| 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 | 33.5 | Very low | 36.2 | Very low | 235 Ų | 235 | 152.5 Ų | 152.5 | 100% | 1.158 | 81% | 0.807 | S | S | * | * | 0 | 133.7 | 0 | -89.8 | -63.1 | -173.3 | 0 | 0 | 108.7 | |||||
| 2 | P | 51.8 | Low | 36.1 | Very low | 113 Ų | 113 | 151.2 Ų | 151.2 | 73% | 0.734 | 79% | 0.793 | S | S | * | * | cis | -120.6 | 167.2 | -23.2 | 38.1 | -25.2 | 0 | 0 | 0 | 112.7 | ||||
| 3 | A | 35.7 | Very low | 35.7 | Very low | 103 Ų | 103 | 151.6 Ų | 151.6 | 85% | 0.851 | 80% | 0.796 | S | S | * | * | trans | -146.9 | 141.7 | 168.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 4 | V | 38.7 | Very low | 35.5 | Very low | 122 Ų | 122 | 153 Ų | 153 | 74% | 0.739 | 80% | 0.803 | S | S | * | * | trans | -162 | 138.3 | -159.1 | 171 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 5 | K | 33.7 | Very low | 35.1 | Very low | 193 Ų | 193 | 149.1 Ų | 149.1 | 84% | 0.839 | 80% | 0.802 | S | S | * | * | cis | -160 | 167.5 | -1.4 | -107.1 | 167.7 | -173.1 | 170.9 | 0 | 105.5 | ||||
| 6 | K | 32.3 | Very low | 34.9 | Very low | 161 Ų | 161 | 150.4 Ų | 150.4 | 70% | 0.7 | 81% | 0.807 | S | S | * | * | cis | -165.6 | 137 | -6.8 | 169.3 | -134.2 | 167.5 | -173.7 | 0 | 106.7 | ||||
| 7 | E | 28.9 | Very low | 34.5 | Very low | 183 Ų | 183 | 147.1 Ų | 147.1 | 86% | 0.855 | 81% | 0.805 | S | S | * | * | trans | -117.7 | 161.9 | 164.3 | -68.4 | -171.9 | 134 | 0 | 0 | 111.5 | ||||
| 8 | F | 32.8 | Very low | 34.2 | Very low | 177 Ų | 177 | 148.7 Ų | 148.7 | 78% | 0.776 | 81% | 0.812 | S | S | * | * | trans | -167.2 | 160.1 | 161.3 | -95.1 | -54.1 | 0 | 0 | 0 | 108.4 | ||||
| 9 | P | 45.8 | Very low | 34 | Very low | 121 Ų | 121 | 145.3 Ų | 145.3 | 79% | 0.786 | 81% | 0.806 | S | S | * | * | trans | -132.3 | -149.3 | -131.9 | 37.2 | -14.1 | 0 | 0 | 0 | 112.2 | ||||
| 10 | G | 30.6 | Very low | 33.9 | Very low | 64 Ų | 64 | 144.2 Ų | 144.2 | 66% | 0.66 | 80% | 0.803 | S | S | * | * | trans | -127.4 | -170.2 | 168.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 11 | R | 34.1 | Very low | 33.6 | Very low | 205 Ų | 205 | 146.5 Ų | 146.5 | 77% | 0.774 | 81% | 0.805 | S | S | * | * | trans | 83 | 124.1 | -179.2 | -53.7 | -160.8 | 90.7 | 169.9 | -1.1 | 117.4 | ||||
| 12 | E | 34.8 | Very low | 33.8 | Very low | 137 Ų | 137 | 142.6 Ų | 142.6 | 64% | 0.64 | 78% | 0.784 | S | S | * | * | 50.4 | 147.2 | 122.2 | -63.6 | 137.9 | -110.3 | 0 | 0 | 122.1 | |||||
| 13 | D | 31.9 | Very low | 33.6 | Very low | 157 Ų | 157 | 143 Ų | 143 | 84% | 0.84 | 79% | 0.786 | S | S | * | * | trans | 63 | 106.6 | 164.8 | -62.2 | -15.5 | 0 | 0 | 0 | 121.5 | ||||
| 14 | L | 32.3 | Very low | 33.6 | Very low | 171 Ų | 171 | 143.6 Ų | 143.6 | 90% | 0.895 | 78% | 0.78 | S | S | * | * | -156.1 | 127 | 128.5 | -139.8 | 155 | 0 | 0 | 0 | 111.2 | |||||
| 15 | A | 29.4 | Very low | 33.2 | Very low | 94 Ų | 94 | 146 Ų | 146 | 78% | 0.777 | 79% | 0.788 | S | S | * | * | trans | -124.9 | 105.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 16 | L | 31.6 | Very low | 33.2 | Very low | 170 Ų | 170 | 140.8 Ų | 140.8 | 89% | 0.89 | 78% | 0.781 | S | S | * | * | trans | -164.7 | 107.4 | 158.9 | -146.7 | 74.6 | 0 | 0 | 0 | 112.7 | ||||
| 17 | A | 29.2 | Very low | 33.2 | Very low | 94 Ų | 94 | 137.6 Ų | 137.6 | 78% | 0.777 | 78% | 0.784 | S | S | * | * | trans | -168.1 | 131.9 | 156.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 18 | L | 29.3 | Very low | 33.5 | Very low | 176 Ų | 176 | 136.6 Ų | 136.6 | 92% | 0.921 | 78% | 0.784 | S | S | * | * | trans | 55.7 | 90.4 | 161.9 | -53.1 | -176.6 | 0 | 0 | 0 | 118.2 | ||||
| 19 | A | 30.4 | Very low | 33.8 | Very low | 84 Ų | 84 | 134.2 Ų | 134.2 | 69% | 0.694 | 79% | 0.786 | S | S | * | * | trans | -98.2 | -179.5 | 150.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 20 | T | 31.5 | Very low | 33.1 | Very low | 123 Ų | 123 | 135.9 Ų | 135.9 | 76% | 0.755 | 79% | 0.788 | S | S | * | * | trans | 73.7 | 146.1 | -175.6 | 81.3 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 21 | F | 27.8 | Very low | 34.3 | Very low | 194 Ų | 194 | 138.3 Ų | 138.3 | 85% | 0.851 | 79% | 0.791 | S | S | * | * | cis | -132.4 | 156 | 6.5 | -106.8 | -82 | 0 | 0 | 0 | 112 | ||||
| 22 | H | 38 | Very low | 35 | Very low | 152 Ų | 152 | 134.3 Ų | 134.3 | 70% | 0.704 | 79% | 0.792 | S | S | * | * | trans | -92.6 | 161 | 157.4 | -134.6 | -90.1 | 0 | 0 | 0 | 108.4 | ||||
| 23 | P | 45.8 | Very low | 35 | Very low | 122 Ų | 122 | 135.2 Ų | 135.2 | 79% | 0.792 | 80% | 0.8 | S | S | * | * | -148.7 | 166.7 | 107.1 | 38.1 | -22.8 | 0 | 0 | 0 | 115.7 | |||||
| 24 | T | 35.7 | Very low | 35.9 | Very low | 116 Ų | 116 | 133.8 Ų | 133.8 | 71% | 0.712 | 80% | 0.8 | S | S | * | * | trans | -121.2 | 144 | 166.4 | -45.2 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 25 | L | 31.2 | Very low | 35.7 | Very low | 172 Ų | 172 | 128.4 Ų | 128.4 | 90% | 0.901 | 79% | 0.786 | S | S | * | * | trans | -168.8 | 167 | 156.5 | -113.2 | 174.1 | 0 | 0 | 0 | 113.4 | ||||
| 26 | A | 33.5 | Very low | 35.8 | Very low | 84 Ų | 84 | 134.5 Ų | 134.5 | 69% | 0.694 | 79% | 0.79 | S | S | * | * | trans | -145.9 | 165.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 27 | A | 31.9 | Very low | 35.8 | Very low | 94 Ų | 94 | 133.9 Ų | 133.9 | 78% | 0.777 | 79% | 0.787 | S | S | * | * | trans | 72.5 | 113.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 28 | L | 35.7 | Very low | 36 | Very low | 162 Ų | 162 | 133.8 Ų | 133.8 | 85% | 0.848 | 79% | 0.786 | S | S | * | * | 34.4 | 141.2 | 127.2 | -63.4 | 177.7 | 0 | 0 | 0 | 120.6 | |||||
| 29 | P | 39.6 | Very low | 36.9 | Very low | 126 Ų | 126 | 131.3 Ų | 131.3 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | -144.9 | -176.5 | 51.3 | 40.4 | -20.3 | 0 | 0 | 0 | 118.4 | |||||
| 30 | L | 31.5 | Very low | 37.1 | Very low | 157 Ų | 157 | 135 Ų | 135 | 82% | 0.822 | 79% | 0.788 | S | S | * | * | trans | -74.8 | 170.7 | 170.4 | -76.3 | 165.6 | 0 | 0 | 0 | 112.1 | ||||
| 31 | P | 54.9 | Low | 38.2 | Very low | 114 Ų | 114 | 134.6 Ų | 134.6 | 74% | 0.74 | 79% | 0.787 | S | S | * | * | cis | -129.9 | -150.7 | 22.4 | 40.8 | -18.9 | 0 | 0 | 0 | 112 | ||||
| 32 | P | 48 | Very low | 38.5 | Very low | 121 Ų | 121 | 130.1 Ų | 130.1 | 79% | 0.786 | 79% | 0.786 | S | S | * | * | cis | -136.2 | -135.6 | -1.7 | 44.5 | -22.6 | 0 | 0 | 0 | 115.5 | ||||
| 33 | L | 36 | Very low | 38.3 | Very low | 156 Ų | 156 | 127.7 Ų | 127.7 | 82% | 0.817 | 79% | 0.793 | S | S | * | * | trans | -149.3 | 171.5 | -174.3 | -91.2 | 175.6 | 0 | 0 | 0 | 108.4 | ||||
| 34 | P | 49.9 | Very low | 37.6 | Very low | 127 Ų | 127 | 126.7 Ų | 126.7 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | cis | -132.1 | -179.1 | 31.1 | 40.8 | -22.5 | 0 | 0 | 0 | 115.5 | ||||
| 35 | G | 29.8 | Very low | 37.4 | Very low | 58 Ų | 58 | 125.6 Ų | 125.6 | 60% | 0.598 | 80% | 0.797 | S | S | * | * | cis | 135.2 | 150.7 | -4.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 36 | Y | 30.1 | Very low | 37.3 | Very low | 222 Ų | 222 | 125.7 Ų | 125.7 | 87% | 0.871 | 80% | 0.798 | S | S | * | * | trans | -171 | 137.9 | 159.1 | -126.4 | -128.4 | 0 | 0 | 0 | 114.4 | ||||
| 37 | L | 31.7 | Very low | 38.7 | Very low | 158 Ų | 158 | 126.8 Ų | 126.8 | 83% | 0.827 | 80% | 0.797 | S | S | * | * | trans | 61.7 | 149.3 | 159.2 | -61.8 | 175.5 | 0 | 0 | 0 | 123.5 | ||||
| 38 | A | 32.8 | Very low | 39.6 | Very low | 91 Ų | 91 | 128.2 Ų | 128.2 | 75% | 0.752 | 80% | 0.799 | S | S | * | * | trans | -124.6 | -175.8 | 168.8 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 39 | P | 49.1 | Very low | 39.4 | Very low | 125 Ų | 125 | 124.8 Ų | 124.8 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | cis | -145.8 | -172.7 | 44.5 | 41.1 | -18.6 | 0 | 0 | 0 | 117.7 | ||||
| 40 | L | 34.5 | Very low | 39 | Very low | 161 Ų | 161 | 123.1 Ų | 123.1 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | trans | -87 | -173.7 | 171.1 | -83.8 | 169.4 | 0 | 0 | 0 | 111.3 | ||||
| 41 | P | 55 | Low | 38.9 | Very low | 114 Ų | 114 | 121.2 Ų | 121.2 | 74% | 0.74 | 79% | 0.79 | S | S | * | * | cis | -154.5 | -174.6 | 24.3 | 46.7 | -24.9 | 0 | 0 | 0 | 121.3 | ||||
| 42 | A | 34 | Very low | 37.9 | Very low | 100 Ų | 100 | 123.7 Ų | 123.7 | 83% | 0.826 | 80% | 0.797 | S | S | * | * | trans | 72.5 | 151.6 | 149.2 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 43 | A | 33.2 | Very low | 37.9 | Very low | 102 Ų | 102 | 123.4 Ų | 123.4 | 84% | 0.843 | 80% | 0.795 | S | S | * | * | cis | -144.4 | -170.2 | -2.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 44 | A | 32.3 | Very low | 37.6 | Very low | 100 Ų | 100 | 120 Ų | 120 | 83% | 0.826 | 79% | 0.789 | S | S | * | * | cis | -143.3 | -142.7 | 3.1 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 45 | A | 30.1 | Very low | 36.6 | Very low | 94 Ų | 94 | 119.7 Ų | 119.7 | 78% | 0.777 | 79% | 0.79 | S | S | * | * | cis | -158 | -169.4 | 2.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 46 | L | 29.7 | Very low | 36.6 | Very low | 174 Ų | 174 | 121.1 Ų | 121.1 | 91% | 0.911 | 80% | 0.796 | S | S | * | * | trans | -142 | 166.6 | -177.9 | -82.4 | 177.8 | 0 | 0 | 0 | 115.5 | ||||
| 47 | P | 63.2 | Low | 36.7 | Very low | 106 Ų | 106 | 115.9 Ų | 115.9 | 69% | 0.688 | 80% | 0.799 | S | S | * | * | trans | -107.8 | -168.5 | -163.6 | 44.1 | -38 | 0 | 0 | 0 | 115.3 | ||||
| 48 | P | 51.7 | Low | 36.5 | Very low | 125 Ų | 125 | 110.9 Ų | 110.9 | 81% | 0.812 | 79% | 0.785 | S | S | * | * | -142.3 | -160 | 93.5 | 40.2 | -21.5 | 0 | 0 | 0 | 112.4 | |||||
| 49 | A | 30 | Very low | 36.4 | Very low | 90 Ų | 90 | 117.1 Ų | 117.1 | 74% | 0.744 | 79% | 0.791 | S | S | * | * | cis | -159.4 | 159.6 | 7.9 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 50 | A | 31.1 | Very low | 35.5 | Very low | 90 Ų | 90 | 119.2 Ų | 119.2 | 74% | 0.744 | 79% | 0.79 | S | S | * | * | trans | 50.6 | 128.7 | 140.1 | 0 | 0 | 0 | 0 | 0 | 126.7 | ||||
| 51 | S | 30.9 | Very low | 35.3 | Very low | 117 Ų | 117 | 114.9 Ų | 114.9 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | 72.3 | 123.8 | 136.6 | 52.6 | 0 | 0 | 0 | 0 | 124.9 | ||||
| 52 | L | 32.1 | Very low | 34.1 | Very low | 166 Ų | 166 | 116.7 Ų | 116.7 | 87% | 0.869 | 78% | 0.78 | S | S | * | * | trans | -83.4 | 177.9 | 148.8 | -73.1 | 170 | 0 | 0 | 0 | 109.7 | ||||
| 53 | P | 48.8 | Very low | 33.9 | Very low | 115 Ų | 115 | 120.4 Ų | 120.4 | 75% | 0.747 | 79% | 0.785 | S | S | * | * | cis | -151.2 | -179.6 | 22.1 | 46.3 | -25.8 | 0 | 0 | 0 | 120.3 | ||||
| 54 | A | 29.2 | Very low | 33.8 | Very low | 84 Ų | 84 | 119.7 Ų | 119.7 | 69% | 0.694 | 78% | 0.779 | S | S | * | * | trans | 72.5 | 143.8 | 139.9 | 0 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 55 | S | 30.2 | Very low | 34.7 | Very low | 121 Ų | 121 | 120.9 Ų | 120.9 | 85% | 0.846 | 78% | 0.778 | S | S | * | * | trans | 70.3 | 158 | 156.4 | 75 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 56 | A | 29.3 | Very low | 35.3 | Very low | 89 Ų | 89 | 121.2 Ų | 121.2 | 74% | 0.736 | 77% | 0.773 | S | S | * | * | cis | -169.4 | 157.3 | -31.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 57 | A | 31 | Very low | 35.2 | Very low | 111 Ų | 111 | 121.2 Ų | 121.2 | 92% | 0.917 | 77% | 0.773 | S | S | * | * | trans | 61.1 | 164.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 58 | G | 27.4 | Very low | 33.6 | Very low | 53 Ų | 53 | 127.6 Ų | 127.6 | 55% | 0.546 | 78% | 0.783 | S | S | . | * | cis | 162.2 | 165.1 | -9.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 59 | Y | 31.6 | Very low | 33.5 | Very low | 223 Ų | 223 | 126.6 Ų | 126.6 | 88% | 0.875 | 78% | 0.776 | S | S | * | * | trans | 60.9 | 131.1 | 172.5 | 87.9 | -93.2 | 0 | 0 | 0 | 116 | ||||
| 60 | E | 29.9 | Very low | 33.8 | Very low | 168 Ų | 168 | 128.6 Ų | 128.6 | 79% | 0.785 | 78% | 0.782 | S | S | * | * | 52.9 | 144 | 94.2 | -81.5 | -154.6 | 117.9 | 0 | 0 | 116.1 | |||||
| 61 | A | 29.6 | Very low | 33.8 | Very low | 70 Ų | 70 | 135.8 Ų | 135.8 | 58% | 0.579 | 79% | 0.79 | S | S | * | * | cis | -158.9 | 166.4 | -1.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 62 | L | 31.1 | Very low | 33.7 | Very low | 153 Ų | 153 | 134.5 Ų | 134.5 | 80% | 0.801 | 79% | 0.786 | S | S | * | * | trans | 28.1 | 124.8 | 144.8 | -56.7 | 168.3 | 0 | 0 | 0 | 120 | ||||
| 63 | L | 30.4 | Very low | 33.5 | Very low | 177 Ų | 177 | 136.6 Ų | 136.6 | 93% | 0.927 | 78% | 0.784 | S | S | * | * | 166.7 | 159.2 | 110.4 | -85.2 | 174.8 | 0 | 0 | 0 | 112.3 | |||||
| 64 | A | 29.6 | Very low | 32.6 | Very low | 87 Ų | 87 | 137.5 Ų | 137.5 | 72% | 0.719 | 78% | 0.782 | S | S | * | * | trans | -147.8 | 175.7 | -177.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 65 | P | 52.4 | Low | 32.4 | Very low | 125 Ų | 125 | 138 Ų | 138 | 81% | 0.812 | 78% | 0.78 | S | S | * | * | cis | -97.1 | -90.2 | -13.4 | 20.8 | -2 | 0 | 0 | 0 | 112.9 | ||||
| 66 | P | 42 | Very low | 32.5 | Very low | 101 Ų | 101 | 139.1 Ų | 139.1 | 66% | 0.656 | 78% | 0.776 | S | S | * | * | cis | -127.4 | -176.6 | -8 | 44.2 | -27.8 | 0 | 0 | 0 | 115.7 | ||||
| 67 | L | 27.8 | Very low | 32.6 | Very low | 174 Ų | 174 | 142.5 Ų | 142.5 | 91% | 0.911 | 78% | 0.776 | S | S | * | * | trans | 70.8 | 140.4 | 161 | -57.3 | -176.5 | 0 | 0 | 0 | 122 | ||||
| 68 | R | 28.9 | Very low | 32.3 | Very low | 240 Ų | 240 | 145.9 Ų | 145.9 | 91% | 0.906 | 77% | 0.773 | S | S | * | * | trans | -118.3 | -179.8 | -178 | -91.9 | 177 | 171.1 | 164.8 | -2.9 | 109 | ||||
| 69 | P | 50.1 | Low | 32.3 | Very low | 104 Ų | 104 | 147.7 Ų | 147.7 | 68% | 0.675 | 78% | 0.783 | S | S | * | * | cis | -130.8 | -159.3 | -31.7 | 35.4 | -14.4 | 0 | 0 | 0 | 111.1 | ||||
| 70 | P | 35.3 | Very low | 32 | Very low | 133 Ų | 133 | 141.2 Ų | 141.2 | 86% | 0.864 | 78% | 0.776 | S | S | * | * | -135.6 | -166.1 | 99.9 | 38.5 | -26.8 | 0 | 0 | 0 | 114.8 | |||||
| 71 | R | 31.8 | Very low | 32.2 | Very low | 240 Ų | 240 | 138.9 Ų | 138.9 | 91% | 0.906 | 78% | 0.775 | S | S | * | * | trans | -122.5 | 143.6 | -155 | -115.9 | 178.2 | 160.6 | 147.6 | -7.9 | 114.4 | ||||
| 72 | A | 29 | Very low | 32.2 | Very low | 90 Ų | 90 | 143.9 Ų | 143.9 | 74% | 0.744 | 79% | 0.786 | S | S | * | * | trans | 64.1 | 159.3 | 147.1 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 73 | Y | 27.1 | Very low | 31.9 | Very low | 211 Ų | 211 | 144 Ų | 144 | 83% | 0.827 | 79% | 0.787 | S | S | * | * | cis | -141.3 | 172.5 | 27.3 | -146.1 | -96 | 0 | 0 | 0 | 114.8 | ||||
| 74 | L | 30.1 | Very low | 31.9 | Very low | 133 Ų | 133 | 144 Ų | 144 | 70% | 0.696 | 78% | 0.781 | S | S | * | * | trans | -71.7 | 169.5 | -174.8 | -59.4 | 156 | 0 | 0 | 0 | 112.6 | ||||
| 75 | S | 26.4 | Very low | 32 | Very low | 94 Ų | 94 | 145.7 Ų | 145.7 | 66% | 0.657 | 78% | 0.778 | S | S | * | * | cis | -156.6 | 148.3 | 37 | -67 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 76 | L | 30.7 | Very low | 31 | Very low | 146 Ų | 146 | 145.9 Ų | 145.9 | 76% | 0.764 | 78% | 0.779 | S | S | * | * | 52.1 | 139.4 | 99.4 | -45 | 166.1 | 0 | 0 | 0 | 115.4 | |||||
| 77 | H | 31.5 | Very low | 31 | Very low | 159 Ų | 159 | 149.4 Ų | 149.4 | 74% | 0.736 | 78% | 0.779 | S | S | * | * | cis | -141.8 | -174.3 | 5.4 | -142.2 | -141.2 | 0 | 0 | 0 | 108.1 | ||||
| 78 | E | 25.9 | Very low | 31.6 | Very low | 182 Ų | 182 | 144.7 Ų | 144.7 | 85% | 0.85 | 76% | 0.755 | S | S | * | * | cis | -159.2 | 144.7 | 37.1 | -168.6 | 171.2 | 158.6 | 0 | 0 | 111.7 | ||||
| 79 | A | 27.1 | Very low | 32.3 | Very low | 91 Ų | 91 | 137.1 Ų | 137.1 | 75% | 0.752 | 74% | 0.737 | S | S | * | * | trans | -147.3 | 149.9 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 80 | A | 25.9 | Very low | 32.1 | Very low | 87 Ų | 87 | 136.7 Ų | 136.7 | 72% | 0.719 | 73% | 0.729 | S | S | * | * | trans | -120.1 | 151.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 81 | P | 32.6 | Very low | 32.8 | Very low | 119 Ų | 119 | 131.4 Ų | 131.4 | 77% | 0.773 | 70% | 0.696 | S | S | * | * | trans | -92.1 | 123.6 | -154.1 | 33 | -35.6 | 0 | 0 | 0 | 115.6 | ||||
| 82 | H | 29.5 | Very low | 33.7 | Very low | 176 Ų | 176 | 121.2 Ų | 121.2 | 82% | 0.815 | 66% | 0.659 | S | S | * | * | trans | -82.8 | 112.3 | 161.4 | -74.8 | -93 | 0 | 0 | 0 | 110.6 | H84 | H82-H84 PolarHBondContact O-N 3.43Š| ||
| 83 | L | 26.2 | Very low | 34.7 | Very low | 155 Ų | 155 | 122.6 Ų | 122.6 | 81% | 0.812 | 65% | 0.651 | S | S | * | * | trans | -74.1 | 87.5 | 175.1 | -72.8 | 171.7 | 0 | 0 | 0 | 111.3 | L85 | L83-L85 PolarHBondContact O-N 3.4Š| ||
| 84 | H | 29.2 | Very low | 36.1 | Very low | 176 Ų | 176 | 119.6 Ų | 119.6 | 82% | 0.815 | 64% | 0.638 | S | S | * | * | trans | -66.2 | 109.4 | 162.4 | -94.9 | -98.8 | 0 | 0 | 0 | 109.9 | H82 | H82-H84 PolarHBondContact O-N 3.43Š| ||
| 85 | L | 32.3 | Very low | 37.3 | Very low | 123 Ų | 123 | 116 Ų | 116 | 64% | 0.644 | 62% | 0.616 | S | S | * | * | trans | -69.3 | 154.3 | 159.6 | -98.5 | 73.9 | 0 | 0 | 0 | 109.6 | L83 R87 | L83-L85 PolarHBondContact O-N 3.4Å; L85-R87 PolarHBondContact O-N 2.75Å | ||
| 86 | P | 32.3 | Very low | 38.7 | Very low | 129 Ų | 129 | 113.5 Ų | 113.5 | 84% | 0.838 | 60% | 0.599 | S | S | * | * | trans | -55.1 | 114.8 | 168.9 | -24.5 | 35 | 0 | 0 | 0 | 110.7 | D88 | P86-D88 PolarHBondContact O-N 3.23Å; P86-D88 VanDerWaalsContact O-N 3.14Å | ||
| 87 | R | 40.8 | Very low | 39.7 | Very low | 176 Ų | 176 | 109.6 Ų | 109.6 | 66% | 0.664 | 59% | 0.588 | S | S | * | * | trans | -80 | 91.3 | 179.3 | -177.9 | -178.1 | -173.2 | 164.7 | 1.5 | 108.5 | L85 P89 | L85-R87 PolarHBondContact O-N 2.75Å; R87-P89 WeakPolarHBondContact O-CD 3.44Å | ||
| 88 | D | 41.2 | Very low | 40.8 | Very low | 74 Ų | 74 | 105 Ų | 105 | 40% | 0.396 | 57% | 0.571 | S | S | . | * | trans | -65.4 | 111.9 | 168.8 | 179 | -4.5 | 0 | 0 | 0 | 109.2 | P86 L90 A91 R130 | P86-D88 PolarHBondContact O-N 3.23Å; P86-D88 VanDerWaalsContact O-N 3.14Å; D88-L90 WeakPolarHBondContact OD1-CA 3.33Å; D88-L90 WeakPolarHBondContact OD1-CB 3.39Å; D88-L90 PolarHBondContact OD1-N 3.45Å; D88-A91 HydrophobicContact CB-CB 4Å; D88-A91 PolarHBondContact OD1-N 2.76Å; D88-A91 WeakPolarHBondContact OD2-CB 3.47Å; D88-R130 PolarHBondContact O-NH2 3.13Å | ||
| 89 | P | 43.1 | Very low | 42.1 | Very low | 81 Ų | 81 | 96.7 Ų | 96.7 | 53% | 0.526 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -75.9 | -32.5 | 177.5 | 32.7 | -32.7 | 0 | 0 | 0 | 111.2 | R87 A91 L92 E93 | R87-P89 WeakPolarHBondContact O-CD 3.44Å; P89-A91 VanDerWaalsContact C-N 3.29Å; P89-A91 PolarHBondContact O-N 2.87Å; P89-L92 WeakPolarHBondContact O-CA 3.3Å; P89-L92 WeakPolarHBondContact O-CB 3.42Å; P89-L92 PolarHBondContact O-N 2.67Å; P89-E93 PolarHBondContact O-N 3.21Å |
| 90 | L | 46.8 | Very low | 43.2 | Very low | 96 Ų | 96 | 96.1 Ų | 96.1 | 50% | 0.503 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -68.6 | -29.9 | -178.9 | -55.2 | 178.3 | 0 | 0 | 0 | 111.4 | D88 R94 | D88-L90 WeakPolarHBondContact OD1-CA 3.33Å; D88-L90 WeakPolarHBondContact OD1-CB 3.39Å; D88-L90 PolarHBondContact OD1-N 3.45Å; L90-R94 VanDerWaalsContact O-CB 3.32Å; L90-R94 WeakPolarHBondContact O-CB 3.43Å; L90-R94 WeakPolarHBondContact O-CD 3.26Å; L90-R94 WeakPolarHBondContact O-CG 3.4Å; L90-R94 PolarHBondContact O-N 3.31Å |
| 91 | A | 48.9 | Very low | 44.4 | Very low | 22 Ų | 22 | 96.2 Ų | 96.2 | 18% | 0.182 | 53% | 0.529 | C | S | . | . | H | α-helix | trans | -63.1 | -42.3 | 168.2 | 0 | 0 | 0 | 0 | 0 | 112 | D88 P89 F95 | D88-A91 HydrophobicContact CB-CB 4Å; D88-A91 PolarHBondContact OD1-N 2.76Å; D88-A91 WeakPolarHBondContact OD2-CB 3.47Å; P89-A91 VanDerWaalsContact C-N 3.29Å; P89-A91 PolarHBondContact O-N 2.87Å; A91-F95 WeakPolarHBondContact O-CD2 3.47Å; A91-F95 PolarHBondContact O-N 3.08Å; A91-F95 VanDerWaalsContact O-N 3.15Å |
| 92 | L | 52.1 | Low | 45.5 | Very low | 25 Ų | 25 | 91.4 Ų | 91.4 | 13% | 0.131 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -67.7 | -47 | 177.8 | -176.5 | 62 | 0 | 0 | 0 | 110.6 | P89 R94 F95 S96 L109 P114 | P89-L92 WeakPolarHBondContact O-CA 3.3Å; P89-L92 WeakPolarHBondContact O-CB 3.42Å; P89-L92 PolarHBondContact O-N 2.67Å; L92-R94 PolarHBondContact O-N 2.68Å; L92-F95 PolarHBondContact O-N 2.82Å; L92-F95 VanDerWaalsContact O-N 3.14Å; L92-S96 PolarHBondContact O-N 2.62Å; L92-S96 PolarHBondContact O-OG 2.95Å; L92-L109 HydrophobicContact CD1-CD2 4.42Å; L92-L109 HydrophobicContact CD2-CD2 4.12Å; L92-P114 HydrophobicContact CD1-CB 4.15Å; L92-P114 HydrophobicContact CD1-CG 4.4Å |
| 93 | E | 49.9 | Very low | 46.5 | Very low | 120 Ų | 120 | 88.5 Ų | 88.5 | 56% | 0.561 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -58.8 | -42.4 | 176.5 | -73.9 | -53.6 | 114.3 | 0 | 0 | 112.8 | P89 F95 S96 A97 | P89-E93 PolarHBondContact O-N 3.21Å; E93-F95 PolarHBondContact O-N 3.36Å; E93-S96 PolarHBondContact O-N 3.22Å; E93-A97 VanDerWaalsContact O-CB 3.32Å; E93-A97 WeakPolarHBondContact O-CB 3.28Å; E93-A97 PolarHBondContact O-N 2.82Å |
| 94 | R | 56.1 | Low | 47.9 | Very low | 148 Ų | 148 | 84.8 Ų | 84.8 | 56% | 0.558 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -64.1 | -38.3 | 175.4 | -72.2 | 169.2 | -169.2 | 128.3 | -1.6 | 112.5 | L90 L92 T98 | L90-R94 VanDerWaalsContact O-CB 3.32Å; L90-R94 WeakPolarHBondContact O-CB 3.43Å; L90-R94 WeakPolarHBondContact O-CD 3.26Å; L90-R94 WeakPolarHBondContact O-CG 3.4Å; L90-R94 PolarHBondContact O-N 3.31Å; L92-R94 PolarHBondContact O-N 2.68Å; R94-T98 VanDerWaalsContact O-CB 3.29Å; R94-T98 WeakPolarHBondContact O-CB 3.37Å; R94-T98 PolarHBondContact O-N 2.8Å; R94-T98 PolarHBondContact O-OG1 3.46Å |
| 95 | F | 55.6 | Low | 49.5 | Very low | 56 Ų | 56 | 77 Ų | 77 | 25% | 0.246 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -68.5 | -41 | 172.7 | -82.9 | -62.2 | 0 | 0 | 0 | 112 | A91 L92 E93 A99 V129 | A91-F95 WeakPolarHBondContact O-CD2 3.47Å; A91-F95 PolarHBondContact O-N 3.08Å; A91-F95 VanDerWaalsContact O-N 3.15Å; L92-F95 PolarHBondContact O-N 2.82Å; L92-F95 VanDerWaalsContact O-N 3.14Å; E93-F95 PolarHBondContact O-N 3.36Å; F95-A99 WeakPolarHBondContact O-CB 3.49Å; F95-A99 PolarHBondContact O-N 2.95Å; F95-V129 HydrophobicContact CD1-CG1 4.15Å; F95-V129 HydrophobicContact CE1-CG1 3.58Å; F95-V129 HydrophobicContact CE2-CG1 4.38Å; F95-V129 HydrophobicContact CZ-CG1 3.72Å |
| 96 | S | 54.2 | Low | 50.8 | Low | 43 Ų | 43 | 77.6 Ų | 77.6 | 30% | 0.301 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.3 | -45.1 | 175.8 | -64.5 | 0 | 0 | 0 | 0 | 112.2 | L92 E93 A99 A100 | L92-S96 PolarHBondContact O-N 2.62Å; L92-S96 PolarHBondContact O-OG 2.95Å; E93-S96 PolarHBondContact O-N 3.22Å; S96-A99 PolarHBondContact O-N 3.38Å; S96-A100 WeakPolarHBondContact O-CB 3.18Å; S96-A100 PolarHBondContact O-N 2.97Å |
| 97 | A | 52.6 | Low | 52.4 | Low | 63 Ų | 63 | 73.2 Ų | 73.2 | 52% | 0.521 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -67.4 | -41.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | E93 A99 A100 A101 | E93-A97 VanDerWaalsContact O-CB 3.32Å; E93-A97 WeakPolarHBondContact O-CB 3.28Å; E93-A97 PolarHBondContact O-N 2.82Å; A97-A99 VanDerWaalsContact C-N 3.27Å; A97-A99 PolarHBondContact O-N 2.83Å; A97-A100 PolarHBondContact O-N 2.82Å; A97-A101 PolarHBondContact O-N 2.89Å; A97-A101 VanDerWaalsContact O-N 3.17Å |
| 98 | T | 54.6 | Low | 54 | Low | 62 Ų | 62 | 69.1 Ų | 69.1 | 38% | 0.38 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -67.7 | -29.4 | 175.3 | -52.3 | 0 | 0 | 0 | 0 | 111.7 | R94 I184 | R94-T98 VanDerWaalsContact O-CB 3.29Å; R94-T98 WeakPolarHBondContact O-CB 3.37Å; R94-T98 PolarHBondContact O-N 2.8Å; R94-T98 PolarHBondContact O-OG1 3.46Å; T98-I184 HydrophobicContact CG2-CG1 4.35Å |
| 99 | A | 53.1 | Low | 55.6 | Low | 8 Ų | 8 | 70.3 Ų | 70.3 | 7% | 0.066 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -77.3 | -39.3 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | F95 S96 A97 A101 A102 F105 P107 | F95-A99 WeakPolarHBondContact O-CB 3.49Å; F95-A99 PolarHBondContact O-N 2.95Å; S96-A99 PolarHBondContact O-N 3.38Å; A97-A99 VanDerWaalsContact C-N 3.27Å; A97-A99 PolarHBondContact O-N 2.83Å; A99-A101 PolarHBondContact O-N 3.41Å; A99-A102 CarbonylContact O-C 3.38Å; A99-A102 VanDerWaalsContact O-C 3.28Å; A99-A102 WeakPolarHBondContact O-CA 3.31Å; A99-A102 PolarHBondContact O-N 3.36Å; A99-F105 HydrophobicContact CB-CB 4.16Å; A99-P107 HydrophobicContact CB-CG 4.38Å |
| 100 | A | 50 | Low | 57.1 | Low | 80 Ų | 80 | 68.6 Ų | 68.6 | 66% | 0.661 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -60.9 | -31.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | S96 A97 A102 | S96-A100 WeakPolarHBondContact O-CB 3.18Å; S96-A100 PolarHBondContact O-N 2.97Å; A97-A100 PolarHBondContact O-N 2.82Å; A100-A102 PolarHBondContact O-N 3.26Å; A100-A102 VanDerWaalsContact O-N 3.12Å |
| 101 | A | 50.4 | Low | 58.2 | Low | 88 Ų | 88 | 71 Ų | 71 | 73% | 0.727 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.5 | -2.9 | 170.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | A97 A99 | A97-A101 PolarHBondContact O-N 2.89Å; A97-A101 VanDerWaalsContact O-N 3.17Å; A99-A101 PolarHBondContact O-N 3.41Å |
| 102 | A | 55.9 | Low | 59.2 | Low | 19 Ų | 19 | 71.1 Ų | 71.1 | 16% | 0.157 | 41% | 0.413 | C | S | . | . | S | Bend | trans | -145.4 | 90.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | A99 A100 D104 F105 I184 | A99-A102 CarbonylContact O-C 3.38Å; A99-A102 VanDerWaalsContact O-C 3.28Å; A99-A102 WeakPolarHBondContact O-CA 3.31Å; A99-A102 PolarHBondContact O-N 3.36Å; A100-A102 PolarHBondContact O-N 3.26Å; A100-A102 VanDerWaalsContact O-N 3.12Å; A102-D104 PolarHBondContact O-N 2.84Å; A102-F105 HydrophobicContact CB-CD2 3.91Å; A102-F105 PolarHBondContact O-N 2.75Å; A102-I184 HydrophobicContact CB-CD1 4.46Å |
| 103 | P | 51 | Low | 60.4 | Low | 114 Ų | 114 | 72.5 Ų | 72.5 | 74% | 0.74 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.3 | -17.8 | -163.4 | 21.1 | -34.4 | 0 | 0 | 0 | 116.2 | F105 | P103-F105 VanDerWaalsContact C-N 3.26Å; P103-F105 PolarHBondContact O-N 2.98Å |
| 104 | D | 55.8 | Low | 62 | Low | 78 Ų | 78 | 66.8 Ų | 66.8 | 42% | 0.417 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.1 | -22 | 171.5 | -54.9 | -73.7 | 0 | 0 | 0 | 113.7 | A102 Q106 K172 K174 | A102-D104 PolarHBondContact O-N 2.84Å; D104-Q106 PolarHBondContact O-N 2.95Å; D104-K172 WeakPolarHBondContact O-CD 3.33Å; D104-K172 WeakPolarHBondContact O-CE 3.49Å; D104-K172 PolarHBondContact O-NZ 2.9Å; D104-K174 IonicContact OD2-NZ 3.89Å; D104-K174 PolarHBondContact OD2-NZ 3.46Å |
| 105 | F | 63.1 | Low | 63.5 | Low | 13 Ų | 13 | 59.8 Ų | 59.8 | 6% | 0.057 | 37% | 0.365 | C | S | . | . | trans | -93 | 97.8 | -175.2 | -73.9 | -81.3 | 0 | 0 | 0 | 111.5 | A99 A102 P103 P107 H171 K174 L179 I184 | A99-F105 HydrophobicContact CB-CB 4.16Å; A102-F105 HydrophobicContact CB-CD2 3.91Å; A102-F105 PolarHBondContact O-N 2.75Å; P103-F105 VanDerWaalsContact C-N 3.26Å; P103-F105 PolarHBondContact O-N 2.98Å; F105-P107 WeakPolarHBondContact O-CD 3.35Å; F105-H171 AromaticContact CD1-CD2 3.76Å; F105-H171 AromaticContact CD1-NE2 3.9Å; F105-H171 HydrophobicContact CE1-CB 4.39Å; F105-H171 AromaticContact CE1-CD2 3.19Å; F105-H171 WeakPolarHBondContact CE1-CD2 3.48Å; F105-H171 AromaticContact CE1-CG 3.93Å; F105-H171 AromaticContact CE1-NE2 3.83Å; F105-H171 AromaticContact CZ-CD2 3.78Å; F105-K174 HydrophobicContact CE2-CD 3.89Å; F105-K174 HydrophobicContact CZ-CD 3.9Å; F105-L179 HydrophobicContact CE1-CD1 3.6Å; F105-L179 HydrophobicContact CE1-CD2 3.74Å; F105-L179 HydrophobicContact CE1-CG 4.29Å; F105-L179 HydrophobicContact CE2-CD2 4.05Å; F105-L179 HydrophobicContact CZ-CD1 3.99Å; F105-L179 HydrophobicContact CZ-CD2 3.24Å; F105-L179 HydrophobicContact CZ-CG 4.24Å; F105-I184 HydrophobicContact CD1-CG2 4.39Å; F105-I184 HydrophobicContact CD2-CD1 4.15Å; F105-I184 HydrophobicContact CE2-CD1 4.3Å | ||
| 106 | Q | 59.8 | Low | 65.2 | Low | 135 Ų | 135 | 57.5 Ų | 57.5 | 63% | 0.631 | 36% | 0.356 | S | S | * | . | trans | -106.1 | 105.7 | 168.9 | -72.6 | 172.5 | -24 | 0 | 0 | 108 | D104 L108 | D104-Q106 PolarHBondContact O-N 2.95Å; Q106-L108 PolarHBondContact O-N 2.82Å | ||
| 107 | P | 65.6 | Low | 67 | Low | 37 Ų | 37 | 58.6 Ų | 58.6 | 24% | 0.24 | 36% | 0.356 | C | S | . | . | trans | -70.1 | 122.2 | 171.6 | 28.4 | -31.8 | 0 | 0 | 0 | 109.5 | A99 F105 C115 | A99-P107 HydrophobicContact CB-CG 4.38Å; F105-P107 WeakPolarHBondContact O-CD 3.35Å; P107-C115 CarbonylContact C-O 3.56Å; P107-C115 VanDerWaalsContact CA-O 3.32Å; P107-C115 WeakPolarHBondContact CA-O 3.41Å | ||
| 108 | L | 74.9 | Confident | 68.9 | Low | 89 Ų | 89 | 55.7 Ų | 55.7 | 47% | 0.466 | 33% | 0.332 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.5 | 129.8 | 171.6 | -67.6 | 160.3 | 0 | 0 | 0 | 108.4 | Q106 D110 C115 E117 L126 | Q106-L108 PolarHBondContact O-N 2.82Å; L108-D110 PolarHBondContact O-N 3.04Å; L108-C115 HydrophobicContact CB-CB 4.48Å; L108-C115 PolarHBondContact N-O 3.22Å; L108-C115 WeakPolarHBondContact O-CA 2.96Å; L108-C115 WeakPolarHBondContact O-CB 3.45Å; L108-C115 PolarHBondContact O-N 2.9Å; L108-E117 HydrophobicContact CD1-CB 4.2Å; L108-L126 HydrophobicContact CD1-CD2 4.08Å |
| 109 | L | 74.8 | Confident | 70.8 | Confident | 100 Ų | 100 | 55.9 Ų | 55.9 | 52% | 0.524 | 33% | 0.329 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.1 | 91.4 | 173.8 | -71.5 | 90.1 | 0 | 0 | 0 | 110.2 | L92 | L92-L109 HydrophobicContact CD1-CD2 4.42Å; L92-L109 HydrophobicContact CD2-CD2 4.12Å |
| 110 | D | 73.3 | Confident | 72.6 | Confident | 45 Ų | 45 | 55.6 Ų | 55.6 | 24% | 0.241 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.6 | 116.4 | 167.9 | 178.3 | 68.5 | 0 | 0 | 0 | 109 | L108 G112 E113 Y128 R142 | L108-D110 PolarHBondContact O-N 3.04Å; D110-G112 PolarHBondContact O-N 3.43Å; D110-E113 PolarHBondContact N-O 3.41Å; D110-E113 PolarHBondContact O-N 3.36Å; D110-Y128 HydrophobicContact CB-CE1 4.25Å; D110-Y128 VanDerWaalsContact CG-OH 3.3Å; D110-Y128 WeakPolarHBondContact OD2-CE1 3.47Å; D110-Y128 PolarHBondContact OD2-OH 3.26Å; D110-R142 IonicContact OD2-NH1 2.73Å; D110-R142 PolarHBondContact OD2-NH1 2.9Å |
| 111 | N | 69.8 | Low | 74.4 | Confident | 145 Ų | 145 | 53.8 Ų | 53.8 | 78% | 0.775 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.6 | 26.9 | 178.6 | -58.3 | -72.3 | 0 | 0 | 0 | 114.6 | ||
| 112 | G | 70.9 | Confident | 76.2 | Confident | 26 Ų | 26 | 54.4 Ų | 54.4 | 27% | 0.268 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.3 | 1.9 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | D110 | D110-G112 PolarHBondContact O-N 3.43Š|
| 113 | E | 77.2 | Confident | 77.9 | Confident | 53 Ų | 53 | 54.8 Ų | 54.8 | 25% | 0.248 | 32% | 0.32 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.6 | 133.8 | 172.4 | -77.8 | -77.3 | 98 | 0 | 0 | 111.2 | D110 C115 Y128 R130 | D110-E113 PolarHBondContact N-O 3.41Å; D110-E113 PolarHBondContact O-N 3.36Å; E113-C115 PolarHBondContact O-N 3.46Å; E113-C115 PolarHBondContact O-SG 3.07Å; E113-Y128 HydrophobicContact CB-CD1 4Å; E113-Y128 HydrophobicContact CB-CE1 4.31Å; E113-R130 WeakPolarHBondContact OE1-CD 3.34Å; E113-R130 IonicContact OE1-CZ 2.79Å; E113-R130 IonicContact OE1-NE 3.82Å; E113-R130 IonicContact OE1-NH1 3.17Å; E113-R130 PolarHBondContact OE1-NH1 3.16Å |
| 114 | P | 82.4 | Confident | 79.9 | Confident | 1 Ų | 1 | 57.1 Ų | 57.1 | 1% | 0.006 | 31% | 0.314 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.4 | 117.8 | 178.1 | 29.4 | -33.6 | 0 | 0 | 0 | 111.2 | L92 V129 R130 | L92-P114 HydrophobicContact CD1-CB 4.15Å; L92-P114 HydrophobicContact CD1-CG 4.4Å; P114-V129 PolarHBondContact O-N 2.84Å; P114-R130 HydrophobicContact CG-CG 3.96Å |
| 115 | C | 89.3 | Confident | 81.7 | Confident | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.9 | 154.2 | -177.9 | -56.1 | 0 | 0 | 0 | 0 | 110.7 | P107 L108 E113 L127 Y128 | P107-C115 CarbonylContact C-O 3.56Å; P107-C115 VanDerWaalsContact CA-O 3.32Å; P107-C115 WeakPolarHBondContact CA-O 3.41Å; L108-C115 HydrophobicContact CB-CB 4.48Å; L108-C115 PolarHBondContact N-O 3.22Å; L108-C115 WeakPolarHBondContact O-CA 2.96Å; L108-C115 WeakPolarHBondContact O-CB 3.45Å; L108-C115 PolarHBondContact O-N 2.9Å; E113-C115 PolarHBondContact O-N 3.46Å; E113-C115 PolarHBondContact O-SG 3.07Å; C115-L127 CarbonylContact C-O 3.47Å; C115-L127 VanDerWaalsContact CA-O 3.28Å; C115-L127 WeakPolarHBondContact CA-O 3.45Å; C115-Y128 WeakPolarHBondContact SG-CD1 3.38Å; C115-Y128 WeakPolarHBondContact SG-CE1 3.4Å |
| 116 | I | 90.3 | Very high | 83.1 | Confident | 9 Ų | 9 | 55.6 Ų | 55.6 | 5% | 0.046 | 31% | 0.307 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.6 | 140.3 | 165.6 | 63.6 | 168.3 | 0 | 0 | 0 | 109.8 | V118 L127 V129 H171 L179 L185 | I116-V118 HydrophobicContact CD1-CG1 4.27Å; I116-V118 HydrophobicContact CG1-CG1 4.12Å; I116-V118 PolarHBondContact O-N 3.18Å; I116-L127 HydrophobicContact CD1-CD2 4.24Å; I116-L127 HydrophobicContact CG1-CB 4.12Å; I116-L127 HydrophobicContact CG1-CD2 4.2Å; I116-L127 HydrophobicContact CG1-CG 4.32Å; I116-L127 PolarHBondContact N-O 3.47Å; I116-L127 PolarHBondContact O-N 2.73Å; I116-V129 HydrophobicContact CG2-CG2 4.33Å; I116-H171 HydrophobicContact CD1-CB 4.23Å; I116-L179 HydrophobicContact CD1-CD1 4.14Å; I116-L185 HydrophobicContact CD1-CD1 3.98Å; I116-L185 HydrophobicContact CD1-CD2 4.17Å |
| 117 | E | 92 | Very high | 84.6 | Confident | 66 Ų | 66 | 49.2 Ų | 49.2 | 31% | 0.308 | 28% | 0.277 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.2 | 126.5 | 174 | -173.6 | 177.4 | -155.9 | 0 | 0 | 110 | L108 R124 A125 L126 H171 | L108-E117 HydrophobicContact CD1-CB 4.2Å; E117-R124 IonicContact OE1-CZ 2.56Å; E117-R124 IonicContact OE1-NE 3.38Å; E117-R124 PolarHBondContact OE1-NE 2.74Å; E117-R124 IonicContact OE1-NH2 2.92Å; E117-R124 PolarHBondContact OE1-NH2 2.79Å; E117-R124 IonicContact OE2-CZ 3.55Å; E117-R124 IonicContact OE2-NE 3.69Å; E117-R124 IonicContact OE2-NH2 2.72Å; E117-R124 PolarHBondContact OE2-NH2 2.97Å; E117-A125 CarbonylContact C-O 3.28Å; E117-A125 WeakPolarHBondContact CA-O 3.17Å; E117-L126 HydrophobicContact CB-CD2 4.2Å; E117-L126 HydrophobicContact CG-CD2 4.48Å; E117-H171 PolarHBondContact O-ND1 3.11Å |
| 118 | V | 93 | Very high | 85.8 | Confident | 1 Ų | 1 | 47.6 Ų | 47.6 | 1% | 0.006 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.3 | 140.5 | 180 | -67.6 | 0 | 0 | 0 | 0 | 112 | I116 R124 A125 L127 I141 F153 I169 R170 L176 | I116-V118 HydrophobicContact CD1-CG1 4.27Å; I116-V118 HydrophobicContact CG1-CG1 4.12Å; I116-V118 PolarHBondContact O-N 3.18Å; V118-R124 CarbonylContact O-C 3.58Å; V118-R124 WeakPolarHBondContact O-CA 3.34Å; V118-A125 HydrophobicContact CG2-CB 4.28Å; V118-A125 PolarHBondContact N-O 3.11Å; V118-A125 PolarHBondContact O-N 3.21Å; V118-L127 HydrophobicContact CB-CB 4.39Å; V118-L127 HydrophobicContact CG1-CB 3.63Å; V118-L127 HydrophobicContact CG1-CD2 3.77Å; V118-L127 HydrophobicContact CG1-CG 4.37Å; V118-L127 HydrophobicContact CG2-CB 3.82Å; V118-I141 HydrophobicContact CG2-CD1 4.31Å; V118-I141 HydrophobicContact CG2-CG2 4.23Å; V118-F153 HydrophobicContact CG2-CE1 4.01Å; V118-I169 HydrophobicContact CB-CG2 3.67Å; V118-I169 HydrophobicContact CG1-CG2 4.12Å; V118-I169 HydrophobicContact CG2-CG2 4.11Å; V118-R170 CarbonylContact C-O 3.51Å; V118-R170 WeakPolarHBondContact CA-O 3.43Å; V118-R170 WeakPolarHBondContact CB-O 3.37Å; V118-L176 HydrophobicContact CG1-CD2 4.01Å |
