 C205 K208 | G201-Q203 PolarHBondContact O-N 3.1Å; Q203-C205 VanDerWaalsContact C-N 3.25Å; Q203-C205 PolarHBondContact O-N 3.29Å; Q203-K208 PolarHBondContact O-NZ 2.79Å; Q203-K208 VanDerWaalsContact O-NZ 3.11Å |
| 204 | G | 93.8 | Very high | 94.9 | Very high | 13 Ų | 13 | 66.4 Ų | 66.4 | 13% | 0.134 | 34% | 0.344 | C | S | . | . | G | 310 helix | trans | 66.8 | 20.8 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | V200 G201 R202 K206 I207 K208 | V200-G204 CarbonylContact O-C 3.43Å; V200-G204 VanDerWaalsContact O-C 3.3Å; V200-G204 VanDerWaalsContact O-CA 3.31Å; V200-G204 WeakPolarHBondContact O-CA 3.36Å; G201-G204 PolarHBondContact O-N 2.72Å; R202-G204 PolarHBondContact O-N 2.75Å; G204-K206 PolarHBondContact O-N 3.29Å; G204-I207 WeakPolarHBondContact O-CG2 3.33Å; G204-I207 PolarHBondContact O-N 3.26Å; G204-K208 WeakPolarHBondContact O-CB 3.41Å; G204-K208 WeakPolarHBondContact O-CD 3.19Å; G204-K208 VanDerWaalsContact O-CG 3.25Å; G204-K208 WeakPolarHBondContact O-CG 3.3Å; G204-K208 PolarHBondContact O-N 3Å |
| 205 | C | 95.8 | Very high | 95 | Very high | 72 Ų | 72 | 66.5 Ų | 66.5 | 49% | 0.486 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -61.6 | -41.2 | -173.5 | 65.6 | 0 | 0 | 0 | 0 | 113 | R202 Q203 A209 | R202-C205 WeakPolarHBondContact O-CB 3.21Å; R202-C205 PolarHBondContact O-N 3.43Å; R202-C205 PolarHBondContact O-SG 3.15Å; Q203-C205 VanDerWaalsContact C-N 3.25Å; Q203-C205 PolarHBondContact O-N 3.29Å; C205-A209 PolarHBondContact O-N 3.42Å |
| 206 | K | 95.8 | Very high | 95.1 | Very high | 95 Ų | 95 | 66 Ų | 66 | 41% | 0.413 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -67.6 | -48.6 | 179.2 | -69.2 | -177.5 | -176.7 | 178.9 | 0 | 111.3 | E198 I199 V200 G204 K208 A209 L210 F252 | E198-K206 VanDerWaalsContact O-CD 3.26Å; E198-K206 WeakPolarHBondContact O-CD 3.4Å; E198-K206 WeakPolarHBondContact O-CE 3.44Å; E198-K206 PolarHBondContact O-NZ 2.86Å; I199-K206 WeakPolarHBondContact O-CB 3.3Å; V200-K206 PolarHBondContact O-N 3.41Å; G204-K206 PolarHBondContact O-N 3.29Å; K206-K208 VanDerWaalsContact C-N 3.3Å; K206-K208 PolarHBondContact O-N 3.41Å; K206-A209 WeakPolarHBondContact O-CB 3.44Å; K206-A209 PolarHBondContact O-N 3.15Å; K206-A209 VanDerWaalsContact O-N 3.15Å; K206-L210 WeakPolarHBondContact O-CB 3.19Å; K206-L210 PolarHBondContact O-N 3.08Å; K206-F252 VanDerWaalsContact NZ-CZ 3.32Å |
| 207 | I | 96.1 | Very high | 95.2 | Very high | 5 Ų | 5 | 72.6 Ų | 72.6 | 3% | 0.026 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -67.2 | -30.9 | 179.4 | -167.2 | 65.3 | 0 | 0 | 0 | 112.4 | V200 G204 L210 R211 I218 F229 | V200-I207 HydrophobicContact CB-CG2 4.39Å; V200-I207 HydrophobicContact CG1-CG2 4.03Å; V200-I207 HydrophobicContact CG2-CG2 4.39Å; V200-I207 PolarHBondContact O-N 3.28Å; G204-I207 WeakPolarHBondContact O-CG2 3.33Å; G204-I207 PolarHBondContact O-N 3.26Å; I207-L210 HydrophobicContact CD1-CB 4.4Å; I207-L210 HydrophobicContact CD1-CD2 4.08Å; I207-L210 PolarHBondContact O-N 3.43Å; I207-R211 WeakPolarHBondContact O-CB 3.44Å; I207-R211 VanDerWaalsContact O-CG 3.23Å; I207-R211 WeakPolarHBondContact O-CG 3.38Å; I207-R211 PolarHBondContact O-N 3.27Å; I207-I218 HydrophobicContact CD1-CB 4.08Å; I207-I218 HydrophobicContact CD1-CD1 3.78Å; I207-I218 HydrophobicContact CD1-CG2 3.9Å; I207-F229 HydrophobicContact CD1-CE1 4.31Å |
| 208 | K | 96.3 | Very high | 95.4 | Very high | 128 Ų | 128 | 69.7 Ų | 69.7 | 56% | 0.557 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -62.7 | -47.2 | 169.3 | -75.8 | 166.5 | 179.5 | 163.9 | 0 | 111.5 | Q203 G204 K206 L210 R211 A212 | Q203-K208 PolarHBondContact O-NZ 2.79Å; Q203-K208 VanDerWaalsContact O-NZ 3.11Å; G204-K208 WeakPolarHBondContact O-CB 3.41Å; G204-K208 WeakPolarHBondContact O-CD 3.19Å; G204-K208 VanDerWaalsContact O-CG 3.25Å; G204-K208 WeakPolarHBondContact O-CG 3.3Å; G204-K208 PolarHBondContact O-N 3Å; K206-K208 VanDerWaalsContact C-N 3.3Å; K206-K208 PolarHBondContact O-N 3.41Å; K208-L210 VanDerWaalsContact C-N 3.33Å; K208-L210 PolarHBondContact O-N 3.19Å; K208-R211 PolarHBondContact O-N 3.03Å; K208-A212 WeakPolarHBondContact O-CB 3.23Å; K208-A212 PolarHBondContact O-N 2.82Å |
| 209 | A | 96.4 | Very high | 95.5 | Very high | 61 Ų | 61 | 72.1 Ų | 72.1 | 50% | 0.504 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -62.4 | -39 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | C205 K206 A212 K213 | C205-A209 PolarHBondContact O-N 3.42Å; K206-A209 WeakPolarHBondContact O-CB 3.44Å; K206-A209 PolarHBondContact O-N 3.15Å; K206-A209 VanDerWaalsContact O-N 3.15Å; A209-A212 PolarHBondContact O-N 3.34Å; A209-K213 VanDerWaalsContact O-CB 3.26Å; A209-K213 WeakPolarHBondContact O-CB 3.33Å; A209-K213 PolarHBondContact O-N 2.88Å |
| 210 | L | 96.3 | Very high | 95.5 | Very high | 27 Ų | 27 | 73.7 Ų | 73.7 | 14% | 0.141 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -66.5 | -45.2 | 178.8 | -156.7 | 74 | 0 | 0 | 0 | 112.2 | K206 I207 K208 A212 K213 T214 I218 E244 I245 | K206-L210 WeakPolarHBondContact O-CB 3.19Å; K206-L210 PolarHBondContact O-N 3.08Å; I207-L210 HydrophobicContact CD1-CB 4.4Å; I207-L210 HydrophobicContact CD1-CD2 4.08Å; I207-L210 PolarHBondContact O-N 3.43Å; K208-L210 VanDerWaalsContact C-N 3.33Å; K208-L210 PolarHBondContact O-N 3.19Å; L210-A212 VanDerWaalsContact C-N 3.34Å; L210-A212 PolarHBondContact O-N 2.93Å; L210-K213 PolarHBondContact O-N 2.86Å; L210-T214 WeakPolarHBondContact O-CB 3.38Å; L210-T214 WeakPolarHBondContact O-CG2 3.47Å; L210-T214 PolarHBondContact O-N 3.28Å; L210-T214 PolarHBondContact O-OG1 2.89Å; L210-I218 HydrophobicContact CB-CD1 4.46Å; L210-I218 HydrophobicContact CD2-CD1 4Å; L210-I218 HydrophobicContact CG-CD1 4.29Å; L210-E244 HydrophobicContact CD1-CB 3.88Å; L210-E244 WeakPolarHBondContact CD1-OE2 3.24Å; L210-I245 HydrophobicContact CD2-CD1 4.46Å; L210-I245 HydrophobicContact CD2-CG1 3.73Å |
| 211 | R | 96.6 | Very high | 95.4 | Very high | 76 Ų | 76 | 73.1 Ų | 73.1 | 29% | 0.287 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -58.9 | -43.4 | 172.4 | -71.5 | 173.6 | -171.1 | 163.8 | 6.1 | 111.6 | I207 K208 N215 T216 I218 | I207-R211 WeakPolarHBondContact O-CB 3.44Å; I207-R211 VanDerWaalsContact O-CG 3.23Å; I207-R211 WeakPolarHBondContact O-CG 3.38Å; I207-R211 PolarHBondContact O-N 3.27Å; K208-R211 PolarHBondContact O-N 3.03Å; R211-N215 VanDerWaalsContact O-CA 3.28Å; R211-N215 WeakPolarHBondContact O-CA 3.47Å; R211-N215 PolarHBondContact O-N 3.18Å; R211-T216 WeakPolarHBondContact CB-O 3.23Å; R211-T216 WeakPolarHBondContact CG-O 3.41Å; R211-T216 PolarHBondContact O-N 3.3Å; R211-I218 HydrophobicContact CG-CB 3.99Å; R211-I218 HydrophobicContact CG-CD1 3.88Å; R211-I218 HydrophobicContact CG-CG1 3.89Å; R211-I218 PolarHBondContact NE-O 3.15Å; R211-I218 PolarHBondContact NH2-O 2.84Å |
| 212 | A | 96.4 | Very high | 95.2 | Very high | 72 Ų | 72 | 76.7 Ų | 76.7 | 60% | 0.595 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -68.7 | -41.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | K208 A209 L210 | K208-A212 WeakPolarHBondContact O-CB 3.23Å; K208-A212 PolarHBondContact O-N 2.82Å; A209-A212 PolarHBondContact O-N 3.34Å; L210-A212 VanDerWaalsContact C-N 3.34Å; L210-A212 PolarHBondContact O-N 2.93Å |
| 213 | K | 95.4 | Very high | 94.7 | Very high | 125 Ų | 125 | 78.2 Ų | 78.2 | 54% | 0.543 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -65.3 | -40.9 | 178 | 178.6 | 179.9 | 171.8 | -169.6 | 0 | 112.5 | A209 L210 E244 | A209-K213 VanDerWaalsContact O-CB 3.26Å; A209-K213 WeakPolarHBondContact O-CB 3.33Å; A209-K213 PolarHBondContact O-N 2.88Å; L210-K213 PolarHBondContact O-N 2.86Å; K213-E244 WeakPolarHBondContact CD-OE2 3.38Å; K213-E244 VanDerWaalsContact CE-OE2 3.3Å; K213-E244 WeakPolarHBondContact CE-OE2 3.33Å; K213-E244 IonicContact NZ-OE1 2.62Å; K213-E244 PolarHBondContact NZ-OE1 3.47Å; K213-E244 IonicContact NZ-OE2 2.97Å; K213-E244 PolarHBondContact NZ-OE2 2.83Å |
| 214 | T | 95.6 | Very high | 94.3 | Very high | 0 Ų | 0 | 73.5 Ų | 73.5 | 0% | 0 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -96.8 | -3.9 | -175.3 | 61.3 | 0 | 0 | 0 | 0 | 113.5 | L210 T216 D237 M240 A241 | L210-T214 WeakPolarHBondContact O-CB 3.38Å; L210-T214 WeakPolarHBondContact O-CG2 3.47Å; L210-T214 PolarHBondContact O-N 3.28Å; L210-T214 PolarHBondContact O-OG1 2.89Å; T214-T216 PolarHBondContact O-N 3.01Å; T214-T216 VanDerWaalsContact O-N 3.1Å; T214-T216 PolarHBondContact OG1-OG1 3.41Å; T214-D237 WeakPolarHBondContact O-CB 3.23Å; T214-M240 HydrophobicContact CG2-CB 4.44Å; T214-M240 HydrophobicContact CG2-CG 4.18Å; T214-M240 HydrophobicContact CG2-SD 4.07Å; T214-A241 HydrophobicContact CG2-CB 3.97Å |
| 215 | N | 95.4 | Very high | 94.2 | Very high | 111 Ų | 111 | 78 Ų | 78 | 59% | 0.594 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54 | 23.1 | -172.8 | -55.4 | -78.6 | 0 | 0 | 0 | 114.6 | R211 | R211-N215 VanDerWaalsContact O-CA 3.28Å; R211-N215 WeakPolarHBondContact O-CA 3.47Å; R211-N215 PolarHBondContact O-N 3.18Å |
| 216 | T | 96.3 | Very high | 94 | Very high | 7 Ų | 7 | 81.5 Ų | 81.5 | 4% | 0.043 | 41% | 0.413 | C | S | . | . | trans | -99.4 | 148.4 | 179.7 | 61.1 | 0 | 0 | 0 | 0 | 112.9 | R211 T214 I218 V231 D237 V238 A241 | R211-T216 WeakPolarHBondContact CB-O 3.23Å; R211-T216 WeakPolarHBondContact CG-O 3.41Å; R211-T216 PolarHBondContact O-N 3.3Å; T214-T216 PolarHBondContact O-N 3.01Å; T214-T216 VanDerWaalsContact O-N 3.1Å; T214-T216 PolarHBondContact OG1-OG1 3.41Å; T216-I218 WeakPolarHBondContact OG1-CD1 3.3Å; T216-I218 VanDerWaalsContact OG1-CG1 3.23Å; T216-I218 WeakPolarHBondContact OG1-CG1 3.15Å; T216-V231 HydrophobicContact CG2-CG1 3.85Å; T216-D237 HydrophobicContact CG2-CB 3.77Å; T216-D237 WeakPolarHBondContact CG2-O 3.5Å; T216-V238 HydrophobicContact CG2-CG2 4.2Å; T216-A241 HydrophobicContact CG2-CB 3.92Å | ||
| 217 | Y | 96.8 | Very high | 94 | Very high | 150 Ų | 150 | 77.9 Ų | 77.9 | 59% | 0.588 | 40% | 0.399 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -86.1 | 111.6 | 162.4 | 179.4 | -90.3 | 0 | 0 | 0 | 109.1 | K219 T232 | Y217-K219 HydrophobicContact CE1-CB 4.2Å; Y217-T232 PolarHBondContact N-O 3.1Å; Y217-T232 PolarHBondContact O-N 3.03Å |
| 218 | I | 96.9 | Very high | 94 | Very high | 0 Ų | 0 | 79.5 Ų | 79.5 | 0% | 0 | 41% | 0.409 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.5 | 103.2 | -179.3 | -51.4 | 167.6 | 0 | 0 | 0 | 109.6 | I207 L210 R211 T216 T220 F229 V230 V231 A241 I245 | I207-I218 HydrophobicContact CD1-CB 4.08Å; I207-I218 HydrophobicContact CD1-CD1 3.78Å; I207-I218 HydrophobicContact CD1-CG2 3.9Å; L210-I218 HydrophobicContact CB-CD1 4.46Å; L210-I218 HydrophobicContact CD2-CD1 4Å; L210-I218 HydrophobicContact CG-CD1 4.29Å; R211-I218 HydrophobicContact CG-CB 3.99Å; R211-I218 HydrophobicContact CG-CD1 3.88Å; R211-I218 HydrophobicContact CG-CG1 3.89Å; R211-I218 PolarHBondContact NE-O 3.15Å; R211-I218 PolarHBondContact NH2-O 2.84Å; T216-I218 WeakPolarHBondContact OG1-CD1 3.3Å; T216-I218 VanDerWaalsContact OG1-CG1 3.23Å; T216-I218 WeakPolarHBondContact OG1-CG1 3.15Å; I218-T220 PolarHBondContact O-N 3.44Å; I218-F229 HydrophobicContact CG2-CB 4Å; I218-F229 HydrophobicContact CG2-CD1 3.76Å; I218-F229 HydrophobicContact CG2-CG 4.24Å; I218-V230 CarbonylContact C-O 3.55Å; I218-V230 WeakPolarHBondContact CA-O 3.37Å; I218-V231 HydrophobicContact CG1-CG1 4.25Å; I218-V231 HydrophobicContact CG1-CG2 4.33Å; I218-V231 HydrophobicContact CG2-CG2 4.16Å; I218-A241 HydrophobicContact CD1-CB 4.39Å; I218-I245 HydrophobicContact CD1-CD1 4.37Å; I218-I245 HydrophobicContact CG2-CD1 4.19Å |
| 219 | K | 96 | Very high | 94 | Very high | 113 Ų | 113 | 73.4 Ų | 73.4 | 49% | 0.491 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.8 | 123.2 | 170.1 | -169.6 | -172.2 | 176.8 | -168.4 | 0 | 108.9 | Y217 F229 V230 | Y217-K219 HydrophobicContact CE1-CB 4.2Å; K219-F229 WeakPolarHBondContact O-CA 3.42Å; K219-V230 HydrophobicContact CB-CB 4.15Å; K219-V230 PolarHBondContact N-O 3.3Å; K219-V230 PolarHBondContact O-N 3.12Å; K219-V230 VanDerWaalsContact O-N 3.15Å |
| 220 | T | 94.8 | Very high | 94 | Very high | 40 Ų | 40 | 72.9 Ų | 72.9 | 25% | 0.245 | 37% | 0.373 | C | S | . | . | P | Polyproline II helix | trans | -83.5 | 132.5 | 171 | -53.3 | 0 | 0 | 0 | 0 | 108.5 | V196 V200 I218 F229 | V196-T220 HydrophobicContact CG1-CG2 4.38Å; V200-T220 HydrophobicContact CG2-CG2 3.51Å; I218-T220 PolarHBondContact O-N 3.44Å; T220-F229 HydrophobicContact CG2-CE1 4.04Å |
| 221 | P | 94 | Very high | 94 | Very high | 17 Ų | 17 | 71.6 Ų | 71.6 | 11% | 0.11 | 37% | 0.366 | C | S | . | . | P | Polyproline II helix | trans | -66.7 | 150.8 | 173.2 | 29.3 | -34.3 | 0 | 0 | 0 | 110.2 | V196 E225 Q226 V228 | V196-P221 HydrophobicContact CG1-CG 4.05Å; V196-P221 HydrophobicContact CG2-CG 4.49Å; P221-E225 HydrophobicContact CB-CB 4.47Å; P221-Q226 WeakPolarHBondContact CB-O 3.49Å; P221-V228 WeakPolarHBondContact CD-O 3.44Å; P221-V228 WeakPolarHBondContact CG-O 3.22Å |
| 222 | V | 89.4 | Confident | 94 | Very high | 93 Ų | 93 | 69.7 Ų | 69.7 | 56% | 0.564 | 36% | 0.363 | S | S | * | . | P | Polyproline II helix | trans | -78.1 | 158.8 | 179.4 | -59 | 0 | 0 | 0 | 0 | 111.6 | G224 E225 | V222-G224 PolarHBondContact O-N 3.25Å; V222-E225 HydrophobicContact CG2-CB 4.27Å; V222-E225 VanDerWaalsContact CG2-CD 3.4Å; V222-E225 HydrophobicContact CG2-CG 3.64Å; V222-E225 PolarHBondContact N-OE2 3.47Å; V222-E225 PolarHBondContact O-N 3.17Å |
| 223 | R | 83.1 | Confident | 94 | Very high | 261 Ų | 261 | 66.8 Ų | 66.8 | 99% | 0.985 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | 94.7 | -175.4 | -176.8 | -177.6 | 177.4 | -175.7 | -1.8 | 110.8 | ||
| 224 | G | 83.1 | Confident | 93.9 | Very high | 78 Ų | 78 | 66 Ų | 66 | 80% | 0.804 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 133.4 | -18.2 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | V222 | V222-G224 PolarHBondContact O-N 3.25Š|
| 225 | E | 91.3 | Very high | 93.8 | Very high | 108 Ų | 108 | 70.4 Ų | 70.4 | 51% | 0.505 | 35% | 0.353 | S | S | . | . | S | Bend | trans | -78.6 | 169.7 | 169.3 | -77.6 | 179 | 173.2 | 0 | 0 | 112.1 | P221 V222 | P221-E225 HydrophobicContact CB-CB 4.47Å; V222-E225 HydrophobicContact CG2-CB 4.27Å; V222-E225 VanDerWaalsContact CG2-CD 3.4Å; V222-E225 HydrophobicContact CG2-CG 3.64Å; V222-E225 PolarHBondContact N-OE2 3.47Å; V222-E225 PolarHBondContact O-N 3.17Å |
| 226 | Q | 92.1 | Very high | 93.8 | Very high | 144 Ų | 144 | 70.4 Ų | 70.4 | 67% | 0.673 | 35% | 0.349 | S | S | * | . | trans | -53.9 | 135.7 | 172 | -171.5 | 67.5 | 10 | 0 | 0 | 110.9 | P221 V228 | P221-Q226 WeakPolarHBondContact CB-O 3.49Å; Q226-V228 HydrophobicContact CG-CG2 3.88Å; Q226-V228 PolarHBondContact O-N 2.83Å | ||
| 227 | P | 95.1 | Very high | 93.7 | Very high | 19 Ų | 19 | 70.6 Ų | 70.6 | 12% | 0.123 | 35% | 0.35 | C | S | . | . | S | Bend | trans | -72.5 | 68.9 | 178.9 | 30.2 | -37.7 | 0 | 0 | 0 | 112.7 | V190 V196 | V190-P227 PolarHBondContact N-O 2.8Å; V190-P227 WeakPolarHBondContact O-CB 3.39Å; V190-P227 WeakPolarHBondContact O-CG 3.27Å; V196-P227 HydrophobicContact CG2-CB 3.52Å |
| 228 | V | 95.9 | Very high | 93.7 | Very high | 39 Ų | 39 | 63.6 Ų | 63.6 | 24% | 0.236 | 32% | 0.323 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.6 | 120.2 | 176.2 | 172.3 | 0 | 0 | 0 | 0 | 109.5 | C187 V188 A189 P221 Q226 | C187-V228 HydrophobicContact CB-CG1 3.79Å; V188-V228 WeakPolarHBondContact O-CA 3.39Å; A189-V228 HydrophobicContact CB-CG2 4.02Å; P221-V228 WeakPolarHBondContact CD-O 3.44Å; P221-V228 WeakPolarHBondContact CG-O 3.22Å; Q226-V228 HydrophobicContact CG-CG2 3.88Å; Q226-V228 PolarHBondContact O-N 2.83Å |
| 229 | F | 96.6 | Very high | 93.7 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -81 | 140.2 | 166.7 | -68.2 | -85.6 | 0 | 0 | 0 | 109.8 | C187 V188 V190 V196 I199 V200 I207 I218 K219 T220 I245 | C187-F229 WeakPolarHBondContact CA-O 3.41Å; V188-F229 HydrophobicContact CB-CB 4.48Å; V188-F229 PolarHBondContact N-O 3.13Å; V188-F229 PolarHBondContact O-N 3.42Å; V190-F229 HydrophobicContact CG2-CD2 3.91Å; V190-F229 HydrophobicContact CG2-CE2 3.94Å; V196-F229 HydrophobicContact CB-CE2 4.37Å; V196-F229 HydrophobicContact CB-CZ 4.26Å; V196-F229 HydrophobicContact CG1-CE1 4.37Å; V196-F229 HydrophobicContact CG1-CE2 4.27Å; V196-F229 HydrophobicContact CG1-CZ 3.78Å; V196-F229 HydrophobicContact CG2-CE2 3.92Å; V196-F229 HydrophobicContact CG2-CZ 4.27Å; I199-F229 HydrophobicContact CB-CE2 4.49Å; I199-F229 HydrophobicContact CB-CZ 4.22Å; I199-F229 HydrophobicContact CD1-CE2 4.26Å; I199-F229 HydrophobicContact CG2-CE2 4.14Å; I199-F229 HydrophobicContact CG2-CZ 3.84Å; V200-F229 HydrophobicContact CG2-CE1 4.06Å; V200-F229 HydrophobicContact CG2-CZ 4.15Å; I207-F229 HydrophobicContact CD1-CE1 4.31Å; I218-F229 HydrophobicContact CG2-CB 4Å; I218-F229 HydrophobicContact CG2-CD1 3.76Å; I218-F229 HydrophobicContact CG2-CG 4.24Å; K219-F229 WeakPolarHBondContact O-CA 3.42Å; T220-F229 HydrophobicContact CG2-CE1 4.04Å; F229-I245 HydrophobicContact CB-CD1 4.18Å; F229-I245 HydrophobicContact CD2-CG2 3.73Å; F229-I245 HydrophobicContact CE2-CG2 4.09Å; F229-I245 HydrophobicContact CG-CD1 4.32Å |
| 230 | V | 96.6 | Very high | 93.7 | Very high | 51 Ų | 51 | 64.9 Ų | 64.9 | 31% | 0.309 | 34% | 0.34 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.5 | 115.6 | 170.8 | -173.2 | 0 | 0 | 0 | 0 | 108.3 | I218 K219 | I218-V230 CarbonylContact C-O 3.55Å; I218-V230 WeakPolarHBondContact CA-O 3.37Å; K219-V230 HydrophobicContact CB-CB 4.15Å; K219-V230 PolarHBondContact N-O 3.3Å; K219-V230 PolarHBondContact O-N 3.12Å; K219-V230 VanDerWaalsContact O-N 3.15Å |
| 231 | V | 97.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 63 Ų | 63 | 0% | 0 | 33% | 0.329 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.5 | 129.4 | -175.1 | -174.2 | 0 | 0 | 0 | 0 | 109 | T185 E186 V188 T216 I218 V238 A241 I245 | T185-V231 CarbonylContact C-O 3.55Å; T185-V231 WeakPolarHBondContact CA-O 3.25Å; E186-V231 PolarHBondContact N-O 3.05Å; E186-V231 PolarHBondContact O-N 2.92Å; V188-V231 HydrophobicContact CG2-CG2 3.86Å; T216-V231 HydrophobicContact CG2-CG1 3.85Å; I218-V231 HydrophobicContact CG1-CG1 4.25Å; I218-V231 HydrophobicContact CG1-CG2 4.33Å; I218-V231 HydrophobicContact CG2-CG2 4.16Å; V231-V238 HydrophobicContact CB-CG1 4.33Å; V231-V238 HydrophobicContact CG1-CB 4.29Å; V231-V238 HydrophobicContact CG1-CG1 4.03Å; V231-V238 HydrophobicContact CG1-CG2 4.07Å; V231-A241 HydrophobicContact CG1-CB 3.81Å; V231-I245 HydrophobicContact CG2-CD1 3.9Å |
| 232 | T | 95.9 | Very high | 93.9 | Very high | 36 Ų | 36 | 65.4 Ų | 65.4 | 22% | 0.221 | 34% | 0.338 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128 | 128.7 | 178.1 | -50.6 | 0 | 0 | 0 | 0 | 109.9 | N183 T184 T185 Y217 | N183-T232 HydrophobicContact CB-CG2 4.42Å; T184-T232 WeakPolarHBondContact O-CA 3.35Å; T185-T232 HydrophobicContact CG2-CG2 3.85Å; Y217-T232 PolarHBondContact N-O 3.1Å; Y217-T232 PolarHBondContact O-N 3.03Å |
| 233 | G | 95.8 | Very high | 94.2 | Very high | 10 Ų | 10 | 70.1 Ų | 70.1 | 10% | 0.103 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 176.2 | -163.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | N183 T184 V238 | N183-G233 CarbonylContact C-O 3.3Å; N183-G233 WeakPolarHBondContact CA-O 3.29Å; T184-G233 PolarHBondContact N-O 2.86Å; T184-G233 PolarHBondContact O-N 3.37Å; T184-G233 VanDerWaalsContact O-N 3.15Å; T184-G233 PolarHBondContact OG1-O 3.06Å; G233-V238 VanDerWaalsContact N-CG2 3.3Å |
| 234 | R | 94.4 | Very high | 94.9 | Very high | 110 Ų | 110 | 60.5 Ų | 60.5 | 42% | 0.415 | 31% | 0.311 | S | S | . | . | trans | -70.7 | 158 | 169.1 | -59.6 | 175.4 | -68.7 | -176.4 | 5.9 | 110 | E236 D237 V238 | R234-E236 VanDerWaalsContact C-N 3.3Å; R234-E236 VanDerWaalsContact CB-CD 3.46Å; R234-E236 VanDerWaalsContact CB-OE1 3.27Å; R234-E236 WeakPolarHBondContact CB-OE1 3.41Å; R234-E236 WeakPolarHBondContact CB-OE2 3.43Å; R234-E236 WeakPolarHBondContact CD-OE1 3.31Å; R234-E236 IonicContact CZ-OE1 3.88Å; R234-E236 IonicContact NE-OE1 3.46Å; R234-E236 PolarHBondContact NE-OE1 3.1Å; R234-E236 PolarHBondContact O-N 3.21Å; R234-D237 HydrophobicContact CB-CB 4.3Å; R234-D237 IonicContact CZ-OD2 3.16Å; R234-D237 IonicContact NE-OD2 2.7Å; R234-D237 PolarHBondContact NE-OD2 2.76Å; R234-D237 IonicContact NH2-OD1 3.28Å; R234-D237 PolarHBondContact NH2-OD1 2.71Å; R234-D237 IonicContact NH2-OD2 2.76Å; R234-D237 PolarHBondContact NH2-OD2 3.38Å; R234-D237 WeakPolarHBondContact O-CB 3.46Å; R234-D237 PolarHBondContact O-N 3.06Å; R234-V238 WeakPolarHBondContact O-CB 3.48Å; R234-V238 VanDerWaalsContact O-CG2 3.22Å; R234-V238 WeakPolarHBondContact O-CG2 3.48Å; R234-V238 PolarHBondContact O-N 3.49Å | ||
| 235 | K | 93.9 | Very high | 95.5 | Very high | 91 Ų | 91 | 56.8 Ų | 56.8 | 40% | 0.396 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -60.3 | -41.3 | -170.9 | -165.6 | -174.8 | -173.6 | -168.8 | 0 | 112.1 | H173 T184 A239 | H173-K235 PolarHBondContact CD2-NZ 3.11Å; H173-K235 VanDerWaalsContact CD2-NZ 3.34Å; H173-K235 WeakPolarHBondContact NE2-CE 3.45Å; H173-K235 PolarHBondContact NE2-NZ 3.37Å; T184-K235 HydrophobicContact CG2-CB 4.31Å; T184-K235 HydrophobicContact CG2-CG 4.39Å; T184-K235 WeakPolarHBondContact OG1-CA 3.43Å; K235-A239 WeakPolarHBondContact O-CB 3.45Å; K235-A239 PolarHBondContact O-N 2.98Å; K235-A239 VanDerWaalsContact O-N 3.08Å |
| 236 | E | 93.9 | Very high | 95.8 | Very high | 112 Ų | 112 | 54.5 Ų | 54.5 | 52% | 0.523 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -65.8 | -43.9 | 176.5 | 65.2 | -77.6 | -169.2 | 0 | 0 | 112.8 | R234 M240 | R234-E236 VanDerWaalsContact C-N 3.3Å; R234-E236 VanDerWaalsContact CB-CD 3.46Å; R234-E236 VanDerWaalsContact CB-OE1 3.27Å; R234-E236 WeakPolarHBondContact CB-OE1 3.41Å; R234-E236 WeakPolarHBondContact CB-OE2 3.43Å; R234-E236 WeakPolarHBondContact CD-OE1 3.31Å; R234-E236 IonicContact CZ-OE1 3.88Å; R234-E236 IonicContact NE-OE1 3.46Å; R234-E236 PolarHBondContact NE-OE1 3.1Å; R234-E236 PolarHBondContact O-N 3.21Å; E236-M240 PolarHBondContact O-N 2.92Å |
