| 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 | 34 | Very low | 34.9 | Very low | 253 Ų | 253 | 155.8 Ų | 155.8 | 100% | 1.246 | 84% | 0.839 | S | S | * | * | 0 | 144.8 | 0 | -70.6 | 163.3 | 170.4 | 0 | 0 | 109.3 | |||||
| 2 | R | 39.5 | Very low | 34.3 | Very low | 240 Ų | 240 | 151.3 Ų | 151.3 | 91% | 0.906 | 83% | 0.828 | S | S | * | * | trans | -125.1 | 150.5 | 159.9 | -90.7 | -174.6 | 172.7 | -175.1 | -1.2 | 105.4 | ||||
| 3 | P | 49.7 | Very low | 33.8 | Very low | 120 Ų | 120 | 148.5 Ų | 148.5 | 78% | 0.779 | 83% | 0.826 | S | S | * | * | -119.5 | 166.1 | 73 | 1.5 | 22.6 | 0 | 0 | 0 | 112.6 | |||||
| 4 | A | 36.3 | Very low | 33.5 | Very low | 86 Ų | 86 | 144.9 Ų | 144.9 | 71% | 0.711 | 83% | 0.825 | S | S | * | * | cis | 74.1 | 149.3 | 49.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 5 | L | 35.1 | Very low | 33.3 | Very low | 175 Ų | 175 | 143.4 Ų | 143.4 | 92% | 0.916 | 83% | 0.827 | S | S | * | * | cis | -164.5 | 154 | 11.9 | -142.3 | 162.9 | 0 | 0 | 0 | 108.5 | ||||
| 6 | G | 27.2 | Very low | 33 | Very low | 64 Ų | 64 | 139.6 Ų | 139.6 | 66% | 0.66 | 83% | 0.829 | S | S | * | * | trans | 149.8 | 127.9 | 159.4 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 7 | H | 29.3 | Very low | 32.9 | Very low | 192 Ų | 192 | 138.6 Ų | 138.6 | 89% | 0.889 | 83% | 0.83 | S | S | * | * | trans | -145.4 | 172.2 | 159.5 | -96.8 | 23.6 | 0 | 0 | 0 | 105.7 | ||||
| 8 | P | 49 | Very low | 32.7 | Very low | 111 Ų | 111 | 141.9 Ų | 141.9 | 72% | 0.721 | 83% | 0.833 | S | S | * | * | cis | -130.7 | 179 | -21.7 | 40.1 | -25.7 | 0 | 0 | 0 | 112.9 | ||||
| 9 | R | 29.2 | Very low | 33.4 | Very low | 246 Ų | 246 | 140.3 Ų | 140.3 | 93% | 0.928 | 83% | 0.827 | S | S | * | * | trans | -178.9 | 163.7 | 137.7 | -106.8 | 168.7 | 179.8 | 157.2 | 1.1 | 115.4 | ||||
| 10 | S | 26.9 | Very low | 34.2 | Very low | 101 Ų | 101 | 139.1 Ų | 139.1 | 71% | 0.706 | 82% | 0.823 | S | S | * | * | trans | -85.9 | 177.6 | 169.4 | 43.9 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 11 | V | 28.2 | Very low | 34.9 | Very low | 126 Ų | 126 | 138.1 Ų | 138.1 | 76% | 0.764 | 82% | 0.821 | S | S | * | * | cis | -158.4 | 164.6 | 29.3 | -141.1 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 12 | S | 26.9 | Very low | 35.3 | Very low | 102 Ų | 102 | 132 Ų | 132 | 71% | 0.713 | 80% | 0.8 | S | S | * | * | trans | 74.9 | 112.9 | 143 | -68.4 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 13 | S | 28.7 | Very low | 35 | Very low | 114 Ų | 114 | 125.1 Ų | 125.1 | 80% | 0.797 | 79% | 0.794 | S | S | * | * | 65.3 | 110.8 | 123.6 | 69.7 | 0 | 0 | 0 | 0 | 124.2 | |||||
| 14 | A | 29.7 | Very low | 34.2 | Very low | 98 Ų | 98 | 124.5 Ų | 124.5 | 81% | 0.81 | 80% | 0.799 | S | S | * | * | 178.4 | 162.9 | 128.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 15 | S | 29.7 | Very low | 33.8 | Very low | 123 Ų | 123 | 125 Ų | 125 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | cis | -169.5 | 132.6 | -37.3 | -89.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 16 | G | 29.4 | Very low | 33.5 | Very low | 83 Ų | 83 | 128.6 Ų | 128.6 | 86% | 0.856 | 81% | 0.805 | S | S | * | * | trans | 90.1 | 149.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 17 | S | 29.9 | Very low | 33.6 | Very low | 122 Ų | 122 | 133.9 Ų | 133.9 | 85% | 0.853 | 82% | 0.817 | S | S | * | * | cis | -138.9 | 176.6 | 6.5 | 58.2 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 18 | F | 30.4 | Very low | 33.7 | Very low | 199 Ų | 199 | 133.8 Ų | 133.8 | 87% | 0.873 | 82% | 0.817 | S | S | * | * | trans | -88.5 | -178.3 | -167.6 | -80 | -116.2 | 0 | 0 | 0 | 113.9 | ||||
| 19 | P | 45.4 | Very low | 33.4 | Very low | 111 Ų | 111 | 134 Ų | 134 | 72% | 0.721 | 82% | 0.818 | S | S | * | * | cis | -135.7 | -179.5 | -22.7 | 28.9 | -6.4 | 0 | 0 | 0 | 115.7 | ||||
| 20 | P | 49.5 | Very low | 33.3 | Very low | 116 Ų | 116 | 130.8 Ų | 130.8 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | trans | -114.7 | -168.1 | 164.8 | 42.7 | -33.1 | 0 | 0 | 0 | 113 | ||||
| 21 | P | 48.3 | Very low | 33.6 | Very low | 119 Ų | 119 | 135.3 Ų | 135.3 | 77% | 0.773 | 83% | 0.826 | S | S | * | * | cis | -109 | -98.9 | -30.8 | 28 | -5.4 | 0 | 0 | 0 | 110.5 | ||||
| 22 | P | 43.7 | Very low | 33.8 | Very low | 125 Ų | 125 | 137.3 Ų | 137.3 | 81% | 0.812 | 83% | 0.831 | S | S | * | * | cis | -110.6 | -134.1 | -16 | 42.4 | -26.9 | 0 | 0 | 0 | 113.1 | ||||
| 23 | A | 32.4 | Very low | 33.8 | Very low | 94 Ų | 94 | 143.9 Ų | 143.9 | 78% | 0.777 | 84% | 0.84 | S | S | * | * | trans | -153 | 163.1 | -172.6 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 24 | A | 32.1 | Very low | 33.7 | Very low | 107 Ų | 107 | 142.4 Ų | 142.4 | 88% | 0.884 | 84% | 0.844 | S | S | * | * | trans | 68.1 | 111.7 | 151 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 25 | A | 29.4 | Very low | 33.6 | Very low | 97 Ų | 97 | 142 Ų | 142 | 80% | 0.802 | 85% | 0.848 | S | S | * | * | trans | -155 | 138.2 | 144.5 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 26 | R | 28.7 | Very low | 33.6 | Very low | 250 Ų | 250 | 140.5 Ų | 140.5 | 94% | 0.943 | 84% | 0.838 | S | S | * | * | cis | 73.9 | 86.6 | 31.4 | -144.4 | -177.4 | -159.8 | -160.6 | 5.7 | 113.7 | ||||
| 27 | L | 28.4 | Very low | 33.6 | Very low | 176 Ų | 176 | 144.9 Ų | 144.9 | 92% | 0.921 | 83% | 0.834 | S | S | * | * | trans | -85.5 | 128 | 176.2 | -70.5 | 167.8 | 0 | 0 | 0 | 112 | ||||
| 28 | Q | 32.6 | Very low | 33.7 | Very low | 189 Ų | 189 | 150 Ų | 150 | 88% | 0.883 | 84% | 0.835 | S | S | * | * | trans | -151.1 | 159.5 | 152.2 | -101.2 | -163.1 | -11.1 | 0 | 0 | 109.7 | ||||
| 29 | P | 41.1 | Very low | 33.6 | Very low | 115 Ų | 115 | 144.3 Ų | 144.3 | 75% | 0.747 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -87.8 | 166.8 | -159.4 | 34.5 | -37.4 | 0 | 0 | 0 | 115.6 | ||
| 30 | L | 28.6 | Very low | 32.9 | Very low | 180 Ų | 180 | 151.2 Ų | 151.2 | 94% | 0.942 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 148.2 | 176.7 | -79.2 | 160.6 | 0 | 0 | 0 | 113.3 | ||
| 31 | F | 31.7 | Very low | 32.2 | Very low | 195 Ų | 195 | 157.3 Ų | 157.3 | 86% | 0.855 | 85% | 0.852 | S | S | * | * | P | Polyproline II helix | trans | -97.6 | 153.5 | 168.5 | -85.2 | -93.9 | 0 | 0 | 0 | 111.4 | ||
| 32 | L | 33.3 | Very low | 31.3 | Very low | 169 Ų | 169 | 154.7 Ų | 154.7 | 89% | 0.885 | 85% | 0.846 | S | S | * | * | 177.7 | 127.1 | 120.2 | -98.9 | 163.1 | 0 | 0 | 0 | 112.9 | |||||
| 33 | R | 26.7 | Very low | 30.9 | Very low | 239 Ų | 239 | 155.1 Ų | 155.1 | 90% | 0.902 | 85% | 0.852 | S | S | * | * | 153 | 113.7 | 111.7 | -173.3 | 171.6 | -172.2 | 162.2 | 2.1 | 114.3 | |||||
| 34 | G | 27.1 | Very low | 30.8 | Very low | 84 Ų | 84 | 154.2 Ų | 154.2 | 87% | 0.866 | 85% | 0.852 | S | S | * | * | trans | 89.7 | 126.2 | 144.6 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 35 | G | 27.2 | Very low | 30.9 | Very low | 88 Ų | 88 | 156.7 Ų | 156.7 | 91% | 0.907 | 85% | 0.851 | S | S | * | * | trans | 147.4 | 113.9 | 169 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 36 | S | 30 | Very low | 31.1 | Very low | 93 Ų | 93 | 157.3 Ų | 157.3 | 65% | 0.65 | 85% | 0.849 | S | S | * | * | trans | -126.7 | 137.1 | 177.9 | 177.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 37 | F | 29.5 | Very low | 31.3 | Very low | 175 Ų | 175 | 150.4 Ų | 150.4 | 77% | 0.768 | 84% | 0.839 | S | S | * | * | 164.3 | 158.2 | 120.6 | -90.8 | -67.2 | 0 | 0 | 0 | 112.6 | |||||
| 38 | R | 31 | Very low | 31.5 | Very low | 229 Ų | 229 | 147.4 Ų | 147.4 | 86% | 0.864 | 83% | 0.828 | S | S | * | * | trans | -4.6 | 135 | 160.6 | -57.7 | 162.4 | 178.6 | -176.6 | -1.8 | 116.5 | ||||
| 39 | G | 29.7 | Very low | 31.6 | Very low | 79 Ų | 79 | 143.3 Ų | 143.3 | 81% | 0.814 | 82% | 0.821 | S | S | * | * | cis | 100.9 | 102.4 | 13.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 40 | R | 30.6 | Very low | 31.1 | Very low | 257 Ų | 257 | 144.3 Ų | 144.3 | 97% | 0.97 | 83% | 0.825 | S | S | * | * | trans | -159.7 | 178.1 | 163 | -151 | 163.7 | -173.8 | -111.7 | 1.8 | 112 | ||||
| 41 | R | 34.1 | Very low | 31.2 | Very low | 243 Ų | 243 | 140.8 Ų | 140.8 | 92% | 0.917 | 82% | 0.815 | S | S | * | * | trans | -130.5 | 145 | -165.5 | -174.4 | -170.2 | -161.5 | -130.7 | 11.3 | 111.3 | ||||
| 42 | G | 30.2 | Very low | 31.3 | Very low | 64 Ų | 64 | 137.8 Ų | 137.8 | 66% | 0.66 | 81% | 0.813 | S | S | * | * | trans | 149.6 | 139.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 43 | S | 35.5 | Very low | 31.2 | Very low | 134 Ų | 134 | 134.7 Ų | 134.7 | 94% | 0.937 | 81% | 0.805 | S | S | * | * | cis | 70.9 | 116 | 22.2 | -49.8 | 0 | 0 | 0 | 0 | 115 | ||||
| 44 | G | 30.3 | Very low | 31.6 | Very low | 76 Ų | 76 | 135.2 Ų | 135.2 | 78% | 0.784 | 81% | 0.807 | S | S | * | * | trans | 163.6 | 118.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 45 | D | 32.5 | Very low | 31.9 | Very low | 158 Ų | 158 | 135.1 Ų | 135.1 | 85% | 0.845 | 81% | 0.806 | S | S | * | * | trans | -102.8 | 174.7 | 179.4 | -59.5 | -79.6 | 0 | 0 | 0 | 112.4 | ||||
| 46 | S | 35 | Very low | 32 | Very low | 111 Ų | 111 | 135.2 Ų | 135.2 | 78% | 0.776 | 81% | 0.807 | S | S | * | * | trans | 101.8 | 122.4 | 154.4 | -43.3 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 47 | S | 33.3 | Very low | 32.1 | Very low | 105 Ų | 105 | 134.7 Ų | 134.7 | 73% | 0.734 | 82% | 0.817 | S | S | * | * | trans | 8.4 | 161.9 | 138.6 | 62.7 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 48 | T | 32.3 | Very low | 32.1 | Very low | 112 Ų | 112 | 130.7 Ų | 130.7 | 69% | 0.687 | 83% | 0.825 | S | S | * | * | cis | -172.1 | 151 | 45.4 | -35.4 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 49 | S | 33.9 | Very low | 32.2 | Very low | 103 Ų | 103 | 123.4 Ų | 123.4 | 72% | 0.72 | 82% | 0.821 | S | S | * | * | trans | 62.6 | 155.1 | 153.3 | 50.5 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 50 | T | 31.3 | Very low | 32.4 | Very low | 136 Ų | 136 | 130.4 Ų | 130.4 | 83% | 0.834 | 82% | 0.823 | S | S | * | * | cis | -141.7 | -162.2 | 12.3 | -16.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 51 | S | 29.8 | Very low | 32.7 | Very low | 107 Ų | 107 | 129.1 Ų | 129.1 | 75% | 0.748 | 82% | 0.818 | S | S | * | * | cis | -148.9 | -157.6 | 14.7 | 64.4 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 52 | T | 33.3 | Very low | 32.6 | Very low | 132 Ų | 132 | 121.6 Ų | 121.6 | 81% | 0.81 | 82% | 0.816 | S | S | * | * | trans | -95.9 | 169.5 | -171.8 | 48.9 | 0 | 0 | 0 | 0 | 114 | ||||
| 53 | S | 31.6 | Very low | 32.7 | Very low | 103 Ų | 103 | 122.3 Ų | 122.3 | 72% | 0.72 | 82% | 0.823 | S | S | * | * | cis | -151.8 | 156.7 | 19.2 | 54.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 54 | R | 36.3 | Very low | 32.5 | Very low | 250 Ų | 250 | 120 Ų | 120 | 94% | 0.943 | 82% | 0.82 | S | S | * | * | 48.4 | 131.5 | 68.3 | -70.4 | -173.6 | 176.3 | -174.9 | -0.5 | 115.5 | |||||
| 55 | G | 32.1 | Very low | 32.6 | Very low | 82 Ų | 82 | 120.6 Ų | 120.6 | 85% | 0.845 | 83% | 0.827 | S | S | * | * | cis | 159.6 | 151.3 | -11.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 56 | G | 29.8 | Very low | 32.4 | Very low | 90 Ų | 90 | 116.8 Ų | 116.8 | 93% | 0.928 | 83% | 0.825 | S | S | * | * | trans | 103.5 | 160.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 57 | G | 31.4 | Very low | 32.7 | Very low | 83 Ų | 83 | 117.2 Ų | 117.2 | 86% | 0.856 | 83% | 0.828 | S | S | * | * | cis | 166.2 | 113.2 | -12.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 58 | G | 30.8 | Very low | 33.4 | Very low | 91 Ų | 91 | 117.9 Ų | 117.9 | 94% | 0.938 | 83% | 0.83 | S | S | * | * | trans | 83.7 | 159.9 | 170.5 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 59 | G | 31.7 | Very low | 33.5 | Very low | 75 Ų | 75 | 117.5 Ų | 117.5 | 77% | 0.773 | 83% | 0.832 | S | S | * | * | cis | 167.1 | 157.1 | -13.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 60 | R | 35.4 | Very low | 33.6 | Very low | 226 Ų | 226 | 117.8 Ų | 117.8 | 85% | 0.853 | 83% | 0.834 | S | S | * | * | trans | 79.1 | 126.4 | 160.5 | -65.7 | -174.8 | 168.9 | -152.2 | -3.1 | 123 | ||||
| 61 | R | 35.9 | Very low | 33.7 | Very low | 231 Ų | 231 | 116.2 Ų | 116.2 | 87% | 0.872 | 83% | 0.828 | S | S | * | * | trans | 78.2 | 139.4 | 134.5 | -78.5 | -175.9 | 168 | -158.5 | -4.6 | 122.3 | ||||
| 62 | G | 32.5 | Very low | 33.9 | Very low | 84 Ų | 84 | 118 Ų | 118 | 87% | 0.866 | 84% | 0.835 | S | S | * | * | trans | 105.5 | 139 | 158.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 63 | G | 32.4 | Very low | 33.7 | Very low | 79 Ų | 79 | 115.7 Ų | 115.7 | 81% | 0.814 | 84% | 0.837 | S | S | * | * | cis | 152.7 | 110.1 | -12.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 64 | G | 31.2 | Very low | 33.9 | Very low | 85 Ų | 85 | 115.5 Ų | 115.5 | 88% | 0.876 | 84% | 0.842 | S | S | * | * | trans | 78.3 | 159.3 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 65 | G | 32.1 | Very low | 33.6 | Very low | 89 Ų | 89 | 113.3 Ų | 113.3 | 92% | 0.918 | 84% | 0.843 | S | S | * | * | cis | 127.3 | 91.1 | -5.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 66 | G | 29.4 | Very low | 33.7 | Very low | 79 Ų | 79 | 118.9 Ų | 118.9 | 81% | 0.814 | 84% | 0.838 | S | S | * | * | trans | 169.3 | 117.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 67 | S | 39.7 | Very low | 33.9 | Very low | 120 Ų | 120 | 120.3 Ų | 120.3 | 84% | 0.839 | 82% | 0.821 | S | S | * | * | trans | -92.4 | 173.2 | 162.9 | -49.5 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 68 | P | 47.8 | Very low | 33.9 | Very low | 118 Ų | 118 | 122.5 Ų | 122.5 | 77% | 0.766 | 81% | 0.813 | S | S | * | * | -151.6 | 175.7 | 89.8 | 42.2 | -24.5 | 0 | 0 | 0 | 117.1 | |||||
| 69 | S | 34.7 | Very low | 34.1 | Very low | 104 Ų | 104 | 125 Ų | 125 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | trans | -19.5 | 168.3 | 155.6 | 55.3 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 70 | S | 35.4 | Very low | 34.1 | Very low | 109 Ų | 109 | 127.3 Ų | 127.3 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | cis | 174.2 | 139.5 | -23.3 | 60.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 71 | S | 33.9 | Very low | 33.9 | Very low | 103 Ų | 103 | 125.9 Ų | 125.9 | 72% | 0.72 | 80% | 0.802 | S | S | * | * | trans | -171.4 | 118.2 | 164.1 | 45.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 72 | T | 33.7 | Very low | 33.8 | Very low | 144 Ų | 144 | 118.5 Ų | 118.5 | 88% | 0.883 | 79% | 0.786 | S | S | * | * | 61.2 | 113.2 | 74.5 | 64.5 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 73 | G | 30.8 | Very low | 33.7 | Very low | 84 Ų | 84 | 123.1 Ų | 123.1 | 87% | 0.866 | 79% | 0.79 | S | S | * | * | trans | 161 | 102.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 74 | A | 34.7 | Very low | 33.6 | Very low | 100 Ų | 100 | 123.8 Ų | 123.8 | 83% | 0.826 | 78% | 0.782 | S | S | * | * | trans | -141.3 | 104.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 75 | E | 30 | Very low | 33.8 | Very low | 203 Ų | 203 | 125.9 Ų | 125.9 | 95% | 0.949 | 78% | 0.778 | S | S | * | * | trans | -129.9 | 172.4 | 172.1 | -66.5 | -168.5 | 121.8 | 0 | 0 | 109.1 | ||||
| 76 | R | 34.6 | Very low | 33.6 | Very low | 200 Ų | 200 | 126.4 Ų | 126.4 | 76% | 0.755 | 77% | 0.767 | S | S | * | * | trans | -146.8 | 163 | -146.6 | -154.5 | 174.3 | 173.9 | -118.6 | 1.1 | 110.4 | ||||
| 77 | E | 33.3 | Very low | 33.9 | Very low | 120 Ų | 120 | 131.8 Ų | 131.8 | 56% | 0.561 | 77% | 0.768 | S | S | * | * | trans | 70.9 | 113.3 | 158.9 | -79.9 | 144.8 | 155.6 | 0 | 0 | 118.1 | ||||
| 78 | D | 32.7 | Very low | 34.1 | Very low | 128 Ų | 128 | 131.2 Ų | 131.2 | 68% | 0.684 | 76% | 0.762 | S | S | * | * | 90.9 | 112 | 122.4 | -53.8 | -6.6 | 0 | 0 | 0 | 122.5 | |||||
| 79 | D | 34.1 | Very low | 33.1 | Very low | 143 Ų | 143 | 132.4 Ų | 132.4 | 77% | 0.765 | 76% | 0.761 | S | S | * | * | 85 | 141.4 | 124.3 | -65.7 | -17 | 0 | 0 | 0 | 125.1 | |||||
| 80 | D | 32.5 | Very low | 33 | Very low | 124 Ų | 124 | 133.5 Ų | 133.5 | 66% | 0.663 | 76% | 0.763 | S | S | * | * | trans | 46.9 | 123.8 | 155.8 | -91.5 | -57.1 | 0 | 0 | 0 | 122 | S82 | D80-S82 PolarHBondContact OD1-OG 2.8Š| ||
| 81 | E | 31 | Very low | 33.6 | Very low | 196 Ų | 196 | 134 Ų | 134 | 92% | 0.916 | 76% | 0.764 | S | S | * | * | -137 | 141 | 108.4 | -139.8 | -162 | 143.5 | 0 | 0 | 111.7 | |||||
| 82 | S | 33.8 | Very low | 33.2 | Very low | 77 Ų | 77 | 137.1 Ų | 137.1 | 54% | 0.538 | 77% | 0.772 | S | S | . | * | trans | -123.9 | 121 | -169.2 | -81.8 | 0 | 0 | 0 | 0 | 111.8 | D80 S84 | D80-S82 PolarHBondContact OD1-OG 2.8Å; S82-S84 PolarHBondContact O-N 3.08Å; S82-S84 VanDerWaalsContact O-N 3.08Å | ||
| 83 | L | 29.8 | Very low | 33 | Very low | 181 Ų | 181 | 134.3 Ų | 134.3 | 95% | 0.948 | 76% | 0.763 | S | S | * | * | trans | -79 | 94.1 | 168.2 | -77.6 | -178.7 | 0 | 0 | 0 | 111.8 | ||||
| 84 | S | 31.4 | Very low | 33 | Very low | 93 Ų | 93 | 134.5 Ų | 134.5 | 65% | 0.65 | 76% | 0.757 | S | S | * | * | trans | -66.9 | -178.1 | 159.5 | -62.7 | 0 | 0 | 0 | 0 | 111 | S82 | S82-S84 PolarHBondContact O-N 3.08Å; S82-S84 VanDerWaalsContact O-N 3.08Å | ||
| 85 | V | 33.6 | Very low | 32.7 | Very low | 129 Ų | 129 | 137 Ų | 137 | 78% | 0.782 | 76% | 0.756 | S | S | * | * | cis | -156.3 | 163.6 | 21.3 | -132.2 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 86 | S | 29.6 | Very low | 32.7 | Very low | 99 Ų | 99 | 135 Ų | 135 | 69% | 0.692 | 75% | 0.75 | S | S | * | * | cis | -143.2 | -179.7 | 7.5 | -56.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 87 | K | 34.1 | Very low | 32.4 | Very low | 192 Ų | 192 | 128.7 Ų | 128.7 | 84% | 0.835 | 75% | 0.748 | S | S | * | * | cis | 70.7 | 158.9 | 20 | -96.3 | 177.4 | 176.7 | 171.9 | 0 | 116.3 | ||||
| 88 | P | 43.9 | Very low | 32.9 | Very low | 109 Ų | 109 | 129 Ų | 129 | 71% | 0.708 | 76% | 0.76 | S | S | * | * | cis | -116.2 | -145.6 | -14.2 | 30.7 | -7.1 | 0 | 0 | 0 | 109.4 | ||||
| 89 | L | 27.4 | Very low | 33.9 | Very low | 143 Ų | 143 | 128.4 Ų | 128.4 | 75% | 0.749 | 76% | 0.764 | S | S | * | * | cis | -157.4 | 105.4 | 2.1 | -164.1 | 120.4 | 0 | 0 | 0 | 113 | ||||
| 90 | V | 33.2 | Very low | 33.8 | Very low | 127 Ų | 127 | 127.6 Ų | 127.6 | 77% | 0.77 | 76% | 0.764 | S | S | * | * | trans | 73.1 | 150.6 | 133.9 | 168.9 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 91 | P | 47.1 | Very low | 33.7 | Very low | 120 Ų | 120 | 130.1 Ų | 130.1 | 78% | 0.779 | 77% | 0.772 | S | S | * | * | trans | -112.1 | -171.3 | -170 | 43.1 | -32 | 0 | 0 | 0 | 114.1 | ||||
| 92 | N | 26.5 | Very low | 33.7 | Very low | 167 Ų | 167 | 127.5 Ų | 127.5 | 89% | 0.893 | 77% | 0.769 | S | S | * | * | trans | -143.7 | 166.1 | 163.9 | -150.4 | -4.2 | 0 | 0 | 0 | 111.9 | ||||
| 93 | A | 29.2 | Very low | 33.5 | Very low | 85 Ų | 85 | 127.3 Ų | 127.3 | 70% | 0.702 | 78% | 0.779 | S | S | * | * | trans | -127.7 | -174 | -167.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 94 | A | 29.9 | Very low | 33.4 | Very low | 89 Ų | 89 | 123.6 Ų | 123.6 | 74% | 0.736 | 78% | 0.775 | S | S | * | * | trans | 78.4 | 151.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 95 | L | 28.6 | Very low | 33.3 | Very low | 152 Ų | 152 | 123.8 Ų | 123.8 | 80% | 0.796 | 78% | 0.782 | S | S | * | * | cis | -162.3 | 167.1 | -5.2 | -144.5 | 56.2 | 0 | 0 | 0 | 111.5 | ||||
| 96 | L | 30.5 | Very low | 33 | Very low | 160 Ų | 160 | 122.4 Ų | 122.4 | 84% | 0.838 | 78% | 0.784 | S | S | * | * | trans | 60.1 | 129.3 | 153 | -78.2 | 157.3 | 0 | 0 | 0 | 123.6 | ||||
| 97 | G | 28.2 | Very low | 32.9 | Very low | 68 Ų | 68 | 121 Ų | 121 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | 96.2 | 117.6 | 112.7 | 0 | 0 | 0 | 0 | 0 | 122.2 | |||||
| 98 | P | 44.5 | Very low | 33.1 | Very low | 127 Ų | 127 | 117.8 Ų | 117.8 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | trans | -107.8 | -157.9 | 163.7 | 44.8 | -35.9 | 0 | 0 | 0 | 110.9 | ||||
| 99 | P | 53.8 | Low | 32.5 | Very low | 116 Ų | 116 | 117.1 Ų | 117.1 | 75% | 0.753 | 79% | 0.787 | S | S | * | * | cis | -135.3 | 179.4 | -15.1 | 43 | -27.2 | 0 | 0 | 0 | 115.6 | ||||
| 100 | T | 30.5 | Very low | 33 | Very low | 126 Ų | 126 | 116.4 Ų | 116.4 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | trans | -171.6 | 127.8 | 145.4 | 25.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 101 | Q | 31.4 | Very low | 32.7 | Very low | 177 Ų | 177 | 115.3 Ų | 115.3 | 83% | 0.827 | 80% | 0.796 | S | S | * | * | 57.8 | 138.3 | 86.2 | -70.2 | -168.3 | -4 | 0 | 0 | 114.7 | |||||
| 102 | V | 31.1 | Very low | 31.7 | Very low | 141 Ų | 141 | 114 Ų | 114 | 86% | 0.855 | 80% | 0.795 | S | S | * | * | cis | -139.5 | 143.7 | 19.3 | 176.4 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 103 | G | 28.6 | Very low | 31.7 | Very low | 72 Ų | 72 | 115.6 Ų | 115.6 | 74% | 0.742 | 79% | 0.794 | S | S | * | * | 143.6 | 156.6 | 109 | 0 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 104 | A | 28 | Very low | 31.5 | Very low | 104 Ų | 104 | 116.8 Ų | 116.8 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | trans | -153.7 | 153.3 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 105 | A | 28.6 | Very low | 31.3 | Very low | 97 Ų | 97 | 118 Ų | 118 | 80% | 0.802 | 80% | 0.801 | S | S | * | * | trans | 167.9 | 154.5 | 137.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 106 | A | 29.1 | Very low | 31.2 | Very low | 100 Ų | 100 | 116.7 Ų | 116.7 | 83% | 0.826 | 80% | 0.804 | S | S | * | * | trans | 64.2 | 122.6 | 149.8 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 107 | G | 26.2 | Very low | 31 | Very low | 70 Ų | 70 | 114.1 Ų | 114.1 | 72% | 0.722 | 81% | 0.806 | S | S | * | * | trans | -89.6 | -166 | 141.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 108 | P | 39.6 | Very low | 30.8 | Very low | 124 Ų | 124 | 115.1 Ų | 115.1 | 81% | 0.805 | 81% | 0.807 | S | S | * | * | cis | -149.8 | 173.1 | 47.6 | 42.6 | -23.6 | 0 | 0 | 0 | 118.3 | ||||
| 109 | A | 30.6 | Very low | 29.8 | Very low | 94 Ų | 94 | 115.5 Ų | 115.5 | 78% | 0.777 | 81% | 0.808 | S | S | * | * | trans | 66.7 | 149.5 | 147.4 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 110 | P | 37.1 | Very low | 28.4 | Very low | 128 Ų | 128 | 114.9 Ų | 114.9 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -100 | 161.5 | -179.2 | 39.3 | -35.2 | 0 | 0 | 0 | 114.2 | ||
| 111 | A | 27.8 | Very low | 28.2 | Very low | 105 Ų | 105 | 114.3 Ų | 114.3 | 87% | 0.868 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 141.5 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 112 | A | 26.8 | Very low | 27.8 | Very low | 92 Ų | 92 | 111.1 Ų | 111.1 | 76% | 0.76 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -97.3 | 156.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 113 | F | 24.9 | Very low | 27.6 | Very low | 200 Ų | 200 | 111.3 Ų | 111.3 | 88% | 0.877 | 81% | 0.806 | S | S | * | * | trans | -142.9 | 118.8 | 161.7 | -132.7 | -85.9 | 0 | 0 | 0 | 111.1 | ||||
| 114 | S | 24.8 | Very low | 27.5 | Very low | 110 Ų | 110 | 112.6 Ų | 112.6 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | trans | -107.6 | 137.7 | 170.3 | -65.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 115 | S | 25.9 | Very low | 27.5 | Very low | 116 Ų | 116 | 113.7 Ų | 113.7 | 81% | 0.811 | 80% | 0.8 | S | S | * | * | trans | -156 | 123.8 | 162.7 | -81.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 116 | S | 26.8 | Very low | 27.7 | Very low | 123 Ų | 123 | 114.4 Ų | 114.4 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | trans | -117.2 | 128.5 | 177.5 | 54.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 117 | A | 25.9 | Very low | 27.5 | Very low | 107 Ų | 107 | 116 Ų | 116 | 88% | 0.884 | 80% | 0.796 | S | S | * | * | trans | -143 | 151.6 | 168.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 118 | A | 25 | Very low | 27.4 | Very low | 88 Ų | 88 | 118.4 Ų | 118.4 | 73% | 0.727 | 80% | 0.802 | S | S | * | * | trans | -123.9 | -167.9 | -174.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 119 | T | 24.2 | Very low | 26.7 | Very low | 135 Ų | 135 | 117.8 Ų | 117.8 | 83% | 0.828 | 80% | 0.8 | S | S | * | * | trans | 78.7 | 157 | 179.1 | 74.2 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 120 | S | 24.4 | Very low | 26.5 | Very low | 104 Ų | 104 | 119.4 Ų | 119.4 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | 179.9 | 113.7 | -67.6 | 47.6 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 121 | S | 24.7 | Very low | 25.9 | Very low | 113 Ų | 113 | 118.7 Ų | 118.7 | 79% | 0.79 | 80% | 0.803 | S | S | * | * | trans | -172.5 | 133.2 | 153.4 | 44.1 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 122 | S | 24.3 | Very low | 25.8 | Very low | 110 Ų | 110 | 123 Ų | 123 | 77% | 0.769 | 81% | 0.807 | S | S | * | * | cis | 109.5 | 83.2 | 17.6 | 74.9 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 123 | T | 25.3 | Very low | 26 | Very low | 145 Ų | 145 | 125.1 Ų | 125.1 | 89% | 0.89 | 81% | 0.811 | S | S | * | * | trans | -127.2 | 116.4 | 154.7 | -54 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 124 | S | 27.7 | Very low | 26.1 | Very low | 100 Ų | 100 | 120.8 Ų | 120.8 | 70% | 0.699 | 81% | 0.812 | S | S | * | * | trans | -87.1 | 170.6 | 178.5 | 57.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 125 | T | 27.8 | Very low | 26.2 | Very low | 127 Ų | 127 | 119.8 Ų | 119.8 | 78% | 0.779 | 81% | 0.81 | S | S | * | * | cis | -175.9 | -175.3 | 0.1 | 13.7 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 126 | P | 32.4 | Very low | 26.2 | Very low | 112 Ų | 112 | 121.7 Ų | 121.7 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | cis | -128.2 | 155.6 | -15.5 | 29.1 | -9.9 | 0 | 0 | 0 | 114.6 | ||||
| 127 | T | 25.6 | Very low | 26.3 | Very low | 133 Ų | 133 | 126.5 Ų | 126.5 | 82% | 0.816 | 82% | 0.817 | S | S | * | * | trans | -119 | 133.4 | 149.9 | 43.1 | 0 | 0 | 0 | 0 | 108.6 | S129 | T127-S129 PolarHBondContact O-N 3.02Š| ||
| 128 | S | 24.5 | Very low | 26.3 | Very low | 120 Ų | 120 | 125.3 Ų | 125.3 | 84% | 0.839 | 82% | 0.816 | S | S | * | * | trans | -86.6 | 97.6 | -174.1 | 57.4 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 129 | S | 24.4 | Very low | 26.3 | Very low | 111 Ų | 111 | 125.3 Ų | 125.3 | 78% | 0.776 | 82% | 0.824 | S | S | * | * | trans | -85.9 | 119.7 | 174 | -58.9 | 0 | 0 | 0 | 0 | 111.3 | T127 | T127-S129 PolarHBondContact O-N 3.02Š| ||
| 130 | C | 26.1 | Very low | 26.3 | Very low | 129 Ų | 129 | 123 Ų | 123 | 87% | 0.872 | 83% | 0.827 | S | S | * | * | trans | -100.1 | 113.4 | 164 | -68.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 131 | S | 24.2 | Very low | 26.4 | Very low | 112 Ų | 112 | 123.2 Ų | 123.2 | 78% | 0.783 | 84% | 0.835 | S | S | * | * | trans | -74.7 | 148.6 | 171.3 | 44.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 132 | M | 27.1 | Very low | 26.6 | Very low | 195 Ų | 195 | 122.9 Ų | 122.9 | 96% | 0.961 | 84% | 0.84 | S | S | * | * | trans | -131.3 | 118.5 | 161.1 | -79.4 | -166.8 | 159.4 | 0 | 0 | 109.1 | ||||
| 133 | T | 30.5 | Very low | 26.9 | Very low | 138 Ų | 138 | 122.7 Ų | 122.7 | 85% | 0.847 | 85% | 0.845 | S | S | * | * | trans | -80.4 | 139.8 | 173.3 | 43.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 134 | A | 26.5 | Very low | 27 | Very low | 108 Ų | 108 | 120 Ų | 120 | 89% | 0.893 | 85% | 0.845 | S | S | * | * | trans | -80.5 | 127.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 135 | A | 27.7 | Very low | 27.1 | Very low | 89 Ų | 89 | 119.9 Ų | 119.9 | 74% | 0.736 | 85% | 0.851 | S | S | * | * | trans | -150 | 162.1 | 161.6 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 136 | D | 25.1 | Very low | 27.1 | Very low | 157 Ų | 157 | 121 Ų | 121 | 84% | 0.84 | 86% | 0.857 | S | S | * | * | trans | 74.9 | 70 | 176.1 | -59.2 | -10.2 | 0 | 0 | 0 | 118.2 | ||||