| 119 | E | 93.7 | Very high | 86.3 | Confident | 67 Ų | 67 | 43.9 Ų | 43.9 | 31% | 0.313 | 25% | 0.247 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -111.7 | 142.4 | 178.3 | 70.6 | -155.7 | 146.6 | 0 | 0 | 110.2 | N123 I169 R170 K172 G173 | E119-N123 CarbonylContact C-O 3.55Å; E119-N123 WeakPolarHBondContact CA-O 3.38Å; E119-I169 WeakPolarHBondContact O-CA 3.02Å; E119-R170 HydrophobicContact CG-CB 3.69Å; E119-R170 PolarHBondContact N-O 3.49Å; E119-R170 PolarHBondContact O-N 3.43Å; E119-R170 WeakPolarHBondContact OE1-CB 3.5Å; E119-K172 PolarHBondContact OE1-N 3.5Å; E119-G173 WeakPolarHBondContact OE1-CA 3.32Å; E119-G173 PolarHBondContact OE1-N 3.32Å |
| 120 | C | 92 | Very high | 86.6 | Confident | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.007 | 23% | 0.233 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -143.5 | 108.8 | 172.4 | -162.5 | 0 | 0 | 0 | 0 | 108.6 | A122 N123 F153 S157 S168 I169 | C120-A122 PolarHBondContact O-N 3.28Å; C120-A122 VanDerWaalsContact O-N 3.15Å; C120-N123 PolarHBondContact N-O 2.96Å; C120-N123 PolarHBondContact O-N 3.1Å; C120-N123 VanDerWaalsContact O-N 3.09Å; C120-F153 HydrophobicContact CB-CD1 4.01Å; C120-F153 HydrophobicContact CB-CE1 3.44Å; C120-F153 VanDerWaalsContact CB-CE1 3.44Å; C120-F153 HydrophobicContact CB-CZ 3.81Å; C120-S157 VanDerWaalsContact O-CB 3.28Å; C120-S157 WeakPolarHBondContact O-CB 3.35Å; C120-S157 PolarHBondContact O-OG 3.04Å; C120-S168 PolarHBondContact SG-O 2.62Å; C120-S168 VanDerWaalsContact SG-O 3.32Å; C120-I169 HydrophobicContact CB-CG1 4.18Å |
| 121 | G | 87.7 | Confident | 87 | Confident | 43 Ų | 43 | 43.7 Ų | 43.7 | 44% | 0.443 | 24% | 0.238 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 61.4 | -119.7 | -168.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 122 | A | 87.6 | Confident | 87.7 | Confident | 101 Ų | 101 | 36.9 Ų | 36.9 | 84% | 0.835 | 20% | 0.202 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -96.3 | -9.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | C120 | C120-A122 PolarHBondContact O-N 3.28Å; C120-A122 VanDerWaalsContact O-N 3.15Å |
| 123 | N | 92.6 | Very high | 88.1 | Confident | 27 Ų | 27 | 36.3 Ų | 36.3 | 14% | 0.144 | 19% | 0.193 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -84.9 | 140.9 | 180 | -73.1 | -34.9 | 0 | 0 | 0 | 111.3 | E119 C120 R144 F153 V156 S157 | E119-N123 CarbonylContact C-O 3.55Å; E119-N123 WeakPolarHBondContact CA-O 3.38Å; C120-N123 PolarHBondContact N-O 2.96Å; C120-N123 PolarHBondContact O-N 3.1Å; C120-N123 VanDerWaalsContact O-N 3.09Å; N123-R144 PolarHBondContact OD1-NH2 3.41Å; N123-F153 HydrophobicContact CB-CE2 3.9Å; N123-F153 HydrophobicContact CB-CZ 4.19Å; N123-V156 PolarHBondContact ND2-O 3.18Å; N123-S157 VanDerWaalsContact ND2-CA 3.34Å; N123-S157 WeakPolarHBondContact ND2-CA 3.29Å; N123-S157 PolarHBondContact ND2-OG 3.35Å |
| 124 | R | 92.7 | Very high | 88.1 | Confident | 163 Ų | 163 | 35.7 Ų | 35.7 | 62% | 0.615 | 19% | 0.191 | S | C | * | . | E | Extended strand (participates in β ladder) | trans | -116.6 | 140.5 | 172.4 | -67.2 | 168 | 66.9 | 160.2 | 3.6 | 109.6 | E117 V118 H143 | E117-R124 IonicContact OE1-CZ 2.56Å; E117-R124 IonicContact OE1-NE 3.38Å; E117-R124 PolarHBondContact OE1-NE 2.74Å; E117-R124 IonicContact OE1-NH2 2.92Å; E117-R124 PolarHBondContact OE1-NH2 2.79Å; E117-R124 IonicContact OE2-CZ 3.55Å; E117-R124 IonicContact OE2-NE 3.69Å; E117-R124 IonicContact OE2-NH2 2.72Å; E117-R124 PolarHBondContact OE2-NH2 2.97Å; V118-R124 CarbonylContact O-C 3.58Å; V118-R124 WeakPolarHBondContact O-CA 3.34Å; R124-H143 PolarHBondContact O-CD2 3.14Å |
| 125 | A | 93.6 | Very high | 88.2 | Confident | 7 Ų | 7 | 35.9 Ų | 35.9 | 6% | 0.058 | 19% | 0.193 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -152.3 | 169 | -176.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | E117 V118 I141 R142 H143 F153 | E117-A125 CarbonylContact C-O 3.28Å; E117-A125 WeakPolarHBondContact CA-O 3.17Å; V118-A125 HydrophobicContact CG2-CB 4.28Å; V118-A125 PolarHBondContact N-O 3.11Å; V118-A125 PolarHBondContact O-N 3.21Å; A125-I141 HydrophobicContact CB-CG2 3.45Å; A125-I141 VanDerWaalsContact CB-CG2 3.45Å; A125-R142 WeakPolarHBondContact CB-O 3.32Å; A125-H143 HydrophobicContact CB-CB 3.85Å; A125-F153 HydrophobicContact CB-CD2 4.13Å; A125-F153 HydrophobicContact CB-CE1 4.21Å; A125-F153 HydrophobicContact CB-CE2 3.5Å; A125-F153 HydrophobicContact CB-CZ 3.55Å |
| 126 | L | 92.8 | Very high | 87.9 | Confident | 52 Ų | 52 | 38 Ų | 38 | 27% | 0.272 | 21% | 0.208 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -105.4 | 116.9 | 178.5 | -64.2 | 176.4 | 0 | 0 | 0 | 110.9 | L108 E117 Y128 I141 R142 | L108-L126 HydrophobicContact CD1-CD2 4.08Å; E117-L126 HydrophobicContact CB-CD2 4.2Å; E117-L126 HydrophobicContact CG-CD2 4.48Å; L126-Y128 HydrophobicContact CB-CE2 4.1Å; L126-Y128 WeakPolarHBondContact O-CD2 3.35Å; L126-I141 CarbonylContact O-C 3.56Å; L126-I141 WeakPolarHBondContact O-CA 3.14Å; L126-R142 PolarHBondContact N-O 3.14Å; L126-R142 PolarHBondContact O-N 3.19Å |
| 127 | L | 91.3 | Very high | 87.5 | Confident | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 116.8 | 175 | 169.8 | 59.3 | 0 | 0 | 0 | 110 | C115 I116 V118 V129 L132 I141 L176 L185 | C115-L127 CarbonylContact C-O 3.47Å; C115-L127 VanDerWaalsContact CA-O 3.28Å; C115-L127 WeakPolarHBondContact CA-O 3.45Å; I116-L127 HydrophobicContact CD1-CD2 4.24Å; I116-L127 HydrophobicContact CG1-CB 4.12Å; I116-L127 HydrophobicContact CG1-CD2 4.2Å; I116-L127 HydrophobicContact CG1-CG 4.32Å; I116-L127 PolarHBondContact N-O 3.47Å; I116-L127 PolarHBondContact O-N 2.73Å; V118-L127 HydrophobicContact CB-CB 4.39Å; V118-L127 HydrophobicContact CG1-CB 3.63Å; V118-L127 HydrophobicContact CG1-CD2 3.77Å; V118-L127 HydrophobicContact CG1-CG 4.37Å; V118-L127 HydrophobicContact CG2-CB 3.82Å; L127-V129 PolarHBondContact O-N 2.92Å; L127-L132 HydrophobicContact CD1-CB 4.36Å; L127-L132 HydrophobicContact CD1-CD1 4.14Å; L127-L132 HydrophobicContact CD1-CD2 4.43Å; L127-L132 HydrophobicContact CD2-CD2 4.23Å; L127-I141 HydrophobicContact CB-CG1 4.24Å; L127-I141 HydrophobicContact CD1-CG1 3.77Å; L127-L176 HydrophobicContact CD2-CD1 3.92Å; L127-L176 HydrophobicContact CD2-CD2 3.94Å; L127-L185 HydrophobicContact CD2-CD1 4.3Å |
| 128 | Y | 89.1 | Confident | 87.2 | Confident | 4 Ų | 4 | 42.5 Ų | 42.5 | 2% | 0.016 | 23% | 0.227 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -84.8 | 111.2 | 179.3 | -70.2 | -111.4 | 0 | 0 | 0 | 108.7 | D110 E113 C115 L126 R130 K131 L132 S140 R142 W147 | D110-Y128 HydrophobicContact CB-CE1 4.25Å; D110-Y128 VanDerWaalsContact CG-OH 3.3Å; D110-Y128 WeakPolarHBondContact OD2-CE1 3.47Å; D110-Y128 PolarHBondContact OD2-OH 3.26Å; E113-Y128 HydrophobicContact CB-CD1 4Å; E113-Y128 HydrophobicContact CB-CE1 4.31Å; C115-Y128 WeakPolarHBondContact SG-CD1 3.38Å; C115-Y128 WeakPolarHBondContact SG-CE1 3.4Å; L126-Y128 HydrophobicContact CB-CE2 4.1Å; L126-Y128 WeakPolarHBondContact O-CD2 3.35Å; Y128-R130 VanDerWaalsContact C-N 3.33Å; Y128-R130 PolarHBondContact O-N 3.31Å; Y128-K131 HydrophobicContact CG-CD 4.36Å; Y128-K131 PolarHBondContact O-N 3.41Å; Y128-L132 PolarHBondContact O-N 3.06Å; Y128-S140 PolarHBondContact N-O 3.18Å; Y128-R142 HydrophobicContact CD2-CB 4.35Å; Y128-R142 HydrophobicContact CE2-CB 3.61Å; Y128-R142 HydrophobicContact CE2-CG 4.46Å; Y128-R142 VanDerWaalsContact OH-CD 3.28Å; Y128-R142 WeakPolarHBondContact OH-CD 3.4Å; Y128-R142 PolarHBondContact OH-NH1 2.82Å; Y128-W147 AromaticContact CD1-CH2 3.8Å; Y128-W147 HydrophobicContact CD1-CH2 3.8Å; Y128-W147 HydrophobicContact CD1-CZ3 4.5Å; Y128-W147 AromaticContact CD2-CH2 3.34Å; Y128-W147 HydrophobicContact CD2-CH2 3.34Å; Y128-W147 AromaticContact CD2-CZ3 3.44Å; Y128-W147 HydrophobicContact CD2-CZ3 3.44Å; Y128-W147 VanDerWaalsContact CD2-CZ3 3.44Å; Y128-W147 AromaticContact CE1-CH2 3.79Å; Y128-W147 HydrophobicContact CE1-CH2 3.79Å; Y128-W147 HydrophobicContact CE1-CZ2 4.48Å; Y128-W147 AromaticContact CE2-CH2 3.34Å; Y128-W147 HydrophobicContact CE2-CH2 3.34Å; Y128-W147 HydrophobicContact CE2-CZ2 4.21Å; Y128-W147 AromaticContact CE2-CZ3 3.79Å; Y128-W147 HydrophobicContact CE2-CZ3 3.79Å; Y128-W147 AromaticContact CG-CH2 3.6Å; Y128-W147 HydrophobicContact CG-CH2 3.6Å; Y128-W147 AromaticContact CG-CZ3 3.85Å; Y128-W147 HydrophobicContact CG-CZ3 3.85Å; Y128-W147 AromaticContact CZ-CH2 3.57Å |
| 129 | V | 86.4 | Confident | 87 | Confident | 11 Ų | 11 | 44.4 Ų | 44.4 | 7% | 0.067 | 24% | 0.239 | C | C | . | . | G | 310 helix | trans | -62 | -42.5 | -169.4 | -178.9 | 0 | 0 | 0 | 0 | 111 | F95 P114 I116 L127 K131 L132 L185 | F95-V129 HydrophobicContact CD1-CG1 4.15Å; F95-V129 HydrophobicContact CE1-CG1 3.58Å; F95-V129 HydrophobicContact CE2-CG1 4.38Å; F95-V129 HydrophobicContact CZ-CG1 3.72Å; P114-V129 PolarHBondContact O-N 2.84Å; I116-V129 HydrophobicContact CG2-CG2 4.33Å; L127-V129 PolarHBondContact O-N 2.92Å; V129-K131 PolarHBondContact O-N 2.99Å; V129-K131 VanDerWaalsContact O-N 3.15Å; V129-L132 WeakPolarHBondContact O-CB 3.41Å; V129-L132 PolarHBondContact O-N 3.03Å; V129-L132 VanDerWaalsContact O-N 3.16Å; V129-L185 HydrophobicContact CB-CD2 4.42Å; V129-L185 HydrophobicContact CG1-CD2 3.8Å; V129-L185 HydrophobicContact CG2-CD2 3.87Å |
| 130 | R | 79.9 | Confident | 86.9 | Confident | 60 Ų | 60 | 41.2 Ų | 41.2 | 23% | 0.226 | 22% | 0.224 | C | C | . | . | G | 310 helix | trans | -64 | -13.7 | 175.4 | -73.4 | 177.4 | 176.1 | 170.6 | -5.8 | 114.8 | D88 E113 P114 Y128 C133 | D88-R130 PolarHBondContact O-NH2 3.13Å; E113-R130 WeakPolarHBondContact OE1-CD 3.34Å; E113-R130 IonicContact OE1-CZ 2.79Å; E113-R130 IonicContact OE1-NE 3.82Å; E113-R130 IonicContact OE1-NH1 3.17Å; E113-R130 PolarHBondContact OE1-NH1 3.16Å; P114-R130 HydrophobicContact CG-CG 3.96Å; Y128-R130 VanDerWaalsContact C-N 3.33Å; Y128-R130 PolarHBondContact O-N 3.31Å; R130-C133 PolarHBondContact O-SG 3.14Å; R130-C133 VanDerWaalsContact O-SG 3.33Å |
| 131 | K | 82.6 | Confident | 86.9 | Confident | 81 Ų | 81 | 41.2 Ų | 41.2 | 35% | 0.352 | 22% | 0.224 | S | C | . | . | G | 310 helix | trans | -101.8 | -10.6 | 177.7 | -59.1 | -173.7 | -175.4 | -177.9 | 0 | 113.1 | Y128 V129 C133 S140 W147 | Y128-K131 HydrophobicContact CG-CD 4.36Å; Y128-K131 PolarHBondContact O-N 3.41Å; V129-K131 PolarHBondContact O-N 2.99Å; V129-K131 VanDerWaalsContact O-N 3.15Å; K131-C133 PolarHBondContact O-N 3.2Å; K131-S140 WeakPolarHBondContact O-CB 3.42Å; K131-W147 HydrophobicContact CD-CE3 4.5Å; K131-W147 HydrophobicContact CD-CH2 3.83Å; K131-W147 HydrophobicContact CD-CZ3 3.67Å; K131-W147 VanDerWaalsContact NZ-CZ2 3.33Å |
| 132 | L | 84.5 | Confident | 87.1 | Confident | 1 Ų | 1 | 43.3 Ų | 43.3 | 1% | 0.005 | 22% | 0.218 | C | C | . | . | G | 310 helix | trans | -70.5 | -5.6 | 179 | -172.8 | 56 | 0 | 0 | 0 | 113.5 | L127 Y128 V129 Q134 G135 P150 W165 L185 V187 | L127-L132 HydrophobicContact CD1-CB 4.36Å; L127-L132 HydrophobicContact CD1-CD1 4.14Å; L127-L132 HydrophobicContact CD1-CD2 4.43Å; L127-L132 HydrophobicContact CD2-CD2 4.23Å; Y128-L132 PolarHBondContact O-N 3.06Å; V129-L132 WeakPolarHBondContact O-CB 3.41Å; V129-L132 PolarHBondContact O-N 3.03Å; V129-L132 VanDerWaalsContact O-N 3.16Å; L132-Q134 PolarHBondContact O-N 3.26Å; L132-G135 PolarHBondContact O-N 3.36Å; L132-P150 HydrophobicContact CD1-CG 4.33Å; L132-W165 HydrophobicContact CD1-CH2 4.1Å; L132-W165 HydrophobicContact CD1-CZ3 4.28Å; L132-L185 HydrophobicContact CD2-CB 4.16Å; L132-L185 HydrophobicContact CD2-CD1 4.06Å; L132-L185 HydrophobicContact CD2-CD2 4.37Å; L132-L185 HydrophobicContact CD2-CG 4.45Å; L132-V187 HydrophobicContact CD1-CG1 4.43Å; L132-V187 HydrophobicContact CG-CG1 4.05Å |
| 133 | C | 80.2 | Confident | 87.4 | Confident | 14 Ų | 14 | 38.9 Ų | 38.9 | 10% | 0.095 | 18% | 0.18 | C | C | . | . | G | 310 helix | trans | -45.9 | -40.4 | -176.6 | -57.3 | 0 | 0 | 0 | 0 | 114.4 | R130 K131 H188 | R130-C133 PolarHBondContact O-SG 3.14Å; R130-C133 VanDerWaalsContact O-SG 3.33Å; K131-C133 PolarHBondContact O-N 3.2Å; C133-H188 HydrophobicContact CB-CB 4.36Å; C133-H188 WeakPolarHBondContact O-CB 3.46Å; C133-H188 PolarHBondContact O-N 2.72Å; C133-H188 VanDerWaalsContact SG-CE1 3.56Å; C133-H188 PolarHBondContact SG-NE2 3.22Å |
| 134 | Q | 77.4 | Confident | 87.2 | Confident | 40 Ų | 40 | 47.3 Ų | 47.3 | 19% | 0.187 | 21% | 0.21 | C | C | . | . | G | 310 helix | trans | -89.1 | 2.3 | 179.7 | -70.1 | -172 | -30.5 | 0 | 0 | 115.2 | L132 S136 K137 G138 C197 S200 | L132-Q134 PolarHBondContact O-N 3.26Å; Q134-S136 PolarHBondContact O-N 3.14Å; Q134-K137 PolarHBondContact O-N 3.3Å; Q134-G138 VanDerWaalsContact OE1-CA 3.32Å; Q134-C197 HydrophobicContact CG-CB 4.31Å; Q134-C197 PolarHBondContact NE2-O 3.22Å; Q134-S200 PolarHBondContact NE2-O 2.9Å; Q134-S200 PolarHBondContact NE2-OG 2.69Å; Q134-S200 VanDerWaalsContact OE1-CB 3.32Å; Q134-S200 PolarHBondContact OE1-O 2.93Å; Q134-S200 PolarHBondContact OE1-OG 3.17Å |
| 135 | G | 84.3 | Confident | 86.9 | Confident | 6 Ų | 6 | 41.9 Ų | 41.9 | 6% | 0.062 | 21% | 0.205 | C | C | . | . | G | 310 helix | trans | 55.7 | -123.6 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L132 K137 G138 P150 | L132-G135 PolarHBondContact O-N 3.36Å; G135-K137 PolarHBondContact O-N 3Å; G135-G138 PolarHBondContact O-N 3.11Å; G135-P150 VanDerWaalsContact O-CD 3.31Å; G135-P150 WeakPolarHBondContact O-CD 3.45Å |
| 136 | S | 82.8 | Confident | 86.7 | Confident | 45 Ų | 45 | 47.9 Ų | 47.9 | 32% | 0.315 | 23% | 0.232 | S | C | . | . | G | 310 helix | trans | -66 | -15.7 | -177 | 39.5 | 0 | 0 | 0 | 0 | 115.7 | Q134 N151 | Q134-S136 PolarHBondContact O-N 3.14Å; S136-N151 VanDerWaalsContact CB-OD1 3.29Å; S136-N151 WeakPolarHBondContact CB-OD1 3.46Å |
| 137 | K | 82.3 | Confident | 86.6 | Confident | 168 Ų | 168 | 50.2 Ų | 50.2 | 73% | 0.73 | 24% | 0.237 | S | C | * | . | G | 310 helix | trans | -94.6 | -17.5 | -177.8 | -64.9 | -172.3 | 179.5 | -176.6 | 0 | 113.9 | Q134 G135 | Q134-K137 PolarHBondContact O-N 3.3Å; G135-K137 PolarHBondContact O-N 3Å |
| 138 | G | 85.6 | Confident | 86.6 | Confident | 1 Ų | 1 | 51.1 Ų | 51.1 | 1% | 0.01 | 24% | 0.242 | C | C | . | . | S | Bend | trans | -102.3 | 134.1 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q134 G135 S140 | Q134-G138 VanDerWaalsContact OE1-CA 3.32Å; G135-G138 PolarHBondContact O-N 3.11Å; G138-S140 PolarHBondContact O-N 3.07Å; G138-S140 VanDerWaalsContact O-N 3.13Å; G138-S140 PolarHBondContact O-OG 2.96Å |
| 139 | P | 88.3 | Confident | 86.7 | Confident | 41 Ų | 41 | 51.7 Ų | 51.7 | 27% | 0.266 | 25% | 0.246 | S | C | . | . | trans | -68 | 110.9 | 171.3 | 28.3 | -32.2 | 0 | 0 | 0 | 109.3 | W147 L148 | P139-W147 HydrophobicContact CB-CB 4.25Å; P139-L148 WeakPolarHBondContact CA-O 3.5Å | ||
| 140 | S | 90.7 | Very high | 87 | Confident | 0 Ų | 0 | 51.1 Ų | 51.1 | 0% | 0 | 24% | 0.243 | C | C | . | . | trans | -133.5 | -14.6 | -171.4 | 53.2 | 0 | 0 | 0 | 0 | 113.6 | Y128 K131 G138 L148 | Y128-S140 PolarHBondContact N-O 3.18Å; K131-S140 WeakPolarHBondContact O-CB 3.42Å; G138-S140 PolarHBondContact O-N 3.07Å; G138-S140 VanDerWaalsContact O-N 3.13Å; G138-S140 PolarHBondContact O-OG 2.96Å; S140-L148 PolarHBondContact N-O 3.5Å | ||
| 141 | I | 92 | Very high | 87.5 | Confident | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 25% | 0.251 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.1 | 132.7 | 179 | -59.8 | -179.5 | 0 | 0 | 0 | 108.7 | V118 A125 L126 L127 L148 P150 F153 I169 | V118-I141 HydrophobicContact CG2-CD1 4.31Å; V118-I141 HydrophobicContact CG2-CG2 4.23Å; A125-I141 HydrophobicContact CB-CG2 3.45Å; A125-I141 VanDerWaalsContact CB-CG2 3.45Å; L126-I141 CarbonylContact O-C 3.56Å; L126-I141 WeakPolarHBondContact O-CA 3.14Å; L127-I141 HydrophobicContact CB-CG1 4.24Å; L127-I141 HydrophobicContact CD1-CG1 3.77Å; I141-L148 PolarHBondContact N-O 3.19Å; I141-L148 PolarHBondContact O-N 3.11Å; I141-P150 HydrophobicContact CD1-CB 4.37Å; I141-P150 HydrophobicContact CD1-CG 4.42Å; I141-F153 HydrophobicContact CB-CB 4.47Å; I141-F153 HydrophobicContact CD1-CB 3.92Å; I141-F153 HydrophobicContact CD1-CD1 3.59Å; I141-F153 HydrophobicContact CD1-CE1 4.45Å; I141-F153 HydrophobicContact CD1-CG 4.03Å; I141-F153 HydrophobicContact CG2-CB 4.22Å; I141-F153 HydrophobicContact CG2-CD1 4.06Å; I141-F153 HydrophobicContact CG2-CD2 4.21Å; I141-F153 HydrophobicContact CG2-CE1 4.48Å; I141-F153 HydrophobicContact CG2-CG 3.9Å; I141-I169 HydrophobicContact CD1-CD1 3.87Å |
| 142 | R | 92.1 | Very high | 87.9 | Confident | 88 Ų | 88 | 52.6 Ų | 52.6 | 33% | 0.332 | 26% | 0.256 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106 | 113.1 | 174.1 | -165.6 | 178.6 | 179.6 | -163.4 | -2.8 | 109.5 | D110 A125 L126 Y128 E146 W147 | D110-R142 IonicContact OD2-NH1 2.73Å; D110-R142 PolarHBondContact OD2-NH1 2.9Å; A125-R142 WeakPolarHBondContact CB-O 3.32Å; L126-R142 PolarHBondContact N-O 3.14Å; L126-R142 PolarHBondContact O-N 3.19Å; Y128-R142 HydrophobicContact CD2-CB 4.35Å; Y128-R142 HydrophobicContact CE2-CB 3.61Å; Y128-R142 HydrophobicContact CE2-CG 4.46Å; Y128-R142 VanDerWaalsContact OH-CD 3.28Å; Y128-R142 WeakPolarHBondContact OH-CD 3.4Å; Y128-R142 PolarHBondContact OH-NH1 2.82Å; R142-E146 CarbonylContact C-O 3.59Å; R142-E146 VanDerWaalsContact CA-O 3.24Å; R142-E146 WeakPolarHBondContact CA-O 3.3Å; R142-W147 HydrophobicContact CB-CE3 4.4Å; R142-W147 HydrophobicContact CB-CH2 4.42Å; R142-W147 HydrophobicContact CB-CZ3 4.31Å |
| 143 | H | 93.1 | Very high | 88.2 | Confident | 8 Ų | 8 | 52.5 Ų | 52.5 | 4% | 0.037 | 26% | 0.255 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.1 | 124.2 | -177.4 | 175.5 | -120.5 | 0 | 0 | 0 | 108.8 | R124 A125 G145 E146 L148 F153 | R124-H143 PolarHBondContact O-CD2 3.14Å; A125-H143 HydrophobicContact CB-CB 3.85Å; H143-G145 PolarHBondContact O-N 3.01Å; H143-E146 PolarHBondContact N-O 2.96Å; H143-E146 PolarHBondContact O-N 3.38Å; H143-L148 HydrophobicContact CB-CD1 3.93Å; H143-F153 HydrophobicContact CB-CD2 4.16Å; H143-F153 HydrophobicContact CB-CE2 4.32Å; H143-F153 AromaticContact CD2-CE2 3.92Å |
| 144 | R | 88.9 | Confident | 88.7 | Confident | 203 Ų | 203 | 52.4 Ų | 52.4 | 77% | 0.766 | 25% | 0.253 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.4 | 26.4 | -178.8 | -55.4 | 179.6 | -171 | -153 | 0.9 | 114.7 | N123 | N123-R144 PolarHBondContact OD1-NH2 3.41Š|
| 145 | G | 85.9 | Confident | 89.3 | Confident | 50 Ų | 50 | 56.6 Ų | 56.6 | 52% | 0.515 | 27% | 0.271 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 97.8 | -24.8 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | H143 | H143-G145 PolarHBondContact O-N 3.01Š|
| 146 | E | 90.7 | Very high | 89.6 | Confident | 132 Ų | 132 | 59.8 Ų | 59.8 | 62% | 0.617 | 29% | 0.289 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -81.9 | 154.1 | -179.2 | -60.1 | -174.2 | 145.8 | 0 | 0 | 112.6 | R142 H143 | R142-E146 CarbonylContact C-O 3.59Å; R142-E146 VanDerWaalsContact CA-O 3.24Å; R142-E146 WeakPolarHBondContact CA-O 3.3Å; H143-E146 PolarHBondContact N-O 2.96Å; H143-E146 PolarHBondContact O-N 3.38Å |
| 147 | W | 91.3 | Very high | 89.8 | Confident | 102 Ų | 102 | 58.4 Ų | 58.4 | 39% | 0.386 | 28% | 0.28 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.6 | 113.1 | 177.7 | -76.1 | 97.7 | 0 | 0 | 0 | 111.1 | Y128 K131 P139 R142 | Y128-W147 AromaticContact CD1-CH2 3.8Å; Y128-W147 HydrophobicContact CD1-CH2 3.8Å; Y128-W147 HydrophobicContact CD1-CZ3 4.5Å; Y128-W147 AromaticContact CD2-CH2 3.34Å; Y128-W147 HydrophobicContact CD2-CH2 3.34Å; Y128-W147 AromaticContact CD2-CZ3 3.44Å; Y128-W147 HydrophobicContact CD2-CZ3 3.44Å; Y128-W147 VanDerWaalsContact CD2-CZ3 3.44Å; Y128-W147 AromaticContact CE1-CH2 3.79Å; Y128-W147 HydrophobicContact CE1-CH2 3.79Å; Y128-W147 HydrophobicContact CE1-CZ2 4.48Å; Y128-W147 AromaticContact CE2-CH2 3.34Å; Y128-W147 HydrophobicContact CE2-CH2 3.34Å; Y128-W147 HydrophobicContact CE2-CZ2 4.21Å; Y128-W147 AromaticContact CE2-CZ3 3.79Å; Y128-W147 HydrophobicContact CE2-CZ3 3.79Å; Y128-W147 AromaticContact CG-CH2 3.6Å; Y128-W147 HydrophobicContact CG-CH2 3.6Å; Y128-W147 AromaticContact CG-CZ3 3.85Å; Y128-W147 HydrophobicContact CG-CZ3 3.85Å; Y128-W147 AromaticContact CZ-CH2 3.57Å; K131-W147 HydrophobicContact CD-CE3 4.5Å; K131-W147 HydrophobicContact CD-CH2 3.83Å; K131-W147 HydrophobicContact CD-CZ3 3.67Å; K131-W147 VanDerWaalsContact NZ-CZ2 3.33Å; P139-W147 HydrophobicContact CB-CB 4.25Å; R142-W147 HydrophobicContact CB-CE3 4.4Å; R142-W147 HydrophobicContact CB-CH2 4.42Å; R142-W147 HydrophobicContact CB-CZ3 4.31Å |
| 148 | L | 90.9 | Very high | 89.9 | Confident | 19 Ų | 19 | 53.5 Ų | 53.5 | 10% | 0.099 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.2 | 148.4 | -178.6 | -56.2 | -177.5 | 0 | 0 | 0 | 111.5 | P139 S140 I141 H143 E152 F153 V156 | P139-L148 WeakPolarHBondContact CA-O 3.5Å; S140-L148 PolarHBondContact N-O 3.5Å; I141-L148 PolarHBondContact N-O 3.19Å; I141-L148 PolarHBondContact O-N 3.11Å; H143-L148 HydrophobicContact CB-CD1 3.93Å; L148-E152 HydrophobicContact CB-CB 4.12Å; L148-E152 HydrophobicContact CD2-CB 4.23Å; L148-F153 HydrophobicContact CB-CB 4.31Å; L148-F153 HydrophobicContact CD1-CB 4.22Å; L148-F153 HydrophobicContact CD1-CD2 4.39Å; L148-V156 HydrophobicContact CD1-CG2 4.35Å |
| 149 | T | 91.3 | Very high | 89.7 | Confident | 15 Ų | 15 | 58.8 Ų | 58.8 | 9% | 0.092 | 30% | 0.296 | C | S | . | . | trans | -69.1 | 161.3 | 160 | 62.7 | 0 | 0 | 0 | 0 | 110.6 | N151 E152 F153 | T149-N151 PolarHBondContact O-N 3.43Å; T149-E152 VanDerWaalsContact CB-OE2 3.24Å; T149-E152 WeakPolarHBondContact CB-OE2 3.46Å; T149-E152 VanDerWaalsContact CG2-OE2 3.24Å; T149-E152 WeakPolarHBondContact CG2-OE2 3.38Å; T149-E152 PolarHBondContact N-OE2 3.47Å; T149-E152 PolarHBondContact O-N 3Å; T149-E152 VanDerWaalsContact OG1-CG 3.31Å; T149-E152 WeakPolarHBondContact OG1-CG 3.38Å; T149-E152 PolarHBondContact OG1-N 2.88Å; T149-E152 VanDerWaalsContact OG1-N 3.12Å; T149-E152 PolarHBondContact OG1-OE2 2.84Å; T149-F153 PolarHBondContact O-N 2.96Å | ||
| 150 | P | 91.6 | Very high | 89 | Confident | 0 Ų | 0 | 62.8 Ų | 62.8 | 0% | 0 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -57 | -30.1 | 171 | -26.6 | 35.9 | 0 | 0 | 0 | 114 | L132 G135 I141 Q154 W165 I169 | L132-P150 HydrophobicContact CD1-CG 4.33Å; G135-P150 VanDerWaalsContact O-CD 3.31Å; G135-P150 WeakPolarHBondContact O-CD 3.45Å; I141-P150 HydrophobicContact CD1-CB 4.37Å; I141-P150 HydrophobicContact CD1-CG 4.42Å; P150-Q154 WeakPolarHBondContact O-CB 3.42Å; P150-Q154 PolarHBondContact O-N 3.05Å; P150-W165 HydrophobicContact CB-CB 4.27Å; P150-W165 HydrophobicContact CB-CD2 3.61Å; P150-W165 HydrophobicContact CB-CE3 3.43Å; P150-W165 VanDerWaalsContact CB-CE3 3.43Å; P150-W165 HydrophobicContact CB-CG 4.01Å; P150-W165 HydrophobicContact CB-CH2 4.49Å; P150-W165 HydrophobicContact CB-CZ3 3.91Å; P150-W165 HydrophobicContact CG-CD2 4.46Å; P150-W165 HydrophobicContact CG-CE3 4.11Å; P150-W165 HydrophobicContact CG-CH2 4.37Å; P150-W165 HydrophobicContact CG-CZ3 4.06Å; P150-I169 HydrophobicContact CB-CD1 3.96Å; P150-I169 WeakPolarHBondContact O-CD1 3.39Å |
| 151 | N | 90.6 | Very high | 88.2 | Confident | 76 Ų | 76 | 69 Ų | 69 | 41% | 0.406 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -71 | -46.6 | 175.9 | -73.4 | 8.1 | 0 | 0 | 0 | 111.6 | S136 T149 Q154 F155 | S136-N151 VanDerWaalsContact CB-OD1 3.29Å; S136-N151 WeakPolarHBondContact CB-OD1 3.46Å; T149-N151 PolarHBondContact O-N 3.43Å; N151-Q154 WeakPolarHBondContact O-CB 3.32Å; N151-Q154 PolarHBondContact O-N 2.9Å; N151-F155 PolarHBondContact O-N 3.1Å |
| 152 | E | 90.9 | Very high | 87.5 | Confident | 95 Ų | 95 | 71 Ų | 71 | 44% | 0.444 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -66.5 | -40.3 | 179.6 | -70.1 | 152.1 | 157.4 | 0 | 0 | 111.6 | L148 T149 Q154 F155 V156 | L148-E152 HydrophobicContact CB-CB 4.12Å; L148-E152 HydrophobicContact CD2-CB 4.23Å; T149-E152 VanDerWaalsContact CB-OE2 3.24Å; T149-E152 WeakPolarHBondContact CB-OE2 3.46Å; T149-E152 VanDerWaalsContact CG2-OE2 3.24Å; T149-E152 WeakPolarHBondContact CG2-OE2 3.38Å; T149-E152 PolarHBondContact N-OE2 3.47Å; T149-E152 PolarHBondContact O-N 3Å; T149-E152 VanDerWaalsContact OG1-CG 3.31Å; T149-E152 WeakPolarHBondContact OG1-CG 3.38Å; T149-E152 PolarHBondContact OG1-N 2.88Å; T149-E152 VanDerWaalsContact OG1-N 3.12Å; T149-E152 PolarHBondContact OG1-OE2 2.84Å; E152-Q154 VanDerWaalsContact C-N 3.29Å; E152-Q154 PolarHBondContact O-N 3.45Å; E152-F155 WeakPolarHBondContact O-CB 3.42Å; E152-F155 PolarHBondContact O-N 2.79Å; E152-V156 WeakPolarHBondContact O-CB 3.43Å; E152-V156 WeakPolarHBondContact O-CG2 3.47Å; E152-V156 PolarHBondContact O-N 2.99Å |
| 153 | F | 91.9 | Very high | 86.9 | Confident | 0 Ų | 0 | 77 Ų | 77 | 0% | 0 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -62.9 | -36.3 | 174.5 | 179.9 | -122.9 | 0 | 0 | 0 | 112.3 | V118 C120 N123 A125 I141 H143 L148 T149 S157 I169 | V118-F153 HydrophobicContact CG2-CE1 4.01Å; C120-F153 HydrophobicContact CB-CD1 4.01Å; C120-F153 HydrophobicContact CB-CE1 3.44Å; C120-F153 VanDerWaalsContact CB-CE1 3.44Å; C120-F153 HydrophobicContact CB-CZ 3.81Å; N123-F153 HydrophobicContact CB-CE2 3.9Å; N123-F153 HydrophobicContact CB-CZ 4.19Å; A125-F153 HydrophobicContact CB-CD2 4.13Å; A125-F153 HydrophobicContact CB-CE1 4.21Å; A125-F153 HydrophobicContact CB-CE2 3.5Å; A125-F153 HydrophobicContact CB-CZ 3.55Å; I141-F153 HydrophobicContact CB-CB 4.47Å; I141-F153 HydrophobicContact CD1-CB 3.92Å; I141-F153 HydrophobicContact CD1-CD1 3.59Å; I141-F153 HydrophobicContact CD1-CE1 4.45Å; I141-F153 HydrophobicContact CD1-CG 4.03Å; I141-F153 HydrophobicContact CG2-CB 4.22Å; I141-F153 HydrophobicContact CG2-CD1 4.06Å; I141-F153 HydrophobicContact CG2-CD2 4.21Å; I141-F153 HydrophobicContact CG2-CE1 4.48Å; I141-F153 HydrophobicContact CG2-CG 3.9Å; H143-F153 HydrophobicContact CB-CD2 4.16Å; H143-F153 HydrophobicContact CB-CE2 4.32Å; H143-F153 AromaticContact CD2-CE2 3.92Å; L148-F153 HydrophobicContact CB-CB 4.31Å; L148-F153 HydrophobicContact CD1-CB 4.22Å; L148-F153 HydrophobicContact CD1-CD2 4.39Å; T149-F153 PolarHBondContact O-N 2.96Å; F153-S157 VanDerWaalsContact O-CB 3.26Å; F153-S157 WeakPolarHBondContact O-CB 3.38Å; F153-S157 PolarHBondContact O-N 3.24Å; F153-S157 PolarHBondContact O-OG 3.36Å; F153-I169 HydrophobicContact CD1-CD1 3.92Å; F153-I169 HydrophobicContact CD1-CG1 4.01Å; F153-I169 HydrophobicContact CD1-CG2 4.43Å; F153-I169 HydrophobicContact CE1-CG1 4.37Å; F153-I169 HydrophobicContact CE1-CG2 4.21Å |
| 154 | Q | 90.9 | Very high | 86.6 | Confident | 11 Ų | 11 | 78.8 Ų | 78.8 | 5% | 0.051 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -66.7 | -41.5 | 173.9 | -173.5 | -163.4 | -36.1 | 0 | 0 | 112 | P150 N151 E152 S157 R159 A162 | P150-Q154 WeakPolarHBondContact O-CB 3.42Å; P150-Q154 PolarHBondContact O-N 3.05Å; N151-Q154 WeakPolarHBondContact O-CB 3.32Å; N151-Q154 PolarHBondContact O-N 2.9Å; E152-Q154 VanDerWaalsContact C-N 3.29Å; E152-Q154 PolarHBondContact O-N 3.45Å; Q154-S157 PolarHBondContact O-N 3.48Å; Q154-R159 HydrophobicContact CG-CB 3.87Å; Q154-R159 PolarHBondContact NE2-O 3.27Å; Q154-R159 PolarHBondContact O-N 3.01Å; Q154-A162 PolarHBondContact NE2-O 3.42Å |
| 155 | F | 89.8 | Confident | 86.6 | Confident | 129 Ų | 129 | 70 Ų | 70 | 57% | 0.566 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -62 | -53.2 | 176.2 | 178.6 | -95.8 | 0 | 0 | 0 | 111.7 | N151 E152 S157 G158 E160 | N151-F155 PolarHBondContact O-N 3.1Å; E152-F155 WeakPolarHBondContact O-CB 3.42Å; E152-F155 PolarHBondContact O-N 2.79Å; F155-S157 PolarHBondContact O-N 3.33Å; F155-G158 PolarHBondContact O-N 3.42Å; F155-E160 HydrophobicContact CD2-CB 3.7Å; F155-E160 HydrophobicContact CE2-CB 4.16Å; F155-E160 WeakPolarHBondContact CE2-OE2 3.3Å |
| 156 | V | 89.3 | Confident | 86.8 | Confident | 73 Ų | 73 | 70.8 Ų | 70.8 | 44% | 0.442 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -58.5 | -16.8 | 175.7 | 171.8 | 0 | 0 | 0 | 0 | 112.9 | N123 L148 E152 | N123-V156 PolarHBondContact ND2-O 3.18Å; L148-V156 HydrophobicContact CD1-CG2 4.35Å; E152-V156 WeakPolarHBondContact O-CB 3.43Å; E152-V156 WeakPolarHBondContact O-CG2 3.47Å; E152-V156 PolarHBondContact O-N 2.99Å |
| 157 | S | 88.1 | Confident | 86.8 | Confident | 16 Ų | 16 | 71.1 Ų | 71.1 | 11% | 0.112 | 36% | 0.356 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.7 | 15.5 | 177.9 | -57.3 | 0 | 0 | 0 | 0 | 114.7 | C120 N123 F153 Q154 F155 R159 | C120-S157 VanDerWaalsContact O-CB 3.28Å; C120-S157 WeakPolarHBondContact O-CB 3.35Å; C120-S157 PolarHBondContact O-OG 3.04Å; N123-S157 VanDerWaalsContact ND2-CA 3.34Å; N123-S157 WeakPolarHBondContact ND2-CA 3.29Å; N123-S157 PolarHBondContact ND2-OG 3.35Å; F153-S157 VanDerWaalsContact O-CB 3.26Å; F153-S157 WeakPolarHBondContact O-CB 3.38Å; F153-S157 PolarHBondContact O-N 3.24Å; F153-S157 PolarHBondContact O-OG 3.36Å; Q154-S157 PolarHBondContact O-N 3.48Å; F155-S157 PolarHBondContact O-N 3.33Å; S157-R159 PolarHBondContact O-N 3.37Å |
| 158 | G | 83.6 | Confident | 86.8 | Confident | 65 Ų | 65 | 66.8 Ų | 66.8 | 67% | 0.67 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66 | 19.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | F155 | F155-G158 PolarHBondContact O-N 3.42Š|
| 159 | R | 81.3 | Confident | 86.8 | Confident | 111 Ų | 111 | 65.9 Ų | 65.9 | 42% | 0.419 | 34% | 0.337 | S | S | . | . | trans | -109.7 | 24.2 | 179.5 | -69.1 | -175.2 | 180 | -92.1 | 2 | 112.3 | Q154 S157 T161 A162 | Q154-R159 HydrophobicContact CG-CB 3.87Å; Q154-R159 PolarHBondContact NE2-O 3.27Å; Q154-R159 PolarHBondContact O-N 3.01Å; S157-R159 PolarHBondContact O-N 3.37Å; R159-T161 PolarHBondContact O-N 2.55Å; R159-T161 VanDerWaalsContact O-N 3.13Å; R159-A162 PolarHBondContact O-N 2.91Å | ||
| 160 | E | 75 | Confident | 86.9 | Confident | 125 Ų | 125 | 70.5 Ų | 70.5 | 58% | 0.584 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.8 | -31.6 | 179 | 63.1 | -178.8 | -167.5 | 0 | 0 | 114.3 | F155 A162 | F155-E160 HydrophobicContact CD2-CB 3.7Å; F155-E160 HydrophobicContact CE2-CB 4.16Å; F155-E160 WeakPolarHBondContact CE2-OE2 3.3Å; E160-A162 VanDerWaalsContact C-N 3.27Å; E160-A162 PolarHBondContact O-N 3.48Å |
| 161 | T | 73.7 | Confident | 86.9 | Confident | 132 Ų | 132 | 70.8 Ų | 70.8 | 81% | 0.81 | 35% | 0.354 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.8 | -16.6 | -179.6 | 53.8 | 0 | 0 | 0 | 0 | 113.9 | R159 | R159-T161 PolarHBondContact O-N 2.55Å; R159-T161 VanDerWaalsContact O-N 3.13Å |
| 162 | A | 76 | Confident | 86.7 | Confident | 40 Ų | 40 | 72.3 Ų | 72.3 | 33% | 0.331 | 36% | 0.357 | S | S | . | . | trans | -84.6 | 135.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q154 R159 E160 | Q154-A162 PolarHBondContact NE2-O 3.42Å; R159-A162 PolarHBondContact O-N 2.91Å; E160-A162 VanDerWaalsContact C-N 3.27Å; E160-A162 PolarHBondContact O-N 3.48Å | ||
| 163 | K | 79.6 | Confident | 86.5 | Confident | 216 Ų | 216 | 69.6 Ų | 69.6 | 94% | 0.939 | 36% | 0.355 | S | S | * | . | S | Bend | trans | -89.6 | -0.4 | 179.7 | -159.5 | 169 | 179.4 | 175.9 | 0 | 114.2 | ||
| 164 | D | 87 | Confident | 86.4 | Confident | 45 Ų | 45 | 72.9 Ų | 72.9 | 24% | 0.241 | 37% | 0.369 | C | S | . | . | trans | -129.2 | 91.4 | -170.8 | -168.7 | -13.4 | 0 | 0 | 0 | 111.6 | K166 R167 S168 | D164-K166 PolarHBondContact O-N 2.66Å; D164-K166 VanDerWaalsContact OD1-CB 3.28Å; D164-K166 WeakPolarHBondContact OD1-CB 3.45Å; D164-K166 PolarHBondContact OD1-N 3.41Å; D164-K166 VanDerWaalsContact OD1-N 3.1Å; D164-R167 HydrophobicContact CB-CB 4.33Å; D164-R167 HydrophobicContact CB-CG 4.35Å; D164-R167 PolarHBondContact O-N 2.81Å; D164-R167 VanDerWaalsContact O-N 3.14Å; D164-R167 PolarHBondContact OD1-N 3.27Å; D164-R167 WeakPolarHBondContact OD2-CD 3.14Å; D164-R167 VanDerWaalsContact OD2-CG 3.28Å; D164-R167 WeakPolarHBondContact OD2-CG 3.48Å; D164-R167 IonicContact OD2-NE 3.3Å; D164-R167 PolarHBondContact OD2-NE 3.14Å; D164-S168 PolarHBondContact O-N 3.35Å; D164-S168 PolarHBondContact O-OG 2.92Å | ||
| 165 | W | 89.4 | Confident | 86.5 | Confident | 18 Ų | 18 | 73.1 Ų | 73.1 | 7% | 0.068 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -58.3 | -31.1 | 175 | 63.3 | -95.5 | 0 | 0 | 0 | 112.5 | L132 P150 R167 S168 I169 L176 M180 V187 | L132-W165 HydrophobicContact CD1-CH2 4.1Å; L132-W165 HydrophobicContact CD1-CZ3 4.28Å; P150-W165 HydrophobicContact CB-CB 4.27Å; P150-W165 HydrophobicContact CB-CD2 3.61Å; P150-W165 HydrophobicContact CB-CE3 3.43Å; P150-W165 VanDerWaalsContact CB-CE3 3.43Å; P150-W165 HydrophobicContact CB-CG 4.01Å; P150-W165 HydrophobicContact CB-CH2 4.49Å; P150-W165 HydrophobicContact CB-CZ3 3.91Å; P150-W165 HydrophobicContact CG-CD2 4.46Å; P150-W165 HydrophobicContact CG-CE3 4.11Å; P150-W165 HydrophobicContact CG-CH2 4.37Å; P150-W165 HydrophobicContact CG-CZ3 4.06Å; W165-R167 PolarHBondContact O-N 3.3Å; W165-S168 PolarHBondContact O-N 3.07Å; W165-I169 HydrophobicContact CB-CD1 4.29Å; W165-I169 HydrophobicContact CE3-CD1 4.43Å; W165-I169 WeakPolarHBondContact O-CB 3.44Å; W165-I169 PolarHBondContact O-N 3.3Å; W165-L176 HydrophobicContact CE3-CD1 4.14Å; W165-L176 HydrophobicContact CZ3-CD1 3.94Å; W165-M180 HydrophobicContact CH2-SD 4.37Å; W165-V187 HydrophobicContact CH2-CG1 4.5Å |
| 166 | K | 91.1 | Very high | 86.5 | Confident | 67 Ų | 67 | 67 Ų | 67 | 29% | 0.291 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -68.4 | -24.7 | -179.1 | -50.2 | 177 | 176.2 | -179.9 | 0 | 111.7 | D164 L176 K177 M180 | D164-K166 PolarHBondContact O-N 2.66Å; D164-K166 VanDerWaalsContact OD1-CB 3.28Å; D164-K166 WeakPolarHBondContact OD1-CB 3.45Å; D164-K166 PolarHBondContact OD1-N 3.41Å; D164-K166 VanDerWaalsContact OD1-N 3.1Å; K166-L176 PolarHBondContact O-N 3.45Å; K166-L176 VanDerWaalsContact O-N 3.11Å; K166-K177 HydrophobicContact CB-CB 3.78Å; K166-K177 WeakPolarHBondContact O-CB 3.33Å; K166-K177 PolarHBondContact O-N 3.22Å; K166-M180 HydrophobicContact CD-CE 4.25Å; K166-M180 HydrophobicContact CD-SD 3.84Å; K166-M180 HydrophobicContact CG-SD 4.15Å |
| 167 | R | 90.3 | Very high | 86.6 | Confident | 138 Ų | 138 | 67.9 Ų | 67.9 | 52% | 0.521 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -92.5 | -31.2 | 172.1 | -68.9 | 178.3 | -168.3 | -100 | 15.7 | 113.4 | D164 W165 K177 | D164-R167 HydrophobicContact CB-CB 4.33Å; D164-R167 HydrophobicContact CB-CG 4.35Å; D164-R167 PolarHBondContact O-N 2.81Å; D164-R167 VanDerWaalsContact O-N 3.14Å; D164-R167 PolarHBondContact OD1-N 3.27Å; D164-R167 WeakPolarHBondContact OD2-CD 3.14Å; D164-R167 VanDerWaalsContact OD2-CG 3.28Å; D164-R167 WeakPolarHBondContact OD2-CG 3.48Å; D164-R167 IonicContact OD2-NE 3.3Å; D164-R167 PolarHBondContact OD2-NE 3.14Å; W165-R167 PolarHBondContact O-N 3.3Å; R167-K177 HydrophobicContact CG-CD 4.27Å |
| 168 | S | 90.1 | Very high | 86.7 | Confident | 12 Ų | 12 | 69.8 Ų | 69.8 | 8% | 0.084 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -77 | -34.5 | -174.5 | -56.4 | 0 | 0 | 0 | 0 | 112.6 | C120 D164 W165 | C120-S168 PolarHBondContact SG-O 2.62Å; C120-S168 VanDerWaalsContact SG-O 3.32Å; D164-S168 PolarHBondContact O-N 3.35Å; D164-S168 PolarHBondContact O-OG 2.92Å; W165-S168 PolarHBondContact O-N 3.07Å |