| 237 | D | 95.8 | Very high | 96 | Very high | 11 Ų | 11 | 50.8 Ų | 50.8 | 6% | 0.059 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.3 | -42.9 | 178.3 | -77.2 | -22.2 | 0 | 0 | 0 | 111.6 | T214 T216 R234 M240 A241 | T214-D237 WeakPolarHBondContact O-CB 3.23Å; T216-D237 HydrophobicContact CG2-CB 3.77Å; T216-D237 WeakPolarHBondContact CG2-O 3.5Å; R234-D237 HydrophobicContact CB-CB 4.3Å; R234-D237 IonicContact CZ-OD2 3.16Å; R234-D237 IonicContact NE-OD2 2.7Å; R234-D237 PolarHBondContact NE-OD2 2.76Å; R234-D237 IonicContact NH2-OD1 3.28Å; R234-D237 PolarHBondContact NH2-OD1 2.71Å; R234-D237 IonicContact NH2-OD2 2.76Å; R234-D237 PolarHBondContact NH2-OD2 3.38Å; R234-D237 WeakPolarHBondContact O-CB 3.46Å; R234-D237 PolarHBondContact O-N 3.06Å; D237-M240 PolarHBondContact O-N 3.47Å; D237-A241 WeakPolarHBondContact O-CB 3.26Å; D237-A241 PolarHBondContact O-N 3.32Å |
| 238 | V | 96.4 | Very high | 96 | Very high | 2 Ų | 2 | 51.2 Ų | 51.2 | 1% | 0.012 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -65.2 | -44.4 | 177.8 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | E186 T216 V231 G233 R234 M240 A241 K242 | E186-V238 HydrophobicContact CB-CG1 3.59Å; T216-V238 HydrophobicContact CG2-CG2 4.2Å; V231-V238 HydrophobicContact CB-CG1 4.33Å; V231-V238 HydrophobicContact CG1-CB 4.29Å; V231-V238 HydrophobicContact CG1-CG1 4.03Å; V231-V238 HydrophobicContact CG1-CG2 4.07Å; G233-V238 VanDerWaalsContact N-CG2 3.3Å; R234-V238 WeakPolarHBondContact O-CB 3.48Å; R234-V238 VanDerWaalsContact O-CG2 3.22Å; R234-V238 WeakPolarHBondContact O-CG2 3.48Å; R234-V238 PolarHBondContact O-N 3.49Å; V238-M240 VanDerWaalsContact C-N 3.32Å; V238-M240 PolarHBondContact O-N 2.75Å; V238-A241 PolarHBondContact O-N 3.22Å; V238-K242 WeakPolarHBondContact O-CB 3.36Å; V238-K242 PolarHBondContact O-N 3.47Å |
| 239 | A | 95.9 | Very high | 96 | Very high | 51 Ų | 51 | 49.5 Ų | 49.5 | 42% | 0.421 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -62 | -38.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | K235 R243 | K235-A239 WeakPolarHBondContact O-CB 3.45Å; K235-A239 PolarHBondContact O-N 2.98Å; K235-A239 VanDerWaalsContact O-N 3.08Å; A239-R243 WeakPolarHBondContact O-CB 3.42Å; A239-R243 PolarHBondContact O-N 3.48Å; A239-R243 VanDerWaalsContact O-N 3.1Å |
| 240 | M | 96.1 | Very high | 96 | Very high | 90 Ų | 90 | 55.2 Ų | 55.2 | 44% | 0.443 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -63.8 | -49.7 | 173.6 | -168.3 | -171.2 | -55.6 | 0 | 0 | 111.3 | T214 E236 D237 V238 K242 R243 E244 | T214-M240 HydrophobicContact CG2-CB 4.44Å; T214-M240 HydrophobicContact CG2-CG 4.18Å; T214-M240 HydrophobicContact CG2-SD 4.07Å; E236-M240 PolarHBondContact O-N 2.92Å; D237-M240 PolarHBondContact O-N 3.47Å; V238-M240 VanDerWaalsContact C-N 3.32Å; V238-M240 PolarHBondContact O-N 2.75Å; M240-K242 PolarHBondContact O-N 2.97Å; M240-R243 PolarHBondContact O-N 3.42Å; M240-E244 PolarHBondContact O-N 3.02Å |
| 241 | A | 97.3 | Very high | 95.9 | Very high | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61 | -43 | 179 | 0 | 0 | 0 | 0 | 0 | 112.6 | T214 T216 I218 V231 D237 V238 R243 E244 I245 | T214-A241 HydrophobicContact CG2-CB 3.97Å; T216-A241 HydrophobicContact CG2-CB 3.92Å; I218-A241 HydrophobicContact CD1-CB 4.39Å; V231-A241 HydrophobicContact CG1-CB 3.81Å; D237-A241 WeakPolarHBondContact O-CB 3.26Å; D237-A241 PolarHBondContact O-N 3.32Å; V238-A241 PolarHBondContact O-N 3.22Å; A241-R243 PolarHBondContact O-N 3.26Å; A241-E244 PolarHBondContact O-N 2.91Å; A241-I245 WeakPolarHBondContact O-CB 3.31Å; A241-I245 VanDerWaalsContact O-CG1 3.23Å; A241-I245 WeakPolarHBondContact O-CG1 2.96Å; A241-I245 PolarHBondContact O-N 2.88Å |
| 242 | K | 96.3 | Very high | 95.7 | Very high | 68 Ų | 68 | 59.2 Ų | 59.2 | 30% | 0.296 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -58.7 | -46.5 | 173.8 | 170 | 168.1 | 169.4 | 172.7 | 0 | 111.9 | E186 V188 V238 M240 E244 I245 L246 | E186-K242 HydrophobicContact CG-CD 4.24Å; E186-K242 VanDerWaalsContact OE1-CD 3.3Å; E186-K242 WeakPolarHBondContact OE1-CD 3.25Å; E186-K242 IonicContact OE1-NZ 2.71Å; E186-K242 PolarHBondContact OE1-NZ 2.91Å; E186-K242 WeakPolarHBondContact OE2-CD 3.38Å; V188-K242 HydrophobicContact CG1-CG 4.26Å; V188-K242 HydrophobicContact CG2-CB 3.8Å; V188-K242 HydrophobicContact CG2-CD 4.22Å; V188-K242 HydrophobicContact CG2-CG 3.84Å; V238-K242 WeakPolarHBondContact O-CB 3.36Å; V238-K242 PolarHBondContact O-N 3.47Å; M240-K242 PolarHBondContact O-N 2.97Å; K242-E244 PolarHBondContact O-N 3.39Å; K242-I245 PolarHBondContact O-N 3.42Å; K242-L246 HydrophobicContact CG-CD1 3.89Å; K242-L246 WeakPolarHBondContact O-CG 3.2Å; K242-L246 PolarHBondContact O-N 2.83Å |
| 243 | R | 96.3 | Very high | 95.6 | Very high | 192 Ų | 192 | 59.2 Ų | 59.2 | 73% | 0.725 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -61.7 | -43.5 | 178.5 | -170.1 | -178.8 | -66.2 | 179.5 | -1.3 | 111.7 | A239 M240 A241 S247 | A239-R243 WeakPolarHBondContact O-CB 3.42Å; A239-R243 PolarHBondContact O-N 3.48Å; A239-R243 VanDerWaalsContact O-N 3.1Å; M240-R243 PolarHBondContact O-N 3.42Å; A241-R243 PolarHBondContact O-N 3.26Å; R243-S247 VanDerWaalsContact O-CB 3.24Å; R243-S247 WeakPolarHBondContact O-CB 3.26Å; R243-S247 PolarHBondContact O-N 2.95Å |
| 244 | E | 96.4 | Very high | 95.3 | Very high | 58 Ų | 58 | 64.5 Ų | 64.5 | 27% | 0.271 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -69.4 | -37.4 | 178 | -64.7 | -145.2 | 106.8 | 0 | 0 | 113.2 | L210 K213 M240 A241 K242 A248 | L210-E244 HydrophobicContact CD1-CB 3.88Å; L210-E244 WeakPolarHBondContact CD1-OE2 3.24Å; K213-E244 WeakPolarHBondContact CD-OE2 3.38Å; K213-E244 VanDerWaalsContact CE-OE2 3.3Å; K213-E244 WeakPolarHBondContact CE-OE2 3.33Å; K213-E244 IonicContact NZ-OE1 2.62Å; K213-E244 PolarHBondContact NZ-OE1 3.47Å; K213-E244 IonicContact NZ-OE2 2.97Å; K213-E244 PolarHBondContact NZ-OE2 2.83Å; M240-E244 PolarHBondContact O-N 3.02Å; A241-E244 PolarHBondContact O-N 2.91Å; K242-E244 PolarHBondContact O-N 3.39Å; E244-A248 WeakPolarHBondContact O-CB 3.42Å; E244-A248 PolarHBondContact O-N 3.48Å |
| 245 | I | 97 | Very high | 95.1 | Very high | 0 Ų | 0 | 63.2 Ų | 63.2 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.1 | -45.5 | 175.8 | -69.4 | 166.3 | 0 | 0 | 0 | 110.8 | V188 V190 I199 L210 I218 F229 V231 A241 K242 A249 | V188-I245 HydrophobicContact CB-CG2 4.29Å; V188-I245 HydrophobicContact CG1-CB 4.04Å; V188-I245 HydrophobicContact CG1-CG2 3.61Å; V190-I245 HydrophobicContact CG2-CG2 3.72Å; I199-I245 HydrophobicContact CD1-CG2 4.42Å; L210-I245 HydrophobicContact CD2-CD1 4.46Å; L210-I245 HydrophobicContact CD2-CG1 3.73Å; I218-I245 HydrophobicContact CD1-CD1 4.37Å; I218-I245 HydrophobicContact CG2-CD1 4.19Å; F229-I245 HydrophobicContact CB-CD1 4.18Å; F229-I245 HydrophobicContact CD2-CG2 3.73Å; F229-I245 HydrophobicContact CE2-CG2 4.09Å; F229-I245 HydrophobicContact CG-CD1 4.32Å; V231-I245 HydrophobicContact CG2-CD1 3.9Å; A241-I245 WeakPolarHBondContact O-CB 3.31Å; A241-I245 VanDerWaalsContact O-CG1 3.23Å; A241-I245 WeakPolarHBondContact O-CG1 2.96Å; A241-I245 PolarHBondContact O-N 2.88Å; K242-I245 PolarHBondContact O-N 3.42Å; I245-A249 WeakPolarHBondContact O-CB 3.45Å; I245-A249 PolarHBondContact O-N 3.36Å |
| 246 | L | 96.3 | Very high | 94.7 | Very high | 60 Ų | 60 | 62.1 Ų | 62.1 | 31% | 0.314 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -67.3 | -48.8 | 179 | -69.1 | 171.3 | 0 | 0 | 0 | 111.6 | V188 A189 K242 A248 A249 E250 | V188-L246 HydrophobicContact CG1-CD1 4.43Å; V188-L246 HydrophobicContact CG1-CD2 3.86Å; V188-L246 HydrophobicContact CG1-CG 3.8Å; A189-L246 WeakPolarHBondContact O-CD2 3.39Å; K242-L246 HydrophobicContact CG-CD1 3.89Å; K242-L246 WeakPolarHBondContact O-CG 3.2Å; K242-L246 PolarHBondContact O-N 2.83Å; L246-A248 VanDerWaalsContact C-N 3.28Å; L246-A248 PolarHBondContact O-N 3.48Å; L246-A249 WeakPolarHBondContact O-CA 3.41Å; L246-A249 WeakPolarHBondContact O-CB 3.44Å; L246-A249 PolarHBondContact O-N 3.3Å; L246-E250 WeakPolarHBondContact O-CG 3.45Å; L246-E250 PolarHBondContact O-N 2.9Å |
| 247 | S | 96.6 | Very high | 94.1 | Very high | 67 Ų | 67 | 60 Ų | 60 | 47% | 0.469 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -60.5 | -37.4 | 177.6 | -177.7 | 0 | 0 | 0 | 0 | 112.2 | R243 H251 | R243-S247 VanDerWaalsContact O-CB 3.24Å; R243-S247 WeakPolarHBondContact O-CB 3.26Å; R243-S247 PolarHBondContact O-N 2.95Å; S247-H251 WeakPolarHBondContact O-CB 3.44Å; S247-H251 PolarHBondContact O-N 3.41Å |
| 248 | A | 95.8 | Very high | 93.3 | Very high | 27 Ų | 27 | 63 Ų | 63 | 22% | 0.223 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -66.1 | -40.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | I199 E244 L246 H251 F252 | I199-A248 HydrophobicContact CG1-CB 4.02Å; E244-A248 WeakPolarHBondContact O-CB 3.42Å; E244-A248 PolarHBondContact O-N 3.48Å; L246-A248 VanDerWaalsContact C-N 3.28Å; L246-A248 PolarHBondContact O-N 3.48Å; A248-H251 PolarHBondContact O-N 2.99Å; A248-F252 HydrophobicContact CB-CE2 4.04Å; A248-F252 WeakPolarHBondContact O-CD2 3.34Å; A248-F252 VanDerWaalsContact O-CG 3.3Å; A248-F252 WeakPolarHBondContact O-CG 3.39Å; A248-F252 PolarHBondContact O-N 2.7Å |
| 249 | A | 95.8 | Very high | 92.1 | Very high | 3 Ų | 3 | 71.2 Ų | 71.2 | 3% | 0.025 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -62.9 | -43.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | V190 I199 I245 L246 S253 | V190-A249 HydrophobicContact CG1-CB 4.01Å; V190-A249 HydrophobicContact CG2-CB 4.37Å; I199-A249 HydrophobicContact CD1-CB 4.02Å; I245-A249 WeakPolarHBondContact O-CB 3.45Å; I245-A249 PolarHBondContact O-N 3.36Å; L246-A249 WeakPolarHBondContact O-CA 3.41Å; L246-A249 WeakPolarHBondContact O-CB 3.44Å; L246-A249 PolarHBondContact O-N 3.3Å; A249-S253 WeakPolarHBondContact O-CB 3.38Å; A249-S253 PolarHBondContact O-N 3.26Å; A249-S253 PolarHBondContact O-OG 2.92Å |
| 250 | E | 95.5 | Very high | 90.4 | Very high | 121 Ų | 121 | 75.4 Ų | 75.4 | 57% | 0.565 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -63.2 | -47.4 | 174.8 | -70.3 | 167.6 | -178.7 | 0 | 0 | 111.6 | L246 F252 S253 L254 | L246-E250 WeakPolarHBondContact O-CG 3.45Å; L246-E250 PolarHBondContact O-N 2.9Å; E250-F252 PolarHBondContact O-N 2.73Å; E250-S253 WeakPolarHBondContact O-CA 3.49Å; E250-S253 WeakPolarHBondContact O-CB 3.48Å; E250-S253 PolarHBondContact O-N 3.41Å; E250-S253 VanDerWaalsContact O-N 3.12Å; E250-L254 WeakPolarHBondContact O-CG 3.28Å; E250-L254 PolarHBondContact O-N 3.02Å |
| 251 | H | 94.1 | Very high | 88.3 | Confident | 103 Ų | 103 | 80.2 Ų | 80.2 | 48% | 0.477 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -59.9 | -43.2 | 177.6 | 175.4 | -98.3 | 0 | 0 | 0 | 112.5 | S247 A248 L254 I255 | S247-H251 WeakPolarHBondContact O-CB 3.44Å; S247-H251 PolarHBondContact O-N 3.41Å; A248-H251 PolarHBondContact O-N 2.99Å; H251-L254 PolarHBondContact O-N 3.02Å; H251-I255 WeakPolarHBondContact CE1-CD1 3.49Å; H251-I255 WeakPolarHBondContact O-CG1 3.23Å; H251-I255 PolarHBondContact O-N 2.92Å |
| 252 | F | 94.1 | Very high | 86 | Confident | 31 Ų | 31 | 85.7 Ų | 85.7 | 14% | 0.136 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -68.6 | -36.5 | 173.8 | -63.1 | -43.1 | 0 | 0 | 0 | 112.1 | E198 I199 K206 A248 E250 L254 I255 R256 | E198-F252 HydrophobicContact CB-CD2 3.84Å; E198-F252 HydrophobicContact CB-CE2 4.09Å; E198-F252 HydrophobicContact CB-CG 4.14Å; I199-F252 HydrophobicContact CG1-CD2 3.98Å; I199-F252 HydrophobicContact CG1-CE2 3.82Å; K206-F252 VanDerWaalsContact NZ-CZ 3.32Å; A248-F252 HydrophobicContact CB-CE2 4.04Å; A248-F252 WeakPolarHBondContact O-CD2 3.34Å; A248-F252 VanDerWaalsContact O-CG 3.3Å; A248-F252 WeakPolarHBondContact O-CG 3.39Å; A248-F252 PolarHBondContact O-N 2.7Å; E250-F252 PolarHBondContact O-N 2.73Å; F252-L254 VanDerWaalsContact C-N 3.32Å; F252-L254 PolarHBondContact O-N 3.39Å; F252-I255 PolarHBondContact O-N 3.37Å; F252-R256 WeakPolarHBondContact O-CB 3.44Å; F252-R256 WeakPolarHBondContact O-CD 3.24Å; F252-R256 VanDerWaalsContact O-CG 3.24Å; F252-R256 WeakPolarHBondContact O-CG 3.11Å; F252-R256 PolarHBondContact O-N 3.1Å |
| 253 | S | 93.6 | Very high | 83.2 | Confident | 37 Ų | 37 | 84.2 Ų | 84.2 | 26% | 0.259 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -59.6 | -41.4 | 173.1 | -58.9 | 0 | 0 | 0 | 0 | 111.9 | H195 A249 E250 R256 A257 | H195-S253 PolarHBondContact CE1-OG 2.92Å; H195-S253 PolarHBondContact NE2-OG 3.12Å; A249-S253 WeakPolarHBondContact O-CB 3.38Å; A249-S253 PolarHBondContact O-N 3.26Å; A249-S253 PolarHBondContact O-OG 2.92Å; E250-S253 WeakPolarHBondContact O-CA 3.49Å; E250-S253 WeakPolarHBondContact O-CB 3.48Å; E250-S253 PolarHBondContact O-N 3.41Å; E250-S253 VanDerWaalsContact O-N 3.12Å; S253-R256 PolarHBondContact O-N 2.94Å; S253-A257 WeakPolarHBondContact O-CB 3.46Å; S253-A257 PolarHBondContact O-N 3.46Å |
| 254 | L | 90.8 | Very high | 81 | Confident | 121 Ų | 121 | 80.7 Ų | 80.7 | 63% | 0.634 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -68.1 | -42.4 | 177.5 | -72.9 | 162.6 | 0 | 0 | 0 | 112.7 | E250 H251 F252 R256 A257 S258 | E250-L254 WeakPolarHBondContact O-CG 3.28Å; E250-L254 PolarHBondContact O-N 3.02Å; H251-L254 PolarHBondContact O-N 3.02Å; F252-L254 VanDerWaalsContact C-N 3.32Å; F252-L254 PolarHBondContact O-N 3.39Å; L254-R256 VanDerWaalsContact C-N 3.28Å; L254-R256 PolarHBondContact O-N 3.05Å; L254-A257 PolarHBondContact O-N 2.92Å; L254-S258 WeakPolarHBondContact O-CB 3.49Å; L254-S258 PolarHBondContact O-N 3.35Å; L254-S258 PolarHBondContact O-OG 2.94Å |
| 255 | I | 88.8 | Confident | 78.3 | Confident | 83 Ų | 83 | 86.2 Ų | 86.2 | 43% | 0.426 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.3 | -38.4 | 173.4 | -72.2 | 172.9 | 0 | 0 | 0 | 110.8 | H251 F252 S258 R259 | H251-I255 WeakPolarHBondContact CE1-CD1 3.49Å; H251-I255 WeakPolarHBondContact O-CG1 3.23Å; H251-I255 PolarHBondContact O-N 2.92Å; F252-I255 PolarHBondContact O-N 3.37Å; I255-S258 WeakPolarHBondContact CA-OG 3.16Å; I255-S258 PolarHBondContact O-OG 3.49Å; I255-S258 VanDerWaalsContact O-OG 3.11Å; I255-R259 WeakPolarHBondContact O-CB 3.35Å; I255-R259 PolarHBondContact O-N 3.06Å |
| 256 | R | 85.9 | Confident | 75.6 | Confident | 68 Ų | 68 | 92.3 Ų | 92.3 | 26% | 0.257 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.6 | -52 | 176.3 | -75.1 | 161.1 | 166.6 | -80.5 | -14.5 | 111.2 | E194 H195 E198 F252 S253 L254 S258 R259 N260 | E194-R256 VanDerWaalsContact CD-CZ 3.46Å; E194-R256 IonicContact OE1-CZ 3.54Å; E194-R256 IonicContact OE1-NH1 3.67Å; E194-R256 PolarHBondContact OE1-NH1 2.84Å; E194-R256 VanDerWaalsContact OE1-NH1 3.1Å; E194-R256 IonicContact OE1-NH2 3.49Å; E194-R256 PolarHBondContact OE1-NH2 3.32Å; E194-R256 IonicContact OE2-CZ 3.38Å; E194-R256 IonicContact OE2-NH1 2.76Å; E194-R256 PolarHBondContact OE2-NH1 2.61Å; E194-R256 IonicContact OE2-NH2 3.55Å; H195-R256 VanDerWaalsContact NE2-CD 3.31Å; H195-R256 WeakPolarHBondContact NE2-CD 3.47Å; E198-R256 IonicContact OE1-CZ 3.51Å; E198-R256 IonicContact OE1-NE 2.83Å; E198-R256 PolarHBondContact OE1-NE 3.32Å; E198-R256 IonicContact OE1-NH2 2.61Å; E198-R256 PolarHBondContact OE1-NH2 3.22Å; E198-R256 IonicContact OE2-CZ 3.1Å; E198-R256 IonicContact OE2-NE 3.34Å; E198-R256 PolarHBondContact OE2-NE 2.99Å; E198-R256 IonicContact OE2-NH2 2.75Å; E198-R256 PolarHBondContact OE2-NH2 3.1Å; F252-R256 WeakPolarHBondContact O-CB 3.44Å; F252-R256 WeakPolarHBondContact O-CD 3.24Å; F252-R256 VanDerWaalsContact O-CG 3.24Å; F252-R256 WeakPolarHBondContact O-CG 3.11Å; F252-R256 PolarHBondContact O-N 3.1Å; S253-R256 PolarHBondContact O-N 2.94Å; L254-R256 VanDerWaalsContact C-N 3.28Å; L254-R256 PolarHBondContact O-N 3.05Å; R256-S258 PolarHBondContact O-N 3.5Å; R256-R259 PolarHBondContact O-N 2.76Å; R256-N260 WeakPolarHBondContact O-CB 3.3Å; R256-N260 PolarHBondContact O-N 3.46Å |
| 257 | A | 81.4 | Confident | 73 | Confident | 67 Ų | 67 | 94.1 Ų | 94.1 | 55% | 0.554 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -57.6 | -43.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113 | S253 L254 N260 K261 | S253-A257 WeakPolarHBondContact O-CB 3.46Å; S253-A257 PolarHBondContact O-N 3.46Å; L254-A257 PolarHBondContact O-N 2.92Å; A257-N260 PolarHBondContact O-N 2.89Å; A257-K261 PolarHBondContact O-N 3.22Å |
| 258 | S | 79 | Confident | 70.1 | Confident | 73 Ų | 73 | 97.6 Ų | 97.6 | 51% | 0.51 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -68.3 | -42.7 | 178 | 51.9 | 0 | 0 | 0 | 0 | 112.7 | L254 I255 R256 N260 K261 T262 | L254-S258 WeakPolarHBondContact O-CB 3.49Å; L254-S258 PolarHBondContact O-N 3.35Å; L254-S258 PolarHBondContact O-OG 2.94Å; I255-S258 WeakPolarHBondContact CA-OG 3.16Å; I255-S258 PolarHBondContact O-OG 3.49Å; I255-S258 VanDerWaalsContact O-OG 3.11Å; R256-S258 PolarHBondContact O-N 3.5Å; S258-N260 PolarHBondContact O-N 3.32Å; S258-K261 PolarHBondContact O-N 3.48Å; S258-T262 PolarHBondContact O-OG1 2.97Å |
| 259 | R | 72 | Confident | 67.1 | Low | 176 Ų | 176 | 102.6 Ų | 102.6 | 66% | 0.664 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -69.2 | -31.5 | 175.7 | -150.7 | -179.9 | 84.8 | -168.2 | 3.6 | 112.8 | I255 R256 K261 T262 G263 | I255-R259 WeakPolarHBondContact O-CB 3.35Å; I255-R259 PolarHBondContact O-N 3.06Å; R256-R259 PolarHBondContact O-N 2.76Å; R259-K261 PolarHBondContact O-N 3.44Å; R259-T262 WeakPolarHBondContact CA-OG1 3.33Å; R259-T262 CarbonylContact O-C 3.46Å; R259-T262 WeakPolarHBondContact O-CA 3.32Å; R259-T262 PolarHBondContact O-N 2.7Å; R259-T262 PolarHBondContact O-OG1 3.28Å; R259-G263 PolarHBondContact O-N 2.72Å |
| 260 | N | 59.9 | Low | 64.1 | Low | 139 Ų | 139 | 105.6 Ų | 105.6 | 74% | 0.743 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -68.8 | -16.8 | 177 | -130.2 | 98.7 | 0 | 0 | 0 | 113.5 | R256 A257 S258 T262 | R256-N260 WeakPolarHBondContact O-CB 3.3Å; R256-N260 PolarHBondContact O-N 3.46Å; A257-N260 PolarHBondContact O-N 2.89Å; S258-N260 PolarHBondContact O-N 3.32Å; N260-T262 VanDerWaalsContact C-N 3.31Å |
| 261 | K | 51.8 | Low | 61.6 | Low | 190 Ų | 190 | 108.7 Ų | 108.7 | 83% | 0.826 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | -2.2 | 168.3 | -161.9 | 165.3 | -177.5 | 176.7 | 0 | 113 | A257 S258 R259 | A257-K261 PolarHBondContact O-N 3.22Å; S258-K261 PolarHBondContact O-N 3.48Å; R259-K261 PolarHBondContact O-N 3.44Å |
| 262 | T | 48.7 | Very low | 58.9 | Low | 115 Ų | 115 | 107.3 Ų | 107.3 | 71% | 0.706 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -129.9 | 34.1 | -179.4 | 43.4 | 0 | 0 | 0 | 0 | 113 | S258 R259 N260 | S258-T262 PolarHBondContact O-OG1 2.97Å; R259-T262 WeakPolarHBondContact CA-OG1 3.33Å; R259-T262 CarbonylContact O-C 3.46Å; R259-T262 WeakPolarHBondContact O-CA 3.32Å; R259-T262 PolarHBondContact O-N 2.7Å; R259-T262 PolarHBondContact O-OG1 3.28Å; N260-T262 VanDerWaalsContact C-N 3.31Å |
| 263 | G | 37.5 | Very low | 56.2 | Low | 38 Ų | 38 | 110.6 Ų | 110.6 | 39% | 0.392 | 68% | 0.678 | S | S | . | * | trans | 91 | 171.7 | 167 | 0 | 0 | 0 | 0 | 0 | 116.1 | R259 | R259-G263 PolarHBondContact O-N 2.72Š| ||
| 264 | P | 48.9 | Very low | 53.9 | Low | 118 Ų | 118 | 113.9 Ų | 113.9 | 77% | 0.766 | 70% | 0.699 | S | S | * | * | cis | -116.7 | 145.5 | 9.7 | 37.9 | -26.2 | 0 | 0 | 0 | 114.4 | ||||
| 265 | L | 40.7 | Very low | 52 | Low | 174 Ų | 174 | 112.5 Ų | 112.5 | 91% | 0.911 | 71% | 0.705 | S | S | * | * | trans | -139.8 | 112.1 | 164.9 | -76 | 178.3 | 0 | 0 | 0 | 111.3 | ||||
| 266 | S | 40.7 | Very low | 50.4 | Low | 128 Ų | 128 | 114.2 Ų | 114.2 | 90% | 0.895 | 71% | 0.714 | S | S | * | * | trans | -145.7 | 89.2 | 162.3 | -88.5 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 267 | A | 40.6 | Very low | 48.9 | Very low | 98 Ų | 98 | 117.3 Ų | 117.3 | 81% | 0.81 | 74% | 0.743 | S | S | * | * | trans | 175.6 | 79.2 | 155.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 268 | V | 36 | Very low | 48.3 | Very low | 139 Ų | 139 | 116.3 Ų | 116.3 | 84% | 0.842 | 74% | 0.74 | S | S | * | * | trans | -177.7 | 130.4 | 131.5 | 139.6 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 269 | T | 33.6 | Very low | 48.4 | Very low | 132 Ų | 132 | 117.9 Ų | 117.9 | 81% | 0.81 | 74% | 0.739 | S | S | * | * | trans | 21.8 | 110.3 | 152.6 | -42.1 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 270 | G | 33.4 | Very low | 49.1 | Very low | 67 Ų | 67 | 111.9 Ų | 111.9 | 69% | 0.691 | 72% | 0.722 | S | S | * | * | 91.4 | 117.7 | 116 | 0 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 271 | L | 42.3 | Very low | 50.5 | Low | 186 Ų | 186 | 109.1 Ų | 109.1 | 97% | 0.974 | 71% | 0.71 | S | S | * | * | trans | 56.9 | 122.8 | 152.8 | -66 | 171.5 | 0 | 0 | 0 | 119.8 | ||||
| 272 | G | 37.2 | Very low | 52.4 | Low | 73 Ų | 73 | 102.3 Ų | 102.3 | 75% | 0.753 | 68% | 0.683 | S | S | * | * | trans | 92.5 | 104.2 | 164.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | P274 | G272-P274 VanDerWaalsContact O-CD 3.26Å; G272-P274 WeakPolarHBondContact O-CD 3.44Å | ||
| 273 | A | 38 | Very low | 54.4 | Low | 100 Ų | 100 | 103.1 Ų | 103.1 | 83% | 0.826 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 116.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 274 | P | 44.1 | Very low | 57.1 | Low | 106 Ų | 106 | 101.4 Ų | 101.4 | 69% | 0.688 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 119.8 | 162.5 | 32.4 | -29.6 | 0 | 0 | 0 | 108.5 | G272 L276 | G272-P274 VanDerWaalsContact O-CD 3.26Å; G272-P274 WeakPolarHBondContact O-CD 3.44Å; P274-L276 PolarHBondContact O-N 2.94Å; P274-L276 VanDerWaalsContact O-N 3.14Å |
| 275 | A | 51.8 | Low | 59.1 | Low | 92 Ų | 92 | 104.3 Ų | 104.3 | 76% | 0.76 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 117.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||
| 276 | L | 54.4 | Low | 61.4 | Low | 119 Ų | 119 | 96.5 Ų | 96.5 | 62% | 0.623 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 134.2 | 175.9 | -67.7 | 175.6 | 0 | 0 | 0 | 109.4 | P274 G278 Q279 | P274-L276 PolarHBondContact O-N 2.94Å; P274-L276 VanDerWaalsContact O-N 3.14Å; L276-G278 PolarHBondContact O-N 3.44Å; L276-Q279 PolarHBondContact O-N 2.96Å |
| 277 | P | 55.4 | Low | 63.8 | Low | 133 Ų | 133 | 94.2 Ų | 94.2 | 86% | 0.864 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | 112.3 | -179 | 24.3 | -33.3 | 0 | 0 | 0 | 110.5 | ||
| 278 | G | 69.2 | Low | 66.1 | Low | 47 Ų | 47 | 96.4 Ų | 96.4 | 49% | 0.485 | 59% | 0.586 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 108.7 | -0.4 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | L276 | L276-G278 PolarHBondContact O-N 3.44Š|