| 137 | F | 28.2 | Very low | 26.9 | Very low | 223 Ų | 223 | 119.2 Ų | 119.2 | 98% | 0.978 | 86% | 0.859 | S | S | * | * | trans | -126.6 | 116.7 | 140.8 | -93.2 | -83.9 | 0 | 0 | 0 | 109.1 | ||||
| 138 | G | 26.7 | Very low | 26.9 | Very low | 83 Ų | 83 | 116.5 Ų | 116.5 | 86% | 0.856 | 86% | 0.857 | S | S | * | * | trans | -171.6 | 108.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 139 | G | 25 | Very low | 27.5 | Very low | 87 Ų | 87 | 117 Ų | 117 | 90% | 0.897 | 86% | 0.858 | S | S | * | * | trans | -178.5 | 91.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 140 | G | 24.2 | Very low | 27.5 | Very low | 87 Ų | 87 | 115.7 Ų | 115.7 | 90% | 0.897 | 86% | 0.862 | S | S | * | * | trans | 118.1 | 67.5 | 157.2 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 141 | A | 27.1 | Very low | 27.6 | Very low | 108 Ų | 108 | 115.6 Ų | 115.6 | 89% | 0.893 | 86% | 0.863 | S | S | * | * | trans | -151 | 141.8 | 148.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 142 | A | 28.8 | Very low | 27.7 | Very low | 107 Ų | 107 | 121.8 Ų | 121.8 | 88% | 0.884 | 87% | 0.869 | S | S | * | * | trans | -127.3 | 133.3 | -170.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 143 | A | 30.3 | Very low | 27.8 | Very low | 106 Ų | 106 | 118.3 Ų | 118.3 | 88% | 0.876 | 86% | 0.864 | S | S | * | * | trans | -163.5 | 143.4 | 165.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 144 | G | 28.1 | Very low | 27.7 | Very low | 87 Ų | 87 | 116.3 Ų | 116.3 | 90% | 0.897 | 86% | 0.861 | S | S | * | * | trans | 77.4 | 126.6 | 159.4 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 145 | A | 27.9 | Very low | 27.8 | Very low | 99 Ų | 99 | 115.2 Ų | 115.2 | 82% | 0.818 | 86% | 0.86 | S | S | * | * | trans | -131.6 | 136 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 146 | V | 29.4 | Very low | 27.7 | Very low | 150 Ų | 150 | 114.5 Ų | 114.5 | 91% | 0.909 | 86% | 0.862 | S | S | * | * | trans | -154.4 | 134.9 | 160.8 | 171.5 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 147 | G | 27.7 | Very low | 28 | Very low | 75 Ų | 75 | 112.6 Ų | 112.6 | 77% | 0.773 | 87% | 0.868 | S | S | * | * | trans | 72.3 | 124.3 | 144.6 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 148 | G | 26 | Very low | 28 | Very low | 76 Ų | 76 | 105.9 Ų | 105.9 | 78% | 0.784 | 86% | 0.862 | S | S | * | * | trans | -101.1 | -151.4 | 155.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 149 | P | 36 | Very low | 28 | Very low | 131 Ų | 131 | 105.9 Ų | 105.9 | 85% | 0.851 | 86% | 0.861 | S | S | * | * | cis | -137.3 | 160.3 | -2.2 | 40.9 | -24.3 | 0 | 0 | 0 | 116.5 | ||||
| 150 | G | 25.7 | Very low | 28.2 | Very low | 83 Ų | 83 | 109 Ų | 109 | 86% | 0.856 | 86% | 0.863 | S | S | * | * | trans | 59.8 | 116.9 | 133.7 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 151 | S | 28.1 | Very low | 28.4 | Very low | 127 Ų | 127 | 108.7 Ų | 108.7 | 89% | 0.888 | 86% | 0.86 | S | S | * | * | trans | -136.6 | 164.6 | 147.1 | 64.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 152 | R | 26.1 | Very low | 28.6 | Very low | 241 Ų | 241 | 111 Ų | 111 | 91% | 0.909 | 86% | 0.863 | S | S | * | * | trans | -124.3 | 169.7 | -169.9 | -72.8 | -178.6 | 174.8 | 173.4 | -1.6 | 112.3 | ||||
| 153 | S | 29.5 | Very low | 28.6 | Very low | 123 Ų | 123 | 109.5 Ų | 109.5 | 86% | 0.86 | 86% | 0.858 | S | S | * | * | trans | 92.2 | 150.3 | 161.7 | -56.8 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 154 | A | 28.1 | Very low | 28.9 | Very low | 96 Ų | 96 | 110.7 Ų | 110.7 | 79% | 0.793 | 86% | 0.86 | S | S | * | * | cis | -168.4 | 143.1 | -25.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 155 | G | 27.4 | Very low | 29.1 | Very low | 85 Ų | 85 | 110.1 Ų | 110.1 | 88% | 0.876 | 85% | 0.854 | S | S | * | * | trans | 78.8 | 149 | 168.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 156 | G | 26.9 | Very low | 29.3 | Very low | 74 Ų | 74 | 109.7 Ų | 109.7 | 76% | 0.763 | 85% | 0.851 | S | S | * | * | cis | 177.4 | 141.2 | -8.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 157 | A | 30.4 | Very low | 29.3 | Very low | 117 Ų | 117 | 108.4 Ų | 108.4 | 97% | 0.967 | 85% | 0.848 | S | S | * | * | trans | 59.9 | 146.2 | -178.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 158 | G | 28 | Very low | 29.4 | Very low | 82 Ų | 82 | 110.4 Ų | 110.4 | 85% | 0.845 | 85% | 0.849 | S | S | * | * | cis | 157.4 | 100.6 | -6.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 159 | G | 27.4 | Very low | 29.8 | Very low | 82 Ų | 82 | 111.4 Ų | 111.4 | 85% | 0.845 | 84% | 0.843 | S | S | * | * | trans | -175.7 | 132.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 160 | T | 29.4 | Very low | 29.8 | Very low | 154 Ų | 154 | 110.4 Ų | 110.4 | 95% | 0.945 | 84% | 0.837 | S | S | * | * | trans | -96 | 149.9 | -177.8 | 50.8 | 0 | 0 | 0 | 0 | 112 | ||||
| 161 | G | 28.3 | Very low | 30.3 | Very low | 80 Ų | 80 | 111.3 Ų | 111.3 | 83% | 0.825 | 83% | 0.829 | S | S | * | * | trans | 159.5 | 110 | 165.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 162 | T | 30.5 | Very low | 30.7 | Very low | 155 Ų | 155 | 110.3 Ų | 110.3 | 95% | 0.951 | 82% | 0.82 | S | S | * | * | trans | -78 | 140.3 | 168 | 44.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 163 | G | 28.7 | Very low | 31 | Very low | 76 Ų | 76 | 104.3 Ų | 104.3 | 78% | 0.784 | 81% | 0.814 | S | S | * | * | trans | 178.4 | 91.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | G165 | G163-G165 PolarHBondContact O-N 3.19Š| ||
| 164 | S | 38.1 | Very low | 31.3 | Very low | 132 Ų | 132 | 104.4 Ų | 104.4 | 92% | 0.923 | 81% | 0.813 | S | S | * | * | trans | -71.4 | 109.3 | 172.2 | -173.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 165 | G | 30.7 | Very low | 31.7 | Very low | 75 Ų | 75 | 105.4 Ų | 105.4 | 77% | 0.773 | 81% | 0.813 | S | S | * | * | trans | -89.3 | 101.9 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | G163 | G163-G165 PolarHBondContact O-N 3.19Š| ||
| 166 | A | 32.3 | Very low | 32 | Very low | 90 Ų | 90 | 105 Ų | 105 | 74% | 0.744 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 135.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | C168 | A166-C168 PolarHBondContact O-N 3.13Š|
| 167 | S | 30.2 | Very low | 32.4 | Very low | 122 Ų | 122 | 107 Ų | 107 | 85% | 0.853 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 119.7 | 178.2 | -178.5 | 0 | 0 | 0 | 0 | 111.9 | ||
| 168 | C | 29.7 | Very low | 32.6 | Very low | 118 Ų | 118 | 107.6 Ų | 107.6 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -87 | 132 | 175.2 | -76.4 | 0 | 0 | 0 | 0 | 110.9 | A166 | A166-C168 PolarHBondContact O-N 3.13Š|
| 169 | C | 35.2 | Very low | 32.8 | Very low | 97 Ų | 97 | 111.3 Ų | 111.3 | 66% | 0.655 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 143.9 | 179.2 | -72.6 | 0 | 0 | 0 | 0 | 112.7 | C171 | C169-C171 PolarHBondContact O-N 3.3Å; C169-C171 VanDerWaalsContact O-N 3.09Å |
| 170 | P | 34.2 | Very low | 33.1 | Very low | 110 Ų | 110 | 118.8 Ų | 118.8 | 71% | 0.714 | 81% | 0.807 | S | S | * | * | G | 310 helix | trans | -69.8 | -7.3 | -174.9 | 28.1 | -36.2 | 0 | 0 | 0 | 115 | C172 | P170-C172 PolarHBondContact O-N 2.98Å; P170-C172 VanDerWaalsContact O-N 3.11Å |
| 171 | C | 37 | Very low | 33.6 | Very low | 102 Ų | 102 | 117.4 Ų | 117.4 | 69% | 0.689 | 80% | 0.804 | S | S | * | * | G | 310 helix | trans | -71.4 | -1.4 | -174.6 | -56.1 | 0 | 0 | 0 | 0 | 115.3 | C169 | C169-C171 PolarHBondContact O-N 3.3Å; C169-C171 VanDerWaalsContact O-N 3.09Å |
| 172 | C | 36.2 | Very low | 33.9 | Very low | 106 Ų | 106 | 116.9 Ų | 116.9 | 72% | 0.716 | 80% | 0.798 | S | S | * | * | G | 310 helix | trans | -88.6 | -11.1 | -178.1 | -70.1 | 0 | 0 | 0 | 0 | 114.7 | P170 C174 | P170-C172 PolarHBondContact O-N 2.98Å; P170-C172 VanDerWaalsContact O-N 3.11Å; C172-C174 VanDerWaalsContact C-N 3.27Å; C172-C174 PolarHBondContact O-N 3.23Å |
| 173 | C | 33.5 | Very low | 34.2 | Very low | 115 Ų | 115 | 121.7 Ų | 121.7 | 78% | 0.777 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | -6.8 | -168 | -60.1 | 0 | 0 | 0 | 0 | 115.7 | C175 | C173-C175 PolarHBondContact O-N 2.84Š|
| 174 | C | 34.4 | Very low | 35 | Very low | 124 Ų | 124 | 130.3 Ų | 130.3 | 84% | 0.838 | 81% | 0.808 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.3 | -1.2 | -175.4 | -57.5 | 0 | 0 | 0 | 0 | 114.9 | C172 G176 | C172-C174 VanDerWaalsContact C-N 3.27Å; C172-C174 PolarHBondContact O-N 3.23Å; C174-G176 PolarHBondContact O-N 3.02Å |
| 175 | C | 36.4 | Very low | 34.9 | Very low | 118 Ų | 118 | 127.5 Ų | 127.5 | 80% | 0.797 | 80% | 0.8 | S | S | * | * | trans | -95.7 | 68.5 | -176.9 | -69.5 | 0 | 0 | 0 | 0 | 112.3 | C173 C177 | C173-C175 PolarHBondContact O-N 2.84Å; C175-C177 PolarHBondContact O-N 2.87Å | ||
| 176 | G | 34.2 | Very low | 35.1 | Very low | 76 Ų | 76 | 134.8 Ų | 134.8 | 78% | 0.784 | 80% | 0.804 | S | S | * | * | trans | -70.1 | 108.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | C174 | C174-G176 PolarHBondContact O-N 3.02Š| ||
| 177 | C | 34.6 | Very low | 35.6 | Very low | 117 Ų | 117 | 142.9 Ų | 142.9 | 79% | 0.791 | 82% | 0.815 | S | S | * | * | trans | -142.5 | 134.5 | 165.8 | -79.4 | 0 | 0 | 0 | 0 | 108.7 | C175 | C175-C177 PolarHBondContact O-N 2.87Š| ||
| 178 | P | 36.7 | Very low | 35.9 | Very low | 129 Ų | 129 | 147.2 Ų | 147.2 | 84% | 0.838 | 81% | 0.813 | S | S | * | * | trans | -71.8 | 138.2 | 179.7 | 29.8 | -34.2 | 0 | 0 | 0 | 111 | ||||
| 179 | D | 31.6 | Very low | 36.1 | Very low | 160 Ų | 160 | 144.9 Ų | 144.9 | 86% | 0.856 | 81% | 0.809 | S | S | * | * | trans | -71.4 | 145.5 | -178 | -150.1 | -22.6 | 0 | 0 | 0 | 111.5 | ||||
| 180 | R | 33 | Very low | 36 | Very low | 239 Ų | 239 | 146.5 Ų | 146.5 | 90% | 0.902 | 82% | 0.82 | S | S | * | * | trans | -138.3 | 106.9 | 175.3 | -147.4 | 178.1 | -166.2 | -173 | 4.7 | 109.7 | G182 | R180-G182 PolarHBondContact O-N 3.37Š| ||
| 181 | S | 39.9 | Very low | 36 | Very low | 125 Ų | 125 | 145.2 Ų | 145.2 | 87% | 0.874 | 82% | 0.819 | S | S | * | * | trans | -64.2 | 127 | -169.4 | 45.6 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 182 | G | 35.5 | Very low | 36 | Very low | 69 Ų | 69 | 144.3 Ų | 144.3 | 71% | 0.711 | 81% | 0.811 | S | S | * | * | trans | -176.4 | 97.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | R180 | R180-G182 PolarHBondContact O-N 3.37Š| ||
| 183 | R | 36 | Very low | 36.1 | Very low | 255 Ų | 255 | 142.7 Ų | 142.7 | 96% | 0.962 | 80% | 0.801 | S | S | * | * | trans | 64.8 | 134.9 | 161.8 | -67.7 | -177.2 | 168.1 | -174.7 | -4.4 | 119.2 | ||||
| 184 | R | 44.9 | Very low | 36.7 | Very low | 257 Ų | 257 | 142.3 Ų | 142.3 | 97% | 0.97 | 80% | 0.797 | S | S | * | * | trans | -70.7 | 137.7 | 171 | -60.2 | 171.5 | 176.4 | 173.7 | -2.7 | 110.6 | ||||
| 185 | G | 36.9 | Very low | 37 | Very low | 73 Ų | 73 | 147.3 Ų | 147.3 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | trans | 175.9 | 114.4 | 167.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 186 | R | 35.7 | Very low | 37.6 | Very low | 228 Ų | 228 | 146.2 Ų | 146.2 | 86% | 0.86 | 79% | 0.791 | S | S | * | * | trans | 55.4 | 113.9 | 175.1 | -69.6 | -177.9 | 167.4 | -174.9 | -5.8 | 116.7 | R188 | R186-R188 VanDerWaalsContact C-N 3.25Å; R186-R188 PolarHBondContact O-N 3.16Å | ||
| 187 | R | 41.4 | Very low | 38.8 | Very low | 261 Ų | 261 | 148.6 Ų | 148.6 | 99% | 0.985 | 78% | 0.777 | S | S | * | * | trans | -64 | 84.1 | 154.8 | -77 | -173.3 | 173.1 | -154 | -0.2 | 110 | G189 | R187-G189 PolarHBondContact O-N 3.13Š| ||
| 188 | R | 37.3 | Very low | 40.4 | Very low | 213 Ų | 213 | 147.9 Ų | 147.9 | 80% | 0.804 | 76% | 0.757 | S | S | * | * | trans | -72.3 | 116.3 | 150.2 | -82.3 | -179.3 | 166.8 | 163.9 | -4.5 | 106.1 | R186 | R186-R188 VanDerWaalsContact C-N 3.25Å; R186-R188 PolarHBondContact O-N 3.16Å | ||
| 189 | G | 33.2 | Very low | 42.5 | Very low | 69 Ų | 69 | 143.7 Ų | 143.7 | 71% | 0.711 | 74% | 0.738 | S | S | * | * | trans | -58.6 | 139.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | R187 A191 | R187-G189 PolarHBondContact O-N 3.13Å; G189-A191 VanDerWaalsContact C-N 3.31Å; G189-A191 PolarHBondContact O-N 2.66Å | ||
| 190 | C | 33.3 | Very low | 45 | Very low | 130 Ų | 130 | 139.4 Ų | 139.4 | 88% | 0.878 | 71% | 0.71 | S | S | * | * | trans | -66.7 | 89.4 | 179 | -61.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 191 | A | 34.2 | Very low | 47.5 | Very low | 84 Ų | 84 | 129 Ų | 129 | 69% | 0.694 | 67% | 0.672 | S | S | * | * | trans | -58.1 | 122.8 | 170.4 | 0 | 0 | 0 | 0 | 0 | 108.1 | G189 S193 | G189-A191 VanDerWaalsContact C-N 3.31Å; G189-A191 PolarHBondContact O-N 2.66Å; A191-S193 PolarHBondContact O-N 2.8Å; A191-S193 VanDerWaalsContact O-N 3.08Å | ||
| 192 | P | 38.1 | Very low | 49.7 | Very low | 83 Ų | 83 | 125.6 Ų | 125.6 | 54% | 0.539 | 65% | 0.651 | S | S | . | * | trans | -62.9 | 118 | -171.8 | 22.7 | -33.1 | 0 | 0 | 0 | 110.2 | ||||
| 193 | S | 37.5 | Very low | 52.3 | Low | 72 Ų | 72 | 126.2 Ų | 126.2 | 50% | 0.503 | 64% | 0.638 | S | S | . | * | trans | -46 | 131.9 | -174.5 | -56 | 0 | 0 | 0 | 0 | 111.4 | A191 R195 C196 | A191-S193 PolarHBondContact O-N 2.8Å; A191-S193 VanDerWaalsContact O-N 3.08Å; S193-R195 PolarHBondContact O-N 3.2Å; S193-C196 PolarHBondContact O-N 3.32Å | ||
| 194 | P | 45.3 | Very low | 54.8 | Low | 107 Ų | 107 | 114.1 Ų | 114.1 | 70% | 0.695 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.4 | -18.6 | -172.4 | 22.3 | -33.1 | 0 | 0 | 0 | 114 | ||
| 195 | R | 41.8 | Very low | 57 | Low | 228 Ų | 228 | 103.2 Ų | 103.2 | 86% | 0.86 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | -35 | 171.9 | -73.1 | -176.2 | 169.5 | 175.4 | -4.1 | 113.6 | S193 R197 | S193-R195 PolarHBondContact O-N 3.2Å; R195-R197 VanDerWaalsContact C-N 3.28Å; R195-R197 PolarHBondContact O-N 2.84Å |
| 196 | C | 49 | Very low | 59.6 | Low | 96 Ų | 96 | 104.2 Ų | 104.2 | 65% | 0.649 | 55% | 0.545 | S | S | * | . | G | 310 helix | trans | -73.5 | -18.3 | -176.4 | -58.3 | 0 | 0 | 0 | 0 | 113.4 | S193 W198 | S193-C196 PolarHBondContact O-N 3.32Å; C196-W198 PolarHBondContact O-N 3.14Å; C196-W198 VanDerWaalsContact O-N 3.17Å |
| 197 | R | 58.8 | Low | 62.3 | Low | 126 Ų | 126 | 94.6 Ų | 94.6 | 48% | 0.475 | 51% | 0.511 | S | S | . | . | G | 310 helix | trans | -72.8 | -0.2 | -179.2 | -69.8 | -176.4 | 176 | -101.2 | 5.8 | 115.1 | R195 | R195-R197 VanDerWaalsContact C-N 3.28Å; R195-R197 PolarHBondContact O-N 2.84Å |
| 198 | W | 67.7 | Low | 64.8 | Low | 101 Ų | 101 | 82.6 Ų | 82.6 | 38% | 0.383 | 47% | 0.466 | S | S | . | . | G | 310 helix | trans | -118 | 2.3 | -177.2 | -66.5 | 87.5 | 0 | 0 | 0 | 113.5 | C196 Y200 Q201 A202 S249 | C196-W198 PolarHBondContact O-N 3.14Å; C196-W198 VanDerWaalsContact O-N 3.17Å; W198-Y200 PolarHBondContact O-N 3.32Å; W198-Q201 HydrophobicContact CE3-CB 4.45Å; W198-Q201 PolarHBondContact O-N 2.88Å; W198-A202 WeakPolarHBondContact O-CB 3.4Å; W198-A202 PolarHBondContact O-N 2.99Å; W198-S249 VanDerWaalsContact CH2-OG 3.31Å; W198-S249 WeakPolarHBondContact CH2-OG 3.45Å |
| 199 | G | 81.8 | Confident | 67.4 | Low | 42 Ų | 42 | 76.7 Ų | 76.7 | 43% | 0.433 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -50.7 | -62.1 | -169.5 | 0 | 0 | 0 | 0 | 0 | 114 | Q201 L203 | G199-Q201 VanDerWaalsContact C-N 3.33Å; G199-Q201 PolarHBondContact O-N 3.47Å; G199-L203 WeakPolarHBondContact O-CB 3.09Å; G199-L203 PolarHBondContact O-N 3.26Å |
| 200 | Y | 82.8 | Confident | 70.1 | Confident | 69 Ų | 69 | 75.8 Ų | 75.8 | 27% | 0.271 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -66.6 | -31.2 | 179.9 | -65.3 | -70.5 | 0 | 0 | 0 | 113.8 | W198 S204 R368 E372 | W198-Y200 PolarHBondContact O-N 3.32Å; Y200-S204 WeakPolarHBondContact O-CB 3.42Å; Y200-S204 PolarHBondContact O-N 2.91Å; Y200-S204 PolarHBondContact O-OG 3.29Å; Y200-R368 HydrophobicContact CD1-CB 3.87Å; Y200-R368 HydrophobicContact CD1-CG 4.35Å; Y200-R368 HydrophobicContact CD2-CB 3.91Å; Y200-R368 HydrophobicContact CE1-CB 4.19Å; Y200-R368 HydrophobicContact CE1-CG 4.2Å; Y200-R368 HydrophobicContact CE2-CB 4.23Å; Y200-R368 HydrophobicContact CG-CB 3.72Å; Y200-E372 WeakPolarHBondContact CD2-OE1 3.5Å; Y200-E372 VanDerWaalsContact CE2-OE1 3.23Å; Y200-E372 WeakPolarHBondContact CE2-OE1 3.1Å |
| 201 | Q | 86.3 | Confident | 73 | Confident | 21 Ų | 21 | 69.6 Ų | 69.6 | 10% | 0.098 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -66.9 | -52.5 | 177.6 | -69.5 | -179.7 | -2.9 | 0 | 0 | 110.8 | W198 G199 L203 S204 V205 F245 A369 | W198-Q201 HydrophobicContact CE3-CB 4.45Å; W198-Q201 PolarHBondContact O-N 2.88Å; G199-Q201 VanDerWaalsContact C-N 3.33Å; G199-Q201 PolarHBondContact O-N 3.47Å; Q201-L203 VanDerWaalsContact C-N 3.34Å; Q201-L203 PolarHBondContact O-N 3.02Å; Q201-S204 PolarHBondContact O-N 2.99Å; Q201-S204 PolarHBondContact O-OG 3Å; Q201-V205 PolarHBondContact O-N 2.82Å; Q201-F245 HydrophobicContact CB-CB 4.48Å; Q201-F245 HydrophobicContact CB-CD1 4.24Å; Q201-F245 HydrophobicContact CB-CD2 4.34Å; Q201-F245 HydrophobicContact CB-CG 4.12Å; Q201-F245 HydrophobicContact CG-CB 4.43Å; Q201-F245 HydrophobicContact CG-CD1 3.66Å; Q201-F245 HydrophobicContact CG-CE1 4.01Å; Q201-F245 HydrophobicContact CG-CG 4.01Å; Q201-A369 HydrophobicContact CG-CB 3.63Å |
| 202 | A | 86.8 | Confident | 75.6 | Confident | 54 Ų | 54 | 65.9 Ų | 65.9 | 45% | 0.446 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.4 | -42.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | W198 S204 V205 V206 | W198-A202 WeakPolarHBondContact O-CB 3.4Å; W198-A202 PolarHBondContact O-N 2.99Å; A202-S204 PolarHBondContact O-N 3.35Å; A202-V205 PolarHBondContact O-N 3.39Å; A202-V206 WeakPolarHBondContact O-CG2 3.5Å; A202-V206 PolarHBondContact O-N 2.85Å |
| 203 | L | 89.4 | Confident | 78 | Confident | 82 Ų | 82 | 63.9 Ų | 63.9 | 43% | 0.429 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -62.1 | -42 | 177.9 | -176.1 | 143.9 | 0 | 0 | 0 | 112 | G199 Q201 V205 V206 L207 | G199-L203 WeakPolarHBondContact O-CB 3.09Å; G199-L203 PolarHBondContact O-N 3.26Å; Q201-L203 VanDerWaalsContact C-N 3.34Å; Q201-L203 PolarHBondContact O-N 3.02Å; L203-V205 VanDerWaalsContact C-N 3.34Å; L203-V205 PolarHBondContact O-N 2.92Å; L203-V206 PolarHBondContact O-N 3.02Å; L203-L207 HydrophobicContact CD2-CD1 3.57Å; L203-L207 HydrophobicContact CD2-CG 4.17Å; L203-L207 HydrophobicContact CG-CD1 4.42Å; L203-L207 WeakPolarHBondContact O-CB 3.09Å; L203-L207 VanDerWaalsContact O-CG 3.31Å; L203-L207 WeakPolarHBondContact O-CG 3.27Å; L203-L207 PolarHBondContact O-N 3.4Å |
| 204 | S | 89 | Confident | 80.4 | Confident | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -63.8 | -36.7 | 176.2 | 70.7 | 0 | 0 | 0 | 0 | 113.1 | Y200 Q201 A202 L207 L208 F245 S365 | Y200-S204 WeakPolarHBondContact O-CB 3.42Å; Y200-S204 PolarHBondContact O-N 2.91Å; Y200-S204 PolarHBondContact O-OG 3.29Å; Q201-S204 PolarHBondContact O-N 2.99Å; Q201-S204 PolarHBondContact O-OG 3Å; A202-S204 PolarHBondContact O-N 3.35Å; S204-L207 PolarHBondContact O-N 2.94Å; S204-L208 PolarHBondContact O-N 3.47Å; S204-F245 WeakPolarHBondContact OG-CE2 3.36Å; S204-F245 VanDerWaalsContact OG-CZ 3.22Å; S204-F245 WeakPolarHBondContact OG-CZ 3.42Å; S204-S365 WeakPolarHBondContact CB-OG 3.47Å |
| 205 | V | 91.3 | Very high | 82.4 | Confident | 29 Ų | 29 | 57.5 Ų | 57.5 | 18% | 0.176 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -70.5 | -38.8 | 175 | 172.7 | 0 | 0 | 0 | 0 | 111.7 | Q201 A202 L203 L208 L209 V238 F245 | Q201-V205 PolarHBondContact O-N 2.82Å; A202-V205 PolarHBondContact O-N 3.39Å; L203-V205 VanDerWaalsContact C-N 3.34Å; L203-V205 PolarHBondContact O-N 2.92Å; V205-L208 PolarHBondContact O-N 3.37Å; V205-L209 HydrophobicContact CG1-CD1 4.16Å; V205-L209 WeakPolarHBondContact O-CG 3.4Å; V205-L209 PolarHBondContact O-N 2.84Å; V205-V238 HydrophobicContact CG1-CG1 4.18Å; V205-F245 HydrophobicContact CG2-CD2 3.96Å; V205-F245 HydrophobicContact CG2-CE2 3.93Å |
| 206 | V | 91.9 | Very high | 84.7 | Confident | 93 Ų | 93 | 47 Ų | 47 | 56% | 0.564 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -66.3 | -40.5 | 174.4 | 169.3 | 0 | 0 | 0 | 0 | 111.1 | A202 L203 L209 A210 | A202-V206 WeakPolarHBondContact O-CG2 3.5Å; A202-V206 PolarHBondContact O-N 2.85Å; L203-V206 PolarHBondContact O-N 3.02Å; V206-L209 PolarHBondContact O-N 3.08Å; V206-A210 VanDerWaalsContact O-CB 3.3Å; V206-A210 WeakPolarHBondContact O-CB 3.48Å; V206-A210 PolarHBondContact O-N 2.93Å |
| 207 | L | 92.3 | Very high | 86.4 | Confident | 26 Ų | 26 | 47 Ų | 47 | 14% | 0.136 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -65 | -41.6 | 175.1 | -71.9 | 179.7 | 0 | 0 | 0 | 112 | L203 S204 A210 Q211 L358 P361 L362 | L203-L207 HydrophobicContact CD2-CD1 3.57Å; L203-L207 HydrophobicContact CD2-CG 4.17Å; L203-L207 HydrophobicContact CG-CD1 4.42Å; L203-L207 WeakPolarHBondContact O-CB 3.09Å; L203-L207 VanDerWaalsContact O-CG 3.31Å; L203-L207 WeakPolarHBondContact O-CG 3.27Å; L203-L207 PolarHBondContact O-N 3.4Å; S204-L207 PolarHBondContact O-N 2.94Å; L207-A210 PolarHBondContact O-N 3.35Å; L207-Q211 WeakPolarHBondContact O-CB 3.4Å; L207-Q211 PolarHBondContact O-N 3.48Å; L207-L358 HydrophobicContact CD2-CD2 4.03Å; L207-P361 HydrophobicContact CD1-CB 4.04Å; L207-P361 HydrophobicContact CD1-CG 4.31Å; L207-L362 HydrophobicContact CB-CB 4.2Å; L207-L362 HydrophobicContact CB-CD1 3.79Å; L207-L362 HydrophobicContact CB-CG 4.45Å; L207-L362 HydrophobicContact CD1-CB 4.12Å |
| 208 | L | 92.3 | Very high | 87.5 | Confident | 9 Ų | 9 | 41.4 Ų | 41.4 | 5% | 0.047 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -57.6 | -51.3 | 172.8 | -87.9 | 177 | 0 | 0 | 0 | 111.7 | S204 V205 A210 Q211 G212 V237 V238 W241 Y321 L362 | S204-L208 PolarHBondContact O-N 3.47Å; V205-L208 PolarHBondContact O-N 3.37Å; L208-A210 VanDerWaalsContact C-N 3.34Å; L208-A210 PolarHBondContact O-N 3.44Å; L208-Q211 PolarHBondContact O-N 3.45Å; L208-G212 PolarHBondContact O-N 3.32Å; L208-V237 HydrophobicContact CD1-CG1 4.43Å; L208-V237 HydrophobicContact CD2-CG1 4.18Å; L208-V238 HydrophobicContact CB-CG2 3.92Å; L208-V238 HydrophobicContact CD1-CG2 4.27Å; L208-W241 HydrophobicContact CD1-CB 3.95Å; L208-W241 HydrophobicContact CD1-CD2 3.43Å; L208-W241 VanDerWaalsContact CD1-CD2 3.43Å; L208-W241 HydrophobicContact CD1-CE3 3.6Å; L208-W241 HydrophobicContact CD1-CG 3.61Å; L208-W241 HydrophobicContact CD1-CZ2 4.41Å; L208-W241 HydrophobicContact CD1-CZ3 4.14Å; L208-W241 HydrophobicContact CD2-CZ2 4.45Å; L208-W241 HydrophobicContact CG-CD2 4.45Å; L208-W241 HydrophobicContact CG-CE3 4.35Å; L208-W241 HydrophobicContact CG-CZ3 4.41Å; L208-Y321 HydrophobicContact CD2-CD2 3.54Å; L208-Y321 HydrophobicContact CD2-CE2 3.94Å; L208-Y321 HydrophobicContact CD2-CG 4.35Å; L208-L362 HydrophobicContact CB-CD1 4.3Å; L208-L362 HydrophobicContact CD2-CD1 3.88Å; L208-L362 HydrophobicContact CG-CD1 3.78Å |
| 209 | L | 92.4 | Very high | 88.2 | Confident | 89 Ų | 89 | 36.8 Ų | 36.8 | 47% | 0.466 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -62.4 | -40.3 | -179.4 | -79.3 | 166.6 | 0 | 0 | 0 | 112.2 | V205 V206 G213 V238 | V205-L209 HydrophobicContact CG1-CD1 4.16Å; V205-L209 WeakPolarHBondContact O-CG 3.4Å; V205-L209 PolarHBondContact O-N 2.84Å; V206-L209 PolarHBondContact O-N 3.08Å; L209-G213 WeakPolarHBondContact O-CA 3.24Å; L209-G213 PolarHBondContact O-N 3.39Å; L209-V238 HydrophobicContact CD1-CG1 4.34Å; L209-V238 HydrophobicContact CD2-CB 4.5Å; L209-V238 HydrophobicContact CD2-CG1 4.07Å; L209-V238 HydrophobicContact CD2-CG2 3.94Å; L209-V238 HydrophobicContact CG-CG1 4.06Å; L209-V238 HydrophobicContact CG-CG2 3.98Å |
| 210 | A | 90.8 | Very high | 88.3 | Confident | 50 Ų | 50 | 37.1 Ų | 37.1 | 41% | 0.413 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -66.6 | -44.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | V206 L207 L208 L214 | V206-A210 VanDerWaalsContact O-CB 3.3Å; V206-A210 WeakPolarHBondContact O-CB 3.48Å; V206-A210 PolarHBondContact O-N 2.93Å; L207-A210 PolarHBondContact O-N 3.35Å; L208-A210 VanDerWaalsContact C-N 3.34Å; L208-A210 PolarHBondContact O-N 3.44Å; A210-L214 VanDerWaalsContact O-CB 3.32Å; A210-L214 WeakPolarHBondContact O-CB 3.2Å; A210-L214 PolarHBondContact O-N 3.01Å; A210-L214 VanDerWaalsContact O-N 3.12Å |
| 211 | Q | 92.8 | Very high | 87.9 | Confident | 1 Ų | 1 | 35.4 Ų | 35.4 | 1% | 0.005 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -70.9 | -48.8 | -176.6 | -168.9 | -174.4 | 24.7 | 0 | 0 | 112.2 | L207 L208 L215 Y321 F325 T355 L358 | L207-Q211 WeakPolarHBondContact O-CB 3.4Å; L207-Q211 PolarHBondContact O-N 3.48Å; L208-Q211 PolarHBondContact O-N 3.45Å; Q211-L215 WeakPolarHBondContact O-CG 3.47Å; Q211-L215 PolarHBondContact O-N 3.21Å; Q211-Y321 PolarHBondContact NE2-OH 3.14Å; Q211-Y321 PolarHBondContact OE1-OH 2.77Å; Q211-F325 HydrophobicContact CG-CE2 3.96Å; Q211-T355 WeakPolarHBondContact CG-O 3.31Å; Q211-T355 PolarHBondContact NE2-O 3.15Å; Q211-L358 HydrophobicContact CG-CB 4.49Å |
| 212 | G | 89.8 | Confident | 87.1 | Confident | 6 Ų | 6 | 35.5 Ų | 35.5 | 6% | 0.062 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -66.2 | -48 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | L208 L214 L215 D216 D234 | L208-G212 PolarHBondContact O-N 3.32Å; G212-L214 VanDerWaalsContact C-N 3.31Å; G212-L214 PolarHBondContact O-N 3.25Å; G212-L215 PolarHBondContact O-N 3.32Å; G212-L215 VanDerWaalsContact O-N 3.09Å; G212-D216 PolarHBondContact O-N 2.99Å; G212-D234 WeakPolarHBondContact CA-OD2 3.36Å |
| 213 | G | 87.6 | Confident | 86.3 | Confident | 40 Ų | 40 | 34.5 Ų | 34.5 | 41% | 0.412 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -62.8 | -31.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | L209 L217 | L209-G213 WeakPolarHBondContact O-CA 3.24Å; L209-G213 PolarHBondContact O-N 3.39Å; G213-L217 WeakPolarHBondContact O-CB 3.37Å; G213-L217 PolarHBondContact O-N 2.9Å |
| 214 | L | 88.4 | Confident | 85.2 | Confident | 44 Ų | 44 | 36.3 Ų | 36.3 | 23% | 0.23 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -74.9 | -36.4 | 173.5 | -145.1 | 79.3 | 0 | 0 | 0 | 111.8 | A210 G212 L217 Y218 T355 | A210-L214 VanDerWaalsContact O-CB 3.32Å; A210-L214 WeakPolarHBondContact O-CB 3.2Å; A210-L214 PolarHBondContact O-N 3.01Å; A210-L214 VanDerWaalsContact O-N 3.12Å; G212-L214 VanDerWaalsContact C-N 3.31Å; G212-L214 PolarHBondContact O-N 3.25Å; L214-L217 HydrophobicContact CD1-CD2 4.33Å; L214-L217 WeakPolarHBondContact O-CB 3.34Å; L214-L217 PolarHBondContact O-N 3.32Å; L214-Y218 HydrophobicContact CD2-CE2 3.99Å; L214-Y218 HydrophobicContact CG-CD2 4.46Å; L214-Y218 HydrophobicContact CG-CE2 4.08Å; L214-Y218 WeakPolarHBondContact O-CD2 3.49Å; L214-Y218 PolarHBondContact O-N 2.87Å; L214-T355 HydrophobicContact CB-CG2 3.71Å; L214-T355 HydrophobicContact CD2-CG2 3.71Å; L214-T355 HydrophobicContact CG-CG2 4.25Å |
| 215 | L | 88.5 | Confident | 83.9 | Confident | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.005 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -65.2 | -41.8 | 173 | -72.5 | 171.7 | 0 | 0 | 0 | 112 | Q211 G212 L217 Y218 L219 F325 K328 V329 I332 F352 T355 | Q211-L215 WeakPolarHBondContact O-CG 3.47Å; Q211-L215 PolarHBondContact O-N 3.21Å; G212-L215 PolarHBondContact O-N 3.32Å; G212-L215 VanDerWaalsContact O-N 3.09Å; L215-L217 VanDerWaalsContact C-N 3.34Å; L215-Y218 PolarHBondContact O-N 2.99Å; L215-L219 WeakPolarHBondContact O-CG 3.47Å; L215-L219 PolarHBondContact O-N 3.17Å; L215-F325 HydrophobicContact CD1-CD2 3.59Å; L215-F325 HydrophobicContact CD1-CE2 3.52Å; L215-K328 HydrophobicContact CB-CD 4.15Å; L215-K328 HydrophobicContact CD1-CB 4.35Å; L215-K328 HydrophobicContact CD1-CD 4.47Å; L215-V329 HydrophobicContact CD1-CG2 4.43Å; L215-V329 HydrophobicContact CD2-CG2 4.36Å; L215-I332 HydrophobicContact CD2-CD1 3.63Å; L215-F352 HydrophobicContact CD2-CD2 4.2Å; L215-F352 HydrophobicContact CD2-CE2 4.26Å; L215-T355 HydrophobicContact CD2-CG2 4.47Å; L215-T355 HydrophobicContact CG-CG2 4.27Å |