| 169 | I | 92.3 | Very high | 86.9 | Confident | 0 Ų | 0 | 66.8 Ų | 66.8 | 0% | 0 | 32% | 0.323 | C | S | . | . | trans | -93.9 | 138.8 | 175.8 | -55.4 | 165.1 | 0 | 0 | 0 | 109.3 | V118 E119 C120 I141 P150 F153 W165 L176 | V118-I169 HydrophobicContact CB-CG2 3.67Å; V118-I169 HydrophobicContact CG1-CG2 4.12Å; V118-I169 HydrophobicContact CG2-CG2 4.11Å; E119-I169 WeakPolarHBondContact O-CA 3.02Å; C120-I169 HydrophobicContact CB-CG1 4.18Å; I141-I169 HydrophobicContact CD1-CD1 3.87Å; P150-I169 HydrophobicContact CB-CD1 3.96Å; P150-I169 WeakPolarHBondContact O-CD1 3.39Å; F153-I169 HydrophobicContact CD1-CD1 3.92Å; F153-I169 HydrophobicContact CD1-CG1 4.01Å; F153-I169 HydrophobicContact CD1-CG2 4.43Å; F153-I169 HydrophobicContact CE1-CG1 4.37Å; F153-I169 HydrophobicContact CE1-CG2 4.21Å; W165-I169 HydrophobicContact CB-CD1 4.29Å; W165-I169 HydrophobicContact CE3-CD1 4.43Å; W165-I169 WeakPolarHBondContact O-CB 3.44Å; W165-I169 PolarHBondContact O-N 3.3Å; I169-L176 HydrophobicContact CB-CD1 3.76Å; I169-L176 HydrophobicContact CB-CG 3.99Å; I169-L176 HydrophobicContact CD1-CD1 4.37Å; I169-L176 HydrophobicContact CG2-CD1 3.61Å; I169-L176 HydrophobicContact CG2-CD2 4.38Å; I169-L176 HydrophobicContact CG2-CG 3.86Å; I169-L176 PolarHBondContact O-N 2.72Å | ||
| 170 | R | 92.3 | Very high | 87.2 | Confident | 112 Ų | 112 | 63.3 Ų | 63.3 | 42% | 0.423 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.8 | 164.2 | -175.9 | -69.4 | 163.7 | -174.7 | -98.9 | 1.6 | 111.3 | V118 E119 G173 K174 | V118-R170 CarbonylContact C-O 3.51Å; V118-R170 WeakPolarHBondContact CA-O 3.43Å; V118-R170 WeakPolarHBondContact CB-O 3.37Å; E119-R170 HydrophobicContact CG-CB 3.69Å; E119-R170 PolarHBondContact N-O 3.49Å; E119-R170 PolarHBondContact O-N 3.43Å; E119-R170 WeakPolarHBondContact OE1-CB 3.5Å; R170-G173 WeakPolarHBondContact CD-O 3.16Å; R170-G173 PolarHBondContact NH1-O 2.99Å; R170-K174 CarbonylContact C-O 3.47Å; R170-K174 WeakPolarHBondContact CA-O 3.27Å; R170-K174 WeakPolarHBondContact CB-O 3.46Å |
| 171 | H | 92 | Very high | 87.7 | Confident | 5 Ų | 5 | 62 Ų | 62 | 2% | 0.023 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.5 | 119.9 | 165.1 | 172.1 | 91 | 0 | 0 | 0 | 107 | F105 I116 E117 G173 K174 L179 | F105-H171 AromaticContact CD1-CD2 3.76Å; F105-H171 AromaticContact CD1-NE2 3.9Å; F105-H171 HydrophobicContact CE1-CB 4.39Å; F105-H171 AromaticContact CE1-CD2 3.19Å; F105-H171 WeakPolarHBondContact CE1-CD2 3.48Å; F105-H171 AromaticContact CE1-CG 3.93Å; F105-H171 AromaticContact CE1-NE2 3.83Å; F105-H171 AromaticContact CZ-CD2 3.78Å; I116-H171 HydrophobicContact CD1-CB 4.23Å; E117-H171 PolarHBondContact O-ND1 3.11Å; H171-G173 VanDerWaalsContact C-N 3.3Å; H171-G173 PolarHBondContact O-N 3.04Å; H171-K174 PolarHBondContact N-O 2.88Å; H171-K174 WeakPolarHBondContact O-CB 3.38Å; H171-K174 PolarHBondContact O-N 3.49Å; H171-L179 HydrophobicContact CB-CD1 4.18Å |
| 172 | K | 86.8 | Confident | 88.3 | Confident | 108 Ų | 108 | 62.5 Ų | 62.5 | 47% | 0.47 | 31% | 0.307 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 48.3 | 52 | -177.4 | -57.9 | 179.6 | -175 | -177.3 | 0 | 111.4 | D104 E119 K174 | D104-K172 WeakPolarHBondContact O-CD 3.33Å; D104-K172 WeakPolarHBondContact O-CE 3.49Å; D104-K172 PolarHBondContact O-NZ 2.9Å; E119-K172 PolarHBondContact OE1-N 3.5Å; K172-K174 PolarHBondContact O-N 3.23Å |
| 173 | G | 86.1 | Confident | 88.4 | Confident | 39 Ų | 39 | 62.2 Ų | 62.2 | 40% | 0.402 | 31% | 0.307 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 75.8 | -24.9 | -176.7 | 0 | 0 | 0 | 0 | 0 | 116 | E119 R170 H171 | E119-G173 WeakPolarHBondContact OE1-CA 3.32Å; E119-G173 PolarHBondContact OE1-N 3.32Å; R170-G173 WeakPolarHBondContact CD-O 3.16Å; R170-G173 PolarHBondContact NH1-O 2.99Å; H171-G173 VanDerWaalsContact C-N 3.3Å; H171-G173 PolarHBondContact O-N 3.04Å |
| 174 | K | 89.9 | Confident | 88.6 | Confident | 68 Ų | 68 | 52.8 Ų | 52.8 | 30% | 0.296 | 27% | 0.267 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.1 | 126.2 | -174.9 | -61.8 | 171.7 | -173.5 | 176.5 | 0 | 110.9 | D104 F105 R170 H171 K172 L179 | D104-K174 IonicContact OD2-NZ 3.89Å; D104-K174 PolarHBondContact OD2-NZ 3.46Å; F105-K174 HydrophobicContact CE2-CD 3.89Å; F105-K174 HydrophobicContact CZ-CD 3.9Å; R170-K174 CarbonylContact C-O 3.47Å; R170-K174 WeakPolarHBondContact CA-O 3.27Å; R170-K174 WeakPolarHBondContact CB-O 3.46Å; H171-K174 PolarHBondContact N-O 2.88Å; H171-K174 WeakPolarHBondContact O-CB 3.38Å; H171-K174 PolarHBondContact O-N 3.49Å; K172-K174 PolarHBondContact O-N 3.23Å; K174-L179 HydrophobicContact CB-CD2 4.05Å |
| 175 | S | 92.1 | Very high | 88.4 | Confident | 17 Ų | 17 | 50.9 Ų | 50.9 | 12% | 0.119 | 26% | 0.257 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.6 | 146.3 | -178.4 | 76.7 | 0 | 0 | 0 | 0 | 112.5 | K177 T178 L179 | S175-K177 PolarHBondContact O-N 3.39Å; S175-K177 VanDerWaalsContact O-N 3.13Å; S175-T178 WeakPolarHBondContact O-CA 3.31Å; S175-T178 VanDerWaalsContact O-CB 3.22Å; S175-T178 WeakPolarHBondContact O-CB 3.29Å; S175-T178 PolarHBondContact O-N 3.45Å; S175-T178 PolarHBondContact O-OG1 3.43Å; S175-T178 PolarHBondContact OG-N 3.15Å; S175-T178 PolarHBondContact OG-OG1 2.94Å; S175-L179 PolarHBondContact O-N 3.11Å |
| 176 | L | 90.5 | Very high | 87.9 | Confident | 1 Ų | 1 | 55.5 Ų | 55.5 | 1% | 0.005 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -55 | -34.3 | 176.8 | -63.4 | -171.5 | 0 | 0 | 0 | 112.1 | V118 L127 W165 K166 I169 T178 L179 M180 L185 | V118-L176 HydrophobicContact CG1-CD2 4.01Å; L127-L176 HydrophobicContact CD2-CD1 3.92Å; L127-L176 HydrophobicContact CD2-CD2 3.94Å; W165-L176 HydrophobicContact CE3-CD1 4.14Å; W165-L176 HydrophobicContact CZ3-CD1 3.94Å; K166-L176 PolarHBondContact O-N 3.45Å; K166-L176 VanDerWaalsContact O-N 3.11Å; I169-L176 HydrophobicContact CB-CD1 3.76Å; I169-L176 HydrophobicContact CB-CG 3.99Å; I169-L176 HydrophobicContact CD1-CD1 4.37Å; I169-L176 HydrophobicContact CG2-CD1 3.61Å; I169-L176 HydrophobicContact CG2-CD2 4.38Å; I169-L176 HydrophobicContact CG2-CG 3.86Å; I169-L176 PolarHBondContact O-N 2.72Å; L176-T178 VanDerWaalsContact C-N 3.26Å; L176-T178 PolarHBondContact O-N 3.39Å; L176-L179 HydrophobicContact CD2-CD1 4.04Å; L176-L179 WeakPolarHBondContact O-CB 3.5Å; L176-L179 PolarHBondContact O-N 3.29Å; L176-M180 VanDerWaalsContact O-CG 3.29Å; L176-M180 WeakPolarHBondContact O-CG 3.38Å; L176-M180 PolarHBondContact O-N 3.04Å; L176-L185 HydrophobicContact CD2-CD1 3.81Å |
| 177 | K | 91.1 | Very high | 87.4 | Confident | 90 Ų | 90 | 54.7 Ų | 54.7 | 39% | 0.391 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -55.1 | -41.4 | 173.5 | -175.2 | 169.9 | 179.3 | 170.2 | 0 | 112 | K166 R167 S175 L179 M180 S181 | K166-K177 HydrophobicContact CB-CB 3.78Å; K166-K177 WeakPolarHBondContact O-CB 3.33Å; K166-K177 PolarHBondContact O-N 3.22Å; R167-K177 HydrophobicContact CG-CD 4.27Å; S175-K177 PolarHBondContact O-N 3.39Å; S175-K177 VanDerWaalsContact O-N 3.13Å; K177-L179 VanDerWaalsContact C-N 3.3Å; K177-L179 PolarHBondContact O-N 3.3Å; K177-M180 PolarHBondContact O-N 2.78Å; K177-S181 PolarHBondContact O-N 2.79Å; K177-S181 PolarHBondContact O-OG 3.25Å; K177-S181 VanDerWaalsContact O-OG 3.14Å |
| 178 | T | 89.8 | Confident | 86.8 | Confident | 57 Ų | 57 | 51.2 Ų | 51.2 | 35% | 0.35 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -66.4 | -32.3 | 177.3 | -49 | 0 | 0 | 0 | 0 | 112 | S175 L176 S181 K182 | S175-T178 WeakPolarHBondContact O-CA 3.31Å; S175-T178 VanDerWaalsContact O-CB 3.22Å; S175-T178 WeakPolarHBondContact O-CB 3.29Å; S175-T178 PolarHBondContact O-N 3.45Å; S175-T178 PolarHBondContact O-OG1 3.43Å; S175-T178 PolarHBondContact OG-N 3.15Å; S175-T178 PolarHBondContact OG-OG1 2.94Å; L176-T178 VanDerWaalsContact C-N 3.26Å; L176-T178 PolarHBondContact O-N 3.39Å; T178-S181 WeakPolarHBondContact CA-OG 3.17Å; T178-S181 PolarHBondContact O-OG 2.85Å; T178-K182 WeakPolarHBondContact O-CB 3.35Å; T178-K182 WeakPolarHBondContact O-CG 3.23Å; T178-K182 PolarHBondContact O-N 2.7Å |
| 179 | L | 88.4 | Confident | 86 | Confident | 2 Ų | 2 | 54.3 Ų | 54.3 | 1% | 0.01 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -78.4 | -37 | 179.8 | -45.7 | -171.9 | 0 | 0 | 0 | 111.1 | F105 I116 H171 K174 S175 L176 K177 K182 G183 I184 L185 | F105-L179 HydrophobicContact CE1-CD1 3.6Å; F105-L179 HydrophobicContact CE1-CD2 3.74Å; F105-L179 HydrophobicContact CE1-CG 4.29Å; F105-L179 HydrophobicContact CE2-CD2 4.05Å; F105-L179 HydrophobicContact CZ-CD1 3.99Å; F105-L179 HydrophobicContact CZ-CD2 3.24Å; F105-L179 HydrophobicContact CZ-CG 4.24Å; I116-L179 HydrophobicContact CD1-CD1 4.14Å; H171-L179 HydrophobicContact CB-CD1 4.18Å; K174-L179 HydrophobicContact CB-CD2 4.05Å; S175-L179 PolarHBondContact O-N 3.11Å; L176-L179 HydrophobicContact CD2-CD1 4.04Å; L176-L179 WeakPolarHBondContact O-CB 3.5Å; L176-L179 PolarHBondContact O-N 3.29Å; K177-L179 VanDerWaalsContact C-N 3.3Å; K177-L179 PolarHBondContact O-N 3.3Å; L179-K182 CarbonylContact O-C 3.52Å; L179-K182 PolarHBondContact O-N 2.92Å; L179-G183 PolarHBondContact O-N 3.42Å; L179-I184 PolarHBondContact O-N 3.14Å; L179-I184 VanDerWaalsContact O-N 3.13Å; L179-L185 HydrophobicContact CB-CB 4.28Å; L179-L185 HydrophobicContact CB-CD1 3.85Å; L179-L185 HydrophobicContact CB-CG 3.9Å; L179-L185 HydrophobicContact CD1-CD1 3.81Å; L179-L185 HydrophobicContact CD1-CG 4.35Å; L179-L185 HydrophobicContact CG-CD1 4.42Å; L179-L185 PolarHBondContact O-N 3.33Å |
| 180 | M | 88.3 | Confident | 84.7 | Confident | 38 Ų | 38 | 61 Ų | 61 | 19% | 0.187 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -65 | -43.7 | 172.3 | -63.9 | 173.8 | 71 | 0 | 0 | 111.7 | W165 K166 L176 K177 K182 G183 L185 V187 | W165-M180 HydrophobicContact CH2-SD 4.37Å; K166-M180 HydrophobicContact CD-CE 4.25Å; K166-M180 HydrophobicContact CD-SD 3.84Å; K166-M180 HydrophobicContact CG-SD 4.15Å; L176-M180 VanDerWaalsContact O-CG 3.29Å; L176-M180 WeakPolarHBondContact O-CG 3.38Å; L176-M180 PolarHBondContact O-N 3.04Å; K177-M180 PolarHBondContact O-N 2.78Å; M180-K182 PolarHBondContact O-N 3.17Å; M180-G183 PolarHBondContact O-N 3.1Å; M180-G183 VanDerWaalsContact O-N 3.13Å; M180-L185 WeakPolarHBondContact CA-O 3.5Å; M180-L185 HydrophobicContact CG-CB 4.09Å; M180-V187 HydrophobicContact CE-CB 4.08Å; M180-V187 HydrophobicContact CE-CG1 3.52Å; M180-V187 HydrophobicContact CE-CG2 3.41Å; M180-V187 VanDerWaalsContact CE-CG2 3.41Å; M180-V187 HydrophobicContact SD-CG1 4.47Å |
| 181 | S | 86.1 | Confident | 83.5 | Confident | 96 Ų | 96 | 63 Ų | 63 | 67% | 0.671 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.6 | -15.4 | 175 | 58.6 | 0 | 0 | 0 | 0 | 114.1 | K177 T178 | K177-S181 PolarHBondContact O-N 2.79Å; K177-S181 PolarHBondContact O-OG 3.25Å; K177-S181 VanDerWaalsContact O-OG 3.14Å; T178-S181 WeakPolarHBondContact CA-OG 3.17Å; T178-S181 PolarHBondContact O-OG 2.85Å |
| 182 | K | 84.9 | Confident | 82.6 | Confident | 144 Ų | 144 | 64.5 Ų | 64.5 | 63% | 0.626 | 36% | 0.361 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.2 | 3.9 | 173.1 | -75.8 | -170.3 | 172 | -153.5 | 0 | 113.5 | T178 L179 M180 I184 | T178-K182 WeakPolarHBondContact O-CB 3.35Å; T178-K182 WeakPolarHBondContact O-CG 3.23Å; T178-K182 PolarHBondContact O-N 2.7Å; L179-K182 CarbonylContact O-C 3.52Å; L179-K182 PolarHBondContact O-N 2.92Å; M180-K182 PolarHBondContact O-N 3.17Å; K182-I184 HydrophobicContact CB-CD1 3.96Å; K182-I184 HydrophobicContact CB-CG1 4.03Å; K182-I184 HydrophobicContact CD-CD1 4.34Å; K182-I184 PolarHBondContact O-N 3.36Å; K182-I184 VanDerWaalsContact O-N 3.1Å |
| 183 | G | 78.9 | Confident | 81.6 | Confident | 33 Ų | 33 | 65.2 Ų | 65.2 | 34% | 0.34 | 37% | 0.37 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.1 | -8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | L179 M180 L185 | L179-G183 PolarHBondContact O-N 3.42Å; M180-G183 PolarHBondContact O-N 3.1Å; M180-G183 VanDerWaalsContact O-N 3.13Å; G183-L185 VanDerWaalsContact C-N 3.31Å; G183-L185 PolarHBondContact O-N 3.12Å |
| 184 | I | 82.3 | Confident | 81 | Confident | 19 Ų | 19 | 64.8 Ų | 64.8 | 10% | 0.097 | 36% | 0.36 | C | S | . | . | S | Bend | trans | -62.8 | -37.1 | -179.3 | -55.8 | 170.3 | 0 | 0 | 0 | 111.1 | T98 A102 F105 L179 K182 | T98-I184 HydrophobicContact CG2-CG1 4.35Å; A102-I184 HydrophobicContact CB-CD1 4.46Å; F105-I184 HydrophobicContact CD1-CG2 4.39Å; F105-I184 HydrophobicContact CD2-CD1 4.15Å; F105-I184 HydrophobicContact CE2-CD1 4.3Å; L179-I184 PolarHBondContact O-N 3.14Å; L179-I184 VanDerWaalsContact O-N 3.13Å; K182-I184 HydrophobicContact CB-CD1 3.96Å; K182-I184 HydrophobicContact CB-CG1 4.03Å; K182-I184 HydrophobicContact CD-CD1 4.34Å; K182-I184 PolarHBondContact O-N 3.36Å; K182-I184 VanDerWaalsContact O-N 3.1Å |
| 185 | L | 84.3 | Confident | 79.7 | Confident | 5 Ų | 5 | 65.7 Ų | 65.7 | 3% | 0.026 | 37% | 0.373 | C | S | . | . | S | Bend | trans | -117.5 | 118 | 174.1 | -67.6 | -175.7 | 0 | 0 | 0 | 110.7 | I116 L127 V129 L132 L176 L179 M180 G183 | I116-L185 HydrophobicContact CD1-CD1 3.98Å; I116-L185 HydrophobicContact CD1-CD2 4.17Å; L127-L185 HydrophobicContact CD2-CD1 4.3Å; V129-L185 HydrophobicContact CB-CD2 4.42Å; V129-L185 HydrophobicContact CG1-CD2 3.8Å; V129-L185 HydrophobicContact CG2-CD2 3.87Å; L132-L185 HydrophobicContact CD2-CB 4.16Å; L132-L185 HydrophobicContact CD2-CD1 4.06Å; L132-L185 HydrophobicContact CD2-CD2 4.37Å; L132-L185 HydrophobicContact CD2-CG 4.45Å; L176-L185 HydrophobicContact CD2-CD1 3.81Å; L179-L185 HydrophobicContact CB-CB 4.28Å; L179-L185 HydrophobicContact CB-CD1 3.85Å; L179-L185 HydrophobicContact CB-CG 3.9Å; L179-L185 HydrophobicContact CD1-CD1 3.81Å; L179-L185 HydrophobicContact CD1-CG 4.35Å; L179-L185 HydrophobicContact CG-CD1 4.42Å; L179-L185 PolarHBondContact O-N 3.33Å; M180-L185 WeakPolarHBondContact CA-O 3.5Å; M180-L185 HydrophobicContact CG-CB 4.09Å; G183-L185 VanDerWaalsContact C-N 3.31Å; G183-L185 PolarHBondContact O-N 3.12Å |
| 186 | Q | 78.1 | Confident | 78.5 | Confident | 115 Ų | 115 | 66.4 Ų | 66.4 | 54% | 0.537 | 38% | 0.383 | S | S | . | . | trans | -104.9 | 125.3 | 178.1 | -58.8 | -173.5 | 22 | 0 | 0 | 110.4 | ||||
| 187 | V | 80.1 | Confident | 77.7 | Confident | 50 Ų | 50 | 67.1 Ų | 67.1 | 30% | 0.303 | 39% | 0.388 | S | S | . | . | P | Polyproline II helix | trans | -93.9 | 146.1 | 160 | -64.1 | 0 | 0 | 0 | 0 | 107.6 | L132 W165 M180 | L132-V187 HydrophobicContact CD1-CG1 4.43Å; L132-V187 HydrophobicContact CG-CG1 4.05Å; W165-V187 HydrophobicContact CH2-CG1 4.5Å; M180-V187 HydrophobicContact CE-CB 4.08Å; M180-V187 HydrophobicContact CE-CG1 3.52Å; M180-V187 HydrophobicContact CE-CG2 3.41Å; M180-V187 VanDerWaalsContact CE-CG2 3.41Å; M180-V187 HydrophobicContact SD-CG1 4.47Å |
| 188 | H | 78 | Confident | 76.4 | Confident | 65 Ų | 65 | 69.7 Ų | 69.7 | 30% | 0.301 | 40% | 0.395 | S | S | . | . | P | Polyproline II helix | trans | -79.6 | 154.3 | -179.8 | -68.4 | -157.7 | 0 | 0 | 0 | 110.3 | C133 C192 C194 | C133-H188 HydrophobicContact CB-CB 4.36Å; C133-H188 WeakPolarHBondContact O-CB 3.46Å; C133-H188 PolarHBondContact O-N 2.72Å; C133-H188 VanDerWaalsContact SG-CE1 3.56Å; C133-H188 PolarHBondContact SG-NE2 3.22Å; H188-C192 HydrophobicContact CB-CB 3.7Å; H188-C192 PolarHBondContact ND1-SG 3.28Å; H188-C194 PolarHBondContact CE1-SG 3.34Å; H188-C194 PolarHBondContact ND1-SG 2.87Å |
| 189 | P | 73.4 | Confident | 75.1 | Confident | 77 Ų | 77 | 71.7 Ų | 71.7 | 50% | 0.5 | 40% | 0.403 | S | S | . | . | P | Polyproline II helix | trans | -54.4 | 151.2 | 167.3 | -25 | 34.9 | 0 | 0 | 0 | 111.3 | I191 C192 | P189-I191 PolarHBondContact O-N 3.34Å; P189-C192 VanDerWaalsContact O-CB 3.24Å; P189-C192 WeakPolarHBondContact O-CB 3.43Å; P189-C192 PolarHBondContact O-N 2.9Å; P189-C192 VanDerWaalsContact O-N 3.15Å |
| 190 | P | 64.4 | Low | 73.5 | Confident | 139 Ų | 139 | 73 Ų | 73 | 90% | 0.903 | 41% | 0.412 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.2 | -9.3 | -178.8 | 26.5 | -34.8 | 0 | 0 | 0 | 114.2 | ||
| 191 | I | 67.3 | Low | 71.8 | Confident | 155 Ų | 155 | 72.8 Ų | 72.8 | 80% | 0.795 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108 | 27.8 | -179.7 | -30.4 | 178.9 | 0 | 0 | 0 | 111.1 | P189 | P189-I191 PolarHBondContact O-N 3.34Š|
| 192 | C | 73.8 | Confident | 70.3 | Confident | 37 Ų | 37 | 73 Ų | 73 | 25% | 0.25 | 41% | 0.413 | C | S | . | . | trans | -95.8 | 118.7 | -174.9 | -174.5 | 0 | 0 | 0 | 0 | 113.5 | H188 P189 C194 C197 | H188-C192 HydrophobicContact CB-CB 3.7Å; H188-C192 PolarHBondContact ND1-SG 3.28Å; P189-C192 VanDerWaalsContact O-CB 3.24Å; P189-C192 WeakPolarHBondContact O-CB 3.43Å; P189-C192 PolarHBondContact O-N 2.9Å; P189-C192 VanDerWaalsContact O-N 3.15Å; C192-C194 VanDerWaalsContact C-N 3.33Å; C192-C194 PolarHBondContact O-N 3.17Å; C192-C197 WeakPolarHBondContact O-CB 3.43Å | ||
| 193 | D | 66.1 | Low | 68.7 | Low | 122 Ų | 122 | 72 Ų | 72 | 65% | 0.652 | 42% | 0.419 | S | S | * | . | trans | -87.4 | 25 | 178.9 | -75.9 | -54 | 0 | 0 | 0 | 115.2 | R198 | D193-R198 WeakPolarHBondContact O-CD 3.39Š| ||
| 194 | C | 72.3 | Confident | 67 | Low | 30 Ų | 30 | 73.4 Ų | 73.4 | 20% | 0.203 | 42% | 0.419 | C | S | . | . | trans | -66 | 156.5 | 175.2 | 83.6 | 0 | 0 | 0 | 0 | 111.4 | H188 C192 G196 C197 R198 | H188-C194 PolarHBondContact CE1-SG 3.34Å; H188-C194 PolarHBondContact ND1-SG 2.87Å; C192-C194 VanDerWaalsContact C-N 3.33Å; C192-C194 PolarHBondContact O-N 3.17Å; C194-G196 VanDerWaalsContact C-N 3.29Å; C194-G196 PolarHBondContact O-N 3.25Å; C194-C197 PolarHBondContact O-N 2.95Å; C194-C197 PolarHBondContact SG-N 3.21Å; C194-C197 VanDerWaalsContact SG-SG 3.63Å; C194-R198 WeakPolarHBondContact O-CG 3.29Å; C194-R198 PolarHBondContact O-N 3.46Å | ||
| 195 | P | 64.1 | Low | 65.3 | Low | 88 Ų | 88 | 80.8 Ų | 80.8 | 57% | 0.571 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -52.9 | -43 | 179.7 | -28.5 | 36 | 0 | 0 | 0 | 113.5 | C197 R198 I199 | P195-C197 PolarHBondContact O-N 3.35Å; P195-R198 PolarHBondContact O-N 3.38Å; P195-I199 WeakPolarHBondContact O-CB 3.44Å; P195-I199 WeakPolarHBondContact O-CD1 3.49Å; P195-I199 WeakPolarHBondContact O-CG1 3.47Å; P195-I199 PolarHBondContact O-N 3.25Å |
| 196 | G | 67.2 | Low | 63.3 | Low | 32 Ų | 32 | 82.7 Ų | 82.7 | 33% | 0.33 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -59.9 | -44.4 | 176 | 0 | 0 | 0 | 0 | 0 | 113.2 | C194 S200 | C194-G196 VanDerWaalsContact C-N 3.29Å; C194-G196 PolarHBondContact O-N 3.25Å; G196-S200 PolarHBondContact O-OG 3.49Å |
| 197 | C | 71.8 | Confident | 61.6 | Low | 15 Ų | 15 | 86.6 Ų | 86.6 | 10% | 0.101 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -71.1 | -29.5 | 176.9 | -73.5 | 0 | 0 | 0 | 0 | 113.4 | Q134 C192 C194 P195 S201 | Q134-C197 HydrophobicContact CG-CB 4.31Å; Q134-C197 PolarHBondContact NE2-O 3.22Å; C192-C197 WeakPolarHBondContact O-CB 3.43Å; C194-C197 PolarHBondContact O-N 2.95Å; C194-C197 PolarHBondContact SG-N 3.21Å; C194-C197 VanDerWaalsContact SG-SG 3.63Å; P195-C197 PolarHBondContact O-N 3.35Å; C197-S201 PolarHBondContact O-N 2.9Å |
| 198 | R | 65.1 | Low | 59.7 | Low | 144 Ų | 144 | 88.8 Ų | 88.8 | 54% | 0.543 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -77 | -41.1 | 177.3 | -68.5 | 178.4 | 77.8 | 171.4 | 9 | 112.2 | D193 C194 P195 S201 N204 | D193-R198 WeakPolarHBondContact O-CD 3.39Å; C194-R198 WeakPolarHBondContact O-CG 3.29Å; C194-R198 PolarHBondContact O-N 3.46Å; P195-R198 PolarHBondContact O-N 3.38Å; R198-S201 WeakPolarHBondContact O-CB 3.19Å; R198-S201 PolarHBondContact O-N 3.25Å; R198-N204 WeakPolarHBondContact O-CB 3.43Å; R198-N204 PolarHBondContact O-ND2 3.34Å |
| 199 | I | 61.4 | Low | 57.9 | Low | 100 Ų | 100 | 88.6 Ų | 88.6 | 51% | 0.513 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.8 | -45.7 | -176 | -71.1 | 163 | 0 | 0 | 0 | 112.3 | P195 | P195-I199 WeakPolarHBondContact O-CB 3.44Å; P195-I199 WeakPolarHBondContact O-CD1 3.49Å; P195-I199 WeakPolarHBondContact O-CG1 3.47Å; P195-I199 PolarHBondContact O-N 3.25Å |
| 200 | S | 56.1 | Low | 56.3 | Low | 30 Ų | 30 | 90.5 Ų | 90.5 | 21% | 0.21 | 50% | 0.501 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.6 | 16.8 | 177.9 | 50.1 | 0 | 0 | 0 | 0 | 113.7 | Q134 G196 | Q134-S200 PolarHBondContact NE2-O 2.9Å; Q134-S200 PolarHBondContact NE2-OG 2.69Å; Q134-S200 VanDerWaalsContact OE1-CB 3.32Å; Q134-S200 PolarHBondContact OE1-O 2.93Å; Q134-S200 PolarHBondContact OE1-OG 3.17Å; G196-S200 PolarHBondContact O-OG 3.49Å |
| 201 | S | 52.5 | Low | 55.2 | Low | 32 Ų | 32 | 91.4 Ų | 91.4 | 22% | 0.224 | 49% | 0.491 | C | S | . | . | trans | -68 | 130.3 | 164.4 | 177.1 | 0 | 0 | 0 | 0 | 109.4 | C197 R198 V203 N204 R205 | C197-S201 PolarHBondContact O-N 2.9Å; R198-S201 WeakPolarHBondContact O-CB 3.19Å; R198-S201 PolarHBondContact O-N 3.25Å; S201-V203 PolarHBondContact O-N 3.38Å; S201-V203 VanDerWaalsContact O-N 3.12Å; S201-N204 PolarHBondContact O-N 3.41Å; S201-R205 PolarHBondContact O-N 2.96Å | ||
| 202 | P | 54.4 | Low | 54.1 | Low | 100 Ų | 100 | 94.8 Ų | 94.8 | 65% | 0.649 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -52.7 | -37.1 | -179.8 | -28.3 | 35.5 | 0 | 0 | 0 | 113.6 | N204 R205 | P202-N204 VanDerWaalsContact C-N 3.27Å; P202-N204 PolarHBondContact O-N 3.23Å; P202-R205 WeakPolarHBondContact O-CB 3.28Å; P202-R205 PolarHBondContact O-N 3.34Å; P202-R205 VanDerWaalsContact O-N 3.14Å |
| 203 | V | 50.4 | Low | 52.2 | Low | 124 Ų | 124 | 98.4 Ų | 98.4 | 75% | 0.752 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.4 | -31.7 | -179 | -174.2 | 0 | 0 | 0 | 0 | 112.5 | S201 | S201-V203 PolarHBondContact O-N 3.38Å; S201-V203 VanDerWaalsContact O-N 3.12Å |
| 204 | N | 43.6 | Very low | 50.6 | Low | 62 Ų | 62 | 98.8 Ų | 98.8 | 33% | 0.332 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -90.4 | -10.9 | 179.6 | -65.9 | -43.5 | 0 | 0 | 0 | 113.2 | R198 S201 P202 G206 R207 L208 | R198-N204 WeakPolarHBondContact O-CB 3.43Å; R198-N204 PolarHBondContact O-ND2 3.34Å; S201-N204 PolarHBondContact O-N 3.41Å; P202-N204 VanDerWaalsContact C-N 3.27Å; P202-N204 PolarHBondContact O-N 3.23Å; N204-G206 VanDerWaalsContact C-N 3.3Å; N204-G206 PolarHBondContact O-N 3.3Å; N204-R207 PolarHBondContact O-N 3.35Å; N204-L208 PolarHBondContact O-N 3.35Å; N204-L208 VanDerWaalsContact O-N 3.11Å |
| 205 | R | 47.4 | Very low | 48.5 | Very low | 174 Ų | 174 | 101.5 Ų | 101.5 | 66% | 0.657 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.9 | -31.5 | -175.5 | -147.9 | 169.5 | -172.6 | 156.4 | -1.7 | 112.2 | S201 P202 A209 | S201-R205 PolarHBondContact O-N 2.96Å; P202-R205 WeakPolarHBondContact O-CB 3.28Å; P202-R205 PolarHBondContact O-N 3.34Å; P202-R205 VanDerWaalsContact O-N 3.14Å; R205-A209 WeakPolarHBondContact O-CB 3.4Å; R205-A209 PolarHBondContact O-N 3.06Å |
| 206 | G | 41.4 | Very low | 47.1 | Very low | 46 Ų | 46 | 105 Ų | 105 | 47% | 0.474 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66.4 | -59.5 | 168.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | N204 L208 A209 D210 | N204-G206 VanDerWaalsContact C-N 3.3Å; N204-G206 PolarHBondContact O-N 3.3Å; G206-L208 PolarHBondContact O-N 3.02Å; G206-A209 WeakPolarHBondContact O-CB 3.46Å; G206-A209 PolarHBondContact O-N 2.99Å; G206-D210 PolarHBondContact O-N 3.42Å |
| 207 | R | 42.5 | Very low | 45.3 | Very low | 197 Ų | 197 | 109.2 Ų | 109.2 | 74% | 0.743 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -66.9 | -6.3 | -174.1 | -157.6 | -177.2 | -76 | -102.5 | 5.5 | 115 | N204 K211 | N204-R207 PolarHBondContact O-N 3.35Å; R207-K211 WeakPolarHBondContact O-CE 3.11Å |
| 208 | L | 40.5 | Very low | 43.4 | Very low | 96 Ų | 96 | 113.2 Ų | 113.2 | 50% | 0.503 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -102.4 | -23.1 | 169.4 | -161.5 | 69.4 | 0 | 0 | 0 | 113.2 | N204 G206 K211 | N204-L208 PolarHBondContact O-N 3.35Å; N204-L208 VanDerWaalsContact O-N 3.11Å; G206-L208 PolarHBondContact O-N 3.02Å; L208-K211 PolarHBondContact O-N 3.38Å |
| 209 | A | 41.1 | Very low | 41.8 | Very low | 60 Ų | 60 | 111 Ų | 111 | 50% | 0.496 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -66.6 | -43.7 | 176 | 0 | 0 | 0 | 0 | 0 | 111.6 | R205 G206 K211 R212 | R205-A209 WeakPolarHBondContact O-CB 3.4Å; R205-A209 PolarHBondContact O-N 3.06Å; G206-A209 WeakPolarHBondContact O-CB 3.46Å; G206-A209 PolarHBondContact O-N 2.99Å; A209-K211 PolarHBondContact O-N 3.23Å; A209-R212 PolarHBondContact O-N 3.22Å |
| 210 | D | 39.2 | Very low | 40.4 | Very low | 118 Ų | 118 | 117.3 Ų | 117.3 | 63% | 0.631 | 65% | 0.645 | S | S | * | * | G | 310 helix | trans | -55.4 | -24.3 | 177.7 | -61.1 | -41.7 | 0 | 0 | 0 | 113.3 | G206 R212 T213 | G206-D210 PolarHBondContact O-N 3.42Å; D210-R212 VanDerWaalsContact C-N 3.26Å; D210-R212 PolarHBondContact O-N 3.02Å; D210-T213 PolarHBondContact O-N 2.91Å |
| 211 | K | 41.2 | Very low | 39.3 | Very low | 157 Ų | 157 | 124 Ų | 124 | 68% | 0.683 | 68% | 0.678 | S | S | * | * | G | 310 helix | trans | -83.9 | 6 | -177.5 | -53.7 | -164 | -179.4 | -165.6 | 0 | 114.2 | R207 L208 A209 | R207-K211 WeakPolarHBondContact O-CE 3.11Å; L208-K211 PolarHBondContact O-N 3.38Å; A209-K211 PolarHBondContact O-N 3.23Å |
| 212 | R | 43.5 | Very low | 38.2 | Very low | 226 Ų | 226 | 130 Ų | 130 | 85% | 0.853 | 71% | 0.707 | S | S | * | * | G | 310 helix | trans | -107.9 | -3.9 | 167.2 | -74.6 | -175.3 | 170.9 | 172.8 | -3.4 | 113.6 | A209 D210 V214 | A209-R212 PolarHBondContact O-N 3.22Å; D210-R212 VanDerWaalsContact C-N 3.26Å; D210-R212 PolarHBondContact O-N 3.02Å; R212-V214 PolarHBondContact O-N 3.25Å |
| 213 | T | 34.2 | Very low | 37 | Very low | 114 Ų | 114 | 134.8 Ų | 134.8 | 70% | 0.699 | 72% | 0.717 | S | S | * | * | trans | -83.5 | 62.4 | 171.8 | -44.2 | 0 | 0 | 0 | 0 | 110.3 | D210 A215 | D210-T213 PolarHBondContact O-N 2.91Å; T213-A215 PolarHBondContact O-N 2.91Å | ||
| 214 | V | 33.1 | Very low | 35.9 | Very low | 130 Ų | 130 | 138.8 Ų | 138.8 | 79% | 0.788 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 123.5 | 160.6 | 176.4 | 0 | 0 | 0 | 0 | 106.6 | R212 L216 | R212-V214 PolarHBondContact O-N 3.25Å; V214-L216 PolarHBondContact O-N 3.47Å |
| 215 | A | 27.2 | Very low | 35 | Very low | 87 Ų | 87 | 142.8 Ų | 142.8 | 72% | 0.719 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 124.2 | -171.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | T213 | T213-A215 PolarHBondContact O-N 2.91Š|
| 216 | L | 34.4 | Very low | 34 | Very low | 161 Ų | 161 | 144.2 Ų | 144.2 | 84% | 0.843 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 132.1 | 156.6 | -67 | 175 | 0 | 0 | 0 | 108 | V214 A218 | V214-L216 PolarHBondContact O-N 3.47Å; L216-A218 PolarHBondContact O-N 3.05Å |
| 217 | P | 30.3 | Very low | 33.3 | Very low | 121 Ų | 121 | 148.6 Ų | 148.6 | 79% | 0.786 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -68 | 125.3 | 179.5 | 27.1 | -33.5 | 0 | 0 | 0 | 110.6 | A219 | P217-A219 PolarHBondContact O-N 3.29Š|
| 218 | A | 32.6 | Very low | 33.1 | Very low | 99 Ų | 99 | 144.5 Ų | 144.5 | 82% | 0.818 | 76% | 0.764 | S | S | * | * | trans | -74.3 | 88 | 179 | 0 | 0 | 0 | 0 | 0 | 111.4 | L216 R220 | L216-A218 PolarHBondContact O-N 3.05Å; A218-R220 PolarHBondContact O-N 3.15Å | ||
| 219 | A | 30.1 | Very low | 32.4 | Very low | 97 Ų | 97 | 144.7 Ų | 144.7 | 80% | 0.802 | 77% | 0.773 | S | S | * | * | trans | -64.5 | 122.6 | 172 | 0 | 0 | 0 | 0 | 0 | 110.5 | P217 | P217-A219 PolarHBondContact O-N 3.29Š| ||
| 220 | R | 32.4 | Very low | 31.7 | Very low | 232 Ų | 232 | 151.2 Ų | 151.2 | 88% | 0.875 | 79% | 0.79 | S | S | * | * | trans | -73.1 | 137.9 | -178.1 | -67.4 | 171.9 | 172 | 160.9 | -5 | 110.7 | A218 L222 | A218-R220 PolarHBondContact O-N 3.15Å; R220-L222 PolarHBondContact O-N 2.96Å | ||
| 221 | N | 32.9 | Very low | 31.2 | Very low | 171 Ų | 171 | 150.9 Ų | 150.9 | 91% | 0.914 | 80% | 0.797 | S | S | * | * | trans | -66.9 | 114.7 | 169.3 | -93.8 | -83.1 | 0 | 0 | 0 | 109.9 | ||||
| 222 | L | 30.3 | Very low | 30.7 | Very low | 159 Ų | 159 | 147.8 Ų | 147.8 | 83% | 0.832 | 80% | 0.801 | S | S | * | * | trans | -144.9 | 102.6 | 171.2 | -119.6 | 165.9 | 0 | 0 | 0 | 112.1 | R220 K224 | R220-L222 PolarHBondContact O-N 2.96Å; L222-K224 PolarHBondContact O-N 3.33Å | ||
| 223 | K | 28.4 | Very low | 30 | Very low | 199 Ų | 199 | 142 Ų | 142 | 87% | 0.865 | 80% | 0.795 | S | S | * | * | trans | -39.8 | 117 | 169.3 | 170.6 | -170.4 | 179 | 179.5 | 0 | 114.3 | ||||
| 224 | K | 27.2 | Very low | 30 | Very low | 208 Ų | 208 | 144 Ų | 144 | 90% | 0.904 | 80% | 0.801 | S | S | * | * | trans | -160.3 | 167.4 | 136.5 | -128.3 | 176.4 | 178.5 | 179 | 0 | 114.8 | L222 | L222-K224 PolarHBondContact O-N 3.33Š| ||
| 225 | E | 24.2 | Very low | 30.1 | Very low | 146 Ų | 146 | 141.6 Ų | 141.6 | 68% | 0.682 | 80% | 0.803 | S | S | * | * | trans | -86.2 | 164.1 | -175.8 | -87.4 | -163.5 | 104.8 | 0 | 0 | 115.3 | ||||
| 226 | R | 27.8 | Very low | 30.3 | Very low | 205 Ų | 205 | 144.8 Ų | 144.8 | 77% | 0.774 | 81% | 0.808 | S | S | * | * | trans | 46.7 | 130.6 | 140.7 | -68 | 172.8 | -176 | -113.5 | -2.2 | 120.9 | ||||
| 227 | T | 26.4 | Very low | 30.4 | Very low | 138 Ų | 138 | 141.6 Ų | 141.6 | 85% | 0.847 | 80% | 0.799 | S | S | * | * | 178 | 168.8 | 113.6 | 24.3 | 0 | 0 | 0 | 0 | 109.6 | |||||
| 228 | P | 38.3 | Very low | 30.5 | Very low | 111 Ų | 111 | 144 Ų | 144 | 72% | 0.721 | 81% | 0.805 | S | S | * | * | cis | -127.2 | -170.5 | -38.9 | 37.9 | -21.7 | 0 | 0 | 0 | 112.2 | ||||
| 229 | S | 24.8 | Very low | 30.6 | Very low | 99 Ų | 99 | 143 Ų | 143 | 69% | 0.692 | 81% | 0.805 | S | S | * | * | trans | 15.2 | 138.4 | 156.5 | -52.9 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 230 | F | 27.5 | Very low | 30.6 | Very low | 198 Ų | 198 | 145 Ų | 145 | 87% | 0.868 | 81% | 0.813 | S | S | * | * | cis | -136.9 | 163 | 48.2 | -81.1 | -95 | 0 | 0 | 0 | 116.2 | ||||
| 231 | S | 28.5 | Very low | 30.5 | Very low | 110 Ų | 110 | 137.2 Ų | 137.2 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | trans | -41.7 | 152.2 | 169.6 | 51.4 | 0 | 0 | 0 | 0 | 116 | ||||
| 232 | A | 30 | Very low | 31.2 | Very low | 92 Ų | 92 | 134.4 Ų | 134.4 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | cis | -152.5 | -171.8 | 13.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 233 | S | 28.7 | Very low | 31.2 | Very low | 106 Ų | 106 | 132.5 Ų | 132.5 | 74% | 0.741 | 79% | 0.791 | S | S | * | * | cis | -156.1 | -167.8 | 3.7 | -135 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 234 | D | 34.9 | Very low | 31.2 | Very low | 155 Ų | 155 | 129.3 Ų | 129.3 | 83% | 0.829 | 79% | 0.792 | S | S | * | * | trans | -46 | 153.5 | 178.7 | -40.7 | -79.8 | 0 | 0 | 0 | 119.2 | ||||
| 235 | G | 34.5 | Very low | 31.3 | Very low | 79 Ų | 79 | 122.8 Ų | 122.8 | 81% | 0.814 | 78% | 0.784 | S | S | * | * | trans | 161.4 | 113 | 163.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 236 | D | 32.6 | Very low | 31.5 | Very low | 154 Ų | 154 | 127.8 Ų | 127.8 | 82% | 0.824 | 80% | 0.797 | S | S | * | * | trans | -53.3 | 139.4 | 172.1 | -87.6 | -69.7 | 0 | 0 | 0 | 114.2 | ||||
| 237 | S | 35.7 | Very low | 31.8 | Very low | 94 Ų | 94 | 129 Ų | 129 | 66% | 0.657 | 80% | 0.802 | S | S | * | * | 87.7 | 137.2 | 67.8 | -55.4 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 238 | D | 33.6 | Very low | 32.6 | Very low | 172 Ų | 172 | 128.6 Ų | 128.6 | 92% | 0.92 | 80% | 0.801 | S | S | * | * | trans | 33.8 | 131.1 | 162.5 | -63.7 | -17.3 | 0 | 0 | 0 | 122.4 | ||||
| 239 | G | 32.8 | Very low | 32.2 | Very low | 79 Ų | 79 | 126.4 Ų | 126.4 | 81% | 0.814 | 80% | 0.799 | S | S | * | * | trans | -172.1 | 52.5 | 179 | 0 | 0 | 0 | 0 | 0 | 117.3 | G241 | G239-G241 PolarHBondContact O-N 3.31Š| ||
| 240 | S | 31.5 | Very low | 32.8 | Very low | 137 Ų | 137 | 129.7 Ų | 129.7 | 96% | 0.958 | 81% | 0.808 | S | S | * | * | trans | -67 | 120.9 | 171.6 | -66.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 241 | G | 30.8 | Very low | 32.9 | Very low | 69 Ų | 69 | 127.1 Ų | 127.1 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | trans | -159.4 | 152.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | G239 | G239-G241 PolarHBondContact O-N 3.31Š| ||
| 242 | P | 46.4 | Very low | 33 | Very low | 113 Ų | 113 | 128.3 Ų | 128.3 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | trans | -133.2 | 164.3 | -146.4 | 40.3 | -22.3 | 0 | 0 | 0 | 118 | ||||
| 243 | T | 29.7 | Very low | 33.1 | Very low | 119 Ų | 119 | 130 Ų | 130 | 73% | 0.73 | 78% | 0.782 | S | S | * | * | trans | 53.6 | 122.9 | 145 | 52.8 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 244 | C | 29.9 | Very low | 33.2 | Very low | 131 Ų | 131 | 132.6 Ų | 132.6 | 89% | 0.885 | 79% | 0.787 | S | S | * | * | trans | 60.6 | 146.5 | 139.8 | 77.2 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 245 | G | 29.3 | Very low | 33.1 | Very low | 72 Ų | 72 | 128.1 Ų | 128.1 | 74% | 0.742 | 78% | 0.777 | S | S | * | * | cis | 148.6 | 155.6 | -13.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 246 | R | 28.4 | Very low | 33.6 | Very low | 250 Ų | 250 | 130 Ų | 130 | 94% | 0.943 | 78% | 0.775 | S | S | * | * | trans | -155.4 | 145.8 | 161.5 | -125.5 | 176.9 | -176 | -124.7 | 1.2 | 114 | ||||
| 247 | R | 32.8 | Very low | 33.5 | Very low | 231 Ų | 231 | 131.6 Ų | 131.6 | 87% | 0.872 | 78% | 0.777 | S | S | * | * | trans | -110 | -176.8 | 166.2 | -82.2 | -174.1 | 172.9 | -158.6 | 0.3 | 108 | ||||
| 248 | P | 44.6 | Very low | 33.3 | Very low | 129 Ų | 129 | 134.9 Ų | 134.9 | 84% | 0.838 | 79% | 0.786 | S | S | * | * | cis | -127.4 | -176.5 | 0.7 | 35.9 | -16.1 | 0 | 0 | 0 | 113.9 | ||||
| 249 | G | 30 | Very low | 33.1 | Very low | 65 Ų | 65 | 137 Ų | 137 | 67% | 0.67 | 78% | 0.781 | S | S | * | * | cis | 155.6 | 171.9 | -11.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 250 | L | 36.1 | Very low | 33.4 | Very low | 168 Ų | 168 | 141.5 Ų | 141.5 | 88% | 0.88 | 79% | 0.785 | S | S | * | * | trans | 74.7 | 117 | 172.2 | -49.7 | 179.5 | 0 | 0 | 0 | 116.7 | ||||
| 251 | K | 29.8 | Very low | 33.3 | Very low | 145 Ų | 145 | 141.4 Ų | 141.4 | 63% | 0.63 | 77% | 0.771 | S | S | * | * | 82.9 | 143.1 | 76.7 | -122.3 | -174.3 | -179.6 | -82.4 | 0 | 111.5 | E253 | K251-E253 IonicContact NZ-OE1 3.28Å; K251-E253 PolarHBondContact NZ-OE1 3.32Å; K251-E253 IonicContact NZ-OE2 2.72Å; K251-E253 PolarHBondContact NZ-OE2 3.46Å | |||
| 252 | Q | 30.3 | Very low | 33.6 | Very low | 135 Ų | 135 | 148.5 Ų | 148.5 | 63% | 0.631 | 78% | 0.782 | S | S | * | * | cis | -163.4 | 149.2 | 28.5 | -174.6 | 154.9 | -8 | 0 | 0 | 114.2 | ||||
| 253 | E | 32.5 | Very low | 33 | Very low | 128 Ų | 128 | 152.1 Ų | 152.1 | 60% | 0.598 | 78% | 0.781 | S | S | * | * | trans | 19.5 | 161.7 | 157 | -69.5 | 111.5 | -117.4 | 0 | 0 | 122.5 | K251 | K251-E253 IonicContact NZ-OE1 3.28Å; K251-E253 PolarHBondContact NZ-OE1 3.32Å; K251-E253 IonicContact NZ-OE2 2.72Å; K251-E253 PolarHBondContact NZ-OE2 3.46Å | ||
| 254 | D | 30.4 | Very low | 33 | Very low | 160 Ų | 160 | 156.8 Ų | 156.8 | 86% | 0.856 | 79% | 0.785 | S | S | * | * | cis | -151.8 | -176.3 | 16.4 | -143.7 | -38.2 | 0 | 0 | 0 | 113 | ||||
| 255 | G | 33.6 | Very low | 33 | Very low | 60 Ų | 60 | 156.6 Ų | 156.6 | 62% | 0.619 | 78% | 0.78 | S | S | * | * | trans | -86 | -146.7 | -168.5 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 256 | P | 45.5 | Very low | 32.9 | Very low | 118 Ų | 118 | 160.5 Ų | 160.5 | 77% | 0.766 | 78% | 0.778 | S | S | * | * | cis | -124 | 158.7 | 30.5 | 41 | -29.4 | 0 | 0 | 0 | 117.3 | ||||
| 257 | H | 29.4 | Very low | 33.2 | Very low | 188 Ų | 188 | 154.2 Ų | 154.2 | 87% | 0.87 | 77% | 0.768 | S | S | * | * | trans | -93.3 | 143.6 | 155.8 | -95.4 | 24 | 0 | 0 | 0 | 110.3 | ||||