| 279 | Q | 79.8 | Confident | 68.6 | Low | 106 Ų | 106 | 101.1 Ų | 101.1 | 50% | 0.495 | 59% | 0.589 | S | S | . | * | trans | -125.5 | 132.2 | 167 | -73.4 | -174.5 | -14.2 | 0 | 0 | 111.5 | L276 G328 | L276-Q279 PolarHBondContact O-N 2.96Å; Q279-G328 CarbonylContact C-O 3.14Å; Q279-G328 VanDerWaalsContact CA-O 3.31Å; Q279-G328 WeakPolarHBondContact CA-O 3.28Å | ||
| 280 | T | 86.6 | Confident | 71.2 | Confident | 49 Ų | 49 | 95.1 Ų | 95.1 | 30% | 0.301 | 55% | 0.551 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -105.5 | 156.3 | 172.3 | -166.7 | 0 | 0 | 0 | 0 | 110.6 | I282 T327 G328 P330 V333 | T280-I282 HydrophobicContact CG2-CG1 4.49Å; T280-T327 WeakPolarHBondContact O-CA 3.47Å; T280-G328 PolarHBondContact N-O 3.03Å; T280-G328 PolarHBondContact O-N 3.15Å; T280-G328 VanDerWaalsContact O-N 3.12Å; T280-P330 HydrophobicContact CG2-CB 4.1Å; T280-V333 HydrophobicContact CG2-CB 3.92Å; T280-V333 HydrophobicContact CG2-CG1 4.19Å; T280-V333 HydrophobicContact CG2-CG2 3.83Å |
| 281 | T | 89.8 | Confident | 73.9 | Confident | 81 Ų | 81 | 93 Ų | 93 | 50% | 0.497 | 53% | 0.525 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.2 | 118.3 | 173.8 | 48.6 | 0 | 0 | 0 | 0 | 109.5 | V326 T327 | T281-V326 WeakPolarHBondContact CA-O 3.39Å; T281-T327 HydrophobicContact CG2-CG2 3.79Å |
| 282 | I | 91.6 | Very high | 76.2 | Confident | 48 Ų | 48 | 86.7 Ų | 86.7 | 25% | 0.246 | 51% | 0.505 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.1 | 139.9 | 178.4 | -62.8 | -172.5 | 0 | 0 | 0 | 109.9 | T280 V284 V326 V333 | T280-I282 HydrophobicContact CG2-CG1 4.49Å; I282-V284 HydrophobicContact CG2-CG2 4.4Å; I282-V326 PolarHBondContact N-O 3.28Å; I282-V326 PolarHBondContact O-N 3.44Å; I282-V333 HydrophobicContact CB-CG1 3.58Å; I282-V333 HydrophobicContact CD1-CG1 3.75Å; I282-V333 HydrophobicContact CG1-CG1 3.64Å |
| 283 | Q | 91.8 | Very high | 78.7 | Confident | 132 Ų | 132 | 87.2 Ų | 87.2 | 62% | 0.617 | 49% | 0.49 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -98.6 | 108 | 178.3 | -73.9 | -175.1 | 19.3 | 0 | 0 | 110.3 | V323 F324 | Q283-V323 HydrophobicContact CB-CG1 3.62Å; Q283-V323 HydrophobicContact CG-CG1 4.05Å; Q283-F324 CarbonylContact C-O 3.53Å; Q283-F324 WeakPolarHBondContact CA-O 3.43Å |
| 284 | V | 92.4 | Very high | 81.3 | Confident | 1 Ų | 1 | 82.5 Ų | 82.5 | 1% | 0.006 | 45% | 0.451 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.1 | 107.5 | 180 | -175.5 | 0 | 0 | 0 | 0 | 109.1 | I282 V286 F324 V326 R337 I340 | I282-V284 HydrophobicContact CG2-CG2 4.4Å; V284-V286 HydrophobicContact CG1-CG1 4.32Å; V284-F324 HydrophobicContact CB-CB 4.4Å; V284-F324 PolarHBondContact N-O 2.99Å; V284-F324 PolarHBondContact O-N 3Å; V284-V326 HydrophobicContact CB-CG2 4.48Å; V284-V326 HydrophobicContact CG2-CG2 3.77Å; V284-R337 HydrophobicContact CG1-CG 4.32Å; V284-R337 HydrophobicContact CG2-CB 3.84Å; V284-R337 HydrophobicContact CG2-CG 3.78Å; V284-I340 HydrophobicContact CB-CD1 4.42Å; V284-I340 HydrophobicContact CG1-CB 4.43Å; V284-I340 HydrophobicContact CG1-CD1 4.3Å; V284-I340 HydrophobicContact CG1-CG2 4.02Å; V284-I340 HydrophobicContact CG2-CD1 4.45Å |
| 285 | R | 91.1 | Very high | 83.6 | Confident | 179 Ų | 179 | 78.8 Ų | 78.8 | 68% | 0.675 | 43% | 0.426 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -83.7 | 132 | 179.1 | -69.4 | -177.3 | 154.6 | 168.3 | -8.9 | 110.6 | E321 V323 | R285-E321 IonicContact NH2-OE2 3.54Å; R285-V323 HydrophobicContact CG-CG1 4.18Å; R285-V323 HydrophobicContact CG-CG2 4.08Å |
| 286 | V | 90.8 | Very high | 85.5 | Confident | 10 Ų | 10 | 75.1 Ų | 75.1 | 6% | 0.061 | 40% | 0.397 | C | S | . | . | trans | -133.7 | 156.2 | 178.1 | -48.5 | 0 | 0 | 0 | 0 | 111.7 | V284 V290 V291 P322 F324 I340 I344 | V284-V286 HydrophobicContact CG1-CG1 4.32Å; V286-V290 HydrophobicContact CB-CG2 4.14Å; V286-V290 HydrophobicContact CG2-CG2 4.29Å; V286-V291 HydrophobicContact CG2-CB 4.49Å; V286-V291 HydrophobicContact CG2-CG2 3.51Å; V286-P322 HydrophobicContact CG2-CB 4.47Å; V286-P322 PolarHBondContact N-O 2.86Å; V286-P322 WeakPolarHBondContact O-CB 3.35Å; V286-P322 WeakPolarHBondContact O-CG 3.39Å; V286-F324 HydrophobicContact CG1-CD2 3.95Å; V286-F324 HydrophobicContact CG1-CE2 4.04Å; V286-F324 HydrophobicContact CG2-CD2 4.15Å; V286-F324 HydrophobicContact CG2-CE2 3.68Å; V286-I340 HydrophobicContact CG1-CG2 3.96Å; V286-I344 HydrophobicContact CB-CD1 3.75Å; V286-I344 HydrophobicContact CG1-CD1 3.49Å; V286-I344 VanDerWaalsContact CG1-CD1 3.49Å | ||
| 287 | P | 91.1 | Very high | 87.3 | Confident | 81 Ų | 81 | 74.5 Ų | 74.5 | 53% | 0.526 | 40% | 0.401 | S | S | . | . | trans | -62.3 | 137.7 | 171.9 | -24 | 33.5 | 0 | 0 | 0 | 113 | R289 V290 V291 | P287-R289 PolarHBondContact O-N 3.16Å; P287-V290 HydrophobicContact CB-CG2 4.17Å; P287-V290 HydrophobicContact CG-CG2 4.3Å; P287-V290 VanDerWaalsContact O-CG2 3.23Å; P287-V290 WeakPolarHBondContact O-CG2 3.31Å; P287-V290 PolarHBondContact O-N 3.02Å; P287-V291 PolarHBondContact O-N 3.14Å | ||
| 288 | Y | 88.5 | Confident | 88.9 | Confident | 143 Ų | 143 | 77.9 Ų | 77.9 | 56% | 0.561 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -48.8 | -37.1 | 178.1 | -79.9 | -78.6 | 0 | 0 | 0 | 114.1 | V290 K320 P322 | Y288-V290 PolarHBondContact O-N 2.94Å; Y288-K320 WeakPolarHBondContact CE1-O 3.31Å; Y288-K320 PolarHBondContact OH-O 3.31Å; Y288-P322 HydrophobicContact CD1-CB 3.95Å; Y288-P322 HydrophobicContact CD1-CG 4.27Å; Y288-P322 HydrophobicContact CD2-CB 4.47Å; Y288-P322 HydrophobicContact CD2-CG 3.96Å; Y288-P322 HydrophobicContact CE1-CB 4.11Å; Y288-P322 HydrophobicContact CE1-CG 4.24Å; Y288-P322 HydrophobicContact CE2-CG 3.92Å; Y288-P322 HydrophobicContact CG-CB 4.15Å; Y288-P322 HydrophobicContact CG-CG 4.15Å |
| 289 | R | 87.9 | Confident | 90 | Very high | 239 Ų | 239 | 76.1 Ų | 76.1 | 90% | 0.902 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -62 | -28 | 179.9 | -62.8 | -173.9 | -176.1 | -173.8 | 3.3 | 113.2 | P287 | P287-R289 PolarHBondContact O-N 3.16Å |
| 290 | V | 89.1 | Confident | 90.7 | Very high | 5 Ų | 5 | 73.3 Ų | 73.3 | 3% | 0.03 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -103.4 | -10.4 | -175 | -53.7 | 0 | 0 | 0 | 0 | 114 | V286 P287 Y288 G292 L293 V294 I344 T348 | V286-V290 HydrophobicContact CB-CG2 4.14Å; V286-V290 HydrophobicContact CG2-CG2 4.29Å; P287-V290 HydrophobicContact CB-CG2 4.17Å; P287-V290 HydrophobicContact CG-CG2 4.3Å; P287-V290 VanDerWaalsContact O-CG2 3.23Å; P287-V290 WeakPolarHBondContact O-CG2 3.31Å; P287-V290 PolarHBondContact O-N 3.02Å; Y288-V290 PolarHBondContact O-N 2.94Å; V290-G292 PolarHBondContact O-N 3.02Å; V290-L293 HydrophobicContact CB-CD1 4.33Å; V290-L293 HydrophobicContact CG1-CD1 4.23Å; V290-L293 WeakPolarHBondContact O-CA 3.49Å; V290-L293 WeakPolarHBondContact O-CB 3.41Å; V290-L293 PolarHBondContact O-N 3.44Å; V290-V294 PolarHBondContact O-N 3.12Å; V290-I344 HydrophobicContact CB-CG1 4.28Å; V290-I344 HydrophobicContact CB-CG2 4.37Å; V290-I344 HydrophobicContact CG1-CG2 4.29Å; V290-I344 HydrophobicContact CG2-CD1 3.81Å; V290-I344 HydrophobicContact CG2-CG1 3.78Å; V290-I344 HydrophobicContact CG2-CG2 3.96Å; V290-T348 HydrophobicContact CG1-CG2 3.82Å; V290-T348 WeakPolarHBondContact CG1-OG1 3.16Å |
| 291 | V | 89.8 | Confident | 91 | Very high | 24 Ų | 24 | 71.4 Ų | 71.4 | 15% | 0.145 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -50.4 | -45.7 | 174 | 178.2 | 0 | 0 | 0 | 0 | 110.9 | V286 P287 L293 V294 V295 P322 F324 | V286-V291 HydrophobicContact CG2-CB 4.49Å; V286-V291 HydrophobicContact CG2-CG2 3.51Å; P287-V291 PolarHBondContact O-N 3.14Å; V291-L293 VanDerWaalsContact C-N 3.3Å; V291-L293 PolarHBondContact O-N 3.25Å; V291-V294 PolarHBondContact O-N 3.31Å; V291-V295 HydrophobicContact CG1-CG2 4.41Å; V291-V295 WeakPolarHBondContact O-CB 3.43Å; V291-V295 VanDerWaalsContact O-CG2 3.29Å; V291-V295 WeakPolarHBondContact O-CG2 3.48Å; V291-V295 PolarHBondContact O-N 3.45Å; V291-P322 HydrophobicContact CG2-CB 3.69Å; V291-F324 HydrophobicContact CG1-CZ 4.11Å |
| 292 | G | 90.2 | Very high | 91.2 | Very high | 53 Ų | 53 | 67.8 Ų | 67.8 | 55% | 0.546 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -64.9 | -28.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | V290 G296 | V290-G292 PolarHBondContact O-N 3.02Å; G292-G296 PolarHBondContact O-N 3.15Å |
| 293 | L | 90.4 | Very high | 91.4 | Very high | 84 Ų | 84 | 71.9 Ų | 71.9 | 44% | 0.44 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -76 | -43.9 | 176.6 | -57.3 | 177.2 | 0 | 0 | 0 | 111 | V290 V291 G296 | V290-L293 HydrophobicContact CB-CD1 4.33Å; V290-L293 HydrophobicContact CG1-CD1 4.23Å; V290-L293 WeakPolarHBondContact O-CA 3.49Å; V290-L293 WeakPolarHBondContact O-CB 3.41Å; V290-L293 PolarHBondContact O-N 3.44Å; V291-L293 VanDerWaalsContact C-N 3.3Å; V291-L293 PolarHBondContact O-N 3.25Å; L293-G296 PolarHBondContact O-N 3.18Å |
| 294 | V | 92 | Very high | 91.5 | Very high | 0 Ų | 0 | 71.1 Ų | 71.1 | 0% | 0 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -64 | -40.7 | 176.4 | 174.6 | 0 | 0 | 0 | 0 | 111.3 | V290 V291 T301 I302 F324 I340 I344 | V290-V294 PolarHBondContact O-N 3.12Å; V291-V294 PolarHBondContact O-N 3.31Å; V294-T301 WeakPolarHBondContact O-CB 3.26Å; V294-T301 WeakPolarHBondContact O-CG2 3.36Å; V294-I302 HydrophobicContact CG1-CD1 3.99Å; V294-I302 PolarHBondContact O-N 2.93Å; V294-I302 VanDerWaalsContact O-N 3.16Å; V294-F324 HydrophobicContact CB-CE2 4.06Å; V294-F324 HydrophobicContact CB-CZ 3.94Å; V294-F324 HydrophobicContact CG1-CD2 4.47Å; V294-F324 HydrophobicContact CG1-CE1 4.32Å; V294-F324 HydrophobicContact CG1-CE2 3.62Å; V294-F324 HydrophobicContact CG1-CZ 3.54Å; V294-I340 HydrophobicContact CG1-CG1 4.34Å; V294-I340 HydrophobicContact CG1-CG2 4.05Å; V294-I340 HydrophobicContact CG2-CG2 4.29Å; V294-I344 HydrophobicContact CG2-CD1 3.9Å; V294-I344 HydrophobicContact CG2-CG1 3.55Å |
| 295 | V | 93.1 | Very high | 91.6 | Very high | 29 Ų | 29 | 71 Ų | 71 | 18% | 0.176 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -66.7 | -50.2 | 172 | 174.9 | 0 | 0 | 0 | 0 | 110.4 | V291 G299 A300 T301 I302 T315 F324 | V291-V295 HydrophobicContact CG1-CG2 4.41Å; V291-V295 WeakPolarHBondContact O-CB 3.43Å; V291-V295 VanDerWaalsContact O-CG2 3.29Å; V291-V295 WeakPolarHBondContact O-CG2 3.48Å; V291-V295 PolarHBondContact O-N 3.45Å; V295-G299 CarbonylContact O-C 3.58Å; V295-G299 WeakPolarHBondContact O-CA 3.36Å; V295-A300 PolarHBondContact O-N 3.5Å; V295-T301 PolarHBondContact O-N 3.48Å; V295-T301 VanDerWaalsContact O-N 3.13Å; V295-I302 HydrophobicContact CB-CG2 4.48Å; V295-I302 HydrophobicContact CG1-CG2 4.31Å; V295-I302 PolarHBondContact O-N 2.85Å; V295-T315 HydrophobicContact CG2-CG2 3.49Å; V295-T315 VanDerWaalsContact CG2-CG2 3.49Å; V295-F324 HydrophobicContact CG2-CE1 4.13Å; V295-F324 HydrophobicContact CG2-CZ 4.17Å |
| 296 | G | 90.9 | Very high | 91.7 | Very high | 14 Ų | 14 | 64.3 Ų | 64.3 | 14% | 0.144 | 33% | 0.328 | C | S | . | . | trans | 71.5 | 173.8 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | G292 L293 K298 G299 | G292-G296 PolarHBondContact O-N 3.15Å; L293-G296 PolarHBondContact O-N 3.18Å; G296-K298 PolarHBondContact O-N 2.89Å; G296-G299 PolarHBondContact O-N 3.3Å | ||
| 297 | P | 91.8 | Very high | 92 | Very high | 107 Ų | 107 | 70.4 Ų | 70.4 | 70% | 0.695 | 36% | 0.356 | S | S | * | . | G | 310 helix | trans | -59 | 126.8 | -177.4 | 24.2 | -33.8 | 0 | 0 | 0 | 111.3 | G299 A300 | P297-G299 PolarHBondContact O-N 3.03Å; P297-G299 VanDerWaalsContact O-N 3.1Å; P297-A300 WeakPolarHBondContact O-CB 3.3Å; P297-A300 PolarHBondContact O-N 3.38Å |
| 298 | K | 89.6 | Confident | 92.1 | Very high | 203 Ų | 203 | 71.1 Ų | 71.1 | 88% | 0.883 | 35% | 0.352 | S | S | * | . | G | 310 helix | trans | 54.8 | 22 | -175.8 | -56.2 | -176.5 | 179.1 | -178.4 | 0 | 114.9 | G296 A300 K303 | G296-K298 PolarHBondContact O-N 2.89Å; K298-A300 VanDerWaalsContact C-N 3.31Å; K298-K303 PolarHBondContact O-NZ 2.99Å |
| 299 | G | 91.7 | Very high | 92.4 | Very high | 10 Ų | 10 | 64.4 Ų | 64.4 | 10% | 0.103 | 33% | 0.325 | C | S | . | . | G | 310 helix | trans | 75 | 16 | -174.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | V295 G296 P297 T301 I302 K303 | V295-G299 CarbonylContact O-C 3.58Å; V295-G299 WeakPolarHBondContact O-CA 3.36Å; G296-G299 PolarHBondContact O-N 3.3Å; P297-G299 PolarHBondContact O-N 3.03Å; P297-G299 VanDerWaalsContact O-N 3.1Å; G299-T301 VanDerWaalsContact C-N 3.3Å; G299-T301 PolarHBondContact O-N 3.45Å; G299-I302 PolarHBondContact O-N 3.11Å; G299-K303 VanDerWaalsContact O-CB 3.27Å; G299-K303 WeakPolarHBondContact O-CB 3.43Å; G299-K303 WeakPolarHBondContact O-CD 3.21Å; G299-K303 WeakPolarHBondContact O-CG 3.37Å; G299-K303 PolarHBondContact O-N 2.83Å |
| 300 | A | 94.4 | Very high | 92.6 | Very high | 48 Ų | 48 | 59.1 Ų | 59.1 | 40% | 0.397 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -65.9 | -27.4 | -172.7 | 0 | 0 | 0 | 0 | 0 | 114 | V295 P297 K298 R304 | V295-A300 PolarHBondContact O-N 3.5Å; P297-A300 WeakPolarHBondContact O-CB 3.3Å; P297-A300 PolarHBondContact O-N 3.38Å; K298-A300 VanDerWaalsContact C-N 3.31Å; A300-R304 WeakPolarHBondContact O-CB 3.37Å; A300-R304 PolarHBondContact O-N 3.46Å |
| 301 | T | 93.7 | Very high | 92.9 | Very high | 9 Ų | 9 | 59.5 Ų | 59.5 | 6% | 0.055 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -74.1 | -56.7 | 174.3 | -64.8 | 0 | 0 | 0 | 0 | 110.2 | V294 V295 G299 K303 R304 I305 H343 | V294-T301 WeakPolarHBondContact O-CB 3.26Å; V294-T301 WeakPolarHBondContact O-CG2 3.36Å; V295-T301 PolarHBondContact O-N 3.48Å; V295-T301 VanDerWaalsContact O-N 3.13Å; G299-T301 VanDerWaalsContact C-N 3.3Å; G299-T301 PolarHBondContact O-N 3.45Å; T301-K303 PolarHBondContact O-N 3.14Å; T301-R304 WeakPolarHBondContact O-CA 3.42Å; T301-R304 VanDerWaalsContact O-CB 3.32Å; T301-R304 WeakPolarHBondContact O-CB 3.3Å; T301-R304 PolarHBondContact O-N 2.88Å; T301-I305 HydrophobicContact CG2-CD1 4.12Å; T301-I305 PolarHBondContact O-N 3.36Å; T301-I305 VanDerWaalsContact O-N 3.07Å; T301-H343 WeakPolarHBondContact CG2-CE1 3.5Å; T301-H343 WeakPolarHBondContact CG2-NE2 3.3Å |
| 302 | I | 94.1 | Very high | 93.1 | Very high | 4 Ų | 4 | 65.5 Ų | 65.5 | 2% | 0.021 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -65.9 | -27.1 | -175.2 | -163.1 | 57.4 | 0 | 0 | 0 | 113.1 | V294 V295 G299 I305 Q306 I313 | V294-I302 HydrophobicContact CG1-CD1 3.99Å; V294-I302 PolarHBondContact O-N 2.93Å; V294-I302 VanDerWaalsContact O-N 3.16Å; V295-I302 HydrophobicContact CB-CG2 4.48Å; V295-I302 HydrophobicContact CG1-CG2 4.31Å; V295-I302 PolarHBondContact O-N 2.85Å; G299-I302 PolarHBondContact O-N 3.11Å; I302-I305 HydrophobicContact CD1-CD1 4.25Å; I302-Q306 WeakPolarHBondContact O-CB 3.43Å; I302-Q306 VanDerWaalsContact O-CG 3.32Å; I302-Q306 WeakPolarHBondContact O-CG 3.43Å; I302-Q306 PolarHBondContact O-N 3.4Å; I302-Q306 VanDerWaalsContact O-N 3.11Å; I302-Q306 PolarHBondContact O-NE2 2.95Å; I302-I313 HydrophobicContact CD1-CB 4.19Å; I302-I313 HydrophobicContact CD1-CD1 3.65Å; I302-I313 HydrophobicContact CD1-CG2 3.9Å; I302-I313 HydrophobicContact CG1-CB 4.21Å; I302-I313 HydrophobicContact CG1-CD1 4.42Å; I302-I313 HydrophobicContact CG1-CG2 4.11Å |
| 303 | K | 94.8 | Very high | 93.3 | Very high | 135 Ų | 135 | 63.3 Ų | 63.3 | 59% | 0.587 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -69.4 | -34.7 | 169.2 | -74.2 | 169.5 | -178.9 | 164.6 | 0 | 112.7 | K298 G299 T301 Q307 | K298-K303 PolarHBondContact O-NZ 2.99Å; G299-K303 VanDerWaalsContact O-CB 3.27Å; G299-K303 WeakPolarHBondContact O-CB 3.43Å; G299-K303 WeakPolarHBondContact O-CD 3.21Å; G299-K303 WeakPolarHBondContact O-CG 3.37Å; G299-K303 PolarHBondContact O-N 2.83Å; T301-K303 PolarHBondContact O-N 3.14Å; K303-Q307 WeakPolarHBondContact O-CB 3.46Å; K303-Q307 PolarHBondContact O-N 3.46Å |
| 304 | R | 93.9 | Very high | 93.5 | Very high | 115 Ų | 115 | 62 Ų | 62 | 43% | 0.434 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -67.1 | -45 | 176 | -160.5 | -157 | -66.8 | 94.4 | 5.2 | 110.9 | A300 T301 Q307 Q308 | A300-R304 WeakPolarHBondContact O-CB 3.37Å; A300-R304 PolarHBondContact O-N 3.46Å; T301-R304 WeakPolarHBondContact O-CA 3.42Å; T301-R304 VanDerWaalsContact O-CB 3.32Å; T301-R304 WeakPolarHBondContact O-CB 3.3Å; T301-R304 PolarHBondContact O-N 2.88Å; R304-Q307 WeakPolarHBondContact O-CB 3.35Å; R304-Q307 PolarHBondContact O-N 2.92Å; R304-Q307 VanDerWaalsContact O-N 3.13Å; R304-Q308 WeakPolarHBondContact O-CB 3.29Å; R304-Q308 PolarHBondContact O-N 2.76Å |
| 305 | I | 94.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 64.9 Ų | 64.9 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -58 | -52.2 | 175.7 | -60.2 | 175.5 | 0 | 0 | 0 | 109.8 | T301 I302 Q307 Q308 T309 I313 A336 E339 I340 | T301-I305 HydrophobicContact CG2-CD1 4.12Å; T301-I305 PolarHBondContact O-N 3.36Å; T301-I305 VanDerWaalsContact O-N 3.07Å; I302-I305 HydrophobicContact CD1-CD1 4.25Å; I305-Q307 VanDerWaalsContact C-N 3.27Å; I305-Q307 PolarHBondContact O-N 3.32Å; I305-Q308 PolarHBondContact O-N 3.36Å; I305-T309 HydrophobicContact CG2-CG2 4.1Å; I305-T309 WeakPolarHBondContact O-CB 3.39Å; I305-T309 VanDerWaalsContact O-CG2 3.26Å; I305-T309 WeakPolarHBondContact O-CG2 3.27Å; I305-T309 PolarHBondContact O-N 3.07Å; I305-T309 PolarHBondContact O-OG1 3.42Å; I305-I313 HydrophobicContact CB-CD1 4.5Å; I305-I313 HydrophobicContact CG2-CD1 3.89Å; I305-A336 HydrophobicContact CG2-CB 4.44Å; I305-E339 HydrophobicContact CD1-CG 4.39Å; I305-E339 HydrophobicContact CG1-CG 4.01Å; I305-E339 HydrophobicContact CG2-CB 4.18Å; I305-E339 HydrophobicContact CG2-CG 4.32Å; I305-I340 HydrophobicContact CD1-CG1 4.14Å; I305-I340 HydrophobicContact CG2-CG1 4.46Å |
| 306 | Q | 94.4 | Very high | 93 | Very high | 38 Ų | 38 | 64.6 Ų | 64.6 | 18% | 0.178 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -53.2 | -42.8 | 173.6 | -77 | 171.3 | 89.8 | 0 | 0 | 112.9 | I302 H310 T311 I313 | I302-Q306 WeakPolarHBondContact O-CB 3.43Å; I302-Q306 VanDerWaalsContact O-CG 3.32Å; I302-Q306 WeakPolarHBondContact O-CG 3.43Å; I302-Q306 PolarHBondContact O-N 3.4Å; I302-Q306 VanDerWaalsContact O-N 3.11Å; I302-Q306 PolarHBondContact O-NE2 2.95Å; Q306-H310 VanDerWaalsContact O-CA 3.3Å; Q306-H310 WeakPolarHBondContact O-CA 3.33Å; Q306-H310 PolarHBondContact O-N 2.88Å; Q306-T311 WeakPolarHBondContact CA-O 3.42Å; Q306-T311 VanDerWaalsContact CB-O 3.29Å; Q306-T311 WeakPolarHBondContact CB-O 3.45Å; Q306-T311 WeakPolarHBondContact CG-O 3.37Å; Q306-T311 PolarHBondContact O-N 3.43Å; Q306-I313 HydrophobicContact CG-CB 3.8Å; Q306-I313 HydrophobicContact CG-CD1 3.75Å; Q306-I313 HydrophobicContact CG-CG1 3.59Å |
| 307 | Q | 95.3 | Very high | 92.6 | Very high | 138 Ų | 138 | 66.9 Ų | 66.9 | 65% | 0.645 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -70.4 | -36.1 | -178.1 | -174.7 | 65.2 | 87.7 | 0 | 0 | 113.8 | K303 R304 I305 H310 | K303-Q307 WeakPolarHBondContact O-CB 3.46Å; K303-Q307 PolarHBondContact O-N 3.46Å; R304-Q307 WeakPolarHBondContact O-CB 3.35Å; R304-Q307 PolarHBondContact O-N 2.92Å; R304-Q307 VanDerWaalsContact O-N 3.13Å; I305-Q307 VanDerWaalsContact C-N 3.27Å; I305-Q307 PolarHBondContact O-N 3.32Å; Q307-H310 PolarHBondContact O-CE1 3.46Å; Q307-H310 PolarHBondContact O-ND1 3.44Å |
| 308 | Q | 94.3 | Very high | 91.9 | Very high | 96 Ų | 96 | 72.6 Ų | 72.6 | 45% | 0.449 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -79.9 | -37.4 | 179 | -79.4 | 172.5 | -135.1 | 0 | 0 | 112.9 | R304 I305 E339 | R304-Q308 WeakPolarHBondContact O-CB 3.29Å; R304-Q308 PolarHBondContact O-N 2.76Å; I305-Q308 PolarHBondContact O-N 3.36Å; Q308-E339 PolarHBondContact NE2-OE1 3.12Å |
| 309 | T | 94.4 | Very high | 91.5 | Very high | 1 Ų | 1 | 70 Ų | 70 | 1% | 0.006 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -87.4 | -20.8 | -177.1 | 60.4 | 0 | 0 | 0 | 0 | 112.2 | I305 T311 N332 R335 A336 | I305-T309 HydrophobicContact CG2-CG2 4.1Å; I305-T309 WeakPolarHBondContact O-CB 3.39Å; I305-T309 VanDerWaalsContact O-CG2 3.26Å; I305-T309 WeakPolarHBondContact O-CG2 3.27Å; I305-T309 PolarHBondContact O-N 3.07Å; I305-T309 PolarHBondContact O-OG1 3.42Å; T309-T311 VanDerWaalsContact C-N 3.33Å; T309-T311 PolarHBondContact OG1-N 3.32Å; T309-T311 PolarHBondContact OG1-OG1 3.31Å; T309-N332 WeakPolarHBondContact O-CB 3.22Å; T309-N332 PolarHBondContact O-ND2 2.97Å; T309-N332 PolarHBondContact O-OD1 2.62Å; T309-R335 PolarHBondContact O-NH2 3.29Å; T309-A336 VanDerWaalsContact CG2-CA 3.48Å; T309-A336 HydrophobicContact CG2-CB 3.65Å |
| 310 | H | 92.8 | Very high | 91 | Very high | 129 Ų | 129 | 76 Ų | 76 | 60% | 0.597 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.3 | 41.8 | -167.9 | -47.9 | -61.4 | 0 | 0 | 0 | 112.6 | Q306 Q307 | Q306-H310 VanDerWaalsContact O-CA 3.3Å; Q306-H310 WeakPolarHBondContact O-CA 3.33Å; Q306-H310 PolarHBondContact O-N 2.88Å; Q307-H310 PolarHBondContact O-CE1 3.46Å; Q307-H310 PolarHBondContact O-ND1 3.44Å |
| 311 | T | 95.4 | Very high | 90.5 | Very high | 12 Ų | 12 | 79.2 Ų | 79.2 | 7% | 0.074 | 37% | 0.369 | C | S | . | . | trans | -109.7 | 161.4 | 170.4 | 60.8 | 0 | 0 | 0 | 0 | 111.3 | Q306 T309 V326 T327 N332 V333 A336 | Q306-T311 WeakPolarHBondContact CA-O 3.42Å; Q306-T311 VanDerWaalsContact CB-O 3.29Å; Q306-T311 WeakPolarHBondContact CB-O 3.45Å; Q306-T311 WeakPolarHBondContact CG-O 3.37Å; Q306-T311 PolarHBondContact O-N 3.43Å; T309-T311 VanDerWaalsContact C-N 3.33Å; T309-T311 PolarHBondContact OG1-N 3.32Å; T309-T311 PolarHBondContact OG1-OG1 3.31Å; T311-V326 HydrophobicContact CG2-CG1 4.07Å; T311-T327 WeakPolarHBondContact CA-O 3.35Å; T311-T327 WeakPolarHBondContact CB-O 3.49Å; T311-N332 VanDerWaalsContact CG2-C 3.45Å; T311-N332 HydrophobicContact CG2-CB 3.83Å; T311-N332 VanDerWaalsContact CG2-O 3.26Å; T311-N332 WeakPolarHBondContact CG2-O 3.35Å; T311-V333 HydrophobicContact CG2-CG2 3.99Å; T311-A336 HydrophobicContact CG2-CB 3.74Å; T311-A336 WeakPolarHBondContact OG1-CB 3.46Å | ||
| 312 | Y | 94.5 | Very high | 90.4 | Very high | 151 Ų | 151 | 79.9 Ų | 79.9 | 59% | 0.592 | 37% | 0.373 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -102.3 | 131.9 | 164.7 | -178.9 | -109.9 | 0 | 0 | 0 | 108.6 | V314 V326 T327 | Y312-V314 HydrophobicContact CD1-CG2 4.26Å; Y312-V314 HydrophobicContact CE1-CG2 3.73Å; Y312-V326 WeakPolarHBondContact O-CA 3.47Å; Y312-T327 PolarHBondContact N-O 2.99Å; Y312-T327 PolarHBondContact O-N 3.01Å |