| 216 | D | 88.2 | Confident | 82.6 | Confident | 8 Ų | 8 | 51.1 Ų | 51.1 | 4% | 0.043 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -64.3 | -38.6 | 173.7 | -75 | -29.7 | 0 | 0 | 0 | 111.8 | G212 Y218 L219 I220 W230 I231 K328 | G212-D216 PolarHBondContact O-N 2.99Å; D216-Y218 VanDerWaalsContact C-N 3.34Å; D216-Y218 PolarHBondContact O-N 2.8Å; D216-L219 PolarHBondContact O-N 3.24Å; D216-I220 HydrophobicContact CB-CD1 4.49Å; D216-I220 WeakPolarHBondContact O-CB 3.41Å; D216-I220 WeakPolarHBondContact O-CD1 3.39Å; D216-I220 WeakPolarHBondContact O-CG1 3.39Å; D216-I220 PolarHBondContact O-N 3.47Å; D216-W230 WeakPolarHBondContact OD1-CB 3.46Å; D216-I231 HydrophobicContact CB-CG1 4.03Å; D216-I231 WeakPolarHBondContact OD2-CA 3.29Å; D216-K328 VanDerWaalsContact CG-NZ 3.27Å; D216-K328 IonicContact OD1-NZ 2.67Å; D216-K328 PolarHBondContact OD1-NZ 3.07Å; D216-K328 IonicContact OD2-NZ 3.51Å; D216-K328 PolarHBondContact OD2-NZ 3.05Å |
| 217 | L | 85.2 | Confident | 81.6 | Confident | 95 Ų | 95 | 50.3 Ų | 50.3 | 50% | 0.497 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -60.8 | -42.1 | 172.4 | -178.9 | 64.9 | 0 | 0 | 0 | 111.8 | G213 L214 L215 A221 | G213-L217 WeakPolarHBondContact O-CB 3.37Å; G213-L217 PolarHBondContact O-N 2.9Å; L214-L217 HydrophobicContact CD1-CD2 4.33Å; L214-L217 WeakPolarHBondContact O-CB 3.34Å; L214-L217 PolarHBondContact O-N 3.32Å; L215-L217 VanDerWaalsContact C-N 3.34Å; L217-A221 WeakPolarHBondContact O-CB 3.31Å; L217-A221 PolarHBondContact O-N 3.14Å |
| 218 | Y | 82.1 | Confident | 80.7 | Confident | 10 Ų | 10 | 51.2 Ų | 51.2 | 4% | 0.039 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.5 | -41.3 | 175.5 | -81 | -61.2 | 0 | 0 | 0 | 112.9 | L214 L215 D216 I341 A345 G348 G351 F352 | L214-Y218 HydrophobicContact CD2-CE2 3.99Å; L214-Y218 HydrophobicContact CG-CD2 4.46Å; L214-Y218 HydrophobicContact CG-CE2 4.08Å; L214-Y218 WeakPolarHBondContact O-CD2 3.49Å; L214-Y218 PolarHBondContact O-N 2.87Å; L215-Y218 PolarHBondContact O-N 2.99Å; D216-Y218 VanDerWaalsContact C-N 3.34Å; D216-Y218 PolarHBondContact O-N 2.8Å; Y218-I341 HydrophobicContact CD1-CD1 3.58Å; Y218-I341 HydrophobicContact CD1-CG1 3.89Å; Y218-I341 HydrophobicContact CD1-CG2 4.14Å; Y218-I341 HydrophobicContact CE1-CD1 4.15Å; Y218-I341 HydrophobicContact CE1-CG1 4.3Å; Y218-I341 HydrophobicContact CE1-CG2 3.67Å; Y218-I341 HydrophobicContact CG-CD1 4.27Å; Y218-A345 HydrophobicContact CD1-CB 4.26Å; Y218-A345 HydrophobicContact CE1-CB 3.83Å; Y218-G348 WeakPolarHBondContact CE1-O 3.47Å; Y218-G348 PolarHBondContact OH-O 3.42Å; Y218-G351 VanDerWaalsContact OH-C 3.23Å; Y218-G351 WeakPolarHBondContact OH-CA 3.21Å; Y218-G351 PolarHBondContact OH-N 3.43Å; Y218-F352 HydrophobicContact CE2-CB 4.11Å; Y218-F352 PolarHBondContact OH-N 3.27Å |
| 219 | L | 83.6 | Confident | 80.2 | Confident | 4 Ų | 4 | 54.9 Ų | 54.9 | 2% | 0.021 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -63.9 | -54.4 | 174.5 | -69.2 | 169.7 | 0 | 0 | 0 | 110.5 | L215 D216 A221 V222 T223 W227 W230 K328 L331 I332 | L215-L219 WeakPolarHBondContact O-CG 3.47Å; L215-L219 PolarHBondContact O-N 3.17Å; D216-L219 PolarHBondContact O-N 3.24Å; L219-A221 VanDerWaalsContact C-N 3.28Å; L219-A221 PolarHBondContact O-N 3.37Å; L219-V222 PolarHBondContact O-N 3.33Å; L219-V222 VanDerWaalsContact O-N 3.07Å; L219-T223 PolarHBondContact O-N 3.05Å; L219-T223 PolarHBondContact O-OG1 3.48Å; L219-W227 HydrophobicContact CB-CB 4.48Å; L219-W230 HydrophobicContact CD1-CG 4.48Å; L219-K328 HydrophobicContact CD1-CB 4.25Å; L219-K328 HydrophobicContact CD1-CD 4.25Å; L219-K328 HydrophobicContact CD1-CG 4.05Å; L219-L331 HydrophobicContact CD2-CB 4.23Å; L219-I332 HydrophobicContact CD2-CD1 4.41Å; L219-I332 HydrophobicContact CD2-CG1 3.93Å; L219-I332 HydrophobicContact CG-CD1 4.38Å; L219-I332 HydrophobicContact CG-CG1 4.41Å |
| 220 | I | 82.6 | Confident | 79.9 | Confident | 49 Ų | 49 | 53.6 Ų | 53.6 | 25% | 0.251 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -62 | -34 | -175.8 | -67 | 163.4 | 0 | 0 | 0 | 112.4 | D216 V222 L225 I231 | D216-I220 HydrophobicContact CB-CD1 4.49Å; D216-I220 WeakPolarHBondContact O-CB 3.41Å; D216-I220 WeakPolarHBondContact O-CD1 3.39Å; D216-I220 WeakPolarHBondContact O-CG1 3.39Å; D216-I220 PolarHBondContact O-N 3.47Å; I220-V222 PolarHBondContact O-N 2.93Å; I220-L225 HydrophobicContact CG2-CD2 4.33Å; I220-I231 HydrophobicContact CD1-CD1 3.78Å; I220-I231 HydrophobicContact CD1-CG1 4.35Å |
| 221 | A | 75.1 | Confident | 79.7 | Confident | 32 Ų | 32 | 54.4 Ų | 54.4 | 26% | 0.264 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -69.1 | -17.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | L217 L219 R344 | L217-A221 WeakPolarHBondContact O-CB 3.31Å; L217-A221 PolarHBondContact O-N 3.14Å; L219-A221 VanDerWaalsContact C-N 3.28Å; L219-A221 PolarHBondContact O-N 3.37Å; A221-R344 PolarHBondContact O-NH1 3.05Å |
| 222 | V | 69.3 | Low | 79.5 | Confident | 23 Ų | 23 | 56.9 Ų | 56.9 | 14% | 0.139 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -131.3 | -26.9 | -171.2 | -161.6 | 0 | 0 | 0 | 0 | 114.8 | L219 I220 I337 L340 I341 | L219-V222 PolarHBondContact O-N 3.33Å; L219-V222 VanDerWaalsContact O-N 3.07Å; I220-V222 PolarHBondContact O-N 2.93Å; V222-I337 HydrophobicContact CB-CD1 4.16Å; V222-I337 HydrophobicContact CB-CG1 4.5Å; V222-I337 HydrophobicContact CB-CG2 4.07Å; V222-I337 HydrophobicContact CG1-CB 4.26Å; V222-I337 HydrophobicContact CG1-CD1 3.75Å; V222-I337 HydrophobicContact CG1-CG1 3.68Å; V222-I337 HydrophobicContact CG1-CG2 3.89Å; V222-I337 HydrophobicContact CG2-CG2 4.16Å; V222-L340 HydrophobicContact CG1-CB 3.97Å; V222-L340 HydrophobicContact CG1-CD2 3.81Å; V222-I341 HydrophobicContact CG2-CG1 3.96Å |
| 223 | T | 69.2 | Low | 79.5 | Confident | 34 Ų | 34 | 59 Ų | 59 | 21% | 0.209 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -112.7 | 12.3 | -177.1 | 66.6 | 0 | 0 | 0 | 0 | 114.9 | L219 W227 I337 | L219-T223 PolarHBondContact O-N 3.05Å; L219-T223 PolarHBondContact O-OG1 3.48Å; T223-W227 PolarHBondContact O-NE1 3.32Å; T223-W227 VanDerWaalsContact O-NE1 3.17Å; T223-I337 HydrophobicContact CG2-CD1 3.39Å |
| 224 | D | 66.1 | Low | 79.6 | Confident | 120 Ų | 120 | 58.3 Ų | 58.3 | 64% | 0.642 | 31% | 0.31 | S | S | * | . | trans | 67.7 | 167.3 | -179.4 | -64.7 | -47.3 | 0 | 0 | 0 | 117 | Y226 W227 | D224-Y226 PolarHBondContact O-N 3.3Å; D224-W227 PolarHBondContact O-N 3.05Å | ||
| 225 | L | 62 | Low | 79.7 | Confident | 133 Ų | 133 | 60.9 Ų | 60.9 | 70% | 0.696 | 32% | 0.323 | S | S | * | . | G | 310 helix | trans | -59.7 | -13.5 | -170.9 | -71.4 | 167.1 | 0 | 0 | 0 | 115.8 | I220 W227 C228 | I220-L225 HydrophobicContact CG2-CD2 4.33Å; L225-W227 PolarHBondContact O-N 2.95Å; L225-C228 WeakPolarHBondContact O-CB 3.33Å; L225-C228 PolarHBondContact O-N 3.43Å; L225-C228 PolarHBondContact O-SG 3.21Å |
| 226 | Y | 64.1 | Low | 79.8 | Confident | 207 Ų | 207 | 65.8 Ų | 65.8 | 81% | 0.812 | 35% | 0.353 | S | S | * | . | G | 310 helix | trans | -60.7 | -29 | 175.4 | -170.7 | -102 | 0 | 0 | 0 | 111.9 | D224 C228 | D224-Y226 PolarHBondContact O-N 3.3Å; Y226-C228 VanDerWaalsContact C-N 3.25Å; Y226-C228 PolarHBondContact O-N 3.18Å |
| 227 | W | 71 | Confident | 80 | Confident | 75 Ų | 75 | 66 Ų | 66 | 28% | 0.284 | 35% | 0.354 | S | S | . | . | G | 310 helix | trans | -80 | -1.9 | -177.7 | -61.5 | 77.6 | 0 | 0 | 0 | 113.7 | L219 T223 D224 L225 S229 W230 L331 | L219-W227 HydrophobicContact CB-CB 4.48Å; T223-W227 PolarHBondContact O-NE1 3.32Å; T223-W227 VanDerWaalsContact O-NE1 3.17Å; D224-W227 PolarHBondContact O-N 3.05Å; L225-W227 PolarHBondContact O-N 2.95Å; W227-S229 PolarHBondContact O-N 3.09Å; W227-W230 AromaticContact CE3-CD1 3.59Å; W227-W230 AromaticContact CE3-NE1 3.2Å; W227-W230 AromaticContact CZ3-NE1 3.51Å; W227-W230 WeakPolarHBondContact O-CB 3.32Å; W227-W230 VanDerWaalsContact O-CD1 3.32Å; W227-W230 PolarHBondContact O-N 3.08Å; W227-L331 HydrophobicContact CE3-CD1 4.15Å; W227-L331 HydrophobicContact CH2-CD1 4.21Å; W227-L331 HydrophobicContact CH2-CD2 4.21Å; W227-L331 HydrophobicContact CZ3-CD1 3.47Å; W227-L331 VanDerWaalsContact CZ3-CD1 3.47Å; W227-L331 HydrophobicContact CZ3-CD2 4.29Å |
| 228 | C | 74.8 | Confident | 80.3 | Confident | 45 Ų | 45 | 62.2 Ų | 62.2 | 30% | 0.304 | 34% | 0.335 | S | S | . | . | G | 310 helix | trans | -57.3 | -15.5 | 171.7 | -70.2 | 0 | 0 | 0 | 0 | 114 | L225 Y226 W230 I231 | L225-C228 WeakPolarHBondContact O-CB 3.33Å; L225-C228 PolarHBondContact O-N 3.43Å; L225-C228 PolarHBondContact O-SG 3.21Å; Y226-C228 VanDerWaalsContact C-N 3.25Å; Y226-C228 PolarHBondContact O-N 3.18Å; C228-W230 PolarHBondContact O-N 3.41Å; C228-I231 HydrophobicContact CB-CD1 4.25Å; C228-I231 WeakPolarHBondContact O-CB 3.25Å; C228-I231 PolarHBondContact O-N 2.8Å; C228-I231 VanDerWaalsContact O-N 3.13Å |
| 229 | S | 81.6 | Confident | 80.7 | Confident | 86 Ų | 86 | 65.6 Ų | 65.6 | 60% | 0.601 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -58.4 | -28.1 | 170.2 | -165 | 0 | 0 | 0 | 0 | 113 | W227 I231 A232 T233 | W227-S229 PolarHBondContact O-N 3.09Å; S229-I231 VanDerWaalsContact C-N 3.28Å; S229-I231 PolarHBondContact O-N 3.39Å; S229-A232 VanDerWaalsContact O-CB 3.29Å; S229-A232 WeakPolarHBondContact O-CB 3.39Å; S229-A232 PolarHBondContact O-N 2.96Å; S229-T233 PolarHBondContact O-N 3.34Å |
| 230 | W | 85.3 | Confident | 81 | Confident | 63 Ų | 63 | 67.1 Ų | 67.1 | 24% | 0.239 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -72.1 | -16.5 | 176.8 | -69.1 | 101.1 | 0 | 0 | 0 | 114.2 | D216 L219 W227 C228 A232 T233 D234 P327 K328 | D216-W230 WeakPolarHBondContact OD1-CB 3.46Å; L219-W230 HydrophobicContact CD1-CG 4.48Å; W227-W230 AromaticContact CE3-CD1 3.59Å; W227-W230 AromaticContact CE3-NE1 3.2Å; W227-W230 AromaticContact CZ3-NE1 3.51Å; W227-W230 WeakPolarHBondContact O-CB 3.32Å; W227-W230 VanDerWaalsContact O-CD1 3.32Å; W227-W230 PolarHBondContact O-N 3.08Å; C228-W230 PolarHBondContact O-N 3.41Å; W230-A232 VanDerWaalsContact C-N 3.3Å; W230-T233 HydrophobicContact CE3-CG2 4.24Å; W230-T233 PolarHBondContact O-OG1 3.34Å; W230-D234 PolarHBondContact O-N 3.15Å; W230-P327 HydrophobicContact CH2-CB 3.78Å; W230-P327 HydrophobicContact CH2-CG 3.48Å; W230-P327 VanDerWaalsContact CH2-CG 3.48Å; W230-P327 HydrophobicContact CZ2-CB 4.45Å; W230-P327 HydrophobicContact CZ3-CB 4.36Å; W230-P327 HydrophobicContact CZ3-CG 3.62Å; W230-K328 HydrophobicContact CE3-CG 4.16Å; W230-K328 PolarHBondContact O-NZ 3.38Å |
| 231 | I | 86.9 | Confident | 81.3 | Confident | 66 Ų | 66 | 65 Ų | 65 | 34% | 0.338 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -67.5 | -36.8 | 166.5 | -58.3 | 166.4 | 0 | 0 | 0 | 109.7 | D216 I220 C228 S229 T233 D234 L235 | D216-I231 HydrophobicContact CB-CG1 4.03Å; D216-I231 WeakPolarHBondContact OD2-CA 3.29Å; I220-I231 HydrophobicContact CD1-CD1 3.78Å; I220-I231 HydrophobicContact CD1-CG1 4.35Å; C228-I231 HydrophobicContact CB-CD1 4.25Å; C228-I231 WeakPolarHBondContact O-CB 3.25Å; C228-I231 PolarHBondContact O-N 2.8Å; C228-I231 VanDerWaalsContact O-N 3.13Å; S229-I231 VanDerWaalsContact C-N 3.28Å; S229-I231 PolarHBondContact O-N 3.39Å; I231-T233 PolarHBondContact O-N 3.4Å; I231-D234 PolarHBondContact O-N 3.31Å; I231-L235 HydrophobicContact CG2-CD1 3.99Å; I231-L235 HydrophobicContact CG2-CG 4.22Å; I231-L235 WeakPolarHBondContact O-CB 3.33Å; I231-L235 VanDerWaalsContact O-CG 3.31Å; I231-L235 WeakPolarHBondContact O-CG 3.46Å; I231-L235 PolarHBondContact O-N 3.49Å |
| 232 | A | 88.4 | Confident | 81.9 | Confident | 54 Ų | 54 | 65.5 Ų | 65.5 | 45% | 0.446 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -67.9 | -34.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | S229 W230 V236 | S229-A232 VanDerWaalsContact O-CB 3.29Å; S229-A232 WeakPolarHBondContact O-CB 3.39Å; S229-A232 PolarHBondContact O-N 2.96Å; W230-A232 VanDerWaalsContact C-N 3.3Å; A232-V236 VanDerWaalsContact O-CG2 3.31Å; A232-V236 WeakPolarHBondContact O-CG2 3.47Å; A232-V236 PolarHBondContact O-N 2.93Å; A232-V236 VanDerWaalsContact O-N 3.09Å |
| 233 | T | 90 | Very high | 82.6 | Confident | 49 Ų | 49 | 69.5 Ų | 69.5 | 30% | 0.301 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -64.1 | -42.7 | 173.5 | 60 | 0 | 0 | 0 | 0 | 111.3 | S229 W230 I231 V236 V237 | S229-T233 PolarHBondContact O-N 3.34Å; W230-T233 HydrophobicContact CE3-CG2 4.24Å; W230-T233 PolarHBondContact O-OG1 3.34Å; I231-T233 PolarHBondContact O-N 3.4Å; T233-V236 WeakPolarHBondContact O-CB 3.28Å; T233-V236 PolarHBondContact O-N 2.94Å; T233-V236 VanDerWaalsContact O-N 3.15Å; T233-V237 WeakPolarHBondContact O-CG2 2.96Å; T233-V237 PolarHBondContact O-N 2.89Å |
| 234 | D | 90.1 | Very high | 83.3 | Confident | 26 Ų | 26 | 68.6 Ų | 68.6 | 14% | 0.139 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -76.7 | -33.8 | -174.6 | -71.9 | 25.5 | 0 | 0 | 0 | 111.8 | G212 W230 I231 V236 V237 V238 K328 | G212-D234 WeakPolarHBondContact CA-OD2 3.36Å; W230-D234 PolarHBondContact O-N 3.15Å; I231-D234 PolarHBondContact O-N 3.31Å; D234-V236 VanDerWaalsContact C-N 3.3Å; D234-V236 PolarHBondContact O-N 3.06Å; D234-V237 PolarHBondContact O-N 3.16Å; D234-V238 WeakPolarHBondContact O-CB 3.38Å; D234-V238 VanDerWaalsContact O-CG2 3.27Å; D234-V238 WeakPolarHBondContact O-CG2 3.19Å; D234-V238 PolarHBondContact O-N 3.45Å; D234-K328 VanDerWaalsContact OD1-CE 3.27Å; D234-K328 WeakPolarHBondContact OD1-CE 3.49Å; D234-K328 IonicContact OD1-NZ 3.66Å; D234-K328 PolarHBondContact OD1-NZ 2.86Å; D234-K328 IonicContact OD2-NZ 3.66Å; D234-K328 PolarHBondContact OD2-NZ 3.14Å |
| 235 | L | 90.2 | Very high | 84.1 | Confident | 98 Ų | 98 | 63.2 Ų | 63.2 | 51% | 0.513 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -59 | -40.4 | 166.1 | -72.5 | 174.5 | 0 | 0 | 0 | 111.6 | I231 V239 | I231-L235 HydrophobicContact CG2-CD1 3.99Å; I231-L235 HydrophobicContact CG2-CG 4.22Å; I231-L235 WeakPolarHBondContact O-CB 3.33Å; I231-L235 VanDerWaalsContact O-CG 3.31Å; I231-L235 WeakPolarHBondContact O-CG 3.46Å; I231-L235 PolarHBondContact O-N 3.49Å; L235-V239 VanDerWaalsContact O-CB 3.22Å; L235-V239 WeakPolarHBondContact O-CB 3.38Å; L235-V239 WeakPolarHBondContact O-CG2 3.49Å; L235-V239 PolarHBondContact O-N 3.01Å |
| 236 | V | 91 | Very high | 84.9 | Confident | 105 Ų | 105 | 58.4 Ų | 58.4 | 64% | 0.636 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -66.2 | -41.7 | 175.1 | 167.5 | 0 | 0 | 0 | 0 | 111.8 | A232 T233 D234 G240 | A232-V236 VanDerWaalsContact O-CG2 3.31Å; A232-V236 WeakPolarHBondContact O-CG2 3.47Å; A232-V236 PolarHBondContact O-N 2.93Å; A232-V236 VanDerWaalsContact O-N 3.09Å; T233-V236 WeakPolarHBondContact O-CB 3.28Å; T233-V236 PolarHBondContact O-N 2.94Å; T233-V236 VanDerWaalsContact O-N 3.15Å; D234-V236 VanDerWaalsContact C-N 3.3Å; D234-V236 PolarHBondContact O-N 3.06Å; V236-G240 PolarHBondContact O-N 2.81Å |
| 237 | V | 91.4 | Very high | 85.5 | Confident | 11 Ų | 11 | 54.4 Ų | 54.4 | 7% | 0.067 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -62 | -50.5 | 174.9 | 176.1 | 0 | 0 | 0 | 0 | 110.9 | L208 T233 D234 V239 G240 W241 I320 A324 | L208-V237 HydrophobicContact CD1-CG1 4.43Å; L208-V237 HydrophobicContact CD2-CG1 4.18Å; T233-V237 WeakPolarHBondContact O-CG2 2.96Å; T233-V237 PolarHBondContact O-N 2.89Å; D234-V237 PolarHBondContact O-N 3.16Å; V237-V239 PolarHBondContact O-N 3.48Å; V237-G240 PolarHBondContact O-N 3.47Å; V237-W241 VanDerWaalsContact O-CD1 3.24Å; V237-W241 PolarHBondContact O-N 2.98Å; V237-I320 HydrophobicContact CG2-CG2 4.09Å; V237-A324 HydrophobicContact CG2-CB 4.08Å |
| 238 | V | 92 | Very high | 85.5 | Confident | 17 Ų | 17 | 51.7 Ų | 51.7 | 10% | 0.103 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -61.3 | -44.8 | 179.7 | 167.7 | 0 | 0 | 0 | 0 | 111.4 | V205 L208 L209 D234 G240 W241 A242 | V205-V238 HydrophobicContact CG1-CG1 4.18Å; L208-V238 HydrophobicContact CB-CG2 3.92Å; L208-V238 HydrophobicContact CD1-CG2 4.27Å; L209-V238 HydrophobicContact CD1-CG1 4.34Å; L209-V238 HydrophobicContact CD2-CB 4.5Å; L209-V238 HydrophobicContact CD2-CG1 4.07Å; L209-V238 HydrophobicContact CD2-CG2 3.94Å; L209-V238 HydrophobicContact CG-CG1 4.06Å; L209-V238 HydrophobicContact CG-CG2 3.98Å; D234-V238 WeakPolarHBondContact O-CB 3.38Å; D234-V238 VanDerWaalsContact O-CG2 3.27Å; D234-V238 WeakPolarHBondContact O-CG2 3.19Å; D234-V238 PolarHBondContact O-N 3.45Å; V238-G240 VanDerWaalsContact C-N 3.34Å; V238-W241 PolarHBondContact O-N 3.06Å; V238-A242 VanDerWaalsContact O-CB 3.28Å; V238-A242 WeakPolarHBondContact O-CB 3.35Å; V238-A242 PolarHBondContact O-N 3.09Å |
| 239 | V | 90.7 | Very high | 85.1 | Confident | 80 Ų | 80 | 50.7 Ų | 50.7 | 49% | 0.485 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64.7 | -38.9 | 175.7 | 168.1 | 0 | 0 | 0 | 0 | 110.9 | L235 V237 A242 I243 | L235-V239 VanDerWaalsContact O-CB 3.22Å; L235-V239 WeakPolarHBondContact O-CB 3.38Å; L235-V239 WeakPolarHBondContact O-CG2 3.49Å; L235-V239 PolarHBondContact O-N 3.01Å; V237-V239 PolarHBondContact O-N 3.48Å; V239-A242 PolarHBondContact O-N 3.46Å; V239-I243 HydrophobicContact CG1-CD1 3.61Å; V239-I243 HydrophobicContact CG1-CG1 4.24Å; V239-I243 WeakPolarHBondContact O-CB 3.09Å; V239-I243 VanDerWaalsContact O-CG1 3.23Å; V239-I243 WeakPolarHBondContact O-CG1 3.36Å; V239-I243 PolarHBondContact O-N 3.28Å |
| 240 | G | 88.6 | Confident | 84.1 | Confident | 37 Ų | 37 | 55.4 Ų | 55.4 | 38% | 0.381 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -58.6 | -49.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | V236 V237 V238 I243 F244 | V236-G240 PolarHBondContact O-N 2.81Å; V237-G240 PolarHBondContact O-N 3.47Å; V238-G240 VanDerWaalsContact C-N 3.34Å; G240-I243 PolarHBondContact O-N 3.47Å; G240-F244 WeakPolarHBondContact O-CB 3.35Å; G240-F244 PolarHBondContact O-N 2.95Å |
| 241 | W | 89.4 | Confident | 82.7 | Confident | 3 Ų | 3 | 54.5 Ų | 54.5 | 1% | 0.011 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -65.4 | -41.2 | 176.2 | -77.2 | 52.8 | 0 | 0 | 0 | 112 | L208 V237 V238 F244 F245 A317 W318 Y321 L362 L366 | L208-W241 HydrophobicContact CD1-CB 3.95Å; L208-W241 HydrophobicContact CD1-CD2 3.43Å; L208-W241 VanDerWaalsContact CD1-CD2 3.43Å; L208-W241 HydrophobicContact CD1-CE3 3.6Å; L208-W241 HydrophobicContact CD1-CG 3.61Å; L208-W241 HydrophobicContact CD1-CZ2 4.41Å; L208-W241 HydrophobicContact CD1-CZ3 4.14Å; L208-W241 HydrophobicContact CD2-CZ2 4.45Å; L208-W241 HydrophobicContact CG-CD2 4.45Å; L208-W241 HydrophobicContact CG-CE3 4.35Å; L208-W241 HydrophobicContact CG-CZ3 4.41Å; V237-W241 VanDerWaalsContact O-CD1 3.24Å; V237-W241 PolarHBondContact O-N 2.98Å; V238-W241 PolarHBondContact O-N 3.06Å; W241-F244 WeakPolarHBondContact O-CB 3.39Å; W241-F244 PolarHBondContact O-N 2.88Å; W241-F245 HydrophobicContact CB-CE2 4.26Å; W241-F245 HydrophobicContact CE3-CE2 4.02Å; W241-F245 HydrophobicContact CE3-CZ 4.03Å; W241-F245 WeakPolarHBondContact O-CD2 3.34Å; W241-F245 WeakPolarHBondContact O-CG 3.2Å; W241-F245 PolarHBondContact O-N 3.38Å; W241-A317 HydrophobicContact CG-CB 4.47Å; W241-A317 PolarHBondContact NE1-O 3.33Å; W241-W318 AromaticContact CH2-CE3 3.88Å; W241-W318 HydrophobicContact CH2-CE3 3.88Å; W241-W318 HydrophobicContact CH2-CZ3 4.01Å; W241-W318 HydrophobicContact CZ2-CE3 4.07Å; W241-Y321 HydrophobicContact CZ2-CG 4.35Å; W241-L362 HydrophobicContact CH2-CD2 4.09Å; W241-L362 HydrophobicContact CH2-CG 4.42Å; W241-L366 HydrophobicContact CE3-CD1 4.14Å; W241-L366 HydrophobicContact CH2-CB 4.23Å; W241-L366 HydrophobicContact CH2-CD1 4.35Å; W241-L366 HydrophobicContact CH2-CD2 3.71Å; W241-L366 HydrophobicContact CH2-CG 4.3Å; W241-L366 HydrophobicContact CZ2-CD2 4.22Å; W241-L366 HydrophobicContact CZ3-CB 3.99Å; W241-L366 HydrophobicContact CZ3-CD1 3.85Å; W241-L366 HydrophobicContact CZ3-CD2 4.06Å; W241-L366 HydrophobicContact CZ3-CG 4.17Å |
| 242 | A | 87 | Confident | 81.3 | Confident | 43 Ų | 43 | 55.3 Ų | 55.3 | 36% | 0.355 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.7 | -41.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | V238 V239 A246 | V238-A242 VanDerWaalsContact O-CB 3.28Å; V238-A242 WeakPolarHBondContact O-CB 3.35Å; V238-A242 PolarHBondContact O-N 3.09Å; V239-A242 PolarHBondContact O-N 3.46Å; A242-A246 WeakPolarHBondContact O-CB 3.15Å; A242-A246 PolarHBondContact O-N 3.32Å |
| 243 | I | 85.8 | Confident | 79.5 | Confident | 108 Ų | 108 | 61.5 Ų | 61.5 | 55% | 0.554 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -65.4 | -41.2 | 173.7 | -71.3 | 169.7 | 0 | 0 | 0 | 110.7 | V239 G240 A246 K247 | V239-I243 HydrophobicContact CG1-CD1 3.61Å; V239-I243 HydrophobicContact CG1-CG1 4.24Å; V239-I243 WeakPolarHBondContact O-CB 3.09Å; V239-I243 VanDerWaalsContact O-CG1 3.23Å; V239-I243 WeakPolarHBondContact O-CG1 3.36Å; V239-I243 PolarHBondContact O-N 3.28Å; G240-I243 PolarHBondContact O-N 3.47Å; I243-A246 PolarHBondContact O-N 3.33Å; I243-K247 VanDerWaalsContact O-CB 3.28Å; I243-K247 WeakPolarHBondContact O-CB 3.29Å; I243-K247 PolarHBondContact O-N 3.28Å |
| 244 | F | 83.2 | Confident | 77.5 | Confident | 15 Ų | 15 | 61.3 Ų | 61.3 | 7% | 0.066 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -57.8 | -54.2 | 174.6 | 165.9 | -112.2 | 0 | 0 | 0 | 111.7 | G240 W241 A246 K247 N248 E310 F313 A314 L366 I370 | G240-F244 WeakPolarHBondContact O-CB 3.35Å; G240-F244 PolarHBondContact O-N 2.95Å; W241-F244 WeakPolarHBondContact O-CB 3.39Å; W241-F244 PolarHBondContact O-N 2.88Å; F244-A246 PolarHBondContact O-N 3.09Å; F244-K247 PolarHBondContact O-N 3.26Å; F244-N248 VanDerWaalsContact O-CB 3.28Å; F244-N248 WeakPolarHBondContact O-CB 3.3Å; F244-N248 PolarHBondContact O-N 2.96Å; F244-E310 WeakPolarHBondContact CE2-O 3.48Å; F244-F313 HydrophobicContact CD2-CB 3.59Å; F244-F313 HydrophobicContact CE2-CB 3.91Å; F244-A314 HydrophobicContact CZ-CB 4.1Å; F244-L366 HydrophobicContact CE1-CD1 4.44Å; F244-I370 HydrophobicContact CE1-CG1 4.35Å; F244-I370 HydrophobicContact CZ-CG1 4.27Å |
| 245 | F | 82.4 | Confident | 75.4 | Confident | 6 Ų | 6 | 62.3 Ų | 62.3 | 3% | 0.026 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -62.6 | -40.4 | 177.4 | -63 | -50 | 0 | 0 | 0 | 112.2 | Q201 S204 V205 W241 N248 S249 L366 A369 | Q201-F245 HydrophobicContact CB-CB 4.48Å; Q201-F245 HydrophobicContact CB-CD1 4.24Å; Q201-F245 HydrophobicContact CB-CD2 4.34Å; Q201-F245 HydrophobicContact CB-CG 4.12Å; Q201-F245 HydrophobicContact CG-CB 4.43Å; Q201-F245 HydrophobicContact CG-CD1 3.66Å; Q201-F245 HydrophobicContact CG-CE1 4.01Å; Q201-F245 HydrophobicContact CG-CG 4.01Å; S204-F245 WeakPolarHBondContact OG-CE2 3.36Å; S204-F245 VanDerWaalsContact OG-CZ 3.22Å; S204-F245 WeakPolarHBondContact OG-CZ 3.42Å; V205-F245 HydrophobicContact CG2-CD2 3.96Å; V205-F245 HydrophobicContact CG2-CE2 3.93Å; W241-F245 HydrophobicContact CB-CE2 4.26Å; W241-F245 HydrophobicContact CE3-CE2 4.02Å; W241-F245 HydrophobicContact CE3-CZ 4.03Å; W241-F245 WeakPolarHBondContact O-CD2 3.34Å; W241-F245 WeakPolarHBondContact O-CG 3.2Å; W241-F245 PolarHBondContact O-N 3.38Å; F245-N248 PolarHBondContact O-N 3.04Å; F245-S249 WeakPolarHBondContact O-CB 3.41Å; F245-S249 PolarHBondContact O-N 3.34Å; F245-L366 HydrophobicContact CE1-CD1 4.05Å; F245-L366 HydrophobicContact CZ-CD1 3.8Å; F245-A369 HydrophobicContact CE1-CB 3.9Å; F245-A369 HydrophobicContact CZ-CB 4.41Å |
| 246 | A | 79.1 | Confident | 73.2 | Confident | 33 Ų | 33 | 61.7 Ų | 61.7 | 27% | 0.273 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -61.8 | -44.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | A242 I243 F244 S249 R250 | A242-A246 WeakPolarHBondContact O-CB 3.15Å; A242-A246 PolarHBondContact O-N 3.32Å; I243-A246 PolarHBondContact O-N 3.33Å; F244-A246 PolarHBondContact O-N 3.09Å; A246-S249 PolarHBondContact O-N 2.65Å; A246-S249 PolarHBondContact O-OG 3.27Å; A246-R250 VanDerWaalsContact O-CG 3.29Å; A246-R250 WeakPolarHBondContact O-CG 3.41Å; A246-R250 PolarHBondContact O-N 2.97Å |
| 247 | K | 77.3 | Confident | 70.9 | Confident | 123 Ų | 123 | 59.7 Ų | 59.7 | 54% | 0.535 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -62.2 | -49.1 | 176.2 | -176 | 179.3 | 177.1 | -175.8 | 0 | 111.1 | I243 F244 S249 R250 G251 F313 | I243-K247 VanDerWaalsContact O-CB 3.28Å; I243-K247 WeakPolarHBondContact O-CB 3.29Å; I243-K247 PolarHBondContact O-N 3.28Å; F244-K247 PolarHBondContact O-N 3.26Å; K247-S249 VanDerWaalsContact C-N 3.35Å; K247-S249 PolarHBondContact O-N 2.96Å; K247-R250 WeakPolarHBondContact O-CB 3.39Å; K247-R250 PolarHBondContact O-N 3.47Å; K247-R250 VanDerWaalsContact O-N 3.09Å; K247-G251 PolarHBondContact O-N 3.13Å; K247-F313 VanDerWaalsContact NZ-CE2 3.32Å |
| 248 | N | 70.4 | Confident | 68.4 | Low | 17 Ų | 17 | 62.9 Ų | 62.9 | 9% | 0.091 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -59.6 | -43.1 | 178.6 | -164.4 | -25.2 | 0 | 0 | 0 | 111.5 | F244 F245 R250 G251 A373 | F244-N248 VanDerWaalsContact O-CB 3.28Å; F244-N248 WeakPolarHBondContact O-CB 3.3Å; F244-N248 PolarHBondContact O-N 2.96Å; F245-N248 PolarHBondContact O-N 3.04Å; N248-R250 VanDerWaalsContact C-N 3.25Å; N248-R250 PolarHBondContact O-N 3.02Å; N248-G251 PolarHBondContact O-N 3.23Å; N248-A373 WeakPolarHBondContact OD1-CB 3.24Å |
| 249 | S | 66.9 | Low | 66 | Low | 25 Ų | 25 | 65.7 Ų | 65.7 | 18% | 0.175 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -60.8 | -29.3 | 175.3 | 82.9 | 0 | 0 | 0 | 0 | 114.5 | W198 F245 A246 K247 | W198-S249 VanDerWaalsContact CH2-OG 3.31Å; W198-S249 WeakPolarHBondContact CH2-OG 3.45Å; F245-S249 WeakPolarHBondContact O-CB 3.41Å; F245-S249 PolarHBondContact O-N 3.34Å; A246-S249 PolarHBondContact O-N 2.65Å; A246-S249 PolarHBondContact O-OG 3.27Å; K247-S249 VanDerWaalsContact C-N 3.35Å; K247-S249 PolarHBondContact O-N 2.96Å |
| 250 | R | 60.4 | Low | 63.6 | Low | 185 Ų | 185 | 64.7 Ų | 64.7 | 70% | 0.698 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -78.4 | -37.4 | -176.3 | -73.9 | 169.6 | -175.6 | -164.1 | 2.7 | 111.9 | A246 K247 N248 R252 R253 G254 | A246-R250 VanDerWaalsContact O-CG 3.29Å; A246-R250 WeakPolarHBondContact O-CG 3.41Å; A246-R250 PolarHBondContact O-N 2.97Å; K247-R250 WeakPolarHBondContact O-CB 3.39Å; K247-R250 PolarHBondContact O-N 3.47Å; K247-R250 VanDerWaalsContact O-N 3.09Å; N248-R250 VanDerWaalsContact C-N 3.25Å; N248-R250 PolarHBondContact O-N 3.02Å; R250-R252 PolarHBondContact O-N 3.38Å; R250-R253 PolarHBondContact O-N 2.98Å; R250-G254 PolarHBondContact O-N 2.69Å; R250-G254 VanDerWaalsContact O-N 3.15Å |
| 251 | G | 55.9 | Low | 61.2 | Low | 43 Ų | 43 | 70.5 Ų | 70.5 | 44% | 0.443 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -53.7 | -42.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | K247 N248 R253 G254 G255 | K247-G251 PolarHBondContact O-N 3.13Å; N248-G251 PolarHBondContact O-N 3.23Å; G251-R253 VanDerWaalsContact C-N 3.25Å; G251-R253 PolarHBondContact O-N 3.28Å; G251-G254 PolarHBondContact O-N 2.99Å; G251-G255 PolarHBondContact O-N 3.34Å |
| 252 | R | 56.5 | Low | 58.9 | Low | 83 Ų | 83 | 76.7 Ų | 76.7 | 31% | 0.313 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -62.7 | -23.5 | 176.7 | -149.1 | 177.3 | -153.9 | 160.7 | 12.4 | 114.7 | R250 V256 E372 A375 | R250-R252 PolarHBondContact O-N 3.38Å; R252-V256 WeakPolarHBondContact O-CG2 3.09Å; R252-E372 VanDerWaalsContact CZ-O 3.23Å; R252-E372 PolarHBondContact NH1-O 3.3Å; R252-E372 PolarHBondContact NH2-O 3.48Å; R252-A375 PolarHBondContact NH2-O 2.93Å |