| 258 | I | 32.4 | Very low | 33 | Very low | 163 Ų | 163 | 151.8 Ų | 151.8 | 84% | 0.836 | 77% | 0.766 | S | S | * | * | trans | -117.7 | 132.4 | 164.7 | -64 | -177.7 | 0 | 0 | 0 | 109.9 | ||||
| 259 | R | 29.4 | Very low | 32.3 | Very low | 218 Ų | 218 | 155.1 Ų | 155.1 | 82% | 0.823 | 76% | 0.762 | S | S | * | * | trans | -95.7 | 113.1 | -167.2 | -62.7 | 154.6 | 72.3 | -176.6 | 6.2 | 110.5 | M261 | R259-M261 PolarHBondContact O-N 3.35Å; R259-M261 VanDerWaalsContact O-N 3.09Å | ||
| 260 | I | 38.4 | Very low | 32.4 | Very low | 173 Ų | 173 | 158.7 Ų | 158.7 | 89% | 0.887 | 77% | 0.766 | S | S | * | * | trans | -69.6 | 106.3 | 166.2 | -59.5 | 178.3 | 0 | 0 | 0 | 108 | K262 | I260-K262 PolarHBondContact O-N 3.46Å; I260-K262 VanDerWaalsContact O-N 3.13Å | ||
| 261 | M | 30.5 | Very low | 32.1 | Very low | 134 Ų | 134 | 157 Ų | 157 | 66% | 0.66 | 76% | 0.762 | S | S | * | * | trans | -70.8 | 107.1 | -180 | -64.3 | -169 | 85.7 | 0 | 0 | 110.9 | R259 R263 | R259-M261 PolarHBondContact O-N 3.35Å; R259-M261 VanDerWaalsContact O-N 3.09Å; M261-R263 VanDerWaalsContact C-N 3.31Å; M261-R263 PolarHBondContact O-N 3.17Å; M261-R263 PolarHBondContact SD-NH2 2.87Å; M261-R263 VanDerWaalsContact SD-NH2 3.43Å | ||
| 262 | K | 36.9 | Very low | 32.1 | Very low | 219 Ų | 219 | 156.6 Ų | 156.6 | 95% | 0.952 | 77% | 0.767 | S | S | * | * | trans | -61.6 | 95 | 154.6 | -83.6 | -175.7 | 174.7 | 176.9 | 0 | 108.5 | I260 | I260-K262 PolarHBondContact O-N 3.46Å; I260-K262 VanDerWaalsContact O-N 3.13Å | ||
| 263 | R | 32.8 | Very low | 32 | Very low | 189 Ų | 189 | 156.9 Ų | 156.9 | 71% | 0.713 | 77% | 0.771 | S | S | * | * | trans | -105 | 108.3 | 171.5 | -155.2 | -179.1 | -62.6 | -173.3 | 2.7 | 109.4 | M261 V265 | M261-R263 VanDerWaalsContact C-N 3.31Å; M261-R263 PolarHBondContact O-N 3.17Å; M261-R263 PolarHBondContact SD-NH2 2.87Å; M261-R263 VanDerWaalsContact SD-NH2 3.43Å; R263-V265 PolarHBondContact O-N 2.95Å | ||
| 264 | R | 30.7 | Very low | 31.9 | Very low | 217 Ų | 217 | 154.9 Ų | 154.9 | 82% | 0.819 | 77% | 0.771 | S | S | * | * | trans | -64.6 | 125.7 | 170 | -178.3 | -168.2 | -62.2 | -158.6 | 2.1 | 108.5 | ||||
| 265 | V | 29.1 | Very low | 31.6 | Very low | 127 Ų | 127 | 156.8 Ų | 156.8 | 77% | 0.77 | 77% | 0.772 | S | S | * | * | trans | -123.7 | 141.9 | 159.3 | -179.1 | 0 | 0 | 0 | 0 | 106.4 | R263 | R263-V265 PolarHBondContact O-N 2.95Š| ||
| 266 | H | 27.2 | Very low | 31.6 | Very low | 153 Ų | 153 | 163.9 Ų | 163.9 | 71% | 0.708 | 78% | 0.781 | S | S | * | * | trans | -76.2 | 162.3 | -175.3 | -84.4 | 89.6 | 0 | 0 | 0 | 112.6 | ||||
| 267 | T | 35.4 | Very low | 30.8 | Very low | 118 Ų | 118 | 167.2 Ų | 167.2 | 72% | 0.724 | 79% | 0.786 | S | S | * | * | trans | -58.2 | 135.2 | 169.9 | 46.2 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 268 | H | 28.4 | Very low | 30.9 | Very low | 181 Ų | 181 | 162.4 Ų | 162.4 | 84% | 0.838 | 78% | 0.778 | S | S | * | * | trans | -138.4 | 142.8 | 132.9 | -155.9 | -84.2 | 0 | 0 | 0 | 108.4 | ||||
| 269 | W | 30 | Very low | 30.7 | Very low | 199 Ų | 199 | 160.2 Ų | 160.2 | 75% | 0.754 | 78% | 0.778 | S | S | * | * | trans | -92.1 | 177.9 | 174.9 | -80.2 | 86.6 | 0 | 0 | 0 | 110.7 | ||||
| 270 | D | 31.4 | Very low | 30.8 | Very low | 139 Ų | 139 | 154.8 Ų | 154.8 | 74% | 0.743 | 77% | 0.772 | S | S | * | * | trans | 55.4 | 99.2 | 159 | -53.7 | -30.2 | 0 | 0 | 0 | 118.7 | ||||
| 271 | V | 30.8 | Very low | 30.4 | Very low | 133 Ų | 133 | 152.6 Ų | 152.6 | 81% | 0.806 | 77% | 0.772 | S | S | * | * | trans | -118.5 | 103.1 | 141.1 | 179 | 0 | 0 | 0 | 0 | 108.2 | I273 | V271-I273 HydrophobicContact CG1-CG1 4.18Å; V271-I273 PolarHBondContact O-N 3.33Å | ||
| 272 | N | 29 | Very low | 30.7 | Very low | 137 Ų | 137 | 154.3 Ų | 154.3 | 73% | 0.733 | 78% | 0.778 | S | S | * | * | trans | -74.7 | 99.5 | 175.1 | 178.8 | 16.2 | 0 | 0 | 0 | 109.9 | S274 | N272-S274 PolarHBondContact O-N 2.95Š| ||
| 273 | I | 29 | Very low | 30.5 | Very low | 141 Ų | 141 | 151.7 Ų | 151.7 | 72% | 0.723 | 78% | 0.775 | S | S | * | * | trans | -81.1 | 72.7 | 174.4 | -52.5 | -177.3 | 0 | 0 | 0 | 109.6 | V271 F275 | V271-I273 HydrophobicContact CG1-CG1 4.18Å; V271-I273 PolarHBondContact O-N 3.33Å; I273-F275 PolarHBondContact O-N 3.46Å | ||
| 274 | S | 29 | Very low | 30.6 | Very low | 86 Ų | 86 | 146 Ų | 146 | 60% | 0.601 | 78% | 0.775 | S | S | * | * | trans | -78 | 92.7 | 163.8 | 58.5 | 0 | 0 | 0 | 0 | 109.4 | N272 R276 | N272-S274 PolarHBondContact O-N 2.95Å; S274-R276 PolarHBondContact O-N 3.41Å; S274-R276 VanDerWaalsContact O-N 3.17Å | ||
| 275 | F | 25 | Very low | 31 | Very low | 199 Ų | 199 | 143.1 Ų | 143.1 | 87% | 0.873 | 78% | 0.776 | S | S | * | * | trans | -75.8 | 104.9 | 168.8 | -135.9 | -89.9 | 0 | 0 | 0 | 108.8 | I273 | I273-F275 PolarHBondContact O-N 3.46Š| ||
| 276 | R | 33.3 | Very low | 31.1 | Very low | 210 Ų | 210 | 144.3 Ų | 144.3 | 79% | 0.792 | 78% | 0.777 | S | S | * | * | trans | -110.4 | 121.5 | -179.7 | -169.3 | 179.2 | -169.9 | -122.8 | 3.5 | 108.2 | S274 | S274-R276 PolarHBondContact O-N 3.41Å; S274-R276 VanDerWaalsContact O-N 3.17Å | ||
| 277 | E | 28.8 | Very low | 32.3 | Very low | 188 Ų | 188 | 141.9 Ų | 141.9 | 88% | 0.879 | 78% | 0.775 | S | S | * | * | trans | -72.2 | 135.7 | 177.4 | -157.2 | 155.8 | -145.4 | 0 | 0 | 109.8 | ||||
| 278 | A | 31.6 | Very low | 32.2 | Very low | 86 Ų | 86 | 142.1 Ų | 142.1 | 71% | 0.711 | 78% | 0.776 | S | S | * | * | trans | -81.7 | 150.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 279 | S | 28.9 | Very low | 32.4 | Very low | 118 Ų | 118 | 140.3 Ų | 140.3 | 83% | 0.825 | 77% | 0.772 | S | S | * | * | -147.7 | 162.1 | 52.7 | -65.1 | 0 | 0 | 0 | 0 | 114 | |||||
| 280 | C | 30.4 | Very low | 32.6 | Very low | 104 Ų | 104 | 137.9 Ų | 137.9 | 70% | 0.703 | 77% | 0.772 | S | S | * | * | trans | -107.5 | 153.9 | 174.7 | -55.5 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 281 | S | 29.5 | Very low | 32.6 | Very low | 127 Ų | 127 | 136.5 Ų | 136.5 | 89% | 0.888 | 77% | 0.774 | S | S | * | * | trans | -126.5 | 147.8 | 136.8 | 60.5 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 282 | Q | 37.3 | Very low | 32.5 | Very low | 169 Ų | 169 | 134.8 Ų | 134.8 | 79% | 0.79 | 77% | 0.767 | S | S | * | * | trans | -151.8 | 138.4 | -170 | 174.8 | 177.8 | -4 | 0 | 0 | 108.2 | ||||
| 283 | D | 33.1 | Very low | 32.7 | Very low | 165 Ų | 165 | 133.8 Ų | 133.8 | 88% | 0.882 | 77% | 0.766 | S | S | * | * | trans | 161.4 | 144.8 | 158.9 | -84.2 | -22.7 | 0 | 0 | 0 | 106.9 | ||||
| 284 | G | 34.5 | Very low | 32.9 | Very low | 69 Ų | 69 | 134.4 Ų | 134.4 | 71% | 0.711 | 77% | 0.765 | S | S | * | * | cis | -158.4 | 177 | -6.6 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 285 | N | 38.7 | Very low | 33 | Very low | 156 Ų | 156 | 140.1 Ų | 140.1 | 83% | 0.834 | 77% | 0.774 | S | S | * | * | trans | -111.9 | 145.2 | -167 | -84.8 | -57.8 | 0 | 0 | 0 | 115.7 | ||||
| 286 | L | 31.2 | Very low | 33.2 | Very low | 152 Ų | 152 | 135.2 Ų | 135.2 | 80% | 0.796 | 76% | 0.764 | S | S | * | * | trans | 69.8 | 163.8 | 152.6 | -94.6 | 58.1 | 0 | 0 | 0 | 117.9 | ||||
| 287 | P | 52.8 | Low | 33.2 | Very low | 103 Ų | 103 | 135 Ų | 135 | 67% | 0.669 | 76% | 0.763 | S | S | * | * | -145.3 | 174.8 | -58.4 | 36.6 | -16.2 | 0 | 0 | 0 | 117.6 | |||||
| 288 | T | 33.7 | Very low | 33.2 | Very low | 123 Ų | 123 | 132.6 Ų | 132.6 | 76% | 0.755 | 75% | 0.752 | S | S | * | * | trans | 87.5 | 148.6 | 148.2 | -3.6 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 289 | L | 33.2 | Very low | 33.1 | Very low | 142 Ų | 142 | 135.6 Ų | 135.6 | 74% | 0.743 | 76% | 0.755 | S | S | * | * | trans | 76 | 88.7 | 159 | -58.7 | -177.9 | 0 | 0 | 0 | 122.2 | ||||
| 290 | I | 32.5 | Very low | 33.1 | Very low | 149 Ų | 149 | 136.2 Ų | 136.2 | 76% | 0.764 | 75% | 0.754 | S | S | * | * | 36.8 | 117.4 | 111.1 | -54 | 166.3 | 0 | 0 | 0 | 116.3 | |||||
| 291 | S | 31.5 | Very low | 32.8 | Very low | 110 Ų | 110 | 139.1 Ų | 139.1 | 77% | 0.769 | 76% | 0.759 | S | S | * | * | 178.4 | 162.1 | 74.2 | -147.9 | 0 | 0 | 0 | 0 | 117.2 | |||||
| 292 | S | 30.1 | Very low | 34.1 | Very low | 96 Ų | 96 | 137.4 Ų | 137.4 | 67% | 0.671 | 75% | 0.745 | S | S | * | * | trans | 56.6 | 98.9 | 143.4 | -163.2 | 0 | 0 | 0 | 0 | 124.5 | ||||
| 293 | V | 32.8 | Very low | 33.7 | Very low | 116 Ų | 116 | 137.3 Ų | 137.3 | 70% | 0.703 | 75% | 0.745 | S | S | * | * | 27.9 | 119.7 | 117.6 | -173.6 | 0 | 0 | 0 | 0 | 120.6 | |||||
| 294 | H | 32.4 | Very low | 33.6 | Very low | 154 Ų | 154 | 136.3 Ų | 136.3 | 71% | 0.713 | 73% | 0.734 | S | S | * | * | trans | 155.1 | 155.3 | 135.3 | -90.7 | -38 | 0 | 0 | 0 | 111.2 | ||||
| 295 | R | 31.1 | Very low | 33.5 | Very low | 207 Ų | 207 | 140.5 Ų | 140.5 | 78% | 0.781 | 74% | 0.735 | S | S | * | * | cis | -176.2 | 147.7 | -20.2 | -168.9 | -176 | -159.7 | 165.7 | 2.5 | 108.6 | ||||
| 296 | S | 28.7 | Very low | 33 | Very low | 96 Ų | 96 | 138.8 Ų | 138.8 | 67% | 0.671 | 74% | 0.735 | S | S | * | * | trans | 69.1 | 148.5 | 156.5 | 144.8 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 297 | R | 34.3 | Very low | 32.8 | Very low | 205 Ų | 205 | 142.2 Ų | 142.2 | 77% | 0.774 | 74% | 0.738 | S | S | * | * | cis | -160.4 | -166.2 | -5 | -99.2 | 170.5 | -164.3 | -174.5 | 5 | 105.4 | ||||
| 298 | H | 29 | Very low | 31.7 | Very low | 137 Ų | 137 | 141.6 Ų | 141.6 | 63% | 0.634 | 74% | 0.735 | S | S | * | * | cis | -171 | 162.9 | 27.7 | -140 | -63.2 | 0 | 0 | 0 | 111.6 | ||||
| 299 | L | 29.3 | Very low | 31.4 | Very low | 150 Ų | 150 | 143 Ų | 143 | 79% | 0.785 | 73% | 0.733 | S | S | * | * | trans | 75.1 | 141.1 | 163.9 | -54.7 | 172.4 | 0 | 0 | 0 | 116.1 | ||||
| 300 | V | 28.6 | Very low | 31 | Very low | 130 Ų | 130 | 143.5 Ų | 143.5 | 79% | 0.788 | 73% | 0.729 | S | S | * | * | cis | -138.3 | 164 | 1.9 | -175.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 301 | M | 25.3 | Very low | 30.8 | Very low | 165 Ų | 165 | 142.3 Ų | 142.3 | 81% | 0.813 | 72% | 0.72 | S | S | * | * | trans | -146.8 | 165.6 | 169.6 | -78.7 | -78.3 | -80.5 | 0 | 0 | 108.6 | ||||
| 302 | P | 55.8 | Low | 30.7 | Very low | 92 Ų | 92 | 147.6 Ų | 147.6 | 60% | 0.597 | 72% | 0.723 | S | S | * | * | cis | -134.6 | -146.9 | -22.4 | 31.1 | -5.9 | 0 | 0 | 0 | 112.5 | ||||
| 303 | E | 29.4 | Very low | 30.5 | Very low | 167 Ų | 167 | 146.7 Ų | 146.7 | 78% | 0.78 | 73% | 0.729 | S | S | * | * | trans | 82.9 | 147.7 | 164.8 | -58.6 | 174.6 | -167.3 | 0 | 0 | 117.4 | ||||
| 304 | H | 30.8 | Very low | 30.2 | Very low | 143 Ų | 143 | 146.2 Ų | 146.2 | 66% | 0.662 | 73% | 0.731 | S | S | * | * | cis | -153.5 | 153.9 | 7.5 | -149.2 | -131.2 | 0 | 0 | 0 | 114.8 | ||||
| 305 | Q | 31.7 | Very low | 30.1 | Very low | 157 Ų | 157 | 146.4 Ų | 146.4 | 73% | 0.734 | 74% | 0.737 | S | S | * | * | trans | 20.7 | 139.5 | 156.1 | -67.3 | 179.8 | -2.9 | 0 | 0 | 126.2 | ||||
| 306 | S | 28 | Very low | 30 | Very low | 120 Ų | 120 | 143.5 Ų | 143.5 | 84% | 0.839 | 73% | 0.732 | S | S | * | * | 177.5 | 149.3 | 121.7 | 37.7 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 307 | R | 28 | Very low | 30 | Very low | 225 Ų | 225 | 145.8 Ų | 145.8 | 85% | 0.849 | 74% | 0.735 | S | S | * | * | cis | -167.2 | 131.4 | -16.6 | 175.8 | 175.9 | -176.8 | -146.1 | 0.1 | 112.5 | ||||
| 308 | C | 28.5 | Very low | 29.6 | Very low | 90 Ų | 90 | 138.8 Ų | 138.8 | 61% | 0.608 | 73% | 0.727 | S | S | * | * | trans | 64.1 | 154 | 153.4 | -69.1 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 309 | E | 28.1 | Very low | 29.8 | Very low | 151 Ų | 151 | 140.3 Ų | 140.3 | 71% | 0.706 | 74% | 0.739 | S | S | * | * | cis | -174.5 | 175.5 | -29.5 | -131.2 | 178.7 | 137.9 | 0 | 0 | 114.4 | ||||
| 310 | F | 25.9 | Very low | 29.7 | Very low | 154 Ų | 154 | 144.3 Ų | 144.3 | 68% | 0.675 | 74% | 0.744 | S | S | * | * | trans | 73.6 | 145.4 | 162.2 | -85.5 | -134.7 | 0 | 0 | 0 | 120 | ||||
| 311 | Q | 28.1 | Very low | 30.6 | Very low | 123 Ų | 123 | 143.1 Ų | 143.1 | 58% | 0.575 | 74% | 0.739 | S | S | * | * | cis | -165.5 | 127.4 | -16.9 | 176.1 | 163 | 93 | 0 | 0 | 115.3 | ||||
| 312 | R | 29.4 | Very low | 30.8 | Very low | 221 Ų | 221 | 140.2 Ų | 140.2 | 83% | 0.834 | 74% | 0.741 | S | S | * | * | trans | 57 | 119.6 | 143.1 | -168 | -175.7 | -65.9 | 176.6 | -0.2 | 124.1 | ||||
| 313 | G | 26.1 | Very low | 29.6 | Very low | 77 Ų | 77 | 139 Ų | 139 | 79% | 0.794 | 75% | 0.745 | S | S | * | * | trans | 95.1 | 158.6 | 143.1 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 314 | S | 25 | Very low | 29.8 | Very low | 106 Ų | 106 | 138.2 Ų | 138.2 | 74% | 0.741 | 75% | 0.746 | S | S | * | * | cis | -171.2 | 156.5 | -14 | -161 | 0 | 0 | 0 | 0 | 111 | ||||
| 315 | L | 31.2 | Very low | 30 | Very low | 158 Ų | 158 | 138 Ų | 138 | 83% | 0.827 | 75% | 0.749 | S | S | * | * | trans | 62.9 | 156.5 | 168.5 | -94.7 | 43.4 | 0 | 0 | 0 | 117 | ||||
| 316 | E | 29.2 | Very low | 30.2 | Very low | 146 Ų | 146 | 138.4 Ų | 138.4 | 68% | 0.682 | 76% | 0.756 | S | S | * | * | cis | -169.2 | 160.4 | -24.1 | -121.8 | -70.3 | 73 | 0 | 0 | 108.8 | ||||
| 317 | I | 29.2 | Very low | 30.3 | Very low | 144 Ų | 144 | 136.4 Ų | 136.4 | 74% | 0.738 | 75% | 0.754 | S | S | * | * | trans | 64.7 | 146.6 | 161.9 | -58.6 | 155.5 | 0 | 0 | 0 | 117.1 | ||||
| 318 | G | 25.8 | Very low | 30.8 | Very low | 59 Ų | 59 | 134 Ų | 134 | 61% | 0.608 | 75% | 0.749 | S | S | * | * | cis | 150.8 | 158.3 | -8.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 319 | L | 31.6 | Very low | 30.9 | Very low | 169 Ų | 169 | 140.8 Ų | 140.8 | 89% | 0.885 | 76% | 0.762 | S | S | * | * | trans | 72.3 | 117.9 | 173.8 | -45.3 | 177.3 | 0 | 0 | 0 | 116.2 | ||||
| 320 | R | 27.3 | Very low | 31.2 | Very low | 233 Ų | 233 | 141.8 Ų | 141.8 | 88% | 0.879 | 77% | 0.771 | S | S | * | * | cis | 64.5 | 153.5 | 46.5 | -84 | -152.7 | -166.9 | 138.1 | 0.2 | 115.7 | ||||
| 321 | P | 48.4 | Very low | 31.2 | Very low | 105 Ų | 105 | 138.1 Ų | 138.1 | 68% | 0.682 | 78% | 0.777 | S | S | * | * | cis | -145.5 | 178.1 | -33.3 | 40.7 | -23.7 | 0 | 0 | 0 | 115.3 | ||||
| 322 | A | 30.1 | Very low | 31.2 | Very low | 105 Ų | 105 | 144.1 Ų | 144.1 | 87% | 0.868 | 80% | 0.795 | S | S | * | * | trans | 62.1 | 159.7 | 149.9 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 323 | G | 29.6 | Very low | 31.3 | Very low | 66 Ų | 66 | 138.7 Ų | 138.7 | 68% | 0.68 | 79% | 0.791 | S | S | * | * | cis | -175.8 | 156.6 | -9.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 324 | D | 33.3 | Very low | 32.1 | Very low | 151 Ų | 151 | 140.8 Ų | 140.8 | 81% | 0.807 | 79% | 0.79 | S | S | * | * | trans | 61.2 | 127.7 | 140.4 | -84.5 | -31.1 | 0 | 0 | 0 | 125.3 | ||||
| 325 | L | 34.7 | Very low | 32.1 | Very low | 137 Ų | 137 | 146.8 Ų | 146.8 | 72% | 0.717 | 80% | 0.797 | S | S | * | * | trans | 85.1 | 122.9 | 135.2 | -65.7 | 168.3 | 0 | 0 | 0 | 123.6 | ||||
| 326 | L | 35.9 | Very low | 32 | Very low | 167 Ų | 167 | 147 Ų | 147 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | 69.7 | 129.5 | 135.2 | -71.5 | 166.3 | 0 | 0 | 0 | 122.2 | ||||
| 327 | G | 30.5 | Very low | 31.7 | Very low | 77 Ų | 77 | 145.3 Ų | 145.3 | 79% | 0.794 | 80% | 0.801 | S | S | * | * | trans | 165.9 | 115.9 | 155.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 328 | K | 38.1 | Very low | 31.6 | Very low | 174 Ų | 174 | 143.1 Ų | 143.1 | 76% | 0.757 | 80% | 0.799 | S | S | * | * | trans | -122.7 | 127.8 | 175.7 | -59.2 | -179.7 | -178.8 | -178.1 | 0 | 111.6 | ||||
| 329 | R | 31.8 | Very low | 31.6 | Very low | 234 Ų | 234 | 147.9 Ų | 147.9 | 88% | 0.883 | 81% | 0.81 | S | S | * | * | 156.4 | 170.5 | 126 | -90.5 | 173.7 | -74.9 | -131.9 | 2.5 | 116 | |||||
| 330 | L | 33.6 | Very low | 31.4 | Very low | 171 Ų | 171 | 145.5 Ų | 145.5 | 90% | 0.895 | 81% | 0.807 | S | S | * | * | trans | -72.6 | 158.2 | -174.1 | -66.6 | 66.5 | 0 | 0 | 0 | 114.2 | ||||
| 331 | G | 25.9 | Very low | 31.2 | Very low | 78 Ų | 78 | 144.9 Ų | 144.9 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | -142.3 | 162.8 | 161.3 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 332 | R | 28.6 | Very low | 30.2 | Very low | 248 Ų | 248 | 143.8 Ų | 143.8 | 94% | 0.936 | 81% | 0.806 | S | S | * | * | trans | -104.4 | 159.4 | -176.3 | -76 | -175.3 | 173.8 | -171.9 | -0.7 | 113.4 | ||||
| 333 | S | 31.6 | Very low | 30.2 | Very low | 108 Ų | 108 | 146 Ų | 146 | 76% | 0.755 | 80% | 0.798 | S | S | * | * | trans | -67.5 | 157.7 | 167.7 | 145.2 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 334 | P | 42 | Very low | 30.2 | Very low | 121 Ų | 121 | 152.7 Ų | 152.7 | 79% | 0.786 | 81% | 0.808 | S | S | * | * | trans | -120.3 | -173.7 | 132.1 | 37.2 | -31.3 | 0 | 0 | 0 | 113.1 | ||||
| 335 | R | 26.7 | Very low | 30 | Very low | 232 Ų | 232 | 156.1 Ų | 156.1 | 88% | 0.875 | 81% | 0.81 | S | S | * | * | trans | -102 | 168.1 | -167.7 | -48.6 | 176.1 | -178 | -173.9 | -0.7 | 113.5 | ||||
| 336 | I | 27.1 | Very low | 29.7 | Very low | 162 Ų | 162 | 154.4 Ų | 154.4 | 83% | 0.831 | 82% | 0.815 | S | S | * | * | trans | 169.6 | 130.4 | 138.6 | -87.8 | 150.8 | 0 | 0 | 0 | 105.8 | ||||
| 337 | S | 24.5 | Very low | 29.4 | Very low | 110 Ų | 110 | 158.2 Ų | 158.2 | 77% | 0.769 | 82% | 0.818 | S | S | * | * | cis | 89.7 | 76.5 | 14.8 | -161 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 338 | S | 26.6 | Very low | 29.3 | Very low | 98 Ų | 98 | 159.7 Ų | 159.7 | 69% | 0.685 | 82% | 0.816 | S | S | * | * | trans | -153.8 | 100.4 | 158.3 | 61.2 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 339 | D | 25.6 | Very low | 28.7 | Very low | 160 Ų | 160 | 160.7 Ų | 160.7 | 86% | 0.856 | 82% | 0.823 | S | S | * | * | trans | 52.8 | 145.6 | 133.4 | -48 | -36.7 | 0 | 0 | 0 | 123.3 | ||||
| 340 | C | 26.7 | Very low | 28.6 | Very low | 119 Ų | 119 | 154.4 Ų | 154.4 | 80% | 0.804 | 82% | 0.816 | S | S | * | * | trans | -80.3 | 163.8 | 179 | -48.3 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 341 | F | 23.1 | Very low | 29.1 | Very low | 219 Ų | 219 | 151.1 Ų | 151.1 | 96% | 0.961 | 81% | 0.805 | S | S | * | * | trans | -134.3 | 145.3 | 142.9 | -110.3 | -81.2 | 0 | 0 | 0 | 111.3 | ||||
| 342 | S | 28.9 | Very low | 29 | Very low | 83 Ų | 83 | 156.3 Ų | 156.3 | 58% | 0.58 | 81% | 0.808 | S | S | * | * | trans | -116.6 | 161.2 | -174.9 | -166.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 343 | E | 29.8 | Very low | 29 | Very low | 151 Ų | 151 | 154.2 Ų | 154.2 | 71% | 0.706 | 81% | 0.808 | S | S | * | * | trans | 52.9 | 120.8 | 154.6 | -75.1 | 155.6 | 95.3 | 0 | 0 | 122.1 | ||||
| 344 | K | 29.9 | Very low | 28.8 | Very low | 206 Ų | 206 | 153.4 Ų | 153.4 | 90% | 0.896 | 81% | 0.809 | S | S | * | * | -157.5 | 110.7 | 126.5 | -99.1 | 148.9 | -175.6 | 176.1 | 0 | 106.9 | |||||
| 345 | R | 29.3 | Very low | 28.1 | Very low | 224 Ų | 224 | 155.2 Ų | 155.2 | 85% | 0.845 | 81% | 0.811 | S | S | * | * | 69.9 | 133 | 69.6 | -86.8 | -163.5 | 173.7 | -127.1 | 0.9 | 115.3 | |||||
| 346 | A | 27.7 | Very low | 28.2 | Very low | 100 Ų | 100 | 150.9 Ų | 150.9 | 83% | 0.826 | 80% | 0.804 | S | S | * | * | trans | 66.9 | 128 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 347 | R | 28.9 | Very low | 28.8 | Very low | 248 Ų | 248 | 150.5 Ų | 150.5 | 94% | 0.936 | 80% | 0.803 | S | S | * | * | cis | 90.2 | 78.3 | 15.1 | -158.7 | -158.5 | -164.4 | -167.4 | 6.8 | 117 | ||||
| 348 | S | 28.2 | Very low | 29.3 | Very low | 108 Ų | 108 | 150.8 Ų | 150.8 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | trans | -171.2 | 110.8 | 146.5 | 50.7 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 349 | E | 25.6 | Very low | 29.4 | Very low | 194 Ų | 194 | 155.7 Ų | 155.7 | 91% | 0.907 | 81% | 0.806 | S | S | * | * | 93.3 | 145.2 | 69.4 | -168.6 | 156.8 | -139.8 | 0 | 0 | 111.8 | |||||
| 350 | S | 30.3 | Very low | 29.5 | Very low | 103 Ų | 103 | 154.8 Ų | 154.8 | 72% | 0.72 | 80% | 0.797 | S | S | * | * | trans | -104.1 | -155.2 | -169.4 | 62 | 0 | 0 | 0 | 0 | 109 | ||||
| 351 | P | 42.9 | Very low | 29.8 | Very low | 102 Ų | 102 | 157 Ų | 157 | 66% | 0.662 | 80% | 0.799 | S | S | * | * | cis | -134.6 | -178.9 | -7.2 | 32.3 | -9.7 | 0 | 0 | 0 | 114.5 | ||||
| 352 | Q | 25.3 | Very low | 30.2 | Very low | 186 Ų | 186 | 149.6 Ų | 149.6 | 87% | 0.869 | 79% | 0.785 | S | S | * | * | 164.2 | 117.1 | 114.7 | -88.1 | -177.8 | 1.2 | 0 | 0 | 112.1 | |||||
| 353 | E | 27.2 | Very low | 30.8 | Very low | 204 Ų | 204 | 151.4 Ų | 151.4 | 95% | 0.953 | 80% | 0.795 | S | S | * | * | trans | -149.4 | 137.5 | 149.1 | -143.2 | 174.5 | -179.2 | 0 | 0 | 107.5 | ||||
| 354 | A | 28.2 | Very low | 31.6 | Very low | 92 Ų | 92 | 150.1 Ų | 150.1 | 76% | 0.76 | 80% | 0.803 | S | S | * | * | trans | -155.4 | 131 | -171.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 355 | L | 27.7 | Very low | 32.4 | Very low | 158 Ų | 158 | 144.4 Ų | 144.4 | 83% | 0.827 | 78% | 0.78 | S | S | * | * | 176.3 | 97.5 | 125.3 | -92.9 | 169.3 | 0 | 0 | 0 | 112.4 | |||||
| 356 | L | 28.6 | Very low | 33.9 | Very low | 141 Ų | 141 | 135.8 Ų | 135.8 | 74% | 0.738 | 76% | 0.757 | S | S | * | * | trans | 34.8 | 110.4 | 138.9 | -55.1 | 175.9 | 0 | 0 | 0 | 122 | ||||
| 357 | L | 39.4 | Very low | 35.3 | Very low | 155 Ų | 155 | 135.7 Ų | 135.7 | 81% | 0.812 | 75% | 0.748 | S | S | * | * | 66.7 | 155 | 126.4 | -74.6 | 171.9 | 0 | 0 | 0 | 119.8 | |||||
| 358 | P | 36 | Very low | 36.7 | Very low | 116 Ų | 116 | 129.9 Ų | 129.9 | 75% | 0.753 | 73% | 0.731 | S | S | * | * | cis | -142.5 | 161.3 | 36.5 | 43.6 | -24.5 | 0 | 0 | 0 | 120.1 | ||||
| 359 | R | 29 | Very low | 38.2 | Very low | 201 Ų | 201 | 127.6 Ų | 127.6 | 76% | 0.758 | 71% | 0.711 | S | S | * | * | 30.1 | 126.1 | 127.8 | -159.6 | 172.9 | 156.1 | 163.5 | -5.4 | 118.4 | |||||
| 360 | E | 26.8 | Very low | 40.2 | Very low | 141 Ų | 141 | 124.5 Ų | 124.5 | 66% | 0.659 | 70% | 0.696 | S | S | * | * | -161.9 | 172.8 | 87 | -103 | -58.4 | 164.5 | 0 | 0 | 115 | |||||
| 361 | L | 33.8 | Very low | 41.6 | Very low | 164 Ų | 164 | 127.2 Ų | 127.2 | 86% | 0.859 | 69% | 0.691 | S | S | * | * | trans | -86.7 | 143.4 | -175.5 | -165.7 | 71.1 | 0 | 0 | 0 | 113 | ||||
| 362 | G | 30.3 | Very low | 42.8 | Very low | 65 Ų | 65 | 130.3 Ų | 130.3 | 67% | 0.67 | 69% | 0.69 | S | S | * | * | trans | -146.4 | 140.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 363 | P | 42.8 | Very low | 44.9 | Very low | 121 Ų | 121 | 129.1 Ų | 129.1 | 79% | 0.786 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -86 | 155.6 | -160.4 | 33.2 | -37.2 | 0 | 0 | 0 | 115.3 | M365 | P363-M365 PolarHBondContact O-N 2.94Š|
| 364 | S | 45.7 | Very low | 46.8 | Very low | 124 Ų | 124 | 123.8 Ų | 123.8 | 87% | 0.867 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 128.7 | 163.1 | -172.3 | 0 | 0 | 0 | 0 | 110.4 | ||
| 365 | M | 47.4 | Very low | 48.5 | Very low | 86 Ų | 86 | 122.7 Ų | 122.7 | 42% | 0.424 | 64% | 0.639 | S | S | . | * | P | Polyproline II helix | trans | -75.6 | 133.7 | 177.8 | -66.3 | -65.5 | -46.6 | 0 | 0 | 110.6 | P363 D369 | P363-M365 PolarHBondContact O-N 2.94Å; M365-D369 HydrophobicContact CE-CB 3.48Å; M365-D369 VanDerWaalsContact CE-CB 3.48Å |
| 366 | A | 61 | Low | 50 | Low | 43 Ų | 43 | 118.1 Ų | 118.1 | 36% | 0.355 | 62% | 0.62 | S | S | . | * | P | Polyproline II helix | trans | -70.2 | 148.1 | 170.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | E368 D369 H370 | A366-E368 PolarHBondContact O-N 3.36Å; A366-E368 VanDerWaalsContact O-N 3.16Å; A366-D369 PolarHBondContact O-N 3.07Å; A366-D369 VanDerWaalsContact O-N 3.13Å; A366-H370 PolarHBondContact O-N 3.19Å |
| 367 | P | 56.3 | Low | 51.3 | Low | 98 Ų | 98 | 114.2 Ų | 114.2 | 64% | 0.636 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -53.4 | -34.9 | 178.4 | -27.3 | 35.5 | 0 | 0 | 0 | 113.9 | D369 H370 Y371 | P367-D369 VanDerWaalsContact C-N 3.33Å; P367-D369 PolarHBondContact O-N 3.43Å; P367-H370 WeakPolarHBondContact O-CB 3.34Å; P367-H370 PolarHBondContact O-N 3.46Å; P367-Y371 PolarHBondContact O-N 3.47Å |
| 368 | E | 57.6 | Low | 51.6 | Low | 125 Ų | 125 | 113 Ų | 113 | 58% | 0.584 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -64.2 | -35.3 | -178.6 | -66.4 | 66.9 | -148.4 | 0 | 0 | 112.3 | A366 Y371 R372 | A366-E368 PolarHBondContact O-N 3.36Å; A366-E368 VanDerWaalsContact O-N 3.16Å; E368-Y371 PolarHBondContact O-N 2.67Å; E368-R372 WeakPolarHBondContact O-CG 3.5Å; E368-R372 PolarHBondContact O-N 2.93Å |
| 369 | D | 59.5 | Low | 52.1 | Low | 60 Ų | 60 | 111.2 Ų | 111.2 | 32% | 0.321 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -81.3 | -24.5 | 177.8 | -73.9 | -37.9 | 0 | 0 | 0 | 112.4 | M365 A366 P367 R372 R373 | M365-D369 HydrophobicContact CE-CB 3.48Å; M365-D369 VanDerWaalsContact CE-CB 3.48Å; A366-D369 PolarHBondContact O-N 3.07Å; A366-D369 VanDerWaalsContact O-N 3.13Å; P367-D369 VanDerWaalsContact C-N 3.33Å; P367-D369 PolarHBondContact O-N 3.43Å; D369-R372 IonicContact OD1-NE 2.71Å; D369-R372 IonicContact OD1-NH2 3.7Å; D369-R372 PolarHBondContact OD1-NH2 2.75Å; D369-R373 WeakPolarHBondContact O-CG 3.26Å; D369-R373 PolarHBondContact O-N 3.34Å |
| 370 | H | 67.9 | Low | 52.7 | Low | 129 Ų | 129 | 108.8 Ų | 108.8 | 60% | 0.597 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -65.5 | -45.8 | 165.5 | -173.7 | 86.5 | 0 | 0 | 0 | 110.3 | A366 P367 R372 R373 L374 | A366-H370 PolarHBondContact O-N 3.19Å; P367-H370 WeakPolarHBondContact O-CB 3.34Å; P367-H370 PolarHBondContact O-N 3.46Å; H370-R372 PolarHBondContact O-N 3.42Å; H370-R373 PolarHBondContact O-N 2.82Å; H370-L374 PolarHBondContact O-N 3.43Å |
| 371 | Y | 60.1 | Low | 53.2 | Low | 160 Ų | 160 | 106.2 Ų | 106.2 | 63% | 0.627 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -59.4 | -44.9 | 174.1 | -176.5 | -97.8 | 0 | 0 | 0 | 112.1 | P367 E368 R373 L374 V375 | P367-Y371 PolarHBondContact O-N 3.47Å; E368-Y371 PolarHBondContact O-N 2.67Å; Y371-R373 PolarHBondContact O-N 3.1Å; Y371-L374 PolarHBondContact O-N 3.13Å; Y371-V375 HydrophobicContact CD1-CG2 4.16Å; Y371-V375 HydrophobicContact CE1-CG2 3.77Å; Y371-V375 WeakPolarHBondContact O-CG2 3.4Å; Y371-V375 PolarHBondContact O-N 3.03Å |
| 372 | R | 67.6 | Low | 53 | Low | 167 Ų | 167 | 103.1 Ų | 103.1 | 63% | 0.63 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -65 | -38.6 | 177.3 | -72.8 | -149.9 | -68.9 | 178.7 | -4.2 | 113.4 | E368 D369 H370 L374 V375 S376 | E368-R372 WeakPolarHBondContact O-CG 3.5Å; E368-R372 PolarHBondContact O-N 2.93Å; D369-R372 IonicContact OD1-NE 2.71Å; D369-R372 IonicContact OD1-NH2 3.7Å; D369-R372 PolarHBondContact OD1-NH2 2.75Å; H370-R372 PolarHBondContact O-N 3.42Å; R372-L374 VanDerWaalsContact C-N 3.31Å; R372-L374 PolarHBondContact O-N 3.11Å; R372-V375 PolarHBondContact O-N 3.31Å; R372-S376 PolarHBondContact O-N 3.4Å; R372-S376 PolarHBondContact O-OG 3.19Å |
| 373 | R | 69.7 | Low | 53.2 | Low | 162 Ų | 162 | 106 Ų | 106 | 61% | 0.611 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -62.1 | -38.5 | 172.4 | -75.3 | 177.6 | -176.3 | 172.4 | 5.5 | 112.3 | D369 H370 Y371 S376 A377 | D369-R373 WeakPolarHBondContact O-CG 3.26Å; D369-R373 PolarHBondContact O-N 3.34Å; H370-R373 PolarHBondContact O-N 2.82Å; Y371-R373 PolarHBondContact O-N 3.1Å; R373-S376 PolarHBondContact O-N 3.02Å; R373-A377 WeakPolarHBondContact O-CB 3.19Å; R373-A377 PolarHBondContact O-N 3.44Å |
| 374 | L | 68.2 | Low | 52.5 | Low | 91 Ų | 91 | 109.5 Ų | 109.5 | 48% | 0.476 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -67.2 | -40.8 | 177.4 | -160.2 | 155.7 | 0 | 0 | 0 | 111.5 | H370 Y371 R372 L378 | H370-L374 PolarHBondContact O-N 3.43Å; Y371-L374 PolarHBondContact O-N 3.13Å; R372-L374 VanDerWaalsContact C-N 3.31Å; R372-L374 PolarHBondContact O-N 3.11Å; L374-L378 HydrophobicContact CD2-CD1 3.91Å; L374-L378 WeakPolarHBondContact O-CG 3.28Å; L374-L378 PolarHBondContact O-N 2.77Å |
| 375 | V | 62.5 | Low | 52 | Low | 70 Ų | 70 | 111.5 Ų | 111.5 | 42% | 0.424 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -65.1 | -40.5 | 172.7 | 173.7 | 0 | 0 | 0 | 0 | 112 | Y371 R372 L378 S379 | Y371-V375 HydrophobicContact CD1-CG2 4.16Å; Y371-V375 HydrophobicContact CE1-CG2 3.77Å; Y371-V375 WeakPolarHBondContact O-CG2 3.4Å; Y371-V375 PolarHBondContact O-N 3.03Å; R372-V375 PolarHBondContact O-N 3.31Å; V375-L378 PolarHBondContact O-N 3.32Å; V375-S379 PolarHBondContact O-N 3.45Å |
| 376 | S | 60.1 | Low | 51.7 | Low | 62 Ų | 62 | 112.8 Ų | 112.8 | 43% | 0.434 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -64.1 | -44.9 | 175.3 | -69.9 | 0 | 0 | 0 | 0 | 112.5 | R372 R373 L378 S379 E380 | R372-S376 PolarHBondContact O-N 3.4Å; R372-S376 PolarHBondContact O-OG 3.19Å; R373-S376 PolarHBondContact O-N 3.02Å; S376-L378 PolarHBondContact O-N 3.46Å; S376-S379 WeakPolarHBondContact O-CA 3.41Å; S376-S379 PolarHBondContact O-N 2.86Å; S376-S379 PolarHBondContact O-OG 3.13Å; S376-E380 PolarHBondContact O-N 3.29Å |
| 377 | A | 55 | Low | 50.7 | Low | 59 Ų | 59 | 116.2 Ų | 116.2 | 49% | 0.488 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -61.3 | -30.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113 | R373 S379 | R373-A377 WeakPolarHBondContact O-CB 3.19Å; R373-A377 PolarHBondContact O-N 3.44Å; A377-S379 VanDerWaalsContact C-N 3.34Å |
| 378 | L | 45.8 | Very low | 49.5 | Very low | 128 Ų | 128 | 119.5 Ų | 119.5 | 67% | 0.67 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -72.9 | -23.5 | 172.2 | -70 | 170.4 | 0 | 0 | 0 | 113.2 | L374 V375 S376 | L374-L378 HydrophobicContact CD2-CD1 3.91Å; L374-L378 WeakPolarHBondContact O-CG 3.28Å; L374-L378 PolarHBondContact O-N 2.77Å; V375-L378 PolarHBondContact O-N 3.32Å; S376-L378 PolarHBondContact O-N 3.46Å |
| 379 | S | 46.5 | Very low | 48.3 | Very low | 79 Ų | 79 | 124.5 Ų | 124.5 | 55% | 0.552 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -85.3 | -23.1 | 177.6 | 69.2 | 0 | 0 | 0 | 0 | 114.3 | V375 S376 A377 A381 | V375-S379 PolarHBondContact O-N 3.45Å; S376-S379 WeakPolarHBondContact O-CA 3.41Å; S376-S379 PolarHBondContact O-N 2.86Å; S376-S379 PolarHBondContact O-OG 3.13Å; A377-S379 VanDerWaalsContact C-N 3.34Å; S379-A381 VanDerWaalsContact C-N 3.26Å; S379-A381 PolarHBondContact O-N 3.36Å |
| 380 | E | 42.6 | Very low | 47 | Very low | 151 Ų | 151 | 129.9 Ų | 129.9 | 71% | 0.706 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.6 | -12.5 | 177.2 | -68.9 | 175.5 | 164.5 | 0 | 0 | 112.9 | S376 S382 | S376-E380 PolarHBondContact O-N 3.29Å; E380-S382 VanDerWaalsContact C-N 3.3Å; E380-S382 PolarHBondContact O-N 2.9Å |
| 381 | A | 36.4 | Very low | 45.3 | Very low | 87 Ų | 87 | 133.9 Ų | 133.9 | 72% | 0.719 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | 4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | S379 | S379-A381 VanDerWaalsContact C-N 3.26Å; S379-A381 PolarHBondContact O-N 3.36Å |
| 382 | S | 30.9 | Very low | 43.9 | Very low | 99 Ų | 99 | 134.9 Ų | 134.9 | 69% | 0.692 | 69% | 0.685 | S | S | * | * | trans | -126 | 85.8 | -177.8 | 62.8 | 0 | 0 | 0 | 0 | 113.1 | E380 | E380-S382 VanDerWaalsContact C-N 3.3Å; E380-S382 PolarHBondContact O-N 2.9Å | ||
| 383 | T | 33.2 | Very low | 42 | Very low | 126 Ų | 126 | 136 Ų | 136 | 77% | 0.773 | 70% | 0.702 | S | S | * | * | trans | -119.4 | 97.2 | 177.8 | 56.2 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 384 | F | 27.9 | Very low | 39.8 | Very low | 194 Ų | 194 | 131.3 Ų | 131.3 | 85% | 0.851 | 71% | 0.705 | S | S | * | * | trans | -158.1 | 109.7 | 150 | -150.2 | -105.8 | 0 | 0 | 0 | 114.7 | ||||
| 385 | E | 35.2 | Very low | 38 | Very low | 166 Ų | 166 | 135.3 Ų | 135.3 | 78% | 0.776 | 73% | 0.726 | S | S | * | * | trans | 59.4 | 144.1 | 154.7 | -65.6 | -70.5 | 74.3 | 0 | 0 | 123.3 | ||||
| 386 | D | 41.5 | Very low | 37 | Very low | 112 Ų | 112 | 138 Ų | 138 | 60% | 0.599 | 74% | 0.744 | S | S | * | * | trans | -106 | 168.7 | -174.1 | -173.5 | 42.2 | 0 | 0 | 0 | 110.7 | Q388 | D386-Q388 PolarHBondContact OD1-N 2.98Å; D386-Q388 PolarHBondContact OD2-N 3.11Å | ||
| 387 | P | 40.2 | Very low | 35.6 | Very low | 115 Ų | 115 | 140.5 Ų | 140.5 | 75% | 0.747 | 76% | 0.762 | S | S | * | * | -148.9 | 112.9 | 97 | 34.1 | -14.7 | 0 | 0 | 0 | 115.3 | R389 | P387-R389 PolarHBondContact O-N 3.34Š| |||
| 388 | Q | 31.7 | Very low | 35.2 | Very low | 168 Ų | 168 | 146.5 Ų | 146.5 | 79% | 0.785 | 78% | 0.78 | S | S | * | * | trans | -70.9 | 96 | 161.4 | -74.1 | -164.2 | -11.4 | 0 | 0 | 110.7 | D386 | D386-Q388 PolarHBondContact OD1-N 2.98Å; D386-Q388 PolarHBondContact OD2-N 3.11Å | ||
| 389 | R | 32.8 | Very low | 34.7 | Very low | 229 Ų | 229 | 147 Ų | 147 | 86% | 0.864 | 78% | 0.783 | S | S | * | * | trans | -131.8 | 144 | 159.4 | -76.7 | -170.7 | 162.5 | 172.5 | -4.3 | 111 | P387 | P387-R389 PolarHBondContact O-N 3.34Š| ||
| 390 | L | 30.6 | Very low | 34.3 | Very low | 173 Ų | 173 | 151.1 Ų | 151.1 | 91% | 0.906 | 80% | 0.798 | S | S | * | * | trans | 74.6 | 73.9 | -178 | -62.1 | 142.7 | 0 | 0 | 0 | 116 | ||||
| 391 | Y | 33 | Very low | 34.1 | Very low | 213 Ų | 213 | 152.3 Ų | 152.3 | 84% | 0.835 | 81% | 0.808 | S | S | * | * | trans | -107 | 158.2 | 139.4 | -91 | -82.3 | 0 | 0 | 0 | 109.5 | ||||
| 392 | H | 30.1 | Very low | 34.3 | Very low | 182 Ų | 182 | 158.1 Ų | 158.1 | 84% | 0.843 | 81% | 0.811 | S | S | * | * | trans | 84.5 | 80.6 | 178.2 | -52.5 | 92.2 | 0 | 0 | 0 | 117.9 | ||||
| 393 | L | 28.2 | Very low | 34.8 | Very low | 189 Ų | 189 | 159.4 Ų | 159.4 | 99% | 0.99 | 82% | 0.815 | S | S | * | * | -158.5 | 147.6 | 127.7 | -99 | 154 | 0 | 0 | 0 | 106.2 | |||||
| 394 | G | 24.3 | Very low | 35.1 | Very low | 65 Ų | 65 | 165 Ų | 165 | 67% | 0.67 | 82% | 0.822 | S | S | * | * | trans | -148.4 | -162.2 | -159.8 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 395 | L | 29.1 | Very low | 35.6 | Very low | 175 Ų | 175 | 164.3 Ų | 164.3 | 92% | 0.916 | 82% | 0.821 | S | S | * | * | trans | 74.5 | 160 | -171.8 | -53.1 | 176.7 | 0 | 0 | 0 | 114.5 | ||||
| 396 | P | 41.6 | Very low | 36 | Very low | 125 Ų | 125 | 164.9 Ų | 164.9 | 81% | 0.812 | 82% | 0.824 | S | S | * | * | cis | -123.8 | -171.4 | 0.8 | 39.5 | -22.8 | 0 | 0 | 0 | 115.2 | ||||
| 397 | S | 31.4 | Very low | 35.9 | Very low | 115 Ų | 115 | 166.3 Ų | 166.3 | 80% | 0.804 | 84% | 0.836 | S | S | * | * | trans | -70.7 | 170.7 | -171.5 | -53.8 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 398 | H | 46.4 | Very low | 35.6 | Very low | 186 Ų | 186 | 165.5 Ų | 165.5 | 86% | 0.861 | 84% | 0.839 | S | S | * | * | S | Bend | trans | -43.1 | 131.7 | 155.5 | -84.7 | -122.7 | 0 | 0 | 0 | 112.8 | ||
| 399 | D | 35.4 | Very low | 35.9 | Very low | 137 Ų | 137 | 162.2 Ų | 162.2 | 73% | 0.733 | 84% | 0.841 | S | S | * | * | trans | -174.1 | -20.4 | 136.1 | -108.9 | -26.2 | 0 | 0 | 0 | 114.5 | L401 | D399-L401 VanDerWaalsContact C-N 3.34Å; D399-L401 PolarHBondContact O-N 3.38Å | ||
| 400 | L | 37.3 | Very low | 35.9 | Very low | 166 Ų | 166 | 156.3 Ų | 156.3 | 87% | 0.869 | 84% | 0.841 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.9 | 24.3 | -165.7 | -93.1 | 169.4 | 0 | 0 | 0 | 118.1 | ||
| 401 | L | 38 | Very low | 35.9 | Very low | 177 Ų | 177 | 152.4 Ų | 152.4 | 93% | 0.927 | 83% | 0.834 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.1 | 8.5 | 177.4 | -72.4 | 178 | 0 | 0 | 0 | 115.5 | D399 | D399-L401 VanDerWaalsContact C-N 3.34Å; D399-L401 PolarHBondContact O-N 3.38Å |