| 313 | I | 94.3 | Very high | 90.2 | Very high | 6 Ų | 6 | 80.8 Ų | 80.8 | 3% | 0.031 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.7 | 112.4 | -177.3 | -54.7 | 171.8 | 0 | 0 | 0 | 110.7 | I302 I305 Q306 T315 F324 E325 V326 A336 I340 | I302-I313 HydrophobicContact CD1-CB 4.19Å; I302-I313 HydrophobicContact CD1-CD1 3.65Å; I302-I313 HydrophobicContact CD1-CG2 3.9Å; I302-I313 HydrophobicContact CG1-CB 4.21Å; I302-I313 HydrophobicContact CG1-CD1 4.42Å; I302-I313 HydrophobicContact CG1-CG2 4.11Å; I305-I313 HydrophobicContact CB-CD1 4.5Å; I305-I313 HydrophobicContact CG2-CD1 3.89Å; Q306-I313 HydrophobicContact CG-CB 3.8Å; Q306-I313 HydrophobicContact CG-CD1 3.75Å; Q306-I313 HydrophobicContact CG-CG1 3.59Å; I313-T315 PolarHBondContact O-N 3.4Å; I313-F324 HydrophobicContact CG2-CB 3.92Å; I313-F324 HydrophobicContact CG2-CD1 3.81Å; I313-F324 HydrophobicContact CG2-CG 4.21Å; I313-E325 WeakPolarHBondContact CA-O 3.38Å; I313-V326 HydrophobicContact CG1-CB 4.42Å; I313-V326 HydrophobicContact CG1-CG1 4.03Å; I313-V326 HydrophobicContact CG1-CG2 4.11Å; I313-V326 HydrophobicContact CG2-CG2 4.16Å; I313-A336 HydrophobicContact CD1-CB 4.47Å; I313-I340 HydrophobicContact CD1-CD1 4.21Å |
| 314 | V | 92.8 | Very high | 90.1 | Very high | 57 Ų | 57 | 74.4 Ų | 74.4 | 35% | 0.345 | 35% | 0.351 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.8 | 120 | 172.9 | -172.1 | 0 | 0 | 0 | 0 | 108.7 | Y312 E325 | Y312-V314 HydrophobicContact CD1-CG2 4.26Å; Y312-V314 HydrophobicContact CE1-CG2 3.73Å; V314-E325 HydrophobicContact CB-CB 4.06Å; V314-E325 HydrophobicContact CG2-CB 4.21Å; V314-E325 PolarHBondContact N-O 3.22Å; V314-E325 PolarHBondContact O-N 2.81Å |
| 315 | T | 89.9 | Confident | 90.1 | Very high | 60 Ų | 60 | 73.1 Ų | 73.1 | 37% | 0.368 | 35% | 0.35 | S | S | . | . | P | Polyproline II helix | trans | -79.9 | 125.3 | 171.6 | -61.5 | 0 | 0 | 0 | 0 | 109.4 | V295 I313 F324 | V295-T315 HydrophobicContact CG2-CG2 3.49Å; V295-T315 VanDerWaalsContact CG2-CG2 3.49Å; I313-T315 PolarHBondContact O-N 3.4Å; T315-F324 HydrophobicContact CG2-CE1 4.19Å |
| 316 | P | 86.5 | Confident | 90.1 | Very high | 24 Ų | 24 | 73.1 Ų | 73.1 | 16% | 0.156 | 35% | 0.35 | C | S | . | . | P | Polyproline II helix | trans | -64.1 | 149.1 | 178.1 | 25.6 | -33.5 | 0 | 0 | 0 | 111.7 | E321 V323 | P316-E321 WeakPolarHBondContact CB-O 3.38Å; P316-V323 WeakPolarHBondContact CB-O 3.21Å; P316-V323 WeakPolarHBondContact CD-O 3.46Å; P316-V323 WeakPolarHBondContact CG-O 3.35Å |
| 317 | S | 82.2 | Confident | 90.1 | Very high | 61 Ų | 61 | 72.8 Ų | 72.8 | 43% | 0.427 | 35% | 0.351 | S | S | . | . | P | Polyproline II helix | trans | -64.7 | 149.4 | 170.9 | -45.2 | 0 | 0 | 0 | 0 | 110.2 | D319 K320 | S317-D319 PolarHBondContact O-N 3.12Å; S317-K320 PolarHBondContact O-N 2.81Å; S317-K320 VanDerWaalsContact O-N 3.12Å |
| 318 | R | 77.2 | Confident | 90 | Very high | 228 Ų | 228 | 66.3 Ų | 66.3 | 86% | 0.86 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56 | -29.2 | -177.6 | -170.5 | 178.5 | -173.8 | -177.6 | 1.2 | 113.5 | ||
| 319 | D | 81.3 | Confident | 89.8 | Confident | 148 Ų | 148 | 66 Ų | 66 | 79% | 0.791 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.9 | 17.1 | -171.8 | -32.8 | -78.2 | 0 | 0 | 0 | 112.3 | S317 | S317-D319 PolarHBondContact O-N 3.12Š|
| 320 | K | 80.4 | Confident | 89.6 | Confident | 135 Ų | 135 | 68.4 Ų | 68.4 | 59% | 0.587 | 34% | 0.337 | S | S | * | . | S | Bend | trans | -121.3 | 168.9 | 175.8 | -69.2 | -176.8 | 179.1 | -178 | 0 | 110.5 | Y288 S317 | Y288-K320 WeakPolarHBondContact CE1-O 3.31Å; Y288-K320 PolarHBondContact OH-O 3.31Å; S317-K320 PolarHBondContact O-N 2.81Å; S317-K320 VanDerWaalsContact O-N 3.12Å |
| 321 | E | 84.6 | Confident | 89.5 | Confident | 117 Ų | 117 | 67.8 Ų | 67.8 | 55% | 0.547 | 33% | 0.334 | S | S | . | . | trans | -52.4 | 144.9 | 171.3 | -68.6 | -169.4 | -172.5 | 0 | 0 | 111.8 | R285 P316 V323 | R285-E321 IonicContact NH2-OE2 3.54Å; P316-E321 WeakPolarHBondContact CB-O 3.38Å; E321-V323 HydrophobicContact CB-CG2 3.73Å; E321-V323 PolarHBondContact O-N 3.09Å | ||
| 322 | P | 90.2 | Very high | 89.4 | Confident | 22 Ų | 22 | 68.6 Ų | 68.6 | 14% | 0.143 | 34% | 0.338 | C | S | . | . | S | Bend | trans | -83.5 | 59.1 | -173.1 | 37 | -36.6 | 0 | 0 | 0 | 111 | V286 Y288 V291 | V286-P322 HydrophobicContact CG2-CB 4.47Å; V286-P322 PolarHBondContact N-O 2.86Å; V286-P322 WeakPolarHBondContact O-CB 3.35Å; V286-P322 WeakPolarHBondContact O-CG 3.39Å; Y288-P322 HydrophobicContact CD1-CB 3.95Å; Y288-P322 HydrophobicContact CD1-CG 4.27Å; Y288-P322 HydrophobicContact CD2-CB 4.47Å; Y288-P322 HydrophobicContact CD2-CG 3.96Å; Y288-P322 HydrophobicContact CE1-CB 4.11Å; Y288-P322 HydrophobicContact CE1-CG 4.24Å; Y288-P322 HydrophobicContact CE2-CG 3.92Å; Y288-P322 HydrophobicContact CG-CB 4.15Å; Y288-P322 HydrophobicContact CG-CG 4.15Å; V291-P322 HydrophobicContact CG2-CB 3.69Å |
| 323 | V | 90.9 | Very high | 89.4 | Confident | 24 Ų | 24 | 61.4 Ų | 61.4 | 15% | 0.145 | 31% | 0.31 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.3 | 119.7 | -176.5 | -164.7 | 0 | 0 | 0 | 0 | 109.3 | Q283 R285 P316 E321 | Q283-V323 HydrophobicContact CB-CG1 3.62Å; Q283-V323 HydrophobicContact CG-CG1 4.05Å; R285-V323 HydrophobicContact CG-CG1 4.18Å; R285-V323 HydrophobicContact CG-CG2 4.08Å; P316-V323 WeakPolarHBondContact CB-O 3.21Å; P316-V323 WeakPolarHBondContact CD-O 3.46Å; P316-V323 WeakPolarHBondContact CG-O 3.35Å; E321-V323 HydrophobicContact CB-CG2 3.73Å; E321-V323 PolarHBondContact O-N 3.09Å |
| 324 | F | 92.9 | Very high | 89.4 | Confident | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.9 | 127.6 | 167.4 | -68.5 | -77.6 | 0 | 0 | 0 | 109.3 | Q283 V284 V286 V291 V294 V295 I313 T315 V326 | Q283-F324 CarbonylContact C-O 3.53Å; Q283-F324 WeakPolarHBondContact CA-O 3.43Å; V284-F324 HydrophobicContact CB-CB 4.4Å; V284-F324 PolarHBondContact N-O 2.99Å; V284-F324 PolarHBondContact O-N 3Å; V286-F324 HydrophobicContact CG1-CD2 3.95Å; V286-F324 HydrophobicContact CG1-CE2 4.04Å; V286-F324 HydrophobicContact CG2-CD2 4.15Å; V286-F324 HydrophobicContact CG2-CE2 3.68Å; V291-F324 HydrophobicContact CG1-CZ 4.11Å; V294-F324 HydrophobicContact CB-CE2 4.06Å; V294-F324 HydrophobicContact CB-CZ 3.94Å; V294-F324 HydrophobicContact CG1-CD2 4.47Å; V294-F324 HydrophobicContact CG1-CE1 4.32Å; V294-F324 HydrophobicContact CG1-CE2 3.62Å; V294-F324 HydrophobicContact CG1-CZ 3.54Å; V295-F324 HydrophobicContact CG2-CE1 4.13Å; V295-F324 HydrophobicContact CG2-CZ 4.17Å; I313-F324 HydrophobicContact CG2-CB 3.92Å; I313-F324 HydrophobicContact CG2-CD1 3.81Å; I313-F324 HydrophobicContact CG2-CG 4.21Å; T315-F324 HydrophobicContact CG2-CE1 4.19Å; F324-V326 HydrophobicContact CB-CG2 4.45Å |
| 325 | E | 93.9 | Very high | 89.4 | Confident | 88 Ų | 88 | 67.9 Ų | 67.9 | 41% | 0.411 | 33% | 0.334 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.7 | 117.6 | 170.5 | -169.7 | -178.8 | 170.3 | 0 | 0 | 108.3 | I313 V314 | I313-E325 WeakPolarHBondContact CA-O 3.38Å; V314-E325 HydrophobicContact CB-CB 4.06Å; V314-E325 HydrophobicContact CG2-CB 4.21Å; V314-E325 PolarHBondContact N-O 3.22Å; V314-E325 PolarHBondContact O-N 2.81Å |
| 326 | V | 94.8 | Very high | 89.7 | Confident | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.1 | 117.3 | -173.5 | -175.2 | 0 | 0 | 0 | 0 | 109.2 | T281 I282 V284 T311 Y312 I313 F324 V333 A336 I340 | T281-V326 WeakPolarHBondContact CA-O 3.39Å; I282-V326 PolarHBondContact N-O 3.28Å; I282-V326 PolarHBondContact O-N 3.44Å; V284-V326 HydrophobicContact CB-CG2 4.48Å; V284-V326 HydrophobicContact CG2-CG2 3.77Å; T311-V326 HydrophobicContact CG2-CG1 4.07Å; Y312-V326 WeakPolarHBondContact O-CA 3.47Å; I313-V326 HydrophobicContact CG1-CB 4.42Å; I313-V326 HydrophobicContact CG1-CG1 4.03Å; I313-V326 HydrophobicContact CG1-CG2 4.11Å; I313-V326 HydrophobicContact CG2-CG2 4.16Å; F324-V326 HydrophobicContact CB-CG2 4.45Å; V326-V333 HydrophobicContact CB-CG1 4.13Å; V326-V333 HydrophobicContact CG1-CB 4.32Å; V326-V333 HydrophobicContact CG1-CG1 3.81Å; V326-V333 HydrophobicContact CG1-CG2 4.22Å; V326-A336 HydrophobicContact CG1-CB 3.83Å; V326-I340 HydrophobicContact CG2-CD1 4.18Å |
| 327 | T | 93.6 | Very high | 90.1 | Very high | 31 Ų | 31 | 68.9 Ų | 68.9 | 19% | 0.19 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.7 | 132.4 | -175.9 | -47.5 | 0 | 0 | 0 | 0 | 111.2 | T280 T281 T311 Y312 | T280-T327 WeakPolarHBondContact O-CA 3.47Å; T281-T327 HydrophobicContact CG2-CG2 3.79Å; T311-T327 WeakPolarHBondContact CA-O 3.35Å; T311-T327 WeakPolarHBondContact CB-O 3.49Å; Y312-T327 PolarHBondContact N-O 2.99Å; Y312-T327 PolarHBondContact O-N 3.01Å |
| 328 | G | 92.5 | Very high | 90.6 | Very high | 3 Ų | 3 | 72.4 Ų | 72.4 | 3% | 0.031 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 169.4 | -166.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | Q279 T280 V333 | Q279-G328 CarbonylContact C-O 3.14Å; Q279-G328 VanDerWaalsContact CA-O 3.31Å; Q279-G328 WeakPolarHBondContact CA-O 3.28Å; T280-G328 PolarHBondContact N-O 3.03Å; T280-G328 PolarHBondContact O-N 3.15Å; T280-G328 VanDerWaalsContact O-N 3.12Å; G328-V333 VanDerWaalsContact N-CG2 3.28Å |
| 329 | M | 90.4 | Very high | 91.3 | Very high | 89 Ų | 89 | 63.8 Ų | 63.8 | 44% | 0.438 | 31% | 0.307 | S | S | . | . | trans | -61.1 | 145.7 | 165.6 | -63.5 | -68.7 | -60.2 | 0 | 0 | 109.7 | E331 N332 V333 | M329-E331 VanDerWaalsContact C-N 3.34Å; M329-E331 PolarHBondContact O-N 3.41Å; M329-N332 HydrophobicContact CB-CB 4.1Å; M329-N332 WeakPolarHBondContact O-CA 3.21Å; M329-N332 WeakPolarHBondContact O-CB 3.01Å; M329-N332 PolarHBondContact O-N 2.82Å; M329-V333 WeakPolarHBondContact O-CG2 3.19Å; M329-V333 PolarHBondContact O-N 2.65Å | ||
| 330 | P | 91 | Very high | 91.9 | Very high | 52 Ų | 52 | 56.8 Ų | 56.8 | 34% | 0.338 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -55.9 | -45.2 | -177.8 | 19.9 | -29.2 | 0 | 0 | 0 | 113 | T280 N332 V333 D334 | T280-P330 HydrophobicContact CG2-CB 4.1Å; P330-N332 PolarHBondContact O-N 3.49Å; P330-N332 VanDerWaalsContact O-N 3.09Å; P330-V333 PolarHBondContact O-N 3.12Å; P330-V333 VanDerWaalsContact O-N 3.08Å; P330-D334 PolarHBondContact O-N 3.05Å |
| 331 | E | 89.7 | Confident | 92.4 | Very high | 116 Ų | 116 | 54.1 Ų | 54.1 | 54% | 0.542 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -65.3 | -16.7 | 178.2 | -45.7 | 81.1 | 178.3 | 0 | 0 | 113.1 | M329 R335 | M329-E331 VanDerWaalsContact C-N 3.34Å; M329-E331 PolarHBondContact O-N 3.41Å; E331-R335 WeakPolarHBondContact O-CD 3.29Å; E331-R335 VanDerWaalsContact O-CG 3.25Å; E331-R335 WeakPolarHBondContact O-CG 3.44Å; E331-R335 PolarHBondContact O-NE 2.85Å |
| 332 | N | 94 | Very high | 92.7 | Very high | 29 Ų | 29 | 50.4 Ų | 50.4 | 16% | 0.155 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -92.7 | -37.4 | 174.5 | -72.4 | -8.6 | 0 | 0 | 0 | 111.6 | T309 T311 M329 P330 R335 A336 | T309-N332 WeakPolarHBondContact O-CB 3.22Å; T309-N332 PolarHBondContact O-ND2 2.97Å; T309-N332 PolarHBondContact O-OD1 2.62Å; T311-N332 VanDerWaalsContact CG2-C 3.45Å; T311-N332 HydrophobicContact CG2-CB 3.83Å; T311-N332 VanDerWaalsContact CG2-O 3.26Å; T311-N332 WeakPolarHBondContact CG2-O 3.35Å; M329-N332 HydrophobicContact CB-CB 4.1Å; M329-N332 WeakPolarHBondContact O-CA 3.21Å; M329-N332 WeakPolarHBondContact O-CB 3.01Å; M329-N332 PolarHBondContact O-N 2.82Å; P330-N332 PolarHBondContact O-N 3.49Å; P330-N332 VanDerWaalsContact O-N 3.09Å; N332-R335 PolarHBondContact OD1-NH2 3.39Å; N332-A336 VanDerWaalsContact O-CB 3.3Å; N332-A336 WeakPolarHBondContact O-CB 3.22Å; N332-A336 PolarHBondContact O-N 3.42Å |
| 333 | V | 94.1 | Very high | 92.7 | Very high | 0 Ų | 0 | 50.4 Ų | 50.4 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -70.9 | -40.7 | -180 | 176.2 | 0 | 0 | 0 | 0 | 111.1 | T280 I282 T311 V326 G328 M329 P330 A336 R337 | T280-V333 HydrophobicContact CG2-CB 3.92Å; T280-V333 HydrophobicContact CG2-CG1 4.19Å; T280-V333 HydrophobicContact CG2-CG2 3.83Å; I282-V333 HydrophobicContact CB-CG1 3.58Å; I282-V333 HydrophobicContact CD1-CG1 3.75Å; I282-V333 HydrophobicContact CG1-CG1 3.64Å; T311-V333 HydrophobicContact CG2-CG2 3.99Å; V326-V333 HydrophobicContact CB-CG1 4.13Å; V326-V333 HydrophobicContact CG1-CB 4.32Å; V326-V333 HydrophobicContact CG1-CG1 3.81Å; V326-V333 HydrophobicContact CG1-CG2 4.22Å; G328-V333 VanDerWaalsContact N-CG2 3.28Å; M329-V333 WeakPolarHBondContact O-CG2 3.19Å; M329-V333 PolarHBondContact O-N 2.65Å; P330-V333 PolarHBondContact O-N 3.12Å; P330-V333 VanDerWaalsContact O-N 3.08Å; V333-A336 PolarHBondContact O-N 2.89Å; V333-R337 WeakPolarHBondContact O-CB 3.27Å; V333-R337 PolarHBondContact O-N 2.88Å |
| 334 | D | 93.5 | Very high | 92.6 | Very high | 85 Ų | 85 | 50.6 Ų | 50.6 | 46% | 0.455 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -65 | -43.6 | 175.6 | -69.5 | -36.9 | 0 | 0 | 0 | 111.5 | P330 A336 R337 E338 | P330-D334 PolarHBondContact O-N 3.05Å; D334-A336 VanDerWaalsContact C-N 3.33Å; D334-A336 PolarHBondContact O-N 3.45Å; D334-R337 WeakPolarHBondContact O-CB 3.45Å; D334-R337 PolarHBondContact O-N 2.89Å; D334-E338 PolarHBondContact O-N 2.85Å |
| 335 | R | 94.4 | Very high | 92.3 | Very high | 114 Ų | 114 | 53.8 Ų | 53.8 | 43% | 0.43 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62.9 | -36.1 | 172.7 | -68.4 | -173.5 | -54.3 | 131.6 | 5 | 112.8 | T309 E331 N332 E339 | T309-R335 PolarHBondContact O-NH2 3.29Å; E331-R335 WeakPolarHBondContact O-CD 3.29Å; E331-R335 VanDerWaalsContact O-CG 3.25Å; E331-R335 WeakPolarHBondContact O-CG 3.44Å; E331-R335 PolarHBondContact O-NE 2.85Å; N332-R335 PolarHBondContact OD1-NH2 3.39Å; R335-E339 WeakPolarHBondContact O-CB 3.39Å; R335-E339 PolarHBondContact O-N 3.2Å |
| 336 | A | 95.1 | Very high | 91.6 | Very high | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -69.8 | -37.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | I305 T309 T311 I313 V326 N332 V333 D334 I340 | I305-A336 HydrophobicContact CG2-CB 4.44Å; T309-A336 VanDerWaalsContact CG2-CA 3.48Å; T309-A336 HydrophobicContact CG2-CB 3.65Å; T311-A336 HydrophobicContact CG2-CB 3.74Å; T311-A336 WeakPolarHBondContact OG1-CB 3.46Å; I313-A336 HydrophobicContact CD1-CB 4.47Å; V326-A336 HydrophobicContact CG1-CB 3.83Å; N332-A336 VanDerWaalsContact O-CB 3.3Å; N332-A336 WeakPolarHBondContact O-CB 3.22Å; N332-A336 PolarHBondContact O-N 3.42Å; V333-A336 PolarHBondContact O-N 2.89Å; D334-A336 VanDerWaalsContact C-N 3.33Å; D334-A336 PolarHBondContact O-N 3.45Å; A336-I340 WeakPolarHBondContact O-CD1 3.29Å; A336-I340 VanDerWaalsContact O-CG1 3.23Å; A336-I340 WeakPolarHBondContact O-CG1 3.33Å; A336-I340 PolarHBondContact O-N 2.93Å |
| 337 | R | 94.4 | Very high | 90.8 | Very high | 104 Ų | 104 | 64.2 Ų | 64.2 | 39% | 0.392 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.4 | -50 | 171.5 | 174 | 176.8 | 174.4 | -127.1 | -27.9 | 110.9 | V284 V333 D334 E339 I340 E341 | V284-R337 HydrophobicContact CG1-CG 4.32Å; V284-R337 HydrophobicContact CG2-CB 3.84Å; V284-R337 HydrophobicContact CG2-CG 3.78Å; V333-R337 WeakPolarHBondContact O-CB 3.27Å; V333-R337 PolarHBondContact O-N 2.88Å; D334-R337 WeakPolarHBondContact O-CB 3.45Å; D334-R337 PolarHBondContact O-N 2.89Å; R337-E339 PolarHBondContact O-N 2.85Å; R337-I340 PolarHBondContact O-N 3.34Å; R337-E341 WeakPolarHBondContact CG-OE1 3.32Å; R337-E341 IonicContact CZ-OE1 3.29Å; R337-E341 VanDerWaalsContact CZ-OE1 3.29Å; R337-E341 IonicContact NE-OE1 2.73Å; R337-E341 PolarHBondContact NE-OE1 2.88Å; R337-E341 IonicContact NH2-OE1 2.95Å; R337-E341 PolarHBondContact NH2-OE1 3.02Å; R337-E341 IonicContact NH2-OE2 3.25Å; R337-E341 PolarHBondContact NH2-OE2 2.84Å; R337-E341 WeakPolarHBondContact O-CG 3.46Å; R337-E341 PolarHBondContact O-N 2.94Å |
| 338 | E | 93.3 | Very high | 90 | Very high | 135 Ų | 135 | 65.6 Ų | 65.6 | 63% | 0.631 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -58.7 | -45 | 176.1 | -173.9 | -179.1 | -162.6 | 0 | 0 | 111.5 | D334 I340 E341 A342 | D334-E338 PolarHBondContact O-N 2.85Å; E338-I340 VanDerWaalsContact C-N 3.33Å; E338-I340 PolarHBondContact O-N 3.03Å; E338-E341 PolarHBondContact O-N 3.18Å; E338-A342 WeakPolarHBondContact O-CB 3.3Å; E338-A342 PolarHBondContact O-N 3.26Å |
| 339 | E | 93 | Very high | 88.3 | Confident | 48 Ų | 48 | 68 Ų | 68 | 22% | 0.224 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -64.1 | -35.5 | 178.2 | -166.2 | 176.3 | 179.4 | 0 | 0 | 112 | I305 Q308 R335 R337 H343 | I305-E339 HydrophobicContact CD1-CG 4.39Å; I305-E339 HydrophobicContact CG1-CG 4.01Å; I305-E339 HydrophobicContact CG2-CB 4.18Å; I305-E339 HydrophobicContact CG2-CG 4.32Å; Q308-E339 PolarHBondContact NE2-OE1 3.12Å; R335-E339 WeakPolarHBondContact O-CB 3.39Å; R335-E339 PolarHBondContact O-N 3.2Å; R337-E339 PolarHBondContact O-N 2.85Å; E339-H343 WeakPolarHBondContact O-CB 3.5Å; E339-H343 PolarHBondContact O-N 3.13Å |
| 340 | I | 93.5 | Very high | 86.6 | Confident | 0 Ų | 0 | 70 Ų | 70 | 0% | 0 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -65.4 | -51.4 | 171.8 | -67.5 | 160.3 | 0 | 0 | 0 | 111.1 | V284 V286 V294 I305 I313 V326 A336 R337 E338 A342 H343 I344 | V284-I340 HydrophobicContact CB-CD1 4.42Å; V284-I340 HydrophobicContact CG1-CB 4.43Å; V284-I340 HydrophobicContact CG1-CD1 4.3Å; V284-I340 HydrophobicContact CG1-CG2 4.02Å; V284-I340 HydrophobicContact CG2-CD1 4.45Å; V286-I340 HydrophobicContact CG1-CG2 3.96Å; V294-I340 HydrophobicContact CG1-CG1 4.34Å; V294-I340 HydrophobicContact CG1-CG2 4.05Å; V294-I340 HydrophobicContact CG2-CG2 4.29Å; I305-I340 HydrophobicContact CD1-CG1 4.14Å; I305-I340 HydrophobicContact CG2-CG1 4.46Å; I313-I340 HydrophobicContact CD1-CD1 4.21Å; V326-I340 HydrophobicContact CG2-CD1 4.18Å; A336-I340 WeakPolarHBondContact O-CD1 3.29Å; A336-I340 VanDerWaalsContact O-CG1 3.23Å; A336-I340 WeakPolarHBondContact O-CG1 3.33Å; A336-I340 PolarHBondContact O-N 2.93Å; R337-I340 PolarHBondContact O-N 3.34Å; E338-I340 VanDerWaalsContact C-N 3.33Å; E338-I340 PolarHBondContact O-N 3.03Å; I340-A342 PolarHBondContact O-N 3.1Å; I340-H343 PolarHBondContact O-N 2.96Å; I340-I344 HydrophobicContact CG2-CD1 4.02Å; I340-I344 WeakPolarHBondContact O-CG1 3.36Å; I340-I344 PolarHBondContact O-N 3.35Å |
| 341 | E | 91.6 | Very high | 84.3 | Confident | 79 Ų | 79 | 73.1 Ų | 73.1 | 37% | 0.369 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -63.3 | -42.8 | -176.7 | -71.5 | 177.1 | -165.7 | 0 | 0 | 110.9 | R337 E338 I344 A345 | R337-E341 WeakPolarHBondContact CG-OE1 3.32Å; R337-E341 IonicContact CZ-OE1 3.29Å; R337-E341 VanDerWaalsContact CZ-OE1 3.29Å; R337-E341 IonicContact NE-OE1 2.73Å; R337-E341 PolarHBondContact NE-OE1 2.88Å; R337-E341 IonicContact NH2-OE1 2.95Å; R337-E341 PolarHBondContact NH2-OE1 3.02Å; R337-E341 IonicContact NH2-OE2 3.25Å; R337-E341 PolarHBondContact NH2-OE2 2.84Å; R337-E341 WeakPolarHBondContact O-CG 3.46Å; R337-E341 PolarHBondContact O-N 2.94Å; E338-E341 PolarHBondContact O-N 3.18Å; E341-I344 WeakPolarHBondContact O-CB 3.11Å; E341-I344 PolarHBondContact O-N 3.4Å; E341-A345 PolarHBondContact O-N 2.95Å |
| 342 | A | 90.4 | Very high | 81.8 | Confident | 40 Ų | 40 | 71.1 Ų | 71.1 | 33% | 0.331 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -66 | -39.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | E338 I340 I344 A345 L346 | E338-A342 WeakPolarHBondContact O-CB 3.3Å; E338-A342 PolarHBondContact O-N 3.26Å; I340-A342 PolarHBondContact O-N 3.1Å; A342-I344 PolarHBondContact O-N 3.32Å; A342-A345 PolarHBondContact O-N 3.46Å; A342-L346 VanDerWaalsContact O-CB 3.32Å; A342-L346 WeakPolarHBondContact O-CB 3.36Å; A342-L346 WeakPolarHBondContact O-CG 3.45Å; A342-L346 PolarHBondContact O-N 3.45Å |
| 343 | H | 89.1 | Confident | 79.3 | Confident | 21 Ų | 21 | 73.4 Ų | 73.4 | 10% | 0.097 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -62.7 | -32.4 | 176.1 | -161.2 | 95.8 | 0 | 0 | 0 | 112.3 | T301 E339 I340 R347 | T301-H343 WeakPolarHBondContact CG2-CE1 3.5Å; T301-H343 WeakPolarHBondContact CG2-NE2 3.3Å; E339-H343 WeakPolarHBondContact O-CB 3.5Å; E339-H343 PolarHBondContact O-N 3.13Å; I340-H343 PolarHBondContact O-N 2.96Å; H343-R347 PolarHBondContact CE1-NE 3.34Å; H343-R347 PolarHBondContact CE1-NH1 2.96Å; H343-R347 VanDerWaalsContact NE2-CD 3.3Å; H343-R347 WeakPolarHBondContact NE2-CD 3.26Å; H343-R347 PolarHBondContact NE2-NE 3.11Å; H343-R347 PolarHBondContact NE2-NH1 2.78Å; H343-R347 WeakPolarHBondContact O-CB 3.5Å |
| 344 | I | 89.9 | Confident | 77.1 | Confident | 29 Ų | 29 | 80 Ų | 80 | 15% | 0.149 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -70.5 | -54.7 | 171.9 | -66.4 | 163.8 | 0 | 0 | 0 | 109.7 | V286 V290 V294 I340 E341 A342 L346 R347 T348 | V286-I344 HydrophobicContact CB-CD1 3.75Å; V286-I344 HydrophobicContact CG1-CD1 3.49Å; V286-I344 VanDerWaalsContact CG1-CD1 3.49Å; V290-I344 HydrophobicContact CB-CG1 4.28Å; V290-I344 HydrophobicContact CB-CG2 4.37Å; V290-I344 HydrophobicContact CG1-CG2 4.29Å; V290-I344 HydrophobicContact CG2-CD1 3.81Å; V290-I344 HydrophobicContact CG2-CG1 3.78Å; V290-I344 HydrophobicContact CG2-CG2 3.96Å; V294-I344 HydrophobicContact CG2-CD1 3.9Å; V294-I344 HydrophobicContact CG2-CG1 3.55Å; I340-I344 HydrophobicContact CG2-CD1 4.02Å; I340-I344 WeakPolarHBondContact O-CG1 3.36Å; I340-I344 PolarHBondContact O-N 3.35Å; E341-I344 WeakPolarHBondContact O-CB 3.11Å; E341-I344 PolarHBondContact O-N 3.4Å; A342-I344 PolarHBondContact O-N 3.32Å; I344-L346 PolarHBondContact O-N 3.29Å; I344-R347 PolarHBondContact O-N 2.95Å; I344-T348 WeakPolarHBondContact O-CB 3.14Å; I344-T348 PolarHBondContact O-N 3.08Å; I344-T348 PolarHBondContact O-OG1 2.95Å |
| 345 | A | 86.6 | Confident | 74.6 | Confident | 67 Ų | 67 | 84.7 Ų | 84.7 | 55% | 0.554 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -57.2 | -48.4 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | E341 A342 R347 | E341-A345 PolarHBondContact O-N 2.95Å; A342-A345 PolarHBondContact O-N 3.46Å; A345-R347 PolarHBondContact O-N 2.9Å |
| 346 | L | 78.8 | Confident | 71.8 | Confident | 147 Ų | 147 | 83.8 Ų | 83.8 | 77% | 0.77 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.8 | -18.1 | -178.1 | -72.1 | 165.9 | 0 | 0 | 0 | 114.4 | A342 I344 | A342-L346 VanDerWaalsContact O-CB 3.32Å; A342-L346 WeakPolarHBondContact O-CB 3.36Å; A342-L346 WeakPolarHBondContact O-CG 3.45Å; A342-L346 PolarHBondContact O-N 3.45Å; I344-L346 PolarHBondContact O-N 3.29Å |