| 253 | R | 51.9 | Low | 56.6 | Low | 185 Ų | 185 | 82.5 Ų | 82.5 | 70% | 0.698 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -85.1 | -39.5 | 174.3 | -65.5 | -171.3 | -177 | -166 | 1.8 | 112.1 | R250 G251 V256 A257 | R250-R253 PolarHBondContact O-N 2.98Å; G251-R253 VanDerWaalsContact C-N 3.25Å; G251-R253 PolarHBondContact O-N 3.28Å; R253-V256 PolarHBondContact O-N 2.82Å; R253-A257 PolarHBondContact O-N 3.49Å |
| 254 | G | 48 | Very low | 54.5 | Low | 44 Ų | 44 | 85.8 Ų | 85.8 | 45% | 0.454 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.7 | -46.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | R250 G251 V256 A257 S258 | R250-G254 PolarHBondContact O-N 2.69Å; R250-G254 VanDerWaalsContact O-N 3.15Å; G251-G254 PolarHBondContact O-N 2.99Å; G254-V256 PolarHBondContact O-N 2.86Å; G254-A257 PolarHBondContact O-N 3.41Å; G254-S258 WeakPolarHBondContact O-CB 3.48Å; G254-S258 PolarHBondContact O-N 3.36Å |
| 255 | G | 45 | Very low | 52.4 | Low | 48 Ų | 48 | 92.5 Ų | 92.5 | 50% | 0.495 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.1 | -40.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114 | G251 S259 | G251-G255 PolarHBondContact O-N 3.34Å; G255-S259 WeakPolarHBondContact O-CB 3.44Å; G255-S259 PolarHBondContact O-N 2.93Å |
| 256 | V | 45.3 | Very low | 50.2 | Low | 85 Ų | 85 | 100.6 Ų | 100.6 | 52% | 0.515 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -69.5 | -41.2 | 178.9 | 178.9 | 0 | 0 | 0 | 0 | 111.4 | R252 R253 G254 A260 P377 | R252-V256 WeakPolarHBondContact O-CG2 3.09Å; R253-V256 PolarHBondContact O-N 2.82Å; G254-V256 PolarHBondContact O-N 2.86Å; V256-A260 WeakPolarHBondContact O-CB 3.23Å; V256-A260 PolarHBondContact O-N 2.95Å; V256-A260 VanDerWaalsContact O-N 3.14Å; V256-P377 HydrophobicContact CG2-CG 4.29Å |
| 257 | A | 41.8 | Very low | 48.1 | Very low | 62 Ų | 62 | 107.4 Ų | 107.4 | 51% | 0.512 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.5 | -41.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | R253 G254 A260 H261 | R253-A257 PolarHBondContact O-N 3.49Å; G254-A257 PolarHBondContact O-N 3.41Å; A257-A260 PolarHBondContact O-N 2.95Å; A257-H261 PolarHBondContact O-N 3.23Å |
| 258 | S | 39.8 | Very low | 46.1 | Very low | 79 Ų | 79 | 110.9 Ų | 110.9 | 55% | 0.552 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -67 | -41.8 | 178.9 | -168.6 | 0 | 0 | 0 | 0 | 112.3 | G254 A260 H261 | G254-S258 WeakPolarHBondContact O-CB 3.48Å; G254-S258 PolarHBondContact O-N 3.36Å; S258-A260 VanDerWaalsContact C-N 3.34Å; S258-A260 PolarHBondContact O-N 2.89Å; S258-H261 PolarHBondContact O-N 3.24Å |
| 259 | S | 41 | Very low | 44.3 | Very low | 75 Ų | 75 | 119.6 Ų | 119.6 | 52% | 0.524 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -63.1 | -38.8 | 175.3 | -170 | 0 | 0 | 0 | 0 | 112.5 | G255 H261 N262 | G255-S259 WeakPolarHBondContact O-CB 3.44Å; G255-S259 PolarHBondContact O-N 2.93Å; S259-H261 VanDerWaalsContact C-N 3.33Å; S259-H261 PolarHBondContact O-N 2.96Å; S259-N262 PolarHBondContact O-N 2.67Å |
| 260 | A | 39.3 | Very low | 42.6 | Very low | 59 Ų | 59 | 123.4 Ų | 123.4 | 49% | 0.488 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -66.7 | -27.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | V256 A257 S258 | V256-A260 WeakPolarHBondContact O-CB 3.23Å; V256-A260 PolarHBondContact O-N 2.95Å; V256-A260 VanDerWaalsContact O-N 3.14Å; A257-A260 PolarHBondContact O-N 2.95Å; S258-A260 VanDerWaalsContact C-N 3.34Å; S258-A260 PolarHBondContact O-N 2.89Å |
| 261 | H | 39.5 | Very low | 41.3 | Very low | 159 Ų | 159 | 119.1 Ų | 119.1 | 74% | 0.736 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -75.5 | -25.3 | -179.6 | -99.2 | 51.5 | 0 | 0 | 0 | 114.1 | A257 S258 S259 H263 | A257-H261 PolarHBondContact O-N 3.23Å; S258-H261 PolarHBondContact O-N 3.24Å; S259-H261 VanDerWaalsContact C-N 3.33Å; S259-H261 PolarHBondContact O-N 2.96Å; H261-H263 VanDerWaalsContact C-N 3.33Å; H261-H263 PolarHBondContact O-N 3.02Å |
| 262 | N | 40 | Very low | 40.4 | Very low | 134 Ų | 134 | 122.7 Ų | 122.7 | 72% | 0.717 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.3 | -9.9 | -177 | -78.4 | -17.3 | 0 | 0 | 0 | 114.6 | S259 | S259-N262 PolarHBondContact O-N 2.67Š|
| 263 | H | 40.3 | Very low | 40 | Very low | 164 Ų | 164 | 124.1 Ų | 124.1 | 76% | 0.759 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | -0.7 | -176.9 | -84.5 | -68.1 | 0 | 0 | 0 | 115.5 | H261 | H261-H263 VanDerWaalsContact C-N 3.33Å; H261-H263 PolarHBondContact O-N 3.02Å |
| 264 | H | 40.1 | Very low | 38.8 | Very low | 178 Ų | 178 | 123.4 Ų | 123.4 | 82% | 0.824 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -106 | 0.6 | -176.9 | -95.2 | -62.6 | 0 | 0 | 0 | 115.8 | ||
| 265 | L | 38.9 | Very low | 37.8 | Very low | 156 Ų | 156 | 129.4 Ų | 129.4 | 82% | 0.817 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -100.1 | 9.9 | -170.4 | -141.1 | 110.8 | 0 | 0 | 0 | 116 | ||
| 266 | H | 37.7 | Very low | 37.1 | Very low | 176 Ų | 176 | 134.3 Ų | 134.3 | 82% | 0.815 | 74% | 0.74 | S | S | * | * | trans | -126.8 | 84.1 | 174.7 | -84.8 | -73.2 | 0 | 0 | 0 | 111.5 | ||||
| 267 | H | 34.9 | Very low | 36.7 | Very low | 176 Ų | 176 | 135.5 Ų | 135.5 | 82% | 0.815 | 75% | 0.749 | S | S | * | * | trans | -178 | 83.9 | 147 | -94 | -52.2 | 0 | 0 | 0 | 111.5 | ||||
| 268 | H | 34.8 | Very low | 35.9 | Very low | 196 Ų | 196 | 137 Ų | 137 | 91% | 0.907 | 76% | 0.762 | S | S | * | * | trans | -151.8 | 119 | 153.3 | -84.8 | -61.9 | 0 | 0 | 0 | 109.6 | ||||
| 269 | H | 33.1 | Very low | 36 | Very low | 199 Ų | 199 | 138.6 Ų | 138.6 | 92% | 0.921 | 77% | 0.77 | S | S | * | * | trans | -110.7 | 129.3 | 168.5 | -82.8 | -77.9 | 0 | 0 | 0 | 109.2 | ||||
| 270 | A | 30.9 | Very low | 35.3 | Very low | 105 Ų | 105 | 140.7 Ų | 140.7 | 87% | 0.868 | 79% | 0.785 | S | S | * | * | trans | -153.4 | 159.5 | 164.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 271 | A | 33.2 | Very low | 34.8 | Very low | 96 Ų | 96 | 142.5 Ų | 142.5 | 79% | 0.793 | 80% | 0.8 | S | S | * | * | trans | -88.8 | 158.7 | -162.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 272 | P | 37.5 | Very low | 34.2 | Very low | 118 Ų | 118 | 139 Ų | 139 | 77% | 0.766 | 80% | 0.798 | S | S | * | * | trans | -103.7 | -173.1 | 169.8 | 43.2 | -35.8 | 0 | 0 | 0 | 111.8 | ||||
| 273 | P | 46.5 | Very low | 33.6 | Very low | 113 Ų | 113 | 139.3 Ų | 139.3 | 73% | 0.734 | 81% | 0.805 | S | S | * | * | -135.4 | 163.1 | -63.2 | 40.1 | -25.4 | 0 | 0 | 0 | 113.7 | |||||
| 274 | L | 26.7 | Very low | 33.1 | Very low | 170 Ų | 170 | 136.6 Ų | 136.6 | 89% | 0.89 | 81% | 0.811 | S | S | * | * | trans | -143.1 | 102.5 | 166.6 | -81.8 | -179.6 | 0 | 0 | 0 | 115 | ||||
| 275 | H | 28.2 | Very low | 32.5 | Very low | 169 Ų | 169 | 132.2 Ų | 132.2 | 78% | 0.782 | 81% | 0.814 | S | S | * | * | trans | 42.3 | 144.8 | 133.3 | -108.8 | -105.2 | 0 | 0 | 0 | 126.1 | ||||
| 276 | L | 30.4 | Very low | 32.1 | Very low | 152 Ų | 152 | 129.4 Ų | 129.4 | 80% | 0.796 | 81% | 0.813 | S | S | * | * | trans | 86.8 | 152.7 | 157.8 | -62.6 | 178 | 0 | 0 | 0 | 120 | ||||
| 277 | P | 35.3 | Very low | 31.6 | Very low | 110 Ų | 110 | 130.9 Ų | 130.9 | 71% | 0.714 | 82% | 0.817 | S | S | * | * | trans | -136.7 | 162.1 | -139.5 | 42.8 | -25.9 | 0 | 0 | 0 | 119.7 | ||||
| 278 | A | 26.9 | Very low | 31.3 | Very low | 94 Ų | 94 | 127 Ų | 127 | 78% | 0.777 | 82% | 0.815 | S | S | * | * | trans | 67.2 | 167.7 | 150.6 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 279 | P | 40.3 | Very low | 31.1 | Very low | 111 Ų | 111 | 128.9 Ų | 128.9 | 72% | 0.721 | 81% | 0.814 | S | S | * | * | cis | -126.3 | 172.8 | -21.8 | 37.6 | -22.9 | 0 | 0 | 0 | 114.5 | ||||
| 280 | S | 27.3 | Very low | 30.8 | Very low | 120 Ų | 120 | 123 Ų | 123 | 84% | 0.839 | 81% | 0.807 | S | S | * | * | trans | 64.9 | 142.3 | 163 | 72.9 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 281 | A | 27.7 | Very low | 30.7 | Very low | 97 Ų | 97 | 123 Ų | 123 | 80% | 0.802 | 81% | 0.807 | S | S | * | * | cis | -153.6 | -165.8 | -10.1 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 282 | A | 27.9 | Very low | 30.5 | Very low | 84 Ų | 84 | 130.3 Ų | 130.3 | 69% | 0.694 | 81% | 0.814 | S | S | * | * | cis | -155.6 | 175 | 7.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 283 | T | 26.7 | Very low | 30.1 | Very low | 141 Ų | 141 | 128.3 Ų | 128.3 | 87% | 0.865 | 82% | 0.815 | S | S | * | * | trans | 0.6 | 113.2 | 158.8 | 54.3 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 284 | A | 30.5 | Very low | 29.3 | Very low | 108 Ų | 108 | 126.4 Ų | 126.4 | 89% | 0.893 | 82% | 0.816 | S | S | * | * | -161.3 | 143 | 127.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 285 | G | 27.1 | Very low | 29.3 | Very low | 85 Ų | 85 | 123.5 Ų | 123.5 | 88% | 0.876 | 82% | 0.817 | S | S | * | * | trans | -109.2 | 136.9 | -166.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 286 | A | 30.4 | Very low | 29.6 | Very low | 98 Ų | 98 | 119.6 Ų | 119.6 | 81% | 0.81 | 82% | 0.822 | S | S | * | * | trans | -141 | 113.7 | 158.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | A288 | A286-A288 VanDerWaalsContact C-N 3.25Å; A286-A288 PolarHBondContact O-N 3.42Å | ||
| 287 | K | 27.8 | Very low | 29.7 | Very low | 207 Ų | 207 | 115.8 Ų | 115.8 | 90% | 0.9 | 82% | 0.82 | S | S | * | * | trans | -82.8 | 58.9 | -171.6 | -166.9 | 175.6 | 177 | 174.5 | 0 | 112.7 | R289 | K287-R289 PolarHBondContact O-N 3.05Š| ||
| 288 | A | 27.4 | Very low | 29.6 | Very low | 93 Ų | 93 | 115 Ų | 115 | 77% | 0.769 | 82% | 0.822 | S | S | * | * | trans | -72 | 109 | 169.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | A286 G290 | A286-A288 VanDerWaalsContact C-N 3.25Å; A286-A288 PolarHBondContact O-N 3.42Å; A288-G290 PolarHBondContact O-N 2.67Å | ||
| 289 | R | 30.6 | Very low | 29.7 | Very low | 237 Ų | 237 | 114.3 Ų | 114.3 | 89% | 0.894 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 116.4 | 168.5 | -92.9 | -177.8 | 165 | 168.5 | -5.3 | 108.3 | K287 | K287-R289 PolarHBondContact O-N 3.05Š|
| 290 | G | 26.7 | Very low | 29.5 | Very low | 75 Ų | 75 | 111.6 Ų | 111.6 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 142.6 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | A288 | A288-G290 PolarHBondContact O-N 2.67Š|
| 291 | A | 29 | Very low | 29.9 | Very low | 104 Ų | 104 | 108.1 Ų | 108.1 | 86% | 0.86 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 133.2 | 166.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||
| 292 | R | 29.1 | Very low | 30.4 | Very low | 251 Ų | 251 | 110.6 Ų | 110.6 | 95% | 0.947 | 80% | 0.798 | S | S | * | * | trans | -88.4 | 110.3 | 164.3 | -166 | 176.2 | -170.3 | 174.3 | 2.9 | 107.1 | ||||
| 293 | G | 30.5 | Very low | 31.3 | Very low | 76 Ų | 76 | 109 Ų | 109 | 78% | 0.784 | 79% | 0.79 | S | S | * | * | trans | -66.1 | 149 | -178 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 294 | G | 27.9 | Very low | 32.2 | Very low | 73 Ų | 73 | 104.1 Ų | 104.1 | 75% | 0.753 | 77% | 0.765 | S | S | * | * | trans | -175.6 | 128 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 295 | A | 28.1 | Very low | 32.9 | Very low | 109 Ų | 109 | 102.2 Ų | 102.2 | 90% | 0.901 | 75% | 0.748 | S | S | * | * | trans | 55.5 | 117.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 296 | G | 33 | Very low | 34 | Very low | 87 Ų | 87 | 100.7 Ų | 100.7 | 90% | 0.897 | 73% | 0.728 | S | S | * | * | trans | -87.2 | 152.4 | 164.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 297 | G | 33.8 | Very low | 35.1 | Very low | 72 Ų | 72 | 97.8 Ų | 97.8 | 74% | 0.742 | 70% | 0.704 | S | S | * | * | trans | 162.8 | 163.9 | 175 | 0 | 0 | 0 | 0 | 0 | 113.4 | G299 | G297-G299 PolarHBondContact O-N 2.97Š| ||
| 298 | A | 33.2 | Very low | 36.2 | Very low | 93 Ų | 93 | 88.8 Ų | 88.8 | 77% | 0.769 | 67% | 0.668 | S | S | * | * | trans | 58.9 | 39 | 164.5 | 0 | 0 | 0 | 0 | 0 | 119 | G300 G301 | A298-G300 PolarHBondContact O-N 3.07Å; A298-G300 VanDerWaalsContact O-N 3.07Å; A298-G301 PolarHBondContact O-N 3.45Å | ||
| 299 | G | 29.2 | Very low | 37.4 | Very low | 79 Ų | 79 | 85.8 Ų | 85.8 | 81% | 0.814 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.9 | -14.8 | 170.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | G297 | G297-G299 PolarHBondContact O-N 2.97Š|
| 300 | G | 35.1 | Very low | 39 | Very low | 55 Ų | 55 | 77.6 Ų | 77.6 | 57% | 0.567 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.4 | -27.2 | -179 | 0 | 0 | 0 | 0 | 0 | 115.9 | A298 L302 | A298-G300 PolarHBondContact O-N 3.07Å; A298-G300 VanDerWaalsContact O-N 3.07Å; G300-L302 PolarHBondContact O-N 2.89Å |
| 301 | G | 35.2 | Very low | 40.8 | Very low | 47 Ų | 47 | 76.2 Ų | 76.2 | 49% | 0.485 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -68.6 | -38.7 | -168.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | A298 G303 A304 A305 | A298-G301 PolarHBondContact O-N 3.45Å; G301-G303 VanDerWaalsContact C-N 3.33Å; G301-G303 PolarHBondContact O-N 3.44Å; G301-A304 PolarHBondContact O-N 3.46Å; G301-A305 PolarHBondContact O-N 3.01Å |
| 302 | L | 39.8 | Very low | 42.7 | Very low | 148 Ų | 148 | 72.4 Ų | 72.4 | 78% | 0.775 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -63.2 | -35.7 | -177.3 | -79.3 | 159.3 | 0 | 0 | 0 | 113 | G300 A306 | G300-L302 PolarHBondContact O-N 2.89Å; L302-A306 WeakPolarHBondContact O-CB 3.31Å; L302-A306 PolarHBondContact O-N 2.98Å; L302-A306 VanDerWaalsContact O-N 3.12Å |
| 303 | G | 46.4 | Very low | 45 | Very low | 51 Ų | 51 | 65 Ų | 65 | 53% | 0.526 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -69.2 | -39.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | G301 A306 A307 | G301-G303 VanDerWaalsContact C-N 3.33Å; G301-G303 PolarHBondContact O-N 3.44Å; G303-A306 PolarHBondContact O-N 3.25Å; G303-A307 PolarHBondContact O-N 3.08Å |
| 304 | A | 45.2 | Very low | 47.3 | Very low | 39 Ų | 39 | 61.3 Ų | 61.3 | 32% | 0.322 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69.9 | -41.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | G301 A306 A307 A308 A454 | G301-A304 PolarHBondContact O-N 3.46Å; A304-A306 VanDerWaalsContact C-N 3.35Å; A304-A306 PolarHBondContact O-N 2.84Å; A304-A307 PolarHBondContact O-N 3.32Å; A304-A308 PolarHBondContact O-N 2.95Å; A304-A454 HydrophobicContact CB-CB 3.77Å |
| 305 | A | 46.1 | Very low | 49.9 | Very low | 67 Ų | 67 | 60 Ų | 60 | 55% | 0.554 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -63.5 | -39 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | G301 G309 | G301-A305 PolarHBondContact O-N 3.01Å; A305-G309 PolarHBondContact O-N 3.14Å; A305-G309 VanDerWaalsContact O-N 3.07Å |
| 306 | A | 50.5 | Low | 52.7 | Low | 54 Ų | 54 | 58.2 Ų | 58.2 | 45% | 0.446 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -63 | -44.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | L302 G303 A304 A308 G309 E310 | L302-A306 WeakPolarHBondContact O-CB 3.31Å; L302-A306 PolarHBondContact O-N 2.98Å; L302-A306 VanDerWaalsContact O-N 3.12Å; G303-A306 PolarHBondContact O-N 3.25Å; A304-A306 VanDerWaalsContact C-N 3.35Å; A304-A306 PolarHBondContact O-N 2.84Å; A306-A308 PolarHBondContact O-N 3.15Å; A306-G309 CarbonylContact O-C 3.59Å; A306-G309 WeakPolarHBondContact O-CA 3.34Å; A306-G309 PolarHBondContact O-N 2.96Å; A306-G309 VanDerWaalsContact O-N 3.11Å; A306-E310 PolarHBondContact O-N 2.84Å |
| 307 | A | 52 | Low | 55.3 | Low | 37 Ų | 37 | 54.6 Ų | 54.6 | 31% | 0.306 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -63.1 | -41.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | G303 A304 G309 E310 F311 | G303-A307 PolarHBondContact O-N 3.08Å; A304-A307 PolarHBondContact O-N 3.32Å; A307-G309 VanDerWaalsContact C-N 3.32Å; A307-G309 PolarHBondContact O-N 3.41Å; A307-E310 WeakPolarHBondContact O-CB 3.5Å; A307-E310 PolarHBondContact O-N 2.88Å; A307-E310 VanDerWaalsContact O-N 3.16Å; A307-F311 VanDerWaalsContact O-CD2 3.23Å; A307-F311 WeakPolarHBondContact O-CD2 3.17Å; A307-F311 PolarHBondContact O-N 3.34Å |
| 308 | A | 51 | Low | 58 | Low | 17 Ų | 17 | 51.1 Ų | 51.1 | 14% | 0.14 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -61.4 | -42.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | A304 A306 E310 F311 A312 N447 A451 | A304-A308 PolarHBondContact O-N 2.95Å; A306-A308 PolarHBondContact O-N 3.15Å; A308-E310 PolarHBondContact O-N 3.4Å; A308-F311 PolarHBondContact O-N 3.19Å; A308-A312 PolarHBondContact O-N 2.88Å; A308-A312 VanDerWaalsContact O-N 3.15Å; A308-N447 PolarHBondContact O-OD1 3.46Å; A308-A451 HydrophobicContact CB-CB 4.46Å |
| 309 | G | 52.8 | Low | 60.8 | Low | 31 Ų | 31 | 49.6 Ų | 49.6 | 32% | 0.32 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -56.3 | -32.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | A305 A306 A307 F313 | A305-G309 PolarHBondContact O-N 3.14Å; A305-G309 VanDerWaalsContact O-N 3.07Å; A306-G309 CarbonylContact O-C 3.59Å; A306-G309 WeakPolarHBondContact O-CA 3.34Å; A306-G309 PolarHBondContact O-N 2.96Å; A306-G309 VanDerWaalsContact O-N 3.11Å; A307-G309 VanDerWaalsContact C-N 3.32Å; A307-G309 PolarHBondContact O-N 3.41Å; G309-F313 WeakPolarHBondContact O-CD2 3.46Å; G309-F313 WeakPolarHBondContact O-CE2 3.29Å |
| 310 | E | 63.4 | Low | 63.7 | Low | 64 Ų | 64 | 50.2 Ų | 50.2 | 30% | 0.299 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -72 | -41.2 | 178.6 | -71.3 | 171.8 | 175 | 0 | 0 | 112.9 | F244 A306 A307 A308 A312 | F244-E310 WeakPolarHBondContact CE2-O 3.48Å; A306-E310 PolarHBondContact O-N 2.84Å; A307-E310 WeakPolarHBondContact O-CB 3.5Å; A307-E310 PolarHBondContact O-N 2.88Å; A307-E310 VanDerWaalsContact O-N 3.16Å; A308-E310 PolarHBondContact O-N 3.4Å; E310-A312 VanDerWaalsContact C-N 3.32Å; E310-A312 PolarHBondContact O-N 3.47Å |
| 311 | F | 64.6 | Low | 66.4 | Low | 47 Ų | 47 | 48 Ų | 48 | 21% | 0.206 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -70.1 | -28.8 | 175.4 | -68.1 | -75.8 | 0 | 0 | 0 | 112.7 | A307 A308 F313 A314 I370 N447 | A307-F311 VanDerWaalsContact O-CD2 3.23Å; A307-F311 WeakPolarHBondContact O-CD2 3.17Å; A307-F311 PolarHBondContact O-N 3.34Å; A308-F311 PolarHBondContact O-N 3.19Å; F311-F313 VanDerWaalsContact C-N 3.32Å; F311-F313 PolarHBondContact O-N 3.37Å; F311-A314 WeakPolarHBondContact O-CB 3.45Å; F311-A314 PolarHBondContact O-N 3.37Å; F311-A314 VanDerWaalsContact O-N 3.08Å; F311-I370 HydrophobicContact CD1-CG2 4.09Å; F311-I370 HydrophobicContact CE1-CG2 3.62Å; F311-N447 HydrophobicContact CB-CB 3.84Å |
| 312 | A | 69.9 | Low | 69.2 | Low | 23 Ų | 23 | 46 Ų | 46 | 19% | 0.19 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -59.5 | -38.7 | 177 | 0 | 0 | 0 | 0 | 0 | 113.5 | A308 E310 A314 Y315 L316 | A308-A312 PolarHBondContact O-N 2.88Å; A308-A312 VanDerWaalsContact O-N 3.15Å; E310-A312 VanDerWaalsContact C-N 3.32Å; E310-A312 PolarHBondContact O-N 3.47Å; A312-A314 VanDerWaalsContact C-N 3.33Å; A312-Y315 HydrophobicContact CB-CE1 4.31Å; A312-L316 WeakPolarHBondContact O-CG 3.29Å |
| 313 | F | 76.4 | Confident | 71.6 | Confident | 95 Ų | 95 | 44.2 Ų | 44.2 | 42% | 0.417 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -71.8 | -26.1 | 175.6 | -67.3 | -73.9 | 0 | 0 | 0 | 113 | F244 K247 G309 F311 A317 | F244-F313 HydrophobicContact CD2-CB 3.59Å; F244-F313 HydrophobicContact CE2-CB 3.91Å; K247-F313 VanDerWaalsContact NZ-CE2 3.32Å; G309-F313 WeakPolarHBondContact O-CD2 3.46Å; G309-F313 WeakPolarHBondContact O-CE2 3.29Å; F311-F313 VanDerWaalsContact C-N 3.32Å; F311-F313 PolarHBondContact O-N 3.37Å; F313-A317 WeakPolarHBondContact O-CB 3.4Å; F313-A317 PolarHBondContact O-N 3.34Å |
| 314 | A | 79.9 | Confident | 73.8 | Confident | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -70.8 | -46.8 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | F244 F311 A312 L316 A317 W318 I370 | F244-A314 HydrophobicContact CZ-CB 4.1Å; F311-A314 WeakPolarHBondContact O-CB 3.45Å; F311-A314 PolarHBondContact O-N 3.37Å; F311-A314 VanDerWaalsContact O-N 3.08Å; A312-A314 VanDerWaalsContact C-N 3.33Å; A314-L316 VanDerWaalsContact C-N 3.34Å; A314-A317 PolarHBondContact O-N 3Å; A314-W318 PolarHBondContact O-N 2.84Å; A314-W318 VanDerWaalsContact O-N 3.12Å; A314-I370 HydrophobicContact CB-CD1 3.66Å; A314-I370 HydrophobicContact CB-CG1 4.44Å |
| 315 | Y | 83.4 | Confident | 75.9 | Confident | 45 Ų | 45 | 41.1 Ų | 41.1 | 18% | 0.176 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -69.4 | -33.5 | 177.5 | 69.6 | -106.6 | 0 | 0 | 0 | 112 | A312 L319 V440 Y444 N447 | A312-Y315 HydrophobicContact CB-CE1 4.31Å; Y315-L319 VanDerWaalsContact O-CB 3.25Å; Y315-L319 WeakPolarHBondContact O-CB 3.37Å; Y315-L319 PolarHBondContact O-N 2.81Å; Y315-V440 HydrophobicContact CD2-CG1 4.37Å; Y315-Y444 HydrophobicContact CD1-CD2 4.48Å; Y315-Y444 AromaticContact CE1-CD2 3.98Å; Y315-Y444 HydrophobicContact CE1-CD2 3.98Å; Y315-Y444 HydrophobicContact CE2-CD2 4.39Å; Y315-Y444 AromaticContact CZ-CD2 3.97Å; Y315-N447 HydrophobicContact CD1-CB 4.47Å; Y315-N447 HydrophobicContact CE1-CB 4.25Å |
| 316 | L | 86.3 | Confident | 78.1 | Confident | 71 Ų | 71 | 39.8 Ų | 39.8 | 37% | 0.372 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -65.8 | -44.7 | 173.2 | -69.2 | 175.2 | 0 | 0 | 0 | 111.6 | A312 A314 W318 L319 I320 | A312-L316 WeakPolarHBondContact O-CG 3.29Å; A314-L316 VanDerWaalsContact C-N 3.34Å; L316-W318 VanDerWaalsContact C-N 3.3Å; L316-W318 PolarHBondContact O-N 2.75Å; L316-L319 PolarHBondContact O-N 3.26Å; L316-I320 WeakPolarHBondContact O-CB 3.33Å; L316-I320 WeakPolarHBondContact O-CD1 3.41Å; L316-I320 WeakPolarHBondContact O-CG1 3.33Å; L316-I320 PolarHBondContact O-N 3.16Å |
| 317 | A | 87.6 | Confident | 79.9 | Confident | 11 Ų | 11 | 39 Ų | 39 | 9% | 0.091 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -60.5 | -39.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | W241 F313 A314 Y321 | W241-A317 HydrophobicContact CG-CB 4.47Å; W241-A317 PolarHBondContact NE1-O 3.33Å; F313-A317 WeakPolarHBondContact O-CB 3.4Å; F313-A317 PolarHBondContact O-N 3.34Å; A314-A317 PolarHBondContact O-N 3Å; A317-Y321 WeakPolarHBondContact O-CB 3.35Å; A317-Y321 PolarHBondContact O-N 3.22Å |
| 318 | W | 90.8 | Very high | 81.7 | Confident | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -69.7 | -47 | 173 | -169.5 | -87.1 | 0 | 0 | 0 | 112.5 | W241 A314 L316 I320 Y321 S322 L362 L363 L366 L436 P439 V440 L443 | W241-W318 AromaticContact CH2-CE3 3.88Å; W241-W318 HydrophobicContact CH2-CE3 3.88Å; W241-W318 HydrophobicContact CH2-CZ3 4.01Å; W241-W318 HydrophobicContact CZ2-CE3 4.07Å; A314-W318 PolarHBondContact O-N 2.84Å; A314-W318 VanDerWaalsContact O-N 3.12Å; L316-W318 VanDerWaalsContact C-N 3.3Å; L316-W318 PolarHBondContact O-N 2.75Å; W318-I320 VanDerWaalsContact C-N 3.35Å; W318-I320 PolarHBondContact O-N 3.07Å; W318-Y321 HydrophobicContact CD2-CD1 4.17Å; W318-Y321 HydrophobicContact CE3-CD1 4.24Å; W318-Y321 HydrophobicContact CH2-CD1 4.34Å; W318-Y321 AromaticContact CH2-CE1 3.82Å; W318-Y321 HydrophobicContact CH2-CE1 3.82Å; W318-Y321 HydrophobicContact CZ2-CD1 4.26Å; W318-Y321 AromaticContact CZ2-CE1 3.82Å; W318-Y321 HydrophobicContact CZ2-CE1 3.82Å; W318-Y321 HydrophobicContact CZ3-CD1 4.34Å; W318-Y321 HydrophobicContact CZ3-CE1 4.2Å; W318-Y321 WeakPolarHBondContact O-CA 3.22Å; W318-Y321 WeakPolarHBondContact O-CB 3.28Å; W318-Y321 PolarHBondContact O-N 2.9Å; W318-Y321 VanDerWaalsContact O-N 3.13Å; W318-S322 PolarHBondContact NE1-OG 3.17Å; W318-S322 PolarHBondContact O-N 3.42Å; W318-S322 PolarHBondContact O-OG 2.68Å; W318-L362 HydrophobicContact CH2-CD2 3.62Å; W318-L362 HydrophobicContact CZ3-CD2 3.45Å; W318-L362 VanDerWaalsContact CZ3-CD2 3.45Å; W318-L363 HydrophobicContact CD2-CD1 4.39Å; W318-L363 HydrophobicContact CE3-CD1 4.19Å; W318-L363 HydrophobicContact CH2-CB 3.5Å; W318-L363 VanDerWaalsContact CH2-CB 3.5Å; W318-L363 HydrophobicContact CH2-CD1 3.78Å; W318-L363 HydrophobicContact CH2-CG 4.15Å; W318-L363 HydrophobicContact CZ2-CB 4.2Å; W318-L363 HydrophobicContact CZ2-CD1 3.99Å; W318-L363 HydrophobicContact CZ2-CG 4.49Å; W318-L363 HydrophobicContact CZ3-CB 3.99Å; W318-L363 HydrophobicContact CZ3-CD1 3.87Å; W318-L366 HydrophobicContact CE3-CD2 3.56Å; W318-L366 HydrophobicContact CZ3-CD2 4.21Å; W318-L436 HydrophobicContact CZ2-CD1 4.29Å; W318-L436 PolarHBondContact NE1-O 3.11Å; W318-P439 HydrophobicContact CD2-CB 4.48Å; W318-P439 HydrophobicContact CG-CB 4.46Å; W318-P439 HydrophobicContact CZ2-CG 4.25Å; W318-V440 HydrophobicContact CG-CG2 4.46Å; W318-L443 HydrophobicContact CB-CD1 4.3Å |
| 319 | L | 91.2 | Very high | 83.5 | Confident | 60 Ų | 60 | 36.6 Ų | 36.6 | 31% | 0.314 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -58.3 | -44.5 | 179.9 | 178.4 | 63.1 | 0 | 0 | 0 | 112.2 | Y315 L316 Y321 S322 I323 V440 | Y315-L319 VanDerWaalsContact O-CB 3.25Å; Y315-L319 WeakPolarHBondContact O-CB 3.37Å; Y315-L319 PolarHBondContact O-N 2.81Å; L316-L319 PolarHBondContact O-N 3.26Å; L319-Y321 VanDerWaalsContact C-N 3.33Å; L319-Y321 PolarHBondContact O-N 3.32Å; L319-S322 PolarHBondContact O-N 3.31Å; L319-I323 HydrophobicContact CD1-CD1 3.88Å; L319-I323 HydrophobicContact CD1-CG1 4.33Å; L319-I323 HydrophobicContact CG-CD1 3.88Å; L319-I323 WeakPolarHBondContact O-CB 3.44Å; L319-I323 VanDerWaalsContact O-CG1 3.28Å; L319-I323 WeakPolarHBondContact O-CG1 3.2Å; L319-I323 PolarHBondContact O-N 3.31Å; L319-V440 HydrophobicContact CB-CG1 4.14Å; L319-V440 HydrophobicContact CB-CG2 3.8Å; L319-V440 HydrophobicContact CD1-CG1 4.45Å; L319-V440 HydrophobicContact CD1-CG2 4.13Å |
| 320 | I | 90.5 | Very high | 85.1 | Confident | 93 Ų | 93 | 38.2 Ų | 38.2 | 48% | 0.477 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -63.8 | -40.8 | 177.2 | -64.1 | 163.8 | 0 | 0 | 0 | 110.3 | V237 L316 W318 I323 A324 | V237-I320 HydrophobicContact CG2-CG2 4.09Å; L316-I320 WeakPolarHBondContact O-CB 3.33Å; L316-I320 WeakPolarHBondContact O-CD1 3.41Å; L316-I320 WeakPolarHBondContact O-CG1 3.33Å; L316-I320 PolarHBondContact O-N 3.16Å; W318-I320 VanDerWaalsContact C-N 3.35Å; W318-I320 PolarHBondContact O-N 3.07Å; I320-I323 PolarHBondContact O-N 2.98Å; I320-A324 WeakPolarHBondContact O-CB 3.42Å; I320-A324 PolarHBondContact O-N 3.44Å |
| 321 | Y | 92.2 | Very high | 86.2 | Confident | 9 Ų | 9 | 37.7 Ų | 37.7 | 4% | 0.035 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60.9 | -48.3 | 173 | 155.5 | -98 | 0 | 0 | 0 | 111.8 | L208 Q211 W241 A317 W318 L319 I323 A324 F325 L362 L436 | L208-Y321 HydrophobicContact CD2-CD2 3.54Å; L208-Y321 HydrophobicContact CD2-CE2 3.94Å; L208-Y321 HydrophobicContact CD2-CG 4.35Å; Q211-Y321 PolarHBondContact NE2-OH 3.14Å; Q211-Y321 PolarHBondContact OE1-OH 2.77Å; W241-Y321 HydrophobicContact CZ2-CG 4.35Å; A317-Y321 WeakPolarHBondContact O-CB 3.35Å; A317-Y321 PolarHBondContact O-N 3.22Å; W318-Y321 HydrophobicContact CD2-CD1 4.17Å; W318-Y321 HydrophobicContact CE3-CD1 4.24Å; W318-Y321 HydrophobicContact CH2-CD1 4.34Å; W318-Y321 AromaticContact CH2-CE1 3.82Å; W318-Y321 HydrophobicContact CH2-CE1 3.82Å; W318-Y321 HydrophobicContact CZ2-CD1 4.26Å; W318-Y321 AromaticContact CZ2-CE1 3.82Å; W318-Y321 HydrophobicContact CZ2-CE1 3.82Å; W318-Y321 HydrophobicContact CZ3-CD1 4.34Å; W318-Y321 HydrophobicContact CZ3-CE1 4.2Å; W318-Y321 WeakPolarHBondContact O-CA 3.22Å; W318-Y321 WeakPolarHBondContact O-CB 3.28Å; W318-Y321 PolarHBondContact O-N 2.9Å; W318-Y321 VanDerWaalsContact O-N 3.13Å; L319-Y321 VanDerWaalsContact C-N 3.33Å; L319-Y321 PolarHBondContact O-N 3.32Å; Y321-I323 VanDerWaalsContact C-N 3.31Å; Y321-I323 PolarHBondContact O-N 2.82Å; Y321-A324 PolarHBondContact O-N 3.04Å; Y321-F325 HydrophobicContact CE2-CB 4.38Å; Y321-F325 HydrophobicContact CE2-CD2 4.25Å; Y321-F325 WeakPolarHBondContact O-CB 3.49Å; Y321-F325 PolarHBondContact O-N 2.85Å; Y321-L362 HydrophobicContact CD1-CD2 4.43Å; Y321-L362 HydrophobicContact CE1-CD2 3.8Å; Y321-L362 HydrophobicContact CE2-CD2 4.05Å; Y321-L436 HydrophobicContact CE1-CD1 4.1Å |