| 402 | R | 40.9 | Very low | 35.8 | Very low | 208 Ų | 208 | 150.3 Ų | 150.3 | 79% | 0.785 | 84% | 0.836 | S | S | * | * | S | Bend | trans | -91.4 | -15.5 | 178.2 | -169.3 | 162.8 | -74.6 | 158.9 | -1.1 | 114.9 | ||
| 403 | V | 42.2 | Very low | 36 | Very low | 126 Ų | 126 | 152.8 Ų | 152.8 | 76% | 0.764 | 84% | 0.838 | S | S | * | * | S | Bend | trans | -97.1 | -1.5 | -164.3 | -180 | 0 | 0 | 0 | 0 | 114.5 | ||
| 404 | R | 39.2 | Very low | 36.1 | Very low | 245 Ų | 245 | 147.1 Ų | 147.1 | 93% | 0.925 | 83% | 0.825 | S | S | * | * | S | Bend | trans | -119.1 | 21.1 | -172.1 | -138.3 | 174.5 | -168.3 | -109 | 1.2 | 116.5 | ||
| 405 | Q | 38.7 | Very low | 37.1 | Very low | 179 Ų | 179 | 149.7 Ų | 149.7 | 84% | 0.836 | 83% | 0.83 | S | S | * | * | S | Bend | trans | -127 | 5 | 178.3 | -161.6 | 149.7 | 10.4 | 0 | 0 | 115.4 | ||
| 406 | E | 42.4 | Very low | 37.1 | Very low | 177 Ų | 177 | 147 Ų | 147 | 83% | 0.827 | 83% | 0.826 | S | S | * | * | S | Bend | trans | -103.2 | 1.2 | 178 | -64.3 | -168.4 | 132.6 | 0 | 0 | 114.6 | ||
| 407 | V | 39.9 | Very low | 36.5 | Very low | 142 Ų | 142 | 144.7 Ų | 144.7 | 86% | 0.861 | 83% | 0.825 | S | S | * | * | S | Bend | trans | -111.3 | 43.3 | -177.2 | -159.6 | 0 | 0 | 0 | 0 | 111.9 | ||
| 408 | A | 34.2 | Very low | 36.6 | Very low | 98 Ų | 98 | 147.2 Ų | 147.2 | 81% | 0.81 | 83% | 0.828 | S | S | * | * | S | Bend | trans | -130.4 | 12.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 409 | A | 36.9 | Very low | 35.6 | Very low | 100 Ų | 100 | 146.7 Ų | 146.7 | 83% | 0.826 | 83% | 0.826 | S | S | * | * | S | Bend | trans | -138.8 | 20.6 | -170.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 410 | A | 34.6 | Very low | 35.3 | Very low | 105 Ų | 105 | 144.4 Ų | 144.4 | 87% | 0.868 | 83% | 0.826 | S | S | * | * | S | Bend | trans | -149.8 | 32.6 | -174.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 411 | A | 30.7 | Very low | 34.8 | Very low | 90 Ų | 90 | 145.1 Ų | 145.1 | 74% | 0.744 | 83% | 0.825 | S | S | * | * | trans | -160.2 | 143.9 | 171 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 412 | L | 30.9 | Very low | 34.6 | Very low | 169 Ų | 169 | 144.6 Ų | 144.6 | 89% | 0.885 | 82% | 0.822 | S | S | * | * | cis | -150.9 | 165.5 | -6.2 | -116 | 170.1 | 0 | 0 | 0 | 109 | ||||
| 413 | R | 33 | Very low | 34.5 | Very low | 235 Ų | 235 | 141 Ų | 141 | 89% | 0.887 | 83% | 0.826 | S | S | * | * | trans | -73.6 | 156 | 164.8 | -61.1 | 173.8 | -176.3 | 143.3 | -0.3 | 109.1 | ||||
| 414 | G | 29.8 | Very low | 33.8 | Very low | 69 Ų | 69 | 140.7 Ų | 140.7 | 71% | 0.711 | 83% | 0.829 | S | S | * | * | trans | -65.1 | 179.7 | 167.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 415 | P | 46.6 | Very low | 33.3 | Very low | 120 Ų | 120 | 134.2 Ų | 134.2 | 78% | 0.779 | 82% | 0.822 | S | S | * | * | cis | -145 | -177.3 | 41.3 | 39.3 | -18.9 | 0 | 0 | 0 | 117.6 | ||||
| 416 | S | 28.1 | Very low | 32.8 | Very low | 118 Ų | 118 | 131.8 Ų | 131.8 | 83% | 0.825 | 82% | 0.819 | S | S | * | * | trans | 59.2 | 130.7 | 146.7 | 59.8 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 417 | G | 29.1 | Very low | 32.3 | Very low | 77 Ų | 77 | 128 Ų | 128 | 79% | 0.794 | 82% | 0.818 | S | S | * | * | trans | 166.1 | 97.8 | 159.9 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 418 | L | 33.8 | Very low | 31.9 | Very low | 168 Ų | 168 | 124.5 Ų | 124.5 | 88% | 0.88 | 81% | 0.81 | S | S | * | * | trans | 28 | 105.4 | 148.9 | -65.5 | 164.3 | 0 | 0 | 0 | 122.1 | ||||
| 419 | E | 26.4 | Very low | 31.9 | Very low | 175 Ų | 175 | 128 Ų | 128 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | 17.2 | 121.7 | 113.4 | -166.3 | 171.4 | 158.6 | 0 | 0 | 120.8 | |||||
| 420 | A | 28.2 | Very low | 31.8 | Very low | 89 Ų | 89 | 132 Ų | 132 | 74% | 0.736 | 80% | 0.804 | S | S | * | * | trans | -169.2 | 119.6 | 149.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 421 | H | 27 | Very low | 31.7 | Very low | 181 Ų | 181 | 136.6 Ų | 136.6 | 84% | 0.838 | 80% | 0.799 | S | S | * | * | trans | 26.6 | 131.6 | 146.4 | -51.8 | -68.7 | 0 | 0 | 0 | 125 | ||||
| 422 | L | 33.3 | Very low | 32.3 | Very low | 165 Ų | 165 | 142 Ų | 142 | 86% | 0.864 | 81% | 0.805 | S | S | * | * | trans | -75.6 | 160.8 | 148.7 | -63.7 | 168.5 | 0 | 0 | 0 | 110.9 | ||||
| 423 | P | 38.6 | Very low | 32.6 | Very low | 134 Ų | 134 | 143.6 Ų | 143.6 | 87% | 0.87 | 81% | 0.808 | S | S | * | * | -142.7 | -170.6 | 99.8 | 37.8 | -22.1 | 0 | 0 | 0 | 115 | |||||
| 424 | S | 28.5 | Very low | 32.5 | Very low | 119 Ų | 119 | 136 Ų | 136 | 83% | 0.832 | 80% | 0.804 | S | S | * | * | trans | -121.3 | -163.4 | -166.9 | -172.2 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 425 | S | 27.4 | Very low | 32.6 | Very low | 109 Ų | 109 | 140.9 Ų | 140.9 | 76% | 0.762 | 81% | 0.812 | S | S | * | * | trans | 79.4 | 152.5 | 178.7 | -120.4 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 426 | T | 29.8 | Very low | 31.8 | Very low | 127 Ų | 127 | 139.1 Ų | 139.1 | 78% | 0.779 | 81% | 0.808 | S | S | * | * | cis | -131.9 | 158 | 1.2 | 36.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 427 | A | 32 | Very low | 31.9 | Very low | 98 Ų | 98 | 142 Ų | 142 | 81% | 0.81 | 81% | 0.808 | S | S | * | * | cis | 94.4 | 119.2 | 29.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 428 | G | 30.1 | Very low | 31.8 | Very low | 68 Ų | 68 | 145.7 Ų | 145.7 | 70% | 0.701 | 80% | 0.804 | S | S | * | * | trans | -175.7 | 109.4 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 429 | Q | 36 | Very low | 31.7 | Very low | 172 Ų | 172 | 146.1 Ų | 146.1 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | 80.1 | 142 | 79.6 | -75.7 | -166.3 | 28.5 | 0 | 0 | 113.4 | |||||
| 430 | R | 33.1 | Very low | 31.8 | Very low | 184 Ų | 184 | 145.3 Ų | 145.3 | 69% | 0.694 | 79% | 0.791 | S | S | * | * | cis | -167.5 | 169.8 | 16 | -138.6 | 176.5 | -176.9 | -94.6 | 7 | 114.7 | ||||
| 431 | R | 33.2 | Very low | 31.9 | Very low | 202 Ų | 202 | 144.6 Ų | 144.6 | 76% | 0.762 | 79% | 0.792 | S | S | * | * | trans | 73.6 | 131.8 | 161.7 | -60.2 | 163.9 | -168.9 | -118.8 | 5 | 116 | ||||
| 432 | K | 44.3 | Very low | 32 | Very low | 203 Ų | 203 | 140.7 Ų | 140.7 | 88% | 0.883 | 79% | 0.791 | S | S | * | * | cis | 75.9 | 115.4 | 5.6 | -79.8 | -163 | 175.8 | -170.9 | 0 | 121.2 | ||||
| 433 | Q | 36.9 | Very low | 31.9 | Very low | 203 Ų | 203 | 137.3 Ų | 137.3 | 95% | 0.949 | 79% | 0.786 | S | S | * | * | trans | 174.9 | 153.7 | 134.2 | -96.2 | 164.1 | -23.7 | 0 | 0 | 107.8 | ||||
| 434 | G | 30.5 | Very low | 32.9 | Very low | 76 Ų | 76 | 136.7 Ų | 136.7 | 78% | 0.784 | 78% | 0.783 | S | S | * | * | cis | 179.4 | -176.5 | -2.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 435 | L | 31.2 | Very low | 32.9 | Very low | 170 Ų | 170 | 135.7 Ų | 135.7 | 89% | 0.89 | 78% | 0.782 | S | S | * | * | cis | -172.1 | 155.2 | -14.9 | -174.6 | 65.1 | 0 | 0 | 0 | 109.3 | ||||
| 436 | A | 30.1 | Very low | 32.8 | Very low | 84 Ų | 84 | 135.3 Ų | 135.3 | 69% | 0.694 | 79% | 0.785 | S | S | * | * | trans | 69.6 | 159.5 | 164.9 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 437 | Q | 30.2 | Very low | 32.9 | Very low | 178 Ų | 178 | 133.5 Ų | 133.5 | 83% | 0.832 | 78% | 0.783 | S | S | * | * | cis | -162.1 | 152.3 | -21.3 | -113.2 | -179.1 | 4.8 | 0 | 0 | 112.5 | ||||
| 438 | H | 26.9 | Very low | 33.7 | Very low | 154 Ų | 154 | 134.9 Ų | 134.9 | 71% | 0.713 | 78% | 0.783 | S | S | * | * | trans | 59.7 | 123.9 | 149.1 | -106.1 | -146.2 | 0 | 0 | 0 | 125.5 | ||||
| 439 | R | 32.3 | Very low | 33.7 | Very low | 178 Ų | 178 | 136.6 Ų | 136.6 | 67% | 0.672 | 79% | 0.785 | S | S | * | * | trans | 67.5 | 145.6 | 134.4 | -76 | -171.7 | 93.1 | 93.3 | 2 | 120.4 | ||||
| 440 | E | 27.7 | Very low | 33.4 | Very low | 158 Ų | 158 | 137.1 Ų | 137.1 | 74% | 0.738 | 79% | 0.785 | S | S | * | * | cis | -120.2 | -122.9 | -10.9 | -63.3 | -152.1 | -152.5 | 0 | 0 | 111.8 | ||||
| 441 | G | 31.1 | Very low | 33.2 | Very low | 73 Ų | 73 | 131.7 Ų | 131.7 | 75% | 0.753 | 78% | 0.775 | S | S | * | * | cis | 142.3 | 143.8 | -1.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 442 | A | 28.8 | Very low | 33 | Very low | 99 Ų | 99 | 128.4 Ų | 128.4 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | cis | -143.5 | 133.6 | -4.9 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 443 | A | 31.8 | Very low | 32.5 | Very low | 94 Ų | 94 | 127 Ų | 127 | 78% | 0.777 | 76% | 0.758 | S | S | * | * | 99.4 | 157.1 | 84.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 444 | P | 58.3 | Low | 32 | Very low | 122 Ų | 122 | 124.5 Ų | 124.5 | 79% | 0.792 | 75% | 0.746 | S | S | * | * | -145.8 | -153.9 | -109.9 | 41.7 | -18.4 | 0 | 0 | 0 | 116.4 | |||||
| 445 | A | 28.4 | Very low | 32 | Very low | 98 Ų | 98 | 128.7 Ų | 128.7 | 81% | 0.81 | 75% | 0.749 | S | S | * | * | trans | 90.4 | 150.4 | 164 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 446 | A | 25.7 | Very low | 32.7 | Very low | 100 Ų | 100 | 125.4 Ų | 125.4 | 83% | 0.826 | 74% | 0.739 | S | S | * | * | cis | -144.9 | 165.5 | 8 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 447 | A | 31.8 | Very low | 32.8 | Very low | 90 Ų | 90 | 130.3 Ų | 130.3 | 74% | 0.744 | 75% | 0.747 | S | S | * | * | trans | -121.9 | 172.7 | 156.5 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 448 | P | 49.2 | Very low | 33.6 | Very low | 126 Ų | 126 | 127.3 Ų | 127.3 | 82% | 0.818 | 74% | 0.743 | S | S | * | * | -160.3 | -158.3 | 84.2 | 43.6 | -22.1 | 0 | 0 | 0 | 115.8 | |||||
| 449 | S | 31.1 | Very low | 34.8 | Very low | 105 Ų | 105 | 125.2 Ų | 125.2 | 73% | 0.734 | 74% | 0.743 | S | S | * | * | trans | 86.1 | 133.4 | 164.6 | -136.5 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 450 | F | 28.7 | Very low | 35.9 | Very low | 183 Ų | 183 | 121.7 Ų | 121.7 | 80% | 0.803 | 74% | 0.743 | S | S | * | * | cis | -169.7 | 162.6 | -2.6 | -132.5 | -144.9 | 0 | 0 | 0 | 107.6 | ||||
| 451 | S | 29.8 | Very low | 36.1 | Very low | 70 Ų | 70 | 121.6 Ų | 121.6 | 49% | 0.49 | 75% | 0.747 | S | S | . | * | cis | -160.9 | 178.2 | -19.1 | -153.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 452 | E | 28.6 | Very low | 36 | Very low | 133 Ų | 133 | 126 Ų | 126 | 62% | 0.621 | 75% | 0.753 | S | S | * | * | trans | 27 | 150.3 | 141 | -71.9 | 173.1 | 102.9 | 0 | 0 | 123.7 | ||||
| 453 | R | 33.5 | Very low | 36.1 | Very low | 173 Ų | 173 | 126.6 Ų | 126.6 | 65% | 0.653 | 75% | 0.751 | S | S | * | * | cis | -163.9 | 145.2 | 5.4 | -133.9 | 175 | 154.5 | 105.7 | 11 | 116.3 | ||||
| 454 | E | 26.3 | Very low | 36.7 | Very low | 151 Ų | 151 | 127.4 Ų | 127.4 | 71% | 0.706 | 75% | 0.748 | S | S | * | * | trans | 61.8 | -178.1 | 140.2 | -82 | 163.9 | -166.4 | 0 | 0 | 125.1 | ||||
| 455 | L | 30.2 | Very low | 35.5 | Very low | 163 Ų | 163 | 129.5 Ų | 129.5 | 85% | 0.853 | 75% | 0.747 | S | S | * | * | trans | -144.2 | -163.1 | -146.4 | -132.8 | 66.5 | 0 | 0 | 0 | 109.9 | ||||
| 456 | P | 47.1 | Very low | 35.6 | Very low | 102 Ų | 102 | 132 Ų | 132 | 66% | 0.662 | 75% | 0.747 | S | S | * | * | cis | -138.5 | 161.1 | -23.3 | 39.3 | -20.8 | 0 | 0 | 0 | 118.2 | ||||
| 457 | Q | 32.2 | Very low | 35.7 | Very low | 186 Ų | 186 | 131.7 Ų | 131.7 | 87% | 0.869 | 74% | 0.744 | S | S | * | * | trans | 40.6 | 162 | 140.1 | -77.4 | -170.9 | -8.4 | 0 | 0 | 125.7 | ||||
| 458 | P | 46.3 | Very low | 36.4 | Very low | 115 Ų | 115 | 132.1 Ų | 132.1 | 75% | 0.747 | 74% | 0.739 | S | S | * | * | cis | -130.6 | -95.1 | -11.4 | 25.5 | 2.6 | 0 | 0 | 0 | 119 | ||||
| 459 | P | 52.8 | Low | 35.5 | Very low | 110 Ų | 110 | 134.8 Ų | 134.8 | 71% | 0.714 | 74% | 0.74 | S | S | * | * | trans | -134.1 | -140.2 | -154.3 | 42.5 | -16.3 | 0 | 0 | 0 | 113.7 | ||||
| 460 | P | 55.4 | Low | 35.9 | Very low | 105 Ų | 105 | 136.4 Ų | 136.4 | 68% | 0.682 | 75% | 0.746 | S | S | * | * | cis | -140.2 | -168.9 | -18.6 | 36.6 | -13.3 | 0 | 0 | 0 | 117.4 | ||||
| 461 | L | 30.7 | Very low | 35.9 | Very low | 155 Ų | 155 | 132.3 Ų | 132.3 | 81% | 0.812 | 75% | 0.746 | S | S | * | * | trans | 74.1 | 117 | 157.7 | -60.8 | -177 | 0 | 0 | 0 | 124.1 | ||||
| 462 | L | 29.9 | Very low | 35.9 | Very low | 167 Ų | 167 | 137.2 Ų | 137.2 | 87% | 0.874 | 77% | 0.766 | S | S | * | * | 160.8 | 158.8 | 113.6 | -85.8 | -176.6 | 0 | 0 | 0 | 114.1 | |||||
| 463 | S | 30.2 | Very low | 35.9 | Very low | 111 Ų | 111 | 134.4 Ų | 134.4 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | trans | -140.6 | 162.2 | 175.7 | -48.4 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 464 | P | 44.2 | Very low | 36.2 | Very low | 111 Ų | 111 | 131 Ų | 131 | 72% | 0.721 | 77% | 0.773 | S | S | * | * | -157.9 | 161.4 | 89.5 | 40.6 | -21 | 0 | 0 | 0 | 119.7 | |||||
| 465 | Q | 34.4 | Very low | 36.5 | Very low | 166 Ų | 166 | 132 Ų | 132 | 78% | 0.776 | 78% | 0.777 | S | S | * | * | trans | 78.2 | 136.6 | 143 | -83.8 | 179.4 | 65.9 | 0 | 0 | 124.9 | ||||
| 466 | N | 28.5 | Very low | 36.6 | Very low | 151 Ų | 151 | 131.2 Ų | 131.2 | 81% | 0.807 | 77% | 0.773 | S | S | * | * | trans | 85.1 | 141.6 | 154.8 | -61.2 | -26.8 | 0 | 0 | 0 | 121.5 | ||||
| 467 | A | 28.9 | Very low | 35.8 | Very low | 93 Ų | 93 | 136.7 Ų | 136.7 | 77% | 0.769 | 78% | 0.78 | S | S | * | * | trans | -147.6 | -169.5 | -172.2 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 468 | P | 46.2 | Very low | 36.2 | Very low | 98 Ų | 98 | 133.3 Ų | 133.3 | 64% | 0.636 | 77% | 0.774 | S | S | * | * | cis | -144.4 | -176.1 | 7.5 | 35.7 | -11.3 | 0 | 0 | 0 | 118 | ||||
| 469 | H | 30.7 | Very low | 36.3 | Very low | 182 Ų | 182 | 133.9 Ų | 133.9 | 84% | 0.843 | 78% | 0.778 | S | S | * | * | trans | 78.9 | 167.8 | 158.4 | -56.2 | -45.1 | 0 | 0 | 0 | 120.8 | ||||
| 470 | V | 40 | Very low | 35.3 | Very low | 139 Ų | 139 | 137.8 Ų | 137.8 | 84% | 0.842 | 78% | 0.784 | S | S | * | * | trans | -133 | 150.4 | -157.5 | 175.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 471 | A | 28.3 | Very low | 34.7 | Very low | 98 Ų | 98 | 140.9 Ų | 140.9 | 81% | 0.81 | 79% | 0.794 | S | S | * | * | trans | -144.8 | 160.7 | 168.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 472 | L | 29.4 | Very low | 34.7 | Very low | 173 Ų | 173 | 137.2 Ų | 137.2 | 91% | 0.906 | 79% | 0.794 | S | S | * | * | trans | -121.2 | 131.1 | -174.5 | -80.7 | 167.6 | 0 | 0 | 0 | 113.5 | ||||
| 473 | G | 27.6 | Very low | 35.2 | Very low | 73 Ų | 73 | 135.5 Ų | 135.5 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | trans | 70.2 | -173.7 | 158.9 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 474 | P | 40.3 | Very low | 35.6 | Very low | 103 Ų | 103 | 136.2 Ų | 136.2 | 67% | 0.669 | 79% | 0.792 | S | S | * | * | cis | -140.1 | 175 | -8.4 | 43.9 | -28 | 0 | 0 | 0 | 116.1 | ||||
| 475 | H | 33.6 | Very low | 35.5 | Very low | 172 Ų | 172 | 136.4 Ų | 136.4 | 80% | 0.796 | 80% | 0.796 | S | S | * | * | trans | 52.7 | 125.3 | 156.7 | -48.6 | -48.7 | 0 | 0 | 0 | 122.2 | ||||
| 476 | L | 32.7 | Very low | 36 | Very low | 145 Ų | 145 | 132.9 Ų | 132.9 | 76% | 0.759 | 80% | 0.795 | S | S | * | * | -180 | 132.6 | 103.7 | -96.5 | 170.2 | 0 | 0 | 0 | 115.1 | |||||
| 477 | R | 28.7 | Very low | 36.2 | Very low | 218 Ų | 218 | 134 Ų | 134 | 82% | 0.823 | 80% | 0.8 | S | S | * | * | trans | 72 | 150.2 | 162.9 | -68.6 | -170.3 | 175.5 | 84.5 | 2.7 | 120.7 | ||||
| 478 | P | 41.4 | Very low | 36.4 | Very low | 114 Ų | 114 | 135.8 Ų | 135.8 | 74% | 0.74 | 81% | 0.806 | S | S | * | * | trans | -108.6 | 174.8 | -176.3 | 42.9 | -36.1 | 0 | 0 | 0 | 114.4 | ||||
| 479 | P | 47.7 | Very low | 36 | Very low | 127 Ų | 127 | 140 Ų | 140 | 83% | 0.825 | 82% | 0.817 | S | S | * | * | trans | -133.3 | -168.7 | 137.1 | 39.5 | -27.9 | 0 | 0 | 0 | 114 | ||||
| 480 | F | 31.5 | Very low | 36.1 | Very low | 192 Ų | 192 | 137.9 Ų | 137.9 | 84% | 0.842 | 82% | 0.817 | S | S | * | * | trans | -86.3 | 159.1 | -165.9 | -77.5 | -107.3 | 0 | 0 | 0 | 115.9 | ||||
| 481 | L | 44 | Very low | 36.3 | Very low | 170 Ų | 170 | 137.7 Ų | 137.7 | 89% | 0.89 | 82% | 0.818 | S | S | * | * | trans | 50.7 | 118.4 | 145.1 | -66.6 | 167.4 | 0 | 0 | 0 | 120.3 | ||||
| 482 | G | 29.9 | Very low | 37 | Very low | 79 Ų | 79 | 136.4 Ų | 136.4 | 81% | 0.814 | 82% | 0.815 | S | S | * | * | trans | 179.9 | 123.8 | 160.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 483 | V | 40.3 | Very low | 37.6 | Very low | 130 Ų | 130 | 139.4 Ų | 139.4 | 79% | 0.788 | 82% | 0.816 | S | S | * | * | trans | -100.6 | 151.8 | 170.9 | -138.9 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 484 | P | 39 | Very low | 38.2 | Very low | 126 Ų | 126 | 139.2 Ų | 139.2 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | -143.3 | 162.7 | 89.5 | 38.2 | -23.3 | 0 | 0 | 0 | 114.9 | |||||
| 485 | S | 42.7 | Very low | 38.4 | Very low | 116 Ų | 116 | 144 Ų | 144 | 81% | 0.811 | 82% | 0.824 | S | S | * | * | trans | -87.4 | 127.9 | 178.7 | -54.9 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 486 | A | 44.3 | Very low | 39.4 | Very low | 91 Ų | 91 | 140.4 Ų | 140.4 | 75% | 0.752 | 81% | 0.81 | S | S | * | * | trans | -155.9 | 166.7 | 161.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 487 | L | 32.3 | Very low | 40.9 | Very low | 174 Ų | 174 | 137 Ų | 137 | 91% | 0.911 | 80% | 0.797 | S | S | * | * | trans | 71.3 | 43.1 | 175.6 | -52.9 | -179.8 | 0 | 0 | 0 | 117.7 | Q489 | L487-Q489 PolarHBondContact O-N 3.14Š| ||
| 488 | C | 33.7 | Very low | 42.4 | Very low | 132 Ų | 132 | 131 Ų | 131 | 89% | 0.892 | 79% | 0.786 | S | S | * | * | trans | -81 | 81.4 | 153.5 | -67.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 489 | Q | 38.8 | Very low | 43.4 | Very low | 186 Ų | 186 | 128.3 Ų | 128.3 | 87% | 0.869 | 77% | 0.774 | S | S | * | * | trans | -143.8 | 80.4 | 162.4 | -74.7 | -157.7 | 30.6 | 0 | 0 | 112.2 | L487 | L487-Q489 PolarHBondContact O-N 3.14Š| ||
| 490 | T | 32 | Very low | 44.1 | Very low | 137 Ų | 137 | 127 Ų | 127 | 84% | 0.84 | 76% | 0.757 | S | S | * | * | trans | -128.7 | 124.9 | 154.7 | 37.8 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 491 | P | 45.1 | Very low | 46 | Very low | 135 Ų | 135 | 120.3 Ų | 120.3 | 88% | 0.877 | 74% | 0.736 | S | S | * | * | trans | -82.9 | 143.5 | -174.8 | 32.4 | -34.3 | 0 | 0 | 0 | 111.7 | ||||
| 492 | G | 43 | Very low | 47.5 | Very low | 71 Ų | 71 | 118 Ų | 118 | 73% | 0.732 | 72% | 0.721 | S | S | * | * | trans | 104.2 | 60.6 | 162.9 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 493 | Y | 41.1 | Very low | 49.4 | Very low | 237 Ų | 237 | 120 Ų | 120 | 93% | 0.929 | 71% | 0.71 | S | S | * | * | trans | -133.8 | 127 | 142.7 | -111.6 | -87.3 | 0 | 0 | 0 | 109.4 | ||||
| 494 | G | 40.4 | Very low | 51.2 | Low | 68 Ų | 68 | 119.3 Ų | 119.3 | 70% | 0.701 | 70% | 0.697 | S | S | * | * | trans | -73 | 134.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | L496 | G494-L496 PolarHBondContact O-N 3.4Å; G494-L496 VanDerWaalsContact O-N 3.16Å | ||
| 495 | F | 44.8 | Very low | 53.3 | Low | 203 Ų | 203 | 116 Ų | 116 | 89% | 0.89 | 68% | 0.68 | S | S | * | * | trans | -70.4 | 108.3 | 172.4 | -154.4 | -86.2 | 0 | 0 | 0 | 108.3 | ||||
| 496 | L | 53.8 | Low | 55.3 | Low | 98 Ų | 98 | 119.1 Ų | 119.1 | 51% | 0.513 | 67% | 0.674 | S | S | . | * | trans | -61.7 | 134 | 176.1 | -73.4 | 172 | 0 | 0 | 0 | 109.4 | G494 Q500 | G494-L496 PolarHBondContact O-N 3.4Å; G494-L496 VanDerWaalsContact O-N 3.16Å; L496-Q500 HydrophobicContact CB-CB 4.38Å; L496-Q500 HydrophobicContact CD2-CB 4.41Å | ||
| 497 | P | 64.5 | Low | 57.4 | Low | 74 Ų | 74 | 121 Ų | 121 | 48% | 0.481 | 67% | 0.667 | S | S | . | * | trans | -54.9 | 145.5 | 171.8 | -25.6 | 34.8 | 0 | 0 | 0 | 111 | A499 Q500 A501 | P497-A499 VanDerWaalsContact C-N 3.27Å; P497-A499 PolarHBondContact O-N 3.3Å; P497-A499 VanDerWaalsContact O-N 3.08Å; P497-Q500 PolarHBondContact O-N 3.36Å; P497-A501 PolarHBondContact O-N 3.03Å | ||
| 498 | P | 60.5 | Low | 60 | Low | 90 Ų | 90 | 118.3 Ų | 118.3 | 58% | 0.584 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -49.5 | -42.8 | -172.9 | -31.5 | 36.1 | 0 | 0 | 0 | 114.5 | Q500 A501 E502 | P498-Q500 VanDerWaalsContact C-N 3.29Å; P498-Q500 PolarHBondContact O-N 2.84Å; P498-A501 WeakPolarHBondContact O-CB 3.39Å; P498-A501 PolarHBondContact O-N 3.03Å; P498-A501 VanDerWaalsContact O-N 3.08Å; P498-E502 WeakPolarHBondContact O-CG 3.27Å; P498-E502 PolarHBondContact O-N 2.65Å |
| 499 | A | 62.7 | Low | 62.6 | Low | 59 Ų | 59 | 114.7 Ų | 114.7 | 49% | 0.488 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -60 | -31 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | P497 M503 | P497-A499 VanDerWaalsContact C-N 3.27Å; P497-A499 PolarHBondContact O-N 3.3Å; P497-A499 VanDerWaalsContact O-N 3.08Å; A499-M503 WeakPolarHBondContact O-CE 3.23Å; A499-M503 WeakPolarHBondContact O-CG 3.2Å; A499-M503 PolarHBondContact O-N 3.12Å |
| 500 | Q | 61 | Low | 65.2 | Low | 100 Ų | 100 | 111.4 Ų | 111.4 | 47% | 0.467 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -77.9 | -35 | 174.2 | -86 | -177.2 | -28.5 | 0 | 0 | 112.3 | L496 P497 P498 E502 M503 F504 | L496-Q500 HydrophobicContact CB-CB 4.38Å; L496-Q500 HydrophobicContact CD2-CB 4.41Å; P497-Q500 PolarHBondContact O-N 3.36Å; P498-Q500 VanDerWaalsContact C-N 3.29Å; P498-Q500 PolarHBondContact O-N 2.84Å; Q500-E502 VanDerWaalsContact C-N 3.34Å; Q500-M503 HydrophobicContact CG-CE 3.93Å; Q500-F504 WeakPolarHBondContact O-CB 3.41Å; Q500-F504 PolarHBondContact O-N 3.33Å |
| 501 | A | 72.2 | Confident | 67.9 | Low | 50 Ų | 50 | 109.6 Ų | 109.6 | 41% | 0.413 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -64.8 | -40.4 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | P497 P498 F504 A505 | P497-A501 PolarHBondContact O-N 3.03Å; P498-A501 WeakPolarHBondContact O-CB 3.39Å; P498-A501 PolarHBondContact O-N 3.03Å; P498-A501 VanDerWaalsContact O-N 3.08Å; A501-F504 PolarHBondContact O-N 2.95Å; A501-A505 WeakPolarHBondContact O-CB 3.37Å; A501-A505 PolarHBondContact O-N 2.96Å |
| 502 | E | 75.7 | Confident | 70 | Confident | 122 Ų | 122 | 109.8 Ų | 109.8 | 57% | 0.57 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -63.7 | -45.9 | 174.7 | -73.9 | 170.9 | -157.2 | 0 | 0 | 112.3 | P498 Q500 F504 A505 W506 | P498-E502 WeakPolarHBondContact O-CG 3.27Å; P498-E502 PolarHBondContact O-N 2.65Å; Q500-E502 VanDerWaalsContact C-N 3.34Å; E502-F504 VanDerWaalsContact C-N 3.33Å; E502-F504 PolarHBondContact O-N 3.22Å; E502-A505 PolarHBondContact O-N 2.96Å; E502-W506 WeakPolarHBondContact O-CB 3.27Å; E502-W506 PolarHBondContact O-N 2.98Å |
| 503 | M | 69.3 | Low | 72.2 | Confident | 120 Ų | 120 | 111.1 Ų | 111.1 | 59% | 0.591 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -60.6 | -40.6 | 174.7 | -78.1 | -172.5 | -71 | 0 | 0 | 112.3 | A499 Q500 W506 Q507 | A499-M503 WeakPolarHBondContact O-CE 3.23Å; A499-M503 WeakPolarHBondContact O-CG 3.2Å; A499-M503 PolarHBondContact O-N 3.12Å; Q500-M503 HydrophobicContact CG-CE 3.93Å; M503-W506 PolarHBondContact O-N 2.91Å; M503-Q507 WeakPolarHBondContact O-CB 3.37Å; M503-Q507 PolarHBondContact O-N 3.42Å |
| 504 | F | 77.4 | Confident | 74.2 | Confident | 117 Ų | 117 | 105.5 Ų | 105.5 | 51% | 0.513 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -69.1 | -38.2 | 177.5 | -167.3 | -104.9 | 0 | 0 | 0 | 112.3 | Q500 A501 E502 Q507 Q508 | Q500-F504 WeakPolarHBondContact O-CB 3.41Å; Q500-F504 PolarHBondContact O-N 3.33Å; A501-F504 PolarHBondContact O-N 2.95Å; E502-F504 VanDerWaalsContact C-N 3.33Å; E502-F504 PolarHBondContact O-N 3.22Å; F504-Q507 PolarHBondContact O-N 3.42Å; F504-Q508 HydrophobicContact CD1-CG 4.46Å; F504-Q508 HydrophobicContact CE1-CG 4.22Å; F504-Q508 VanDerWaalsContact CE1-NE2 3.27Å; F504-Q508 WeakPolarHBondContact O-CG 3.32Å; F504-Q508 PolarHBondContact O-N 2.9Å |
| 505 | A | 84.9 | Confident | 76.2 | Confident | 55 Ų | 55 | 105.3 Ų | 105.3 | 46% | 0.455 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.6 | -41.8 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112 | A501 E502 Q508 E509 | A501-A505 WeakPolarHBondContact O-CB 3.37Å; A501-A505 PolarHBondContact O-N 2.96Å; E502-A505 PolarHBondContact O-N 2.96Å; A505-Q508 PolarHBondContact O-N 2.78Å; A505-E509 PolarHBondContact O-N 3.39Å |
| 506 | W | 83.9 | Confident | 77.9 | Confident | 183 Ų | 183 | 99.4 Ų | 99.4 | 69% | 0.693 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.2 | -42.3 | 172 | -94.1 | 105.1 | 0 | 0 | 0 | 112.4 | E502 M503 E509 L510 | E502-W506 WeakPolarHBondContact O-CB 3.27Å; E502-W506 PolarHBondContact O-N 2.98Å; M503-W506 PolarHBondContact O-N 2.91Å; W506-E509 PolarHBondContact O-N 3.13Å; W506-L510 VanDerWaalsContact O-CB 3.28Å; W506-L510 WeakPolarHBondContact O-CB 3.38Å; W506-L510 PolarHBondContact O-N 3.16Å |
| 507 | Q | 87.7 | Confident | 78.7 | Confident | 129 Ų | 129 | 97.2 Ų | 97.2 | 60% | 0.603 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.5 | -40.6 | 176.1 | -174.5 | 177.4 | -11 | 0 | 0 | 111.8 | M503 F504 L511 | M503-Q507 WeakPolarHBondContact O-CB 3.37Å; M503-Q507 PolarHBondContact O-N 3.42Å; F504-Q507 PolarHBondContact O-N 3.42Å; Q507-L511 WeakPolarHBondContact O-CB 3.22Å; Q507-L511 PolarHBondContact O-N 3.17Å |
| 508 | Q | 87.8 | Confident | 78.9 | Confident | 118 Ų | 118 | 101.8 Ų | 101.8 | 55% | 0.551 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -66.8 | -42.5 | 174.3 | -73 | -165.1 | -13.2 | 0 | 0 | 112.6 | F504 A505 L511 R512 | F504-Q508 HydrophobicContact CD1-CG 4.46Å; F504-Q508 HydrophobicContact CE1-CG 4.22Å; F504-Q508 VanDerWaalsContact CE1-NE2 3.27Å; F504-Q508 WeakPolarHBondContact O-CG 3.32Å; F504-Q508 PolarHBondContact O-N 2.9Å; A505-Q508 PolarHBondContact O-N 2.78Å; Q508-L511 PolarHBondContact O-N 3.02Å; Q508-R512 WeakPolarHBondContact O-CB 3.48Å; Q508-R512 PolarHBondContact O-N 2.98Å |
| 509 | E | 88.4 | Confident | 79.3 | Confident | 56 Ų | 56 | 103.6 Ų | 103.6 | 26% | 0.262 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68.3 | -35 | 177 | 177.3 | 58.2 | -167.8 | 0 | 0 | 112.2 | A505 W506 R512 K513 | A505-E509 PolarHBondContact O-N 3.39Å; W506-E509 PolarHBondContact O-N 3.13Å; E509-R512 VanDerWaalsContact CD-NH2 3.32Å; E509-R512 PolarHBondContact O-N 2.89Å; E509-R512 IonicContact OE1-CZ 3.04Å; E509-R512 IonicContact OE1-NE 2.67Å; E509-R512 IonicContact OE1-NH2 2.72Å; E509-R512 PolarHBondContact OE1-NH2 3.02Å; E509-R512 IonicContact OE2-CZ 3.65Å; E509-R512 VanDerWaalsContact OE2-CZ 3.3Å; E509-R512 IonicContact OE2-NE 3.74Å; E509-R512 PolarHBondContact OE2-NE 2.85Å; E509-R512 IonicContact OE2-NH2 3.8Å; E509-R512 PolarHBondContact OE2-NH2 2.86Å; E509-K513 HydrophobicContact CG-CD 4.25Å; E509-K513 WeakPolarHBondContact O-CB 3.19Å; E509-K513 WeakPolarHBondContact O-CG 3.5Å; E509-K513 PolarHBondContact O-N 2.79Å; E509-K513 WeakPolarHBondContact OE1-CE 3.45Å; E509-K513 IonicContact OE1-NZ 3.42Å; E509-K513 PolarHBondContact OE1-NZ 3.31Å |
| 510 | L | 92.1 | Very high | 79.5 | Confident | 118 Ų | 118 | 105.7 Ų | 105.7 | 62% | 0.618 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.4 | -43.9 | 172.9 | -176.2 | 63.6 | 0 | 0 | 0 | 111.3 | W506 R512 K513 Q514 | W506-L510 VanDerWaalsContact O-CB 3.28Å; W506-L510 WeakPolarHBondContact O-CB 3.38Å; W506-L510 PolarHBondContact O-N 3.16Å; L510-R512 VanDerWaalsContact C-N 3.33Å; L510-R512 PolarHBondContact O-N 2.71Å; L510-K513 PolarHBondContact O-N 2.69Å; L510-Q514 WeakPolarHBondContact O-CB 3.33Å; L510-Q514 PolarHBondContact O-N 3.32Å |
| 511 | L | 89.9 | Confident | 79.6 | Confident | 99 Ų | 99 | 107 Ų | 107 | 52% | 0.518 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.7 | -36.7 | 174.5 | -174.4 | 63.1 | 0 | 0 | 0 | 111.7 | Q507 Q508 Q514 N515 | Q507-L511 WeakPolarHBondContact O-CB 3.22Å; Q507-L511 PolarHBondContact O-N 3.17Å; Q508-L511 PolarHBondContact O-N 3.02Å; L511-Q514 PolarHBondContact O-N 3Å; L511-N515 PolarHBondContact O-N 3.31Å; L511-N515 PolarHBondContact O-ND2 3.15Å |
| 512 | R | 89.5 | Confident | 79.3 | Confident | 138 Ų | 138 | 107.6 Ų | 107.6 | 52% | 0.521 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.1 | -43.5 | 174.3 | -162.7 | -175.2 | 69.2 | 79 | 7.3 | 111.4 | Q508 E509 L510 N515 L516 | Q508-R512 WeakPolarHBondContact O-CB 3.48Å; Q508-R512 PolarHBondContact O-N 2.98Å; E509-R512 VanDerWaalsContact CD-NH2 3.32Å; E509-R512 PolarHBondContact O-N 2.89Å; E509-R512 IonicContact OE1-CZ 3.04Å; E509-R512 IonicContact OE1-NE 2.67Å; E509-R512 IonicContact OE1-NH2 2.72Å; E509-R512 PolarHBondContact OE1-NH2 3.02Å; E509-R512 IonicContact OE2-CZ 3.65Å; E509-R512 VanDerWaalsContact OE2-CZ 3.3Å; E509-R512 IonicContact OE2-NE 3.74Å; E509-R512 PolarHBondContact OE2-NE 2.85Å; E509-R512 IonicContact OE2-NH2 3.8Å; E509-R512 PolarHBondContact OE2-NH2 2.86Å; L510-R512 VanDerWaalsContact C-N 3.33Å; L510-R512 PolarHBondContact O-N 2.71Å; R512-N515 PolarHBondContact O-N 2.77Å; R512-L516 PolarHBondContact O-N 3.44Å |
| 513 | K | 88 | Confident | 78.6 | Confident | 100 Ų | 100 | 104.1 Ų | 104.1 | 44% | 0.435 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.9 | -43 | 174.5 | -78 | 166.6 | 171.4 | 153.3 | 0 | 112.7 | E509 L510 N515 L516 A517 | E509-K513 HydrophobicContact CG-CD 4.25Å; E509-K513 WeakPolarHBondContact O-CB 3.19Å; E509-K513 WeakPolarHBondContact O-CG 3.5Å; E509-K513 PolarHBondContact O-N 2.79Å; E509-K513 WeakPolarHBondContact OE1-CE 3.45Å; E509-K513 IonicContact OE1-NZ 3.42Å; E509-K513 PolarHBondContact OE1-NZ 3.31Å; L510-K513 PolarHBondContact O-N 2.69Å; K513-N515 VanDerWaalsContact C-N 3.33Å; K513-N515 PolarHBondContact O-N 3.35Å; K513-L516 WeakPolarHBondContact O-CB 3.43Å; K513-L516 PolarHBondContact O-N 3.41Å; K513-A517 PolarHBondContact O-N 2.91Å |
| 514 | Q | 84.3 | Confident | 78.3 | Confident | 118 Ų | 118 | 103 Ų | 103 | 55% | 0.551 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.4 | -42.2 | 175.9 | -172.1 | -172.9 | 86 | 0 | 0 | 111.5 | L510 L511 R518 | L510-Q514 WeakPolarHBondContact O-CB 3.33Å; L510-Q514 PolarHBondContact O-N 3.32Å; L511-Q514 PolarHBondContact O-N 3Å; Q514-R518 WeakPolarHBondContact O-CG 3.42Å; Q514-R518 PolarHBondContact O-N 3.28Å; Q514-R518 VanDerWaalsContact O-N 3.14Å |
| 515 | N | 81.5 | Confident | 77.6 | Confident | 64 Ų | 64 | 102.8 Ų | 102.8 | 34% | 0.342 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -70.3 | -31.1 | 175.8 | -75.1 | -65.5 | 0 | 0 | 0 | 112.9 | L511 R512 K513 L519 | L511-N515 PolarHBondContact O-N 3.31Å; L511-N515 PolarHBondContact O-ND2 3.15Å; R512-N515 PolarHBondContact O-N 2.77Å; K513-N515 VanDerWaalsContact C-N 3.33Å; K513-N515 PolarHBondContact O-N 3.35Å; N515-L519 WeakPolarHBondContact O-CG 3.48Å; N515-L519 PolarHBondContact O-N 3.27Å |
| 516 | L | 80.3 | Confident | 76.5 | Confident | 80 Ų | 80 | 105.8 Ų | 105.8 | 42% | 0.419 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.9 | -50.5 | 171.9 | -163.8 | 80.3 | 0 | 0 | 0 | 111.4 | R512 K513 R518 L519 E520 | R512-L516 PolarHBondContact O-N 3.44Å; K513-L516 WeakPolarHBondContact O-CB 3.43Å; K513-L516 PolarHBondContact O-N 3.41Å; L516-R518 PolarHBondContact O-N 3.48Å; L516-L519 CarbonylContact O-C 3.57Å; L516-L519 WeakPolarHBondContact O-CA 3.47Å; L516-L519 WeakPolarHBondContact O-CB 3.24Å; L516-L519 PolarHBondContact O-N 3.13Å; L516-E520 PolarHBondContact O-N 3.25Å |
| 517 | A | 70.5 | Confident | 75.6 | Confident | 52 Ų | 52 | 105.7 Ų | 105.7 | 43% | 0.43 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.1 | -33.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | K513 L519 E520 L521 | K513-A517 PolarHBondContact O-N 2.91Å; A517-L519 PolarHBondContact O-N 3.26Å; A517-E520 PolarHBondContact O-N 2.56Å; A517-L521 PolarHBondContact O-N 3.29Å; A517-L521 VanDerWaalsContact O-N 3.16Å |
| 518 | R | 69.6 | Low | 74.5 | Confident | 170 Ų | 170 | 104.9 Ų | 104.9 | 64% | 0.642 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -68.9 | -15.4 | 172.5 | -72.8 | -179.3 | 71.8 | -141.7 | 1.7 | 114.4 | Q514 L516 P522 | Q514-R518 WeakPolarHBondContact O-CG 3.42Å; Q514-R518 PolarHBondContact O-N 3.28Å; Q514-R518 VanDerWaalsContact O-N 3.14Å; L516-R518 PolarHBondContact O-N 3.48Å; R518-P522 VanDerWaalsContact O-CD 3.24Å; R518-P522 WeakPolarHBondContact O-CD 3.5Å; R518-P522 WeakPolarHBondContact O-CG 3.41Å |
| 519 | L | 69.3 | Low | 73.7 | Confident | 128 Ų | 128 | 106.4 Ų | 106.4 | 67% | 0.67 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -101 | -20.7 | 174.7 | -66.4 | 170.4 | 0 | 0 | 0 | 112.8 | N515 L516 A517 | N515-L519 WeakPolarHBondContact O-CG 3.48Å; N515-L519 PolarHBondContact O-N 3.27Å; L516-L519 CarbonylContact O-C 3.57Å; L516-L519 WeakPolarHBondContact O-CA 3.47Å; L516-L519 WeakPolarHBondContact O-CB 3.24Å; L516-L519 PolarHBondContact O-N 3.13Å; A517-L519 PolarHBondContact O-N 3.26Å |
| 520 | E | 67.4 | Low | 72.5 | Confident | 102 Ų | 102 | 110.3 Ų | 110.3 | 48% | 0.477 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -77.2 | -44.3 | 173.8 | -70 | 167.2 | 156.9 | 0 | 0 | 111.3 | L516 A517 A523 D524 | L516-E520 PolarHBondContact O-N 3.25Å; A517-E520 PolarHBondContact O-N 2.56Å; E520-A523 WeakPolarHBondContact O-CB 3.03Å; E520-A523 PolarHBondContact O-N 3.39Å; E520-D524 PolarHBondContact O-N 2.65Å |
| 521 | L | 62.3 | Low | 70.8 | Confident | 128 Ų | 128 | 111.1 Ų | 111.1 | 67% | 0.67 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -54.5 | -41.8 | 179.9 | -150.8 | 82.3 | 0 | 0 | 0 | 114.4 | A517 L525 | A517-L521 PolarHBondContact O-N 3.29Å; A517-L521 VanDerWaalsContact O-N 3.16Å; L521-L525 PolarHBondContact O-N 2.98Å |
| 522 | P | 65.4 | Low | 69.1 | Low | 63 Ų | 63 | 112.7 Ų | 112.7 | 41% | 0.409 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -70.3 | -29.3 | 174.1 | -19.5 | 34.2 | 0 | 0 | 0 | 113.9 | R518 L526 | R518-P522 VanDerWaalsContact O-CD 3.24Å; R518-P522 WeakPolarHBondContact O-CD 3.5Å; R518-P522 WeakPolarHBondContact O-CG 3.41Å; P522-L526 WeakPolarHBondContact O-CG 3.43Å; P522-L526 PolarHBondContact O-N 3.12Å |
| 523 | A | 62.1 | Low | 67.1 | Low | 49 Ų | 49 | 110.9 Ų | 110.9 | 41% | 0.405 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -72.8 | -40.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | E520 L526 R527 | E520-A523 WeakPolarHBondContact O-CB 3.03Å; E520-A523 PolarHBondContact O-N 3.39Å; A523-L526 PolarHBondContact O-N 2.76Å; A523-R527 PolarHBondContact O-N 3.22Å |
| 524 | D | 62 | Low | 65.2 | Low | 97 Ų | 97 | 109.9 Ų | 109.9 | 52% | 0.519 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -69.3 | -37.3 | 173.1 | -76.1 | -36.4 | 0 | 0 | 0 | 111.9 | E520 L526 R527 Q528 | E520-D524 PolarHBondContact O-N 2.65Å; D524-L526 VanDerWaalsContact C-N 3.32Å; D524-L526 PolarHBondContact O-N 2.79Å; D524-R527 PolarHBondContact O-N 3.45Å; D524-Q528 VanDerWaalsContact O-CB 3.28Å; D524-Q528 WeakPolarHBondContact O-CB 3.24Å; D524-Q528 PolarHBondContact O-N 3.46Å |
| 525 | L | 62.3 | Low | 63 | Low | 112 Ų | 112 | 114 Ų | 114 | 59% | 0.586 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -60.3 | -38.2 | 170.9 | -88.3 | 166.7 | 0 | 0 | 0 | 112.9 | L521 K529 | L521-L525 PolarHBondContact O-N 2.98Å; L525-K529 VanDerWaalsContact O-CB 3.3Å; L525-K529 WeakPolarHBondContact O-CB 3.43Å; L525-K529 PolarHBondContact O-N 3.28Å |
| 526 | L | 63.3 | Low | 61.2 | Low | 118 Ų | 118 | 117 Ų | 117 | 62% | 0.618 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -66.5 | -47.2 | 174 | -76.9 | 166.4 | 0 | 0 | 0 | 111.5 | P522 A523 D524 Q528 K529 E530 | P522-L526 WeakPolarHBondContact O-CG 3.43Å; P522-L526 PolarHBondContact O-N 3.12Å; A523-L526 PolarHBondContact O-N 2.76Å; D524-L526 VanDerWaalsContact C-N 3.32Å; D524-L526 PolarHBondContact O-N 2.79Å; L526-Q528 VanDerWaalsContact C-N 3.33Å; L526-Q528 PolarHBondContact O-N 3.22Å; L526-K529 PolarHBondContact O-N 3.26Å; L526-E530 PolarHBondContact O-N 2.9Å |