| 347 | R | 77.3 | Confident | 69.5 | Low | 160 Ų | 160 | 90.2 Ų | 90.2 | 60% | 0.604 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.6 | -15.6 | -172.4 | -64.9 | 177.2 | 167.2 | -149.8 | -11.3 | 114.4 | H343 I344 A345 G349 | H343-R347 PolarHBondContact CE1-NE 3.34Å; H343-R347 PolarHBondContact CE1-NH1 2.96Å; H343-R347 VanDerWaalsContact NE2-CD 3.3Å; H343-R347 WeakPolarHBondContact NE2-CD 3.26Å; H343-R347 PolarHBondContact NE2-NE 3.11Å; H343-R347 PolarHBondContact NE2-NH1 2.78Å; H343-R347 WeakPolarHBondContact O-CB 3.5Å; I344-R347 PolarHBondContact O-N 2.95Å; A345-R347 PolarHBondContact O-N 2.9Å; R347-G349 VanDerWaalsContact C-N 3.32Å |
| 348 | T | 77.5 | Confident | 67.1 | Low | 59 Ų | 59 | 88.9 Ų | 88.9 | 36% | 0.362 | 57% | 0.574 | S | S | . | * | S | Bend | trans | -99.7 | 16 | 172.5 | -35.6 | 0 | 0 | 0 | 0 | 110.5 | V290 I344 S350 | V290-T348 HydrophobicContact CG1-CG2 3.82Å; V290-T348 WeakPolarHBondContact CG1-OG1 3.16Å; I344-T348 WeakPolarHBondContact O-CB 3.14Å; I344-T348 PolarHBondContact O-N 3.08Å; I344-T348 PolarHBondContact O-OG1 2.95Å; T348-S350 PolarHBondContact O-N 3.31Å |
| 349 | G | 56.8 | Low | 64.8 | Low | 55 Ų | 55 | 89.3 Ų | 89.3 | 57% | 0.567 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.5 | 103.8 | -169.4 | 0 | 0 | 0 | 0 | 0 | 114 | R347 | R347-G349 VanDerWaalsContact C-N 3.32Š|
| 350 | S | 55.7 | Low | 62.3 | Low | 129 Ų | 129 | 92.7 Ų | 92.7 | 90% | 0.902 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 39.2 | 72.2 | 168.2 | -154.1 | 0 | 0 | 0 | 0 | 116.7 | T348 | T348-S350 PolarHBondContact O-N 3.31Š|
| 351 | C | 41.1 | Very low | 59.9 | Low | 119 Ų | 119 | 99 Ų | 99 | 80% | 0.804 | 64% | 0.639 | S | S | * | * | trans | -140 | 60.7 | 166.4 | 58.6 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 352 | G | 38.5 | Very low | 57.7 | Low | 73 Ų | 73 | 101 Ų | 101 | 75% | 0.753 | 66% | 0.662 | S | S | * | * | trans | 147.9 | 115.9 | 163 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 353 | G | 41.1 | Very low | 55.7 | Low | 77 Ų | 77 | 105.1 Ų | 105.1 | 79% | 0.794 | 68% | 0.678 | S | S | * | * | trans | -70.8 | 179.2 | 148.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 354 | V | 47.1 | Very low | 53.6 | Low | 140 Ų | 140 | 114.1 Ų | 114.1 | 85% | 0.848 | 72% | 0.717 | S | S | * | * | cis | -143.2 | 178.1 | 10.6 | -76.7 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 355 | E | 42.1 | Very low | 51.7 | Low | 183 Ų | 183 | 119.2 Ų | 119.2 | 86% | 0.855 | 74% | 0.741 | S | S | * | * | cis | -145.7 | 152.1 | 21.6 | -57.8 | 170.6 | 110.3 | 0 | 0 | 111.5 | ||||
| 356 | A | 35.7 | Very low | 49.8 | Very low | 94 Ų | 94 | 126.3 Ų | 126.3 | 78% | 0.777 | 76% | 0.759 | S | S | * | * | trans | -147.9 | 126.1 | 152.8 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 357 | P | 45.8 | Very low | 48.3 | Very low | 135 Ų | 135 | 126.7 Ų | 126.7 | 88% | 0.877 | 76% | 0.762 | S | S | * | * | trans | -85.9 | 133.6 | -168.2 | 31.8 | -34.3 | 0 | 0 | 0 | 113.2 | ||||
| 358 | G | 45 | Very low | 46.2 | Very low | 76 Ų | 76 | 122.2 Ų | 122.2 | 78% | 0.784 | 77% | 0.766 | S | S | * | * | trans | 90.5 | 78.7 | 155.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 359 | V | 44.3 | Very low | 44.3 | Very low | 145 Ų | 145 | 125.9 Ų | 125.9 | 88% | 0.879 | 79% | 0.788 | S | S | * | * | trans | -151.7 | 150.6 | 132.3 | 126 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 360 | D | 39.8 | Very low | 43.3 | Very low | 119 Ų | 119 | 128.5 Ų | 128.5 | 64% | 0.636 | 79% | 0.789 | S | S | * | * | trans | -107.9 | 169.6 | -167.6 | 56.6 | -35.4 | 0 | 0 | 0 | 113.9 | ||||
| 361 | N | 44.5 | Very low | 42.4 | Very low | 133 Ų | 133 | 128.1 Ų | 128.1 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | trans | 59.5 | 97.1 | 163.1 | -49 | -40.4 | 0 | 0 | 0 | 119 | ||||
| 362 | S | 44.6 | Very low | 41.9 | Very low | 121 Ų | 121 | 127.1 Ų | 127.1 | 85% | 0.846 | 78% | 0.776 | S | S | * | * | trans | -162.2 | 61.7 | 140.8 | -82.9 | 0 | 0 | 0 | 0 | 111.2 | F364 | S362-F364 PolarHBondContact O-N 3.09Š| ||
| 363 | D | 48.1 | Very low | 41.6 | Very low | 126 Ų | 126 | 132.5 Ų | 132.5 | 67% | 0.674 | 78% | 0.779 | S | S | * | * | trans | -81.8 | 56.7 | 179.4 | -166.2 | 20.8 | 0 | 0 | 0 | 112.1 | Q365 | D363-Q365 VanDerWaalsContact CG-NE2 3.27Å; D363-Q365 PolarHBondContact O-N 2.75Å; D363-Q365 WeakPolarHBondContact OD1-CG 3.39Å; D363-Q365 PolarHBondContact OD1-NE2 3.26Å; D363-Q365 PolarHBondContact OD2-NE2 3.02Å | ||
| 364 | F | 45.8 | Very low | 41.3 | Very low | 209 Ų | 209 | 136.2 Ų | 136.2 | 92% | 0.917 | 78% | 0.78 | S | S | * | * | trans | -89.1 | 89.9 | 171.2 | -103.2 | -83.9 | 0 | 0 | 0 | 109.8 | S362 | S362-F364 PolarHBondContact O-N 3.09Š| ||
| 365 | Q | 50.1 | Low | 40.5 | Very low | 137 Ų | 137 | 135.2 Ų | 135.2 | 64% | 0.64 | 77% | 0.774 | S | S | * | * | trans | -70.7 | 143.9 | -165.6 | -66.8 | 173.8 | 0.3 | 0 | 0 | 113.7 | D363 N367 | D363-Q365 VanDerWaalsContact CG-NE2 3.27Å; D363-Q365 PolarHBondContact O-N 2.75Å; D363-Q365 WeakPolarHBondContact OD1-CG 3.39Å; D363-Q365 PolarHBondContact OD1-NE2 3.26Å; D363-Q365 PolarHBondContact OD2-NE2 3.02Å; Q365-N367 PolarHBondContact O-N 3.28Å | ||
| 366 | F | 45.7 | Very low | 40.1 | Very low | 215 Ų | 215 | 131.8 Ų | 131.8 | 94% | 0.943 | 77% | 0.771 | S | S | * | * | trans | -55 | 92.3 | 162.8 | 169.7 | -97 | 0 | 0 | 0 | 110.7 | ||||
| 367 | N | 47.3 | Very low | 39.8 | Very low | 156 Ų | 156 | 134.7 Ų | 134.7 | 83% | 0.834 | 77% | 0.773 | S | S | * | * | trans | -159.5 | 136.5 | 166.4 | -146.4 | -6.5 | 0 | 0 | 0 | 111.9 | Q365 | Q365-N367 PolarHBondContact O-N 3.28Š| ||
| 368 | G | 33.5 | Very low | 39.2 | Very low | 66 Ų | 66 | 135.2 Ų | 135.2 | 68% | 0.68 | 77% | 0.768 | S | S | * | * | trans | 81.4 | 149.8 | -170.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 369 | T | 38.7 | Very low | 39.5 | Very low | 135 Ų | 135 | 136.7 Ų | 136.7 | 83% | 0.828 | 76% | 0.764 | S | S | * | * | cis | -131.4 | 144.1 | 10.8 | -35 | 0 | 0 | 0 | 0 | 111 | ||||
| 370 | D | 34.8 | Very low | 38.7 | Very low | 110 Ų | 110 | 136.7 Ų | 136.7 | 59% | 0.588 | 76% | 0.764 | S | S | * | * | trans | -73.1 | 168 | 162.9 | 65.5 | -70.8 | 0 | 0 | 0 | 111.6 | S372 | D370-S372 WeakPolarHBondContact OD2-CB 3.23Å; D370-S372 PolarHBondContact OD2-N 3.36Å; D370-S372 PolarHBondContact OD2-OG 2.92Å | ||
| 371 | V | 37.4 | Very low | 38.2 | Very low | 122 Ų | 122 | 134.6 Ų | 134.6 | 74% | 0.739 | 77% | 0.771 | S | S | * | * | trans | -122.9 | 68.9 | 169.7 | -77.5 | 0 | 0 | 0 | 0 | 110.2 | F373 | V371-F373 HydrophobicContact CB-CE2 3.96Å; V371-F373 HydrophobicContact CB-CZ 4.35Å | ||
| 372 | S | 31 | Very low | 37.6 | Very low | 98 Ų | 98 | 135.6 Ų | 135.6 | 69% | 0.685 | 78% | 0.781 | S | S | * | * | trans | -71.5 | 126 | 167.6 | -61.7 | 0 | 0 | 0 | 0 | 110.7 | D370 | D370-S372 WeakPolarHBondContact OD2-CB 3.23Å; D370-S372 PolarHBondContact OD2-N 3.36Å; D370-S372 PolarHBondContact OD2-OG 2.92Å | ||
| 373 | F | 31.8 | Very low | 36.8 | Very low | 186 Ų | 186 | 133 Ų | 133 | 82% | 0.816 | 77% | 0.773 | S | S | * | * | trans | -118.3 | 122.8 | 171.2 | -64 | -73.1 | 0 | 0 | 0 | 111.4 | V371 | V371-F373 HydrophobicContact CB-CE2 3.96Å; V371-F373 HydrophobicContact CB-CZ 4.35Å | ||
| 374 | D | 33.5 | Very low | 36 | Very low | 155 Ų | 155 | 136.1 Ų | 136.1 | 83% | 0.829 | 78% | 0.784 | S | S | * | * | trans | 85.3 | 152.5 | 155.7 | -131.2 | -67 | 0 | 0 | 0 | 121.8 | ||||
| 375 | T | 31.1 | Very low | 35.4 | Very low | 118 Ų | 118 | 130.9 Ų | 130.9 | 72% | 0.724 | 78% | 0.779 | S | S | * | * | trans | 68.5 | 77 | 160.8 | -47.1 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 376 | S | 33.7 | Very low | 34.4 | Very low | 112 Ų | 112 | 127.3 Ų | 127.3 | 78% | 0.783 | 78% | 0.779 | S | S | * | * | trans | -61.6 | 134.7 | 145.5 | -59.5 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 377 | L | 29.6 | Very low | 33.5 | Very low | 155 Ų | 155 | 128.3 Ų | 128.3 | 81% | 0.812 | 78% | 0.777 | S | S | * | * | -178.9 | 145.4 | 124.6 | -99.7 | 166.1 | 0 | 0 | 0 | 114.3 | |||||
| 378 | N | 33.6 | Very low | 32.8 | Very low | 146 Ų | 146 | 127.2 Ų | 127.2 | 78% | 0.781 | 77% | 0.77 | S | S | * | * | trans | 73 | 148.7 | 163.6 | -76.5 | 3.6 | 0 | 0 | 0 | 120.3 | ||||
| 379 | P | 49.7 | Very low | 32.8 | Very low | 106 Ų | 106 | 132.4 Ų | 132.4 | 69% | 0.688 | 78% | 0.776 | S | S | * | * | trans | -138.5 | -168 | -138 | 35 | -11.2 | 0 | 0 | 0 | 115.6 | ||||
| 380 | V | 29.1 | Very low | 32.4 | Very low | 145 Ų | 145 | 130.9 Ų | 130.9 | 88% | 0.879 | 78% | 0.777 | S | S | * | * | trans | 77.2 | 125.9 | 167.6 | -171.5 | 0 | 0 | 0 | 0 | 116 | ||||
| 381 | G | 29.5 | Very low | 32.1 | Very low | 76 Ų | 76 | 129 Ų | 129 | 78% | 0.784 | 78% | 0.784 | S | S | * | * | trans | 168.3 | 80.5 | 170 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 382 | V | 30.4 | Very low | 31.8 | Very low | 153 Ų | 153 | 127.8 Ų | 127.8 | 93% | 0.927 | 79% | 0.787 | S | S | * | * | trans | -61.3 | 149.6 | 178.7 | -175.5 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 383 | G | 29.7 | Very low | 31.7 | Very low | 66 Ų | 66 | 128.9 Ų | 128.9 | 68% | 0.68 | 79% | 0.794 | S | S | * | * | trans | 105.7 | 128.8 | 162 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 384 | E | 30.6 | Very low | 31.7 | Very low | 193 Ų | 193 | 125.5 Ų | 125.5 | 90% | 0.902 | 79% | 0.794 | S | S | * | * | cis | 101.3 | 115.2 | 29.7 | -171.4 | 171.8 | 143.7 | 0 | 0 | 113.9 | ||||
| 385 | A | 33.7 | Very low | 32.4 | Very low | 98 Ų | 98 | 123.4 Ų | 123.4 | 81% | 0.81 | 79% | 0.789 | S | S | * | * | trans | 58 | 157.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 386 | G | 27.5 | Very low | 32.4 | Very low | 63 Ų | 63 | 123.4 Ų | 123.4 | 65% | 0.649 | 79% | 0.794 | S | S | * | * | cis | 162.5 | 157.7 | -11.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 387 | W | 27.4 | Very low | 32.1 | Very low | 236 Ų | 236 | 121.7 Ų | 121.7 | 89% | 0.894 | 79% | 0.793 | S | S | * | * | trans | 70.1 | 123.9 | 151.7 | -67.1 | 111.7 | 0 | 0 | 0 | 123 | ||||
| 388 | L | 32 | Very low | 32.1 | Very low | 133 Ų | 133 | 118 Ų | 118 | 70% | 0.696 | 79% | 0.793 | S | S | * | * | trans | 86.1 | 110.5 | 137.3 | -60 | 166.2 | 0 | 0 | 0 | 123.9 | ||||
| 389 | H | 33.9 | Very low | 31.9 | Very low | 174 Ų | 174 | 116.4 Ų | 116.4 | 81% | 0.806 | 79% | 0.793 | S | S | * | * | 47.4 | 127.9 | 126.3 | -81.2 | -65.1 | 0 | 0 | 0 | 125.4 | |||||
| 390 | A | 30.8 | Very low | 31 | Very low | 103 Ų | 103 | 119 Ų | 119 | 85% | 0.851 | 80% | 0.801 | S | S | * | * | trans | 62.1 | 152.8 | 133.9 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 391 | G | 27.3 | Very low | 31 | Very low | 70 Ų | 70 | 120 Ų | 120 | 72% | 0.722 | 80% | 0.8 | S | S | * | * | cis | 165.5 | 168.7 | -9.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 392 | A | 32 | Very low | 31.9 | Very low | 98 Ų | 98 | 121.5 Ų | 121.5 | 81% | 0.81 | 80% | 0.796 | S | S | * | * | trans | 70.3 | 155.3 | 160.6 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 393 | S | 29.8 | Very low | 31.9 | Very low | 120 Ų | 120 | 120.7 Ų | 120.7 | 84% | 0.839 | 79% | 0.791 | S | S | * | * | trans | 92.2 | 115.3 | 154.8 | -42.5 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 394 | S | 31.9 | Very low | 31.8 | Very low | 115 Ų | 115 | 122.1 Ų | 122.1 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | trans | -91.7 | 178.4 | 156.4 | -43.1 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 395 | P | 47.4 | Very low | 31.8 | Very low | 111 Ų | 111 | 120 Ų | 120 | 72% | 0.721 | 78% | 0.784 | S | S | * | * | -155.6 | 171.3 | 79.5 | 40.5 | -20.7 | 0 | 0 | 0 | 117.7 | |||||
| 396 | S | 30.8 | Very low | 31.7 | Very low | 119 Ų | 119 | 121.1 Ų | 121.1 | 83% | 0.832 | 79% | 0.786 | S | S | * | * | trans | 59.2 | 145.1 | 151.1 | 57.1 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 397 | G | 28.5 | Very low | 31.6 | Very low | 75 Ų | 75 | 121.4 Ų | 121.4 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | cis | 163.3 | 137.8 | -9.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 398 | G | 29 | Very low | 31.8 | Very low | 79 Ų | 79 | 114.8 Ų | 114.8 | 81% | 0.814 | 78% | 0.778 | S | S | * | * | trans | 76.3 | 167.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 399 | S | 29.9 | Very low | 31.7 | Very low | 111 Ų | 111 | 116.9 Ų | 116.9 | 78% | 0.776 | 79% | 0.785 | S | S | * | * | cis | -164.3 | 156.3 | -21 | -154.7 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 400 | L | 29.4 | Very low | 31.5 | Very low | 161 Ų | 161 | 118 Ų | 118 | 84% | 0.843 | 78% | 0.782 | S | S | * | * | trans | 72 | 158.8 | 166.3 | -53.8 | -178.4 | 0 | 0 | 0 | 119.9 | ||||
| 401 | L | 28.7 | Very low | 31.5 | Very low | 165 Ų | 165 | 119.4 Ų | 119.4 | 86% | 0.864 | 78% | 0.78 | S | S | * | * | trans | -111.6 | -159.1 | -177 | -47.9 | 170.8 | 0 | 0 | 0 | 108 | ||||
| 402 | P | 50 | Low | 31.5 | Very low | 109 Ų | 109 | 123.2 Ų | 123.2 | 71% | 0.708 | 78% | 0.783 | S | S | * | * | cis | -136.9 | -155.3 | -10.9 | 27.1 | 0.3 | 0 | 0 | 0 | 113.2 | ||||
| 403 | V | 29.4 | Very low | 31.5 | Very low | 135 Ų | 135 | 122.9 Ų | 122.9 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | 81.8 | 143.7 | 158.6 | 176.8 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 404 | S | 27.5 | Very low | 31.4 | Very low | 97 Ų | 97 | 124.5 Ų | 124.5 | 68% | 0.678 | 78% | 0.775 | S | S | * | * | cis | -175.1 | -180 | -33 | -159.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 405 | I | 30.2 | Very low | 31.5 | Very low | 148 Ų | 148 | 125.5 Ų | 125.5 | 76% | 0.759 | 77% | 0.77 | S | S | * | * | trans | 79.2 | 134.5 | 152.1 | -75.1 | 165.4 | 0 | 0 | 0 | 120.2 | ||||
| 406 | S | 31.3 | Very low | 30.6 | Very low | 122 Ų | 122 | 124.9 Ų | 124.9 | 85% | 0.853 | 77% | 0.768 | S | S | * | * | trans | 65.7 | 152.5 | 163.2 | -69.6 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 407 | G | 26.3 | Very low | 30.5 | Very low | 68 Ų | 68 | 124.4 Ų | 124.4 | 70% | 0.701 | 76% | 0.764 | S | S | * | * | cis | 156.6 | 129.3 | -10.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 408 | S | 31.7 | Very low | 30.6 | Very low | 97 Ų | 97 | 128 Ų | 128 | 68% | 0.678 | 77% | 0.772 | S | S | * | * | trans | 65.3 | 102.2 | 161.8 | -63.8 | 0 | 0 | 0 | 0 | 122 | R410 | S408-R410 PolarHBondContact O-NH1 2.94Š| ||
| 409 | Q | 28.8 | Very low | 30.7 | Very low | 177 Ų | 177 | 130.7 Ų | 130.7 | 83% | 0.827 | 77% | 0.772 | S | S | * | * | trans | 67.7 | 171.5 | 146.6 | -55.2 | 174.9 | -21.1 | 0 | 0 | 115.4 | ||||
| 410 | R | 30.2 | Very low | 30.9 | Very low | 198 Ų | 198 | 136.8 Ų | 136.8 | 75% | 0.747 | 78% | 0.778 | S | S | * | * | cis | -163.6 | 151.1 | 21.1 | 14.2 | -175.7 | 177.1 | -66.8 | -11.9 | 111.1 | S408 | S408-R410 PolarHBondContact O-NH1 2.94Š| ||
| 411 | V | 31.1 | Very low | 30.8 | Very low | 133 Ų | 133 | 137.3 Ų | 137.3 | 81% | 0.806 | 78% | 0.778 | S | S | * | * | trans | 60.9 | 100.1 | 148.3 | -177 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 412 | N | 28.1 | Very low | 31.1 | Very low | 149 Ų | 149 | 135.1 Ų | 135.1 | 80% | 0.797 | 78% | 0.776 | S | S | * | * | 61 | 145.2 | 117.5 | -147.3 | 24.5 | 0 | 0 | 0 | 124.5 | |||||
| 413 | S | 31.6 | Very low | 30.2 | Very low | 92 Ų | 92 | 134.9 Ų | 134.9 | 64% | 0.643 | 78% | 0.777 | S | S | * | * | trans | 73.8 | 85.5 | 153.4 | -66.2 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 414 | N | 28.6 | Very low | 30.5 | Very low | 154 Ų | 154 | 135.3 Ų | 135.3 | 82% | 0.824 | 78% | 0.781 | S | S | * | * | 69.4 | 164.6 | 111.9 | -156.8 | 21 | 0 | 0 | 0 | 122 | |||||
| 415 | I | 32.7 | Very low | 30.5 | Very low | 136 Ų | 136 | 141.6 Ų | 141.6 | 70% | 0.697 | 79% | 0.791 | S | S | * | * | trans | 89.9 | 82.2 | 165.3 | -49.2 | -173.2 | 0 | 0 | 0 | 117.3 | ||||
| 416 | S | 28.3 | Very low | 30.5 | Very low | 98 Ų | 98 | 145 Ų | 145 | 69% | 0.685 | 79% | 0.794 | S | S | * | * | 80.6 | 119.4 | 126.2 | -55.6 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 417 | S | 30.1 | Very low | 30.5 | Very low | 108 Ų | 108 | 145.7 Ų | 145.7 | 76% | 0.755 | 79% | 0.788 | S | S | * | * | trans | 61 | 94.5 | 136.2 | 62.3 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 418 | T | 30.3 | Very low | 30.9 | Very low | 151 Ų | 151 | 148.7 Ų | 148.7 | 93% | 0.926 | 79% | 0.788 | S | S | * | * | -149.1 | 154 | 123.6 | -9.8 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 419 | V | 31 | Very low | 31.1 | Very low | 135 Ų | 135 | 149.7 Ų | 149.7 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -100.6 | 119.4 | -159.1 | 178.9 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 420 | R | 34.2 | Very low | 31.4 | Very low | 239 Ų | 239 | 146.3 Ų | 146.3 | 90% | 0.902 | 79% | 0.791 | S | S | * | * | trans | -157.7 | 84.6 | 148.2 | -72.8 | -155 | -159.6 | -161.3 | 8.5 | 112.4 | ||||
| 421 | M | 27.3 | Very low | 31.5 | Very low | 173 Ų | 173 | 142 Ų | 142 | 85% | 0.852 | 79% | 0.792 | S | S | * | * | trans | -143.7 | 136.1 | 155.6 | -72.7 | -174.9 | 156.2 | 0 | 0 | 106.5 | ||||
| 422 | S | 34.9 | Very low | 31.8 | Very low | 118 Ų | 118 | 140.7 Ų | 140.7 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | cis | 73.8 | 67.9 | 19.7 | -43.8 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 423 | S | 30.1 | Very low | 32 | Very low | 104 Ų | 104 | 141.8 Ų | 141.8 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | trans | -149 | 140.3 | 154.2 | 52.9 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 424 | T | 36.9 | Very low | 31.9 | Very low | 145 Ų | 145 | 140.4 Ų | 140.4 | 89% | 0.89 | 79% | 0.793 | S | S | * | * | trans | -67 | 138.6 | 163.8 | -5.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 425 | Y | 27.6 | Very low | 32.1 | Very low | 228 Ų | 228 | 139.5 Ų | 139.5 | 89% | 0.894 | 80% | 0.799 | S | S | * | * | trans | -77 | 165.6 | -167.3 | -132.9 | -101.5 | 0 | 0 | 0 | 114.4 | ||||
| 426 | R | 30.1 | Very low | 31.7 | Very low | 220 Ų | 220 | 136.9 Ų | 136.9 | 83% | 0.83 | 81% | 0.806 | S | S | * | * | trans | -113.2 | 141.5 | -171.8 | -84.7 | 179.7 | 170 | 175.7 | -4.3 | 113.2 | ||||
| 427 | N | 31.5 | Very low | 31.9 | Very low | 136 Ų | 136 | 137.3 Ų | 137.3 | 73% | 0.727 | 81% | 0.809 | S | S | * | * | 57.3 | 145 | 128.3 | -138.5 | 94.1 | 0 | 0 | 0 | 122.7 | |||||
| 428 | D | 33.3 | Very low | 32.1 | Very low | 131 Ų | 131 | 137.6 Ų | 137.6 | 70% | 0.701 | 81% | 0.811 | S | S | * | * | trans | -45.3 | 157.7 | 174.9 | -13.8 | -57.3 | 0 | 0 | 0 | 118.9 | ||||
| 429 | S | 36 | Very low | 32.2 | Very low | 118 Ų | 118 | 135.7 Ų | 135.7 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | trans | -172.8 | 162.3 | 135.2 | -74.3 | 0 | 0 | 0 | 0 | 109 | ||||
| 430 | S | 34.8 | Very low | 32.1 | Very low | 106 Ų | 106 | 133.2 Ų | 133.2 | 74% | 0.741 | 80% | 0.797 | S | S | * | * | cis | -141.1 | 173.3 | 15.4 | -50.8 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 431 | S | 32.9 | Very low | 31.7 | Very low | 108 Ų | 108 | 129.5 Ų | 129.5 | 76% | 0.755 | 80% | 0.795 | S | S | * | * | cis | -150.8 | 136.1 | 24.5 | -66.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 432 | S | 37.8 | Very low | 32 | Very low | 105 Ų | 105 | 126.5 Ų | 126.5 | 73% | 0.734 | 79% | 0.792 | S | S | * | * | 73.9 | 133.1 | 71.7 | -52.8 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 433 | L | 32.7 | Very low | 31.6 | Very low | 172 Ų | 172 | 130.3 Ų | 130.3 | 90% | 0.901 | 79% | 0.793 | S | S | * | * | cis | -136.5 | 175.8 | 10.9 | -70.7 | 172 | 0 | 0 | 0 | 110.7 | ||||
| 434 | G | 29.9 | Very low | 31.6 | Very low | 63 Ų | 63 | 135.3 Ų | 135.3 | 65% | 0.649 | 80% | 0.798 | S | S | * | * | cis | 144.4 | 146.9 | -9 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 435 | S | 32.8 | Very low | 31.1 | Very low | 135 Ų | 135 | 132 Ų | 132 | 94% | 0.944 | 79% | 0.792 | S | S | * | * | trans | 74.4 | 137.4 | 165.7 | -58 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 436 | G | 24.3 | Very low | 31.1 | Very low | 81 Ų | 81 | 125.4 Ų | 125.4 | 84% | 0.835 | 79% | 0.794 | S | S | * | * | trans | 169.6 | 42.8 | 178 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 437 | S | 32.5 | Very low | 31 | Very low | 107 Ų | 107 | 118.9 Ų | 118.9 | 75% | 0.748 | 80% | 0.795 | S | S | * | * | trans | -42.3 | 158.3 | -169.8 | -46.9 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 438 | S | 32.5 | Very low | 31.1 | Very low | 114 Ų | 114 | 120.6 Ų | 120.6 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | trans | 67.2 | 158 | 152.8 | 29.1 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 439 | S | 32.4 | Very low | 30.9 | Very low | 112 Ų | 112 | 117.7 Ų | 117.7 | 78% | 0.783 | 81% | 0.805 | S | S | * | * | cis | -176.2 | 159.5 | -5.9 | 43.3 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 440 | A | 30.1 | Very low | 30.8 | Very low | 82 Ų | 82 | 118.7 Ų | 118.7 | 68% | 0.678 | 80% | 0.801 | S | S | * | * | cis | -171.3 | -170.7 | -15.5 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 441 | D | 26.3 | Very low | 30.6 | Very low | 161 Ų | 161 | 125.3 Ų | 125.3 | 86% | 0.861 | 81% | 0.81 | S | S | * | * | trans | 66.3 | 167.5 | 165.4 | -65.4 | -51.3 | 0 | 0 | 0 | 120.4 | ||||
| 442 | S | 32.1 | Very low | 30.4 | Very low | 111 Ų | 111 | 128.8 Ų | 128.8 | 78% | 0.776 | 82% | 0.817 | S | S | * | * | trans | -144.5 | 166.8 | -170.7 | -59.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 443 | F | 27.5 | Very low | 30 | Very low | 197 Ų | 197 | 127.7 Ų | 127.7 | 86% | 0.864 | 81% | 0.813 | S | S | * | * | trans | -178.9 | 143.3 | 137.3 | -114.9 | -94.9 | 0 | 0 | 0 | 111.9 | ||||
| 444 | Y | 29.5 | Very low | 29.6 | Very low | 210 Ų | 210 | 125.7 Ų | 125.7 | 82% | 0.824 | 80% | 0.804 | S | S | * | * | trans | 25.2 | 111.2 | 162.2 | -87.5 | -111 | 0 | 0 | 0 | 122.4 | ||||
| 445 | G | 25.7 | Very low | 29.4 | Very low | 74 Ų | 74 | 131.4 Ų | 131.4 | 76% | 0.763 | 81% | 0.811 | S | S | * | * | 70 | 90.3 | 87.7 | 0 | 0 | 0 | 0 | 0 | 121.4 | |||||