| 322 | S | 92.8 | Very high | 87.1 | Confident | 5 Ų | 5 | 35.5 Ų | 35.5 | 4% | 0.035 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -58.5 | -42.2 | 176.7 | -56.3 | 0 | 0 | 0 | 0 | 112 | W318 L319 T326 L436 | W318-S322 PolarHBondContact NE1-OG 3.17Å; W318-S322 PolarHBondContact O-N 3.42Å; W318-S322 PolarHBondContact O-OG 2.68Å; L319-S322 PolarHBondContact O-N 3.31Å; S322-T326 WeakPolarHBondContact O-CB 3.45Å; S322-T326 PolarHBondContact O-N 3.49Å; S322-T326 PolarHBondContact O-OG1 2.75Å; S322-L436 PolarHBondContact OG-O 3.17Å |
| 323 | I | 91.4 | Very high | 87.6 | Confident | 110 Ų | 110 | 35.9 Ų | 35.9 | 56% | 0.564 | 19% | 0.19 | S | C | * | . | H | α-helix | trans | -68.7 | -37.1 | 179.1 | -69.1 | 168.2 | 0 | 0 | 0 | 111.8 | L319 I320 Y321 P327 | L319-I323 HydrophobicContact CD1-CD1 3.88Å; L319-I323 HydrophobicContact CD1-CG1 4.33Å; L319-I323 HydrophobicContact CG-CD1 3.88Å; L319-I323 WeakPolarHBondContact O-CB 3.44Å; L319-I323 VanDerWaalsContact O-CG1 3.28Å; L319-I323 WeakPolarHBondContact O-CG1 3.2Å; L319-I323 PolarHBondContact O-N 3.31Å; I320-I323 PolarHBondContact O-N 2.98Å; Y321-I323 VanDerWaalsContact C-N 3.31Å; Y321-I323 PolarHBondContact O-N 2.82Å; I323-P327 WeakPolarHBondContact O-CD 3.47Å |
| 324 | A | 91 | Very high | 87.4 | Confident | 15 Ų | 15 | 34 Ų | 34 | 12% | 0.124 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -73.9 | -36.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | V237 I320 Y321 P327 | V237-A324 HydrophobicContact CG2-CB 4.08Å; I320-A324 WeakPolarHBondContact O-CB 3.42Å; I320-A324 PolarHBondContact O-N 3.44Å; Y321-A324 PolarHBondContact O-N 3.04Å; A324-P327 WeakPolarHBondContact O-CD 3.25Å |
| 325 | F | 91.1 | Very high | 87 | Confident | 9 Ų | 9 | 37 Ų | 37 | 4% | 0.039 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -73.6 | -40.2 | -178.8 | -179.8 | -93.4 | 0 | 0 | 0 | 112.8 | Q211 L215 Y321 K328 V329 Y432 F433 L436 | Q211-F325 HydrophobicContact CG-CE2 3.96Å; L215-F325 HydrophobicContact CD1-CD2 3.59Å; L215-F325 HydrophobicContact CD1-CE2 3.52Å; Y321-F325 HydrophobicContact CE2-CB 4.38Å; Y321-F325 HydrophobicContact CE2-CD2 4.25Å; Y321-F325 WeakPolarHBondContact O-CB 3.49Å; Y321-F325 PolarHBondContact O-N 2.85Å; F325-K328 PolarHBondContact O-N 2.86Å; F325-V329 HydrophobicContact CD1-CG2 3.96Å; F325-V329 HydrophobicContact CE1-CG2 3.56Å; F325-V329 HydrophobicContact CE2-CG2 4.13Å; F325-V329 HydrophobicContact CG-CG2 4.44Å; F325-V329 HydrophobicContact CZ-CG2 3.65Å; F325-V329 PolarHBondContact O-N 3.45Å; F325-Y432 AromaticContact CE1-CE1 3.97Å; F325-Y432 HydrophobicContact CE1-CE1 3.97Å; F325-Y432 WeakPolarHBondContact CE1-OH 3.38Å; F325-F433 HydrophobicContact CD1-CE1 4.45Å; F325-L436 HydrophobicContact CD1-CD2 3.36Å; F325-L436 HydrophobicContact CE1-CD2 3.8Å; F325-L436 HydrophobicContact CG-CD2 4.27Å |
| 326 | T | 91.3 | Very high | 85.8 | Confident | 40 Ų | 40 | 39.4 Ų | 39.4 | 25% | 0.245 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -49.2 | -57.7 | -178.8 | -65.3 | 0 | 0 | 0 | 0 | 114.1 | S322 K328 V329 V330 F433 | S322-T326 WeakPolarHBondContact O-CB 3.45Å; S322-T326 PolarHBondContact O-N 3.49Å; S322-T326 PolarHBondContact O-OG1 2.75Å; T326-K328 VanDerWaalsContact C-N 3.34Å; T326-K328 PolarHBondContact O-N 2.75Å; T326-V329 PolarHBondContact O-N 2.96Å; T326-V330 HydrophobicContact CG2-CG2 4.32Å; T326-V330 WeakPolarHBondContact O-CG2 3.5Å; T326-V330 PolarHBondContact O-N 3.22Å; T326-F433 HydrophobicContact CG2-CD1 4.01Å; T326-F433 HydrophobicContact CG2-CD2 3.8Å; T326-F433 HydrophobicContact CG2-CE1 4.08Å; T326-F433 HydrophobicContact CG2-CE2 3.83Å; T326-F433 HydrophobicContact CG2-CG 3.89Å; T326-F433 HydrophobicContact CG2-CZ 3.98Å; T326-F433 WeakPolarHBondContact OG1-CD1 3.4Å |
| 327 | P | 89 | Confident | 84.7 | Confident | 38 Ų | 38 | 37 Ų | 37 | 25% | 0.247 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.8 | -36.1 | -177.2 | 25.4 | -34.7 | 0 | 0 | 0 | 112.7 | W230 I323 A324 V329 V330 L331 | W230-P327 HydrophobicContact CH2-CB 3.78Å; W230-P327 HydrophobicContact CH2-CG 3.48Å; W230-P327 VanDerWaalsContact CH2-CG 3.48Å; W230-P327 HydrophobicContact CZ2-CB 4.45Å; W230-P327 HydrophobicContact CZ3-CB 4.36Å; W230-P327 HydrophobicContact CZ3-CG 3.62Å; I323-P327 WeakPolarHBondContact O-CD 3.47Å; A324-P327 WeakPolarHBondContact O-CD 3.25Å; P327-V329 PolarHBondContact O-N 3.16Å; P327-V330 PolarHBondContact O-N 3.01Å; P327-L331 WeakPolarHBondContact O-CB 3.09Å; P327-L331 WeakPolarHBondContact O-CD1 3.12Å; P327-L331 WeakPolarHBondContact O-CG 3.38Å; P327-L331 PolarHBondContact O-N 2.87Å |
| 328 | K | 88.7 | Confident | 83.4 | Confident | 1 Ų | 1 | 37.7 Ų | 37.7 | 0% | 0.004 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -60.4 | -46.7 | 177.1 | -58.9 | -168.4 | -174.8 | -160 | 0 | 111.2 | L215 D216 L219 W230 D234 F325 T326 L331 I332 | L215-K328 HydrophobicContact CB-CD 4.15Å; L215-K328 HydrophobicContact CD1-CB 4.35Å; L215-K328 HydrophobicContact CD1-CD 4.47Å; D216-K328 VanDerWaalsContact CG-NZ 3.27Å; D216-K328 IonicContact OD1-NZ 2.67Å; D216-K328 PolarHBondContact OD1-NZ 3.07Å; D216-K328 IonicContact OD2-NZ 3.51Å; D216-K328 PolarHBondContact OD2-NZ 3.05Å; L219-K328 HydrophobicContact CD1-CB 4.25Å; L219-K328 HydrophobicContact CD1-CD 4.25Å; L219-K328 HydrophobicContact CD1-CG 4.05Å; W230-K328 HydrophobicContact CE3-CG 4.16Å; W230-K328 PolarHBondContact O-NZ 3.38Å; D234-K328 VanDerWaalsContact OD1-CE 3.27Å; D234-K328 WeakPolarHBondContact OD1-CE 3.49Å; D234-K328 IonicContact OD1-NZ 3.66Å; D234-K328 PolarHBondContact OD1-NZ 2.86Å; D234-K328 IonicContact OD2-NZ 3.66Å; D234-K328 PolarHBondContact OD2-NZ 3.14Å; F325-K328 PolarHBondContact O-N 2.86Å; T326-K328 VanDerWaalsContact C-N 3.34Å; T326-K328 PolarHBondContact O-N 2.75Å; K328-L331 PolarHBondContact O-N 2.73Å; K328-I332 WeakPolarHBondContact O-CD1 3.32Å; K328-I332 WeakPolarHBondContact O-CG1 3.27Å; K328-I332 PolarHBondContact O-N 3.2Å; K328-I332 VanDerWaalsContact O-N 3.14Å |
| 329 | V | 88.8 | Confident | 82 | Confident | 1 Ų | 1 | 42.8 Ų | 42.8 | 1% | 0.006 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -67.2 | -42.4 | 177.1 | 173.4 | 0 | 0 | 0 | 0 | 111.4 | L215 F325 T326 P327 L331 I332 L333 F352 M356 Y432 F433 | L215-V329 HydrophobicContact CD1-CG2 4.43Å; L215-V329 HydrophobicContact CD2-CG2 4.36Å; F325-V329 HydrophobicContact CD1-CG2 3.96Å; F325-V329 HydrophobicContact CE1-CG2 3.56Å; F325-V329 HydrophobicContact CE2-CG2 4.13Å; F325-V329 HydrophobicContact CG-CG2 4.44Å; F325-V329 HydrophobicContact CZ-CG2 3.65Å; F325-V329 PolarHBondContact O-N 3.45Å; T326-V329 PolarHBondContact O-N 2.96Å; P327-V329 PolarHBondContact O-N 3.16Å; V329-L331 VanDerWaalsContact C-N 3.33Å; V329-L331 PolarHBondContact O-N 3.37Å; V329-I332 PolarHBondContact O-N 3.47Å; V329-L333 HydrophobicContact CG1-CD2 4.43Å; V329-L333 WeakPolarHBondContact O-CB 3.41Å; V329-L333 PolarHBondContact O-N 3.31Å; V329-F352 HydrophobicContact CG1-CZ 4.09Å; V329-M356 HydrophobicContact CG1-SD 4.25Å; V329-Y432 HydrophobicContact CG1-CE1 4.47Å; V329-F433 HydrophobicContact CB-CE1 4.12Å; V329-F433 HydrophobicContact CB-CZ 3.87Å; V329-F433 HydrophobicContact CG1-CE1 4.14Å; V329-F433 HydrophobicContact CG1-CZ 3.75Å |
| 330 | V | 87.6 | Confident | 80.4 | Confident | 65 Ų | 65 | 44.5 Ų | 44.5 | 39% | 0.394 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.2 | -40.6 | 175.3 | 171.9 | 0 | 0 | 0 | 0 | 111.9 | T326 P327 G334 I429 F433 | T326-V330 HydrophobicContact CG2-CG2 4.32Å; T326-V330 WeakPolarHBondContact O-CG2 3.5Å; T326-V330 PolarHBondContact O-N 3.22Å; P327-V330 PolarHBondContact O-N 3.01Å; V330-G334 WeakPolarHBondContact O-CA 3.35Å; V330-G334 PolarHBondContact O-N 3.36Å; V330-I429 HydrophobicContact CG2-CG2 4.37Å; V330-F433 HydrophobicContact CG2-CD2 4.48Å; V330-F433 HydrophobicContact CG2-CE2 3.42Å; V330-F433 VanDerWaalsContact CG2-CE2 3.42Å; V330-F433 HydrophobicContact CG2-CZ 3.81Å |
| 331 | L | 85.9 | Confident | 79 | Confident | 53 Ų | 53 | 40.1 Ų | 40.1 | 28% | 0.277 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -65.9 | -50 | 179.6 | -73.8 | 162.1 | 0 | 0 | 0 | 111.6 | L219 W227 P327 K328 V329 L333 T335 | L219-L331 HydrophobicContact CD2-CB 4.23Å; W227-L331 HydrophobicContact CE3-CD1 4.15Å; W227-L331 HydrophobicContact CH2-CD1 4.21Å; W227-L331 HydrophobicContact CH2-CD2 4.21Å; W227-L331 HydrophobicContact CZ3-CD1 3.47Å; W227-L331 VanDerWaalsContact CZ3-CD1 3.47Å; W227-L331 HydrophobicContact CZ3-CD2 4.29Å; P327-L331 WeakPolarHBondContact O-CB 3.09Å; P327-L331 WeakPolarHBondContact O-CD1 3.12Å; P327-L331 WeakPolarHBondContact O-CG 3.38Å; P327-L331 PolarHBondContact O-N 2.87Å; K328-L331 PolarHBondContact O-N 2.73Å; V329-L331 VanDerWaalsContact C-N 3.33Å; V329-L331 PolarHBondContact O-N 3.37Å; L331-L333 PolarHBondContact O-N 2.9Å; L331-T335 WeakPolarHBondContact O-CB 3.38Å; L331-T335 WeakPolarHBondContact O-CG2 3.45Å; L331-T335 PolarHBondContact O-N 3.48Å; L331-T335 PolarHBondContact O-OG1 3.25Å |
| 332 | I | 82.9 | Confident | 77.6 | Confident | 2 Ų | 2 | 46.1 Ų | 46.1 | 1% | 0.01 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.5 | -32.7 | 179.7 | -66.1 | 164.2 | 0 | 0 | 0 | 111.9 | L215 L219 K328 V329 L338 I341 F352 | L215-I332 HydrophobicContact CD2-CD1 3.63Å; L219-I332 HydrophobicContact CD2-CD1 4.41Å; L219-I332 HydrophobicContact CD2-CG1 3.93Å; L219-I332 HydrophobicContact CG-CD1 4.38Å; L219-I332 HydrophobicContact CG-CG1 4.41Å; K328-I332 WeakPolarHBondContact O-CD1 3.32Å; K328-I332 WeakPolarHBondContact O-CG1 3.27Å; K328-I332 PolarHBondContact O-N 3.2Å; K328-I332 VanDerWaalsContact O-N 3.14Å; V329-I332 PolarHBondContact O-N 3.47Å; I332-L338 HydrophobicContact CG2-CD1 3.95Å; I332-I341 HydrophobicContact CG2-CD1 3.92Å; I332-F352 HydrophobicContact CB-CD2 4.48Å; I332-F352 HydrophobicContact CB-CE2 3.95Å; I332-F352 HydrophobicContact CD1-CD2 4.27Å; I332-F352 HydrophobicContact CD1-CE2 4.15Å; I332-F352 HydrophobicContact CG2-CD2 3.72Å; I332-F352 HydrophobicContact CG2-CE2 3.55Å; I332-F352 HydrophobicContact CG2-CG 4.45Å; I332-F352 HydrophobicContact CG2-CZ 4.16Å |
| 333 | L | 81.1 | Confident | 75.9 | Confident | 31 Ų | 31 | 53.5 Ų | 53.5 | 16% | 0.162 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -99 | -23.8 | -171.3 | -165.7 | 60.6 | 0 | 0 | 0 | 114.2 | V329 L331 F352 V410 M413 L414 I429 | V329-L333 HydrophobicContact CG1-CD2 4.43Å; V329-L333 WeakPolarHBondContact O-CB 3.41Å; V329-L333 PolarHBondContact O-N 3.31Å; L331-L333 PolarHBondContact O-N 2.9Å; L333-F352 HydrophobicContact CB-CZ 4.46Å; L333-F352 HydrophobicContact CD1-CE1 4.29Å; L333-F352 HydrophobicContact CD1-CZ 4.47Å; L333-V410 HydrophobicContact CD2-CG1 4.39Å; L333-M413 HydrophobicContact CD1-CE 3.98Å; L333-M413 HydrophobicContact CD2-CE 3.71Å; L333-M413 HydrophobicContact CG-CE 3.97Å; L333-L414 HydrophobicContact CD1-CD1 3.71Å; L333-L414 HydrophobicContact CD1-CG 4.38Å; L333-I429 HydrophobicContact CD2-CD1 3.87Å; L333-I429 HydrophobicContact CD2-CG1 3.86Å; L333-I429 HydrophobicContact CG-CD1 4.21Å |
| 334 | G | 72.2 | Confident | 74.3 | Confident | 55 Ų | 55 | 56.5 Ų | 56.5 | 57% | 0.567 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -94.8 | -19.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | V330 | V330-G334 WeakPolarHBondContact O-CA 3.35Å; V330-G334 PolarHBondContact O-N 3.36Å |
| 335 | T | 71 | Confident | 72.9 | Confident | 63 Ų | 63 | 56.6 Ų | 56.6 | 39% | 0.387 | 31% | 0.314 | S | S | . | . | S | Bend | trans | -89.1 | 154.4 | 162.6 | 60.2 | 0 | 0 | 0 | 0 | 109.4 | L331 I337 | L331-T335 WeakPolarHBondContact O-CB 3.38Å; L331-T335 WeakPolarHBondContact O-CG2 3.45Å; L331-T335 PolarHBondContact O-N 3.48Å; L331-T335 PolarHBondContact O-OG1 3.25Å; T335-I337 PolarHBondContact O-N 3.15Å; T335-I337 VanDerWaalsContact OG1-CB 3.31Å; T335-I337 WeakPolarHBondContact OG1-CB 3.27Å; T335-I337 VanDerWaalsContact OG1-CD1 3.24Å; T335-I337 WeakPolarHBondContact OG1-CD1 3.5Å; T335-I337 WeakPolarHBondContact OG1-CG1 3.36Å |
| 336 | S | 59.6 | Low | 71.2 | Confident | 95 Ų | 95 | 61.5 Ų | 61.5 | 66% | 0.664 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.9 | 40.4 | 175.3 | 59.8 | 0 | 0 | 0 | 0 | 112.4 | ||
| 337 | I | 61.8 | Low | 70.1 | Confident | 21 Ų | 21 | 66 Ų | 66 | 11% | 0.108 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -83.2 | -20.2 | -174 | -83.9 | -175.2 | 0 | 0 | 0 | 112.1 | V222 T223 T335 D339 L340 I341 | V222-I337 HydrophobicContact CB-CD1 4.16Å; V222-I337 HydrophobicContact CB-CG1 4.5Å; V222-I337 HydrophobicContact CB-CG2 4.07Å; V222-I337 HydrophobicContact CG1-CB 4.26Å; V222-I337 HydrophobicContact CG1-CD1 3.75Å; V222-I337 HydrophobicContact CG1-CG1 3.68Å; V222-I337 HydrophobicContact CG1-CG2 3.89Å; V222-I337 HydrophobicContact CG2-CG2 4.16Å; T223-I337 HydrophobicContact CG2-CD1 3.39Å; T335-I337 PolarHBondContact O-N 3.15Å; T335-I337 VanDerWaalsContact OG1-CB 3.31Å; T335-I337 WeakPolarHBondContact OG1-CB 3.27Å; T335-I337 VanDerWaalsContact OG1-CD1 3.24Å; T335-I337 WeakPolarHBondContact OG1-CD1 3.5Å; T335-I337 WeakPolarHBondContact OG1-CG1 3.36Å; I337-D339 VanDerWaalsContact C-N 3.28Å; I337-D339 PolarHBondContact O-N 3.26Å; I337-L340 CarbonylContact O-C 3.56Å; I337-L340 PolarHBondContact O-N 2.67Å; I337-L340 VanDerWaalsContact O-N 3.14Å; I337-I341 HydrophobicContact CG2-CD1 3.56Å; I337-I341 HydrophobicContact CG2-CG1 3.87Å; I337-I341 WeakPolarHBondContact O-CB 3.37Å; I337-I341 WeakPolarHBondContact O-CG1 3.35Å; I337-I341 PolarHBondContact O-N 3.27Å |
| 338 | L | 60.7 | Low | 69.6 | Low | 25 Ų | 25 | 64.9 Ų | 64.9 | 13% | 0.131 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -56 | -41.4 | 176.1 | -112.8 | 72.8 | 0 | 0 | 0 | 112.9 | I332 I341 E342 T349 L414 | I332-L338 HydrophobicContact CG2-CD1 3.95Å; L338-I341 WeakPolarHBondContact O-CB 3.37Å; L338-I341 PolarHBondContact O-N 3.02Å; L338-E342 PolarHBondContact O-N 3.04Å; L338-T349 HydrophobicContact CD2-CG2 4.11Å; L338-T349 HydrophobicContact CG-CG2 4.1Å; L338-L414 HydrophobicContact CD2-CD2 3.79Å; L338-L414 HydrophobicContact CD2-CG 3.73Å |
| 339 | D | 60.9 | Low | 69.2 | Low | 108 Ų | 108 | 66.2 Ų | 66.2 | 58% | 0.578 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -69.4 | -35.3 | 179.8 | -51.4 | -16.4 | 0 | 0 | 0 | 111.1 | I337 L343 | I337-D339 VanDerWaalsContact C-N 3.28Å; I337-D339 PolarHBondContact O-N 3.26Å; D339-L343 WeakPolarHBondContact O-CD1 3.36Å |
| 340 | L | 58.5 | Low | 69 | Low | 96 Ų | 96 | 71 Ų | 71 | 50% | 0.503 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -71.3 | -33.5 | 171.9 | -88.8 | 67.9 | 0 | 0 | 0 | 112 | V222 I337 E342 L343 R344 | V222-L340 HydrophobicContact CG1-CB 3.97Å; V222-L340 HydrophobicContact CG1-CD2 3.81Å; I337-L340 CarbonylContact O-C 3.56Å; I337-L340 PolarHBondContact O-N 2.67Å; I337-L340 VanDerWaalsContact O-N 3.14Å; L340-E342 VanDerWaalsContact C-N 3.34Å; L340-L343 PolarHBondContact O-N 2.8Å; L340-R344 WeakPolarHBondContact O-CB 3.45Å; L340-R344 PolarHBondContact O-N 3.35Å; L340-R344 VanDerWaalsContact O-N 3.09Å |
| 341 | I | 60.9 | Low | 68.8 | Low | 1 Ų | 1 | 68.1 Ų | 68.1 | 1% | 0.005 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -63.7 | -39.9 | 176 | -82.9 | 172.8 | 0 | 0 | 0 | 110.8 | Y218 V222 I332 I337 L338 L343 R344 A345 G348 | Y218-I341 HydrophobicContact CD1-CD1 3.58Å; Y218-I341 HydrophobicContact CD1-CG1 3.89Å; Y218-I341 HydrophobicContact CD1-CG2 4.14Å; Y218-I341 HydrophobicContact CE1-CD1 4.15Å; Y218-I341 HydrophobicContact CE1-CG1 4.3Å; Y218-I341 HydrophobicContact CE1-CG2 3.67Å; Y218-I341 HydrophobicContact CG-CD1 4.27Å; V222-I341 HydrophobicContact CG2-CG1 3.96Å; I332-I341 HydrophobicContact CG2-CD1 3.92Å; I337-I341 HydrophobicContact CG2-CD1 3.56Å; I337-I341 HydrophobicContact CG2-CG1 3.87Å; I337-I341 WeakPolarHBondContact O-CB 3.37Å; I337-I341 WeakPolarHBondContact O-CG1 3.35Å; I337-I341 PolarHBondContact O-N 3.27Å; L338-I341 WeakPolarHBondContact O-CB 3.37Å; L338-I341 PolarHBondContact O-N 3.02Å; I341-L343 VanDerWaalsContact C-N 3.32Å; I341-L343 PolarHBondContact O-N 3.06Å; I341-R344 PolarHBondContact O-N 3.01Å; I341-A345 HydrophobicContact CG2-CB 4.2Å; I341-A345 WeakPolarHBondContact O-CB 3.48Å; I341-A345 PolarHBondContact O-N 2.91Å; I341-G348 VanDerWaalsContact CG2-O 3.25Å; I341-G348 WeakPolarHBondContact CG2-O 3.38Å |
| 342 | E | 62.4 | Low | 68.8 | Low | 135 Ų | 135 | 65.6 Ų | 65.6 | 63% | 0.631 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -62.6 | -36.6 | 177.9 | -173.4 | 163.4 | -174.9 | 0 | 0 | 112.6 | L338 L340 | L338-E342 PolarHBondContact O-N 3.04Å; L340-E342 VanDerWaalsContact C-N 3.34Å |
| 343 | L | 57.7 | Low | 69.1 | Low | 160 Ų | 160 | 67.7 Ų | 67.7 | 84% | 0.838 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -83.6 | -19.2 | 177.3 | -82.3 | 80.3 | 0 | 0 | 0 | 114.5 | D339 L340 I341 | D339-L343 WeakPolarHBondContact O-CD1 3.36Å; L340-L343 PolarHBondContact O-N 2.8Å; I341-L343 VanDerWaalsContact C-N 3.32Å; I341-L343 PolarHBondContact O-N 3.06Å |
| 344 | R | 58 | Low | 69.5 | Low | 173 Ų | 173 | 70.7 Ų | 70.7 | 65% | 0.653 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -125.3 | -16.8 | -164.4 | -144.1 | -175.6 | -158.1 | -160.9 | 12 | 116.1 | A221 L340 I341 | A221-R344 PolarHBondContact O-NH1 3.05Å; L340-R344 WeakPolarHBondContact O-CB 3.45Å; L340-R344 PolarHBondContact O-N 3.35Å; L340-R344 VanDerWaalsContact O-N 3.09Å; I341-R344 PolarHBondContact O-N 3.01Å |
| 345 | A | 60.7 | Low | 70.3 | Confident | 17 Ų | 17 | 68.1 Ų | 68.1 | 14% | 0.14 | 36% | 0.362 | C | S | . | . | S | Bend | trans | -110.7 | 138 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y218 I341 F347 G348 | Y218-A345 HydrophobicContact CD1-CB 4.26Å; Y218-A345 HydrophobicContact CE1-CB 3.83Å; I341-A345 HydrophobicContact CG2-CB 4.2Å; I341-A345 WeakPolarHBondContact O-CB 3.48Å; I341-A345 PolarHBondContact O-N 2.91Å; A345-F347 PolarHBondContact O-N 2.89Å; A345-G348 PolarHBondContact O-N 3.23Å; A345-G348 VanDerWaalsContact O-N 3.07Å |
| 346 | P | 56.1 | Low | 71.2 | Confident | 112 Ų | 112 | 65.1 Ų | 65.1 | 73% | 0.727 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.7 | -8.4 | -172.1 | 27.5 | -36.5 | 0 | 0 | 0 | 115.4 | ||
| 347 | F | 67.1 | Low | 72.7 | Confident | 135 Ų | 135 | 62.1 Ų | 62.1 | 59% | 0.592 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -125.7 | 8.1 | 176.3 | -64.9 | -71.7 | 0 | 0 | 0 | 113.6 | A345 T350 G351 | A345-F347 PolarHBondContact O-N 2.89Å; F347-T350 WeakPolarHBondContact O-CB 3.11Å; F347-T350 PolarHBondContact O-N 3.17Å; F347-T350 VanDerWaalsContact O-N 3.14Å; F347-G351 PolarHBondContact O-N 2.9Å |
| 348 | G | 78.3 | Confident | 74.1 | Confident | 13 Ų | 13 | 62.8 Ų | 62.8 | 13% | 0.134 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | 45.3 | -139.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114 | Y218 I341 A345 T350 | Y218-G348 WeakPolarHBondContact CE1-O 3.47Å; Y218-G348 PolarHBondContact OH-O 3.42Å; I341-G348 VanDerWaalsContact CG2-O 3.25Å; I341-G348 WeakPolarHBondContact CG2-O 3.38Å; A345-G348 PolarHBondContact O-N 3.23Å; A345-G348 VanDerWaalsContact O-N 3.07Å; G348-T350 VanDerWaalsContact C-N 3.31Å |
| 349 | T | 81.3 | Confident | 75.6 | Confident | 30 Ų | 30 | 61.6 Ų | 61.6 | 18% | 0.184 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -69.7 | -25.9 | 174 | 61.7 | 0 | 0 | 0 | 0 | 113 | L338 G351 F352 R353 | L338-T349 HydrophobicContact CD2-CG2 4.11Å; L338-T349 HydrophobicContact CG-CG2 4.1Å; T349-G351 PolarHBondContact O-N 2.99Å; T349-F352 PolarHBondContact O-N 3.49Å; T349-R353 PolarHBondContact O-N 2.92Å |
| 350 | T | 84 | Confident | 77.1 | Confident | 101 Ų | 101 | 57.4 Ų | 57.4 | 62% | 0.62 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -62 | -41.2 | -178.3 | -53.1 | 0 | 0 | 0 | 0 | 112.9 | F347 G348 F352 R353 L354 | F347-T350 WeakPolarHBondContact O-CB 3.11Å; F347-T350 PolarHBondContact O-N 3.17Å; F347-T350 VanDerWaalsContact O-N 3.14Å; G348-T350 VanDerWaalsContact C-N 3.31Å; T350-F352 VanDerWaalsContact C-N 3.34Å; T350-R353 PolarHBondContact O-N 2.8Å; T350-L354 PolarHBondContact O-N 2.96Å |
| 351 | G | 84.4 | Confident | 78.7 | Confident | 4 Ų | 4 | 55.4 Ų | 55.4 | 4% | 0.041 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -68.1 | -32.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y218 F347 T349 L354 T355 | Y218-G351 VanDerWaalsContact OH-C 3.23Å; Y218-G351 WeakPolarHBondContact OH-CA 3.21Å; Y218-G351 PolarHBondContact OH-N 3.43Å; F347-G351 PolarHBondContact O-N 2.9Å; T349-G351 PolarHBondContact O-N 2.99Å; G351-L354 WeakPolarHBondContact O-CB 3.46Å; G351-L354 PolarHBondContact O-N 2.76Å; G351-T355 WeakPolarHBondContact O-CG2 3.49Å; G351-T355 PolarHBondContact O-N 3.35Å |
| 352 | F | 86 | Confident | 80.1 | Confident | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -69 | -44 | 173 | 176.4 | -96.8 | 0 | 0 | 0 | 111.4 | L215 Y218 V329 I332 L333 T349 T350 L354 T355 M356 L414 | L215-F352 HydrophobicContact CD2-CD2 4.2Å; L215-F352 HydrophobicContact CD2-CE2 4.26Å; Y218-F352 HydrophobicContact CE2-CB 4.11Å; Y218-F352 PolarHBondContact OH-N 3.27Å; V329-F352 HydrophobicContact CG1-CZ 4.09Å; I332-F352 HydrophobicContact CB-CD2 4.48Å; I332-F352 HydrophobicContact CB-CE2 3.95Å; I332-F352 HydrophobicContact CD1-CD2 4.27Å; I332-F352 HydrophobicContact CD1-CE2 4.15Å; I332-F352 HydrophobicContact CG2-CD2 3.72Å; I332-F352 HydrophobicContact CG2-CE2 3.55Å; I332-F352 HydrophobicContact CG2-CG 4.45Å; I332-F352 HydrophobicContact CG2-CZ 4.16Å; L333-F352 HydrophobicContact CB-CZ 4.46Å; L333-F352 HydrophobicContact CD1-CE1 4.29Å; L333-F352 HydrophobicContact CD1-CZ 4.47Å; T349-F352 PolarHBondContact O-N 3.49Å; T350-F352 VanDerWaalsContact C-N 3.34Å; F352-L354 VanDerWaalsContact C-N 3.25Å; F352-L354 PolarHBondContact O-N 3.09Å; F352-T355 PolarHBondContact O-N 2.93Å; F352-T355 VanDerWaalsContact O-N 3.08Å; F352-T355 PolarHBondContact O-OG1 3.28Å; F352-M356 HydrophobicContact CD1-CE 3.71Å; F352-M356 HydrophobicContact CD1-SD 4.46Å; F352-M356 HydrophobicContact CE1-CE 3.31Å; F352-M356 HydrophobicContact CE1-SD 3.68Å; F352-M356 HydrophobicContact CZ-CE 4.07Å; F352-M356 HydrophobicContact CZ-CG 4.46Å; F352-M356 HydrophobicContact CZ-SD 3.79Å; F352-M356 PolarHBondContact O-N 3.31Å; F352-M356 VanDerWaalsContact O-N 3.15Å; F352-L414 HydrophobicContact CD1-CD2 3.62Å; F352-L414 HydrophobicContact CE1-CD1 4.29Å; F352-L414 HydrophobicContact CE1-CD2 3.85Å |
| 353 | R | 89.3 | Confident | 81.4 | Confident | 46 Ų | 46 | 48.9 Ų | 48.9 | 17% | 0.174 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -52.6 | -45.7 | 168.9 | -66.8 | -175.6 | -166.7 | -154 | 7.5 | 110.9 | T349 T350 T355 M356 A357 F407 E411 L414 E415 | T349-R353 PolarHBondContact O-N 2.92Å; T350-R353 PolarHBondContact O-N 2.8Å; R353-T355 PolarHBondContact O-N 3.5Å; R353-M356 PolarHBondContact O-N 3.13Å; R353-A357 WeakPolarHBondContact O-CB 3.49Å; R353-A357 PolarHBondContact O-N 3.39Å; R353-F407 HydrophobicContact CB-CE2 4.3Å; R353-F407 HydrophobicContact CB-CZ 4.19Å; R353-F407 VanDerWaalsContact O-CE2 3.24Å; R353-F407 WeakPolarHBondContact O-CE2 3.44Å; R353-E411 WeakPolarHBondContact CD-OE1 3.26Å; R353-E411 IonicContact CZ-OE1 3.51Å; R353-E411 IonicContact NE-OE1 2.69Å; R353-E411 VanDerWaalsContact NH1-CG 3.3Å; R353-E411 IonicContact NH1-OE1 3.55Å; R353-E411 PolarHBondContact NH1-OE1 2.98Å; R353-L414 HydrophobicContact CG-CD2 4.21Å; R353-E415 IonicContact CZ-OE1 2.65Å; R353-E415 IonicContact NH1-OE1 3.24Å; R353-E415 PolarHBondContact NH1-OE1 3.18Å; R353-E415 IonicContact NH2-OE1 3.84Å |
| 354 | L | 88.9 | Confident | 82.9 | Confident | 95 Ų | 95 | 46.1 Ų | 46.1 | 50% | 0.497 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -59 | -46.2 | 175.5 | -176.8 | 63.9 | 0 | 0 | 0 | 112.1 | T350 G351 F352 M356 A357 L358 | T350-L354 PolarHBondContact O-N 2.96Å; G351-L354 WeakPolarHBondContact O-CB 3.46Å; G351-L354 PolarHBondContact O-N 2.76Å; F352-L354 VanDerWaalsContact C-N 3.25Å; F352-L354 PolarHBondContact O-N 3.09Å; L354-M356 VanDerWaalsContact C-N 3.31Å; L354-M356 PolarHBondContact O-N 2.92Å; L354-A357 PolarHBondContact O-N 3.27Å; L354-A357 VanDerWaalsContact O-N 3.17Å; L354-L358 HydrophobicContact CD1-CD2 4.24Å; L354-L358 HydrophobicContact CD1-CG 4.27Å; L354-L358 HydrophobicContact CG-CD1 4.47Å; L354-L358 HydrophobicContact CG-CG 4.3Å; L354-L358 WeakPolarHBondContact O-CG 3.49Å; L354-L358 PolarHBondContact O-N 3.24Å |
| 355 | T | 89.7 | Confident | 84.3 | Confident | 1 Ų | 1 | 38 Ų | 38 | 1% | 0.006 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -59.6 | -37.8 | 178.1 | 59.6 | 0 | 0 | 0 | 0 | 113.6 | Q211 L214 L215 G351 F352 R353 | Q211-T355 WeakPolarHBondContact CG-O 3.31Å; Q211-T355 PolarHBondContact NE2-O 3.15Å; L214-T355 HydrophobicContact CB-CG2 3.71Å; L214-T355 HydrophobicContact CD2-CG2 3.71Å; L214-T355 HydrophobicContact CG-CG2 4.25Å; L215-T355 HydrophobicContact CD2-CG2 4.47Å; L215-T355 HydrophobicContact CG-CG2 4.27Å; G351-T355 WeakPolarHBondContact O-CG2 3.49Å; G351-T355 PolarHBondContact O-N 3.35Å; F352-T355 PolarHBondContact O-N 2.93Å; F352-T355 VanDerWaalsContact O-N 3.08Å; F352-T355 PolarHBondContact O-OG1 3.28Å; R353-T355 PolarHBondContact O-N 3.5Å |
| 356 | M | 89.1 | Confident | 85.5 | Confident | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -72 | -40.4 | 175.7 | -67 | -172.4 | -60 | 0 | 0 | 111.4 | V329 F352 R353 L354 L358 S359 F407 V410 L414 Y432 | V329-M356 HydrophobicContact CG1-SD 4.25Å; F352-M356 HydrophobicContact CD1-CE 3.71Å; F352-M356 HydrophobicContact CD1-SD 4.46Å; F352-M356 HydrophobicContact CE1-CE 3.31Å; F352-M356 HydrophobicContact CE1-SD 3.68Å; F352-M356 HydrophobicContact CZ-CE 4.07Å; F352-M356 HydrophobicContact CZ-CG 4.46Å; F352-M356 HydrophobicContact CZ-SD 3.79Å; F352-M356 PolarHBondContact O-N 3.31Å; F352-M356 VanDerWaalsContact O-N 3.15Å; R353-M356 PolarHBondContact O-N 3.13Å; L354-M356 VanDerWaalsContact C-N 3.31Å; L354-M356 PolarHBondContact O-N 2.92Å; M356-L358 VanDerWaalsContact C-N 3.34Å; M356-L358 PolarHBondContact O-N 3.39Å; M356-S359 WeakPolarHBondContact O-CB 3.49Å; M356-S359 PolarHBondContact O-N 3.31Å; M356-S359 PolarHBondContact O-OG 3.09Å; M356-F407 HydrophobicContact CB-CD2 3.81Å; M356-F407 HydrophobicContact CB-CE2 4.06Å; M356-F407 HydrophobicContact CE-CE2 4.33Å; M356-V410 HydrophobicContact CE-CG1 3.63Å; M356-V410 HydrophobicContact SD-CG1 3.82Å; M356-L414 HydrophobicContact CE-CD1 4.4Å; M356-Y432 HydrophobicContact SD-CE1 4.34Å |
| 357 | A | 90.9 | Very high | 86.8 | Confident | 31 Ų | 31 | 33.1 Ų | 33.1 | 26% | 0.256 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -64.2 | -33.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | R353 L354 S359 V360 P361 F407 | R353-A357 WeakPolarHBondContact O-CB 3.49Å; R353-A357 PolarHBondContact O-N 3.39Å; L354-A357 PolarHBondContact O-N 3.27Å; L354-A357 VanDerWaalsContact O-N 3.17Å; A357-S359 PolarHBondContact O-N 2.86Å; A357-S359 VanDerWaalsContact O-N 3.16Å; A357-V360 PolarHBondContact O-N 3.23Å; A357-P361 VanDerWaalsContact O-CD 3.29Å; A357-P361 WeakPolarHBondContact O-CD 3.44Å; A357-F407 HydrophobicContact CB-CD2 4.4Å; A357-F407 HydrophobicContact CB-CE2 4.11Å; A357-F407 HydrophobicContact CB-CZ 4.21Å |
| 358 | L | 92.4 | Very high | 87.5 | Confident | 35 Ų | 35 | 31.7 Ų | 31.7 | 18% | 0.183 | 17% | 0.168 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -63.1 | -17.5 | 177.9 | -73.8 | -174.8 | 0 | 0 | 0 | 114 | L207 Q211 L354 M356 V360 P361 L362 | L207-L358 HydrophobicContact CD2-CD2 4.03Å; Q211-L358 HydrophobicContact CG-CB 4.49Å; L354-L358 HydrophobicContact CD1-CD2 4.24Å; L354-L358 HydrophobicContact CD1-CG 4.27Å; L354-L358 HydrophobicContact CG-CD1 4.47Å; L354-L358 HydrophobicContact CG-CG 4.3Å; L354-L358 WeakPolarHBondContact O-CG 3.49Å; L354-L358 PolarHBondContact O-N 3.24Å; M356-L358 VanDerWaalsContact C-N 3.34Å; M356-L358 PolarHBondContact O-N 3.39Å; L358-V360 PolarHBondContact O-N 3.3Å; L358-P361 HydrophobicContact CD2-CG 4.28Å; L358-P361 VanDerWaalsContact O-CD 3.26Å; L358-P361 WeakPolarHBondContact O-CD 3.41Å; L358-P361 WeakPolarHBondContact O-CG 3.31Å; L358-L362 WeakPolarHBondContact O-CB 3.31Å; L358-L362 PolarHBondContact O-N 3.12Å; L358-L362 VanDerWaalsContact O-N 3.11Å |