| 527 | R | 64.9 | Low | 59.5 | Low | 181 Ų | 181 | 122 Ų | 122 | 68% | 0.683 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -61.9 | -38.1 | 175.9 | -76.6 | -165.5 | 67 | -150.5 | -5.5 | 113.2 | A523 D524 L531 | A523-R527 PolarHBondContact O-N 3.22Å; D524-R527 PolarHBondContact O-N 3.45Å; R527-L531 WeakPolarHBondContact O-CB 3.46Å; R527-L531 PolarHBondContact O-N 3.23Å |
| 528 | Q | 63.7 | Low | 57.6 | Low | 112 Ų | 112 | 127.9 Ų | 127.9 | 52% | 0.523 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -69 | -39.7 | 177.9 | -174.3 | 167.2 | -25.5 | 0 | 0 | 110.9 | D524 L526 L531 E532 | D524-Q528 VanDerWaalsContact O-CB 3.28Å; D524-Q528 WeakPolarHBondContact O-CB 3.24Å; D524-Q528 PolarHBondContact O-N 3.46Å; L526-Q528 VanDerWaalsContact C-N 3.33Å; L526-Q528 PolarHBondContact O-N 3.22Å; Q528-L531 WeakPolarHBondContact O-CB 3.33Å; Q528-L531 PolarHBondContact O-N 2.89Å; Q528-E532 PolarHBondContact O-N 3.05Å |
| 529 | K | 70.3 | Confident | 55.8 | Low | 150 Ų | 150 | 127.6 Ų | 127.6 | 65% | 0.652 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -65.4 | -38.3 | 174.6 | -173.1 | 171.6 | -178.5 | 175.4 | 0 | 112.9 | L525 L526 L531 S533 | L525-K529 VanDerWaalsContact O-CB 3.3Å; L525-K529 WeakPolarHBondContact O-CB 3.43Å; L525-K529 PolarHBondContact O-N 3.28Å; L526-K529 PolarHBondContact O-N 3.26Å; K529-L531 VanDerWaalsContact C-N 3.34Å; K529-S533 WeakPolarHBondContact O-CB 3.18Å; K529-S533 PolarHBondContact O-N 2.83Å; K529-S533 PolarHBondContact O-OG 3.11Å |
| 530 | E | 63.9 | Low | 53.9 | Low | 137 Ų | 137 | 125.7 Ų | 125.7 | 64% | 0.64 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -61 | -43.6 | 170.2 | -73.6 | -175.4 | 148.2 | 0 | 0 | 111.1 | L526 S533 A534 | L526-E530 PolarHBondContact O-N 2.9Å; E530-S533 PolarHBondContact O-N 2.85Å; E530-S533 PolarHBondContact O-OG 2.85Å; E530-A534 PolarHBondContact O-N 2.84Å |
| 531 | L | 55.8 | Low | 52.7 | Low | 136 Ų | 136 | 126.9 Ų | 126.9 | 71% | 0.712 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -66.4 | -37.1 | 179.4 | -160 | 73.8 | 0 | 0 | 0 | 113.3 | R527 Q528 K529 | R527-L531 WeakPolarHBondContact O-CB 3.46Å; R527-L531 PolarHBondContact O-N 3.23Å; Q528-L531 WeakPolarHBondContact O-CB 3.33Å; Q528-L531 PolarHBondContact O-N 2.89Å; K529-L531 VanDerWaalsContact C-N 3.34Å |
| 532 | E | 54 | Low | 51.5 | Low | 131 Ų | 131 | 129.6 Ų | 129.6 | 61% | 0.612 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -71.6 | -37.9 | 174.1 | -72.8 | -177 | 143.4 | 0 | 0 | 112.1 | Q528 A534 R535 | Q528-E532 PolarHBondContact O-N 3.05Å; E532-A534 PolarHBondContact O-N 3.05Å; E532-R535 PolarHBondContact O-N 2.82Å |
| 533 | S | 49 | Very low | 49.7 | Very low | 101 Ų | 101 | 133.4 Ų | 133.4 | 71% | 0.706 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -65.5 | -20.9 | 177 | 74.4 | 0 | 0 | 0 | 0 | 113.9 | K529 E530 | K529-S533 WeakPolarHBondContact O-CB 3.18Å; K529-S533 PolarHBondContact O-N 2.83Å; K529-S533 PolarHBondContact O-OG 3.11Å; E530-S533 PolarHBondContact O-N 2.85Å; E530-S533 PolarHBondContact O-OG 2.85Å |
| 534 | A | 47.2 | Very low | 48 | Very low | 79 Ų | 79 | 135 Ų | 135 | 65% | 0.653 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.4 | 8.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | E530 E532 | E530-A534 PolarHBondContact O-N 2.84Å; E532-A534 PolarHBondContact O-N 3.05Å |
| 535 | R | 39 | Very low | 46.4 | Very low | 205 Ų | 205 | 138.5 Ų | 138.5 | 77% | 0.774 | 74% | 0.738 | S | S | * | * | trans | -113.7 | 107.8 | -169.1 | -159.4 | 173.4 | -171 | 177.6 | 1.8 | 112.6 | E532 | E532-R535 PolarHBondContact O-N 2.82Š| ||
| 536 | P | 43.7 | Very low | 44.6 | Very low | 125 Ų | 125 | 144.3 Ų | 144.3 | 81% | 0.812 | 75% | 0.752 | S | S | * | * | trans | -61.2 | 137.8 | 174.9 | -23 | 34.1 | 0 | 0 | 0 | 112.2 | ||||
| 537 | Q | 43.9 | Very low | 43.8 | Very low | 187 Ų | 187 | 144.1 Ų | 144.1 | 87% | 0.874 | 76% | 0.758 | S | S | * | * | trans | -84.1 | 132.6 | 172.5 | -62.8 | 175.8 | -2.1 | 0 | 0 | 110.2 | ||||
| 538 | L | 31 | Very low | 41.9 | Very low | 175 Ų | 175 | 141.9 Ų | 141.9 | 92% | 0.916 | 76% | 0.759 | S | S | * | * | trans | -172.8 | 142.2 | 145.9 | -106.8 | 167.3 | 0 | 0 | 0 | 109.7 | ||||
| 539 | L | 30.8 | Very low | 40.2 | Very low | 164 Ų | 164 | 143.5 Ų | 143.5 | 86% | 0.859 | 77% | 0.771 | S | S | * | * | trans | -146.9 | 102.6 | 177.4 | -116.1 | 175.9 | 0 | 0 | 0 | 110.6 | ||||
| 540 | A | 30.5 | Very low | 38 | Very low | 88 Ų | 88 | 139.8 Ų | 139.8 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | trans | 60.8 | 170.1 | 154.8 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 541 | P | 41.3 | Very low | 36.3 | Very low | 127 Ų | 127 | 138.5 Ų | 138.5 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | cis | -114.2 | 179.6 | -6.8 | 39.4 | -26.3 | 0 | 0 | 0 | 114.3 | ||||
| 542 | E | 37.2 | Very low | 35.1 | Very low | 184 Ų | 184 | 140.8 Ų | 140.8 | 86% | 0.86 | 80% | 0.796 | S | S | * | * | trans | -92.5 | 163.7 | -170 | -52.5 | -171.3 | 143.7 | 0 | 0 | 115.3 | ||||
| 543 | T | 27.5 | Very low | 34 | Very low | 143 Ų | 143 | 141.7 Ų | 141.7 | 88% | 0.877 | 80% | 0.8 | S | S | * | * | trans | -148.3 | 94.1 | 154 | -1.6 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 544 | A | 26.6 | Very low | 33.2 | Very low | 84 Ų | 84 | 142.7 Ų | 142.7 | 69% | 0.694 | 80% | 0.797 | S | S | * | * | trans | 69 | 155.1 | 134.1 | 0 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 545 | L | 27.8 | Very low | 32.3 | Very low | 169 Ų | 169 | 144 Ų | 144 | 89% | 0.885 | 79% | 0.79 | S | S | * | * | trans | 86.2 | 153.5 | 162.1 | -55.1 | -176.1 | 0 | 0 | 0 | 120.2 | ||||
| 546 | R | 25.7 | Very low | 32.1 | Very low | 235 Ų | 235 | 145.4 Ų | 145.4 | 89% | 0.887 | 80% | 0.795 | S | S | * | * | trans | -140 | -173.9 | -176.7 | -36.3 | -151.9 | 81.1 | -179 | 7.5 | 107.9 | ||||
| 547 | P | 45.7 | Very low | 31.8 | Very low | 114 Ų | 114 | 149.4 Ų | 149.4 | 74% | 0.74 | 79% | 0.794 | S | S | * | * | cis | -126.8 | -167.6 | -47.1 | 29 | -9 | 0 | 0 | 0 | 111.5 | ||||
| 548 | N | 25.8 | Very low | 31.2 | Very low | 133 Ų | 133 | 144 Ų | 144 | 71% | 0.711 | 79% | 0.788 | S | S | * | * | trans | 110.2 | 148.7 | 136.4 | -143.8 | 56.4 | 0 | 0 | 0 | 119.6 | ||||
| 549 | D | 27.3 | Very low | 31.4 | Very low | 146 Ų | 146 | 140.2 Ų | 140.2 | 78% | 0.781 | 78% | 0.782 | S | S | * | * | trans | 6.1 | 145.4 | 170.3 | -70.9 | -49.3 | 0 | 0 | 0 | 122.6 | ||||
| 550 | G | 24.8 | Very low | 31.4 | Very low | 72 Ų | 72 | 139.4 Ų | 139.4 | 74% | 0.742 | 78% | 0.778 | S | S | * | * | trans | 146.4 | 102.7 | 136.7 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 551 | A | 28.5 | Very low | 31.5 | Very low | 111 Ų | 111 | 142.4 Ų | 142.4 | 92% | 0.917 | 78% | 0.781 | S | S | * | * | trans | 62 | 173.8 | 137.8 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 552 | E | 30.7 | Very low | 31 | Very low | 184 Ų | 184 | 141.5 Ų | 141.5 | 86% | 0.86 | 77% | 0.773 | S | S | * | * | trans | -105.2 | 174.7 | -171.2 | -58.2 | 169.8 | 96.4 | 0 | 0 | 113.2 | ||||
| 553 | E | 29.9 | Very low | 30.7 | Very low | 149 Ų | 149 | 139.4 Ų | 139.4 | 70% | 0.696 | 77% | 0.766 | S | S | * | * | trans | 73.7 | 90.6 | 142.4 | -149.6 | 58.6 | -166.5 | 0 | 0 | 121.5 | ||||
| 554 | L | 31.7 | Very low | 30.7 | Very low | 123 Ų | 123 | 138.1 Ų | 138.1 | 64% | 0.644 | 75% | 0.754 | S | S | * | * | 64.2 | 131.2 | 124.2 | -115.4 | 81.3 | 0 | 0 | 0 | 123.4 | |||||
| 555 | Q | 28.8 | Very low | 31.3 | Very low | 107 Ų | 107 | 143 Ų | 143 | 50% | 0.5 | 76% | 0.762 | S | S | . | * | 76.6 | 104 | 126.9 | -160.5 | 89.7 | -110.6 | 0 | 0 | 121.4 | |||||
| 556 | R | 34.7 | Very low | 31.3 | Very low | 234 Ų | 234 | 138.5 Ų | 138.5 | 88% | 0.883 | 76% | 0.757 | S | S | * | * | -173.9 | 129.5 | 116.3 | -93.2 | 148.1 | -159.6 | -102.2 | 5.6 | 108.7 | |||||
| 557 | R | 37.3 | Very low | 31.6 | Very low | 209 Ų | 209 | 132.4 Ų | 132.4 | 79% | 0.789 | 76% | 0.757 | S | S | * | * | cis | 88.9 | 115.5 | 44.1 | -75.6 | -173.1 | 179.1 | -157.6 | -0.8 | 114 | ||||
| 558 | G | 31.7 | Very low | 30.9 | Very low | 73 Ų | 73 | 131.3 Ų | 131.3 | 75% | 0.753 | 76% | 0.757 | S | S | * | * | trans | 154.9 | 85.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 559 | A | 34.8 | Very low | 32.1 | Very low | 96 Ų | 96 | 130.1 Ų | 130.1 | 79% | 0.793 | 76% | 0.757 | S | S | * | * | 77.2 | 133 | 80.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 560 | L | 31.2 | Very low | 32.2 | Very low | 146 Ų | 146 | 130.5 Ų | 130.5 | 76% | 0.764 | 76% | 0.758 | S | S | * | * | cis | -159.6 | 164.6 | 3.1 | -154.1 | 121.7 | 0 | 0 | 0 | 110.9 | V562 | L560-V562 HydrophobicContact CD2-CG2 4.12Š| ||
| 561 | L | 31.9 | Very low | 32.3 | Very low | 152 Ų | 152 | 135.4 Ų | 135.4 | 80% | 0.796 | 77% | 0.767 | S | S | * | * | trans | 154.7 | 115.8 | 150.9 | -83.1 | 169.4 | 0 | 0 | 0 | 108.2 | ||||
| 562 | V | 32.3 | Very low | 32.1 | Very low | 108 Ų | 108 | 134.7 Ų | 134.7 | 66% | 0.655 | 76% | 0.761 | S | S | * | * | 76.8 | 113.4 | 71.4 | 165.4 | 0 | 0 | 0 | 0 | 109.7 | L560 | L560-V562 HydrophobicContact CD2-CG2 4.12Š| |||
| 563 | L | 29.5 | Very low | 32 | Very low | 139 Ų | 139 | 133.9 Ų | 133.9 | 73% | 0.728 | 76% | 0.761 | S | S | * | * | cis | -152.2 | 166.2 | 36 | -101.8 | 146.8 | 0 | 0 | 0 | 115.4 | ||||
| 564 | N | 29 | Very low | 32.9 | Very low | 117 Ų | 117 | 132.4 Ų | 132.4 | 63% | 0.626 | 76% | 0.764 | S | S | * | * | trans | 55.3 | 114.4 | 155.1 | -64.3 | -15.7 | 0 | 0 | 0 | 120.2 | ||||
| 565 | H | 38.1 | Very low | 33.5 | Very low | 185 Ų | 185 | 131.7 Ų | 131.7 | 86% | 0.856 | 77% | 0.767 | S | S | * | * | 74.8 | 127.3 | 68.4 | -62.3 | -29.6 | 0 | 0 | 0 | 113.9 | |||||
| 566 | G | 28.8 | Very low | 33.6 | Very low | 76 Ų | 76 | 135.7 Ų | 135.7 | 78% | 0.784 | 79% | 0.786 | S | S | * | * | cis | 178.8 | -167.6 | 0.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 567 | A | 30.3 | Very low | 33.3 | Very low | 106 Ų | 106 | 127.6 Ų | 127.6 | 88% | 0.876 | 78% | 0.776 | S | S | * | * | cis | -167.2 | 165.3 | -18.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 568 | A | 30.8 | Very low | 33.7 | Very low | 91 Ų | 91 | 123.6 Ų | 123.6 | 75% | 0.752 | 78% | 0.777 | S | S | * | * | trans | -114.5 | -165 | 162.9 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 569 | P | 51.1 | Low | 34.4 | Very low | 108 Ų | 108 | 126.4 Ų | 126.4 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | cis | -142.7 | -168.7 | -2.1 | 43.6 | -22.8 | 0 | 0 | 0 | 115.9 | ||||
| 570 | L | 29.6 | Very low | 34 | Very low | 154 Ų | 154 | 125.4 Ų | 125.4 | 81% | 0.806 | 78% | 0.781 | S | S | * | * | trans | 29.2 | 134.6 | 146.2 | -64.6 | 165 | 0 | 0 | 0 | 123.2 | ||||
| 571 | L | 26.7 | Very low | 34.1 | Very low | 176 Ų | 176 | 124.4 Ų | 124.4 | 92% | 0.921 | 79% | 0.786 | S | S | * | * | 174 | -164.5 | 113.2 | -89.8 | 177.1 | 0 | 0 | 0 | 113.8 | |||||
| 572 | A | 24.6 | Very low | 33.9 | Very low | 96 Ų | 96 | 120.7 Ų | 120.7 | 79% | 0.793 | 79% | 0.785 | S | S | * | * | trans | -111.6 | -179.7 | -150.2 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 573 | L | 28.7 | Very low | 34.8 | Very low | 167 Ų | 167 | 121.4 Ų | 121.4 | 87% | 0.874 | 79% | 0.791 | S | S | * | * | trans | -70 | 179.7 | 178.4 | -56.6 | 168.2 | 0 | 0 | 0 | 113.8 | ||||
| 574 | P | 48.7 | Very low | 35.6 | Very low | 117 Ų | 117 | 120 Ų | 120 | 76% | 0.76 | 79% | 0.791 | S | S | * | * | cis | -130.8 | -144.8 | -0.9 | 45.9 | -27.8 | 0 | 0 | 0 | 111.1 | ||||
| 575 | P | 45.9 | Very low | 35.8 | Very low | 108 Ų | 108 | 120.7 Ų | 120.7 | 70% | 0.701 | 80% | 0.799 | S | S | * | * | cis | -125.2 | 178.9 | -28.2 | 41.1 | -26.4 | 0 | 0 | 0 | 113.9 | ||||
| 576 | Q | 31 | Very low | 35.9 | Very low | 192 Ų | 192 | 118.2 Ų | 118.2 | 90% | 0.897 | 80% | 0.799 | S | S | * | * | trans | 165.6 | 169.7 | 137.9 | -89.3 | -61.7 | -2.6 | 0 | 0 | 112.7 | ||||
| 577 | G | 28 | Very low | 35.8 | Very low | 64 Ų | 64 | 119.8 Ų | 119.8 | 66% | 0.66 | 80% | 0.799 | S | S | * | * | trans | -99.9 | -169.4 | -164.2 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 578 | P | 46.2 | Very low | 35.8 | Very low | 125 Ų | 125 | 125 Ų | 125 | 81% | 0.812 | 80% | 0.796 | S | S | * | * | trans | -96.2 | 170.6 | -166.9 | 42.1 | -39.5 | 0 | 0 | 0 | 114.2 | ||||
| 579 | P | 45.3 | Very low | 35.7 | Very low | 131 Ų | 131 | 125.7 Ų | 125.7 | 85% | 0.851 | 79% | 0.787 | S | S | * | * | -116.9 | 174.6 | 67.1 | 0.1 | 24.1 | 0 | 0 | 0 | 113.3 | |||||
| 580 | G | 27.3 | Very low | 34.8 | Very low | 76 Ų | 76 | 124.7 Ų | 124.7 | 78% | 0.784 | 78% | 0.782 | S | S | * | * | 91.6 | 136.8 | 52.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 581 | S | 31.8 | Very low | 34.9 | Very low | 124 Ų | 124 | 120.6 Ų | 120.6 | 87% | 0.867 | 77% | 0.77 | S | S | * | * | cis | -167 | 156 | 3.8 | 55.1 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 582 | G | 29.4 | Very low | 35.3 | Very low | 75 Ų | 75 | 122 Ų | 122 | 77% | 0.773 | 76% | 0.764 | S | S | * | * | trans | 77.8 | 127.4 | 150.6 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 583 | P | 50.3 | Low | 35.4 | Very low | 123 Ų | 123 | 128.1 Ų | 128.1 | 80% | 0.799 | 77% | 0.766 | S | S | * | * | trans | -96 | 171 | 167.7 | 40.7 | -35.7 | 0 | 0 | 0 | 112.2 | ||||
| 584 | P | 45.7 | Very low | 35.5 | Very low | 110 Ų | 110 | 124.3 Ų | 124.3 | 71% | 0.714 | 76% | 0.759 | S | S | * | * | -155.5 | 157.6 | 95.7 | 40.9 | -22.8 | 0 | 0 | 0 | 118.4 | |||||
| 585 | T | 33.7 | Very low | 35.5 | Very low | 131 Ų | 131 | 124.4 Ų | 124.4 | 80% | 0.804 | 76% | 0.759 | S | S | * | * | trans | 53.5 | 142.5 | 145 | 54.1 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 586 | P | 40.8 | Very low | 34.9 | Very low | 132 Ų | 132 | 131.1 Ų | 131.1 | 86% | 0.857 | 77% | 0.771 | S | S | * | * | trans | -96.4 | 151.2 | 167.7 | 37.6 | -33.2 | 0 | 0 | 0 | 114.8 | ||||
| 587 | S | 25.4 | Very low | 35 | Very low | 110 Ų | 110 | 131.9 Ų | 131.9 | 77% | 0.769 | 77% | 0.771 | S | S | * | * | trans | -126 | 126.1 | 163.6 | 53.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 588 | R | 30.7 | Very low | 34.8 | Very low | 215 Ų | 215 | 132.2 Ų | 132.2 | 81% | 0.811 | 78% | 0.775 | S | S | * | * | 77.9 | 148.9 | 60.9 | -159 | -172.6 | -172.8 | -117.3 | 11.1 | 113.2 | |||||
| 589 | D | 28.7 | Very low | 33.9 | Very low | 106 Ų | 106 | 129.7 Ų | 129.7 | 57% | 0.567 | 77% | 0.772 | S | S | * | * | trans | 99.4 | 140.2 | 157.6 | -83.7 | -62.2 | 0 | 0 | 0 | 117.6 | ||||
| 590 | S | 32.1 | Very low | 33.8 | Very low | 86 Ų | 86 | 129.8 Ų | 129.8 | 60% | 0.601 | 77% | 0.772 | S | S | * | * | cis | -160.2 | 167.6 | 0.3 | -148 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 591 | A | 32.2 | Very low | 33.8 | Very low | 68 Ų | 68 | 129.2 Ų | 129.2 | 56% | 0.562 | 77% | 0.766 | S | S | * | * | trans | 71.5 | 153.7 | 140.3 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 592 | R | 34 | Very low | 34.4 | Very low | 206 Ų | 206 | 129.8 Ų | 129.8 | 78% | 0.777 | 77% | 0.767 | S | S | * | * | cis | -158.6 | 175.4 | -10.9 | -113.5 | 173.7 | -79.4 | -115.9 | -4.4 | 106.5 | ||||
| 593 | R | 28.7 | Very low | 34.2 | Very low | 224 Ų | 224 | 131.2 Ų | 131.2 | 85% | 0.845 | 77% | 0.772 | S | S | * | * | cis | -160.6 | 166.9 | 21.1 | -148.4 | 178.6 | -72.6 | -136.3 | 2.7 | 110.4 | ||||
| 594 | A | 29.8 | Very low | 33.1 | Very low | 87 Ų | 87 | 131.3 Ų | 131.3 | 72% | 0.719 | 78% | 0.775 | S | S | * | * | trans | -145 | 165.8 | 164.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 595 | P | 49.3 | Very low | 32.1 | Very low | 119 Ų | 119 | 130.6 Ų | 130.6 | 77% | 0.773 | 78% | 0.779 | S | S | * | * | -155.6 | 148.6 | 115.2 | 37.5 | -19.2 | 0 | 0 | 0 | 118.5 | |||||
| 596 | R | 33.7 | Very low | 32 | Very low | 249 Ų | 249 | 135.7 Ų | 135.7 | 94% | 0.94 | 78% | 0.783 | S | S | * | * | trans | 36.1 | 147.4 | 134.6 | -54.1 | -176.3 | 174.4 | -137.6 | -6 | 120.4 | ||||
| 597 | K | 31.7 | Very low | 31.9 | Very low | 208 Ų | 208 | 135.6 Ų | 135.6 | 90% | 0.904 | 78% | 0.782 | S | S | * | * | cis | -160.6 | 161.6 | 36.1 | 167.4 | -173 | 174.2 | -170.8 | 0 | 107.8 | ||||
| 598 | G | 24.6 | Very low | 32 | Very low | 72 Ų | 72 | 135.3 Ų | 135.3 | 74% | 0.742 | 78% | 0.78 | S | S | * | * | cis | 176.5 | -149.6 | 4.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 599 | G | 27.4 | Very low | 31.9 | Very low | 72 Ų | 72 | 133.7 Ų | 133.7 | 74% | 0.742 | 78% | 0.782 | S | S | * | * | trans | -121.5 | -168.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 600 | P | 42.1 | Very low | 31.8 | Very low | 132 Ų | 132 | 133.7 Ų | 133.7 | 86% | 0.857 | 79% | 0.79 | S | S | * | * | cis | -139.3 | -173.6 | 35.8 | 42.4 | -24.1 | 0 | 0 | 0 | 117 | ||||
| 601 | G | 27.3 | Very low | 31.4 | Very low | 65 Ų | 65 | 138.6 Ų | 138.6 | 67% | 0.67 | 80% | 0.801 | S | S | * | * | trans | -87.2 | -156.4 | 158.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 602 | P | 45.9 | Very low | 31.1 | Very low | 135 Ų | 135 | 143.1 Ų | 143.1 | 88% | 0.877 | 81% | 0.81 | S | S | * | * | cis | -140.2 | -175 | 20.6 | 44.4 | -27 | 0 | 0 | 0 | 116 | ||||
| 603 | A | 23.3 | Very low | 30.6 | Very low | 106 Ų | 106 | 140.9 Ų | 140.9 | 88% | 0.876 | 81% | 0.811 | S | S | * | * | trans | -172.4 | 165.1 | 145 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 604 | S | 27.8 | Very low | 30.3 | Very low | 125 Ų | 125 | 136.7 Ų | 136.7 | 87% | 0.874 | 81% | 0.81 | S | S | * | * | trans | -147 | 143.2 | -178.5 | 177.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 605 | A | 24.7 | Very low | 30 | Very low | 95 Ų | 95 | 136 Ų | 136 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | trans | -169.1 | 146.7 | 155.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 606 | R | 32.2 | Very low | 28.8 | Very low | 238 Ų | 238 | 135.7 Ų | 135.7 | 90% | 0.898 | 82% | 0.819 | S | S | * | * | trans | -145.2 | 148.3 | 151.8 | -92.9 | -167.2 | 172.1 | -159.1 | -2.3 | 107.2 | ||||
| 607 | P | 38.7 | Very low | 28.3 | Very low | 129 Ų | 129 | 134.3 Ų | 134.3 | 84% | 0.838 | 81% | 0.814 | S | S | * | * | -138.1 | -141.1 | 106.9 | 36.9 | -21.5 | 0 | 0 | 0 | 113.3 | |||||
| 608 | S | 27.6 | Very low | 27.9 | Very low | 104 Ų | 104 | 130.2 Ų | 130.2 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | trans | -144.8 | -160.8 | -151.1 | 53 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 609 | E | 27.3 | Very low | 28.1 | Very low | 182 Ų | 182 | 137.5 Ų | 137.5 | 85% | 0.85 | 81% | 0.806 | S | S | * | * | trans | 87.6 | 149.2 | 171 | -54.3 | -168.4 | 120 | 0 | 0 | 117.2 | ||||
| 610 | S | 27.6 | Very low | 28 | Very low | 105 Ų | 105 | 138 Ų | 138 | 73% | 0.734 | 80% | 0.803 | S | S | * | * | cis | -167.8 | 178.9 | -22.2 | 58.9 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 611 | K | 24.6 | Very low | 27.3 | Very low | 189 Ų | 189 | 140 Ų | 140 | 82% | 0.822 | 80% | 0.801 | S | S | * | * | trans | 89.4 | 88.4 | 145.2 | -157.5 | 173.3 | -175.4 | 176.1 | 0 | 124.1 | ||||
| 612 | E | 24.2 | Very low | 27.3 | Very low | 164 Ų | 164 | 144 Ų | 144 | 77% | 0.766 | 81% | 0.807 | S | S | * | * | 35.3 | 120.6 | 108.9 | -159.6 | 167.3 | 158.2 | 0 | 0 | 125.2 | |||||
| 613 | M | 25.2 | Very low | 26.6 | Very low | 159 Ų | 159 | 140.2 Ų | 140.2 | 78% | 0.783 | 79% | 0.792 | S | S | * | * | trans | 56.7 | 139 | 134.7 | -153.4 | 101.9 | 76.5 | 0 | 0 | 125 | ||||
| 614 | T | 22.1 | Very low | 26.7 | Very low | 135 Ų | 135 | 140 Ų | 140 | 83% | 0.828 | 79% | 0.785 | S | S | * | * | trans | 121.7 | 135.7 | 131.1 | -39.3 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 615 | G | 23.8 | Very low | 27.1 | Very low | 73 Ų | 73 | 142.4 Ų | 142.4 | 75% | 0.753 | 78% | 0.782 | S | S | * | * | trans | 96.1 | 154.5 | 158.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 616 | A | 23.6 | Very low | 27.3 | Very low | 112 Ų | 112 | 145 Ų | 145 | 93% | 0.926 | 78% | 0.783 | S | S | * | * | cis | -154.4 | -167.8 | -9.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 617 | R | 23.4 | Very low | 27.3 | Very low | 220 Ų | 220 | 141.4 Ų | 141.4 | 83% | 0.83 | 78% | 0.776 | S | S | * | * | trans | -123.6 | 162.9 | -166.2 | -171.1 | -165.4 | 177 | -175.9 | -0.6 | 111.9 | ||||
| 618 | L | 23.6 | Very low | 28.1 | Very low | 122 Ų | 122 | 140 Ų | 140 | 64% | 0.639 | 77% | 0.767 | S | S | * | * | trans | 82.1 | 154.2 | 167.7 | -42.2 | 163.7 | 0 | 0 | 0 | 114.6 | ||||
| 619 | W | 27 | Very low | 29.2 | Very low | 226 Ų | 226 | 140 Ų | 140 | 86% | 0.856 | 76% | 0.764 | S | S | * | * | cis | -149.7 | 160.6 | 6.9 | -96.8 | 112.6 | 0 | 0 | 0 | 111.5 | ||||
| 620 | A | 26 | Very low | 29.5 | Very low | 82 Ų | 82 | 139.7 Ų | 139.7 | 68% | 0.678 | 76% | 0.76 | S | S | * | * | trans | 53.2 | 148.4 | 152.3 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 621 | Q | 27.7 | Very low | 29.6 | Very low | 175 Ų | 175 | 140.1 Ų | 140.1 | 82% | 0.818 | 75% | 0.754 | S | S | * | * | cis | 72.4 | 138.8 | 32.7 | -63.9 | -158.3 | -10.8 | 0 | 0 | 115.3 | ||||
| 622 | D | 27.8 | Very low | 30.2 | Very low | 148 Ų | 148 | 135.6 Ų | 135.6 | 79% | 0.791 | 75% | 0.746 | S | S | * | * | cis | -153.4 | -164.4 | -9.1 | -124.5 | 62.6 | 0 | 0 | 0 | 108.9 | ||||
| 623 | G | 29.6 | Very low | 30.5 | Very low | 55 Ų | 55 | 135.2 Ų | 135.2 | 57% | 0.567 | 75% | 0.75 | S | S | * | * | cis | -177.4 | -132.3 | 12.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 624 | S | 25.4 | Very low | 30.8 | Very low | 102 Ų | 102 | 131.1 Ų | 131.1 | 71% | 0.713 | 75% | 0.748 | S | S | * | * | trans | 75.4 | 110.7 | -173.9 | -162.8 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 625 | E | 36.4 | Very low | 31.2 | Very low | 176 Ų | 176 | 134.3 Ų | 134.3 | 82% | 0.822 | 75% | 0.753 | S | S | * | * | cis | 76.3 | 130.3 | 49.7 | -56.2 | 171 | 149.2 | 0 | 0 | 111.5 | ||||
| 626 | D | 29.1 | Very low | 31.5 | Very low | 150 Ų | 150 | 138.4 Ų | 138.4 | 80% | 0.802 | 76% | 0.758 | S | S | * | * | cis | -149.9 | 162.4 | 26.3 | -154.1 | -126.6 | 0 | 0 | 0 | 115.9 | ||||
| 627 | E | 32.4 | Very low | 33.1 | Very low | 162 Ų | 162 | 137.8 Ų | 137.8 | 76% | 0.757 | 74% | 0.744 | S | S | * | * | trans | -42.2 | -174.1 | 173.7 | -79.6 | -106.1 | 99 | 0 | 0 | 122.3 | ||||
| 628 | P | 55.1 | Low | 33.6 | Very low | 98 Ų | 98 | 135 Ų | 135 | 64% | 0.636 | 74% | 0.741 | S | S | * | * | cis | -133.3 | -113.6 | -35.5 | 36.2 | -16.6 | 0 | 0 | 0 | 115.4 | ||||
| 629 | P | 51.7 | Low | 34 | Very low | 104 Ų | 104 | 135 Ų | 135 | 68% | 0.675 | 75% | 0.746 | S | S | * | * | -122.9 | 163 | -71 | 39 | -24.7 | 0 | 0 | 0 | 118.4 | |||||
| 630 | K | 33.2 | Very low | 34.2 | Very low | 177 Ų | 177 | 128.5 Ų | 128.5 | 77% | 0.77 | 74% | 0.741 | S | S | * | * | trans | 59.1 | 161.7 | 142.1 | -81.6 | 174.1 | 149 | -84.9 | 0 | 122.4 | ||||
| 631 | D | 29.8 | Very low | 34.5 | Very low | 114 Ų | 114 | 129.1 Ų | 129.1 | 61% | 0.61 | 75% | 0.746 | S | S | * | * | cis | -142.4 | 154 | -0.6 | -98 | -41.6 | 0 | 0 | 0 | 108.4 | ||||
| 632 | S | 37.3 | Very low | 34.6 | Very low | 93 Ų | 93 | 127.4 Ų | 127.4 | 65% | 0.65 | 75% | 0.747 | S | S | * | * | 62.2 | 131.5 | 70.7 | -90.7 | 0 | 0 | 0 | 0 | 116.8 | |||||
| 633 | D | 29.5 | Very low | 34.6 | Very low | 157 Ų | 157 | 123.7 Ų | 123.7 | 84% | 0.84 | 74% | 0.743 | S | S | * | * | cis | -139.5 | -149.5 | -3.9 | -65.1 | -49.9 | 0 | 0 | 0 | 110.4 | ||||
| 634 | G | 31.8 | Very low | 34.5 | Very low | 72 Ų | 72 | 126.8 Ų | 126.8 | 74% | 0.742 | 76% | 0.755 | S | S | * | * | cis | -179 | -167 | 9.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 635 | E | 31.3 | Very low | 34.5 | Very low | 202 Ų | 202 | 134.5 Ų | 134.5 | 94% | 0.944 | 77% | 0.769 | S | S | * | * | trans | -136.6 | 141.1 | -168.9 | -62.1 | 174.5 | 94.9 | 0 | 0 | 118.6 | ||||
| 636 | D | 29.9 | Very low | 33.9 | Very low | 159 Ų | 159 | 129.7 Ų | 129.7 | 85% | 0.85 | 77% | 0.766 | S | S | * | * | trans | 45.2 | -167.4 | 149.7 | -132.8 | 23.4 | 0 | 0 | 0 | 121.1 | ||||
| 637 | P | 56.7 | Low | 34.6 | Very low | 99 Ų | 99 | 127.9 Ų | 127.9 | 64% | 0.643 | 76% | 0.763 | S | S | * | * | cis | -140 | -178.4 | -16.9 | 42.8 | -24.4 | 0 | 0 | 0 | 119 | ||||
| 638 | E | 33.6 | Very low | 34.1 | Very low | 162 Ų | 162 | 126.5 Ų | 126.5 | 76% | 0.757 | 77% | 0.765 | S | S | * | * | trans | 65.6 | 176.9 | 158.2 | -92.3 | -77.3 | 73.8 | 0 | 0 | 119.3 | ||||
| 639 | T | 33.5 | Very low | 33.3 | Very low | 121 Ų | 121 | 127.7 Ų | 127.7 | 74% | 0.742 | 77% | 0.773 | S | S | * | * | cis | -150.1 | 174.8 | 12.3 | 11.3 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 640 | A | 30.6 | Very low | 32.1 | Very low | 91 Ų | 91 | 126.2 Ų | 126.2 | 75% | 0.752 | 78% | 0.777 | S | S | * | * | cis | -159.5 | -117 | -8.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 641 | A | 31.5 | Very low | 31.8 | Very low | 94 Ų | 94 | 127.7 Ų | 127.7 | 78% | 0.777 | 79% | 0.786 | S | S | * | * | trans | -145.7 | -173.7 | -173.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 642 | V | 29.8 | Very low | 31.6 | Very low | 140 Ų | 140 | 126.3 Ų | 126.3 | 85% | 0.848 | 79% | 0.791 | S | S | * | * | cis | -157.5 | 170.7 | 28.6 | 174.6 | 0 | 0 | 0 | 0 | 107 | ||||
| 643 | G | 28.5 | Very low | 32.1 | Very low | 69 Ų | 69 | 127.7 Ų | 127.7 | 71% | 0.711 | 80% | 0.797 | S | S | * | * | cis | 163.8 | -163.9 | 5.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 644 | C | 26.8 | Very low | 31.9 | Very low | 121 Ų | 121 | 125 Ų | 125 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | cis | -172.1 | 149.5 | -24.7 | -92.8 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 645 | R | 27 | Very low | 31.6 | Very low | 264 Ų | 264 | 125.4 Ų | 125.4 | 100% | 0.996 | 80% | 0.801 | S | S | * | * | trans | 66.2 | 138.9 | 168 | -88.2 | -172.1 | 177.2 | -120.8 | 1.9 | 122 | ||||
| 646 | G | 22.3 | Very low | 31.4 | Very low | 74 Ų | 74 | 119.7 Ų | 119.7 | 76% | 0.763 | 80% | 0.797 | S | S | * | * | trans | 140.3 | 132.4 | 156.2 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 647 | P | 44.1 | Very low | 31.4 | Very low | 113 Ų | 113 | 117.2 Ų | 117.2 | 73% | 0.734 | 80% | 0.798 | S | S | * | * | trans | -129.6 | 148.3 | -172.6 | 40.8 | -26.7 | 0 | 0 | 0 | 119 | ||||
| 648 | T | 21.5 | Very low | 30.2 | Very low | 133 Ų | 133 | 116 Ų | 116 | 82% | 0.816 | 80% | 0.804 | S | S | * | * | trans | 61.2 | 164.8 | 149.2 | 49.8 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 649 | P | 39.9 | Very low | 30.3 | Very low | 122 Ų | 122 | 112.3 Ų | 112.3 | 79% | 0.792 | 80% | 0.801 | S | S | * | * | cis | -135.1 | 169.9 | -36.1 | 37.1 | -21.5 | 0 | 0 | 0 | 114.6 | ||||
| 650 | G | 24.6 | Very low | 30.3 | Very low | 73 Ų | 73 | 115.3 Ų | 115.3 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | trans | 114.7 | 156.1 | 132.2 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 651 | Q | 28.5 | Very low | 30.2 | Very low | 208 Ų | 208 | 114.4 Ų | 114.4 | 97% | 0.972 | 81% | 0.806 | S | S | * | * | trans | 78.8 | 144 | 162.1 | -142.8 | 150.6 | 69.2 | 0 | 0 | 119.4 | ||||
| 652 | A | 24.1 | Very low | 30.3 | Very low | 86 Ų | 86 | 119.9 Ų | 119.9 | 71% | 0.711 | 81% | 0.813 | S | S | * | * | trans | -133.8 | -166.6 | -175 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 653 | P | 47.8 | Very low | 30.2 | Very low | 121 Ų | 121 | 116.3 Ų | 116.3 | 79% | 0.786 | 80% | 0.804 | S | S | * | * | cis | -138.1 | -162.3 | -0.2 | 44.1 | -25.1 | 0 | 0 | 0 | 114.2 | ||||
| 654 | A | 25.8 | Very low | 30.1 | Very low | 101 Ų | 101 | 120.2 Ų | 120.2 | 84% | 0.835 | 81% | 0.808 | S | S | * | * | trans | 69.7 | 152.8 | 168.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 655 | G | 26.3 | Very low | 30.2 | Very low | 80 Ų | 80 | 123.3 Ų | 123.3 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | cis | 135 | 106 | -5.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 656 | G | 26.4 | Very low | 30.8 | Very low | 83 Ų | 83 | 116.8 Ų | 116.8 | 86% | 0.856 | 80% | 0.8 | S | S | * | * | trans | 164 | 148.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 657 | A | 30.3 | Very low | 31 | Very low | 106 Ų | 106 | 116.8 Ų | 116.8 | 88% | 0.876 | 80% | 0.799 | S | S | * | * | trans | -115.6 | 132.9 | -171.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 658 | G | 30.9 | Very low | 30.3 | Very low | 75 Ų | 75 | 116.8 Ų | 116.8 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | 93.6 | 147.8 | 123.6 | 0 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 659 | A | 36.1 | Very low | 30.6 | Very low | 83 Ų | 83 | 117.1 Ų | 117.1 | 69% | 0.686 | 80% | 0.804 | S | S | * | * | trans | 71.9 | 146.2 | 156.6 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 660 | E | 32.9 | Very low | 30.1 | Very low | 184 Ų | 184 | 118.3 Ų | 118.3 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | cis | -165.2 | 166.8 | -11.3 | -117.1 | 179.3 | 98.4 | 0 | 0 | 110.5 | ||||
| 661 | G | 30.1 | Very low | 30.6 | Very low | 72 Ų | 72 | 120 Ų | 120 | 74% | 0.742 | 80% | 0.801 | S | S | * | * | trans | -153.1 | 51.2 | -171.7 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 662 | K | 33.5 | Very low | 31.1 | Very low | 210 Ų | 210 | 118 Ų | 118 | 91% | 0.913 | 80% | 0.796 | S | S | * | * | trans | 41.4 | 123.7 | 153.4 | -61.6 | -177 | 177.3 | -177.7 | 0 | 122.1 | ||||
| 663 | G | 26.2 | Very low | 31.1 | Very low | 65 Ų | 65 | 116.5 Ų | 116.5 | 67% | 0.67 | 79% | 0.789 | S | S | * | * | trans | 82.7 | 113.7 | 149.5 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 664 | L | 26.6 | Very low | 30.1 | Very low | 150 Ų | 150 | 120.4 Ų | 120.4 | 79% | 0.785 | 79% | 0.794 | S | S | * | * | cis | 61.8 | 132.1 | 34.1 | -37 | 177.7 | 0 | 0 | 0 | 113.2 | ||||
| 665 | F | 30.1 | Very low | 31 | Very low | 186 Ų | 186 | 120.2 Ų | 120.2 | 82% | 0.816 | 78% | 0.784 | S | S | * | * | cis | 177.8 | -169.5 | -11.9 | -105.1 | -32.7 | 0 | 0 | 0 | 105.2 | ||||
| 666 | P | 39 | Very low | 31 | Very low | 128 Ų | 128 | 126.3 Ų | 126.3 | 83% | 0.831 | 78% | 0.783 | S | S | * | * | cis | -132.9 | 179 | 9.4 | 43.5 | -26.1 | 0 | 0 | 0 | 116.1 | ||||
| 667 | G | 26.8 | Very low | 31.1 | Very low | 73 Ų | 73 | 126.3 Ų | 126.3 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | trans | 170.7 | 47.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 668 | S | 28.9 | Very low | 31 | Very low | 113 Ų | 113 | 126.9 Ų | 126.9 | 79% | 0.79 | 77% | 0.768 | S | S | * | * | trans | -61.9 | 141.3 | 170.7 | -54.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 669 | T | 27 | Very low | 30.7 | Very low | 140 Ų | 140 | 128.9 Ų | 128.9 | 86% | 0.859 | 77% | 0.77 | S | S | * | * | -133.8 | 134 | 75.7 | 46.3 | 0 | 0 | 0 | 0 | 116.6 | |||||
| 670 | L | 30.5 | Very low | 31.1 | Very low | 147 Ų | 147 | 129.3 Ų | 129.3 | 77% | 0.77 | 77% | 0.766 | S | S | * | * | trans | -34.7 | 165.8 | 150.7 | -68.7 | 174.2 | 0 | 0 | 0 | 116 | ||||
| 671 | P | 35.2 | Very low | 31 | Very low | 110 Ų | 110 | 129.9 Ų | 129.9 | 71% | 0.714 | 76% | 0.762 | S | S | * | * | cis | -131.9 | 156.2 | 20.5 | 33.4 | -13.6 | 0 | 0 | 0 | 118.4 | ||||
| 672 | L | 38.7 | Very low | 30.8 | Very low | 165 Ų | 165 | 135.3 Ų | 135.3 | 86% | 0.864 | 77% | 0.765 | S | S | * | * | trans | 45.7 | 118 | 145.4 | -59 | 168.9 | 0 | 0 | 0 | 117.6 | ||||
| 673 | G | 24 | Very low | 30.9 | Very low | 54 Ų | 54 | 133.3 Ų | 133.3 | 56% | 0.557 | 76% | 0.759 | S | S | * | * | cis | 117 | 91.6 | 24.1 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 674 | F | 27.2 | Very low | 31.1 | Very low | 203 Ų | 203 | 137.6 Ų | 137.6 | 89% | 0.89 | 77% | 0.772 | S | S | * | * | 74 | 154.3 | 83.2 | -84.9 | -124.2 | 0 | 0 | 0 | 112.6 | |||||
| 675 | P | 43.6 | Very low | 30.9 | Very low | 98 Ų | 98 | 134.2 Ų | 134.2 | 64% | 0.636 | 77% | 0.774 | S | S | * | * | cis | -142 | -177.8 | -32 | 39.6 | -22.1 | 0 | 0 | 0 | 113.6 | ||||
| 676 | Y | 27.5 | Very low | 31 | Very low | 207 Ų | 207 | 129.9 Ų | 129.9 | 81% | 0.812 | 77% | 0.772 | S | S | * | * | trans | 31 | 149.6 | 135.3 | -75.6 | -117.5 | 0 | 0 | 0 | 121.2 | V678 | Y676-V678 HydrophobicContact CD1-CG2 3.86Å; Y676-V678 HydrophobicContact CE1-CG2 4.03Å | ||
| 677 | A | 28.9 | Very low | 30.7 | Very low | 84 Ų | 84 | 131.2 Ų | 131.2 | 69% | 0.694 | 78% | 0.777 | S | S | * | * | cis | -142.6 | 146.9 | 23.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 678 | V | 27.9 | Very low | 30.7 | Very low | 118 Ų | 118 | 131.9 Ų | 131.9 | 72% | 0.715 | 78% | 0.784 | S | S | * | * | 46.7 | 103 | 91.5 | -169.2 | 0 | 0 | 0 | 0 | 114.6 | Y676 | Y676-V678 HydrophobicContact CD1-CG2 3.86Å; Y676-V678 HydrophobicContact CE1-CG2 4.03Å | |||
| 679 | S | 24.6 | Very low | 30.5 | Very low | 117 Ų | 117 | 130.2 Ų | 130.2 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | -172.3 | 142.7 | 116.7 | -160 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 680 | P | 44.6 | Very low | 30.9 | Very low | 92 Ų | 92 | 132.4 Ų | 132.4 | 60% | 0.597 | 79% | 0.79 | S | S | * | * | trans | -117.6 | 151.5 | -178.2 | 40.9 | -31.3 | 0 | 0 | 0 | 115.8 | ||||
| 681 | Y | 29.5 | Very low | 30.5 | Very low | 195 Ų | 195 | 131.1 Ų | 131.1 | 77% | 0.765 | 79% | 0.794 | S | S | * | * | trans | 61.6 | 159.5 | 170.3 | -63.2 | -73 | 0 | 0 | 0 | 115.8 | ||||
| 682 | F | 27 | Very low | 30.6 | Very low | 187 Ų | 187 | 133.2 Ų | 133.2 | 82% | 0.82 | 80% | 0.796 | S | S | * | * | cis | -139.9 | 177.4 | 25.7 | -91.3 | -84.6 | 0 | 0 | 0 | 114.8 | ||||
| 683 | H | 35.9 | Very low | 30 | Very low | 167 Ų | 167 | 132.6 Ų | 132.6 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | trans | -75.7 | 157.1 | 169 | -54.3 | -98.7 | 0 | 0 | 0 | 113.3 | ||||
| 684 | T | 28.5 | Very low | 30.9 | Very low | 156 Ų | 156 | 133.3 Ų | 133.3 | 96% | 0.957 | 80% | 0.801 | S | S | * | * | trans | -150.4 | 148.6 | 145.1 | 4.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 685 | G | 24.2 | Very low | 31.2 | Very low | 79 Ų | 79 | 132.4 Ų | 132.4 | 81% | 0.814 | 80% | 0.8 | S | S | * | * | trans | 174 | 8.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 686 | A | 32.2 | Very low | 30.6 | Very low | 94 Ų | 94 | 136 Ų | 136 | 78% | 0.777 | 81% | 0.808 | S | S | * | * | trans | -168.4 | 107.5 | 165.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 687 | V | 32.7 | Very low | 30.9 | Very low | 156 Ų | 156 | 130.4 Ų | 130.4 | 95% | 0.945 | 81% | 0.805 | S | S | * | * | -165.3 | 149.5 | 123.6 | -93 | 0 | 0 | 0 | 0 | 107.6 | |||||
| 688 | G | 26 | Very low | 31.1 | Very low | 87 Ų | 87 | 130.7 Ų | 130.7 | 90% | 0.897 | 80% | 0.8 | S | S | * | * | trans | -89.1 | 152.3 | -161 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 689 | G | 24.3 | Very low | 31.5 | Very low | 79 Ų | 79 | 128.6 Ų | 128.6 | 81% | 0.814 | 80% | 0.795 | S | S | * | * | trans | -128.2 | 142.8 | 158.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 690 | L | 35.2 | Very low | 32.9 | Very low | 185 Ų | 185 | 128.6 Ų | 128.6 | 97% | 0.969 | 79% | 0.792 | S | S | * | * | trans | -96.4 | 123.9 | -169.3 | -67.1 | 164.8 | 0 | 0 | 0 | 112.4 | ||||
| 691 | S | 23.1 | Very low | 33.5 | Very low | 120 Ų | 120 | 129.4 Ų | 129.4 | 84% | 0.839 | 79% | 0.787 | S | S | * | * | trans | -161.7 | 172.7 | 142.9 | -153.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 692 | M | 37.8 | Very low | 35.7 | Very low | 155 Ų | 155 | 124.3 Ų | 124.3 | 76% | 0.764 | 77% | 0.774 | S | S | * | * | trans | -70.2 | 163.7 | 170.2 | -52.6 | -91.2 | 47 | 0 | 0 | 109.4 | ||||