| 446 | G | 29 | Very low | 29.1 | Very low | 90 Ų | 90 | 129.4 Ų | 129.4 | 93% | 0.928 | 80% | 0.797 | S | S | * | * | trans | 78 | 118.5 | 131 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 447 | G | 27.3 | Very low | 29.8 | Very low | 84 Ų | 84 | 131.3 Ų | 131.3 | 87% | 0.866 | 80% | 0.795 | S | S | * | * | trans | -172.9 | 143.7 | 166.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 448 | N | 33.1 | Very low | 29.6 | Very low | 172 Ų | 172 | 130.7 Ų | 130.7 | 92% | 0.92 | 79% | 0.787 | S | S | * | * | trans | -134.1 | 123.9 | -174 | -175.1 | 79.7 | 0 | 0 | 0 | 111.2 | ||||
| 449 | G | 28.9 | Very low | 29.5 | Very low | 69 Ų | 69 | 134.4 Ų | 134.4 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | trans | 168 | 123.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 450 | N | 35.2 | Very low | 29.8 | Very low | 140 Ų | 140 | 135.1 Ų | 135.1 | 75% | 0.749 | 79% | 0.791 | S | S | * | * | trans | -72.5 | 152.2 | 171.9 | -43 | 20.7 | 0 | 0 | 0 | 111.9 | ||||
| 451 | R | 30.5 | Very low | 29.6 | Very low | 245 Ų | 245 | 139.6 Ų | 139.6 | 93% | 0.925 | 80% | 0.795 | S | S | * | * | -166.7 | 177.5 | 129.3 | -111.4 | 147.1 | -100.5 | -101.8 | 5.1 | 113.4 | |||||
| 452 | M | 28.9 | Very low | 29.5 | Very low | 181 Ų | 181 | 138.3 Ų | 138.3 | 89% | 0.892 | 79% | 0.789 | S | S | * | * | trans | -105.3 | 171.9 | -157.9 | -59.9 | 159.6 | 165.7 | 0 | 0 | 113.9 | ||||
| 453 | A | 28.4 | Very low | 29.3 | Very low | 81 Ų | 81 | 136.7 Ų | 136.7 | 67% | 0.669 | 78% | 0.782 | S | S | * | * | trans | 70.8 | 155.3 | 154.8 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 454 | D | 25 | Very low | 29.2 | Very low | 130 Ų | 130 | 134.7 Ų | 134.7 | 70% | 0.695 | 78% | 0.78 | S | S | * | * | cis | -166.7 | 174.6 | -28 | -94.7 | -35.4 | 0 | 0 | 0 | 108.7 | ||||
| 455 | F | 25.7 | Very low | 29.1 | Very low | 183 Ų | 183 | 129 Ų | 129 | 80% | 0.803 | 78% | 0.776 | S | S | * | * | trans | 73.5 | 105.4 | 160.3 | -55 | -64.5 | 0 | 0 | 0 | 122 | ||||
| 456 | S | 27.2 | Very low | 29.3 | Very low | 94 Ų | 94 | 132.7 Ų | 132.7 | 66% | 0.657 | 78% | 0.779 | S | S | * | * | 22.9 | 150.3 | 118.6 | -42.9 | 0 | 0 | 0 | 0 | 122.3 | |||||
| 457 | P | 37.9 | Very low | 29.3 | Very low | 121 Ų | 121 | 134.9 Ų | 134.9 | 79% | 0.786 | 77% | 0.769 | S | S | * | * | -124.5 | 130.1 | 80.8 | 3.4 | 18.6 | 0 | 0 | 0 | 113.8 | |||||
| 458 | T | 27.5 | Very low | 29.3 | Very low | 94 Ų | 94 | 137.2 Ų | 137.2 | 58% | 0.577 | 76% | 0.762 | S | S | * | * | 72.3 | 104.5 | 69.6 | 64.6 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 459 | F | 30.9 | Very low | 29.3 | Very low | 192 Ų | 192 | 135.5 Ų | 135.5 | 84% | 0.842 | 75% | 0.752 | S | S | * | * | 85.2 | 137.5 | 95.4 | -66.3 | -44.5 | 0 | 0 | 0 | 115.5 | |||||
| 460 | P | 38.9 | Very low | 29.4 | Very low | 127 Ų | 127 | 138.7 Ų | 138.7 | 83% | 0.825 | 75% | 0.753 | S | S | * | * | -142.7 | -179.1 | 81.1 | 28 | -6 | 0 | 0 | 0 | 115.2 | |||||
| 461 | F | 25.1 | Very low | 29.3 | Very low | 175 Ų | 175 | 137.9 Ų | 137.9 | 77% | 0.768 | 75% | 0.749 | S | S | * | * | cis | -178.1 | 126.1 | -33.6 | 177.6 | -111.3 | 0 | 0 | 0 | 111.3 | ||||
| 462 | N | 25.6 | Very low | 29.2 | Very low | 135 Ų | 135 | 133.6 Ų | 133.6 | 72% | 0.722 | 74% | 0.744 | S | S | * | * | trans | 63.4 | 161 | 158.7 | -129.1 | 11.7 | 0 | 0 | 0 | 118.1 | ||||
| 463 | A | 27.8 | Very low | 29.4 | Very low | 76 Ų | 76 | 129.5 Ų | 129.5 | 63% | 0.628 | 73% | 0.733 | S | S | * | * | cis | -150.8 | 147.1 | 0.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 464 | N | 26 | Very low | 29.5 | Very low | 156 Ų | 156 | 131.4 Ų | 131.4 | 83% | 0.834 | 74% | 0.742 | S | S | * | * | trans | 21.5 | 109.5 | 143.9 | -178.1 | 41.9 | 0 | 0 | 0 | 121.3 | ||||
| 465 | A | 27.3 | Very low | 29.8 | Very low | 89 Ų | 89 | 130.8 Ų | 130.8 | 74% | 0.736 | 75% | 0.747 | S | S | * | * | -177 | 127.3 | 123.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 466 | N | 28.8 | Very low | 30 | Very low | 153 Ų | 153 | 127.4 Ų | 127.4 | 82% | 0.818 | 75% | 0.747 | S | S | * | * | trans | 45.5 | 130.1 | 142.7 | -157.3 | 19.4 | 0 | 0 | 0 | 123.3 | ||||
| 467 | N | 29.2 | Very low | 30 | Very low | 136 Ų | 136 | 128.3 Ų | 128.3 | 73% | 0.727 | 75% | 0.753 | S | S | * | * | trans | 89.3 | 139.5 | 149 | -151.5 | 14.6 | 0 | 0 | 0 | 121.4 | ||||
| 468 | N | 27.9 | Very low | 29.6 | Very low | 133 Ų | 133 | 128.4 Ų | 128.4 | 71% | 0.711 | 76% | 0.757 | S | S | * | * | trans | 60 | 98.9 | 154 | -116.9 | -3.1 | 0 | 0 | 0 | 123.8 | ||||
| 469 | N | 31.6 | Very low | 29.7 | Very low | 135 Ų | 135 | 130.4 Ų | 130.4 | 72% | 0.722 | 77% | 0.769 | S | S | * | * | 64.1 | 146.9 | 124.1 | -154.7 | 21.9 | 0 | 0 | 0 | 123.2 | |||||
| 470 | N | 31.9 | Very low | 29.7 | Very low | 136 Ų | 136 | 126.8 Ų | 126.8 | 73% | 0.727 | 77% | 0.768 | S | S | * | * | trans | 64.3 | 156.5 | 175.1 | -93.9 | -4.7 | 0 | 0 | 0 | 116.4 | ||||
| 471 | N | 32.2 | Very low | 29.2 | Very low | 123 Ų | 123 | 129.8 Ų | 129.8 | 66% | 0.658 | 77% | 0.768 | S | S | * | * | cis | -143.3 | 164.3 | 6.3 | -160.4 | 5.8 | 0 | 0 | 0 | 111.2 | ||||
| 472 | N | 30.1 | Very low | 29.3 | Very low | 156 Ų | 156 | 133.3 Ų | 133.3 | 83% | 0.834 | 78% | 0.776 | S | S | * | * | trans | -144.2 | 130.8 | 155.7 | -173.7 | 14.2 | 0 | 0 | 0 | 109.5 | ||||
| 473 | S | 32 | Very low | 29.7 | Very low | 94 Ų | 94 | 136 Ų | 136 | 66% | 0.657 | 78% | 0.782 | S | S | * | * | trans | -151.7 | 119.9 | -170.5 | 57.5 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 474 | S | 31.7 | Very low | 29.6 | Very low | 122 Ų | 122 | 135.9 Ų | 135.9 | 85% | 0.853 | 79% | 0.788 | S | S | * | * | trans | -120 | 129 | 155.8 | 46.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 475 | S | 30.3 | Very low | 29.8 | Very low | 116 Ų | 116 | 136.2 Ų | 136.2 | 81% | 0.811 | 79% | 0.79 | S | S | * | * | trans | -86.3 | 168.7 | -178 | 50 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 476 | S | 30.3 | Very low | 29.8 | Very low | 112 Ų | 112 | 135.4 Ų | 135.4 | 78% | 0.783 | 79% | 0.79 | S | S | * | * | cis | -160.4 | 163.3 | -3.4 | 22.7 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 477 | S | 26.4 | Very low | 29.9 | Very low | 114 Ų | 114 | 135.5 Ų | 135.5 | 80% | 0.797 | 79% | 0.789 | S | S | * | * | cis | -155.6 | 132.7 | 40.4 | 39.8 | 0 | 0 | 0 | 0 | 113 | ||||
| 478 | S | 30.7 | Very low | 30 | Very low | 123 Ų | 123 | 136.7 Ų | 136.7 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | trans | -146.4 | 125.2 | 172.7 | -63.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 479 | T | 30 | Very low | 29.9 | Very low | 135 Ų | 135 | 136.3 Ų | 136.3 | 83% | 0.828 | 80% | 0.802 | S | S | * | * | trans | -97.5 | 101.6 | -178.3 | 50.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 480 | S | 29.6 | Very low | 29.9 | Very low | 117 Ų | 117 | 136.8 Ų | 136.8 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | trans | -143.3 | 119 | 167.2 | -68.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 481 | F | 27.8 | Very low | 29.6 | Very low | 189 Ų | 189 | 133.1 Ų | 133.1 | 83% | 0.829 | 81% | 0.805 | S | S | * | * | trans | -112.2 | 143.9 | 170.8 | -70.3 | -85 | 0 | 0 | 0 | 109.6 | ||||
| 482 | W | 27.7 | Very low | 29.6 | Very low | 250 Ų | 250 | 132.8 Ų | 132.8 | 95% | 0.947 | 81% | 0.812 | S | S | * | * | trans | -139.1 | 140.4 | 172.7 | -164.5 | -62.5 | 0 | 0 | 0 | 107.8 | ||||
| 483 | F | 34.1 | Very low | 29.6 | Very low | 192 Ų | 192 | 134.1 Ų | 134.1 | 84% | 0.842 | 81% | 0.813 | S | S | * | * | trans | -125.1 | 156.5 | -178.9 | -90.4 | -84.1 | 0 | 0 | 0 | 113.2 | ||||
| 484 | G | 25.8 | Very low | 29.7 | Very low | 73 Ų | 73 | 136.9 Ų | 136.9 | 75% | 0.753 | 82% | 0.82 | S | S | * | * | trans | 162.7 | 136.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 485 | D | 29.4 | Very low | 29.7 | Very low | 163 Ų | 163 | 137.3 Ų | 137.3 | 87% | 0.872 | 81% | 0.813 | S | S | * | * | cis | -145.2 | 168.4 | 6.4 | -156.2 | -35.3 | 0 | 0 | 0 | 108.5 | ||||
| 486 | G | 28.6 | Very low | 29.5 | Very low | 71 Ų | 71 | 141.1 Ų | 141.1 | 73% | 0.732 | 82% | 0.815 | S | S | * | * | trans | 164.6 | 116.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 487 | L | 30.5 | Very low | 29.8 | Very low | 156 Ų | 156 | 140.8 Ų | 140.8 | 82% | 0.817 | 81% | 0.812 | S | S | * | * | trans | -94 | 138.3 | -172.9 | -73.3 | 163 | 0 | 0 | 0 | 114.5 | ||||
| 488 | L | 31.6 | Very low | 30.1 | Very low | 161 Ų | 161 | 144 Ų | 144 | 84% | 0.843 | 82% | 0.82 | S | S | * | * | trans | 25.9 | 135.3 | 146 | -56.5 | 177.8 | 0 | 0 | 0 | 121.8 | ||||
| 489 | S | 25.5 | Very low | 29.9 | Very low | 124 Ų | 124 | 142 Ų | 142 | 87% | 0.867 | 82% | 0.819 | S | S | * | * | trans | -146 | 169.9 | 142.7 | -165.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 490 | V | 31.1 | Very low | 29.8 | Very low | 145 Ų | 145 | 139.3 Ų | 139.3 | 88% | 0.879 | 82% | 0.818 | S | S | * | * | trans | -128.5 | 145.9 | -160.8 | 173.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 491 | G | 26.6 | Very low | 29.8 | Very low | 60 Ų | 60 | 137.9 Ų | 137.9 | 62% | 0.619 | 82% | 0.822 | S | S | * | * | trans | 160 | 132 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 492 | S | 32.6 | Very low | 29.8 | Very low | 116 Ų | 116 | 132.1 Ų | 132.1 | 81% | 0.811 | 82% | 0.815 | S | S | * | * | 62.8 | 134.8 | 63 | -81.4 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 493 | E | 30.2 | Very low | 29.9 | Very low | 184 Ų | 184 | 126.3 Ų | 126.3 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | cis | -157.9 | -157.9 | 0.7 | 58.4 | -151.2 | 95.8 | 0 | 0 | 112.5 | ||||
| 494 | D | 32.2 | Very low | 29.8 | Very low | 151 Ų | 151 | 122 Ų | 122 | 81% | 0.807 | 81% | 0.806 | S | S | * | * | trans | -84.8 | 161 | -157.3 | -84.4 | -75.1 | 0 | 0 | 0 | 119 | ||||
| 495 | L | 32.9 | Very low | 30 | Very low | 132 Ų | 132 | 124.1 Ų | 124.1 | 69% | 0.691 | 81% | 0.81 | S | S | * | * | trans | 12.6 | 123.5 | 147.8 | -120.4 | 71.3 | 0 | 0 | 0 | 119.8 | ||||
| 496 | F | 26.8 | Very low | 30 | Very low | 195 Ų | 195 | 119.6 Ų | 119.6 | 86% | 0.855 | 80% | 0.802 | S | S | * | * | -176.7 | 161 | 99.1 | -108.8 | -75.6 | 0 | 0 | 0 | 113.6 | |||||
| 497 | S | 35.6 | Very low | 30 | Very low | 105 Ų | 105 | 126.1 Ų | 126.1 | 73% | 0.734 | 81% | 0.811 | S | S | * | * | trans | -79.9 | 151.2 | 178.1 | -47.7 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 498 | L | 32.2 | Very low | 30 | Very low | 181 Ų | 181 | 126.6 Ų | 126.6 | 95% | 0.948 | 81% | 0.809 | S | S | * | * | -167.6 | 122.6 | 127.2 | -106.9 | 167.8 | 0 | 0 | 0 | 111.6 | |||||
| 499 | G | 26.1 | Very low | 30.8 | Very low | 82 Ų | 82 | 123.1 Ų | 123.1 | 85% | 0.845 | 80% | 0.796 | S | S | * | * | trans | -149.6 | 117.5 | 170.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 500 | G | 28.8 | Very low | 31.2 | Very low | 79 Ų | 79 | 124.5 Ų | 124.5 | 81% | 0.814 | 79% | 0.793 | S | S | * | * | trans | -165.2 | 106.2 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 501 | G | 29.5 | Very low | 31.2 | Very low | 87 Ų | 87 | 123.5 Ų | 123.5 | 90% | 0.897 | 79% | 0.787 | S | S | * | * | trans | 79.4 | 138.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 502 | G | 28.1 | Very low | 31.4 | Very low | 67 Ų | 67 | 127.6 Ų | 127.6 | 69% | 0.691 | 79% | 0.793 | S | S | * | * | cis | 156.6 | 156.5 | -10.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 503 | S | 30.2 | Very low | 31.3 | Very low | 129 Ų | 129 | 127.3 Ų | 127.3 | 90% | 0.902 | 79% | 0.791 | S | S | * | * | trans | 60.8 | 144 | 159.8 | -63.2 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 504 | S | 30.6 | Very low | 31.3 | Very low | 100 Ų | 100 | 124.2 Ų | 124.2 | 70% | 0.699 | 79% | 0.785 | S | S | * | * | cis | -160.3 | 150.8 | 3.5 | 49.3 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 505 | S | 31.6 | Very low | 31.3 | Very low | 119 Ų | 119 | 121.2 Ų | 121.2 | 83% | 0.832 | 78% | 0.781 | S | S | * | * | trans | 33.4 | 125.8 | 146.1 | 62.8 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 506 | G | 28.1 | Very low | 31.1 | Very low | 68 Ų | 68 | 123 Ų | 123 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | trans | 179.3 | 97.1 | 160.4 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 507 | F | 28.6 | Very low | 31.2 | Very low | 207 Ų | 207 | 119.7 Ų | 119.7 | 91% | 0.908 | 78% | 0.782 | S | S | * | * | trans | 48 | 149 | 147.6 | 97.8 | -67.1 | 0 | 0 | 0 | 125.1 | ||||
| 508 | E | 32.1 | Very low | 30.9 | Very low | 166 Ų | 166 | 119.1 Ų | 119.1 | 78% | 0.776 | 78% | 0.778 | S | S | * | * | trans | -116.4 | 174.4 | 161.8 | -128.5 | -164.9 | 116 | 0 | 0 | 106.8 | ||||
| 509 | P | 48.4 | Very low | 30.8 | Very low | 88 Ų | 88 | 119.8 Ų | 119.8 | 57% | 0.571 | 78% | 0.776 | S | S | * | * | cis | -142.9 | 179.3 | -8.9 | 41.9 | -22.8 | 0 | 0 | 0 | 116.8 | ||||
| 510 | L | 33.9 | Very low | 30.7 | Very low | 154 Ų | 154 | 121.7 Ų | 121.7 | 81% | 0.806 | 78% | 0.776 | S | S | * | * | trans | 66.9 | 166.4 | 145.6 | -77.5 | 167.5 | 0 | 0 | 0 | 124.8 | ||||
| 511 | T | 29.6 | Very low | 30.6 | Very low | 124 Ų | 124 | 122.7 Ų | 122.7 | 76% | 0.761 | 78% | 0.777 | S | S | * | * | trans | 92.6 | 150 | 160.9 | 75.1 | 0 | 0 | 0 | 0 | 120 | ||||
| 512 | I | 32.1 | Very low | 30.5 | Very low | 146 Ų | 146 | 123 Ų | 123 | 75% | 0.749 | 77% | 0.771 | S | S | * | * | cis | -165.4 | 146.2 | -27.8 | -108.1 | 161.8 | 0 | 0 | 0 | 110.9 | ||||
| 513 | S | 30.7 | Very low | 32.1 | Very low | 109 Ų | 109 | 125.5 Ų | 125.5 | 76% | 0.762 | 78% | 0.775 | S | S | * | * | trans | 56.2 | 173.2 | 162.1 | -66.1 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 514 | T | 30.1 | Very low | 33.4 | Very low | 119 Ų | 119 | 123.6 Ų | 123.6 | 73% | 0.73 | 76% | 0.76 | S | S | * | * | cis | -149.2 | 166.1 | 18.4 | -45 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 515 | A | 30.8 | Very low | 33.6 | Very low | 89 Ų | 89 | 127.5 Ų | 127.5 | 74% | 0.736 | 77% | 0.766 | S | S | * | * | trans | -133.3 | 144.6 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 516 | H | 29.4 | Very low | 33.6 | Very low | 169 Ų | 169 | 128 Ų | 128 | 78% | 0.782 | 76% | 0.758 | S | S | * | * | trans | -145.7 | 142.4 | 177.1 | -66 | -69.3 | 0 | 0 | 0 | 115.7 | ||||
| 517 | T | 28.1 | Very low | 33.5 | Very low | 126 Ų | 126 | 136.1 Ų | 136.1 | 77% | 0.773 | 77% | 0.768 | S | S | * | * | trans | -35.1 | 171.3 | 158.3 | 44.5 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 518 | S | 29.9 | Very low | 33.7 | Very low | 93 Ų | 93 | 131.4 Ų | 131.4 | 65% | 0.65 | 76% | 0.761 | S | S | * | * | cis | 170.7 | 164.8 | -27.8 | 63 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 519 | Q | 29.5 | Very low | 34.5 | Very low | 194 Ų | 194 | 128.8 Ų | 128.8 | 91% | 0.907 | 76% | 0.758 | S | S | * | * | trans | 81.4 | -179.3 | 162.6 | -60 | -171.5 | 10.2 | 0 | 0 | 119.6 | ||||
| 520 | S | 25.6 | Very low | 33.7 | Very low | 122 Ų | 122 | 133.9 Ų | 133.9 | 85% | 0.853 | 77% | 0.772 | S | S | * | * | trans | -153.2 | 155.6 | -141.8 | 172.1 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 521 | A | 25.8 | Very low | 33.6 | Very low | 100 Ų | 100 | 133.3 Ų | 133.3 | 83% | 0.826 | 77% | 0.774 | S | S | * | * | trans | -157.1 | 169.1 | 167.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 522 | A | 28.3 | Very low | 33.6 | Very low | 94 Ų | 94 | 133.6 Ų | 133.6 | 78% | 0.777 | 77% | 0.771 | S | S | * | * | trans | -145.2 | -156 | -170.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 523 | P | 61.7 | Low | 33.6 | Very low | 119 Ų | 119 | 134.4 Ų | 134.4 | 77% | 0.773 | 77% | 0.772 | S | S | * | * | cis | -132.6 | -23.9 | -23.1 | 19 | 2 | 0 | 0 | 0 | 125.8 | ||||
| 524 | P | 56.8 | Low | 34.5 | Very low | 89 Ų | 89 | 133.8 Ų | 133.8 | 58% | 0.578 | 77% | 0.765 | S | S | * | * | -130.7 | 157.7 | -121 | 43.5 | -29.1 | 0 | 0 | 0 | 121.2 | |||||
| 525 | H | 33.8 | Very low | 34.3 | Very low | 182 Ų | 182 | 133.2 Ų | 133.2 | 84% | 0.843 | 77% | 0.766 | S | S | * | * | trans | 74.5 | 147.7 | 157.9 | -55.9 | -42.1 | 0 | 0 | 0 | 120.1 | ||||
| 526 | I | 31.6 | Very low | 34.2 | Very low | 130 Ų | 130 | 135.9 Ų | 135.9 | 67% | 0.667 | 77% | 0.767 | S | S | * | * | cis | -154.5 | 158.8 | 31.1 | -148.9 | 164.4 | 0 | 0 | 0 | 116.2 | ||||
| 527 | W | 27.2 | Very low | 34.3 | Very low | 238 Ų | 238 | 136 Ų | 136 | 90% | 0.902 | 77% | 0.768 | S | S | * | * | trans | 70.5 | 157.3 | 159.1 | -71.3 | -27.9 | 0 | 0 | 0 | 125.8 | ||||
| 528 | S | 32.6 | Very low | 34.3 | Very low | 108 Ų | 108 | 133.5 Ų | 133.5 | 76% | 0.755 | 76% | 0.76 | S | S | * | * | trans | -152.1 | 174 | -173.5 | 61.6 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 529 | P | 49.4 | Very low | 34.2 | Very low | 111 Ų | 111 | 137.9 Ų | 137.9 | 72% | 0.721 | 77% | 0.767 | S | S | * | * | -160.9 | 157.4 | 96.5 | 38.5 | -17.7 | 0 | 0 | 0 | 119.8 | |||||
| 530 | F | 31.9 | Very low | 34.2 | Very low | 196 Ų | 196 | 134.6 Ų | 134.6 | 86% | 0.86 | 76% | 0.756 | S | S | * | * | trans | 52.7 | 147.8 | 149.7 | -79.6 | -102.8 | 0 | 0 | 0 | 121.3 | ||||
| 531 | V | 31.1 | Very low | 34.2 | Very low | 142 Ų | 142 | 132.8 Ų | 132.8 | 86% | 0.861 | 74% | 0.744 | S | S | * | * | cis | -143.2 | 174.1 | 47.4 | 167.5 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 532 | D | 30 | Very low | 34.3 | Very low | 130 Ų | 130 | 135.2 Ų | 135.2 | 70% | 0.695 | 74% | 0.742 | S | S | * | * | trans | -130.9 | -173.8 | -165.6 | -157.3 | -27.4 | 0 | 0 | 0 | 112.8 | ||||
| 533 | Q | 32.2 | Very low | 34.3 | Very low | 163 Ų | 163 | 137.9 Ų | 137.9 | 76% | 0.762 | 74% | 0.738 | S | S | * | * | trans | 95.9 | 150.9 | 166 | -65.9 | -75.5 | -70.4 | 0 | 0 | 120 | ||||
| 534 | P | 47.8 | Very low | 32.5 | Very low | 96 Ų | 96 | 137.1 Ų | 137.1 | 62% | 0.623 | 74% | 0.736 | S | S | * | * | trans | -142 | -151.5 | -140.5 | 45.4 | -24.7 | 0 | 0 | 0 | 116.2 | ||||
| 535 | S | 25.8 | Very low | 31.1 | Very low | 106 Ų | 106 | 140.7 Ų | 140.7 | 74% | 0.741 | 75% | 0.745 | S | S | * | * | trans | 81.3 | 150.2 | 160.3 | 77.6 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 536 | L | 28.9 | Very low | 30.6 | Very low | 146 Ų | 146 | 137.8 Ų | 137.8 | 76% | 0.764 | 74% | 0.74 | S | S | * | * | cis | -162.9 | 171.2 | -4.4 | -123.3 | 175.3 | 0 | 0 | 0 | 111.4 | ||||
| 537 | Q | 32.6 | Very low | 30.4 | Very low | 172 Ų | 172 | 136.6 Ų | 136.6 | 80% | 0.804 | 74% | 0.743 | S | S | * | * | trans | 72 | 147.8 | 156.1 | -73.6 | 173.6 | 4.5 | 0 | 0 | 119.6 | ||||
| 538 | A | 27.5 | Very low | 30.6 | Very low | 72 Ų | 72 | 133.9 Ų | 133.9 | 60% | 0.595 | 74% | 0.741 | S | S | * | * | cis | -166.1 | 157.4 | -9.8 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 539 | F | 27.6 | Very low | 30.9 | Very low | 185 Ų | 185 | 134.6 Ų | 134.6 | 81% | 0.811 | 74% | 0.743 | S | S | * | * | trans | 51.4 | 148.3 | 156.6 | -60.7 | -56.3 | 0 | 0 | 0 | 120.4 | ||||
| 540 | D | 29.1 | Very low | 29.8 | Very low | 126 Ų | 126 | 132.9 Ų | 132.9 | 67% | 0.674 | 75% | 0.745 | S | S | * | * | cis | -142.4 | 134.1 | -8 | -106.4 | -40.9 | 0 | 0 | 0 | 106.9 | ||||
| 541 | S | 27.1 | Very low | 29.8 | Very low | 84 Ų | 84 | 130.2 Ų | 130.2 | 59% | 0.587 | 75% | 0.745 | S | S | * | * | 82.2 | 111.2 | 67.2 | -58.2 | 0 | 0 | 0 | 0 | 115.4 | |||||
| 542 | L | 27.1 | Very low | 30.2 | Very low | 150 Ų | 150 | 128.7 Ų | 128.7 | 79% | 0.785 | 74% | 0.738 | S | S | * | * | trans | 65.4 | 152.4 | 152 | -48.4 | 168.8 | 0 | 0 | 0 | 117.3 | ||||
| 543 | Q | 28.4 | Very low | 30.1 | Very low | 150 Ų | 150 | 133 Ų | 133 | 70% | 0.701 | 75% | 0.745 | S | S | * | * | cis | -149.1 | 135.2 | -23.8 | -113.1 | 172.5 | -7.1 | 0 | 0 | 105.3 | ||||
| 544 | S | 24.6 | Very low | 29.8 | Very low | 104 Ų | 104 | 132.3 Ų | 132.3 | 73% | 0.727 | 75% | 0.745 | S | S | * | * | 49.5 | 125.2 | 92.4 | -44.3 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 545 | Q | 26.2 | Very low | 28.7 | Very low | 164 Ų | 164 | 132.7 Ų | 132.7 | 77% | 0.766 | 75% | 0.75 | S | S | * | * | 154.3 | 117.3 | 125.4 | -74.5 | -105.2 | 44.9 | 0 | 0 | 112.9 | |||||
| 546 | T | 24.5 | Very low | 29.4 | Very low | 121 Ų | 121 | 133.4 Ų | 133.4 | 74% | 0.742 | 75% | 0.753 | S | S | * | * | trans | 55 | -179.7 | 149 | 79.7 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 547 | S | 27.1 | Very low | 29.3 | Very low | 105 Ų | 105 | 132 Ų | 132 | 73% | 0.734 | 75% | 0.75 | S | S | * | * | cis | -154.9 | 158.6 | -18.5 | 15.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 548 | Q | 30.3 | Very low | 29.2 | Very low | 181 Ų | 181 | 133.8 Ų | 133.8 | 85% | 0.846 | 76% | 0.755 | S | S | * | * | trans | -87.1 | -171.9 | 159.4 | -50 | -173.2 | -3.8 | 0 | 0 | 109.7 | ||||
| 549 | P | 40.7 | Very low | 29.2 | Very low | 123 Ų | 123 | 135.8 Ų | 135.8 | 80% | 0.799 | 77% | 0.765 | S | S | * | * | cis | -132.7 | -168.8 | -12.1 | 41.3 | -24.2 | 0 | 0 | 0 | 113.1 | ||||
| 550 | G | 26 | Very low | 29.3 | Very low | 75 Ų | 75 | 129.8 Ų | 129.8 | 77% | 0.773 | 76% | 0.756 | S | S | * | * | trans | 132.9 | 144.4 | 149.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 551 | T | 31.3 | Very low | 29.3 | Very low | 139 Ų | 139 | 130 Ų | 130 | 85% | 0.853 | 76% | 0.762 | S | S | * | * | trans | -113 | -174.2 | 168.8 | 62.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 552 | P | 38.9 | Very low | 29.2 | Very low | 110 Ų | 110 | 134.4 Ų | 134.4 | 71% | 0.714 | 77% | 0.773 | S | S | * | * | cis | -137.7 | 176.7 | -2.5 | 42.1 | -24.7 | 0 | 0 | 0 | 116.8 | ||||
| 553 | R | 27.9 | Very low | 29.2 | Very low | 222 Ų | 222 | 131.3 Ų | 131.3 | 84% | 0.838 | 77% | 0.769 | S | S | * | * | trans | 56.8 | 134.4 | 152.9 | -100.8 | -173.2 | 178.9 | -98.4 | -0.2 | 120.8 | ||||
| 554 | L | 27.2 | Very low | 29.4 | Very low | 147 Ų | 147 | 131.3 Ų | 131.3 | 77% | 0.77 | 77% | 0.773 | S | S | * | * | -178 | 173.9 | 103.7 | -98.1 | -179.2 | 0 | 0 | 0 | 113.2 | |||||
| 555 | S | 24.9 | Very low | 29.5 | Very low | 105 Ų | 105 | 134.5 Ų | 134.5 | 73% | 0.734 | 78% | 0.776 | S | S | * | * | trans | 77.1 | 159.8 | 161.2 | -58 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 556 | P | 39 | Very low | 29.6 | Very low | 121 Ų | 121 | 135 Ų | 135 | 79% | 0.786 | 78% | 0.779 | S | S | * | * | cis | -117.4 | 176.3 | 0.4 | 40.8 | -28.6 | 0 | 0 | 0 | 115.7 | ||||
| 557 | T | 27.7 | Very low | 30.5 | Very low | 116 Ų | 116 | 134.4 Ų | 134.4 | 71% | 0.712 | 78% | 0.776 | S | S | * | * | trans | -108.7 | 147.8 | -177.5 | -50.7 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 558 | F | 30.6 | Very low | 30.6 | Very low | 209 Ų | 209 | 138.1 Ų | 138.1 | 92% | 0.917 | 78% | 0.782 | S | S | * | * | trans | -139.3 | 157.3 | 153.7 | -88 | -78.7 | 0 | 0 | 0 | 110.2 | ||||