| 359 | S | 91.6 | Very high | 87.5 | Confident | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.1 | -31.6 | 174.6 | 65.1 | 0 | 0 | 0 | 0 | 113.3 | M356 A357 L363 L403 | M356-S359 WeakPolarHBondContact O-CB 3.49Å; M356-S359 PolarHBondContact O-N 3.31Å; M356-S359 PolarHBondContact O-OG 3.09Å; A357-S359 PolarHBondContact O-N 2.86Å; A357-S359 VanDerWaalsContact O-N 3.16Å; S359-L363 WeakPolarHBondContact O-CB 3.44Å; S359-L363 PolarHBondContact O-N 2.87Å; S359-L403 WeakPolarHBondContact OG-CD2 3.2Å |
| 360 | V | 92.2 | Very high | 87.2 | Confident | 20 Ų | 20 | 30.5 Ų | 30.5 | 12% | 0.121 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -72.1 | -54.2 | -179 | -177.6 | 0 | 0 | 0 | 0 | 113 | A357 L358 L362 L363 Y364 C400 L403 L404 | A357-V360 PolarHBondContact O-N 3.23Å; L358-V360 PolarHBondContact O-N 3.3Å; V360-L362 PolarHBondContact O-N 2.98Å; V360-L363 PolarHBondContact O-N 3.36Å; V360-Y364 PolarHBondContact O-N 3.03Å; V360-C400 HydrophobicContact CG1-CB 4.1Å; V360-L403 HydrophobicContact CG2-CB 4.05Å; V360-L403 HydrophobicContact CG2-CD2 3.88Å; V360-L403 HydrophobicContact CG2-CG 3.75Å; V360-L404 HydrophobicContact CG1-CD1 4.41Å; V360-L404 HydrophobicContact CG1-CD2 4.47Å; V360-L404 HydrophobicContact CG1-CG 4.23Å; V360-L404 HydrophobicContact CG2-CD2 3.99Å; V360-L404 HydrophobicContact CG2-CG 3.99Å |
| 361 | P | 91.3 | Very high | 86.7 | Confident | 54 Ų | 54 | 28.2 Ų | 28.2 | 35% | 0.351 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -65.8 | -26.2 | 173.4 | 26.4 | -34.6 | 0 | 0 | 0 | 112.6 | L207 A357 L358 S365 | L207-P361 HydrophobicContact CD1-CB 4.04Å; L207-P361 HydrophobicContact CD1-CG 4.31Å; A357-P361 VanDerWaalsContact O-CD 3.29Å; A357-P361 WeakPolarHBondContact O-CD 3.44Å; L358-P361 HydrophobicContact CD2-CG 4.28Å; L358-P361 VanDerWaalsContact O-CD 3.26Å; L358-P361 WeakPolarHBondContact O-CD 3.41Å; L358-P361 WeakPolarHBondContact O-CG 3.31Å; P361-S365 VanDerWaalsContact O-CB 3.23Å; P361-S365 WeakPolarHBondContact O-CB 3.27Å; P361-S365 PolarHBondContact O-N 3.2Å; P361-S365 PolarHBondContact O-OG 3.39Å |
| 362 | L | 91.6 | Very high | 85.8 | Confident | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -67.7 | -44.6 | 173 | 178.6 | 134.4 | 0 | 0 | 0 | 111.6 | L207 L208 W241 W318 Y321 L358 V360 S365 L366 | L207-L362 HydrophobicContact CB-CB 4.2Å; L207-L362 HydrophobicContact CB-CD1 3.79Å; L207-L362 HydrophobicContact CB-CG 4.45Å; L207-L362 HydrophobicContact CD1-CB 4.12Å; L208-L362 HydrophobicContact CB-CD1 4.3Å; L208-L362 HydrophobicContact CD2-CD1 3.88Å; L208-L362 HydrophobicContact CG-CD1 3.78Å; W241-L362 HydrophobicContact CH2-CD2 4.09Å; W241-L362 HydrophobicContact CH2-CG 4.42Å; W318-L362 HydrophobicContact CH2-CD2 3.62Å; W318-L362 HydrophobicContact CZ3-CD2 3.45Å; W318-L362 VanDerWaalsContact CZ3-CD2 3.45Å; Y321-L362 HydrophobicContact CD1-CD2 4.43Å; Y321-L362 HydrophobicContact CE1-CD2 3.8Å; Y321-L362 HydrophobicContact CE2-CD2 4.05Å; L358-L362 WeakPolarHBondContact O-CB 3.31Å; L358-L362 PolarHBondContact O-N 3.12Å; L358-L362 VanDerWaalsContact O-N 3.11Å; V360-L362 PolarHBondContact O-N 2.98Å; L362-S365 PolarHBondContact O-OG 2.86Å; L362-S365 VanDerWaalsContact O-OG 3.07Å; L362-L366 WeakPolarHBondContact O-CB 3.36Å; L362-L366 PolarHBondContact O-N 3.02Å |
| 363 | L | 89.4 | Confident | 84.4 | Confident | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -59.1 | -51.2 | 170 | -179.5 | 55.7 | 0 | 0 | 0 | 111.7 | W318 S359 V360 S365 L366 V367 L403 P439 | W318-L363 HydrophobicContact CD2-CD1 4.39Å; W318-L363 HydrophobicContact CE3-CD1 4.19Å; W318-L363 HydrophobicContact CH2-CB 3.5Å; W318-L363 VanDerWaalsContact CH2-CB 3.5Å; W318-L363 HydrophobicContact CH2-CD1 3.78Å; W318-L363 HydrophobicContact CH2-CG 4.15Å; W318-L363 HydrophobicContact CZ2-CB 4.2Å; W318-L363 HydrophobicContact CZ2-CD1 3.99Å; W318-L363 HydrophobicContact CZ2-CG 4.49Å; W318-L363 HydrophobicContact CZ3-CB 3.99Å; W318-L363 HydrophobicContact CZ3-CD1 3.87Å; S359-L363 WeakPolarHBondContact O-CB 3.44Å; S359-L363 PolarHBondContact O-N 2.87Å; V360-L363 PolarHBondContact O-N 3.36Å; L363-S365 VanDerWaalsContact C-N 3.34Å; L363-S365 PolarHBondContact O-N 3.35Å; L363-L366 PolarHBondContact O-N 3.07Å; L363-V367 HydrophobicContact CD1-CG2 4.06Å; L363-V367 WeakPolarHBondContact O-CG2 3.25Å; L363-V367 PolarHBondContact O-N 2.9Å; L363-L403 HydrophobicContact CD2-CD2 4.49Å; L363-P439 HydrophobicContact CD1-CB 3.78Å; L363-P439 HydrophobicContact CD1-CG 3.81Å; L363-P439 HydrophobicContact CD2-CG 3.7Å; L363-P439 HydrophobicContact CG-CG 4.44Å |
| 364 | Y | 88.5 | Confident | 82.7 | Confident | 102 Ų | 102 | 31.4 Ų | 31.4 | 40% | 0.4 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -60.6 | -42.2 | -178.1 | 179.5 | -103.6 | 0 | 0 | 0 | 112.3 | V360 V367 R368 | V360-Y364 PolarHBondContact O-N 3.03Å; Y364-V367 PolarHBondContact O-N 3.43Å; Y364-R368 HydrophobicContact CD1-CG 4.37Å; Y364-R368 HydrophobicContact CE1-CG 3.99Å; Y364-R368 HydrophobicContact CE2-CG 4.25Å; Y364-R368 WeakPolarHBondContact O-CB 3.44Å; Y364-R368 VanDerWaalsContact O-CG 3.31Å; Y364-R368 WeakPolarHBondContact O-CG 3.42Å; Y364-R368 PolarHBondContact O-N 2.91Å; Y364-R368 PolarHBondContact OH-NE 3.45Å; Y364-R368 PolarHBondContact OH-NH2 2.87Å |
| 365 | S | 88.6 | Confident | 80.8 | Confident | 1 Ų | 1 | 28.6 Ų | 28.6 | 1% | 0.007 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -69.5 | -37.9 | 178.2 | 60.3 | 0 | 0 | 0 | 0 | 112.9 | S204 P361 L362 L363 R368 A369 | S204-S365 WeakPolarHBondContact CB-OG 3.47Å; P361-S365 VanDerWaalsContact O-CB 3.23Å; P361-S365 WeakPolarHBondContact O-CB 3.27Å; P361-S365 PolarHBondContact O-N 3.2Å; P361-S365 PolarHBondContact O-OG 3.39Å; L362-S365 PolarHBondContact O-OG 2.86Å; L362-S365 VanDerWaalsContact O-OG 3.07Å; L363-S365 VanDerWaalsContact C-N 3.34Å; L363-S365 PolarHBondContact O-N 3.35Å; S365-R368 PolarHBondContact O-N 3.41Å; S365-A369 WeakPolarHBondContact O-CB 3.2Å; S365-A369 PolarHBondContact O-N 3.06Å |
| 366 | L | 85.8 | Confident | 78.7 | Confident | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.9 | -50.7 | 171.1 | 176.9 | 64.8 | 0 | 0 | 0 | 111.3 | W241 F244 F245 W318 L362 L363 R368 A369 I370 | W241-L366 HydrophobicContact CE3-CD1 4.14Å; W241-L366 HydrophobicContact CH2-CB 4.23Å; W241-L366 HydrophobicContact CH2-CD1 4.35Å; W241-L366 HydrophobicContact CH2-CD2 3.71Å; W241-L366 HydrophobicContact CH2-CG 4.3Å; W241-L366 HydrophobicContact CZ2-CD2 4.22Å; W241-L366 HydrophobicContact CZ3-CB 3.99Å; W241-L366 HydrophobicContact CZ3-CD1 3.85Å; W241-L366 HydrophobicContact CZ3-CD2 4.06Å; W241-L366 HydrophobicContact CZ3-CG 4.17Å; F244-L366 HydrophobicContact CE1-CD1 4.44Å; F245-L366 HydrophobicContact CE1-CD1 4.05Å; F245-L366 HydrophobicContact CZ-CD1 3.8Å; W318-L366 HydrophobicContact CE3-CD2 3.56Å; W318-L366 HydrophobicContact CZ3-CD2 4.21Å; L362-L366 WeakPolarHBondContact O-CB 3.36Å; L362-L366 PolarHBondContact O-N 3.02Å; L363-L366 PolarHBondContact O-N 3.07Å; L366-R368 VanDerWaalsContact C-N 3.3Å; L366-R368 PolarHBondContact O-N 2.84Å; L366-A369 WeakPolarHBondContact O-CB 3.39Å; L366-A369 PolarHBondContact O-N 2.72Å; L366-A369 VanDerWaalsContact O-N 3.16Å; L366-I370 HydrophobicContact CD1-CD1 3.82Å; L366-I370 HydrophobicContact CD1-CG1 4.16Å; L366-I370 HydrophobicContact CD2-CD1 4.39Å; L366-I370 HydrophobicContact CG-CD1 3.75Å; L366-I370 HydrophobicContact CG-CG1 4.48Å; L366-I370 WeakPolarHBondContact O-CG1 3.2Å; L366-I370 PolarHBondContact O-N 3.37Å |
| 367 | V | 81.9 | Confident | 76.4 | Confident | 27 Ų | 27 | 37 Ų | 37 | 16% | 0.164 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -60 | -41.8 | -179.8 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | L363 Y364 I370 S371 F396 | L363-V367 HydrophobicContact CD1-CG2 4.06Å; L363-V367 WeakPolarHBondContact O-CG2 3.25Å; L363-V367 PolarHBondContact O-N 2.9Å; Y364-V367 PolarHBondContact O-N 3.43Å; V367-I370 PolarHBondContact O-N 2.79Å; V367-S371 WeakPolarHBondContact O-CB 3.49Å; V367-S371 PolarHBondContact O-N 3.44Å; V367-S371 PolarHBondContact O-OG 2.97Å; V367-F396 HydrophobicContact CG1-CB 4.33Å; V367-F396 HydrophobicContact CG1-CD2 3.57Å; V367-F396 HydrophobicContact CG1-CE2 3.97Å; V367-F396 HydrophobicContact CG1-CG 3.94Å; V367-F396 HydrophobicContact CG2-CB 4.5Å; V367-F396 HydrophobicContact CG2-CD1 3.8Å; V367-F396 HydrophobicContact CG2-CD2 4.19Å; V367-F396 HydrophobicContact CG2-CE1 4Å; V367-F396 HydrophobicContact CG2-CE2 4.36Å; V367-F396 HydrophobicContact CG2-CG 3.92Å; V367-F396 HydrophobicContact CG2-CZ 4.28Å |
| 368 | R | 81.3 | Confident | 74.1 | Confident | 106 Ų | 106 | 39.5 Ų | 39.5 | 40% | 0.4 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -61.3 | -50.3 | 172.6 | -75.3 | -67.5 | -174.7 | -177.3 | 1.4 | 112 | Y200 Y364 S365 L366 I370 S371 E372 | Y200-R368 HydrophobicContact CD1-CB 3.87Å; Y200-R368 HydrophobicContact CD1-CG 4.35Å; Y200-R368 HydrophobicContact CD2-CB 3.91Å; Y200-R368 HydrophobicContact CE1-CB 4.19Å; Y200-R368 HydrophobicContact CE1-CG 4.2Å; Y200-R368 HydrophobicContact CE2-CB 4.23Å; Y200-R368 HydrophobicContact CG-CB 3.72Å; Y364-R368 HydrophobicContact CD1-CG 4.37Å; Y364-R368 HydrophobicContact CE1-CG 3.99Å; Y364-R368 HydrophobicContact CE2-CG 4.25Å; Y364-R368 WeakPolarHBondContact O-CB 3.44Å; Y364-R368 VanDerWaalsContact O-CG 3.31Å; Y364-R368 WeakPolarHBondContact O-CG 3.42Å; Y364-R368 PolarHBondContact O-N 2.91Å; Y364-R368 PolarHBondContact OH-NE 3.45Å; Y364-R368 PolarHBondContact OH-NH2 2.87Å; S365-R368 PolarHBondContact O-N 3.41Å; L366-R368 VanDerWaalsContact C-N 3.3Å; L366-R368 PolarHBondContact O-N 2.84Å; R368-I370 VanDerWaalsContact C-N 3.28Å; R368-I370 PolarHBondContact O-N 2.63Å; R368-S371 WeakPolarHBondContact CA-OG 3.39Å; R368-S371 PolarHBondContact O-N 3.17Å; R368-S371 PolarHBondContact O-OG 3.32Å; R368-E372 PolarHBondContact O-N 3.04Å |
| 369 | A | 78.9 | Confident | 71.7 | Confident | 1 Ų | 1 | 41.4 Ų | 41.4 | 1% | 0.008 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -57.5 | -35.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q201 F245 S365 L366 A373 | Q201-A369 HydrophobicContact CG-CB 3.63Å; F245-A369 HydrophobicContact CE1-CB 3.9Å; F245-A369 HydrophobicContact CZ-CB 4.41Å; S365-A369 WeakPolarHBondContact O-CB 3.2Å; S365-A369 PolarHBondContact O-N 3.06Å; L366-A369 WeakPolarHBondContact O-CB 3.39Å; L366-A369 PolarHBondContact O-N 2.72Å; L366-A369 VanDerWaalsContact O-N 3.16Å; A369-A373 WeakPolarHBondContact O-CB 3.47Å; A369-A373 PolarHBondContact O-N 3.01Å |
| 370 | I | 75.9 | Confident | 69.4 | Low | 16 Ų | 16 | 46.8 Ų | 46.8 | 8% | 0.082 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -72.1 | -46.4 | 173.1 | -64 | 162.2 | 0 | 0 | 0 | 110.5 | F244 F311 A314 L366 V367 R368 E372 A373 G374 L443 | F244-I370 HydrophobicContact CE1-CG1 4.35Å; F244-I370 HydrophobicContact CZ-CG1 4.27Å; F311-I370 HydrophobicContact CD1-CG2 4.09Å; F311-I370 HydrophobicContact CE1-CG2 3.62Å; A314-I370 HydrophobicContact CB-CD1 3.66Å; A314-I370 HydrophobicContact CB-CG1 4.44Å; L366-I370 HydrophobicContact CD1-CD1 3.82Å; L366-I370 HydrophobicContact CD1-CG1 4.16Å; L366-I370 HydrophobicContact CD2-CD1 4.39Å; L366-I370 HydrophobicContact CG-CD1 3.75Å; L366-I370 HydrophobicContact CG-CG1 4.48Å; L366-I370 WeakPolarHBondContact O-CG1 3.2Å; L366-I370 PolarHBondContact O-N 3.37Å; V367-I370 PolarHBondContact O-N 2.79Å; R368-I370 VanDerWaalsContact C-N 3.28Å; R368-I370 PolarHBondContact O-N 2.63Å; I370-E372 VanDerWaalsContact C-N 3.31Å; I370-E372 PolarHBondContact O-N 3.32Å; I370-A373 WeakPolarHBondContact O-CB 3.44Å; I370-A373 PolarHBondContact O-N 2.93Å; I370-A373 VanDerWaalsContact O-N 3.11Å; I370-G374 PolarHBondContact O-N 3.31Å; I370-L443 HydrophobicContact CD1-CD2 4.21Å |
| 371 | S | 73 | Confident | 67.2 | Low | 53 Ų | 53 | 48.8 Ų | 48.8 | 37% | 0.371 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62 | -35.3 | -177.1 | 75.2 | 0 | 0 | 0 | 0 | 113.6 | V367 R368 | V367-S371 WeakPolarHBondContact O-CB 3.49Å; V367-S371 PolarHBondContact O-N 3.44Å; V367-S371 PolarHBondContact O-OG 2.97Å; R368-S371 WeakPolarHBondContact CA-OG 3.39Å; R368-S371 PolarHBondContact O-N 3.17Å; R368-S371 PolarHBondContact O-OG 3.32Å |
| 372 | E | 65.6 | Low | 65 | Low | 79 Ų | 79 | 50 Ų | 50 | 37% | 0.369 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -78.7 | -20.9 | 177.2 | -70.4 | -177.2 | 178.7 | 0 | 0 | 113.3 | Y200 R252 R368 I370 | Y200-E372 WeakPolarHBondContact CD2-OE1 3.5Å; Y200-E372 VanDerWaalsContact CE2-OE1 3.23Å; Y200-E372 WeakPolarHBondContact CE2-OE1 3.1Å; R252-E372 VanDerWaalsContact CZ-O 3.23Å; R252-E372 PolarHBondContact NH1-O 3.3Å; R252-E372 PolarHBondContact NH2-O 3.48Å; R368-E372 PolarHBondContact O-N 3.04Å; I370-E372 VanDerWaalsContact C-N 3.31Å; I370-E372 PolarHBondContact O-N 3.32Å |
| 373 | A | 57.5 | Low | 62.6 | Low | 14 Ų | 14 | 56.6 Ų | 56.6 | 12% | 0.116 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -78.5 | -49.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | N248 A369 I370 A375 | N248-A373 WeakPolarHBondContact OD1-CB 3.24Å; A369-A373 WeakPolarHBondContact O-CB 3.47Å; A369-A373 PolarHBondContact O-N 3.01Å; I370-A373 WeakPolarHBondContact O-CB 3.44Å; I370-A373 PolarHBondContact O-N 2.93Å; I370-A373 VanDerWaalsContact O-N 3.11Å; A373-A375 PolarHBondContact O-N 2.86Å |
| 374 | G | 52.9 | Low | 60.3 | Low | 24 Ų | 24 | 64 Ų | 64 | 25% | 0.247 | 41% | 0.411 | C | S | . | . | S | Bend | trans | -69.1 | 24.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | I370 R389 | I370-G374 PolarHBondContact O-N 3.31Å; G374-R389 PolarHBondContact O-NH2 3.07Å |
| 375 | A | 47.7 | Very low | 58.4 | Low | 36 Ų | 36 | 63.5 Ų | 63.5 | 30% | 0.298 | 42% | 0.415 | S | S | . | . | trans | -115.3 | 99.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | R252 A373 | R252-A375 PolarHBondContact NH2-O 2.93Å; A373-A375 PolarHBondContact O-N 2.86Å | ||
| 376 | P | 46.6 | Very low | 56.5 | Low | 92 Ų | 92 | 67.9 Ų | 67.9 | 60% | 0.597 | 44% | 0.435 | S | S | * | . | trans | -69.3 | 132.5 | 176.9 | 27.8 | -33.6 | 0 | 0 | 0 | 110.9 | G378 | P376-G378 PolarHBondContact O-N 3.44Š| ||
| 377 | P | 39.7 | Very low | 54.9 | Low | 85 Ų | 85 | 72 Ų | 72 | 55% | 0.552 | 46% | 0.462 | S | S | * | . | S | Bend | trans | -79.7 | 115.7 | 177.6 | 30.9 | -32.1 | 0 | 0 | 0 | 111.2 | V256 | V256-P377 HydrophobicContact CG2-CG 4.29Š|
| 378 | G | 44.1 | Very low | 53.7 | Low | 85 Ų | 85 | 75.1 Ų | 75.1 | 88% | 0.876 | 48% | 0.475 | S | S | * | . | S | Bend | trans | 112 | -14.8 | 164 | 0 | 0 | 0 | 0 | 0 | 116.9 | P376 | P376-G378 PolarHBondContact O-N 3.44Š|
| 379 | S | 41 | Very low | 52.8 | Low | 74 Ų | 74 | 75.1 Ų | 75.1 | 52% | 0.517 | 48% | 0.475 | S | S | . | . | trans | -81.8 | 120.7 | 176.1 | 55.9 | 0 | 0 | 0 | 0 | 111.8 | G381 | S379-G381 PolarHBondContact O-N 3.36Š| ||
| 380 | A | 43.4 | Very low | 52.1 | Low | 114 Ų | 114 | 81.2 Ų | 81.2 | 94% | 0.942 | 50% | 0.503 | S | S | * | . | S | Bend | trans | -72.9 | 70.2 | 170 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 381 | G | 46.8 | Very low | 51.6 | Low | 61 Ų | 61 | 86 Ų | 86 | 63% | 0.629 | 52% | 0.52 | S | S | * | . | trans | -153.7 | 61.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 115 | S379 | S379-G381 PolarHBondContact O-N 3.36Š| ||
| 382 | P | 45.5 | Very low | 51.5 | Low | 80 Ų | 80 | 84.1 Ų | 84.1 | 52% | 0.519 | 51% | 0.508 | S | S | . | . | trans | -88.5 | -19.8 | -179.3 | -3.5 | 24.6 | 0 | 0 | 0 | 113.9 | L384 L385 Q386 | P382-L384 PolarHBondContact O-N 2.98Å; P382-L385 PolarHBondContact O-N 3.16Å; P382-Q386 PolarHBondContact O-N 3.04Å | ||
| 383 | L | 40.7 | Very low | 51.9 | Low | 138 Ų | 138 | 83 Ų | 83 | 72% | 0.723 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.9 | -33.2 | -154.5 | -75.5 | 165.7 | 0 | 0 | 0 | 115.6 | P387 | L383-P387 VanDerWaalsContact O-CD 3.24Å; L383-P387 WeakPolarHBondContact O-CD 3.49Å |
| 384 | L | 41.4 | Very low | 52.8 | Low | 155 Ų | 155 | 84.2 Ų | 84.2 | 81% | 0.812 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.5 | -25.2 | -176.8 | -69.2 | 176.7 | 0 | 0 | 0 | 114.1 | P382 | P382-L384 PolarHBondContact O-N 2.98Š|
| 385 | L | 48.5 | Very low | 54 | Low | 93 Ų | 93 | 84.7 Ų | 84.7 | 49% | 0.487 | 53% | 0.525 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95 | -13.5 | 178.5 | -86.8 | 165.3 | 0 | 0 | 0 | 113.2 | P382 R389 | P382-L385 PolarHBondContact O-N 3.16Å; L385-R389 WeakPolarHBondContact O-CB 3.35Å; L385-R389 VanDerWaalsContact O-CG 3.27Å; L385-R389 WeakPolarHBondContact O-CG 3.07Å; L385-R389 PolarHBondContact O-N 3.46Å |
| 386 | Q | 48.7 | Very low | 55.6 | Low | 92 Ų | 92 | 83.8 Ų | 83.8 | 43% | 0.43 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66 | -46.3 | -176 | -169.2 | 165.3 | -19.5 | 0 | 0 | 113.2 | P382 Q388 R389 H390 | P382-Q386 PolarHBondContact O-N 3.04Å; Q386-Q388 PolarHBondContact O-N 3.12Å; Q386-R389 PolarHBondContact O-N 3.46Å; Q386-H390 WeakPolarHBondContact CG-NE2 3.2Å; Q386-H390 PolarHBondContact O-CD2 2.89Å; Q386-H390 PolarHBondContact O-N 2.66Å; Q386-H390 VanDerWaalsContact O-N 3.07Å |
| 387 | P | 51.6 | Low | 57.4 | Low | 87 Ų | 87 | 84.6 Ų | 84.6 | 57% | 0.565 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.2 | -41.6 | 176.4 | -22.3 | 33.7 | 0 | 0 | 0 | 112.8 | L383 R389 H390 R391 | L383-P387 VanDerWaalsContact O-CD 3.24Å; L383-P387 WeakPolarHBondContact O-CD 3.49Å; P387-R389 PolarHBondContact O-N 2.99Å; P387-H390 PolarHBondContact O-N 2.88Å; P387-R391 PolarHBondContact O-N 2.85Å; P387-R391 VanDerWaalsContact O-N 3.08Å |
| 388 | Q | 57.1 | Low | 59.6 | Low | 93 Ų | 93 | 80.7 Ų | 80.7 | 44% | 0.435 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.8 | -44.3 | 175.2 | -77.1 | -72.7 | -20.6 | 0 | 0 | 111.5 | Q386 R391 A392 | Q386-Q388 PolarHBondContact O-N 3.12Å; Q388-R391 PolarHBondContact O-N 3.4Å; Q388-A392 WeakPolarHBondContact O-CB 3.28Å; Q388-A392 PolarHBondContact O-N 3.47Å |
| 389 | R | 62.6 | Low | 61.7 | Low | 105 Ų | 105 | 76.7 Ų | 76.7 | 40% | 0.396 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -63.9 | -40.9 | 177.5 | -75.4 | 171.6 | -174.7 | -163.8 | -0.3 | 113.3 | G374 L385 Q386 P387 A393 | G374-R389 PolarHBondContact O-NH2 3.07Å; L385-R389 WeakPolarHBondContact O-CB 3.35Å; L385-R389 VanDerWaalsContact O-CG 3.27Å; L385-R389 WeakPolarHBondContact O-CG 3.07Å; L385-R389 PolarHBondContact O-N 3.46Å; Q386-R389 PolarHBondContact O-N 3.46Å; P387-R389 PolarHBondContact O-N 2.99Å; R389-A393 WeakPolarHBondContact O-CB 3.33Å; R389-A393 PolarHBondContact O-N 3.49Å |
| 390 | H | 64 | Low | 64 | Low | 129 Ų | 129 | 73.7 Ų | 73.7 | 60% | 0.597 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -64.8 | -42.7 | 176.5 | -70.1 | -64 | 0 | 0 | 0 | 111.6 | Q386 P387 A393 G394 | Q386-H390 WeakPolarHBondContact CG-NE2 3.2Å; Q386-H390 PolarHBondContact O-CD2 2.89Å; Q386-H390 PolarHBondContact O-N 2.66Å; Q386-H390 VanDerWaalsContact O-N 3.07Å; P387-H390 PolarHBondContact O-N 2.88Å; H390-A393 PolarHBondContact O-N 3.28Å; H390-G394 PolarHBondContact O-N 3.03Å |
| 391 | R | 66 | Low | 66.3 | Low | 117 Ų | 117 | 71 Ų | 71 | 44% | 0.442 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -66 | -45.4 | 176 | -163.8 | 173.5 | -163.2 | 170.6 | 5.6 | 112.5 | P387 Q388 A393 G394 C395 E514 | P387-R391 PolarHBondContact O-N 2.85Å; P387-R391 VanDerWaalsContact O-N 3.08Å; Q388-R391 PolarHBondContact O-N 3.4Å; R391-A393 VanDerWaalsContact C-N 3.32Å; R391-A393 PolarHBondContact O-N 3.15Å; R391-G394 PolarHBondContact O-N 3.04Å; R391-G394 VanDerWaalsContact O-N 3.1Å; R391-C395 PolarHBondContact O-N 3.43Å; R391-C395 VanDerWaalsContact O-N 3.1Å; R391-E514 IonicContact CZ-OE1 2.86Å; R391-E514 IonicContact CZ-OE2 2.68Å; R391-E514 IonicContact NH2-OE1 3.81Å; R391-E514 PolarHBondContact NH2-OE1 3.32Å; R391-E514 IonicContact NH2-OE2 2.72Å; R391-E514 PolarHBondContact NH2-OE2 3.42Å |
| 392 | A | 69.7 | Low | 68.4 | Low | 14 Ų | 14 | 68.2 Ų | 68.2 | 12% | 0.116 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -57.5 | -43 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q388 G394 C395 F396 L446 | Q388-A392 WeakPolarHBondContact O-CB 3.28Å; Q388-A392 PolarHBondContact O-N 3.47Å; A392-G394 VanDerWaalsContact C-N 3.27Å; A392-G394 PolarHBondContact O-N 3.1Å; A392-C395 PolarHBondContact O-N 2.98Å; A392-F396 HydrophobicContact CB-CD2 4.4Å; A392-F396 HydrophobicContact CB-CE2 4.2Å; A392-F396 WeakPolarHBondContact O-CD2 3.49Å; A392-F396 PolarHBondContact O-N 3.2Å; A392-L446 HydrophobicContact CB-CD1 4.02Å; A392-L446 HydrophobicContact CB-CD2 3.77Å; A392-L446 HydrophobicContact CB-CG 4.5Å |
| 393 | A | 74.6 | Confident | 70.6 | Confident | 56 Ų | 56 | 64.5 Ų | 64.5 | 46% | 0.463 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -60.7 | -36.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | R389 H390 R391 L397 | R389-A393 WeakPolarHBondContact O-CB 3.33Å; R389-A393 PolarHBondContact O-N 3.49Å; H390-A393 PolarHBondContact O-N 3.28Å; R391-A393 VanDerWaalsContact C-N 3.32Å; R391-A393 PolarHBondContact O-N 3.15Å; A393-L397 VanDerWaalsContact O-CB 3.3Å; A393-L397 WeakPolarHBondContact O-CB 3.32Å; A393-L397 PolarHBondContact O-N 3.45Å |
| 394 | G | 76.9 | Confident | 73 | Confident | 38 Ų | 38 | 60.8 Ų | 60.8 | 39% | 0.392 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -64.5 | -46 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | H390 R391 A392 L397 G398 | H390-G394 PolarHBondContact O-N 3.03Å; R391-G394 PolarHBondContact O-N 3.04Å; R391-G394 VanDerWaalsContact O-N 3.1Å; A392-G394 VanDerWaalsContact C-N 3.27Å; A392-G394 PolarHBondContact O-N 3.1Å; G394-L397 PolarHBondContact O-N 3.14Å; G394-G398 PolarHBondContact O-N 3.13Å |
| 395 | C | 77.1 | Confident | 75.4 | Confident | 35 Ų | 35 | 53.4 Ų | 53.4 | 24% | 0.236 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.3 | -45.1 | 175.8 | -63.8 | 0 | 0 | 0 | 0 | 112.2 | R391 A392 G398 T399 W442 | R391-C395 PolarHBondContact O-N 3.43Å; R391-C395 VanDerWaalsContact O-N 3.1Å; A392-C395 PolarHBondContact O-N 2.98Å; C395-G398 WeakPolarHBondContact O-CA 3.42Å; C395-G398 PolarHBondContact O-N 3.07Å; C395-T399 PolarHBondContact O-N 2.94Å; C395-W442 HydrophobicContact CB-CD2 3.98Å; C395-W442 HydrophobicContact CB-CE3 3.79Å; C395-W442 HydrophobicContact CB-CZ3 4.08Å; C395-W442 VanDerWaalsContact SG-CZ3 3.59Å |
| 396 | F | 81.5 | Confident | 77.5 | Confident | 17 Ų | 17 | 49.1 Ų | 49.1 | 8% | 0.075 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.9 | -41.5 | 177.1 | -71.9 | -54.3 | 0 | 0 | 0 | 112.6 | V367 A392 G398 T399 C400 W442 L443 L446 | V367-F396 HydrophobicContact CG1-CB 4.33Å; V367-F396 HydrophobicContact CG1-CD2 3.57Å; V367-F396 HydrophobicContact CG1-CE2 3.97Å; V367-F396 HydrophobicContact CG1-CG 3.94Å; V367-F396 HydrophobicContact CG2-CB 4.5Å; V367-F396 HydrophobicContact CG2-CD1 3.8Å; V367-F396 HydrophobicContact CG2-CD2 4.19Å; V367-F396 HydrophobicContact CG2-CE1 4Å; V367-F396 HydrophobicContact CG2-CE2 4.36Å; V367-F396 HydrophobicContact CG2-CG 3.92Å; V367-F396 HydrophobicContact CG2-CZ 4.28Å; A392-F396 HydrophobicContact CB-CD2 4.4Å; A392-F396 HydrophobicContact CB-CE2 4.2Å; A392-F396 WeakPolarHBondContact O-CD2 3.49Å; A392-F396 PolarHBondContact O-N 3.2Å; F396-G398 VanDerWaalsContact C-N 3.27Å; F396-G398 PolarHBondContact O-N 3.34Å; F396-T399 WeakPolarHBondContact CA-OG1 3.44Å; F396-T399 PolarHBondContact O-N 3.32Å; F396-T399 VanDerWaalsContact O-N 3.17Å; F396-T399 PolarHBondContact O-OG1 3.2Å; F396-C400 PolarHBondContact O-N 3.04Å; F396-C400 PolarHBondContact O-SG 3.47Å; F396-C400 VanDerWaalsContact O-SG 3.4Å; F396-W442 HydrophobicContact CE1-CB 4.05Å; F396-L443 HydrophobicContact CE1-CD2 4.09Å; F396-L443 HydrophobicContact CE1-CG 4Å; F396-L443 HydrophobicContact CZ-CD2 3.68Å; F396-L443 HydrophobicContact CZ-CG 4.02Å; F396-L446 HydrophobicContact CE2-CD1 3.59Å; F396-L446 HydrophobicContact CZ-CD1 3.56Å |
| 397 | L | 84.9 | Confident | 79.6 | Confident | 108 Ų | 108 | 45.8 Ų | 45.8 | 57% | 0.565 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -63.3 | -36.9 | 174.8 | -173.3 | 63.2 | 0 | 0 | 0 | 111.3 | A393 G394 C400 L401 | A393-L397 VanDerWaalsContact O-CB 3.3Å; A393-L397 WeakPolarHBondContact O-CB 3.32Å; A393-L397 PolarHBondContact O-N 3.45Å; G394-L397 PolarHBondContact O-N 3.14Å; L397-C400 PolarHBondContact O-N 2.98Å; L397-L401 WeakPolarHBondContact O-CG 3.45Å; L397-L401 PolarHBondContact O-N 3.07Å; L397-L401 VanDerWaalsContact O-N 3.11Å |
| 398 | G | 86.1 | Confident | 81.4 | Confident | 3 Ų | 3 | 43.5 Ų | 43.5 | 3% | 0.031 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -52.6 | -58 | 166.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | G394 C395 F396 C400 L401 D402 | G394-G398 PolarHBondContact O-N 3.13Å; C395-G398 WeakPolarHBondContact O-CA 3.42Å; C395-G398 PolarHBondContact O-N 3.07Å; F396-G398 VanDerWaalsContact C-N 3.27Å; F396-G398 PolarHBondContact O-N 3.34Å; G398-C400 VanDerWaalsContact C-N 3.26Å; G398-C400 PolarHBondContact O-N 3.08Å; G398-L401 CarbonylContact O-C 3.59Å; G398-L401 WeakPolarHBondContact O-CA 3.43Å; G398-L401 WeakPolarHBondContact O-CB 3.43Å; G398-L401 PolarHBondContact O-N 3.21Å; G398-D402 PolarHBondContact O-N 3.38Å; G398-D402 VanDerWaalsContact O-OD1 3.1Å |
| 399 | T | 87.5 | Confident | 83 | Confident | 2 Ų | 2 | 39.2 Ų | 39.2 | 1% | 0.012 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.4 | -30.5 | 179.6 | 55.4 | 0 | 0 | 0 | 0 | 114.2 | C395 F396 D402 L403 S438 | C395-T399 PolarHBondContact O-N 2.94Å; F396-T399 WeakPolarHBondContact CA-OG1 3.44Å; F396-T399 PolarHBondContact O-N 3.32Å; F396-T399 VanDerWaalsContact O-N 3.17Å; F396-T399 PolarHBondContact O-OG1 3.2Å; T399-D402 WeakPolarHBondContact CA-OD2 3.36Å; T399-D402 PolarHBondContact O-N 2.86Å; T399-L403 VanDerWaalsContact O-CB 3.24Å; T399-L403 WeakPolarHBondContact O-CB 3.32Å; T399-L403 PolarHBondContact O-N 2.93Å; T399-S438 WeakPolarHBondContact CG2-OG 3.3Å |
| 400 | C | 89.7 | Confident | 84.2 | Confident | 11 Ų | 11 | 34.3 Ų | 34.3 | 7% | 0.074 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -65.6 | -37.8 | 171.2 | -69.7 | 0 | 0 | 0 | 0 | 112.2 | V360 F396 L397 G398 L404 | V360-C400 HydrophobicContact CG1-CB 4.1Å; F396-C400 PolarHBondContact O-N 3.04Å; F396-C400 PolarHBondContact O-SG 3.47Å; F396-C400 VanDerWaalsContact O-SG 3.4Å; L397-C400 PolarHBondContact O-N 2.98Å; G398-C400 VanDerWaalsContact C-N 3.26Å; G398-C400 PolarHBondContact O-N 3.08Å; C400-L404 VanDerWaalsContact O-CG 3.3Å; C400-L404 WeakPolarHBondContact O-CG 3.24Å; C400-L404 PolarHBondContact O-N 3.33Å; C400-L404 VanDerWaalsContact O-N 3.1Å |
| 401 | L | 90.8 | Very high | 85.4 | Confident | 56 Ų | 56 | 30.6 Ų | 30.6 | 29% | 0.293 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -73.1 | -35.4 | 175.1 | -64.6 | 168.6 | 0 | 0 | 0 | 112.1 | L397 G398 L403 L404 D405 F500 K503 | L397-L401 WeakPolarHBondContact O-CG 3.45Å; L397-L401 PolarHBondContact O-N 3.07Å; L397-L401 VanDerWaalsContact O-N 3.11Å; G398-L401 CarbonylContact O-C 3.59Å; G398-L401 WeakPolarHBondContact O-CA 3.43Å; G398-L401 WeakPolarHBondContact O-CB 3.43Å; G398-L401 PolarHBondContact O-N 3.21Å; L401-L403 VanDerWaalsContact C-N 3.32Å; L401-L404 HydrophobicContact CD2-CD1 4.42Å; L401-L404 PolarHBondContact O-N 2.92Å; L401-D405 WeakPolarHBondContact O-CB 3.46Å; L401-D405 PolarHBondContact O-N 2.86Å; L401-F500 HydrophobicContact CD2-CE1 4.38Å; L401-K503 HydrophobicContact CB-CD 3.53Å; L401-K503 HydrophobicContact CD1-CD 3.88Å; L401-K503 HydrophobicContact CD1-CG 4.47Å; L401-K503 HydrophobicContact CG-CD 4.32Å |