| 693 | D | 25.8 | Very low | 38.4 | Very low | 151 Ų | 151 | 115.6 Ų | 115.6 | 81% | 0.807 | 74% | 0.736 | S | S | * | * | cis | -142.5 | -177.6 | 27.9 | -139.2 | -70 | 0 | 0 | 0 | 113.7 | ||||
| 694 | G | 41.7 | Very low | 40.8 | Very low | 70 Ų | 70 | 110.9 Ų | 110.9 | 72% | 0.722 | 72% | 0.719 | S | S | * | * | trans | -90.8 | 115.1 | -179 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 695 | E | 33.9 | Very low | 43.6 | Very low | 183 Ų | 183 | 110.6 Ų | 110.6 | 86% | 0.855 | 70% | 0.704 | S | S | * | * | trans | -119.5 | 127.2 | 161.9 | -161.2 | 179.2 | 107.2 | 0 | 0 | 109.7 | A697 | E695-A697 PolarHBondContact O-N 2.75Š| ||
| 696 | E | 31.3 | Very low | 46.9 | Very low | 174 Ų | 174 | 107.8 Ų | 107.8 | 81% | 0.813 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 116.2 | 177.8 | -176.3 | 161.4 | 105.9 | 0 | 0 | 109 | P698 | E696-P698 WeakPolarHBondContact O-CD 3.15Š|
| 697 | A | 32.8 | Very low | 49.7 | Very low | 90 Ų | 90 | 106.9 Ų | 106.9 | 74% | 0.744 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 117.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | E695 A699 | E695-A697 PolarHBondContact O-N 2.75Å; A697-A699 PolarHBondContact O-N 3.49Å |
| 698 | P | 33.2 | Very low | 52.6 | Low | 90 Ų | 90 | 101.3 Ų | 101.3 | 58% | 0.584 | 62% | 0.62 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 138.8 | -158.1 | 17.3 | -30.9 | 0 | 0 | 0 | 111.8 | E696 E701 | E696-P698 WeakPolarHBondContact O-CD 3.15Å; P698-E701 HydrophobicContact CB-CG 4.48Å |
| 699 | A | 37.9 | Very low | 55.9 | Low | 74 Ų | 74 | 101 Ų | 101 | 61% | 0.612 | 60% | 0.598 | S | S | * | * | P | Polyproline II helix | trans | -47.7 | 146.2 | 165.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | A697 E701 | A697-A699 PolarHBondContact O-N 3.49Å; A699-E701 PolarHBondContact O-N 3.01Å |
| 700 | P | 52.3 | Low | 59.2 | Low | 117 Ų | 117 | 100.7 Ų | 100.7 | 76% | 0.76 | 58% | 0.577 | S | S | * | * | trans | -57.8 | 101.6 | -173.3 | 24.7 | -35.1 | 0 | 0 | 0 | 110 | D702 | P700-D702 PolarHBondContact O-N 3.35Š| ||
| 701 | E | 57.9 | Low | 62 | Low | 108 Ų | 108 | 91.9 Ų | 91.9 | 51% | 0.505 | 53% | 0.531 | S | S | . | . | trans | -57.7 | 135.4 | -167.4 | -63 | 172.9 | 152.2 | 0 | 0 | 110.3 | P698 A699 V703 W706 | P698-E701 HydrophobicContact CB-CG 4.48Å; A699-E701 PolarHBondContact O-N 3.01Å; E701-V703 PolarHBondContact O-N 2.87Å; E701-W706 PolarHBondContact OE2-NE1 3.48Å | ||
| 702 | D | 76.1 | Confident | 65.3 | Low | 89 Ų | 89 | 86.5 Ų | 86.5 | 48% | 0.476 | 49% | 0.494 | S | S | . | . | trans | -57.1 | 114.2 | 174.4 | -57.1 | -69.3 | 0 | 0 | 0 | 107.7 | P700 T704 K705 | P700-D702 PolarHBondContact O-N 3.35Å; D702-T704 PolarHBondContact O-N 2.88Å; D702-K705 HydrophobicContact CB-CD 4.06Å; D702-K705 HydrophobicContact CB-CG 4.27Å; D702-K705 WeakPolarHBondContact O-CB 3.19Å; D702-K705 PolarHBondContact O-N 2.99Å; D702-K705 WeakPolarHBondContact OD2-CE 3.47Å; D702-K705 IonicContact OD2-NZ 3.38Å; D702-K705 PolarHBondContact OD2-NZ 3.31Å | ||
| 703 | V | 84.4 | Confident | 67.9 | Low | 4 Ų | 4 | 83.1 Ų | 83.1 | 2% | 0.024 | 49% | 0.485 | C | S | . | . | G | 310 helix | trans | -54.1 | -27.5 | -174 | 175.8 | 0 | 0 | 0 | 0 | 111.5 | E701 K705 W706 G735 L738 P739 R767 L768 | E701-V703 PolarHBondContact O-N 2.87Å; V703-K705 PolarHBondContact O-N 3.41Å; V703-W706 HydrophobicContact CG1-CD2 4.25Å; V703-W706 HydrophobicContact CG1-CE3 3.83Å; V703-W706 HydrophobicContact CG1-CZ3 4.17Å; V703-W706 WeakPolarHBondContact O-CB 3.24Å; V703-W706 PolarHBondContact O-N 3.14Å; V703-G735 CarbonylContact C-O 3.54Å; V703-G735 CarbonylContact O-C 3.56Å; V703-G735 WeakPolarHBondContact O-CA 3.49Å; V703-L738 HydrophobicContact CG1-CD2 4.16Å; V703-P739 HydrophobicContact CG1-CG 4.42Å; V703-R767 HydrophobicContact CG2-CB 3.64Å; V703-L768 HydrophobicContact CB-CD2 3.8Å; V703-L768 HydrophobicContact CB-CG 4.38Å; V703-L768 HydrophobicContact CG1-CD2 4.39Å; V703-L768 HydrophobicContact CG2-CD2 4.12Å; V703-L768 HydrophobicContact CG2-CG 4.3Å |
| 704 | T | 84.9 | Confident | 71.1 | Confident | 67 Ų | 67 | 76.9 Ų | 76.9 | 41% | 0.411 | 45% | 0.451 | S | S | . | . | G | 310 helix | trans | -60.7 | -19.7 | 174 | 55.2 | 0 | 0 | 0 | 0 | 114.9 | D702 G735 E736 | D702-T704 PolarHBondContact O-N 2.88Å; T704-G735 WeakPolarHBondContact CA-O 3.39Å; T704-E736 VanDerWaalsContact O-CG 3.26Å; T704-E736 WeakPolarHBondContact O-CG 3.24Å |
| 705 | K | 87.9 | Confident | 73.5 | Confident | 151 Ų | 151 | 73.6 Ų | 73.6 | 66% | 0.657 | 42% | 0.417 | S | S | * | . | G | 310 helix | trans | -88.8 | -7.3 | 178.9 | -65.5 | 171.1 | 178.7 | 161.1 | 0 | 113.5 | D702 V703 | D702-K705 HydrophobicContact CB-CD 4.06Å; D702-K705 HydrophobicContact CB-CG 4.27Å; D702-K705 WeakPolarHBondContact O-CB 3.19Å; D702-K705 PolarHBondContact O-N 2.99Å; D702-K705 WeakPolarHBondContact OD2-CE 3.47Å; D702-K705 IonicContact OD2-NZ 3.38Å; D702-K705 PolarHBondContact OD2-NZ 3.31Å; V703-K705 PolarHBondContact O-N 3.41Å |
| 706 | W | 92.9 | Very high | 76.2 | Confident | 20 Ų | 20 | 66.6 Ų | 66.6 | 8% | 0.076 | 39% | 0.394 | C | S | . | . | trans | -70.2 | 135.2 | -176.3 | -72.1 | -5.9 | 0 | 0 | 0 | 112.2 | E701 V703 D710 V711 F714 G735 L738 | E701-W706 PolarHBondContact OE2-NE1 3.48Å; V703-W706 HydrophobicContact CG1-CD2 4.25Å; V703-W706 HydrophobicContact CG1-CE3 3.83Å; V703-W706 HydrophobicContact CG1-CZ3 4.17Å; V703-W706 WeakPolarHBondContact O-CB 3.24Å; V703-W706 PolarHBondContact O-N 3.14Å; W706-D710 HydrophobicContact CB-CB 3.92Å; W706-D710 HydrophobicContact CG-CB 4.11Å; W706-V711 HydrophobicContact CB-CG2 4.17Å; W706-V711 HydrophobicContact CE3-CG2 4.29Å; W706-F714 HydrophobicContact CH2-CB 4.09Å; W706-F714 HydrophobicContact CH2-CD1 4.35Å; W706-F714 AromaticContact CH2-CD2 3.72Å; W706-F714 HydrophobicContact CH2-CD2 3.72Å; W706-F714 HydrophobicContact CH2-CE2 4.21Å; W706-F714 AromaticContact CH2-CG 3.79Å; W706-F714 HydrophobicContact CH2-CG 3.79Å; W706-F714 HydrophobicContact CZ3-CB 3.85Å; W706-F714 AromaticContact CZ3-CD1 3.75Å; W706-F714 HydrophobicContact CZ3-CD1 3.75Å; W706-F714 AromaticContact CZ3-CD2 3.97Å; W706-F714 HydrophobicContact CZ3-CD2 3.97Å; W706-F714 HydrophobicContact CZ3-CE1 4.26Å; W706-F714 HydrophobicContact CZ3-CE2 4.45Å; W706-F714 AromaticContact CZ3-CG 3.57Å; W706-F714 HydrophobicContact CZ3-CG 3.57Å; W706-G735 WeakPolarHBondContact O-CA 3.31Å; W706-G735 PolarHBondContact O-N 2.97Å; W706-L738 HydrophobicContact CE3-CD2 4.09Å; W706-L738 HydrophobicContact CZ3-CD2 4.11Å | ||
| 707 | T | 92.4 | Very high | 79 | Confident | 75 Ų | 75 | 61.6 Ų | 61.6 | 46% | 0.46 | 39% | 0.389 | S | S | . | . | trans | -76.9 | 168.7 | 169.7 | 71.6 | 0 | 0 | 0 | 0 | 111.1 | D709 D710 V711 | T707-D709 PolarHBondContact O-N 3.27Å; T707-D709 PolarHBondContact OG1-N 3Å; T707-D710 VanDerWaalsContact CB-OD2 3.3Å; T707-D710 WeakPolarHBondContact CB-OD2 3.5Å; T707-D710 WeakPolarHBondContact CG2-OD2 3.47Å; T707-D710 PolarHBondContact N-OD2 3.06Å; T707-D710 PolarHBondContact O-N 3.44Å; T707-D710 VanDerWaalsContact O-N 3.08Å; T707-D710 VanDerWaalsContact OG1-CG 3.3Å; T707-D710 PolarHBondContact OG1-N 3.02Å; T707-D710 PolarHBondContact OG1-OD2 3.21Å; T707-V711 WeakPolarHBondContact O-CG2 3.4Å; T707-V711 PolarHBondContact O-N 3.13Å | ||
| 708 | V | 93.9 | Very high | 81.8 | Confident | 38 Ų | 38 | 58.7 Ų | 58.7 | 23% | 0.23 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -56.4 | -33.8 | 173.2 | -174.7 | 0 | 0 | 0 | 0 | 111.7 | C712 G732 I733 D734 | V708-C712 WeakPolarHBondContact O-CB 3.29Å; V708-C712 PolarHBondContact O-N 3.26Å; V708-C712 PolarHBondContact O-SG 3.39Å; V708-G732 WeakPolarHBondContact CG2-O 3.42Å; V708-I733 WeakPolarHBondContact CA-O 3.33Å; V708-D734 HydrophobicContact CG2-CB 4.19Å |
| 709 | D | 94.3 | Very high | 84.4 | Confident | 81 Ų | 81 | 58.7 Ų | 58.7 | 43% | 0.433 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -70.6 | -35.9 | 176.8 | -87 | -83.3 | 0 | 0 | 0 | 113 | T707 C712 S713 R729 | T707-D709 PolarHBondContact O-N 3.27Å; T707-D709 PolarHBondContact OG1-N 3Å; D709-C712 PolarHBondContact O-N 2.98Å; D709-S713 WeakPolarHBondContact O-CB 3.46Å; D709-S713 PolarHBondContact O-N 2.79Å; D709-S713 PolarHBondContact O-OG 3.12Å; D709-R729 IonicContact OD1-CZ 3.93Å; D709-R729 IonicContact OD1-NH1 2.95Å; D709-R729 PolarHBondContact OD1-NH1 3.36Å; D709-R729 IonicContact OD1-NH2 2.67Å; D709-R729 PolarHBondContact OD1-NH2 2.99Å; D709-R729 IonicContact OD2-CZ 2.68Å; D709-R729 IonicContact OD2-NH1 3.2Å; D709-R729 PolarHBondContact OD2-NH1 3.06Å |
| 710 | D | 93.3 | Very high | 86.7 | Confident | 72 Ų | 72 | 58.1 Ų | 58.1 | 39% | 0.385 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -69.6 | -42.2 | 174.2 | -55.2 | -53.6 | 0 | 0 | 0 | 111.2 | W706 T707 S713 F714 | W706-D710 HydrophobicContact CB-CB 3.92Å; W706-D710 HydrophobicContact CG-CB 4.11Å; T707-D710 VanDerWaalsContact CB-OD2 3.3Å; T707-D710 WeakPolarHBondContact CB-OD2 3.5Å; T707-D710 WeakPolarHBondContact CG2-OD2 3.47Å; T707-D710 PolarHBondContact N-OD2 3.06Å; T707-D710 PolarHBondContact O-N 3.44Å; T707-D710 VanDerWaalsContact O-N 3.08Å; T707-D710 VanDerWaalsContact OG1-CG 3.3Å; T707-D710 PolarHBondContact OG1-N 3.02Å; T707-D710 PolarHBondContact OG1-OD2 3.21Å; D710-S713 PolarHBondContact O-N 3.28Å; D710-F714 VanDerWaalsContact O-CB 3.28Å; D710-F714 WeakPolarHBondContact O-CB 3.46Å; D710-F714 PolarHBondContact O-N 2.99Å |
| 711 | V | 93.5 | Very high | 88.4 | Confident | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -60.6 | -44.7 | 172.7 | 175.7 | 0 | 0 | 0 | 0 | 110.8 | W706 T707 F714 V715 F728 I733 L738 | W706-V711 HydrophobicContact CB-CG2 4.17Å; W706-V711 HydrophobicContact CE3-CG2 4.29Å; T707-V711 WeakPolarHBondContact O-CG2 3.4Å; T707-V711 PolarHBondContact O-N 3.13Å; V711-F714 PolarHBondContact O-N 3.09Å; V711-V715 HydrophobicContact CG1-CG2 4.49Å; V711-V715 WeakPolarHBondContact O-CG2 3.49Å; V711-V715 PolarHBondContact O-N 2.98Å; V711-F728 HydrophobicContact CG1-CD1 3.8Å; V711-I733 WeakPolarHBondContact CB-O 3.18Å; V711-I733 HydrophobicContact CG1-CB 4.47Å; V711-I733 HydrophobicContact CG1-CG2 4.08Å; V711-L738 HydrophobicContact CG1-CD1 4.14Å; V711-L738 HydrophobicContact CG1-CD2 4.06Å; V711-L738 HydrophobicContact CG1-CG 4.5Å; V711-L738 HydrophobicContact CG2-CB 4.49Å; V711-L738 HydrophobicContact CG2-CD2 4.02Å |
| 712 | C | 93.3 | Very high | 89.8 | Confident | 7 Ų | 7 | 49 Ų | 49 | 5% | 0.047 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -62.6 | -41.9 | 175.4 | -72.6 | 0 | 0 | 0 | 0 | 112.1 | V708 D709 V715 G716 T725 | V708-C712 WeakPolarHBondContact O-CB 3.29Å; V708-C712 PolarHBondContact O-N 3.26Å; V708-C712 PolarHBondContact O-SG 3.39Å; D709-C712 PolarHBondContact O-N 2.98Å; C712-V715 PolarHBondContact O-N 2.89Å; C712-G716 PolarHBondContact O-N 2.66Å; C712-T725 VanDerWaalsContact O-CG2 3.31Å; C712-T725 WeakPolarHBondContact O-CG2 3.44Å; C712-T725 PolarHBondContact SG-O 3.05Å |
| 713 | S | 92.8 | Very high | 90.4 | Very high | 85 Ų | 85 | 50.5 Ų | 50.5 | 59% | 0.594 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -65.1 | -40.9 | 177.2 | -60.9 | 0 | 0 | 0 | 0 | 111.5 | D709 D710 G716 G717 | D709-S713 WeakPolarHBondContact O-CB 3.46Å; D709-S713 PolarHBondContact O-N 2.79Å; D709-S713 PolarHBondContact O-OG 3.12Å; D710-S713 PolarHBondContact O-N 3.28Å; S713-G716 PolarHBondContact O-N 3.22Å; S713-G717 PolarHBondContact O-N 3.21Å |
| 714 | F | 92.3 | Very high | 90.7 | Very high | 20 Ų | 20 | 51.1 Ų | 51.1 | 9% | 0.088 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -63.3 | -47.4 | 174.2 | 166.1 | -107 | 0 | 0 | 0 | 112.8 | W706 D710 V711 G716 G717 L718 L738 Q763 V764 | W706-F714 HydrophobicContact CH2-CB 4.09Å; W706-F714 HydrophobicContact CH2-CD1 4.35Å; W706-F714 AromaticContact CH2-CD2 3.72Å; W706-F714 HydrophobicContact CH2-CD2 3.72Å; W706-F714 HydrophobicContact CH2-CE2 4.21Å; W706-F714 AromaticContact CH2-CG 3.79Å; W706-F714 HydrophobicContact CH2-CG 3.79Å; W706-F714 HydrophobicContact CZ3-CB 3.85Å; W706-F714 AromaticContact CZ3-CD1 3.75Å; W706-F714 HydrophobicContact CZ3-CD1 3.75Å; W706-F714 AromaticContact CZ3-CD2 3.97Å; W706-F714 HydrophobicContact CZ3-CD2 3.97Å; W706-F714 HydrophobicContact CZ3-CE1 4.26Å; W706-F714 HydrophobicContact CZ3-CE2 4.45Å; W706-F714 AromaticContact CZ3-CG 3.57Å; W706-F714 HydrophobicContact CZ3-CG 3.57Å; D710-F714 VanDerWaalsContact O-CB 3.28Å; D710-F714 WeakPolarHBondContact O-CB 3.46Å; D710-F714 PolarHBondContact O-N 2.99Å; V711-F714 PolarHBondContact O-N 3.09Å; F714-G716 VanDerWaalsContact C-N 3.31Å; F714-G716 PolarHBondContact O-N 3.15Å; F714-G717 PolarHBondContact O-N 3.44Å; F714-L718 HydrophobicContact CE1-CD1 4.29Å; F714-L718 HydrophobicContact CZ-CD1 4.16Å; F714-L738 HydrophobicContact CD1-CD2 4.26Å; F714-L738 HydrophobicContact CE1-CD2 4.27Å; F714-Q763 HydrophobicContact CE2-CB 4.36Å; F714-Q763 HydrophobicContact CE2-CG 3.49Å; F714-Q763 VanDerWaalsContact CE2-CG 3.49Å; F714-Q763 HydrophobicContact CZ-CB 3.86Å; F714-Q763 HydrophobicContact CZ-CG 3.5Å; F714-V764 HydrophobicContact CE1-CG2 3.67Å; F714-V764 HydrophobicContact CZ-CG2 4.03Å |
| 715 | V | 92.6 | Very high | 91 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -66.5 | -34.6 | 176.1 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | V711 C712 L718 C721 T725 F728 I760 | V711-V715 HydrophobicContact CG1-CG2 4.49Å; V711-V715 WeakPolarHBondContact O-CG2 3.49Å; V711-V715 PolarHBondContact O-N 2.98Å; C712-V715 PolarHBondContact O-N 2.89Å; V715-L718 PolarHBondContact O-N 3.32Å; V715-C721 HydrophobicContact CG1-CB 4.21Å; V715-C721 WeakPolarHBondContact O-CB 3.35Å; V715-T725 HydrophobicContact CB-CG2 4.15Å; V715-T725 HydrophobicContact CG1-CG2 3.96Å; V715-F728 HydrophobicContact CG1-CD2 4.26Å; V715-F728 HydrophobicContact CG1-CE2 4.36Å; V715-F728 HydrophobicContact CG2-CD1 4.13Å; V715-F728 HydrophobicContact CG2-CD2 4.38Å; V715-F728 HydrophobicContact CG2-CE1 4.14Å; V715-F728 HydrophobicContact CG2-CE2 4.38Å; V715-F728 HydrophobicContact CG2-CG 4.26Å; V715-F728 HydrophobicContact CG2-CZ 4.27Å; V715-I760 HydrophobicContact CG1-CD1 3.98Å; V715-I760 HydrophobicContact CG2-CD1 4.27Å; V715-I760 HydrophobicContact CG2-CG2 4.49Å |
| 716 | G | 91.4 | Very high | 91.2 | Very high | 37 Ų | 37 | 50.7 Ų | 50.7 | 38% | 0.381 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65.3 | -38.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | C712 S713 F714 L718 T725 | C712-G716 PolarHBondContact O-N 2.66Å; S713-G716 PolarHBondContact O-N 3.22Å; F714-G716 VanDerWaalsContact C-N 3.31Å; F714-G716 PolarHBondContact O-N 3.15Å; G716-L718 PolarHBondContact O-N 2.97Å; G716-T725 VanDerWaalsContact N-CG2 3.25Å |
| 717 | G | 90.1 | Very high | 91.2 | Very high | 69 Ų | 69 | 51.3 Ų | 51.3 | 71% | 0.711 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.7 | -6.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | S713 F714 | S713-G717 PolarHBondContact O-N 3.21Å; F714-G717 PolarHBondContact O-N 3.44Å |
| 718 | L | 91.4 | Very high | 91.2 | Very high | 28 Ų | 28 | 47.7 Ų | 47.7 | 15% | 0.147 | 30% | 0.302 | C | S | . | . | S | Bend | trans | -91.3 | 129.2 | 178.2 | -71.3 | 175.2 | 0 | 0 | 0 | 112.1 | F714 V715 G716 G720 C721 I760 Q763 | F714-L718 HydrophobicContact CE1-CD1 4.29Å; F714-L718 HydrophobicContact CZ-CD1 4.16Å; V715-L718 PolarHBondContact O-N 3.32Å; G716-L718 PolarHBondContact O-N 2.97Å; L718-G720 PolarHBondContact O-N 3.31Å; L718-G720 VanDerWaalsContact O-N 3.14Å; L718-C721 HydrophobicContact CB-CB 3.7Å; L718-C721 WeakPolarHBondContact O-CB 3.48Å; L718-C721 PolarHBondContact O-N 3.34Å; L718-I760 HydrophobicContact CD1-CG1 3.91Å; L718-Q763 HydrophobicContact CD1-CB 4.39Å; L718-Q763 HydrophobicContact CD2-CB 4.37Å; L718-Q763 HydrophobicContact CD2-CG 4.09Å |
| 719 | S | 87.7 | Confident | 91.1 | Very high | 91 Ų | 91 | 51.5 Ų | 51.5 | 64% | 0.636 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.3 | 116.3 | -174.3 | 59.8 | 0 | 0 | 0 | 0 | 112.4 | C721 K759 | S719-C721 VanDerWaalsContact C-N 3.29Å; S719-C721 PolarHBondContact O-N 3.14Å; S719-K759 PolarHBondContact O-NZ 3.25Å; S719-K759 PolarHBondContact OG-NZ 3.05Å |
| 720 | G | 85.4 | Confident | 91 | Very high | 61 Ų | 61 | 53.2 Ų | 53.2 | 63% | 0.629 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.1 | 21.6 | -176.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | L718 | L718-G720 PolarHBondContact O-N 3.31Å; L718-G720 VanDerWaalsContact O-N 3.14Å |
| 721 | C | 87.9 | Confident | 90.9 | Very high | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 32% | 0.322 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -112 | -10.6 | 172.7 | -59.4 | 0 | 0 | 0 | 0 | 113.2 | V715 L718 S719 E723 Y724 I760 | V715-C721 HydrophobicContact CG1-CB 4.21Å; V715-C721 WeakPolarHBondContact O-CB 3.35Å; L718-C721 HydrophobicContact CB-CB 3.7Å; L718-C721 WeakPolarHBondContact O-CB 3.48Å; L718-C721 PolarHBondContact O-N 3.34Å; S719-C721 VanDerWaalsContact C-N 3.29Å; S719-C721 PolarHBondContact O-N 3.14Å; C721-E723 PolarHBondContact O-N 3.1Å; C721-E723 VanDerWaalsContact O-N 3.14Å; C721-Y724 PolarHBondContact O-N 2.79Å; C721-I760 HydrophobicContact CB-CD1 4.47Å |
| 722 | G | 87.8 | Confident | 90.7 | Very high | 33 Ų | 33 | 56.7 Ų | 56.7 | 34% | 0.34 | 34% | 0.342 | S | S | . | . | G | 310 helix | trans | -53.5 | -33.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 115 | Y724 T725 | G722-Y724 PolarHBondContact O-N 2.85Å; G722-T725 WeakPolarHBondContact O-CB 3.22Å; G722-T725 WeakPolarHBondContact O-CG2 3.44Å; G722-T725 PolarHBondContact O-N 3.42Å; G722-T725 PolarHBondContact O-OG1 3.24Å |
| 723 | E | 89 | Confident | 90.7 | Very high | 121 Ų | 121 | 56.8 Ų | 56.8 | 57% | 0.565 | 34% | 0.342 | S | S | * | . | G | 310 helix | trans | -60.9 | -24.5 | 176.9 | 64.3 | -177.5 | -174.4 | 0 | 0 | 113.3 | C721 K753 | C721-E723 PolarHBondContact O-N 3.1Å; C721-E723 VanDerWaalsContact O-N 3.14Å; E723-K753 IonicContact OE1-NZ 3.61Å; E723-K753 PolarHBondContact OE1-NZ 3.27Å; E723-K753 IonicContact OE2-NZ 3.52Å |
| 724 | Y | 89.6 | Confident | 90.7 | Very high | 17 Ų | 17 | 55.3 Ų | 55.3 | 7% | 0.067 | 33% | 0.327 | C | S | . | . | G | 310 helix | trans | -92.4 | -9.3 | -179.4 | -54.5 | -73.8 | 0 | 0 | 0 | 114 | C721 G722 R726 V727 F728 L752 K753 P756 | C721-Y724 PolarHBondContact O-N 2.79Å; G722-Y724 PolarHBondContact O-N 2.85Å; Y724-R726 PolarHBondContact O-N 3.24Å; Y724-V727 WeakPolarHBondContact O-CA 3.31Å; Y724-V727 WeakPolarHBondContact O-CB 3.34Å; Y724-V727 PolarHBondContact O-N 3.17Å; Y724-F728 WeakPolarHBondContact O-CD2 3.44Å; Y724-F728 PolarHBondContact O-N 2.77Å; Y724-F728 VanDerWaalsContact O-N 3.1Å; Y724-L752 HydrophobicContact CD1-CB 4.5Å; Y724-L752 HydrophobicContact CD1-CD1 3.71Å; Y724-L752 HydrophobicContact CD1-CG 3.58Å; Y724-L752 HydrophobicContact CD2-CG 4.24Å; Y724-L752 HydrophobicContact CE1-CB 4.33Å; Y724-L752 HydrophobicContact CE1-CD1 4.31Å; Y724-L752 HydrophobicContact CE1-CG 3.87Å; Y724-L752 HydrophobicContact CG-CD1 4.09Å; Y724-L752 HydrophobicContact CG-CD2 4.32Å; Y724-L752 HydrophobicContact CG-CG 3.77Å; Y724-K753 VanDerWaalsContact OH-CD 3.27Å; Y724-K753 WeakPolarHBondContact OH-CD 3.48Å; Y724-K753 WeakPolarHBondContact OH-CE 3.49Å; Y724-K753 WeakPolarHBondContact OH-CG 3.44Å; Y724-K753 PolarHBondContact OH-N 2.81Å; Y724-K753 PolarHBondContact OH-NZ 2.87Å; Y724-P756 HydrophobicContact CD2-CB 3.95Å; Y724-P756 HydrophobicContact CD2-CG 4.39Å; Y724-P756 HydrophobicContact CE2-CB 3.52Å; Y724-P756 HydrophobicContact CE2-CG 3.52Å |
| 725 | T | 92.1 | Very high | 90.6 | Very high | 39 Ų | 39 | 54.3 Ų | 54.3 | 24% | 0.239 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -55 | -38.5 | -179.8 | 53.9 | 0 | 0 | 0 | 0 | 112.6 | C712 V715 G716 G722 V727 F728 R729 | C712-T725 VanDerWaalsContact O-CG2 3.31Å; C712-T725 WeakPolarHBondContact O-CG2 3.44Å; C712-T725 PolarHBondContact SG-O 3.05Å; V715-T725 HydrophobicContact CB-CG2 4.15Å; V715-T725 HydrophobicContact CG1-CG2 3.96Å; G716-T725 VanDerWaalsContact N-CG2 3.25Å; G722-T725 WeakPolarHBondContact O-CB 3.22Å; G722-T725 WeakPolarHBondContact O-CG2 3.44Å; G722-T725 PolarHBondContact O-N 3.42Å; G722-T725 PolarHBondContact O-OG1 3.24Å; T725-V727 VanDerWaalsContact C-N 3.33Å; T725-V727 PolarHBondContact O-N 3.29Å; T725-F728 PolarHBondContact O-N 3.41Å; T725-R729 PolarHBondContact O-N 3.33Å |
| 726 | R | 91.4 | Very high | 90.3 | Very high | 170 Ų | 170 | 60.3 Ų | 60.3 | 64% | 0.642 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -59.6 | -41.4 | 173.3 | 179.8 | 176.2 | 169 | 171.2 | 0.2 | 112.3 | Y724 R729 E730 | Y724-R726 PolarHBondContact O-N 3.24Å; R726-R729 WeakPolarHBondContact O-CB 3.26Å; R726-R729 PolarHBondContact O-N 3.27Å; R726-E730 HydrophobicContact CG-CG 4.28Å; R726-E730 IonicContact CZ-OE1 2.67Å; R726-E730 IonicContact NE-OE1 2.89Å; R726-E730 PolarHBondContact NE-OE1 3.21Å; R726-E730 IonicContact NE-OE2 2.82Å; R726-E730 IonicContact NH2-OE1 3.2Å; R726-E730 PolarHBondContact NH2-OE1 2.77Å; R726-E730 WeakPolarHBondContact O-CB 3.36Å; R726-E730 WeakPolarHBondContact O-CG 3.32Å; R726-E730 PolarHBondContact O-N 2.88Å |
| 727 | V | 92.3 | Very high | 90.2 | Very high | 33 Ų | 33 | 61 Ų | 61 | 20% | 0.2 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -67.1 | -41.7 | 179 | -172.9 | 0 | 0 | 0 | 0 | 111 | Y724 T725 R729 E730 Q731 M750 | Y724-V727 WeakPolarHBondContact O-CA 3.31Å; Y724-V727 WeakPolarHBondContact O-CB 3.34Å; Y724-V727 PolarHBondContact O-N 3.17Å; T725-V727 VanDerWaalsContact C-N 3.33Å; T725-V727 PolarHBondContact O-N 3.29Å; V727-R729 VanDerWaalsContact C-N 3.28Å; V727-R729 PolarHBondContact O-N 2.99Å; V727-E730 PolarHBondContact O-N 3.2Å; V727-Q731 HydrophobicContact CG1-CG 4.26Å; V727-Q731 WeakPolarHBondContact O-CB 3.49Å; V727-Q731 VanDerWaalsContact O-CG 3.3Å; V727-Q731 WeakPolarHBondContact O-CG 3.47Å; V727-Q731 PolarHBondContact O-N 3.05Å; V727-M750 HydrophobicContact CG1-CB 3.85Å; V727-M750 HydrophobicContact CG1-CG 3.86Å |
| 728 | F | 92.8 | Very high | 90.2 | Very high | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -62.2 | -36.7 | 174.3 | -81 | -105.2 | 0 | 0 | 0 | 111.9 | V711 V715 Y724 T725 G732 I733 L738 L741 L746 M750 L752 I760 | V711-F728 HydrophobicContact CG1-CD1 3.8Å; V715-F728 HydrophobicContact CG1-CD2 4.26Å; V715-F728 HydrophobicContact CG1-CE2 4.36Å; V715-F728 HydrophobicContact CG2-CD1 4.13Å; V715-F728 HydrophobicContact CG2-CD2 4.38Å; V715-F728 HydrophobicContact CG2-CE1 4.14Å; V715-F728 HydrophobicContact CG2-CE2 4.38Å; V715-F728 HydrophobicContact CG2-CG 4.26Å; V715-F728 HydrophobicContact CG2-CZ 4.27Å; Y724-F728 WeakPolarHBondContact O-CD2 3.44Å; Y724-F728 PolarHBondContact O-N 2.77Å; Y724-F728 VanDerWaalsContact O-N 3.1Å; T725-F728 PolarHBondContact O-N 3.41Å; F728-G732 PolarHBondContact O-N 2.69Å; F728-I733 HydrophobicContact CB-CB 4.44Å; F728-I733 HydrophobicContact CB-CG1 4.5Å; F728-I733 HydrophobicContact CD1-CB 3.82Å; F728-I733 HydrophobicContact CD1-CG1 3.94Å; F728-I733 HydrophobicContact CD1-CG2 3.81Å; F728-I733 HydrophobicContact CE1-CG2 4.2Å; F728-I733 HydrophobicContact CG-CG1 4.44Å; F728-I733 PolarHBondContact O-N 3.38Å; F728-L738 HydrophobicContact CD1-CD1 4.44Å; F728-L738 HydrophobicContact CE1-CD1 3.79Å; F728-L741 HydrophobicContact CE1-CD1 3.87Å; F728-L741 HydrophobicContact CZ-CD1 4.49Å; F728-L746 HydrophobicContact CE1-CD2 4.44Å; F728-L746 HydrophobicContact CE2-CD2 4.35Å; F728-L746 HydrophobicContact CZ-CD2 3.63Å; F728-M750 HydrophobicContact CE2-SD 4.22Å; F728-M750 HydrophobicContact CZ-SD 4.22Å; F728-L752 HydrophobicContact CE2-CD1 4.32Å; F728-L752 HydrophobicContact CE2-CD2 4.23Å; F728-I760 HydrophobicContact CE2-CD1 3.9Å; F728-I760 HydrophobicContact CZ-CD1 3.85Å; F728-I760 HydrophobicContact CZ-CG2 4.19Å |
| 729 | R | 92.9 | Very high | 90.1 | Very high | 118 Ų | 118 | 58.9 Ų | 58.9 | 45% | 0.445 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -68.1 | -45.6 | 173.1 | -169 | 176.1 | -67.4 | -86.2 | 1.5 | 112.9 | D709 T725 R726 V727 Q731 G732 | D709-R729 IonicContact OD1-CZ 3.93Å; D709-R729 IonicContact OD1-NH1 2.95Å; D709-R729 PolarHBondContact OD1-NH1 3.36Å; D709-R729 IonicContact OD1-NH2 2.67Å; D709-R729 PolarHBondContact OD1-NH2 2.99Å; D709-R729 IonicContact OD2-CZ 2.68Å; D709-R729 IonicContact OD2-NH1 3.2Å; D709-R729 PolarHBondContact OD2-NH1 3.06Å; T725-R729 PolarHBondContact O-N 3.33Å; R726-R729 WeakPolarHBondContact O-CB 3.26Å; R726-R729 PolarHBondContact O-N 3.27Å; V727-R729 VanDerWaalsContact C-N 3.28Å; V727-R729 PolarHBondContact O-N 2.99Å; R729-Q731 VanDerWaalsContact C-N 3.31Å; R729-Q731 PolarHBondContact O-N 3.13Å; R729-G732 PolarHBondContact O-N 2.92Å; R729-G732 VanDerWaalsContact O-N 3.11Å |
| 730 | E | 91.4 | Very high | 90.1 | Very high | 117 Ų | 117 | 60.7 Ų | 60.7 | 55% | 0.547 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -68.1 | -29.6 | -179.2 | -75.3 | 173.2 | 156.1 | 0 | 0 | 112.7 | R726 V727 | R726-E730 HydrophobicContact CG-CG 4.28Å; R726-E730 IonicContact CZ-OE1 2.67Å; R726-E730 IonicContact NE-OE1 2.89Å; R726-E730 PolarHBondContact NE-OE1 3.21Å; R726-E730 IonicContact NE-OE2 2.82Å; R726-E730 IonicContact NH2-OE1 3.2Å; R726-E730 PolarHBondContact NH2-OE1 2.77Å; R726-E730 WeakPolarHBondContact O-CB 3.36Å; R726-E730 WeakPolarHBondContact O-CG 3.32Å; R726-E730 PolarHBondContact O-N 2.88Å; V727-E730 PolarHBondContact O-N 3.2Å |
| 731 | Q | 91.3 | Very high | 90.3 | Very high | 105 Ų | 105 | 58.7 Ų | 58.7 | 49% | 0.491 | 30% | 0.299 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.1 | -1.2 | 172.3 | -62.8 | -66.1 | -26 | 0 | 0 | 113.4 | V727 R729 I733 M750 | V727-Q731 HydrophobicContact CG1-CG 4.26Å; V727-Q731 WeakPolarHBondContact O-CB 3.49Å; V727-Q731 VanDerWaalsContact O-CG 3.3Å; V727-Q731 WeakPolarHBondContact O-CG 3.47Å; V727-Q731 PolarHBondContact O-N 3.05Å; R729-Q731 VanDerWaalsContact C-N 3.31Å; R729-Q731 PolarHBondContact O-N 3.13Å; Q731-I733 VanDerWaalsContact C-N 3.31Å; Q731-I733 HydrophobicContact CB-CD1 3.87Å; Q731-I733 HydrophobicContact CB-CG1 3.92Å; Q731-I733 PolarHBondContact O-N 2.78Å; Q731-M750 HydrophobicContact CG-CG 4.13Å |
| 732 | G | 90 | Very high | 90.4 | Very high | 39 Ų | 39 | 62.3 Ų | 62.3 | 40% | 0.402 | 32% | 0.321 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 63.5 | 29.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | V708 F728 R729 D734 | V708-G732 WeakPolarHBondContact CG2-O 3.42Å; F728-G732 PolarHBondContact O-N 2.69Å; R729-G732 PolarHBondContact O-N 2.92Å; R729-G732 VanDerWaalsContact O-N 3.11Å; G732-D734 PolarHBondContact O-N 2.99Å |
| 733 | I | 92.6 | Very high | 90.6 | Very high | 10 Ų | 10 | 64 Ų | 64 | 5% | 0.051 | 32% | 0.32 | C | S | . | . | trans | -69.4 | 113.5 | -174.3 | -54.3 | -54.6 | 0 | 0 | 0 | 110.7 | V708 V711 F728 Q731 L738 L741 | V708-I733 WeakPolarHBondContact CA-O 3.33Å; V711-I733 WeakPolarHBondContact CB-O 3.18Å; V711-I733 HydrophobicContact CG1-CB 4.47Å; V711-I733 HydrophobicContact CG1-CG2 4.08Å; F728-I733 HydrophobicContact CB-CB 4.44Å; F728-I733 HydrophobicContact CB-CG1 4.5Å; F728-I733 HydrophobicContact CD1-CB 3.82Å; F728-I733 HydrophobicContact CD1-CG1 3.94Å; F728-I733 HydrophobicContact CD1-CG2 3.81Å; F728-I733 HydrophobicContact CE1-CG2 4.2Å; F728-I733 HydrophobicContact CG-CG1 4.44Å; F728-I733 PolarHBondContact O-N 3.38Å; Q731-I733 VanDerWaalsContact C-N 3.31Å; Q731-I733 HydrophobicContact CB-CD1 3.87Å; Q731-I733 HydrophobicContact CB-CG1 3.92Å; Q731-I733 PolarHBondContact O-N 2.78Å; I733-L738 HydrophobicContact CG2-CB 4.02Å; I733-L738 HydrophobicContact CG2-CD1 4.31Å; I733-L741 HydrophobicContact CD1-CD2 4.06Å; I733-L741 HydrophobicContact CG2-CD1 3.85Å | ||
| 734 | D | 92.7 | Very high | 90.5 | Very high | 53 Ų | 53 | 64.7 Ų | 64.7 | 28% | 0.283 | 32% | 0.324 | S | S | . | . | trans | -99.2 | -176.8 | 175.6 | 67.5 | 7.1 | 0 | 0 | 0 | 112.6 | V708 G732 E736 T737 L738 | V708-D734 HydrophobicContact CG2-CB 4.19Å; G732-D734 PolarHBondContact O-N 2.99Å; D734-E736 VanDerWaalsContact C-N 3.31Å; D734-E736 PolarHBondContact O-N 2.96Å; D734-E736 PolarHBondContact OD1-N 3.2Å; D734-T737 PolarHBondContact N-OG1 3.35Å; D734-T737 VanDerWaalsContact N-OG1 3.1Å; D734-T737 PolarHBondContact O-OG1 3.19Å; D734-T737 VanDerWaalsContact OD1-CB 3.29Å; D734-T737 WeakPolarHBondContact OD1-CB 3.46Å; D734-T737 WeakPolarHBondContact OD1-CG2 3.29Å; D734-T737 PolarHBondContact OD1-N 3.45Å; D734-T737 PolarHBondContact OD1-OG1 3.07Å; D734-L738 WeakPolarHBondContact O-CB 3.39Å; D734-L738 PolarHBondContact O-N 3.39Å | ||
| 735 | G | 89.2 | Confident | 90.6 | Very high | 0 Ų | 0 | 66.5 Ų | 66.5 | 0% | 0 | 33% | 0.332 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66 | -25.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | V703 T704 W706 P739 | V703-G735 CarbonylContact C-O 3.54Å; V703-G735 CarbonylContact O-C 3.56Å; V703-G735 WeakPolarHBondContact O-CA 3.49Å; T704-G735 WeakPolarHBondContact CA-O 3.39Å; W706-G735 WeakPolarHBondContact O-CA 3.31Å; W706-G735 PolarHBondContact O-N 2.97Å; G735-P739 WeakPolarHBondContact O-CD 3.47Å; G735-P739 WeakPolarHBondContact O-CG 3.28Å |
| 736 | E | 87.6 | Confident | 90.6 | Very high | 126 Ų | 126 | 64.7 Ų | 64.7 | 59% | 0.589 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84 | -34.3 | 179.6 | -59.9 | -157.9 | 155.1 | 0 | 0 | 112 | T704 D734 P739 | T704-E736 VanDerWaalsContact O-CG 3.26Å; T704-E736 WeakPolarHBondContact O-CG 3.24Å; D734-E736 VanDerWaalsContact C-N 3.31Å; D734-E736 PolarHBondContact O-N 2.96Å; D734-E736 PolarHBondContact OD1-N 3.2Å; E736-P739 WeakPolarHBondContact O-CD 3.47Å |
| 737 | T | 88.8 | Confident | 90.6 | Very high | 51 Ų | 51 | 59.4 Ų | 59.4 | 31% | 0.313 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.6 | -35.1 | 177.2 | 56.2 | 0 | 0 | 0 | 0 | 113.3 | D734 P739 L740 L741 | D734-T737 PolarHBondContact N-OG1 3.35Å; D734-T737 VanDerWaalsContact N-OG1 3.1Å; D734-T737 PolarHBondContact O-OG1 3.19Å; D734-T737 VanDerWaalsContact OD1-CB 3.29Å; D734-T737 WeakPolarHBondContact OD1-CB 3.46Å; D734-T737 WeakPolarHBondContact OD1-CG2 3.29Å; D734-T737 PolarHBondContact OD1-N 3.45Å; D734-T737 PolarHBondContact OD1-OG1 3.07Å; T737-P739 VanDerWaalsContact C-CD 3.45Å; T737-P739 VanDerWaalsContact C-N 3.34Å; T737-L740 WeakPolarHBondContact O-CA 3.28Å; T737-L740 WeakPolarHBondContact O-CB 3.47Å; T737-L740 PolarHBondContact O-N 2.95Å; T737-L741 WeakPolarHBondContact O-CD2 3.18Å; T737-L741 WeakPolarHBondContact O-CG 3.28Å; T737-L741 PolarHBondContact O-N 3.01Å |
| 738 | L | 89.9 | Confident | 90.4 | Very high | 6 Ų | 6 | 62.8 Ų | 62.8 | 3% | 0.031 | 33% | 0.326 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -51 | -39.2 | 178.7 | 178.7 | 68.4 | 0 | 0 | 0 | 114.6 | V703 W706 V711 F714 F728 I733 D734 L740 L741 I760 V764 | V703-L738 HydrophobicContact CG1-CD2 4.16Å; W706-L738 HydrophobicContact CE3-CD2 4.09Å; W706-L738 HydrophobicContact CZ3-CD2 4.11Å; V711-L738 HydrophobicContact CG1-CD1 4.14Å; V711-L738 HydrophobicContact CG1-CD2 4.06Å; V711-L738 HydrophobicContact CG1-CG 4.5Å; V711-L738 HydrophobicContact CG2-CB 4.49Å; V711-L738 HydrophobicContact CG2-CD2 4.02Å; F714-L738 HydrophobicContact CD1-CD2 4.26Å; F714-L738 HydrophobicContact CE1-CD2 4.27Å; F728-L738 HydrophobicContact CD1-CD1 4.44Å; F728-L738 HydrophobicContact CE1-CD1 3.79Å; I733-L738 HydrophobicContact CG2-CB 4.02Å; I733-L738 HydrophobicContact CG2-CD1 4.31Å; D734-L738 WeakPolarHBondContact O-CB 3.39Å; D734-L738 PolarHBondContact O-N 3.39Å; L738-L740 VanDerWaalsContact C-N 3.31Å; L738-L740 PolarHBondContact O-N 3.02Å; L738-L741 HydrophobicContact CD1-CD1 3.99Å; L738-I760 HydrophobicContact CD1-CG2 4.31Å; L738-V764 HydrophobicContact CD1-CG2 3.91Å; L738-V764 HydrophobicContact CD2-CG2 3.75Å; L738-V764 HydrophobicContact CG-CG1 4.26Å; L738-V764 HydrophobicContact CG-CG2 3.71Å |
| 739 | P | 89 | Confident | 90.1 | Very high | 46 Ų | 46 | 67.7 Ų | 67.7 | 30% | 0.299 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -23.6 | 171.8 | -25.3 | 36.2 | 0 | 0 | 0 | 115.6 | V703 G735 E736 T737 L768 | V703-P739 HydrophobicContact CG1-CG 4.42Å; G735-P739 WeakPolarHBondContact O-CD 3.47Å; G735-P739 WeakPolarHBondContact O-CG 3.28Å; E736-P739 WeakPolarHBondContact O-CD 3.47Å; T737-P739 VanDerWaalsContact C-CD 3.45Å; T737-P739 VanDerWaalsContact C-N 3.34Å; P739-L768 HydrophobicContact CB-CD1 3.69Å; P739-L768 HydrophobicContact CG-CD1 3.94Å; P739-L768 HydrophobicContact CG-CD2 4.07Å |
| 740 | L | 88.4 | Confident | 89.9 | Confident | 130 Ų | 130 | 62.6 Ų | 62.6 | 68% | 0.681 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.8 | -15.3 | -172.7 | -55.1 | 177.9 | 0 | 0 | 0 | 112.7 | T737 L738 T742 | T737-L740 WeakPolarHBondContact O-CA 3.28Å; T737-L740 WeakPolarHBondContact O-CB 3.47Å; T737-L740 PolarHBondContact O-N 2.95Å; L738-L740 VanDerWaalsContact C-N 3.31Å; L738-L740 PolarHBondContact O-N 3.02Å; L740-T742 PolarHBondContact O-N 3.16Å; L740-T742 VanDerWaalsContact O-N 3.17Å |
| 741 | L | 89.5 | Confident | 89.7 | Confident | 18 Ų | 18 | 59.4 Ų | 59.4 | 9% | 0.094 | 33% | 0.333 | C | S | . | . | trans | -64.1 | 115.2 | -176.7 | -45.9 | 178.2 | 0 | 0 | 0 | 111.2 | F728 I733 T737 L738 L746 M750 | F728-L741 HydrophobicContact CE1-CD1 3.87Å; F728-L741 HydrophobicContact CZ-CD1 4.49Å; I733-L741 HydrophobicContact CD1-CD2 4.06Å; I733-L741 HydrophobicContact CG2-CD1 3.85Å; T737-L741 WeakPolarHBondContact O-CD2 3.18Å; T737-L741 WeakPolarHBondContact O-CG 3.28Å; T737-L741 PolarHBondContact O-N 3.01Å; L738-L741 HydrophobicContact CD1-CD1 3.99Å; L741-L746 HydrophobicContact CB-CD1 4.46Å; L741-L746 HydrophobicContact CB-CG 4.28Å; L741-L746 HydrophobicContact CD1-CD2 4.19Å; L741-M750 HydrophobicContact CD1-CE 4.03Å; L741-M750 HydrophobicContact CD2-CE 4.28Å | ||
| 742 | T | 90.3 | Very high | 89.7 | Confident | 76 Ų | 76 | 54.7 Ų | 54.7 | 47% | 0.466 | 31% | 0.311 | S | S | . | . | trans | -72.6 | 165.1 | 176 | 66.7 | 0 | 0 | 0 | 0 | 111.5 | L740 E744 H745 L746 | L740-T742 PolarHBondContact O-N 3.16Å; L740-T742 VanDerWaalsContact O-N 3.17Å; T742-E744 VanDerWaalsContact C-N 3.3Å; T742-H745 PolarHBondContact O-N 3.37Å; T742-H745 VanDerWaalsContact OG1-CB 3.29Å; T742-H745 WeakPolarHBondContact OG1-CB 3.35Å; T742-H745 PolarHBondContact OG1-N 2.91Å; T742-L746 PolarHBondContact O-N 2.96Å | ||
| 743 | E | 90.8 | Very high | 89.8 | Confident | 68 Ų | 68 | 58.7 Ų | 58.7 | 32% | 0.318 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -59.9 | -44.5 | 173.1 | -160.3 | 165.6 | 141.1 | 0 | 0 | 111.1 | L746 L747 L758 R761 | E743-L746 PolarHBondContact O-N 2.97Å; E743-L747 HydrophobicContact CG-CD1 4.17Å; E743-L747 WeakPolarHBondContact O-CB 3.15Å; E743-L747 VanDerWaalsContact O-CG 3.22Å; E743-L747 WeakPolarHBondContact O-CG 3.28Å; E743-L747 PolarHBondContact O-N 3.13Å; E743-L758 HydrophobicContact CG-CD2 4.46Å; E743-R761 IonicContact OE2-CZ 3.74Å; E743-R761 IonicContact OE2-NH1 2.74Å; E743-R761 PolarHBondContact OE2-NH1 2.94Å; E743-R761 IonicContact OE2-NH2 2.78Å |
| 744 | E | 88.9 | Confident | 89.7 | Confident | 137 Ų | 137 | 62.4 Ų | 62.4 | 64% | 0.64 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -60.4 | -42.7 | 175.2 | -178.3 | 173.1 | -159.8 | 0 | 0 | 112.5 | T742 L746 L747 T748 | T742-E744 VanDerWaalsContact C-N 3.3Å; E744-L746 PolarHBondContact O-N 3.22Å; E744-L747 PolarHBondContact O-N 2.95Å; E744-T748 WeakPolarHBondContact O-CA 3.08Å; E744-T748 WeakPolarHBondContact O-CB 3.45Å; E744-T748 PolarHBondContact O-N 3.25Å; E744-T748 PolarHBondContact O-OG1 3.17Å; E744-T748 VanDerWaalsContact O-OG1 3.11Å |