| 559 | S | 27.6 | Very low | 30.4 | Very low | 114 Ų | 114 | 134 Ų | 134 | 80% | 0.797 | 78% | 0.779 | S | S | * | * | trans | -129.4 | 151.1 | -166.6 | -56 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 560 | G | 28.3 | Very low | 29.8 | Very low | 60 Ų | 60 | 135.5 Ų | 135.5 | 62% | 0.619 | 78% | 0.776 | S | S | * | * | trans | 108.4 | 100.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 561 | T | 29.2 | Very low | 29.9 | Very low | 130 Ų | 130 | 141.8 Ų | 141.8 | 80% | 0.798 | 78% | 0.776 | S | S | * | * | 63.9 | 118.2 | 85.2 | 60.3 | 0 | 0 | 0 | 0 | 113 | |||||
| 562 | E | 26.6 | Very low | 29.6 | Very low | 177 Ų | 177 | 140.3 Ų | 140.3 | 83% | 0.827 | 77% | 0.767 | S | S | * | * | cis | -156.2 | 170.5 | 10.2 | -115.5 | 168.3 | 119.5 | 0 | 0 | 112.9 | ||||
| 563 | A | 27.1 | Very low | 29 | Very low | 85 Ų | 85 | 142.8 Ų | 142.8 | 70% | 0.702 | 77% | 0.768 | S | S | * | * | trans | 12.4 | 147.6 | 151.9 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 564 | L | 30.8 | Very low | 29 | Very low | 149 Ų | 149 | 143.1 Ų | 143.1 | 78% | 0.78 | 77% | 0.769 | S | S | * | * | cis | -163.7 | 173.7 | 4.3 | -121.2 | 168.2 | 0 | 0 | 0 | 111 | ||||
| 565 | E | 27.1 | Very low | 28.9 | Very low | 171 Ų | 171 | 147.9 Ų | 147.9 | 80% | 0.799 | 78% | 0.777 | S | S | * | * | trans | 61.9 | 119.2 | 160.3 | -95.7 | 163.9 | 90 | 0 | 0 | 122.8 | ||||
| 566 | H | 29.5 | Very low | 29.7 | Very low | 176 Ų | 176 | 147.7 Ų | 147.7 | 82% | 0.815 | 77% | 0.773 | S | S | * | * | trans | -75.9 | 166.9 | 145.6 | -80.5 | 64 | 0 | 0 | 0 | 108.9 | ||||
| 567 | P | 43.2 | Very low | 29.4 | Very low | 107 Ų | 107 | 151.9 Ų | 151.9 | 70% | 0.695 | 78% | 0.78 | S | S | * | * | cis | -153.1 | 175.6 | 35.6 | 44.2 | -22.8 | 0 | 0 | 0 | 119.9 | ||||
| 568 | Q | 29.1 | Very low | 29.3 | Very low | 183 Ų | 183 | 150.2 Ų | 150.2 | 86% | 0.855 | 79% | 0.785 | S | S | * | * | trans | 40.3 | 122.5 | 141.9 | -70.2 | -177.2 | -15.1 | 0 | 0 | 123.5 | ||||
| 569 | A | 26.4 | Very low | 29.2 | Very low | 94 Ų | 94 | 146.1 Ų | 146.1 | 78% | 0.777 | 78% | 0.783 | S | S | * | * | 90.5 | 159.6 | 127.5 | 0 | 0 | 0 | 0 | 0 | 122.4 | |||||
| 570 | Q | 28.6 | Very low | 29.3 | Very low | 156 Ų | 156 | 145.7 Ų | 145.7 | 73% | 0.729 | 79% | 0.786 | S | S | * | * | trans | 66.8 | 106.9 | 173.7 | -62 | -160.7 | 11.4 | 0 | 0 | 118.4 | ||||
| 571 | R | 27.6 | Very low | 29.2 | Very low | 206 Ų | 206 | 145.9 Ų | 145.9 | 78% | 0.777 | 79% | 0.788 | S | S | * | * | 91.6 | 147.2 | 81.2 | -163.3 | -152.4 | -80.9 | 176.4 | -5.8 | 112 | |||||
| 572 | V | 25.1 | Very low | 29.2 | Very low | 109 Ų | 109 | 146 Ų | 146 | 66% | 0.661 | 79% | 0.789 | S | S | * | * | trans | 93.7 | 104.6 | 159.7 | -167.2 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 573 | H | 25.1 | Very low | 29.3 | Very low | 162 Ų | 162 | 144.2 Ų | 144.2 | 75% | 0.75 | 78% | 0.784 | S | S | * | * | trans | 68.6 | 121.2 | 143.8 | -77.2 | 44.1 | 0 | 0 | 0 | 123.9 | ||||
| 574 | R | 27.8 | Very low | 29.2 | Very low | 228 Ų | 228 | 147.1 Ų | 147.1 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | 31.5 | 123.5 | 123 | -63.9 | -177.9 | 171.3 | -162.9 | -1.8 | 119.7 | |||||
| 575 | R | 26.3 | Very low | 29.1 | Very low | 248 Ų | 248 | 142.9 Ų | 142.9 | 94% | 0.936 | 77% | 0.774 | S | S | * | * | -147.7 | 157 | 121 | -117.4 | -175.2 | 175.2 | 133.6 | 1 | 111.8 | |||||
| 576 | P | 41.8 | Very low | 29.2 | Very low | 100 Ų | 100 | 143.4 Ų | 143.4 | 65% | 0.649 | 78% | 0.776 | S | S | * | * | trans | -119.5 | -179.7 | -174 | 34.1 | -16.1 | 0 | 0 | 0 | 115 | ||||
| 577 | F | 30.9 | Very low | 29.1 | Very low | 210 Ų | 210 | 145.9 Ų | 145.9 | 92% | 0.921 | 78% | 0.779 | S | S | * | * | trans | 74.7 | 144.6 | 172.9 | -62.7 | -79.8 | 0 | 0 | 0 | 118.3 | ||||
| 578 | G | 27.2 | Very low | 28.4 | Very low | 80 Ų | 80 | 147.8 Ų | 147.8 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | trans | 152.7 | 73.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 579 | S | 28.6 | Very low | 29.3 | Very low | 124 Ų | 124 | 144.4 Ų | 144.4 | 87% | 0.867 | 78% | 0.775 | S | S | * | * | trans | -93.9 | 144.1 | 175.7 | -52.5 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 580 | A | 28.9 | Very low | 29.3 | Very low | 105 Ų | 105 | 144.9 Ų | 144.9 | 87% | 0.868 | 77% | 0.773 | S | S | * | * | trans | 152.2 | 150.1 | 134.8 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 581 | G | 27.5 | Very low | 29.4 | Very low | 64 Ų | 64 | 147.6 Ų | 147.6 | 66% | 0.66 | 78% | 0.778 | S | S | * | * | trans | 86.2 | 119.1 | 170.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 582 | T | 27.7 | Very low | 29.3 | Very low | 132 Ų | 132 | 142.2 Ų | 142.2 | 81% | 0.81 | 77% | 0.772 | S | S | * | * | cis | 63 | 130.5 | 36.6 | 81.5 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 583 | L | 30.1 | Very low | 29.4 | Very low | 139 Ų | 139 | 142.4 Ų | 142.4 | 73% | 0.728 | 78% | 0.778 | S | S | * | * | cis | -165.3 | 153.4 | -2.2 | -115.8 | 168.4 | 0 | 0 | 0 | 108.3 | ||||
| 584 | D | 25 | Very low | 29.7 | Very low | 146 Ų | 146 | 137.7 Ų | 137.7 | 78% | 0.781 | 77% | 0.767 | S | S | * | * | trans | 47.6 | 157.8 | 150.4 | -75.7 | -11.6 | 0 | 0 | 0 | 123 | ||||
| 585 | A | 27.9 | Very low | 29.6 | Very low | 60 Ų | 60 | 135.9 Ų | 135.9 | 50% | 0.496 | 77% | 0.765 | S | S | . | * | cis | -168.7 | 160.4 | -23.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 586 | H | 28.8 | Very low | 29.9 | Very low | 183 Ų | 183 | 128.9 Ų | 128.9 | 85% | 0.847 | 76% | 0.755 | S | S | * | * | trans | 66.3 | 158.5 | 163.1 | -52.9 | -45.3 | 0 | 0 | 0 | 116.2 | ||||
| 587 | R | 28.1 | Very low | 29.2 | Very low | 228 Ų | 228 | 129.8 Ų | 129.8 | 86% | 0.86 | 76% | 0.763 | S | S | * | * | cis | -152.3 | 131.1 | 27.9 | 179.3 | 174.9 | -95.6 | 178.7 | -6.4 | 113.2 | ||||
| 588 | I | 28.1 | Very low | 29.1 | Very low | 147 Ų | 147 | 124.8 Ų | 124.8 | 75% | 0.754 | 76% | 0.755 | S | S | * | * | trans | -12.9 | 169.8 | 147.8 | 40 | 172.1 | 0 | 0 | 0 | 119.4 | ||||
| 589 | P | 47.3 | Very low | 29.5 | Very low | 111 Ų | 111 | 125.6 Ų | 125.6 | 72% | 0.721 | 75% | 0.747 | S | S | * | * | cis | -143.4 | 162.3 | 21 | 39.2 | -19.2 | 0 | 0 | 0 | 120.5 | ||||
| 590 | S | 27.3 | Very low | 29.8 | Very low | 104 Ų | 104 | 127.5 Ų | 127.5 | 73% | 0.727 | 74% | 0.743 | S | S | * | * | trans | -178.1 | 156.4 | 139.4 | -80.2 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 591 | Y | 29.7 | Very low | 30.1 | Very low | 214 Ų | 214 | 126.3 Ų | 126.3 | 84% | 0.839 | 73% | 0.728 | S | S | * | * | cis | -156.6 | -173.5 | -38.7 | 56.3 | -136.6 | 0 | 0 | 0 | 110.9 | ||||
| 592 | S | 25.5 | Very low | 30.5 | Very low | 92 Ų | 92 | 129.2 Ų | 129.2 | 64% | 0.643 | 73% | 0.733 | S | S | * | * | trans | -57 | 147.5 | -177.4 | -48.8 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 593 | S | 27.7 | Very low | 30.6 | Very low | 114 Ų | 114 | 129.2 Ų | 129.2 | 80% | 0.797 | 73% | 0.733 | S | S | * | * | cis | 76.6 | 146.9 | 35 | 91.7 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 594 | A | 31.3 | Very low | 30.7 | Very low | 62 Ų | 62 | 127.6 Ų | 127.6 | 51% | 0.512 | 73% | 0.733 | S | S | . | * | cis | -150.4 | -171.6 | 5.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 595 | F | 26.7 | Very low | 30.9 | Very low | 190 Ų | 190 | 125.4 Ų | 125.4 | 83% | 0.833 | 73% | 0.729 | S | S | * | * | cis | -143.4 | 165.3 | 9.4 | -55.7 | -99.5 | 0 | 0 | 0 | 109.3 | ||||
| 596 | S | 31.6 | Very low | 30.9 | Very low | 102 Ų | 102 | 128 Ų | 128 | 71% | 0.713 | 74% | 0.744 | S | S | * | * | cis | 93.2 | 61.4 | 5.4 | -44 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 597 | S | 27.8 | Very low | 32.2 | Very low | 118 Ų | 118 | 124.6 Ų | 124.6 | 83% | 0.825 | 74% | 0.738 | S | S | * | * | trans | -138.7 | 134.4 | 150.8 | -74.5 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 598 | S | 29.1 | Very low | 33 | Very low | 106 Ų | 106 | 119.6 Ų | 119.6 | 74% | 0.741 | 74% | 0.735 | S | S | * | * | cis | 101.5 | 140.5 | 21.7 | -66.4 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 599 | S | 35.4 | Very low | 33.3 | Very low | 96 Ų | 96 | 119.1 Ų | 119.1 | 67% | 0.671 | 73% | 0.734 | S | S | * | * | cis | -178.5 | -168.1 | -8 | 45 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 600 | E | 35.3 | Very low | 32.3 | Very low | 165 Ų | 165 | 120 Ų | 120 | 77% | 0.771 | 74% | 0.743 | S | S | * | * | trans | 93.8 | 145.3 | 146.3 | -63 | -105.7 | 80.8 | 0 | 0 | 119.1 | ||||
| 601 | S | 34.9 | Very low | 32.7 | Very low | 80 Ų | 80 | 118.8 Ų | 118.8 | 56% | 0.559 | 73% | 0.734 | S | S | * | * | cis | -165 | 163.3 | -19.7 | -139.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 602 | T | 35 | Very low | 32.4 | Very low | 125 Ų | 125 | 118.2 Ų | 118.2 | 77% | 0.767 | 74% | 0.737 | S | S | * | * | cis | -120.6 | -110.8 | -7.1 | -43.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 603 | T | 30.1 | Very low | 33.4 | Very low | 131 Ų | 131 | 119.2 Ų | 119.2 | 80% | 0.804 | 74% | 0.744 | S | S | * | * | cis | -133.7 | -158.8 | -3.9 | 57.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 604 | S | 33.1 | Very low | 33.3 | Very low | 105 Ų | 105 | 123.7 Ų | 123.7 | 73% | 0.734 | 75% | 0.745 | S | S | * | * | trans | -143.8 | 161.3 | -175.6 | 69.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 605 | S | 27.8 | Very low | 33.7 | Very low | 100 Ų | 100 | 130.9 Ų | 130.9 | 70% | 0.699 | 76% | 0.759 | S | S | * | * | cis | -160.4 | 144 | 46.9 | -48.5 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 606 | S | 29.1 | Very low | 34.4 | Very low | 114 Ų | 114 | 127.6 Ų | 127.6 | 80% | 0.797 | 76% | 0.756 | S | S | * | * | trans | 52.3 | 111 | 144.2 | -50.1 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 607 | P | 55.7 | Low | 34.6 | Very low | 112 Ų | 112 | 127.1 Ų | 127.1 | 73% | 0.727 | 76% | 0.759 | S | S | * | * | trans | -97.2 | -174.8 | 147.9 | 41.3 | -33.1 | 0 | 0 | 0 | 111.1 | ||||
| 608 | P | 44.2 | Very low | 34.8 | Very low | 124 Ų | 124 | 130.1 Ų | 130.1 | 81% | 0.805 | 76% | 0.764 | S | S | * | * | -144.7 | 166.1 | 86.8 | 39.6 | -23.7 | 0 | 0 | 0 | 116.1 | |||||
| 609 | D | 35.4 | Very low | 34.9 | Very low | 136 Ų | 136 | 128.2 Ų | 128.2 | 73% | 0.727 | 76% | 0.762 | S | S | * | * | trans | -76.3 | 164 | -178.6 | -56.2 | -105.5 | 0 | 0 | 0 | 115.9 | ||||
| 610 | S | 25.7 | Very low | 34.9 | Very low | 129 Ų | 129 | 129.9 Ų | 129.9 | 90% | 0.902 | 77% | 0.773 | S | S | * | * | trans | -130.5 | 119.4 | 131.6 | 65.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 611 | S | 34.8 | Very low | 35.3 | Very low | 79 Ų | 79 | 128.4 Ų | 128.4 | 55% | 0.552 | 78% | 0.781 | S | S | * | * | trans | -130.8 | 154.2 | -172.2 | 61.1 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 612 | F | 24.2 | Very low | 35.5 | Very low | 202 Ų | 202 | 127.8 Ų | 127.8 | 89% | 0.886 | 79% | 0.787 | S | S | * | * | trans | -143.3 | 91 | 157.6 | -86 | -65 | 0 | 0 | 0 | 110.7 | ||||
| 613 | S | 46.1 | Very low | 36.2 | Very low | 114 Ų | 114 | 131.3 Ų | 131.3 | 80% | 0.797 | 79% | 0.786 | S | S | * | * | trans | -92.7 | 130.9 | 160.8 | -70.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 614 | Y | 26.4 | Very low | 37.1 | Very low | 207 Ų | 207 | 130.6 Ų | 130.6 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | trans | -131.8 | 119.6 | 162.8 | -106.3 | -85.3 | 0 | 0 | 0 | 111.3 | ||||
| 615 | R | 39.3 | Very low | 38.4 | Very low | 213 Ų | 213 | 131.7 Ų | 131.7 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | trans | -139.3 | 124.7 | 162.7 | -96.1 | -167.9 | 172.6 | -154.2 | -1 | 108.3 | ||||
| 616 | P | 40.5 | Very low | 41 | Very low | 121 Ų | 121 | 132.1 Ų | 132.1 | 79% | 0.786 | 77% | 0.766 | S | S | * | * | trans | -86.2 | 154.2 | 141.3 | -10 | 28.7 | 0 | 0 | 0 | 109 | ||||
| 617 | A | 36.8 | Very low | 44 | Very low | 93 Ų | 93 | 131.5 Ų | 131.5 | 77% | 0.769 | 75% | 0.753 | S | S | * | * | trans | -120.1 | 147.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 618 | L | 32.9 | Very low | 45.8 | Very low | 180 Ų | 180 | 126.2 Ų | 126.2 | 94% | 0.942 | 72% | 0.719 | S | S | * | * | trans | -168.1 | 134 | 137.3 | -155.8 | 62.4 | 0 | 0 | 0 | 112.8 | ||||
| 619 | G | 30.2 | Very low | 48.1 | Very low | 66 Ų | 66 | 124.2 Ų | 124.2 | 68% | 0.68 | 70% | 0.7 | S | S | * | * | trans | 90.5 | 136.9 | 145.3 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 620 | S | 34.5 | Very low | 50.6 | Low | 131 Ų | 131 | 122.7 Ų | 122.7 | 92% | 0.916 | 69% | 0.689 | S | S | * | * | trans | 68.2 | 144.2 | 156.8 | -66.8 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 621 | S | 45.6 | Very low | 53.8 | Low | 135 Ų | 135 | 118.3 Ų | 118.3 | 94% | 0.944 | 66% | 0.658 | S | S | * | * | trans | -72.5 | 121.6 | 178.8 | -54.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 622 | G | 37.6 | Very low | 56.3 | Low | 66 Ų | 66 | 121.7 Ų | 121.7 | 68% | 0.68 | 67% | 0.667 | S | S | * | * | trans | -167.1 | 161.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | V624 | G622-V624 PolarHBondContact O-N 3.22Š| ||
| 623 | R | 49.4 | Very low | 59.3 | Low | 199 Ų | 199 | 120.1 Ų | 120.1 | 75% | 0.751 | 66% | 0.662 | S | S | * | * | trans | -63.8 | 128.8 | 170.5 | -67.6 | -173.9 | -176.6 | -171.5 | -0.6 | 108.2 | Q625 M680 | R623-Q625 VanDerWaalsContact C-N 3.34Å; R623-Q625 PolarHBondContact O-N 3.33Å; R623-M680 PolarHBondContact NH1-OXT 3.43Å | ||
| 624 | V | 49.3 | Very low | 61.4 | Low | 117 Ų | 117 | 118 Ų | 118 | 71% | 0.709 | 64% | 0.642 | S | S | * | * | trans | -66.3 | 99.7 | 167.7 | 179.6 | 0 | 0 | 0 | 0 | 106.8 | G622 E626 | G622-V624 PolarHBondContact O-N 3.22Å; V624-E626 PolarHBondContact O-N 3.23Å | ||
| 625 | Q | 61.5 | Low | 64.5 | Low | 128 Ų | 128 | 111.9 Ų | 111.9 | 60% | 0.598 | 62% | 0.62 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 116.9 | 172.7 | -73.7 | 172 | -18.1 | 0 | 0 | 107.2 | R623 I627 Q635 | R623-Q625 VanDerWaalsContact C-N 3.34Å; R623-Q625 PolarHBondContact O-N 3.33Å; Q625-I627 PolarHBondContact O-N 3.13Å; Q625-Q635 HydrophobicContact CB-CG 4.31Å |
| 626 | E | 82.6 | Confident | 67.1 | Low | 109 Ų | 109 | 101.9 Ų | 101.9 | 51% | 0.509 | 58% | 0.583 | S | S | . | * | P | Polyproline II helix | trans | -63.5 | 136.7 | 178.7 | -63.4 | -179.2 | 153.7 | 0 | 0 | 109.1 | V624 V636 | V624-E626 PolarHBondContact O-N 3.23Å; E626-V636 HydrophobicContact CB-CB 4.07Å; E626-V636 HydrophobicContact CB-CG2 3.84Å; E626-V636 WeakPolarHBondContact O-CG2 3.23Å; E626-V636 PolarHBondContact O-N 2.9Å |
| 627 | I | 91.4 | Very high | 69.6 | Low | 101 Ų | 101 | 98.3 Ų | 98.3 | 52% | 0.518 | 56% | 0.557 | S | S | . | * | B | Isolated β-bridge | trans | -102.6 | 139.2 | -176.9 | -54.1 | 178.7 | 0 | 0 | 0 | 108 | Q625 I629 M632 | Q625-I627 PolarHBondContact O-N 3.13Å; I627-I629 PolarHBondContact O-N 3.4Å; I627-M632 WeakPolarHBondContact CG2-O 3.49Å |
| 628 | C | 93.1 | Very high | 72.3 | Confident | 1 Ų | 1 | 93.9 Ų | 93.9 | 1% | 0.007 | 52% | 0.521 | C | S | . | . | P | Polyproline II helix | trans | -57.3 | 126.1 | -176.6 | 173.7 | 0 | 0 | 0 | 0 | 111.8 | Q630 M632 N634 L647 C649 | C628-Q630 PolarHBondContact O-N 2.92Å; C628-Q630 VanDerWaalsContact O-N 3.12Å; C628-Q630 PolarHBondContact SG-N 2.94Å; C628-Q630 VanDerWaalsContact SG-N 3.4Å; C628-M632 WeakPolarHBondContact O-CA 3.32Å; C628-M632 PolarHBondContact O-N 2.94Å; C628-N634 VanDerWaalsContact CB-O 3.27Å; C628-N634 WeakPolarHBondContact CB-O 3.1Å; C628-N634 PolarHBondContact N-O 3.49Å; C628-L647 WeakPolarHBondContact CA-O 3.17Å; C628-C649 HydrophobicContact CB-CB 3.97Å; C628-C649 PolarHBondContact SG-N 3.03Å |
| 629 | I | 92.1 | Very high | 75.2 | Confident | 81 Ų | 81 | 86 Ų | 86 | 42% | 0.415 | 48% | 0.481 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.5 | -15.5 | -178.1 | 66.3 | 174.3 | 0 | 0 | 0 | 113.8 | I627 L647 F648 V666 | I627-I629 PolarHBondContact O-N 3.4Å; I629-L647 HydrophobicContact CD1-CB 4.02Å; I629-L647 HydrophobicContact CD1-CD1 4.2Å; I629-L647 HydrophobicContact CG1-CB 4.2Å; I629-L647 HydrophobicContact CG2-CB 4.21Å; I629-L647 PolarHBondContact N-O 3Å; I629-L647 VanDerWaalsContact N-O 3.09Å; I629-F648 HydrophobicContact CD1-CE1 3.88Å; I629-F648 HydrophobicContact CD1-CZ 3.87Å; I629-F648 HydrophobicContact CG1-CD1 4.2Å; I629-F648 HydrophobicContact CG1-CE1 3.65Å; I629-F648 HydrophobicContact CG1-CZ 4.15Å; I629-V666 HydrophobicContact CD1-CG2 4.09Å |
| 630 | Q | 88.9 | Confident | 78.3 | Confident | 105 Ų | 105 | 82.9 Ų | 82.9 | 49% | 0.491 | 45% | 0.449 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | -32 | -174.3 | -172.5 | 58.7 | 67.1 | 0 | 0 | 113.9 | C628 F648 C652 | C628-Q630 PolarHBondContact O-N 2.92Å; C628-Q630 VanDerWaalsContact O-N 3.12Å; C628-Q630 PolarHBondContact SG-N 2.94Å; C628-Q630 VanDerWaalsContact SG-N 3.4Å; Q630-F648 HydrophobicContact CB-CD1 4.14Å; Q630-F648 HydrophobicContact CB-CE1 4.31Å; Q630-C652 HydrophobicContact CB-CB 3.93Å; Q630-C652 HydrophobicContact CG-CB 3.98Å |
| 631 | C | 91.8 | Very high | 81.1 | Confident | 36 Ų | 36 | 78.6 Ų | 78.6 | 24% | 0.243 | 42% | 0.417 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -115.2 | -19.3 | 176.8 | 66.1 | 0 | 0 | 0 | 0 | 114.2 | E633 N634 | C631-E633 PolarHBondContact O-N 3.37Å; C631-N634 PolarHBondContact SG-N 3.16Å; C631-N634 VanDerWaalsContact SG-N 3.41Å; C631-N634 PolarHBondContact SG-OD1 3.49Å |
| 632 | M | 88.1 | Confident | 83.1 | Confident | 151 Ų | 151 | 76.8 Ų | 76.8 | 74% | 0.744 | 40% | 0.402 | S | S | * | . | S | Bend | trans | 56.4 | 12.2 | -174.8 | -61.6 | -171.7 | 170.5 | 0 | 0 | 115.9 | I627 C628 | I627-M632 WeakPolarHBondContact CG2-O 3.49Å; C628-M632 WeakPolarHBondContact O-CA 3.32Å; C628-M632 PolarHBondContact O-N 2.94Å |
| 633 | E | 87.1 | Confident | 85.8 | Confident | 169 Ų | 169 | 75.3 Ų | 75.3 | 79% | 0.79 | 38% | 0.381 | S | S | * | . | S | Bend | trans | -115.3 | -47.2 | -178.3 | -70.5 | 174.2 | -174.9 | 0 | 0 | 112.4 | C631 | C631-E633 PolarHBondContact O-N 3.37Š|
| 634 | N | 89.7 | Confident | 87.8 | Confident | 69 Ų | 69 | 68.4 Ų | 68.4 | 37% | 0.369 | 37% | 0.371 | S | S | . | . | S | Bend | trans | -88.6 | 150.4 | -175.9 | -56.1 | 91.3 | 0 | 0 | 0 | 112.2 | C628 C631 C649 | C628-N634 VanDerWaalsContact CB-O 3.27Å; C628-N634 WeakPolarHBondContact CB-O 3.1Å; C628-N634 PolarHBondContact N-O 3.49Å; C631-N634 PolarHBondContact SG-N 3.16Å; C631-N634 VanDerWaalsContact SG-N 3.41Å; C631-N634 PolarHBondContact SG-OD1 3.49Å; N634-C649 HydrophobicContact CB-CB 3.38Å |
| 635 | Q | 91.6 | Very high | 89.9 | Confident | 78 Ų | 78 | 65.5 Ų | 65.5 | 36% | 0.364 | 35% | 0.35 | S | S | . | . | B | Isolated β-bridge | trans | -62.3 | 146.5 | 171.8 | -174.2 | 177.2 | 104.7 | 0 | 0 | 112.5 | Q625 I637 C649 | Q625-Q635 HydrophobicContact CB-CG 4.31Å; Q635-I637 HydrophobicContact CB-CG2 4.09Å; Q635-I637 HydrophobicContact CG-CG2 3.87Å; Q635-I637 PolarHBondContact O-N 3.38Å; Q635-C649 WeakPolarHBondContact O-CA 3.2Å; Q635-C649 VanDerWaalsContact O-CB 3.29Å; Q635-C649 WeakPolarHBondContact O-CB 3.33Å |
| 636 | V | 93.6 | Very high | 91.4 | Very high | 4 Ų | 4 | 61.2 Ų | 61.2 | 2% | 0.024 | 33% | 0.331 | C | S | . | . | trans | -65.7 | 110.9 | 166.6 | 174.1 | 0 | 0 | 0 | 0 | 109.2 | E626 N646 F648 | E626-V636 HydrophobicContact CB-CB 4.07Å; E626-V636 HydrophobicContact CB-CG2 3.84Å; E626-V636 WeakPolarHBondContact O-CG2 3.23Å; E626-V636 PolarHBondContact O-N 2.9Å; V636-N646 WeakPolarHBondContact CG1-O 3.44Å; V636-N646 WeakPolarHBondContact CG1-OD1 3.4Å; V636-F648 WeakPolarHBondContact CA-O 3.48Å | ||
| 637 | I | 93.3 | Very high | 91.8 | Very high | 46 Ų | 46 | 58.8 Ų | 58.8 | 24% | 0.236 | 32% | 0.321 | C | S | . | . | trans | -140.1 | 12.7 | -177.7 | 62.9 | 167.8 | 0 | 0 | 0 | 112.3 | Q635 F648 F650 Q676 L677 | Q635-I637 HydrophobicContact CB-CG2 4.09Å; Q635-I637 HydrophobicContact CG-CG2 3.87Å; Q635-I637 PolarHBondContact O-N 3.38Å; I637-F648 PolarHBondContact N-O 3.22Å; I637-F650 HydrophobicContact CD1-CB 4Å; I637-F650 HydrophobicContact CG1-CB 4.15Å; I637-Q676 CarbonylContact O-C 3.5Å; I637-Q676 WeakPolarHBondContact O-CA 3.09Å; I637-L677 PolarHBondContact O-N 3.24Å | ||
| 638 | A | 93.2 | Very high | 91.9 | Very high | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149 | 138.9 | -176 | 0 | 0 | 0 | 0 | 0 | 113.9 | N646 F648 F650 A653 I675 | A638-N646 PolarHBondContact O-OD1 2.97Å; A638-N646 VanDerWaalsContact O-OD1 3.12Å; A638-F648 PolarHBondContact N-O 3.39Å; A638-F650 HydrophobicContact CB-CB 4.21Å; A638-F650 HydrophobicContact CB-CD2 4.14Å; A638-A653 HydrophobicContact CB-CB 3.79Å; A638-I675 WeakPolarHBondContact CA-O 3.32Å |
| 639 | A | 94.5 | Very high | 92 | Very high | 14 Ų | 14 | 54 Ų | 54 | 12% | 0.116 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.3 | 143.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | H645 N646 I675 | A639-H645 WeakPolarHBondContact CA-O 3.48Å; A639-N646 HydrophobicContact CB-CB 4.14Å; A639-I675 PolarHBondContact N-O 3.07Å; A639-I675 PolarHBondContact O-N 3.26Å |
| 640 | L | 94.5 | Very high | 92.1 | Very high | 1 Ų | 1 | 53.4 Ų | 53.4 | 1% | 0.005 | 29% | 0.291 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 136.4 | 173.5 | -65.7 | 173.4 | 0 | 0 | 0 | 111.3 | C643 G644 H645 F648 A653 I656 C664 A671 A674 | L640-C643 PolarHBondContact O-N 3.35Å; L640-G644 WeakPolarHBondContact O-CA 3.26Å; L640-G644 PolarHBondContact O-N 2.92Å; L640-H645 PolarHBondContact N-O 2.73Å; L640-H645 VanDerWaalsContact N-O 3.16Å; L640-F648 HydrophobicContact CD1-CD2 3.86Å; L640-F648 HydrophobicContact CD1-CE2 3.62Å; L640-F648 HydrophobicContact CD1-CZ 4.29Å; L640-F648 HydrophobicContact CG-CD2 4.12Å; L640-F648 HydrophobicContact CG-CE2 4.34Å; L640-A653 HydrophobicContact CD2-CB 3.88Å; L640-I656 HydrophobicContact CD1-CD1 4.27Å; L640-I656 HydrophobicContact CD1-CG2 3.99Å; L640-I656 HydrophobicContact CD2-CB 4.45Å; L640-I656 HydrophobicContact CD2-CG2 4.23Å; L640-C664 HydrophobicContact CD1-CB 3.94Å; L640-A671 HydrophobicContact CB-CB 4.26Å; L640-A671 HydrophobicContact CD1-CB 4.34Å; L640-A671 HydrophobicContact CD2-CB 4.26Å; L640-A674 HydrophobicContact CD2-CB 4.48Å |