| 402 | D | 90.9 | Very high | 86.3 | Confident | 4 Ų | 4 | 26.2 Ų | 26.2 | 2% | 0.021 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -64.2 | -38.9 | 174.8 | -51.9 | -21 | 0 | 0 | 0 | 111.3 | G398 T399 D405 S406 T435 V478 L482 K503 | G398-D402 PolarHBondContact O-N 3.38Å; G398-D402 VanDerWaalsContact O-OD1 3.1Å; T399-D402 WeakPolarHBondContact CA-OD2 3.36Å; T399-D402 PolarHBondContact O-N 2.86Å; D402-D405 PolarHBondContact O-N 2.93Å; D402-S406 PolarHBondContact O-N 3.45Å; D402-S406 PolarHBondContact O-OG 3.18Å; D402-T435 HydrophobicContact CB-CG2 4.14Å; D402-V478 HydrophobicContact CB-CG1 3.77Å; D402-L482 HydrophobicContact CB-CD1 3.96Å; D402-K503 WeakPolarHBondContact OD1-CE 3.39Å; D402-K503 IonicContact OD1-NZ 3.94Å; D402-K503 PolarHBondContact OD1-NZ 3.05Å |
| 403 | L | 92.1 | Very high | 87 | Confident | 1 Ų | 1 | 26.9 Ų | 26.9 | 1% | 0.005 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -72 | -31.4 | 176.9 | -168.7 | 57 | 0 | 0 | 0 | 112 | S359 V360 L363 T399 L401 S406 F407 Y432 L436 | S359-L403 WeakPolarHBondContact OG-CD2 3.2Å; V360-L403 HydrophobicContact CG2-CB 4.05Å; V360-L403 HydrophobicContact CG2-CD2 3.88Å; V360-L403 HydrophobicContact CG2-CG 3.75Å; L363-L403 HydrophobicContact CD2-CD2 4.49Å; T399-L403 VanDerWaalsContact O-CB 3.24Å; T399-L403 WeakPolarHBondContact O-CB 3.32Å; T399-L403 PolarHBondContact O-N 2.93Å; L401-L403 VanDerWaalsContact C-N 3.32Å; L403-S406 WeakPolarHBondContact CA-OG 3.05Å; L403-S406 PolarHBondContact O-OG 3.48Å; L403-F407 VanDerWaalsContact O-CB 3.27Å; L403-F407 WeakPolarHBondContact O-CB 3.46Å; L403-F407 PolarHBondContact O-N 2.95Å; L403-Y432 HydrophobicContact CD1-CD2 4.49Å; L403-Y432 HydrophobicContact CD1-CE2 3.97Å; L403-L436 HydrophobicContact CD1-CB 4.41Å; L403-L436 HydrophobicContact CD1-CD1 4.15Å |
| 404 | L | 92.2 | Very high | 87.3 | Confident | 61 Ų | 61 | 25.3 Ų | 25.3 | 32% | 0.319 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -71.5 | -41.9 | 168.8 | -73 | 167.3 | 0 | 0 | 0 | 112.5 | V360 C400 L401 F407 T408 F500 | V360-L404 HydrophobicContact CG1-CD1 4.41Å; V360-L404 HydrophobicContact CG1-CD2 4.47Å; V360-L404 HydrophobicContact CG1-CG 4.23Å; V360-L404 HydrophobicContact CG2-CD2 3.99Å; V360-L404 HydrophobicContact CG2-CG 3.99Å; C400-L404 VanDerWaalsContact O-CG 3.3Å; C400-L404 WeakPolarHBondContact O-CG 3.24Å; C400-L404 PolarHBondContact O-N 3.33Å; C400-L404 VanDerWaalsContact O-N 3.1Å; L401-L404 HydrophobicContact CD2-CD1 4.42Å; L401-L404 PolarHBondContact O-N 2.92Å; L404-F407 PolarHBondContact O-N 3.29Å; L404-T408 PolarHBondContact O-N 2.89Å; L404-T408 PolarHBondContact O-OG1 2.91Å; L404-F500 HydrophobicContact CB-CE1 4.04Å; L404-F500 HydrophobicContact CB-CZ 3.89Å |
| 405 | D | 92.1 | Very high | 87.4 | Confident | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -59 | -53.6 | 176.4 | -172.2 | 18 | 0 | 0 | 0 | 110.3 | L401 D402 F407 T408 L409 L482 R486 F500 N504 | L401-D405 WeakPolarHBondContact O-CB 3.46Å; L401-D405 PolarHBondContact O-N 2.86Å; D402-D405 PolarHBondContact O-N 2.93Å; D405-F407 PolarHBondContact O-N 2.89Å; D405-T408 PolarHBondContact O-N 3.41Å; D405-T408 VanDerWaalsContact O-N 3.16Å; D405-T408 PolarHBondContact O-OG1 3.03Å; D405-L409 WeakPolarHBondContact O-CG 3.39Å; D405-L409 PolarHBondContact O-N 3.33Å; D405-L482 HydrophobicContact CB-CD1 4.29Å; D405-L482 HydrophobicContact CB-CD2 4.45Å; D405-R486 IonicContact OD1-CZ 3.63Å; D405-R486 IonicContact OD1-NE 3.81Å; D405-R486 PolarHBondContact OD1-NE 3.38Å; D405-R486 IonicContact OD1-NH2 3.49Å; D405-R486 PolarHBondContact OD1-NH2 3.09Å; D405-F500 HydrophobicContact CB-CB 3.79Å; D405-F500 HydrophobicContact CB-CD1 3.81Å; D405-F500 HydrophobicContact CB-CD2 4.26Å; D405-F500 HydrophobicContact CB-CE1 4.45Å; D405-F500 HydrophobicContact CB-CG 3.71Å; D405-F500 VanDerWaalsContact OD1-CB 3.26Å; D405-F500 WeakPolarHBondContact OD1-CB 3.49Å; D405-N504 PolarHBondContact OD2-ND2 3.15Å |
| 406 | S | 91.8 | Very high | 87 | Confident | 2 Ų | 2 | 28 Ų | 28 | 1% | 0.014 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62 | -36.3 | 175.6 | 48.3 | 0 | 0 | 0 | 0 | 113.8 | D402 L403 L409 V410 T435 | D402-S406 PolarHBondContact O-N 3.45Å; D402-S406 PolarHBondContact O-OG 3.18Å; L403-S406 WeakPolarHBondContact CA-OG 3.05Å; L403-S406 PolarHBondContact O-OG 3.48Å; S406-L409 PolarHBondContact O-N 2.84Å; S406-V410 WeakPolarHBondContact O-CG2 3.42Å; S406-V410 PolarHBondContact O-N 2.9Å; S406-T435 PolarHBondContact OG-OG1 3.37Å |
| 407 | F | 91.6 | Very high | 86 | Confident | 22 Ų | 22 | 36.7 Ų | 36.7 | 10% | 0.096 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -58 | -49.2 | 170.8 | 169.9 | -99 | 0 | 0 | 0 | 111.7 | R353 M356 A357 L403 L404 D405 L409 V410 E411 | R353-F407 HydrophobicContact CB-CE2 4.3Å; R353-F407 HydrophobicContact CB-CZ 4.19Å; R353-F407 VanDerWaalsContact O-CE2 3.24Å; R353-F407 WeakPolarHBondContact O-CE2 3.44Å; M356-F407 HydrophobicContact CB-CD2 3.81Å; M356-F407 HydrophobicContact CB-CE2 4.06Å; M356-F407 HydrophobicContact CE-CE2 4.33Å; A357-F407 HydrophobicContact CB-CD2 4.4Å; A357-F407 HydrophobicContact CB-CE2 4.11Å; A357-F407 HydrophobicContact CB-CZ 4.21Å; L403-F407 VanDerWaalsContact O-CB 3.27Å; L403-F407 WeakPolarHBondContact O-CB 3.46Å; L403-F407 PolarHBondContact O-N 2.95Å; L404-F407 PolarHBondContact O-N 3.29Å; D405-F407 PolarHBondContact O-N 2.89Å; F407-L409 VanDerWaalsContact C-N 3.28Å; F407-L409 PolarHBondContact O-N 2.87Å; F407-V410 PolarHBondContact O-N 3.42Å; F407-V410 VanDerWaalsContact O-N 3.15Å; F407-E411 HydrophobicContact CE1-CB 4.47Å; F407-E411 WeakPolarHBondContact CE1-OE2 3.24Å; F407-E411 HydrophobicContact CZ-CB 4.43Å; F407-E411 WeakPolarHBondContact O-CB 3.39Å; F407-E411 PolarHBondContact O-N 3.12Å |
| 408 | T | 90.6 | Very high | 84.9 | Confident | 40 Ų | 40 | 32.5 Ų | 32.5 | 25% | 0.245 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -68.4 | -25 | 179.8 | 62 | 0 | 0 | 0 | 0 | 113.6 | L404 D405 L412 R486 F500 | L404-T408 PolarHBondContact O-N 2.89Å; L404-T408 PolarHBondContact O-OG1 2.91Å; D405-T408 PolarHBondContact O-N 3.41Å; D405-T408 VanDerWaalsContact O-N 3.16Å; D405-T408 PolarHBondContact O-OG1 3.03Å; T408-L412 WeakPolarHBondContact O-CB 3.49Å; T408-L412 PolarHBondContact O-N 2.87Å; T408-L412 VanDerWaalsContact O-N 3.09Å; T408-R486 PolarHBondContact OG1-NH2 3.43Å; T408-F500 HydrophobicContact CG2-CE2 4.45Å |
| 409 | L | 89.4 | Confident | 84.2 | Confident | 3 Ų | 3 | 37.6 Ų | 37.6 | 2% | 0.016 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -68.7 | -42.8 | 170 | -72.1 | 175.4 | 0 | 0 | 0 | 111.9 | D405 S406 F407 M413 L428 L482 L485 R486 L489 | D405-L409 WeakPolarHBondContact O-CG 3.39Å; D405-L409 PolarHBondContact O-N 3.33Å; S406-L409 PolarHBondContact O-N 2.84Å; F407-L409 VanDerWaalsContact C-N 3.28Å; F407-L409 PolarHBondContact O-N 2.87Å; L409-M413 PolarHBondContact O-N 3.46Å; L409-L428 HydrophobicContact CB-CD2 4.05Å; L409-L428 HydrophobicContact CD1-CD2 4.26Å; L409-L428 HydrophobicContact CD2-CD2 4.45Å; L409-L482 HydrophobicContact CD1-CD2 3.8Å; L409-L485 HydrophobicContact CD1-CB 4.41Å; L409-L485 HydrophobicContact CD1-CD1 4.44Å; L409-R486 HydrophobicContact CD2-CG 4.42Å; L409-L489 HydrophobicContact CD2-CD1 3.41Å; L409-L489 VanDerWaalsContact CD2-CD1 3.41Å |
| 410 | V | 89.1 | Confident | 83.7 | Confident | 1 Ų | 1 | 37.7 Ų | 37.7 | 1% | 0.006 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -68.7 | -37.9 | 175.3 | 173.5 | 0 | 0 | 0 | 0 | 110.6 | L333 M356 S406 F407 L412 M413 L414 Y432 | L333-V410 HydrophobicContact CD2-CG1 4.39Å; M356-V410 HydrophobicContact CE-CG1 3.63Å; M356-V410 HydrophobicContact SD-CG1 3.82Å; S406-V410 WeakPolarHBondContact O-CG2 3.42Å; S406-V410 PolarHBondContact O-N 2.9Å; F407-V410 PolarHBondContact O-N 3.42Å; F407-V410 VanDerWaalsContact O-N 3.15Å; V410-L412 PolarHBondContact O-N 3.15Å; V410-M413 HydrophobicContact CG1-CE 4.38Å; V410-M413 WeakPolarHBondContact O-CB 3.37Å; V410-M413 PolarHBondContact O-N 2.9Å; V410-M413 VanDerWaalsContact O-N 3.16Å; V410-L414 HydrophobicContact CG1-CD1 3.61Å; V410-L414 WeakPolarHBondContact O-CD1 3.4Å; V410-L414 PolarHBondContact O-N 3.37Å; V410-Y432 HydrophobicContact CG2-CD2 4.4Å; V410-Y432 HydrophobicContact CG2-CG 4.11Å |
| 411 | E | 88.6 | Confident | 83.5 | Confident | 51 Ų | 51 | 39.3 Ų | 39.3 | 24% | 0.238 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -60 | -43.8 | 174.2 | -175.2 | 165.5 | -139.7 | 0 | 0 | 112.6 | R353 F407 M413 L414 E415 | R353-E411 WeakPolarHBondContact CD-OE1 3.26Å; R353-E411 IonicContact CZ-OE1 3.51Å; R353-E411 IonicContact NE-OE1 2.69Å; R353-E411 VanDerWaalsContact NH1-CG 3.3Å; R353-E411 IonicContact NH1-OE1 3.55Å; R353-E411 PolarHBondContact NH1-OE1 2.98Å; F407-E411 HydrophobicContact CE1-CB 4.47Å; F407-E411 WeakPolarHBondContact CE1-OE2 3.24Å; F407-E411 HydrophobicContact CZ-CB 4.43Å; F407-E411 WeakPolarHBondContact O-CB 3.39Å; F407-E411 PolarHBondContact O-N 3.12Å; E411-M413 VanDerWaalsContact C-N 3.26Å; E411-M413 PolarHBondContact O-N 2.78Å; E411-L414 WeakPolarHBondContact O-CB 3.39Å; E411-L414 PolarHBondContact O-N 3.43Å; E411-E415 PolarHBondContact O-N 3.37Å |
| 412 | L | 85.4 | Confident | 83.2 | Confident | 26 Ų | 26 | 39.5 Ų | 39.5 | 14% | 0.136 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -58.6 | -38.3 | 174.5 | -171.6 | 159.6 | 0 | 0 | 0 | 111.8 | T408 V410 E415 V418 L420 Q495 | T408-L412 WeakPolarHBondContact O-CB 3.49Å; T408-L412 PolarHBondContact O-N 2.87Å; T408-L412 VanDerWaalsContact O-N 3.09Å; V410-L412 PolarHBondContact O-N 3.15Å; L412-E415 PolarHBondContact O-N 3.22Å; L412-V418 HydrophobicContact CD2-CG2 4.44Å; L412-L420 HydrophobicContact CD2-CD1 4.12Å; L412-Q495 HydrophobicContact CD1-CG 4.32Å |
| 413 | M | 84.1 | Confident | 83.1 | Confident | 27 Ų | 27 | 46.1 Ų | 46.1 | 13% | 0.133 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -69.5 | -36.2 | 174.1 | -177.3 | -177.5 | 73.8 | 0 | 0 | 112.6 | L333 L409 V410 E411 E415 L420 R425 L428 I429 | L333-M413 HydrophobicContact CD1-CE 3.98Å; L333-M413 HydrophobicContact CD2-CE 3.71Å; L333-M413 HydrophobicContact CG-CE 3.97Å; L409-M413 PolarHBondContact O-N 3.46Å; V410-M413 HydrophobicContact CG1-CE 4.38Å; V410-M413 WeakPolarHBondContact O-CB 3.37Å; V410-M413 PolarHBondContact O-N 2.9Å; V410-M413 VanDerWaalsContact O-N 3.16Å; E411-M413 VanDerWaalsContact C-N 3.26Å; E411-M413 PolarHBondContact O-N 2.78Å; M413-E415 VanDerWaalsContact C-N 3.32Å; M413-L420 HydrophobicContact CB-CD2 4.48Å; M413-L420 HydrophobicContact CG-CD2 4.5Å; M413-R425 HydrophobicContact CG-CG 4.24Å; M413-R425 HydrophobicContact SD-CB 3.59Å; M413-R425 VanDerWaalsContact SD-CB 3.59Å; M413-R425 HydrophobicContact SD-CG 3.68Å; M413-L428 HydrophobicContact CB-CD1 4.04Å; M413-L428 HydrophobicContact SD-CD1 4.2Å; M413-I429 HydrophobicContact CE-CD1 4.11Å; M413-I429 HydrophobicContact CE-CG1 4.02Å |
| 414 | L | 81.3 | Confident | 82.9 | Confident | 24 Ų | 24 | 46.2 Ų | 46.2 | 13% | 0.126 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -70.1 | -24.6 | 175 | -93.6 | 83.8 | 0 | 0 | 0 | 113.7 | L333 L338 F352 R353 M356 V410 E411 G416 | L333-L414 HydrophobicContact CD1-CD1 3.71Å; L333-L414 HydrophobicContact CD1-CG 4.38Å; L338-L414 HydrophobicContact CD2-CD2 3.79Å; L338-L414 HydrophobicContact CD2-CG 3.73Å; F352-L414 HydrophobicContact CD1-CD2 3.62Å; F352-L414 HydrophobicContact CE1-CD1 4.29Å; F352-L414 HydrophobicContact CE1-CD2 3.85Å; R353-L414 HydrophobicContact CG-CD2 4.21Å; M356-L414 HydrophobicContact CE-CD1 4.4Å; V410-L414 HydrophobicContact CG1-CD1 3.61Å; V410-L414 WeakPolarHBondContact O-CD1 3.4Å; V410-L414 PolarHBondContact O-N 3.37Å; E411-L414 WeakPolarHBondContact O-CB 3.39Å; E411-L414 PolarHBondContact O-N 3.43Å; L414-G416 VanDerWaalsContact C-N 3.27Å; L414-G416 PolarHBondContact O-N 3.08Å |
| 415 | E | 78.6 | Confident | 82.6 | Confident | 72 Ų | 72 | 49.1 Ų | 49.1 | 34% | 0.336 | 26% | 0.261 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.4 | -9.9 | 179.8 | -77.8 | -170.8 | 169.5 | 0 | 0 | 114.2 | R353 E411 L412 M413 R417 | R353-E415 IonicContact CZ-OE1 2.65Å; R353-E415 IonicContact NH1-OE1 3.24Å; R353-E415 PolarHBondContact NH1-OE1 3.18Å; R353-E415 IonicContact NH2-OE1 3.84Å; E411-E415 PolarHBondContact O-N 3.37Å; L412-E415 PolarHBondContact O-N 3.22Å; M413-E415 VanDerWaalsContact C-N 3.32Å; E415-R417 HydrophobicContact CB-CG 4.23Å; E415-R417 PolarHBondContact O-N 2.91Å; E415-R417 IonicContact OE1-NH1 2.66Å; E415-R417 IonicContact OE2-CZ 2.73Å; E415-R417 IonicContact OE2-NE 3.15Å; E415-R417 IonicContact OE2-NH1 2.75Å; E415-R417 PolarHBondContact OE2-NH1 2.93Å |
| 416 | G | 68 | Low | 82.5 | Confident | 57 Ų | 57 | 56.6 Ų | 56.6 | 59% | 0.588 | 29% | 0.29 | S | S | * | . | trans | 64.3 | -7.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | L414 V418 | L414-G416 VanDerWaalsContact C-N 3.27Å; L414-G416 PolarHBondContact O-N 3.08Å; G416-V418 PolarHBondContact O-N 3.31Å | ||
| 417 | R | 60.6 | Low | 82.4 | Confident | 199 Ų | 199 | 60.6 Ų | 60.6 | 75% | 0.751 | 31% | 0.311 | S | S | * | . | S | Bend | trans | -58.3 | -16.8 | -176.2 | -74.5 | 175.5 | 170.3 | 158.1 | -6 | 114.5 | E415 | E415-R417 HydrophobicContact CB-CG 4.23Å; E415-R417 PolarHBondContact O-N 2.91Å; E415-R417 IonicContact OE1-NH1 2.66Å; E415-R417 IonicContact OE2-CZ 2.73Å; E415-R417 IonicContact OE2-NE 3.15Å; E415-R417 IonicContact OE2-NH1 2.75Å; E415-R417 PolarHBondContact OE2-NH1 2.93Å |
| 418 | V | 63.3 | Low | 82.4 | Confident | 20 Ų | 20 | 59.8 Ų | 59.8 | 12% | 0.121 | 31% | 0.307 | C | S | . | . | S | Bend | trans | -130.7 | 128 | 172.3 | -177.3 | 0 | 0 | 0 | 0 | 108.1 | L412 G416 L420 Y493 | L412-V418 HydrophobicContact CD2-CG2 4.44Å; G416-V418 PolarHBondContact O-N 3.31Å; V418-L420 VanDerWaalsContact C-N 3.27Å; V418-L420 HydrophobicContact CB-CD1 3.68Å; V418-L420 HydrophobicContact CG1-CD1 3.76Å; V418-L420 VanDerWaalsContact O-CD1 3.25Å; V418-L420 WeakPolarHBondContact O-CD1 3.3Å; V418-L420 PolarHBondContact O-N 3.11Å; V418-Y493 HydrophobicContact CG1-CD1 3.26Å; V418-Y493 HydrophobicContact CG1-CE1 3.8Å; V418-Y493 HydrophobicContact CG1-CG 3.83Å |
| 419 | P | 69.9 | Low | 82.4 | Confident | 111 Ų | 111 | 58.9 Ų | 58.9 | 72% | 0.721 | 30% | 0.301 | S | S | * | . | trans | -75.9 | 76.7 | 176.7 | 31.1 | -34.7 | 0 | 0 | 0 | 110.9 | ||||
| 420 | L | 78.1 | Confident | 82.5 | Confident | 4 Ų | 4 | 61.4 Ų | 61.4 | 2% | 0.021 | 32% | 0.322 | C | S | . | . | trans | -62.2 | 130.9 | 177.5 | -83.3 | 76 | 0 | 0 | 0 | 110.8 | L412 M413 V418 L424 R425 L428 | L412-L420 HydrophobicContact CD2-CD1 4.12Å; M413-L420 HydrophobicContact CB-CD2 4.48Å; M413-L420 HydrophobicContact CG-CD2 4.5Å; V418-L420 VanDerWaalsContact C-N 3.27Å; V418-L420 HydrophobicContact CB-CD1 3.68Å; V418-L420 HydrophobicContact CG1-CD1 3.76Å; V418-L420 VanDerWaalsContact O-CD1 3.25Å; V418-L420 WeakPolarHBondContact O-CD1 3.3Å; V418-L420 PolarHBondContact O-N 3.11Å; L420-L424 HydrophobicContact CD2-CD2 3.99Å; L420-L424 HydrophobicContact CD2-CG 4.05Å; L420-L424 HydrophobicContact CG-CD2 4Å; L420-L424 HydrophobicContact CG-CG 4.49Å; L420-R425 HydrophobicContact CB-CG 4Å; L420-R425 PolarHBondContact O-NE 3.42Å; L420-R425 PolarHBondContact O-NH2 2.67Å; L420-L428 HydrophobicContact CD2-CD1 3.49Å; L420-L428 VanDerWaalsContact CD2-CD1 3.49Å; L420-L428 HydrophobicContact CD2-CG 4.44Å | ||
| 421 | P | 85.1 | Confident | 82.7 | Confident | 45 Ų | 45 | 61.7 Ų | 61.7 | 29% | 0.292 | 32% | 0.324 | S | S | . | . | trans | -59.2 | 150.8 | 169.3 | -25.4 | 34.9 | 0 | 0 | 0 | 112.7 | H423 L424 R425 Y493 | P421-H423 VanDerWaalsContact C-N 3.31Å; P421-H423 WeakPolarHBondContact CB-CE1 3.46Å; P421-H423 PolarHBondContact O-N 3.37Å; P421-L424 WeakPolarHBondContact O-CB 3.38Å; P421-L424 PolarHBondContact O-N 3.26Å; P421-R425 PolarHBondContact O-N 3.05Å; P421-R425 VanDerWaalsContact O-N 3.13Å; P421-Y493 WeakPolarHBondContact CD-OH 3.4Å | ||
| 422 | A | 85.1 | Confident | 82.8 | Confident | 60 Ų | 60 | 59.4 Ų | 59.4 | 50% | 0.496 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -54.5 | -42.6 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | L424 R425 Y426 | A422-L424 VanDerWaalsContact C-N 3.27Å; A422-L424 PolarHBondContact O-N 3.16Å; A422-R425 WeakPolarHBondContact O-CB 3.47Å; A422-R425 PolarHBondContact O-N 2.84Å; A422-Y426 HydrophobicContact CB-CE2 4.28Å; A422-Y426 WeakPolarHBondContact O-CD2 3.33Å; A422-Y426 PolarHBondContact O-N 2.88Å |
| 423 | H | 87.9 | Confident | 83.2 | Confident | 142 Ų | 142 | 59.4 Ų | 59.4 | 66% | 0.657 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -59.5 | -36.5 | 177.3 | 61 | -107.7 | 0 | 0 | 0 | 112.7 | P421 L427 | P421-H423 VanDerWaalsContact C-N 3.31Å; P421-H423 WeakPolarHBondContact CB-CE1 3.46Å; P421-H423 PolarHBondContact O-N 3.37Å; H423-L427 WeakPolarHBondContact O-CB 3.41Å; H423-L427 PolarHBondContact O-N 3.27Å |
| 424 | L | 87.8 | Confident | 83.5 | Confident | 4 Ų | 4 | 60.7 Ų | 60.7 | 2% | 0.021 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -74.7 | -35.7 | 179.8 | -171 | 60.4 | 0 | 0 | 0 | 110.8 | L420 P421 A422 L427 L428 L485 L488 Y493 | L420-L424 HydrophobicContact CD2-CD2 3.99Å; L420-L424 HydrophobicContact CD2-CG 4.05Å; L420-L424 HydrophobicContact CG-CD2 4Å; L420-L424 HydrophobicContact CG-CG 4.49Å; P421-L424 WeakPolarHBondContact O-CB 3.38Å; P421-L424 PolarHBondContact O-N 3.26Å; A422-L424 VanDerWaalsContact C-N 3.27Å; A422-L424 PolarHBondContact O-N 3.16Å; L424-L427 HydrophobicContact CD1-CD2 4.42Å; L424-L427 PolarHBondContact O-N 3.19Å; L424-L428 WeakPolarHBondContact O-CG 3.46Å; L424-L428 PolarHBondContact O-N 3.44Å; L424-L485 HydrophobicContact CD1-CD2 3.73Å; L424-L488 HydrophobicContact CD1-CD1 4.29Å; L424-L488 HydrophobicContact CD1-CD2 4.15Å; L424-L488 HydrophobicContact CD2-CD2 3.91Å; L424-Y493 HydrophobicContact CD2-CE2 3.8Å |
| 425 | R | 87 | Confident | 84 | Confident | 121 Ų | 121 | 59.6 Ų | 59.6 | 46% | 0.457 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -60 | -50.2 | 171.6 | -58.3 | -176 | -163.6 | -161.2 | 0 | 111.2 | M413 L420 P421 A422 L427 L428 I429 | M413-R425 HydrophobicContact CG-CG 4.24Å; M413-R425 HydrophobicContact SD-CB 3.59Å; M413-R425 VanDerWaalsContact SD-CB 3.59Å; M413-R425 HydrophobicContact SD-CG 3.68Å; L420-R425 HydrophobicContact CB-CG 4Å; L420-R425 PolarHBondContact O-NE 3.42Å; L420-R425 PolarHBondContact O-NH2 2.67Å; P421-R425 PolarHBondContact O-N 3.05Å; P421-R425 VanDerWaalsContact O-N 3.13Å; A422-R425 WeakPolarHBondContact O-CB 3.47Å; A422-R425 PolarHBondContact O-N 2.84Å; R425-L427 VanDerWaalsContact C-N 3.28Å; R425-L427 PolarHBondContact O-N 2.79Å; R425-L428 PolarHBondContact O-N 3.4Å; R425-I429 WeakPolarHBondContact O-CB 3.24Å; R425-I429 WeakPolarHBondContact O-CD1 3.33Å; R425-I429 WeakPolarHBondContact O-CG1 3.27Å; R425-I429 PolarHBondContact O-N 2.97Å |
| 426 | Y | 88.7 | Confident | 84.7 | Confident | 157 Ų | 157 | 56.2 Ų | 56.2 | 62% | 0.616 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -61.5 | -35.7 | 176.5 | -66.4 | -57.7 | 0 | 0 | 0 | 112.5 | A422 I429 A430 | A422-Y426 HydrophobicContact CB-CE2 4.28Å; A422-Y426 WeakPolarHBondContact O-CD2 3.33Å; A422-Y426 PolarHBondContact O-N 2.88Å; Y426-I429 PolarHBondContact O-N 2.93Å; Y426-A430 VanDerWaalsContact O-CB 3.31Å; Y426-A430 WeakPolarHBondContact O-CB 3.38Å; Y426-A430 PolarHBondContact O-N 3.35Å |
| 427 | L | 90.7 | Very high | 85.8 | Confident | 86 Ų | 86 | 55.1 Ų | 55.1 | 45% | 0.45 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -68 | -41.9 | 175.7 | -172.7 | 62.5 | 0 | 0 | 0 | 112.7 | H423 L424 R425 I429 A430 V431 L485 | H423-L427 WeakPolarHBondContact O-CB 3.41Å; H423-L427 PolarHBondContact O-N 3.27Å; L424-L427 HydrophobicContact CD1-CD2 4.42Å; L424-L427 PolarHBondContact O-N 3.19Å; R425-L427 VanDerWaalsContact C-N 3.28Å; R425-L427 PolarHBondContact O-N 2.79Å; L427-I429 VanDerWaalsContact C-N 3.35Å; L427-A430 PolarHBondContact O-N 2.93Å; L427-V431 WeakPolarHBondContact O-CG2 3.43Å; L427-V431 PolarHBondContact O-N 3.17Å; L427-L485 HydrophobicContact CD2-CD2 3.72Å; L427-L485 HydrophobicContact CD2-CG 4.49Å; L427-L485 HydrophobicContact CG-CD2 3.95Å |
| 428 | L | 90.7 | Very high | 87.1 | Confident | 5 Ų | 5 | 45.9 Ų | 45.9 | 3% | 0.026 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -59 | -47 | 172.6 | -71.6 | -173 | 0 | 0 | 0 | 111.5 | L409 M413 L420 L424 R425 V431 Y432 L485 | L409-L428 HydrophobicContact CB-CD2 4.05Å; L409-L428 HydrophobicContact CD1-CD2 4.26Å; L409-L428 HydrophobicContact CD2-CD2 4.45Å; M413-L428 HydrophobicContact CB-CD1 4.04Å; M413-L428 HydrophobicContact SD-CD1 4.2Å; L420-L428 HydrophobicContact CD2-CD1 3.49Å; L420-L428 VanDerWaalsContact CD2-CD1 3.49Å; L420-L428 HydrophobicContact CD2-CG 4.44Å; L424-L428 WeakPolarHBondContact O-CG 3.46Å; L424-L428 PolarHBondContact O-N 3.44Å; R425-L428 PolarHBondContact O-N 3.4Å; L428-V431 PolarHBondContact O-N 2.96Å; L428-Y432 PolarHBondContact O-N 2.95Å; L428-L485 HydrophobicContact CD2-CB 4.47Å; L428-L485 HydrophobicContact CD2-CD1 3.77Å; L428-L485 HydrophobicContact CD2-CD2 3.73Å; L428-L485 HydrophobicContact CD2-CG 4.2Å |
| 429 | I | 90.3 | Very high | 88.2 | Confident | 22 Ų | 22 | 44.9 Ų | 44.9 | 11% | 0.113 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.2 | -44.8 | 179.2 | -68.5 | 168.2 | 0 | 0 | 0 | 110.6 | V330 L333 M413 R425 Y426 L427 V431 Y432 F433 | V330-I429 HydrophobicContact CG2-CG2 4.37Å; L333-I429 HydrophobicContact CD2-CD1 3.87Å; L333-I429 HydrophobicContact CD2-CG1 3.86Å; L333-I429 HydrophobicContact CG-CD1 4.21Å; M413-I429 HydrophobicContact CE-CD1 4.11Å; M413-I429 HydrophobicContact CE-CG1 4.02Å; R425-I429 WeakPolarHBondContact O-CB 3.24Å; R425-I429 WeakPolarHBondContact O-CD1 3.33Å; R425-I429 WeakPolarHBondContact O-CG1 3.27Å; R425-I429 PolarHBondContact O-N 2.97Å; Y426-I429 PolarHBondContact O-N 2.93Å; L427-I429 VanDerWaalsContact C-N 3.35Å; I429-V431 PolarHBondContact O-N 3.24Å; I429-Y432 PolarHBondContact O-N 3.1Å; I429-F433 HydrophobicContact CG2-CD2 3.9Å; I429-F433 HydrophobicContact CG2-CE2 3.35Å; I429-F433 HydrophobicContact CG2-CZ 4.27Å; I429-F433 WeakPolarHBondContact O-CD2 3.18Å; I429-F433 PolarHBondContact O-N 3.45Å; I429-F433 VanDerWaalsContact O-N 3.08Å |
| 430 | A | 92.1 | Very high | 89.1 | Confident | 55 Ų | 55 | 40.4 Ų | 40.4 | 46% | 0.455 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -62.1 | -42.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y426 L427 F433 L434 | Y426-A430 VanDerWaalsContact O-CB 3.31Å; Y426-A430 WeakPolarHBondContact O-CB 3.38Å; Y426-A430 PolarHBondContact O-N 3.35Å; L427-A430 PolarHBondContact O-N 2.93Å; A430-F433 PolarHBondContact O-N 3.39Å; A430-L434 WeakPolarHBondContact O-CB 3.17Å; A430-L434 PolarHBondContact O-N 3.11Å |
| 431 | V | 92.6 | Very high | 89.3 | Confident | 8 Ų | 8 | 44.1 Ų | 44.1 | 5% | 0.048 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -69.9 | -33.2 | 177.6 | 174.1 | 0 | 0 | 0 | 0 | 111.9 | L427 L428 I429 L434 T435 P481 L482 L485 | L427-V431 WeakPolarHBondContact O-CG2 3.43Å; L427-V431 PolarHBondContact O-N 3.17Å; L428-V431 PolarHBondContact O-N 2.96Å; I429-V431 PolarHBondContact O-N 3.24Å; V431-L434 WeakPolarHBondContact O-CB 3.3Å; V431-L434 PolarHBondContact O-N 2.85Å; V431-T435 WeakPolarHBondContact O-CG2 3.44Å; V431-T435 PolarHBondContact O-N 2.61Å; V431-T435 PolarHBondContact O-OG1 2.72Å; V431-P481 HydrophobicContact CG1-CB 4.17Å; V431-P481 HydrophobicContact CG2-CB 3.58Å; V431-L482 HydrophobicContact CG1-CD2 3.62Å; V431-L482 HydrophobicContact CG1-CG 3.94Å; V431-L485 HydrophobicContact CB-CD1 3.81Å; V431-L485 HydrophobicContact CG1-CD1 4.01Å; V431-L485 HydrophobicContact CG2-CD1 3.67Å |
| 432 | Y | 92.4 | Very high | 88.9 | Confident | 2 Ų | 2 | 43.1 Ų | 43.1 | 1% | 0.008 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64.5 | -37.9 | 171.6 | 174.5 | -105.5 | 0 | 0 | 0 | 112.9 | F325 V329 M356 L403 V410 L428 I429 T435 L436 | F325-Y432 AromaticContact CE1-CE1 3.97Å; F325-Y432 HydrophobicContact CE1-CE1 3.97Å; F325-Y432 WeakPolarHBondContact CE1-OH 3.38Å; V329-Y432 HydrophobicContact CG1-CE1 4.47Å; M356-Y432 HydrophobicContact SD-CE1 4.34Å; L403-Y432 HydrophobicContact CD1-CD2 4.49Å; L403-Y432 HydrophobicContact CD1-CE2 3.97Å; V410-Y432 HydrophobicContact CG2-CD2 4.4Å; V410-Y432 HydrophobicContact CG2-CG 4.11Å; L428-Y432 PolarHBondContact O-N 2.95Å; I429-Y432 PolarHBondContact O-N 3.1Å; Y432-T435 PolarHBondContact O-OG1 3.26Å; Y432-L436 WeakPolarHBondContact O-CB 3.25Å; Y432-L436 PolarHBondContact O-N 2.86Å |
| 433 | F | 91.9 | Very high | 88.6 | Confident | 26 Ų | 26 | 40.5 Ų | 40.5 | 11% | 0.114 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -75.1 | -26.6 | 172.8 | -61.4 | -51.6 | 0 | 0 | 0 | 113 | F325 T326 V329 V330 I429 A430 L436 A437 | F325-F433 HydrophobicContact CD1-CE1 4.45Å; T326-F433 HydrophobicContact CG2-CD1 4.01Å; T326-F433 HydrophobicContact CG2-CD2 3.8Å; T326-F433 HydrophobicContact CG2-CE1 4.08Å; T326-F433 HydrophobicContact CG2-CE2 3.83Å; T326-F433 HydrophobicContact CG2-CG 3.89Å; T326-F433 HydrophobicContact CG2-CZ 3.98Å; T326-F433 WeakPolarHBondContact OG1-CD1 3.4Å; V329-F433 HydrophobicContact CB-CE1 4.12Å; V329-F433 HydrophobicContact CB-CZ 3.87Å; V329-F433 HydrophobicContact CG1-CE1 4.14Å; V329-F433 HydrophobicContact CG1-CZ 3.75Å; V330-F433 HydrophobicContact CG2-CD2 4.48Å; V330-F433 HydrophobicContact CG2-CE2 3.42Å; V330-F433 VanDerWaalsContact CG2-CE2 3.42Å; V330-F433 HydrophobicContact CG2-CZ 3.81Å; I429-F433 HydrophobicContact CG2-CD2 3.9Å; I429-F433 HydrophobicContact CG2-CE2 3.35Å; I429-F433 HydrophobicContact CG2-CZ 4.27Å; I429-F433 WeakPolarHBondContact O-CD2 3.18Å; I429-F433 PolarHBondContact O-N 3.45Å; I429-F433 VanDerWaalsContact O-N 3.08Å; A430-F433 PolarHBondContact O-N 3.39Å; F433-L436 HydrophobicContact CD1-CD2 4.18Å; F433-L436 PolarHBondContact O-N 3.07Å; F433-A437 VanDerWaalsContact O-CB 3.27Å; F433-A437 WeakPolarHBondContact O-CB 3.32Å; F433-A437 PolarHBondContact O-N 3.49Å |
| 434 | L | 91.8 | Very high | 88.2 | Confident | 55 Ų | 55 | 39.5 Ų | 39.5 | 29% | 0.288 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -68.3 | -41.3 | 172.3 | -166.7 | 59.4 | 0 | 0 | 0 | 112 | A430 V431 A437 S438 L477 P481 | A430-L434 WeakPolarHBondContact O-CB 3.17Å; A430-L434 PolarHBondContact O-N 3.11Å; V431-L434 WeakPolarHBondContact O-CB 3.3Å; V431-L434 PolarHBondContact O-N 2.85Å; L434-A437 PolarHBondContact O-N 3.37Å; L434-S438 PolarHBondContact O-N 3.39Å; L434-L477 HydrophobicContact CD1-CD1 4.27Å; L434-L477 HydrophobicContact CD1-CD2 4.1Å; L434-L477 HydrophobicContact CD1-CG 4.01Å; L434-L477 HydrophobicContact CD2-CD1 4.07Å; L434-L477 HydrophobicContact CD2-CG 4.14Å; L434-L477 VanDerWaalsContact CD2-O 3.24Å; L434-L477 WeakPolarHBondContact CD2-O 3.38Å; L434-L477 HydrophobicContact CG-CG 4.3Å; L434-P481 HydrophobicContact CD2-CG 4.45Å |
| 435 | T | 92 | Very high | 87.7 | Confident | 1 Ų | 1 | 41.6 Ų | 41.6 | 1% | 0.006 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -66.4 | -41 | 171.9 | 58.4 | 0 | 0 | 0 | 0 | 111.3 | D402 S406 V431 Y432 A437 S438 P439 V478 L482 | D402-T435 HydrophobicContact CB-CG2 4.14Å; S406-T435 PolarHBondContact OG-OG1 3.37Å; V431-T435 WeakPolarHBondContact O-CG2 3.44Å; V431-T435 PolarHBondContact O-N 2.61Å; V431-T435 PolarHBondContact O-OG1 2.72Å; Y432-T435 PolarHBondContact O-OG1 3.26Å; T435-A437 VanDerWaalsContact C-N 3.33Å; T435-A437 PolarHBondContact O-N 3.15Å; T435-S438 WeakPolarHBondContact O-CB 3.33Å; T435-S438 PolarHBondContact O-N 3.49Å; T435-P439 WeakPolarHBondContact O-CD 3.37Å; T435-V478 HydrophobicContact CG2-CG1 3.58Å; T435-L482 HydrophobicContact CG2-CD1 3.91Å; T435-L482 HydrophobicContact CG2-CD2 4.28Å; T435-L482 HydrophobicContact CG2-CG 4.29Å |