| 745 | H | 90.3 | Very high | 89.6 | Confident | 54 Ų | 54 | 61.9 Ų | 61.9 | 25% | 0.25 | 34% | 0.344 | C | S | . | . | I | π-helix | trans | -65.7 | -39.3 | -179.8 | -173.3 | 59.4 | 0 | 0 | 0 | 112.3 | T742 N749 M750 | T742-H745 PolarHBondContact O-N 3.37Å; T742-H745 VanDerWaalsContact OG1-CB 3.29Å; T742-H745 WeakPolarHBondContact OG1-CB 3.35Å; T742-H745 PolarHBondContact OG1-N 2.91Å; H745-N749 WeakPolarHBondContact ND1-CB 3.28Å; H745-N749 VanDerWaalsContact ND1-CG 3.28Å; H745-N749 PolarHBondContact ND1-OD1 3.35Å; H745-N749 WeakPolarHBondContact O-CB 3.43Å; H745-N749 PolarHBondContact O-N 3.09Å; H745-N749 VanDerWaalsContact O-N 3.1Å; H745-M750 WeakPolarHBondContact CD2-CE 3.35Å; H745-M750 PolarHBondContact O-N 3.46Å; H745-M750 VanDerWaalsContact O-N 3.14Å |
| 746 | L | 92.3 | Very high | 89.7 | Confident | 1 Ų | 1 | 62.8 Ų | 62.8 | 1% | 0.005 | 35% | 0.35 | C | S | . | . | I | π-helix | trans | -65.8 | -43.3 | 174 | -70.4 | 160.6 | 0 | 0 | 0 | 112.1 | F728 L741 T742 E743 E744 M750 G751 L752 A757 R761 | F728-L746 HydrophobicContact CE1-CD2 4.44Å; F728-L746 HydrophobicContact CE2-CD2 4.35Å; F728-L746 HydrophobicContact CZ-CD2 3.63Å; L741-L746 HydrophobicContact CB-CD1 4.46Å; L741-L746 HydrophobicContact CB-CG 4.28Å; L741-L746 HydrophobicContact CD1-CD2 4.19Å; T742-L746 PolarHBondContact O-N 2.96Å; E743-L746 PolarHBondContact O-N 2.97Å; E744-L746 PolarHBondContact O-N 3.22Å; L746-M750 HydrophobicContact CD2-CE 3.64Å; L746-M750 HydrophobicContact CD2-SD 3.89Å; L746-M750 HydrophobicContact CG-CE 4.11Å; L746-M750 CarbonylContact O-C 3.59Å; L746-M750 WeakPolarHBondContact O-CB 3.42Å; L746-G751 PolarHBondContact O-N 3.39Å; L746-L752 HydrophobicContact CB-CD2 4.48Å; L746-L752 HydrophobicContact CD2-CD2 4.04Å; L746-L752 WeakPolarHBondContact O-CB 3.3Å; L746-L752 PolarHBondContact O-N 3.08Å; L746-A757 HydrophobicContact CB-CB 3.84Å; L746-A757 HydrophobicContact CD1-CB 4.29Å; L746-R761 VanDerWaalsContact CD1-CD 3.44Å; L746-R761 HydrophobicContact CD1-CG 3.55Å |
| 747 | L | 91.8 | Very high | 89.9 | Confident | 60 Ų | 60 | 56.8 Ų | 56.8 | 31% | 0.314 | 32% | 0.321 | S | S | . | . | I | π-helix | trans | -70.7 | -49.1 | -179.7 | -69.4 | 171.1 | 0 | 0 | 0 | 112.5 | E743 E744 G751 L752 L754 A757 | E743-L747 HydrophobicContact CG-CD1 4.17Å; E743-L747 WeakPolarHBondContact O-CB 3.15Å; E743-L747 VanDerWaalsContact O-CG 3.22Å; E743-L747 WeakPolarHBondContact O-CG 3.28Å; E743-L747 PolarHBondContact O-N 3.13Å; E744-L747 PolarHBondContact O-N 2.95Å; L747-G751 VanDerWaalsContact O-CA 3.27Å; L747-G751 WeakPolarHBondContact O-CA 3.35Å; L747-G751 PolarHBondContact O-N 2.92Å; L747-L752 VanDerWaalsContact CD2-O 3.32Å; L747-L752 WeakPolarHBondContact CD2-O 3.4Å; L747-L754 HydrophobicContact CD1-CD1 4.14Å; L747-L754 HydrophobicContact CD2-CB 4.1Å; L747-L754 HydrophobicContact CD2-CD1 4.11Å; L747-A757 HydrophobicContact CD2-CB 4.35Å |
| 748 | T | 87.5 | Confident | 90.1 | Very high | 103 Ų | 103 | 57 Ų | 57 | 63% | 0.632 | 32% | 0.32 | S | S | * | . | I | π-helix | trans | -95.1 | -42.8 | -164.6 | -50.3 | 0 | 0 | 0 | 0 | 112.7 | E744 | E744-T748 WeakPolarHBondContact O-CA 3.08Å; E744-T748 WeakPolarHBondContact O-CB 3.45Å; E744-T748 PolarHBondContact O-N 3.25Å; E744-T748 PolarHBondContact O-OG1 3.17Å; E744-T748 VanDerWaalsContact O-OG1 3.11Å |
| 749 | N | 87.1 | Confident | 90.2 | Very high | 103 Ų | 103 | 61.1 Ų | 61.1 | 55% | 0.551 | 34% | 0.338 | S | S | * | . | I | π-helix | trans | -88.1 | -39.6 | -179.7 | -60 | 99.6 | 0 | 0 | 0 | 112.5 | H745 | H745-N749 WeakPolarHBondContact ND1-CB 3.28Å; H745-N749 VanDerWaalsContact ND1-CG 3.28Å; H745-N749 PolarHBondContact ND1-OD1 3.35Å; H745-N749 WeakPolarHBondContact O-CB 3.43Å; H745-N749 PolarHBondContact O-N 3.09Å; H745-N749 VanDerWaalsContact O-N 3.1Å |
| 750 | M | 87.7 | Confident | 90.3 | Very high | 11 Ų | 11 | 59 Ų | 59 | 5% | 0.054 | 33% | 0.325 | C | S | . | . | S | Bend | trans | -94.5 | -6.6 | 178.7 | -73.8 | 175.9 | -102.1 | 0 | 0 | 114.2 | V727 F728 Q731 L741 H745 L746 L752 | V727-M750 HydrophobicContact CG1-CB 3.85Å; V727-M750 HydrophobicContact CG1-CG 3.86Å; F728-M750 HydrophobicContact CE2-SD 4.22Å; F728-M750 HydrophobicContact CZ-SD 4.22Å; Q731-M750 HydrophobicContact CG-CG 4.13Å; L741-M750 HydrophobicContact CD1-CE 4.03Å; L741-M750 HydrophobicContact CD2-CE 4.28Å; H745-M750 WeakPolarHBondContact CD2-CE 3.35Å; H745-M750 PolarHBondContact O-N 3.46Å; H745-M750 VanDerWaalsContact O-N 3.14Å; L746-M750 HydrophobicContact CD2-CE 3.64Å; L746-M750 HydrophobicContact CD2-SD 3.89Å; L746-M750 HydrophobicContact CG-CE 4.11Å; L746-M750 CarbonylContact O-C 3.59Å; L746-M750 WeakPolarHBondContact O-CB 3.42Å; M750-L752 VanDerWaalsContact C-N 3.27Å; M750-L752 HydrophobicContact CB-CD1 3.51Å; M750-L752 PolarHBondContact O-N 2.87Å |
| 751 | G | 87.6 | Confident | 90.4 | Very high | 51 Ų | 51 | 56.2 Ų | 56.2 | 53% | 0.526 | 31% | 0.305 | S | S | . | . | trans | 66.8 | 21.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115 | L746 L747 | L746-G751 PolarHBondContact O-N 3.39Å; L747-G751 VanDerWaalsContact O-CA 3.27Å; L747-G751 WeakPolarHBondContact O-CA 3.35Å; L747-G751 PolarHBondContact O-N 2.92Å | ||
| 752 | L | 91.9 | Very high | 90.4 | Very high | 6 Ų | 6 | 57.3 Ų | 57.3 | 3% | 0.031 | 32% | 0.317 | C | S | . | . | trans | -67.5 | 144.5 | 177.7 | -85.8 | 71 | 0 | 0 | 0 | 110.9 | Y724 F728 L746 L747 M750 P756 A757 I760 | Y724-L752 HydrophobicContact CD1-CB 4.5Å; Y724-L752 HydrophobicContact CD1-CD1 3.71Å; Y724-L752 HydrophobicContact CD1-CG 3.58Å; Y724-L752 HydrophobicContact CD2-CG 4.24Å; Y724-L752 HydrophobicContact CE1-CB 4.33Å; Y724-L752 HydrophobicContact CE1-CD1 4.31Å; Y724-L752 HydrophobicContact CE1-CG 3.87Å; Y724-L752 HydrophobicContact CG-CD1 4.09Å; Y724-L752 HydrophobicContact CG-CD2 4.32Å; Y724-L752 HydrophobicContact CG-CG 3.77Å; F728-L752 HydrophobicContact CE2-CD1 4.32Å; F728-L752 HydrophobicContact CE2-CD2 4.23Å; L746-L752 HydrophobicContact CB-CD2 4.48Å; L746-L752 HydrophobicContact CD2-CD2 4.04Å; L746-L752 WeakPolarHBondContact O-CB 3.3Å; L746-L752 PolarHBondContact O-N 3.08Å; L747-L752 VanDerWaalsContact CD2-O 3.32Å; L747-L752 WeakPolarHBondContact CD2-O 3.4Å; M750-L752 VanDerWaalsContact C-N 3.27Å; M750-L752 HydrophobicContact CB-CD1 3.51Å; M750-L752 PolarHBondContact O-N 2.87Å; L752-P756 HydrophobicContact CD2-CB 4.27Å; L752-A757 HydrophobicContact CB-CB 4.06Å; L752-A757 HydrophobicContact CD2-CB 4.21Å; L752-I760 HydrophobicContact CD2-CD1 3.7Å | ||
| 753 | K | 92.3 | Very high | 90.3 | Very high | 123 Ų | 123 | 56.1 Ų | 56.1 | 54% | 0.535 | 31% | 0.306 | S | S | . | . | trans | -68.2 | 148.1 | 163.5 | -61.1 | 159.8 | -160.4 | 144.4 | 0 | 108.6 | E723 Y724 G755 P756 A757 | E723-K753 IonicContact OE1-NZ 3.61Å; E723-K753 PolarHBondContact OE1-NZ 3.27Å; E723-K753 IonicContact OE2-NZ 3.52Å; Y724-K753 VanDerWaalsContact OH-CD 3.27Å; Y724-K753 WeakPolarHBondContact OH-CD 3.48Å; Y724-K753 WeakPolarHBondContact OH-CE 3.49Å; Y724-K753 WeakPolarHBondContact OH-CG 3.44Å; Y724-K753 PolarHBondContact OH-N 2.81Å; Y724-K753 PolarHBondContact OH-NZ 2.87Å; K753-G755 VanDerWaalsContact C-N 3.29Å; K753-G755 PolarHBondContact O-N 3.25Å; K753-P756 HydrophobicContact CB-CG 4.23Å; K753-P756 VanDerWaalsContact O-CD 3.23Å; K753-P756 WeakPolarHBondContact O-CD 3.42Å; K753-A757 PolarHBondContact O-N 3.4Å; K753-A757 VanDerWaalsContact O-N 3.07Å | ||
| 754 | L | 89.6 | Confident | 90.3 | Very high | 88 Ų | 88 | 53.3 Ų | 53.3 | 46% | 0.461 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -53.5 | -40.9 | -177.2 | -175.9 | 64 | 0 | 0 | 0 | 113.6 | L747 A757 L758 | L747-L754 HydrophobicContact CD1-CD1 4.14Å; L747-L754 HydrophobicContact CD2-CB 4.1Å; L747-L754 HydrophobicContact CD2-CD1 4.11Å; L754-A757 PolarHBondContact O-N 3.06Å; L754-L758 HydrophobicContact CD1-CD1 3.86Å; L754-L758 HydrophobicContact CD1-CD2 4.29Å; L754-L758 HydrophobicContact CD1-CG 3.88Å; L754-L758 HydrophobicContact CD2-CD1 4.38Å; L754-L758 HydrophobicContact CG-CD1 3.7Å; L754-L758 HydrophobicContact CG-CG 4.16Å; L754-L758 WeakPolarHBondContact O-CB 3.49Å; L754-L758 WeakPolarHBondContact O-CG 3.4Å; L754-L758 PolarHBondContact O-N 3.08Å |
| 755 | G | 90.5 | Very high | 90.2 | Very high | 42 Ų | 42 | 48 Ų | 48 | 43% | 0.433 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -56.5 | -60.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | K753 A757 L758 K759 | K753-G755 VanDerWaalsContact C-N 3.29Å; K753-G755 PolarHBondContact O-N 3.25Å; G755-A757 PolarHBondContact O-N 3.04Å; G755-L758 PolarHBondContact O-N 2.72Å; G755-K759 WeakPolarHBondContact O-CG 3.46Å; G755-K759 PolarHBondContact O-N 2.87Å |
| 756 | P | 91.9 | Very high | 89.9 | Confident | 18 Ų | 18 | 54.4 Ų | 54.4 | 12% | 0.117 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -50.7 | -46.9 | 170.4 | -31.2 | 35.2 | 0 | 0 | 0 | 114.8 | Y724 L752 K753 L758 K759 I760 | Y724-P756 HydrophobicContact CD2-CB 3.95Å; Y724-P756 HydrophobicContact CD2-CG 4.39Å; Y724-P756 HydrophobicContact CE2-CB 3.52Å; Y724-P756 HydrophobicContact CE2-CG 3.52Å; L752-P756 HydrophobicContact CD2-CB 4.27Å; K753-P756 HydrophobicContact CB-CG 4.23Å; K753-P756 VanDerWaalsContact O-CD 3.23Å; K753-P756 WeakPolarHBondContact O-CD 3.42Å; P756-L758 PolarHBondContact O-N 3.38Å; P756-K759 WeakPolarHBondContact O-CB 3.5Å; P756-K759 PolarHBondContact O-N 2.92Å; P756-I760 WeakPolarHBondContact O-CG1 3.38Å; P756-I760 PolarHBondContact O-N 3.33Å |
| 757 | A | 92.7 | Very high | 89.4 | Confident | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -60.7 | -45.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L746 L747 L752 K753 L754 G755 R761 | L746-A757 HydrophobicContact CB-CB 3.84Å; L746-A757 HydrophobicContact CD1-CB 4.29Å; L747-A757 HydrophobicContact CD2-CB 4.35Å; L752-A757 HydrophobicContact CB-CB 4.06Å; L752-A757 HydrophobicContact CD2-CB 4.21Å; K753-A757 PolarHBondContact O-N 3.4Å; K753-A757 VanDerWaalsContact O-N 3.07Å; L754-A757 PolarHBondContact O-N 3.06Å; G755-A757 PolarHBondContact O-N 3.04Å; A757-R761 PolarHBondContact O-N 3.31Å; A757-R761 VanDerWaalsContact O-N 3.11Å |
| 758 | L | 91.6 | Very high | 88.9 | Confident | 55 Ų | 55 | 60 Ų | 60 | 29% | 0.288 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -66.3 | -39.5 | 175.5 | -65.5 | 172.6 | 0 | 0 | 0 | 112 | E743 L754 G755 P756 A762 Y773 | E743-L758 HydrophobicContact CG-CD2 4.46Å; L754-L758 HydrophobicContact CD1-CD1 3.86Å; L754-L758 HydrophobicContact CD1-CD2 4.29Å; L754-L758 HydrophobicContact CD1-CG 3.88Å; L754-L758 HydrophobicContact CD2-CD1 4.38Å; L754-L758 HydrophobicContact CG-CD1 3.7Å; L754-L758 HydrophobicContact CG-CG 4.16Å; L754-L758 WeakPolarHBondContact O-CB 3.49Å; L754-L758 WeakPolarHBondContact O-CG 3.4Å; L754-L758 PolarHBondContact O-N 3.08Å; G755-L758 PolarHBondContact O-N 2.72Å; P756-L758 PolarHBondContact O-N 3.38Å; L758-A762 WeakPolarHBondContact O-CB 3.37Å; L758-A762 PolarHBondContact O-N 3.43Å; L758-Y773 WeakPolarHBondContact CD2-OH 3.41Å |
| 759 | K | 92 | Very high | 87.8 | Confident | 94 Ų | 94 | 58.1 Ų | 58.1 | 41% | 0.409 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59.1 | -48.7 | 175.6 | -80.3 | -176.7 | 179.9 | -170.1 | 0 | 112 | S719 G755 P756 A762 Q763 | S719-K759 PolarHBondContact O-NZ 3.25Å; S719-K759 PolarHBondContact OG-NZ 3.05Å; G755-K759 WeakPolarHBondContact O-CG 3.46Å; G755-K759 PolarHBondContact O-N 2.87Å; P756-K759 WeakPolarHBondContact O-CB 3.5Å; P756-K759 PolarHBondContact O-N 2.92Å; K759-A762 PolarHBondContact O-N 3.04Å; K759-Q763 WeakPolarHBondContact O-CB 3.48Å; K759-Q763 PolarHBondContact O-N 3.32Å |
| 760 | I | 91.9 | Very high | 86.2 | Confident | 2 Ų | 2 | 61.3 Ų | 61.3 | 1% | 0.01 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63.5 | -53.4 | -178.9 | -66.2 | 166.8 | 0 | 0 | 0 | 109.3 | V715 L718 C721 F728 L738 L752 P756 A762 Q763 V764 | V715-I760 HydrophobicContact CG1-CD1 3.98Å; V715-I760 HydrophobicContact CG2-CD1 4.27Å; V715-I760 HydrophobicContact CG2-CG2 4.49Å; L718-I760 HydrophobicContact CD1-CG1 3.91Å; C721-I760 HydrophobicContact CB-CD1 4.47Å; F728-I760 HydrophobicContact CE2-CD1 3.9Å; F728-I760 HydrophobicContact CZ-CD1 3.85Å; F728-I760 HydrophobicContact CZ-CG2 4.19Å; L738-I760 HydrophobicContact CD1-CG2 4.31Å; L752-I760 HydrophobicContact CD2-CD1 3.7Å; P756-I760 WeakPolarHBondContact O-CG1 3.38Å; P756-I760 PolarHBondContact O-N 3.33Å; I760-A762 VanDerWaalsContact C-N 3.34Å; I760-A762 PolarHBondContact O-N 2.9Å; I760-Q763 PolarHBondContact O-N 2.89Å; I760-Q763 VanDerWaalsContact O-N 3.11Å; I760-V764 HydrophobicContact CG2-CG2 4.2Å; I760-V764 VanDerWaalsContact O-CG2 3.3Å; I760-V764 WeakPolarHBondContact O-CG2 3.39Å; I760-V764 PolarHBondContact O-N 3.41Å |
| 761 | R | 90.4 | Very high | 83.9 | Confident | 70 Ų | 70 | 66.5 Ų | 66.5 | 26% | 0.264 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -57.5 | -42.2 | 178.1 | -79.9 | 177.5 | 59.4 | -121.8 | 13.5 | 113.2 | E743 L746 A757 Q763 V764 A765 Y773 | E743-R761 IonicContact OE2-CZ 3.74Å; E743-R761 IonicContact OE2-NH1 2.74Å; E743-R761 PolarHBondContact OE2-NH1 2.94Å; E743-R761 IonicContact OE2-NH2 2.78Å; L746-R761 VanDerWaalsContact CD1-CD 3.44Å; L746-R761 HydrophobicContact CD1-CG 3.55Å; A757-R761 PolarHBondContact O-N 3.31Å; A757-R761 VanDerWaalsContact O-N 3.11Å; R761-Q763 PolarHBondContact O-N 2.94Å; R761-V764 PolarHBondContact O-N 3.49Å; R761-A765 VanDerWaalsContact O-CB 3.31Å; R761-A765 WeakPolarHBondContact O-CB 3.44Å; R761-A765 PolarHBondContact O-N 3.37Å; R761-Y773 PolarHBondContact NH1-OH 3.3Å |
| 762 | A | 89.1 | Confident | 81.8 | Confident | 42 Ų | 42 | 71.7 Ų | 71.7 | 35% | 0.347 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.7 | -42 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L758 K759 I760 R766 | L758-A762 WeakPolarHBondContact O-CB 3.37Å; L758-A762 PolarHBondContact O-N 3.43Å; K759-A762 PolarHBondContact O-N 3.04Å; I760-A762 VanDerWaalsContact C-N 3.34Å; I760-A762 PolarHBondContact O-N 2.9Å; A762-R766 VanDerWaalsContact O-CG 3.27Å; A762-R766 WeakPolarHBondContact O-CG 3.34Å; A762-R766 PolarHBondContact O-N 2.85Å |
| 763 | Q | 89.1 | Confident | 79.1 | Confident | 51 Ų | 51 | 77.5 Ų | 77.5 | 24% | 0.238 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -73.7 | -36.1 | 179.7 | -169.6 | 78.2 | -25.2 | 0 | 0 | 112.6 | F714 L718 K759 I760 R761 R766 R767 | F714-Q763 HydrophobicContact CE2-CB 4.36Å; F714-Q763 HydrophobicContact CE2-CG 3.49Å; F714-Q763 VanDerWaalsContact CE2-CG 3.49Å; F714-Q763 HydrophobicContact CZ-CB 3.86Å; F714-Q763 HydrophobicContact CZ-CG 3.5Å; L718-Q763 HydrophobicContact CD1-CB 4.39Å; L718-Q763 HydrophobicContact CD2-CB 4.37Å; L718-Q763 HydrophobicContact CD2-CG 4.09Å; K759-Q763 WeakPolarHBondContact O-CB 3.48Å; K759-Q763 PolarHBondContact O-N 3.32Å; I760-Q763 PolarHBondContact O-N 2.89Å; I760-Q763 VanDerWaalsContact O-N 3.11Å; R761-Q763 PolarHBondContact O-N 2.94Å; Q763-R766 WeakPolarHBondContact O-CB 3.41Å; Q763-R766 PolarHBondContact O-N 3.37Å; Q763-R767 PolarHBondContact O-N 2.87Å; Q763-R767 VanDerWaalsContact O-N 3.11Å |
| 764 | V | 90.5 | Very high | 76.4 | Confident | 8 Ų | 8 | 77.4 Ų | 77.4 | 5% | 0.048 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -62.4 | -49 | 172.7 | 171.1 | 0 | 0 | 0 | 0 | 110.4 | F714 L738 I760 R761 R766 R767 L768 | F714-V764 HydrophobicContact CE1-CG2 3.67Å; F714-V764 HydrophobicContact CZ-CG2 4.03Å; L738-V764 HydrophobicContact CD1-CG2 3.91Å; L738-V764 HydrophobicContact CD2-CG2 3.75Å; L738-V764 HydrophobicContact CG-CG1 4.26Å; L738-V764 HydrophobicContact CG-CG2 3.71Å; I760-V764 HydrophobicContact CG2-CG2 4.2Å; I760-V764 VanDerWaalsContact O-CG2 3.3Å; I760-V764 WeakPolarHBondContact O-CG2 3.39Å; I760-V764 PolarHBondContact O-N 3.41Å; R761-V764 PolarHBondContact O-N 3.49Å; V764-R766 VanDerWaalsContact C-N 3.28Å; V764-R766 PolarHBondContact O-N 2.98Å; V764-R767 PolarHBondContact O-N 2.85Å; V764-R767 VanDerWaalsContact O-N 3.07Å; V764-L768 HydrophobicContact CG1-CD1 3.6Å; V764-L768 HydrophobicContact CG1-CG 4.32Å; V764-L768 WeakPolarHBondContact O-CG 3.24Å; V764-L768 PolarHBondContact O-N 2.86Å |
| 765 | A | 85.8 | Confident | 73.6 | Confident | 27 Ų | 27 | 77 Ų | 77 | 22% | 0.223 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -59.3 | -36.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | R761 G769 R770 | R761-A765 VanDerWaalsContact O-CB 3.31Å; R761-A765 WeakPolarHBondContact O-CB 3.44Å; R761-A765 PolarHBondContact O-N 3.37Å; A765-G769 PolarHBondContact O-N 3.38Å; A765-R770 PolarHBondContact O-N 3.14Å |
| 766 | R | 83.9 | Confident | 70.9 | Confident | 188 Ų | 188 | 80.7 Ų | 80.7 | 71% | 0.709 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -64.6 | -37 | 173.7 | -77.1 | 178.3 | 72.7 | -151 | 5.2 | 113.4 | A762 Q763 V764 | A762-R766 VanDerWaalsContact O-CG 3.27Å; A762-R766 WeakPolarHBondContact O-CG 3.34Å; A762-R766 PolarHBondContact O-N 2.85Å; Q763-R766 WeakPolarHBondContact O-CB 3.41Å; Q763-R766 PolarHBondContact O-N 3.37Å; V764-R766 VanDerWaalsContact C-N 3.28Å; V764-R766 PolarHBondContact O-N 2.98Å |
| 767 | R | 82.7 | Confident | 67.8 | Low | 125 Ų | 125 | 88.6 Ų | 88.6 | 47% | 0.472 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -75.5 | -41.1 | 177.5 | -74.1 | -175.3 | 172.8 | -89.5 | 10.4 | 112.3 | V703 Q763 V764 G769 | V703-R767 HydrophobicContact CG2-CB 3.64Å; Q763-R767 PolarHBondContact O-N 2.87Å; Q763-R767 VanDerWaalsContact O-N 3.11Å; V764-R767 PolarHBondContact O-N 2.85Å; V764-R767 VanDerWaalsContact O-N 3.07Å; R767-G769 PolarHBondContact O-N 3.24Å; R767-G769 VanDerWaalsContact O-N 3.11Å |
| 768 | L | 81.3 | Confident | 65.2 | Low | 54 Ų | 54 | 95 Ų | 95 | 28% | 0.283 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.7 | -5.5 | 177.9 | -70.3 | 167.6 | 0 | 0 | 0 | 114.8 | V703 P739 V764 R770 | V703-L768 HydrophobicContact CB-CD2 3.8Å; V703-L768 HydrophobicContact CB-CG 4.38Å; V703-L768 HydrophobicContact CG1-CD2 4.39Å; V703-L768 HydrophobicContact CG2-CD2 4.12Å; V703-L768 HydrophobicContact CG2-CG 4.3Å; P739-L768 HydrophobicContact CB-CD1 3.69Å; P739-L768 HydrophobicContact CG-CD1 3.94Å; P739-L768 HydrophobicContact CG-CD2 4.07Å; V764-L768 HydrophobicContact CG1-CD1 3.6Å; V764-L768 HydrophobicContact CG1-CG 4.32Å; V764-L768 WeakPolarHBondContact O-CG 3.24Å; V764-L768 PolarHBondContact O-N 2.86Å; L768-R770 HydrophobicContact CB-CB 4.4Å; L768-R770 HydrophobicContact CB-CG 4.44Å; L768-R770 PolarHBondContact O-N 3.36Å |
| 769 | G | 64.9 | Low | 62.4 | Low | 62 Ų | 62 | 98.6 Ų | 98.6 | 64% | 0.639 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.3 | 3.6 | -174.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | A765 R767 V771 | A765-G769 PolarHBondContact O-N 3.38Å; R767-G769 PolarHBondContact O-N 3.24Å; R767-G769 VanDerWaalsContact O-N 3.11Å; G769-V771 PolarHBondContact O-N 3.5Å |
| 770 | R | 52.3 | Low | 59.5 | Low | 171 Ų | 171 | 98.5 Ų | 98.5 | 65% | 0.645 | 54% | 0.537 | S | S | * | . | trans | -89.2 | 99.9 | -175.7 | -74.2 | -171.2 | -176.5 | -164.4 | 3.3 | 110.6 | A765 L768 F772 | A765-R770 PolarHBondContact O-N 3.14Å; L768-R770 HydrophobicContact CB-CB 4.4Å; L768-R770 HydrophobicContact CB-CG 4.44Å; L768-R770 PolarHBondContact O-N 3.36Å; R770-F772 HydrophobicContact CB-CD2 4.1Å; R770-F772 PolarHBondContact O-N 3.04Å | ||
| 771 | V | 40.3 | Very low | 56.6 | Low | 119 Ų | 119 | 105.8 Ų | 105.8 | 72% | 0.721 | 58% | 0.575 | S | S | * | * | trans | -75.9 | 65.2 | 172.7 | -169.6 | 0 | 0 | 0 | 0 | 110.6 | G769 | G769-V771 PolarHBondContact O-N 3.5Š| ||
| 772 | F | 43.3 | Very low | 53.8 | Low | 161 Ų | 161 | 107.9 Ų | 107.9 | 71% | 0.706 | 60% | 0.597 | S | S | * | * | trans | -113.8 | 71.5 | 172 | -71.7 | -61 | 0 | 0 | 0 | 110.6 | R770 | R770-F772 HydrophobicContact CB-CD2 4.1Å; R770-F772 PolarHBondContact O-N 3.04Å | ||
| 773 | Y | 34.3 | Very low | 50.9 | Low | 127 Ų | 127 | 113.8 Ų | 113.8 | 50% | 0.498 | 62% | 0.622 | S | S | . | * | trans | -106.5 | 74.6 | 159.9 | -132.2 | -79.6 | 0 | 0 | 0 | 109.4 | L758 R761 | L758-Y773 WeakPolarHBondContact CD2-OH 3.41Å; R761-Y773 PolarHBondContact NH1-OH 3.3Å | ||
| 774 | V | 35.5 | Very low | 48.2 | Very low | 121 Ų | 121 | 120.2 Ų | 120.2 | 73% | 0.733 | 65% | 0.652 | S | S | * | * | trans | -106 | 115 | 167.8 | -178 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 775 | A | 31 | Very low | 45.5 | Very low | 79 Ų | 79 | 124.8 Ų | 124.8 | 65% | 0.653 | 68% | 0.682 | S | S | * | * | trans | -66.3 | 147.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | F777 | A775-F777 PolarHBondContact O-N 2.82Š| ||
| 776 | S | 33.7 | Very low | 42.9 | Very low | 121 Ų | 121 | 129.5 Ų | 129.5 | 85% | 0.846 | 71% | 0.71 | S | S | * | * | trans | -51.2 | 117 | -164 | -50.5 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 777 | F | 27.6 | Very low | 40.3 | Very low | 184 Ų | 184 | 126.7 Ų | 126.7 | 81% | 0.807 | 71% | 0.714 | S | S | * | * | trans | -140.5 | 128.5 | 156.3 | -83.7 | -80.4 | 0 | 0 | 0 | 109.2 | A775 V779 | A775-F777 PolarHBondContact O-N 2.82Å; F777-V779 PolarHBondContact O-N 3.43Å | ||
| 778 | P | 37.6 | Very low | 37.6 | Very low | 135 Ų | 135 | 129 Ų | 129 | 88% | 0.877 | 74% | 0.735 | S | S | * | * | trans | -76.8 | 90.7 | 178.4 | 30.8 | -33.5 | 0 | 0 | 0 | 110.5 | ||||
| 779 | V | 33.4 | Very low | 35.1 | Very low | 130 Ų | 130 | 137.2 Ų | 137.2 | 79% | 0.788 | 76% | 0.762 | S | S | * | * | trans | -84.4 | 114.2 | 162.4 | 178 | 0 | 0 | 0 | 0 | 107.5 | F777 L781 | F777-V779 PolarHBondContact O-N 3.43Å; V779-L781 PolarHBondContact O-N 3.31Å | ||
| 780 | A | 31.7 | Very low | 33.3 | Very low | 92 Ų | 92 | 138.3 Ų | 138.3 | 76% | 0.76 | 77% | 0.765 | S | S | * | * | trans | -61.8 | 124.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 781 | L | 29.7 | Very low | 32.3 | Very low | 155 Ų | 155 | 136.2 Ų | 136.2 | 81% | 0.812 | 77% | 0.774 | S | S | * | * | trans | -73.6 | 124 | 166.1 | -80.2 | 162.7 | 0 | 0 | 0 | 108.5 | V779 L783 | V779-L781 PolarHBondContact O-N 3.31Å; L781-L783 PolarHBondContact O-N 2.67Å; L781-L783 VanDerWaalsContact O-N 3.12Å | ||
| 782 | P | 32.5 | Very low | 31.6 | Very low | 113 Ų | 113 | 139.2 Ų | 139.2 | 73% | 0.734 | 78% | 0.78 | S | S | * | * | trans | -69.4 | 109 | 167.3 | 28.7 | -31.5 | 0 | 0 | 0 | 108.4 | Q784 | P782-Q784 PolarHBondContact O-N 3.28Å; P782-Q784 VanDerWaalsContact O-N 3.13Å | ||
| 783 | L | 29 | Very low | 31 | Very low | 166 Ų | 166 | 143.2 Ų | 143.2 | 87% | 0.869 | 79% | 0.79 | S | S | * | * | trans | -61.4 | 113.7 | 170.9 | -69.9 | 170.8 | 0 | 0 | 0 | 108.9 | L781 | L781-L783 PolarHBondContact O-N 2.67Å; L781-L783 VanDerWaalsContact O-N 3.12Å | ||
| 784 | Q | 32.1 | Very low | 30.5 | Very low | 186 Ų | 186 | 146.4 Ų | 146.4 | 87% | 0.869 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 129.8 | 166.2 | -69.4 | -172 | -54.8 | 0 | 0 | 108.6 | P782 | P782-Q784 PolarHBondContact O-N 3.28Å; P782-Q784 VanDerWaalsContact O-N 3.13Å |
| 785 | P | 32.6 | Very low | 30.2 | Very low | 105 Ų | 105 | 149.1 Ų | 149.1 | 68% | 0.682 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 145.3 | 173.9 | 29 | -34.1 | 0 | 0 | 0 | 110.4 | T787 | P785-T787 PolarHBondContact O-N 3.16Š|
| 786 | P | 32.3 | Very low | 29.9 | Very low | 125 Ų | 125 | 148.4 Ų | 148.4 | 81% | 0.812 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 122.2 | 178.5 | 26.9 | -33.8 | 0 | 0 | 0 | 110.4 | L788 | P786-L788 PolarHBondContact O-N 3.07Š|
| 787 | T | 28.3 | Very low | 29.5 | Very low | 129 Ų | 129 | 149.8 Ų | 149.8 | 79% | 0.791 | 82% | 0.823 | S | S | * | * | trans | -77.9 | 113.6 | 176.8 | -47.9 | 0 | 0 | 0 | 0 | 109.4 | P785 R789 | P785-T787 PolarHBondContact O-N 3.16Å; T787-R789 PolarHBondContact O-N 3.24Å | ||
| 788 | L | 26.8 | Very low | 29.4 | Very low | 174 Ų | 174 | 144.7 Ų | 144.7 | 91% | 0.911 | 82% | 0.822 | S | S | * | * | trans | -60.3 | 108.9 | 173.4 | -78.7 | 167 | 0 | 0 | 0 | 110.4 | P786 | P786-L788 PolarHBondContact O-N 3.07Š| ||
| 789 | R | 28.1 | Very low | 28.9 | Very low | 227 Ų | 227 | 147 Ų | 147 | 86% | 0.857 | 82% | 0.821 | S | S | * | * | trans | -87 | 103.7 | 165.2 | -85.4 | -78.5 | -179.7 | 141.3 | -2.6 | 108.8 | T787 | T787-R789 PolarHBondContact O-N 3.24Š| ||
| 790 | A | 26.6 | Very low | 28.6 | Very low | 84 Ų | 84 | 148.9 Ų | 148.9 | 69% | 0.694 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 151.6 | 159.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 791 | P | 32.4 | Very low | 28.7 | Very low | 127 Ų | 127 | 149.8 Ų | 149.8 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -81 | 122.9 | -173.8 | 31.1 | -33.8 | 0 | 0 | 0 | 111.9 | ||
| 792 | E | 25.4 | Very low | 28.5 | Very low | 183 Ų | 183 | 151 Ų | 151 | 86% | 0.855 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -97.5 | 135 | 160.3 | -70 | -173.3 | 109.8 | 0 | 0 | 109.2 | ||
| 793 | R | 29.6 | Very low | 28.2 | Very low | 245 Ų | 245 | 150.9 Ų | 150.9 | 93% | 0.925 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 151 | -178.9 | -77.8 | 172.7 | 157.6 | 166.6 | -8.9 | 110.8 | ||
| 794 | E | 25.5 | Very low | 29.2 | Very low | 194 Ų | 194 | 148.4 Ų | 148.4 | 91% | 0.907 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 144.8 | 169.8 | -62.1 | -174.5 | 128.7 | 0 | 0 | 111.7 | ||
| 795 | L | 27.7 | Very low | 29 | Very low | 177 Ų | 177 | 144.7 Ų | 144.7 | 93% | 0.927 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 139.8 | 160.3 | -161.5 | 75.2 | 0 | 0 | 0 | 107.2 | ||
| 796 | G | 25.1 | Very low | 28.8 | Very low | 64 Ų | 64 | 146.3 Ų | 146.3 | 66% | 0.66 | 82% | 0.82 | S | S | * | * | cis | 143.5 | 109.9 | 4.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 797 | T | 25.2 | Very low | 28.6 | Very low | 150 Ų | 150 | 144.9 Ų | 144.9 | 92% | 0.92 | 82% | 0.819 | S | S | * | * | trans | -136.1 | 124.4 | -175.2 | -56.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 798 | G | 26 | Very low | 28.6 | Very low | 77 Ų | 77 | 145.8 Ų | 145.8 | 79% | 0.794 | 83% | 0.825 | S | S | * | * | trans | 110.4 | 110.4 | 169.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 799 | E | 26.7 | Very low | 28.6 | Very low | 184 Ų | 184 | 142.7 Ų | 142.7 | 86% | 0.86 | 82% | 0.817 | S | S | * | * | trans | -69.3 | 165.1 | 150.9 | -70.3 | 173.4 | 86.7 | 0 | 0 | 109.9 | ||||
| 800 | Q | 26.8 | Very low | 30 | Very low | 170 Ų | 170 | 136.8 Ų | 136.8 | 79% | 0.794 | 81% | 0.808 | S | S | * | * | cis | -154.5 | 170.4 | 4.9 | -130.7 | -167.6 | 5.1 | 0 | 0 | 108.5 | ||||
| 801 | P | 35.5 | Very low | 30.2 | Very low | 111 Ų | 111 | 144.1 Ų | 144.1 | 72% | 0.721 | 82% | 0.82 | S | S | * | * | trans | -108.5 | 170.9 | -175.9 | 40.3 | -31.7 | 0 | 0 | 0 | 115.1 | ||||
| 802 | L | 24.9 | Very low | 30 | Very low | 179 Ų | 179 | 141.9 Ų | 141.9 | 94% | 0.937 | 82% | 0.82 | S | S | * | * | trans | -134.3 | 149.6 | 164.8 | -81.7 | 173.3 | 0 | 0 | 0 | 112.3 | ||||
| 803 | S | 26.7 | Very low | 30.1 | Very low | 111 Ų | 111 | 137.3 Ų | 137.3 | 78% | 0.776 | 82% | 0.822 | S | S | * | * | trans | -101.5 | -154.1 | -176.4 | -30.9 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 804 | P | 49.3 | Very low | 30 | Very low | 114 Ų | 114 | 129 Ų | 129 | 74% | 0.74 | 81% | 0.812 | S | S | * | * | cis | -121.4 | -147 | -0 | 26.6 | 1.3 | 0 | 0 | 0 | 111.3 | ||||
| 805 | T | 27.7 | Very low | 30.2 | Very low | 108 Ų | 108 | 129 Ų | 129 | 66% | 0.663 | 81% | 0.812 | S | S | * | * | cis | -162.9 | 143.3 | 13.8 | -25.6 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 806 | T | 28.8 | Very low | 30.2 | Very low | 139 Ų | 139 | 124.4 Ų | 124.4 | 85% | 0.853 | 80% | 0.8 | S | S | * | * | trans | 65.5 | 155.9 | 151.1 | 31.8 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 807 | A | 28.2 | Very low | 30.5 | Very low | 95 Ų | 95 | 129.3 Ų | 129.3 | 79% | 0.785 | 81% | 0.81 | S | S | * | * | trans | -146.7 | 164.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 808 | T | 28 | Very low | 30.7 | Very low | 149 Ų | 149 | 126.9 Ų | 126.9 | 91% | 0.914 | 81% | 0.805 | S | S | * | * | trans | -147.2 | 166 | 166.7 | -17.8 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 809 | S | 27.1 | Very low | 30.7 | Very low | 108 Ų | 108 | 126.4 Ų | 126.4 | 76% | 0.755 | 80% | 0.801 | S | S | * | * | trans | -158.5 | 177.6 | -172.4 | -139.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 810 | P | 57.3 | Low | 30.7 | Very low | 103 Ų | 103 | 126.5 Ų | 126.5 | 67% | 0.669 | 80% | 0.801 | S | S | * | * | cis | -136.6 | -166.3 | -1.6 | 26.8 | -0.4 | 0 | 0 | 0 | 115 | ||||
| 811 | Y | 30.7 | Very low | 30.7 | Very low | 238 Ų | 238 | 124.5 Ų | 124.5 | 93% | 0.933 | 80% | 0.8 | S | S | * | * | trans | 76.5 | 140.9 | 164.9 | -82.6 | -83.8 | 0 | 0 | 0 | 120 | ||||
| 812 | G | 28.3 | Very low | 30.2 | Very low | 81 Ų | 81 | 124.2 Ų | 124.2 | 84% | 0.835 | 80% | 0.801 | S | S | * | * | trans | 178.5 | -100.9 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 813 | G | 27.1 | Very low | 31.5 | Very low | 87 Ų | 87 | 120.6 Ų | 120.6 | 90% | 0.897 | 79% | 0.788 | S | S | * | * | trans | 100.8 | 154.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 814 | G | 28 | Very low | 31.7 | Very low | 70 Ų | 70 | 123.6 Ų | 123.6 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | trans | 111.7 | 87.6 | 158.8 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 815 | H | 30.3 | Very low | 31 | Very low | 193 Ų | 193 | 124.5 Ų | 124.5 | 89% | 0.894 | 78% | 0.782 | S | S | * | * | trans | 53.2 | 124.2 | 140.1 | -71.6 | -84.1 | 0 | 0 | 0 | 124.5 | ||||
| 816 | A | 27.3 | Very low | 31.3 | Very low | 82 Ų | 82 | 125.7 Ų | 125.7 | 68% | 0.678 | 78% | 0.78 | S | S | * | * | 90 | 123.7 | 122.1 | 0 | 0 | 0 | 0 | 0 | 124.2 | |||||
| 817 | L | 29.7 | Very low | 31.7 | Very low | 166 Ų | 166 | 125.6 Ų | 125.6 | 87% | 0.869 | 77% | 0.774 | S | S | * | * | trans | 65.6 | 118.2 | 131.4 | -73.4 | 167.3 | 0 | 0 | 0 | 124 | ||||
| 818 | A | 29.4 | Very low | 32.1 | Very low | 100 Ų | 100 | 124 Ų | 124 | 83% | 0.826 | 77% | 0.767 | S | S | * | * | 79.6 | 163.9 | 128.6 | 0 | 0 | 0 | 0 | 0 | 121.4 | |||||
| 819 | G | 26.4 | Very low | 32.5 | Very low | 67 Ų | 67 | 122.5 Ų | 122.5 | 69% | 0.691 | 76% | 0.758 | S | S | * | * | trans | 92.4 | 126.7 | -166.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 820 | Q | 26.8 | Very low | 32.9 | Very low | 185 Ų | 185 | 125.1 Ų | 125.1 | 86% | 0.864 | 76% | 0.762 | S | S | * | * | cis | 52.3 | 125.1 | 30.8 | -54.2 | -163 | 15.9 | 0 | 0 | 112 | ||||
| 821 | T | 26.6 | Very low | 31.8 | Very low | 128 Ų | 128 | 124.2 Ų | 124.2 | 79% | 0.785 | 76% | 0.763 | S | S | * | * | cis | -143.7 | 177 | 27.3 | 52.4 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 822 | S | 26.4 | Very low | 31.9 | Very low | 105 Ų | 105 | 119.8 Ų | 119.8 | 73% | 0.734 | 76% | 0.755 | S | S | * | * | trans | -63.5 | -178.2 | 158.4 | -140.7 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 823 | P | 50.7 | Low | 32.2 | Very low | 103 Ų | 103 | 122.9 Ų | 122.9 | 67% | 0.669 | 75% | 0.752 | S | S | * | * | cis | -144 | -171 | 2.5 | 44.8 | -25.8 | 0 | 0 | 0 | 117.3 | ||||
| 824 | K | 31.2 | Very low | 33.1 | Very low | 174 Ų | 174 | 124.6 Ų | 124.6 | 76% | 0.757 | 75% | 0.747 | S | S | * | * | trans | 71.3 | 131.5 | 154.7 | -79.9 | -168.1 | 167.5 | -163.8 | 0 | 118.8 | ||||
| 825 | Q | 34.4 | Very low | 33.1 | Very low | 133 Ų | 133 | 125.1 Ų | 125.1 | 62% | 0.621 | 75% | 0.752 | S | S | * | * | 74.9 | 136.4 | 74.6 | -140.3 | -165.1 | -31.2 | 0 | 0 | 110.2 | |||||
| 826 | E | 34.9 | Very low | 33.2 | Very low | 134 Ų | 134 | 120.6 Ų | 120.6 | 63% | 0.626 | 75% | 0.749 | S | S | * | * | cis | -167.2 | 160.1 | 33.6 | -167.3 | -175 | 86.9 | 0 | 0 | 113 | ||||
| 827 | N | 36.2 | Very low | 34 | Very low | 137 Ų | 137 | 122.7 Ų | 122.7 | 73% | 0.733 | 76% | 0.755 | S | S | * | * | trans | 61.2 | 164 | 158 | -88.8 | -40.9 | 0 | 0 | 0 | 117.6 | ||||
| 828 | G | 37.3 | Very low | 34.3 | Very low | 62 Ų | 62 | 121.7 Ų | 121.7 | 64% | 0.639 | 75% | 0.751 | S | S | * | * | cis | -176 | 150.8 | -5.3 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 829 | T | 36.3 | Very low | 35.3 | Very low | 116 Ų | 116 | 122.1 Ų | 122.1 | 71% | 0.712 | 75% | 0.745 | S | S | * | * | 122.5 | 134 | 68.5 | -79.5 | 0 | 0 | 0 | 0 | 107.9 | |||||
| 830 | L | 34.7 | Very low | 35.7 | Very low | 164 Ų | 164 | 123.4 Ų | 123.4 | 86% | 0.859 | 74% | 0.743 | S | S | * | * | trans | 18.3 | 152.2 | 158.8 | -59.3 | 165.1 | 0 | 0 | 0 | 121.4 | ||||
| 831 | A | 34.5 | Very low | 36.4 | Very low | 83 Ų | 83 | 122.9 Ų | 122.9 | 69% | 0.686 | 74% | 0.741 | S | S | * | * | cis | -179.2 | -152.7 | -18.5 | 0 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 832 | L | 34.4 | Very low | 37.7 | Very low | 146 Ų | 146 | 122.2 Ų | 122.2 | 76% | 0.764 | 74% | 0.739 | S | S | * | * | cis | -166.5 | 173.1 | -4.7 | -140.1 | -171.2 | 0 | 0 | 0 | 107.6 | ||||
| 833 | L | 33.9 | Very low | 38.2 | Very low | 145 Ų | 145 | 124.7 Ų | 124.7 | 76% | 0.759 | 74% | 0.743 | S | S | * | * | trans | 70.2 | 171.3 | 162.3 | -59.3 | 172 | 0 | 0 | 0 | 116.8 | ||||
| 834 | P | 46.6 | Very low | 37.5 | Very low | 124 Ų | 124 | 129.2 Ų | 129.2 | 81% | 0.805 | 78% | 0.775 | S | S | * | * | -139.3 | 177.4 | -68.8 | 42.2 | -26.3 | 0 | 0 | 0 | 114.3 | |||||
| 835 | G | 27.1 | Very low | 37.8 | Very low | 80 Ų | 80 | 127 Ų | 127 | 83% | 0.825 | 78% | 0.776 | S | S | * | * | trans | 136.1 | 134.5 | 155.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 836 | A | 32.9 | Very low | 38 | Very low | 99 Ų | 99 | 126.7 Ų | 126.7 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | -102.1 | 166.1 | 166.8 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 837 | P | 44.1 | Very low | 38.2 | Very low | 125 Ų | 125 | 126.3 Ų | 126.3 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | -141.5 | 170.7 | 67 | 40.3 | -23.6 | 0 | 0 | 0 | 116.2 | |||||
| 838 | D | 35.3 | Very low | 38.3 | Very low | 145 Ų | 145 | 125.6 Ų | 125.6 | 78% | 0.775 | 80% | 0.796 | S | S | * | * | trans | -66 | 163.4 | 158.8 | -136.9 | -11.2 | 0 | 0 | 0 | 109.8 | ||||
| 839 | P | 50.3 | Low | 38.3 | Very low | 110 Ų | 110 | 129.6 Ų | 129.6 | 71% | 0.714 | 81% | 0.806 | S | S | * | * | -148.4 | 166.2 | 59 | 41 | -21 | 0 | 0 | 0 | 118.3 | |||||
| 840 | S | 34.6 | Very low | 38.5 | Very low | 93 Ų | 93 | 130.5 Ų | 130.5 | 65% | 0.65 | 81% | 0.812 | S | S | * | * | trans | 58.2 | 103.3 | 140.7 | 63.6 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 841 | Q | 42.4 | Very low | 38.7 | Very low | 175 Ų | 175 | 128.1 Ų | 128.1 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | 16.8 | 144.6 | 106.3 | -97.9 | -171.7 | 19.8 | 0 | 0 | 118.7 | |||||
| 842 | P | 52.7 | Low | 39.1 | Very low | 113 Ų | 113 | 131.6 Ų | 131.6 | 73% | 0.734 | 82% | 0.819 | S | S | * | * | -146.4 | 154.4 | 69.7 | 39.3 | -22 | 0 | 0 | 0 | 118.8 | |||||
| 843 | L | 37.6 | Very low | 39.5 | Very low | 157 Ų | 157 | 130.4 Ų | 130.4 | 82% | 0.822 | 82% | 0.823 | S | S | * | * | trans | 45.6 | 101 | 141.2 | -59.9 | 168.5 | 0 | 0 | 0 | 118.8 | ||||
| 844 | C | 36.1 | Very low | 40 | Very low | 199 Ų | 199 | 129.1 Ų | 129.1 | 100% | 1.345 | 83% | 0.829 | S | S | * | * | -150.1 | 0 | 93.7 | -151.1 | 0 | 0 | 0 | 0 | 111.5 |
Retrieved 844 of 844 residues in 589.7 ms
(Link to these results)