| 641 | V | 93.8 | Very high | 92.4 | Very high | 40 Ų | 40 | 52.7 Ų | 52.7 | 24% | 0.242 | 29% | 0.291 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 137.6 | 179.4 | -179.3 | 0 | 0 | 0 | 0 | 109.1 | A671 T672 Q673 I675 | V641-A671 CarbonylContact O-C 3.36Å; V641-A671 VanDerWaalsContact O-CA 3.3Å; V641-A671 WeakPolarHBondContact O-CA 3.41Å; V641-T672 PolarHBondContact O-N 3Å; V641-T672 PolarHBondContact O-OG1 2.9Å; V641-Q673 HydrophobicContact CB-CB 4.06Å; V641-Q673 WeakPolarHBondContact CB-O 3.34Å; V641-Q673 HydrophobicContact CG2-CB 4.24Å; V641-Q673 PolarHBondContact N-O 2.93Å; V641-I675 HydrophobicContact CG2-CD1 3.47Å; V641-I675 VanDerWaalsContact CG2-CD1 3.47Å; V641-I675 HydrophobicContact CG2-CG1 3.72Å |
| 642 | P | 88.9 | Confident | 92.5 | Very high | 98 Ų | 98 | 51.5 Ų | 51.5 | 64% | 0.636 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | cis | -88.9 | -3.5 | 4.4 | 36 | -34.5 | 0 | 0 | 0 | 114.5 | G644 P670 | P642-G644 VanDerWaalsContact C-N 3.31Å; P642-G644 PolarHBondContact O-N 2.67Å; P642-P670 VanDerWaalsContact CD-O 3.23Å; P642-P670 WeakPolarHBondContact CD-O 3.34Å |
| 643 | C | 93.8 | Very high | 92.8 | Very high | 35 Ų | 35 | 44.3 Ų | 44.3 | 24% | 0.236 | 25% | 0.247 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78.4 | -4.8 | -166.2 | 69.1 | 0 | 0 | 0 | 0 | 116.2 | L640 H645 C664 S669 | L640-C643 PolarHBondContact O-N 3.35Å; C643-H645 PolarHBondContact O-N 2.95Å; C643-H645 VanDerWaalsContact O-N 3.13Å; C643-H645 PolarHBondContact O-ND1 3.26Å; C643-C664 VanDerWaalsContact SG-CB 3.59Å; C643-C664 VanDerWaalsContact SG-SG 3.66Å; C643-S669 WeakPolarHBondContact CB-OG 3.19Å |
| 644 | G | 91.1 | Very high | 93.2 | Very high | 53 Ų | 53 | 38 Ų | 38 | 55% | 0.546 | 22% | 0.221 | S | C | . | . | trans | 70 | 4.4 | 174 | 0 | 0 | 0 | 0 | 0 | 116 | L640 P642 N646 | L640-G644 WeakPolarHBondContact O-CA 3.26Å; L640-G644 PolarHBondContact O-N 2.92Å; P642-G644 VanDerWaalsContact C-N 3.31Å; P642-G644 PolarHBondContact O-N 2.67Å; G644-N646 PolarHBondContact O-N 2.88Å; G644-N646 VanDerWaalsContact O-N 3.14Å | ||
| 645 | H | 93.6 | Very high | 93.3 | Very high | 57 Ų | 57 | 40.7 Ų | 40.7 | 26% | 0.264 | 23% | 0.231 | S | C | . | . | trans | -71.8 | 110.9 | -172.6 | -78.1 | 75.7 | 0 | 0 | 0 | 111.8 | A639 L640 C643 V666 C667 | A639-H645 WeakPolarHBondContact CA-O 3.48Å; L640-H645 PolarHBondContact N-O 2.73Å; L640-H645 VanDerWaalsContact N-O 3.16Å; C643-H645 PolarHBondContact O-N 2.95Å; C643-H645 VanDerWaalsContact O-N 3.13Å; C643-H645 PolarHBondContact O-ND1 3.26Å; H645-V666 HydrophobicContact CB-CG2 4.42Å; H645-V666 VanDerWaalsContact CD2-CB 3.45Å; H645-V666 WeakPolarHBondContact CD2-CB 3.33Å; H645-V666 VanDerWaalsContact CD2-CG1 3.46Å; H645-V666 WeakPolarHBondContact CD2-CG1 3.35Å; H645-C667 PolarHBondContact CE1-SG 3.21Å; H645-C667 PolarHBondContact ND1-SG 3.22Å; H645-C667 VanDerWaalsContact ND1-SG 3.41Å | ||
| 646 | N | 92.4 | Very high | 93.4 | Very high | 38 Ų | 38 | 38.1 Ų | 38.1 | 20% | 0.203 | 22% | 0.219 | C | C | . | . | trans | -104.6 | 77.1 | -179.9 | -177.4 | 49.7 | 0 | 0 | 0 | 110.4 | V636 A638 A639 G644 L677 | V636-N646 WeakPolarHBondContact CG1-O 3.44Å; V636-N646 WeakPolarHBondContact CG1-OD1 3.4Å; A638-N646 PolarHBondContact O-OD1 2.97Å; A638-N646 VanDerWaalsContact O-OD1 3.12Å; A639-N646 HydrophobicContact CB-CB 4.14Å; G644-N646 PolarHBondContact O-N 2.88Å; G644-N646 VanDerWaalsContact O-N 3.14Å; N646-L677 HydrophobicContact CB-CD1 4.29Å; N646-L677 VanDerWaalsContact CG-CD1 3.42Å; N646-L677 WeakPolarHBondContact OD1-CD1 3.35Å | ||
| 647 | L | 92.3 | Very high | 93.2 | Very high | 57 Ų | 57 | 39.3 Ų | 39.3 | 30% | 0.298 | 23% | 0.228 | S | C | . | . | trans | -131.8 | 17.6 | 174.5 | -68.7 | 178.1 | 0 | 0 | 0 | 111.7 | C628 I629 V666 | C628-L647 WeakPolarHBondContact CA-O 3.17Å; I629-L647 HydrophobicContact CD1-CB 4.02Å; I629-L647 HydrophobicContact CD1-CD1 4.2Å; I629-L647 HydrophobicContact CG1-CB 4.2Å; I629-L647 HydrophobicContact CG2-CB 4.21Å; I629-L647 PolarHBondContact N-O 3Å; I629-L647 VanDerWaalsContact N-O 3.09Å; L647-V666 HydrophobicContact CD1-CG1 4.45Å; L647-V666 HydrophobicContact CD1-CG2 4.08Å | ||
| 648 | F | 93.5 | Very high | 93.1 | Very high | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 25% | 0.25 | C | S | . | . | B | Isolated β-bridge | trans | -127.5 | 147.9 | -168.7 | -55.9 | -76.8 | 0 | 0 | 0 | 112.3 | I629 Q630 V636 I637 A638 L640 A653 I656 P665 V666 | I629-F648 HydrophobicContact CD1-CE1 3.88Å; I629-F648 HydrophobicContact CD1-CZ 3.87Å; I629-F648 HydrophobicContact CG1-CD1 4.2Å; I629-F648 HydrophobicContact CG1-CE1 3.65Å; I629-F648 HydrophobicContact CG1-CZ 4.15Å; Q630-F648 HydrophobicContact CB-CD1 4.14Å; Q630-F648 HydrophobicContact CB-CE1 4.31Å; V636-F648 WeakPolarHBondContact CA-O 3.48Å; I637-F648 PolarHBondContact N-O 3.22Å; A638-F648 PolarHBondContact N-O 3.39Å; L640-F648 HydrophobicContact CD1-CD2 3.86Å; L640-F648 HydrophobicContact CD1-CE2 3.62Å; L640-F648 HydrophobicContact CD1-CZ 4.29Å; L640-F648 HydrophobicContact CG-CD2 4.12Å; L640-F648 HydrophobicContact CG-CE2 4.34Å; F648-A653 HydrophobicContact CB-CB 3.92Å; F648-I656 HydrophobicContact CD1-CD1 3.79Å; F648-I656 HydrophobicContact CE1-CD1 3.7Å; F648-I656 HydrophobicContact CG-CD1 4.35Å; F648-I656 HydrophobicContact CZ-CD1 4.19Å; F648-P665 HydrophobicContact CE1-CG 4.1Å; F648-P665 HydrophobicContact CZ-CB 4.21Å; F648-P665 HydrophobicContact CZ-CG 3.96Å; F648-V666 HydrophobicContact CE2-CG2 4.05Å; F648-V666 HydrophobicContact CZ-CG2 3.88Å |
| 649 | C | 94.8 | Very high | 92.8 | Very high | 1 Ų | 1 | 45.7 Ų | 45.7 | 1% | 0.007 | 26% | 0.264 | C | S | . | . | trans | -75.3 | 163.2 | 160.7 | 69.7 | 0 | 0 | 0 | 0 | 109.6 | C628 N634 Q635 D651 C652 A653 | C628-C649 HydrophobicContact CB-CB 3.97Å; C628-C649 PolarHBondContact SG-N 3.03Å; N634-C649 HydrophobicContact CB-CB 3.38Å; Q635-C649 WeakPolarHBondContact O-CA 3.2Å; Q635-C649 VanDerWaalsContact O-CB 3.29Å; Q635-C649 WeakPolarHBondContact O-CB 3.33Å; C649-D651 VanDerWaalsContact C-N 3.28Å; C649-D651 PolarHBondContact O-N 2.89Å; C649-C652 PolarHBondContact O-N 3.47Å; C649-C652 PolarHBondContact SG-N 3.27Å; C649-C652 VanDerWaalsContact SG-N 3.44Å; C649-A653 VanDerWaalsContact O-CB 3.31Å; C649-A653 WeakPolarHBondContact O-CB 3.44Å; C649-A653 PolarHBondContact O-N 2.87Å | ||
| 650 | F | 94.5 | Very high | 92 | Very high | 69 Ų | 69 | 52 Ų | 52 | 30% | 0.303 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.8 | -36.7 | -175.7 | -173.9 | -110.6 | 0 | 0 | 0 | 112.9 | I637 A638 T654 Q676 | I637-F650 HydrophobicContact CD1-CB 4Å; I637-F650 HydrophobicContact CG1-CB 4.15Å; A638-F650 HydrophobicContact CB-CB 4.21Å; A638-F650 HydrophobicContact CB-CD2 4.14Å; F650-T654 VanDerWaalsContact O-CB 3.3Å; F650-T654 WeakPolarHBondContact O-CB 3.47Å; F650-T654 PolarHBondContact O-N 3.42Å; F650-T654 PolarHBondContact O-OG1 2.92Å; F650-Q676 HydrophobicContact CD2-CB 3.64Å; F650-Q676 HydrophobicContact CD2-CG 4.15Å; F650-Q676 HydrophobicContact CE2-CB 3.88Å; F650-Q676 HydrophobicContact CG-CB 4.31Å; F650-Q676 HydrophobicContact CG-CG 4.36Å |
| 651 | D | 94.9 | Very high | 91.4 | Very high | 90 Ų | 90 | 58.9 Ų | 58.9 | 48% | 0.481 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -70.4 | -46.8 | -178.6 | -49.4 | -70.7 | 0 | 0 | 0 | 111.9 | C649 T654 Q655 | C649-D651 VanDerWaalsContact C-N 3.28Å; C649-D651 PolarHBondContact O-N 2.89Å; D651-T654 PolarHBondContact O-N 2.93Å; D651-Q655 VanDerWaalsContact O-CG 3.32Å; D651-Q655 WeakPolarHBondContact O-CG 3.43Å; D651-Q655 PolarHBondContact O-N 2.92Å |
| 652 | C | 94.3 | Very high | 91.1 | Very high | 11 Ų | 11 | 58.6 Ų | 58.6 | 7% | 0.074 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -65.7 | -39.8 | 174.9 | -70.1 | 0 | 0 | 0 | 0 | 112.3 | Q630 C649 T654 Q655 I656 | Q630-C652 HydrophobicContact CB-CB 3.93Å; Q630-C652 HydrophobicContact CG-CB 3.98Å; C649-C652 PolarHBondContact O-N 3.47Å; C649-C652 PolarHBondContact SG-N 3.27Å; C649-C652 VanDerWaalsContact SG-N 3.44Å; C652-T654 VanDerWaalsContact C-N 3.3Å; C652-T654 PolarHBondContact O-N 3.25Å; C652-Q655 PolarHBondContact O-N 3.47Å; C652-I656 WeakPolarHBondContact O-CD1 3.45Å; C652-I656 VanDerWaalsContact O-CG1 3.28Å; C652-I656 WeakPolarHBondContact O-CG1 3.38Å; C652-I656 PolarHBondContact O-N 3.5Å |
| 653 | A | 94.6 | Very high | 91.3 | Very high | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.3 | -40.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | A638 L640 F648 C649 I656 C657 A674 | A638-A653 HydrophobicContact CB-CB 3.79Å; L640-A653 HydrophobicContact CD2-CB 3.88Å; F648-A653 HydrophobicContact CB-CB 3.92Å; C649-A653 VanDerWaalsContact O-CB 3.31Å; C649-A653 WeakPolarHBondContact O-CB 3.44Å; C649-A653 PolarHBondContact O-N 2.87Å; A653-I656 PolarHBondContact O-N 3.32Å; A653-C657 PolarHBondContact O-N 3.06Å; A653-C657 VanDerWaalsContact O-N 3.17Å; A653-C657 PolarHBondContact O-SG 3.33Å; A653-A674 HydrophobicContact CB-CB 3.59Å |
| 654 | T | 93.8 | Very high | 91.2 | Very high | 37 Ų | 37 | 55.8 Ų | 55.8 | 23% | 0.227 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -67.7 | -41.1 | 176.7 | -58.5 | 0 | 0 | 0 | 0 | 111.7 | F650 D651 C652 I656 C657 Q658 | F650-T654 VanDerWaalsContact O-CB 3.3Å; F650-T654 WeakPolarHBondContact O-CB 3.47Å; F650-T654 PolarHBondContact O-N 3.42Å; F650-T654 PolarHBondContact O-OG1 2.92Å; D651-T654 PolarHBondContact O-N 2.93Å; C652-T654 VanDerWaalsContact C-N 3.3Å; C652-T654 PolarHBondContact O-N 3.25Å; T654-I656 VanDerWaalsContact C-N 3.35Å; T654-I656 PolarHBondContact O-N 2.93Å; T654-C657 PolarHBondContact O-N 2.87Å; T654-Q658 WeakPolarHBondContact O-CG 3.48Å; T654-Q658 PolarHBondContact O-N 2.95Å; T654-Q658 VanDerWaalsContact O-N 3.15Å |
| 655 | Q | 93.4 | Very high | 91.2 | Very high | 126 Ų | 126 | 56.2 Ų | 56.2 | 59% | 0.589 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -61.6 | -40.7 | 174.3 | -73 | 169.5 | 15.2 | 0 | 0 | 112.1 | D651 C652 C657 Q658 G659 | D651-Q655 VanDerWaalsContact O-CG 3.32Å; D651-Q655 WeakPolarHBondContact O-CG 3.43Å; D651-Q655 PolarHBondContact O-N 2.92Å; C652-Q655 PolarHBondContact O-N 3.47Å; Q655-C657 VanDerWaalsContact C-N 3.32Å; Q655-C657 PolarHBondContact O-N 3.18Å; Q655-Q658 CarbonylContact O-C 3.59Å; Q655-Q658 PolarHBondContact O-N 2.96Å; Q655-Q658 VanDerWaalsContact O-N 3.12Å; Q655-G659 PolarHBondContact O-N 2.95Å; Q655-G659 VanDerWaalsContact O-N 3.1Å |
| 656 | I | 92.1 | Very high | 91.1 | Very high | 23 Ų | 23 | 56.6 Ų | 56.6 | 12% | 0.118 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -59.6 | -42.9 | 174.6 | -71.2 | 160.6 | 0 | 0 | 0 | 110.8 | L640 F648 C652 A653 T654 Q658 G659 A662 M663 P665 A671 | L640-I656 HydrophobicContact CD1-CD1 4.27Å; L640-I656 HydrophobicContact CD1-CG2 3.99Å; L640-I656 HydrophobicContact CD2-CB 4.45Å; L640-I656 HydrophobicContact CD2-CG2 4.23Å; F648-I656 HydrophobicContact CD1-CD1 3.79Å; F648-I656 HydrophobicContact CE1-CD1 3.7Å; F648-I656 HydrophobicContact CG-CD1 4.35Å; F648-I656 HydrophobicContact CZ-CD1 4.19Å; C652-I656 WeakPolarHBondContact O-CD1 3.45Å; C652-I656 VanDerWaalsContact O-CG1 3.28Å; C652-I656 WeakPolarHBondContact O-CG1 3.38Å; C652-I656 PolarHBondContact O-N 3.5Å; A653-I656 PolarHBondContact O-N 3.32Å; T654-I656 VanDerWaalsContact C-N 3.35Å; T654-I656 PolarHBondContact O-N 2.93Å; I656-Q658 PolarHBondContact O-N 3.5Å; I656-G659 PolarHBondContact O-N 3.25Å; I656-A662 WeakPolarHBondContact O-CA 3.47Å; I656-M663 VanDerWaalsContact CG2-O 3.25Å; I656-M663 WeakPolarHBondContact CG2-O 3.25Å; I656-P665 HydrophobicContact CD1-CG 3.82Å; I656-P665 HydrophobicContact CG1-CG 4.37Å; I656-A671 HydrophobicContact CG2-CB 4.3Å |
| 657 | C | 91 | Very high | 91.1 | Very high | 30 Ų | 30 | 57.3 Ų | 57.3 | 20% | 0.203 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -73.3 | -10.6 | 178.3 | -60.1 | 0 | 0 | 0 | 0 | 114 | A653 T654 Q655 A674 | A653-C657 PolarHBondContact O-N 3.06Å; A653-C657 VanDerWaalsContact O-N 3.17Å; A653-C657 PolarHBondContact O-SG 3.33Å; T654-C657 PolarHBondContact O-N 2.87Å; Q655-C657 VanDerWaalsContact C-N 3.32Å; Q655-C657 PolarHBondContact O-N 3.18Å; C657-A674 PolarHBondContact SG-N 3.23Å |
| 658 | Q | 89.7 | Confident | 91.1 | Very high | 151 Ų | 151 | 60.5 Ų | 60.5 | 71% | 0.706 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.3 | -1.3 | 179 | -70.5 | 178.1 | 3.4 | 0 | 0 | 113 | T654 Q655 I656 | T654-Q658 WeakPolarHBondContact O-CG 3.48Å; T654-Q658 PolarHBondContact O-N 2.95Å; T654-Q658 VanDerWaalsContact O-N 3.15Å; Q655-Q658 CarbonylContact O-C 3.59Å; Q655-Q658 PolarHBondContact O-N 2.96Å; Q655-Q658 VanDerWaalsContact O-N 3.12Å; I656-Q658 PolarHBondContact O-N 3.5Å |
| 659 | G | 86.8 | Confident | 90.9 | Very high | 28 Ų | 28 | 62.1 Ų | 62.1 | 29% | 0.289 | 35% | 0.348 | S | S | . | . | S | Bend | trans | -70.5 | 158.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113 | Q655 I656 E661 | Q655-G659 PolarHBondContact O-N 2.95Å; Q655-G659 VanDerWaalsContact O-N 3.1Å; I656-G659 PolarHBondContact O-N 3.25Å; G659-E661 PolarHBondContact O-N 2.8Å |
| 660 | P | 78 | Confident | 90.8 | Very high | 146 Ų | 146 | 66.4 Ų | 66.4 | 95% | 0.948 | 38% | 0.376 | S | S | * | . | S | Bend | trans | -63.6 | -27.7 | 174.8 | 28.1 | -35.1 | 0 | 0 | 0 | 112.2 | ||
| 661 | E | 81.6 | Confident | 90.6 | Very high | 147 Ų | 147 | 63.1 Ų | 63.1 | 69% | 0.687 | 36% | 0.362 | S | S | * | . | S | Bend | trans | -116.7 | 82.9 | 168.7 | -65.9 | -179.1 | 169.2 | 0 | 0 | 108 | G659 M663 | G659-E661 PolarHBondContact O-N 2.8Å; E661-M663 VanDerWaalsContact C-N 3.26Å; E661-M663 HydrophobicContact CB-CE 4.18Å; E661-M663 PolarHBondContact O-N 3.27Å; E661-M663 WeakPolarHBondContact OE2-CE 3.41Å |
| 662 | A | 87.7 | Confident | 90.4 | Very high | 33 Ų | 33 | 64 Ų | 64 | 27% | 0.273 | 37% | 0.37 | S | S | . | . | trans | -72.4 | 79.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | I656 P670 A671 | I656-A662 WeakPolarHBondContact O-CA 3.47Å; A662-P670 CarbonylContact O-C 3.58Å; A662-P670 VanDerWaalsContact O-CA 3.3Å; A662-P670 WeakPolarHBondContact O-CA 3.2Å; A662-A671 PolarHBondContact O-N 2.98Å | ||
| 663 | M | 93.1 | Very high | 90.3 | Very high | 75 Ų | 75 | 68.9 Ų | 68.9 | 37% | 0.369 | 39% | 0.392 | S | S | . | . | B | Isolated β-bridge | trans | -125.9 | 146.6 | -179.2 | 57.7 | 168.3 | 164.4 | 0 | 0 | 112.3 | I656 E661 P665 L668 S669 | I656-M663 VanDerWaalsContact CG2-O 3.25Å; I656-M663 WeakPolarHBondContact CG2-O 3.25Å; E661-M663 VanDerWaalsContact C-N 3.26Å; E661-M663 HydrophobicContact CB-CE 4.18Å; E661-M663 PolarHBondContact O-N 3.27Å; E661-M663 WeakPolarHBondContact OE2-CE 3.41Å; M663-P665 WeakPolarHBondContact O-CD 3.3Å; M663-L668 HydrophobicContact SD-CD2 4.11Å; M663-S669 WeakPolarHBondContact CA-O 3.14Å |
| 664 | C | 93.1 | Very high | 90.3 | Very high | 0 Ų | 0 | 69.6 Ų | 69.6 | 0% | 0 | 40% | 0.398 | C | S | . | . | trans | -73 | 121.5 | 178.4 | 177 | 0 | 0 | 0 | 0 | 111.5 | L640 C643 V666 C667 L668 S669 | L640-C664 HydrophobicContact CD1-CB 3.94Å; C643-C664 VanDerWaalsContact SG-CB 3.59Å; C643-C664 VanDerWaalsContact SG-SG 3.66Å; C664-V666 PolarHBondContact O-N 2.71Å; C664-C667 PolarHBondContact O-N 2.97Å; C664-L668 WeakPolarHBondContact O-CA 3.48Å; C664-L668 PolarHBondContact O-N 2.82Å; C664-S669 PolarHBondContact N-O 3.4Å | ||
| 665 | P | 89.8 | Confident | 90.3 | Very high | 62 Ų | 62 | 71.6 Ų | 71.6 | 40% | 0.403 | 41% | 0.406 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.4 | -14.5 | -179.3 | -27 | 35.2 | 0 | 0 | 0 | 116.2 | F648 I656 M663 | F648-P665 HydrophobicContact CE1-CG 4.1Å; F648-P665 HydrophobicContact CZ-CB 4.21Å; F648-P665 HydrophobicContact CZ-CG 3.96Å; I656-P665 HydrophobicContact CD1-CG 3.82Å; I656-P665 HydrophobicContact CG1-CG 4.37Å; M663-P665 WeakPolarHBondContact O-CD 3.3Å |
| 666 | V | 91.4 | Very high | 90.2 | Very high | 64 Ų | 64 | 68.8 Ų | 68.8 | 39% | 0.388 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.3 | -29.7 | -176.2 | -163.4 | 0 | 0 | 0 | 0 | 112.9 | I629 H645 L647 F648 C664 | I629-V666 HydrophobicContact CD1-CG2 4.09Å; H645-V666 HydrophobicContact CB-CG2 4.42Å; H645-V666 VanDerWaalsContact CD2-CB 3.45Å; H645-V666 WeakPolarHBondContact CD2-CB 3.33Å; H645-V666 VanDerWaalsContact CD2-CG1 3.46Å; H645-V666 WeakPolarHBondContact CD2-CG1 3.35Å; L647-V666 HydrophobicContact CD1-CG1 4.45Å; L647-V666 HydrophobicContact CD1-CG2 4.08Å; F648-V666 HydrophobicContact CE2-CG2 4.05Å; F648-V666 HydrophobicContact CZ-CG2 3.88Å; C664-V666 PolarHBondContact O-N 2.71Å |
| 667 | C | 92.8 | Very high | 90.1 | Very high | 53 Ų | 53 | 70.7 Ų | 70.7 | 36% | 0.358 | 40% | 0.404 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -140 | 3.1 | -171.4 | 58.4 | 0 | 0 | 0 | 0 | 114.5 | H645 C664 S669 | H645-C667 PolarHBondContact CE1-SG 3.21Å; H645-C667 PolarHBondContact ND1-SG 3.22Å; H645-C667 VanDerWaalsContact ND1-SG 3.41Å; C664-C667 PolarHBondContact O-N 2.97Å; C667-S669 PolarHBondContact O-N 3.26Å; C667-S669 PolarHBondContact SG-OG 2.91Å |
| 668 | L | 91.5 | Very high | 89.6 | Confident | 125 Ų | 125 | 78.9 Ų | 78.9 | 65% | 0.654 | 43% | 0.43 | S | S | * | . | trans | 58.3 | 3.7 | 176.3 | -50.9 | 179.6 | 0 | 0 | 0 | 116.2 | M663 C664 | M663-L668 HydrophobicContact SD-CD2 4.11Å; C664-L668 WeakPolarHBondContact O-CA 3.48Å; C664-L668 PolarHBondContact O-N 2.82Å | ||
| 669 | S | 90.7 | Very high | 88.3 | Confident | 33 Ų | 33 | 79.5 Ų | 79.5 | 23% | 0.231 | 44% | 0.438 | C | S | . | . | trans | -66.4 | 145.9 | 172.1 | 65.1 | 0 | 0 | 0 | 0 | 111.5 | C643 M663 C664 C667 A671 | C643-S669 WeakPolarHBondContact CB-OG 3.19Å; M663-S669 WeakPolarHBondContact CA-O 3.14Å; C664-S669 PolarHBondContact N-O 3.4Å; C667-S669 PolarHBondContact O-N 3.26Å; C667-S669 PolarHBondContact SG-OG 2.91Å; S669-A671 PolarHBondContact O-N 3.34Å | ||
| 670 | P | 91.2 | Very high | 86.7 | Confident | 91 Ų | 91 | 84.8 Ų | 84.8 | 59% | 0.591 | 46% | 0.457 | S | S | * | . | B | Isolated β-bridge | trans | -59.6 | 130.9 | 175.5 | 25.7 | -34.5 | 0 | 0 | 0 | 111.3 | P642 A662 | P642-P670 VanDerWaalsContact CD-O 3.23Å; P642-P670 WeakPolarHBondContact CD-O 3.34Å; A662-P670 CarbonylContact O-C 3.58Å; A662-P670 VanDerWaalsContact O-CA 3.3Å; A662-P670 WeakPolarHBondContact O-CA 3.2Å |
| 671 | A | 92.1 | Very high | 87.1 | Confident | 1 Ų | 1 | 81.8 Ų | 81.8 | 1% | 0.008 | 43% | 0.433 | C | S | . | . | trans | -109.5 | 103.4 | -176.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | L640 V641 I656 A662 S669 | L640-A671 HydrophobicContact CB-CB 4.26Å; L640-A671 HydrophobicContact CD1-CB 4.34Å; L640-A671 HydrophobicContact CD2-CB 4.26Å; V641-A671 CarbonylContact O-C 3.36Å; V641-A671 VanDerWaalsContact O-CA 3.3Å; V641-A671 WeakPolarHBondContact O-CA 3.41Å; I656-A671 HydrophobicContact CG2-CB 4.3Å; A662-A671 PolarHBondContact O-N 2.98Å; S669-A671 PolarHBondContact O-N 3.34Å | ||
| 672 | T | 90.8 | Very high | 87.4 | Confident | 108 Ų | 108 | 78.3 Ų | 78.3 | 66% | 0.663 | 42% | 0.419 | S | S | * | . | trans | -89.4 | -21.6 | -171.8 | 56.8 | 0 | 0 | 0 | 0 | 114 | V641 | V641-T672 PolarHBondContact O-N 3Å; V641-T672 PolarHBondContact O-OG1 2.9Å | ||
| 673 | Q | 91.3 | Very high | 87.4 | Confident | 113 Ų | 113 | 80.8 Ų | 80.8 | 53% | 0.528 | 43% | 0.428 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.2 | 146.2 | -179 | -169.3 | 177.1 | 28.8 | 0 | 0 | 111.8 | V641 | V641-Q673 HydrophobicContact CB-CB 4.06Å; V641-Q673 WeakPolarHBondContact CB-O 3.34Å; V641-Q673 HydrophobicContact CG2-CB 4.24Å; V641-Q673 PolarHBondContact N-O 2.93Å |
| 674 | A | 93.7 | Very high | 87 | Confident | 15 Ų | 15 | 81.2 Ų | 81.2 | 12% | 0.124 | 43% | 0.431 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 128.7 | 166.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | L640 A653 C657 | L640-A674 HydrophobicContact CD2-CB 4.48Å; A653-A674 HydrophobicContact CB-CB 3.59Å; C657-A674 PolarHBondContact SG-N 3.23Å |
| 675 | I | 94 | Very high | 86.7 | Confident | 79 Ų | 79 | 86.3 Ų | 86.3 | 41% | 0.405 | 46% | 0.458 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.2 | 125.7 | 176 | -65.8 | -179.8 | 0 | 0 | 0 | 109.6 | A638 A639 V641 | A638-I675 WeakPolarHBondContact CA-O 3.32Å; A639-I675 PolarHBondContact N-O 3.07Å; A639-I675 PolarHBondContact O-N 3.26Å; V641-I675 HydrophobicContact CG2-CD1 3.47Å; V641-I675 VanDerWaalsContact CG2-CD1 3.47Å; V641-I675 HydrophobicContact CG2-CG1 3.72Å |
| 676 | Q | 92.6 | Very high | 86.5 | Confident | 67 Ų | 67 | 87.9 Ų | 87.9 | 31% | 0.313 | 46% | 0.462 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.5 | 123.6 | 174.7 | -165.9 | -178.7 | 44.3 | 0 | 0 | 111.3 | I637 F650 R678 | I637-Q676 CarbonylContact O-C 3.5Å; I637-Q676 WeakPolarHBondContact O-CA 3.09Å; F650-Q676 HydrophobicContact CD2-CB 3.64Å; F650-Q676 HydrophobicContact CD2-CG 4.15Å; F650-Q676 HydrophobicContact CE2-CB 3.88Å; F650-Q676 HydrophobicContact CG-CB 4.31Å; F650-Q676 HydrophobicContact CG-CG 4.36Å; Q676-R678 HydrophobicContact CG-CG 4.36Å; Q676-R678 PolarHBondContact O-N 2.65Å; Q676-R678 VanDerWaalsContact OE1-CZ 3.27Å |
| 677 | L | 90.4 | Very high | 86.1 | Confident | 64 Ų | 64 | 89.6 Ų | 89.6 | 34% | 0.335 | 47% | 0.467 | S | S | . | . | trans | -85.7 | 107.7 | 177.4 | -58.3 | -173.7 | 0 | 0 | 0 | 110.5 | I637 N646 M680 | I637-L677 PolarHBondContact O-N 3.24Å; N646-L677 HydrophobicContact CB-CD1 4.29Å; N646-L677 VanDerWaalsContact CG-CD1 3.42Å; N646-L677 WeakPolarHBondContact OD1-CD1 3.35Å; L677-M680 HydrophobicContact CD1-SD 4.13Å | ||
| 678 | R | 80.4 | Confident | 85.6 | Confident | 201 Ų | 201 | 92.4 Ų | 92.4 | 76% | 0.758 | 48% | 0.475 | S | S | * | . | trans | -102.1 | 58.5 | -178.6 | -63.6 | -175.9 | 179.9 | 175 | 1.9 | 112.5 | Q676 | Q676-R678 HydrophobicContact CG-CG 4.36Å; Q676-R678 PolarHBondContact O-N 2.65Å; Q676-R678 VanDerWaalsContact OE1-CZ 3.27Å | ||
| 679 | N | 61.2 | Low | 85.1 | Confident | 165 Ų | 165 | 89.7 Ų | 89.7 | 88% | 0.882 | 46% | 0.46 | S | S | * | . | trans | 175.3 | 98.7 | 160.7 | -90 | -27.1 | 0 | 0 | 0 | 109.8 | ||||
| 680 | M | 52.8 | Low | 84.6 | Confident | 139 Ų | 139 | 94.8 Ų | 94.8 | 69% | 0.685 | 48% | 0.481 | S | S | * | . | trans | -140 | 0 | 170.1 | -70.7 | -172.8 | 67.9 | 0 | 0 | 110.8 | R623 L677 | R623-M680 PolarHBondContact NH1-OXT 3.43Å; L677-M680 HydrophobicContact CD1-SD 4.13Å |
Retrieved 680 of 680 residues in 304.6 ms
(Link to these results)