| 436 | L | 92.1 | Very high | 87 | Confident | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64 | -34.6 | 176.1 | -170.8 | 71.9 | 0 | 0 | 0 | 112.9 | W318 Y321 S322 F325 L403 Y432 F433 P439 | W318-L436 HydrophobicContact CZ2-CD1 4.29Å; W318-L436 PolarHBondContact NE1-O 3.11Å; Y321-L436 HydrophobicContact CE1-CD1 4.1Å; S322-L436 PolarHBondContact OG-O 3.17Å; F325-L436 HydrophobicContact CD1-CD2 3.36Å; F325-L436 HydrophobicContact CE1-CD2 3.8Å; F325-L436 HydrophobicContact CG-CD2 4.27Å; L403-L436 HydrophobicContact CD1-CB 4.41Å; L403-L436 HydrophobicContact CD1-CD1 4.15Å; Y432-L436 WeakPolarHBondContact O-CB 3.25Å; Y432-L436 PolarHBondContact O-N 2.86Å; F433-L436 HydrophobicContact CD1-CD2 4.18Å; F433-L436 PolarHBondContact O-N 3.07Å; L436-P439 WeakPolarHBondContact O-CD 3.45Å |
| 437 | A | 90.9 | Very high | 86.4 | Confident | 34 Ų | 34 | 31.2 Ų | 31.2 | 28% | 0.281 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -84 | -22.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | F433 L434 T435 P439 V440 | F433-A437 VanDerWaalsContact O-CB 3.27Å; F433-A437 WeakPolarHBondContact O-CB 3.32Å; F433-A437 PolarHBondContact O-N 3.49Å; L434-A437 PolarHBondContact O-N 3.37Å; T435-A437 VanDerWaalsContact C-N 3.33Å; T435-A437 PolarHBondContact O-N 3.15Å; A437-P439 VanDerWaalsContact C-CD 3.4Å; A437-V440 WeakPolarHBondContact O-CB 3.13Å; A437-V440 VanDerWaalsContact O-CG2 3.28Å; A437-V440 WeakPolarHBondContact O-CG2 3.36Å; A437-V440 PolarHBondContact O-N 3.21Å |
| 438 | S | 88.6 | Confident | 85.5 | Confident | 5 Ų | 5 | 29 Ų | 29 | 4% | 0.035 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -46.8 | -43.2 | -179.4 | 178.7 | 0 | 0 | 0 | 0 | 115.3 | T399 L434 T435 V440 L441 W442 | T399-S438 WeakPolarHBondContact CG2-OG 3.3Å; L434-S438 PolarHBondContact O-N 3.39Å; T435-S438 WeakPolarHBondContact O-CB 3.33Å; T435-S438 PolarHBondContact O-N 3.49Å; S438-V440 PolarHBondContact O-N 3.27Å; S438-L441 PolarHBondContact O-N 3.08Å; S438-W442 VanDerWaalsContact O-CD1 3.32Å; S438-W442 PolarHBondContact OG-NE1 3.27Å |
| 439 | P | 87.6 | Confident | 84.5 | Confident | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -57.1 | -24.4 | 178.3 | -27.1 | 36.5 | 0 | 0 | 0 | 115.1 | W318 L363 T435 L436 A437 L441 W442 L443 | W318-P439 HydrophobicContact CD2-CB 4.48Å; W318-P439 HydrophobicContact CG-CB 4.46Å; W318-P439 HydrophobicContact CZ2-CG 4.25Å; L363-P439 HydrophobicContact CD1-CB 3.78Å; L363-P439 HydrophobicContact CD1-CG 3.81Å; L363-P439 HydrophobicContact CD2-CG 3.7Å; L363-P439 HydrophobicContact CG-CG 4.44Å; T435-P439 WeakPolarHBondContact O-CD 3.37Å; L436-P439 WeakPolarHBondContact O-CD 3.45Å; A437-P439 VanDerWaalsContact C-CD 3.4Å; P439-L441 VanDerWaalsContact C-N 3.31Å; P439-L441 PolarHBondContact O-N 2.93Å; P439-W442 PolarHBondContact O-N 3.45Å; P439-L443 WeakPolarHBondContact O-CB 3.33Å; P439-L443 VanDerWaalsContact O-CG 3.3Å; P439-L443 WeakPolarHBondContact O-CG 3.32Å; P439-L443 PolarHBondContact O-N 3.44Å |
| 440 | V | 87.6 | Confident | 83.4 | Confident | 17 Ų | 17 | 30.5 Ų | 30.5 | 10% | 0.103 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -61 | -41.6 | 175.9 | -176 | 0 | 0 | 0 | 0 | 110.8 | Y315 W318 L319 A437 S438 Y444 | Y315-V440 HydrophobicContact CD2-CG1 4.37Å; W318-V440 HydrophobicContact CG-CG2 4.46Å; L319-V440 HydrophobicContact CB-CG1 4.14Å; L319-V440 HydrophobicContact CB-CG2 3.8Å; L319-V440 HydrophobicContact CD1-CG1 4.45Å; L319-V440 HydrophobicContact CD1-CG2 4.13Å; A437-V440 WeakPolarHBondContact O-CB 3.13Å; A437-V440 VanDerWaalsContact O-CG2 3.28Å; A437-V440 WeakPolarHBondContact O-CG2 3.36Å; A437-V440 PolarHBondContact O-N 3.21Å; S438-V440 PolarHBondContact O-N 3.27Å; V440-Y444 WeakPolarHBondContact O-CB 3.41Å; V440-Y444 PolarHBondContact O-N 2.89Å |
| 441 | L | 82.3 | Confident | 82.1 | Confident | 82 Ų | 82 | 30 Ų | 30 | 43% | 0.429 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -66.4 | -42.9 | -179.2 | -61.5 | 178.3 | 0 | 0 | 0 | 111.3 | S438 P439 Y444 E445 L477 | S438-L441 PolarHBondContact O-N 3.08Å; P439-L441 VanDerWaalsContact C-N 3.31Å; P439-L441 PolarHBondContact O-N 2.93Å; L441-Y444 PolarHBondContact O-N 2.91Å; L441-E445 PolarHBondContact O-N 3.3Å; L441-L477 HydrophobicContact CD1-CD2 4.3Å |
| 442 | W | 77.9 | Confident | 80.8 | Confident | 24 Ų | 24 | 32.4 Ų | 32.4 | 9% | 0.091 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -69 | -41.8 | 177.9 | -59.9 | 105.4 | 0 | 0 | 0 | 112.4 | C395 F396 S438 P439 Y444 E445 L446 R471 | C395-W442 HydrophobicContact CB-CD2 3.98Å; C395-W442 HydrophobicContact CB-CE3 3.79Å; C395-W442 HydrophobicContact CB-CZ3 4.08Å; C395-W442 VanDerWaalsContact SG-CZ3 3.59Å; F396-W442 HydrophobicContact CE1-CB 4.05Å; S438-W442 VanDerWaalsContact O-CD1 3.32Å; S438-W442 PolarHBondContact OG-NE1 3.27Å; P439-W442 PolarHBondContact O-N 3.45Å; W442-Y444 VanDerWaalsContact C-N 3.34Å; W442-E445 PolarHBondContact O-N 3.29Å; W442-L446 WeakPolarHBondContact O-CG 3.26Å; W442-L446 PolarHBondContact O-N 3.4Å; W442-L446 VanDerWaalsContact O-N 3.08Å; W442-R471 HydrophobicContact CZ3-CG 4.31Å |
| 443 | L | 78.2 | Confident | 79.4 | Confident | 4 Ų | 4 | 34.8 Ų | 34.8 | 2% | 0.021 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -66.2 | -36.1 | 174.5 | -71.4 | 164.7 | 0 | 0 | 0 | 111.9 | W318 I370 F396 P439 N447 | W318-L443 HydrophobicContact CB-CD1 4.3Å; I370-L443 HydrophobicContact CD1-CD2 4.21Å; F396-L443 HydrophobicContact CE1-CD2 4.09Å; F396-L443 HydrophobicContact CE1-CG 4Å; F396-L443 HydrophobicContact CZ-CD2 3.68Å; F396-L443 HydrophobicContact CZ-CG 4.02Å; P439-L443 WeakPolarHBondContact O-CB 3.33Å; P439-L443 VanDerWaalsContact O-CG 3.3Å; P439-L443 WeakPolarHBondContact O-CG 3.32Å; P439-L443 PolarHBondContact O-N 3.44Å; L443-N447 PolarHBondContact O-N 3.21Å |
| 444 | Y | 79.4 | Confident | 78 | Confident | 122 Ų | 122 | 35.6 Ų | 35.6 | 48% | 0.478 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -65.8 | -43.7 | 172.6 | 174 | -97.4 | 0 | 0 | 0 | 112.1 | Y315 V440 L441 W442 L446 N447 A448 | Y315-Y444 HydrophobicContact CD1-CD2 4.48Å; Y315-Y444 AromaticContact CE1-CD2 3.98Å; Y315-Y444 HydrophobicContact CE1-CD2 3.98Å; Y315-Y444 HydrophobicContact CE2-CD2 4.39Å; Y315-Y444 AromaticContact CZ-CD2 3.97Å; V440-Y444 WeakPolarHBondContact O-CB 3.41Å; V440-Y444 PolarHBondContact O-N 2.89Å; L441-Y444 PolarHBondContact O-N 2.91Å; W442-Y444 VanDerWaalsContact C-N 3.34Å; Y444-L446 VanDerWaalsContact C-N 3.33Å; Y444-L446 PolarHBondContact O-N 2.9Å; Y444-N447 WeakPolarHBondContact O-CB 3.23Å; Y444-N447 PolarHBondContact O-N 2.87Å; Y444-A448 PolarHBondContact O-N 3.39Å |
| 445 | E | 77.1 | Confident | 76.5 | Confident | 48 Ų | 48 | 36.6 Ų | 36.6 | 22% | 0.224 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -61.8 | -41.8 | 176.5 | -175.4 | 173.5 | -148.7 | 0 | 0 | 111.4 | L441 W442 N447 A448 A449 S467 R471 | L441-E445 PolarHBondContact O-N 3.3Å; W442-E445 PolarHBondContact O-N 3.29Å; E445-N447 VanDerWaalsContact C-N 3.29Å; E445-N447 PolarHBondContact O-N 3.07Å; E445-A448 PolarHBondContact O-N 2.8Å; E445-A448 VanDerWaalsContact O-N 3.15Å; E445-A449 VanDerWaalsContact O-CB 3.32Å; E445-A449 WeakPolarHBondContact O-CB 3.29Å; E445-A449 PolarHBondContact O-N 3.04Å; E445-S467 PolarHBondContact OE1-OG 3.18Å; E445-R471 WeakPolarHBondContact OE1-CD 3.46Å; E445-R471 WeakPolarHBondContact OE1-CG 3.48Å; E445-R471 IonicContact OE1-CZ 2.61Å; E445-R471 IonicContact OE1-NE 3.2Å; E445-R471 PolarHBondContact OE1-NE 2.85Å; E445-R471 IonicContact OE1-NH2 3.87Å; E445-R471 VanDerWaalsContact OE2-CD 3.32Å; E445-R471 WeakPolarHBondContact OE2-CD 3.39Å; E445-R471 WeakPolarHBondContact OE2-CG 3.49Å; E445-R471 IonicContact OE2-NE 2.77Å |
| 446 | L | 72.3 | Confident | 74.6 | Confident | 37 Ų | 37 | 39.1 Ų | 39.1 | 19% | 0.194 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.8 | -37.5 | 177.2 | -68.1 | 168.6 | 0 | 0 | 0 | 112.3 | A392 F396 W442 Y444 A450 | A392-L446 HydrophobicContact CB-CD1 4.02Å; A392-L446 HydrophobicContact CB-CD2 3.77Å; A392-L446 HydrophobicContact CB-CG 4.5Å; F396-L446 HydrophobicContact CE2-CD1 3.59Å; F396-L446 HydrophobicContact CZ-CD1 3.56Å; W442-L446 WeakPolarHBondContact O-CG 3.26Å; W442-L446 PolarHBondContact O-N 3.4Å; W442-L446 VanDerWaalsContact O-N 3.08Å; Y444-L446 VanDerWaalsContact C-N 3.33Å; Y444-L446 PolarHBondContact O-N 2.9Å; L446-A450 WeakPolarHBondContact O-CB 3.38Å; L446-A450 PolarHBondContact O-N 3.33Å |
| 447 | N | 75.6 | Confident | 72.7 | Confident | 22 Ų | 22 | 50 Ų | 50 | 12% | 0.118 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -64.3 | -47.9 | 171.5 | -177.3 | 44.8 | 0 | 0 | 0 | 111.9 | A308 F311 Y315 L443 Y444 E445 A449 A450 A451 | A308-N447 PolarHBondContact O-OD1 3.46Å; F311-N447 HydrophobicContact CB-CB 3.84Å; Y315-N447 HydrophobicContact CD1-CB 4.47Å; Y315-N447 HydrophobicContact CE1-CB 4.25Å; L443-N447 PolarHBondContact O-N 3.21Å; Y444-N447 WeakPolarHBondContact O-CB 3.23Å; Y444-N447 PolarHBondContact O-N 2.87Å; E445-N447 VanDerWaalsContact C-N 3.29Å; E445-N447 PolarHBondContact O-N 3.07Å; N447-A449 VanDerWaalsContact C-N 3.33Å; N447-A449 PolarHBondContact O-N 3.26Å; N447-A450 PolarHBondContact O-N 3.43Å; N447-A451 WeakPolarHBondContact O-CB 3.04Å; N447-A451 PolarHBondContact O-N 3.48Å |
| 448 | A | 72.7 | Confident | 70.5 | Confident | 39 Ų | 39 | 51.5 Ų | 51.5 | 32% | 0.322 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62.4 | -39.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y444 E445 A452 | Y444-A448 PolarHBondContact O-N 3.39Å; E445-A448 PolarHBondContact O-N 2.8Å; E445-A448 VanDerWaalsContact O-N 3.15Å; A448-A452 VanDerWaalsContact O-CB 3.25Å; A448-A452 WeakPolarHBondContact O-CB 3.18Å; A448-A452 PolarHBondContact O-N 2.93Å |
| 449 | A | 69.1 | Low | 68.3 | Low | 33 Ų | 33 | 58.2 Ų | 58.2 | 27% | 0.273 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -67.5 | -40.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | E445 N447 A453 | E445-A449 VanDerWaalsContact O-CB 3.32Å; E445-A449 WeakPolarHBondContact O-CB 3.29Å; E445-A449 PolarHBondContact O-N 3.04Å; N447-A449 VanDerWaalsContact C-N 3.33Å; N447-A449 PolarHBondContact O-N 3.26Å; A449-A453 WeakPolarHBondContact O-CB 3.22Å; A449-A453 PolarHBondContact O-N 2.93Å |
| 450 | A | 67 | Low | 66.1 | Low | 26 Ų | 26 | 63.3 Ų | 63.3 | 22% | 0.215 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -65.2 | -43.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112 | L446 N447 A453 A454 | L446-A450 WeakPolarHBondContact O-CB 3.38Å; L446-A450 PolarHBondContact O-N 3.33Å; N447-A450 PolarHBondContact O-N 3.43Å; A450-A453 PolarHBondContact O-N 3.5Å; A450-A454 PolarHBondContact O-N 2.85Å |
| 451 | A | 66.3 | Low | 64.1 | Low | 45 Ų | 45 | 67 Ų | 67 | 37% | 0.372 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -64.8 | -42 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | A308 N447 A454 A455 | A308-A451 HydrophobicContact CB-CB 4.46Å; N447-A451 WeakPolarHBondContact O-CB 3.04Å; N447-A451 PolarHBondContact O-N 3.48Å; A451-A454 WeakPolarHBondContact O-CB 3.36Å; A451-A454 PolarHBondContact O-N 3.34Å; A451-A455 PolarHBondContact O-N 2.91Å; A451-A455 VanDerWaalsContact O-N 3.07Å |
| 452 | A | 65.1 | Low | 62.7 | Low | 59 Ų | 59 | 65.9 Ų | 65.9 | 49% | 0.488 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -63.3 | -41.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | A448 A454 A455 S456 | A448-A452 VanDerWaalsContact O-CB 3.25Å; A448-A452 WeakPolarHBondContact O-CB 3.18Å; A448-A452 PolarHBondContact O-N 2.93Å; A452-A454 VanDerWaalsContact C-N 3.3Å; A452-A454 PolarHBondContact O-N 3Å; A452-A455 PolarHBondContact O-N 3.48Å; A452-S456 WeakPolarHBondContact O-CB 3.44Å; A452-S456 PolarHBondContact O-N 3.34Å; A452-S456 PolarHBondContact O-OG 2.84Å |
| 453 | A | 62.3 | Low | 61.6 | Low | 52 Ų | 52 | 69.6 Ų | 69.6 | 43% | 0.43 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -65.6 | -31.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | A449 A450 S456 | A449-A453 WeakPolarHBondContact O-CB 3.22Å; A449-A453 PolarHBondContact O-N 2.93Å; A450-A453 PolarHBondContact O-N 3.5Å; A453-S456 WeakPolarHBondContact CA-OG 3.28Å; A453-S456 PolarHBondContact O-OG 3.37Å |
| 454 | A | 62.1 | Low | 60.8 | Low | 43 Ų | 43 | 71.5 Ų | 71.5 | 36% | 0.355 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -69.9 | -38.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | A304 A450 A451 A452 | A304-A454 HydrophobicContact CB-CB 3.77Å; A450-A454 PolarHBondContact O-N 2.85Å; A451-A454 WeakPolarHBondContact O-CB 3.36Å; A451-A454 PolarHBondContact O-N 3.34Å; A452-A454 VanDerWaalsContact C-N 3.3Å; A452-A454 PolarHBondContact O-N 3Å |
| 455 | A | 59.7 | Low | 59.8 | Low | 76 Ų | 76 | 68.2 Ų | 68.2 | 63% | 0.628 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -74 | -34.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | A451 A452 W457 G458 | A451-A455 PolarHBondContact O-N 2.91Å; A451-A455 VanDerWaalsContact O-N 3.07Å; A452-A455 PolarHBondContact O-N 3.48Å; A455-W457 PolarHBondContact O-N 2.96Å; A455-W457 VanDerWaalsContact O-N 3.14Å; A455-G458 PolarHBondContact O-N 3.16Å |
| 456 | S | 53.5 | Low | 58.9 | Low | 53 Ų | 53 | 70.1 Ų | 70.1 | 37% | 0.371 | 49% | 0.486 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.1 | -0.1 | -176.6 | 72.3 | 0 | 0 | 0 | 0 | 114.6 | A452 A453 G458 Q459 | A452-S456 WeakPolarHBondContact O-CB 3.44Å; A452-S456 PolarHBondContact O-N 3.34Å; A452-S456 PolarHBondContact O-OG 2.84Å; A453-S456 WeakPolarHBondContact CA-OG 3.28Å; A453-S456 PolarHBondContact O-OG 3.37Å; S456-G458 PolarHBondContact O-N 3.3Å; S456-Q459 VanDerWaalsContact CA-O 3.29Å; S456-Q459 WeakPolarHBondContact CA-O 3.41Å; S456-Q459 WeakPolarHBondContact CB-O 3.48Å |
| 457 | W | 50.7 | Low | 58.6 | Low | 229 Ų | 229 | 70.3 Ų | 70.3 | 87% | 0.867 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.4 | -13.6 | 166.3 | -99.7 | 53.3 | 0 | 0 | 0 | 113.1 | A455 | A455-W457 PolarHBondContact O-N 2.96Å; A455-W457 VanDerWaalsContact O-N 3.14Å |
| 458 | G | 45 | Very low | 58.2 | Low | 65 Ų | 65 | 73.9 Ų | 73.9 | 67% | 0.67 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.5 | -37 | 168 | 0 | 0 | 0 | 0 | 0 | 114.8 | A455 S456 | A455-G458 PolarHBondContact O-N 3.16Å; S456-G458 PolarHBondContact O-N 3.3Å |
| 459 | Q | 43.8 | Very low | 57.9 | Low | 146 Ų | 146 | 77.5 Ų | 77.5 | 68% | 0.682 | 52% | 0.516 | S | S | * | . | trans | -132.6 | 123.1 | -171.8 | -133.1 | 80.4 | 17.1 | 0 | 0 | 112.5 | S456 S461 | S456-Q459 VanDerWaalsContact CA-O 3.29Å; S456-Q459 WeakPolarHBondContact CA-O 3.41Å; S456-Q459 WeakPolarHBondContact CB-O 3.48Å; Q459-S461 PolarHBondContact O-N 3.04Å | ||
| 460 | A | 39.9 | Very low | 57.8 | Low | 107 Ų | 107 | 80.9 Ų | 80.9 | 88% | 0.884 | 53% | 0.529 | S | S | * | . | trans | -79.9 | 47.4 | -178 | 0 | 0 | 0 | 0 | 0 | 114.3 | G462 | A460-G462 PolarHBondContact O-N 3.07Š| ||
| 461 | S | 45.7 | Very low | 57.9 | Low | 96 Ų | 96 | 82.3 Ų | 82.3 | 67% | 0.671 | 53% | 0.529 | S | S | * | . | trans | -77.7 | 96.4 | 173.1 | 51.6 | 0 | 0 | 0 | 0 | 110.8 | Q459 | Q459-S461 PolarHBondContact O-N 3.04Š| ||
| 462 | G | 54.2 | Low | 58.2 | Low | 58 Ų | 58 | 82.1 Ų | 82.1 | 60% | 0.598 | 52% | 0.521 | S | S | * | . | trans | -62.9 | 161.1 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | A460 G464 | A460-G462 PolarHBondContact O-N 3.07Å; G462-G464 PolarHBondContact O-N 2.82Å | ||
| 463 | P | 54.7 | Low | 58.5 | Low | 101 Ų | 101 | 84.8 Ų | 84.8 | 66% | 0.656 | 53% | 0.527 | S | S | * | . | trans | -62.4 | 110.6 | -172.6 | 24.6 | -34.2 | 0 | 0 | 0 | 112.2 | ||||
| 464 | G | 59.8 | Low | 58.9 | Low | 45 Ų | 45 | 82.7 Ų | 82.7 | 46% | 0.464 | 51% | 0.511 | S | S | . | . | trans | -63.6 | 160.6 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | G462 C466 S467 | G462-G464 PolarHBondContact O-N 2.82Å; G464-C466 PolarHBondContact O-N 3.39Å; G464-S467 PolarHBondContact O-N 2.94Å | ||
| 465 | S | 59.9 | Low | 59.3 | Low | 53 Ų | 53 | 80.7 Ų | 80.7 | 37% | 0.371 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -53.3 | -30.2 | -177.9 | -160 | 0 | 0 | 0 | 0 | 113.8 | R468 L469 R522 | S465-R468 PolarHBondContact O-N 3.37Å; S465-L469 PolarHBondContact O-N 3.19Å; S465-R522 PolarHBondContact OG-NH1 3.45Å; S465-R522 VanDerWaalsContact OG-NH1 3.16Å |
| 466 | C | 57.7 | Low | 60.2 | Low | 87 Ų | 87 | 78.6 Ų | 78.6 | 59% | 0.588 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -63.2 | -40.3 | 177 | -170.1 | 0 | 0 | 0 | 0 | 112.6 | G464 R468 L469 L470 | G464-C466 PolarHBondContact O-N 3.39Å; C466-R468 VanDerWaalsContact C-N 3.34Å; C466-R468 PolarHBondContact O-N 3.37Å; C466-L469 PolarHBondContact O-N 2.87Å; C466-L469 VanDerWaalsContact O-N 3.16Å; C466-L470 WeakPolarHBondContact O-CD1 3.11Å; C466-L470 PolarHBondContact O-N 3.35Å |
| 467 | S | 67.1 | Low | 61.7 | Low | 42 Ų | 42 | 79.6 Ų | 79.6 | 29% | 0.294 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -67.1 | -34.4 | 177.5 | 171 | 0 | 0 | 0 | 0 | 112.1 | E445 G464 R471 | E445-S467 PolarHBondContact OE1-OG 3.18Å; G464-S467 PolarHBondContact O-N 2.94Å; S467-R471 PolarHBondContact O-N 2.99Å; S467-R471 VanDerWaalsContact O-N 3.12Å; S467-R471 PolarHBondContact O-NE 2.98Å; S467-R471 PolarHBondContact OG-NH2 2.85Å |
| 468 | R | 65.9 | Low | 63.3 | Low | 97 Ų | 97 | 68.8 Ų | 68.8 | 37% | 0.366 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -65.8 | -40.5 | 171 | -75.9 | -171.1 | -87.4 | 158.2 | -5.3 | 111.9 | S465 C466 R471 L472 G518 | S465-R468 PolarHBondContact O-N 3.37Å; C466-R468 VanDerWaalsContact C-N 3.34Å; C466-R468 PolarHBondContact O-N 3.37Å; R468-R471 WeakPolarHBondContact O-CB 3.17Å; R468-R471 PolarHBondContact O-N 3.39Å; R468-L472 PolarHBondContact O-N 3.31Å; R468-L472 VanDerWaalsContact O-N 3.07Å; R468-G518 PolarHBondContact NH1-O 3.06Å |
| 469 | L | 66.5 | Low | 65.4 | Low | 114 Ų | 114 | 65.7 Ų | 65.7 | 60% | 0.597 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -67.2 | -40.3 | 176.8 | -173.6 | 62.1 | 0 | 0 | 0 | 112.6 | S465 C466 L472 L473 | S465-L469 PolarHBondContact O-N 3.19Å; C466-L469 PolarHBondContact O-N 2.87Å; C466-L469 VanDerWaalsContact O-N 3.16Å; L469-L472 WeakPolarHBondContact O-CB 3.42Å; L469-L472 PolarHBondContact O-N 3.08Å; L469-L473 WeakPolarHBondContact O-CB 3.47Å; L469-L473 PolarHBondContact O-N 3.1Å |
| 470 | L | 67.4 | Low | 67.7 | Low | 104 Ų | 104 | 61.9 Ų | 61.9 | 55% | 0.545 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -62.8 | -39.7 | 173.9 | -96.8 | 75.7 | 0 | 0 | 0 | 112.2 | C466 L473 G474 | C466-L470 WeakPolarHBondContact O-CD1 3.11Å; C466-L470 PolarHBondContact O-N 3.35Å; L470-L473 PolarHBondContact O-N 3.39Å; L470-G474 PolarHBondContact O-N 3.5Å |
| 471 | R | 69.3 | Low | 70.1 | Confident | 56 Ų | 56 | 58.6 Ų | 58.6 | 21% | 0.211 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60.2 | -45.9 | 173.5 | -99.9 | 176.2 | -91 | 152.8 | -9.7 | 112.8 | W442 E445 S467 R468 G475 | W442-R471 HydrophobicContact CZ3-CG 4.31Å; E445-R471 WeakPolarHBondContact OE1-CD 3.46Å; E445-R471 WeakPolarHBondContact OE1-CG 3.48Å; E445-R471 IonicContact OE1-CZ 2.61Å; E445-R471 IonicContact OE1-NE 3.2Å; E445-R471 PolarHBondContact OE1-NE 2.85Å; E445-R471 IonicContact OE1-NH2 3.87Å; E445-R471 VanDerWaalsContact OE2-CD 3.32Å; E445-R471 WeakPolarHBondContact OE2-CD 3.39Å; E445-R471 WeakPolarHBondContact OE2-CG 3.49Å; E445-R471 IonicContact OE2-NE 2.77Å; S467-R471 PolarHBondContact O-N 2.99Å; S467-R471 VanDerWaalsContact O-N 3.12Å; S467-R471 PolarHBondContact O-NE 2.98Å; S467-R471 PolarHBondContact OG-NH2 2.85Å; R468-R471 WeakPolarHBondContact O-CB 3.17Å; R468-R471 PolarHBondContact O-N 3.39Å; R471-G475 PolarHBondContact O-N 3.07Å; R471-G475 VanDerWaalsContact O-N 3.14Å |
| 472 | L | 71.4 | Confident | 72.2 | Confident | 41 Ų | 41 | 54 Ų | 54 | 22% | 0.215 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -60 | -51.8 | 174.9 | -89.9 | 154.5 | 0 | 0 | 0 | 111 | R468 L469 G474 G475 C476 R511 A515 | R468-L472 PolarHBondContact O-N 3.31Å; R468-L472 VanDerWaalsContact O-N 3.07Å; L469-L472 WeakPolarHBondContact O-CB 3.42Å; L469-L472 PolarHBondContact O-N 3.08Å; L472-G474 PolarHBondContact O-N 3.05Å; L472-G475 PolarHBondContact O-N 3.31Å; L472-C476 WeakPolarHBondContact O-CB 3.33Å; L472-C476 PolarHBondContact O-N 3.48Å; L472-C476 PolarHBondContact O-SG 3.5Å; L472-R511 HydrophobicContact CD2-CB 4.02Å; L472-R511 WeakPolarHBondContact CD2-O 3.43Å; L472-A515 HydrophobicContact CD1-CB 3.48Å; L472-A515 VanDerWaalsContact CD1-CB 3.48Å; L472-A515 HydrophobicContact CD2-CB 3.83Å; L472-A515 HydrophobicContact CG-CB 4.28Å |
| 473 | L | 72.2 | Confident | 74 | Confident | 115 Ų | 115 | 52.5 Ų | 52.5 | 60% | 0.602 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -60.4 | -47.1 | -179.7 | -173.3 | 61.8 | 0 | 0 | 0 | 111.7 | L469 L470 G475 C476 L477 | L469-L473 WeakPolarHBondContact O-CB 3.47Å; L469-L473 PolarHBondContact O-N 3.1Å; L470-L473 PolarHBondContact O-N 3.39Å; L473-G475 VanDerWaalsContact C-N 3.32Å; L473-G475 PolarHBondContact O-N 3.39Å; L473-C476 PolarHBondContact O-N 2.89Å; L473-L477 WeakPolarHBondContact O-CB 3.46Å; L473-L477 PolarHBondContact O-N 3.43Å |
| 474 | G | 70 | Confident | 75.8 | Confident | 9 Ų | 9 | 50.4 Ų | 50.4 | 9% | 0.093 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -63.7 | -31.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | L470 L472 | L470-G474 PolarHBondContact O-N 3.5Å; L472-G474 PolarHBondContact O-N 3.05Å |
| 475 | G | 71.2 | Confident | 77.3 | Confident | 1 Ų | 1 | 48.5 Ų | 48.5 | 1% | 0.01 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -75.2 | -51 | 171.3 | 0 | 0 | 0 | 0 | 0 | 113 | R471 L472 L473 L477 V478 D479 | R471-G475 PolarHBondContact O-N 3.07Å; R471-G475 VanDerWaalsContact O-N 3.14Å; L472-G475 PolarHBondContact O-N 3.31Å; L473-G475 VanDerWaalsContact C-N 3.32Å; L473-G475 PolarHBondContact O-N 3.39Å; G475-L477 VanDerWaalsContact C-N 3.26Å; G475-L477 PolarHBondContact O-N 3.04Å; G475-V478 PolarHBondContact O-N 3.16Å; G475-V478 VanDerWaalsContact O-N 3.17Å; G475-D479 PolarHBondContact O-N 3.5Å; G475-D479 VanDerWaalsContact O-N 3.17Å |
| 476 | C | 79.1 | Confident | 78.7 | Confident | 32 Ų | 32 | 47.1 Ų | 47.1 | 22% | 0.216 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -63.8 | -30.6 | -179 | -64.7 | 0 | 0 | 0 | 0 | 112.8 | L472 L473 V478 V480 L508 | L472-C476 WeakPolarHBondContact O-CB 3.33Å; L472-C476 PolarHBondContact O-N 3.48Å; L472-C476 PolarHBondContact O-SG 3.5Å; L473-C476 PolarHBondContact O-N 2.89Å; C476-V478 PolarHBondContact O-N 3.12Å; C476-V478 VanDerWaalsContact O-N 3.09Å; C476-V480 HydrophobicContact CB-CG2 4.14Å; C476-V480 VanDerWaalsContact O-CB 3.23Å; C476-V480 WeakPolarHBondContact O-CB 3.45Å; C476-V480 VanDerWaalsContact O-CG2 3.31Å; C476-V480 WeakPolarHBondContact O-CG2 3.5Å; C476-V480 PolarHBondContact O-N 3.14Å; C476-L508 HydrophobicContact CB-CD1 4.35Å; C476-L508 WeakPolarHBondContact SG-CD1 3.22Å |
| 477 | L | 83.5 | Confident | 80.3 | Confident | 73 Ų | 73 | 45.5 Ų | 45.5 | 38% | 0.382 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -55.8 | -23.9 | 175.3 | -179.8 | 62.7 | 0 | 0 | 0 | 113.1 | L434 L441 L473 G475 P481 | L434-L477 HydrophobicContact CD1-CD1 4.27Å; L434-L477 HydrophobicContact CD1-CD2 4.1Å; L434-L477 HydrophobicContact CD1-CG 4.01Å; L434-L477 HydrophobicContact CD2-CD1 4.07Å; L434-L477 HydrophobicContact CD2-CG 4.14Å; L434-L477 VanDerWaalsContact CD2-O 3.24Å; L434-L477 WeakPolarHBondContact CD2-O 3.38Å; L434-L477 HydrophobicContact CG-CG 4.3Å; L441-L477 HydrophobicContact CD1-CD2 4.3Å; L473-L477 WeakPolarHBondContact O-CB 3.46Å; L473-L477 PolarHBondContact O-N 3.43Å; G475-L477 VanDerWaalsContact C-N 3.26Å; G475-L477 PolarHBondContact O-N 3.04Å; L477-P481 VanDerWaalsContact O-CD 3.29Å; L477-P481 WeakPolarHBondContact O-CD 3.31Å; L477-P481 VanDerWaalsContact O-CG 3.3Å; L477-P481 WeakPolarHBondContact O-CG 3.47Å |
| 478 | V | 86 | Confident | 81.4 | Confident | 3 Ų | 3 | 46.7 Ų | 46.7 | 2% | 0.018 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -108.7 | -50.6 | -178.5 | -178.8 | 0 | 0 | 0 | 0 | 112 | D402 T435 G475 C476 V480 P481 L482 | D402-V478 HydrophobicContact CB-CG1 3.77Å; T435-V478 HydrophobicContact CG2-CG1 3.58Å; G475-V478 PolarHBondContact O-N 3.16Å; G475-V478 VanDerWaalsContact O-N 3.17Å; C476-V478 PolarHBondContact O-N 3.12Å; C476-V478 VanDerWaalsContact O-N 3.09Å; V478-V480 VanDerWaalsContact C-N 3.32Å; V478-V480 PolarHBondContact O-N 3.27Å; V478-P481 WeakPolarHBondContact O-CD 3.35Å; V478-L482 HydrophobicContact CG1-CD1 3.94Å; V478-L482 WeakPolarHBondContact O-CG 3.32Å; V478-L482 PolarHBondContact O-N 3.48Å |
| 479 | D | 88.8 | Confident | 82.5 | Confident | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.8 | -34 | -178.2 | -74.9 | -77.9 | 0 | 0 | 0 | 112.4 | G475 L483 K503 N504 R511 | G475-D479 PolarHBondContact O-N 3.5Å; G475-D479 VanDerWaalsContact O-N 3.17Å; D479-L483 WeakPolarHBondContact O-CB 3.34Å; D479-L483 PolarHBondContact O-N 3.48Å; D479-K503 IonicContact OD1-NZ 2.67Å; D479-K503 PolarHBondContact OD1-NZ 3.42Å; D479-N504 HydrophobicContact CB-CB 4.49Å; D479-N504 WeakPolarHBondContact OD1-CA 3.47Å; D479-N504 PolarHBondContact OD1-OD1 2.76Å; D479-R511 IonicContact OD2-CZ 2.8Å; D479-R511 IonicContact OD2-NH1 2.76Å; D479-R511 PolarHBondContact OD2-NH1 2.94Å; D479-R511 IonicContact OD2-NH2 2.8Å; D479-R511 PolarHBondContact OD2-NH2 2.86Å |
| 480 | V | 91 | Very high | 83.6 | Confident | 66 Ų | 66 | 38.3 Ų | 38.3 | 40% | 0.4 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -72.2 | -48.8 | -178 | 178.7 | 0 | 0 | 0 | 0 | 112.3 | C476 V478 L482 L483 A484 L508 | C476-V480 HydrophobicContact CB-CG2 4.14Å; C476-V480 VanDerWaalsContact O-CB 3.23Å; C476-V480 WeakPolarHBondContact O-CB 3.45Å; C476-V480 VanDerWaalsContact O-CG2 3.31Å; C476-V480 WeakPolarHBondContact O-CG2 3.5Å; C476-V480 PolarHBondContact O-N 3.14Å; V478-V480 VanDerWaalsContact C-N 3.32Å; V478-V480 PolarHBondContact O-N 3.27Å; V480-L482 PolarHBondContact O-N 2.93Å; V480-L483 PolarHBondContact O-N 3.23Å; V480-A484 WeakPolarHBondContact O-CB 3.29Å; V480-A484 PolarHBondContact O-N 3.43Å; V480-L508 HydrophobicContact CG2-CD1 3.76Å; V480-L508 HydrophobicContact CG2-CD2 3.87Å; V480-L508 HydrophobicContact CG2-CG 4.49Å |
| 481 | P | 90.8 | Very high | 84.6 | Confident | 37 Ų | 37 | 38.4 Ų | 38.4 | 24% | 0.24 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.4 | -38.8 | 175.2 | -26.6 | 37.5 | 0 | 0 | 0 | 113.6 | V431 L434 L477 V478 A484 L485 | V431-P481 HydrophobicContact CG1-CB 4.17Å; V431-P481 HydrophobicContact CG2-CB 3.58Å; L434-P481 HydrophobicContact CD2-CG 4.45Å; L477-P481 VanDerWaalsContact O-CD 3.29Å; L477-P481 WeakPolarHBondContact O-CD 3.31Å; L477-P481 VanDerWaalsContact O-CG 3.3Å; L477-P481 WeakPolarHBondContact O-CG 3.47Å; V478-P481 WeakPolarHBondContact O-CD 3.35Å; P481-A484 PolarHBondContact O-N 3.06Å; P481-L485 WeakPolarHBondContact O-CB 3.23Å; P481-L485 WeakPolarHBondContact O-CG 3.21Å; P481-L485 PolarHBondContact O-N 3.28Å |
| 482 | L | 90.3 | Very high | 85.5 | Confident | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.8 | -46.3 | 174.7 | -73.6 | 174.7 | 0 | 0 | 0 | 111.9 | D402 D405 L409 V431 T435 V478 V480 L485 R486 N504 | D402-L482 HydrophobicContact CB-CD1 3.96Å; D405-L482 HydrophobicContact CB-CD1 4.29Å; D405-L482 HydrophobicContact CB-CD2 4.45Å; L409-L482 HydrophobicContact CD1-CD2 3.8Å; V431-L482 HydrophobicContact CG1-CD2 3.62Å; V431-L482 HydrophobicContact CG1-CG 3.94Å; T435-L482 HydrophobicContact CG2-CD1 3.91Å; T435-L482 HydrophobicContact CG2-CD2 4.28Å; T435-L482 HydrophobicContact CG2-CG 4.29Å; V478-L482 HydrophobicContact CG1-CD1 3.94Å; V478-L482 WeakPolarHBondContact O-CG 3.32Å; V478-L482 PolarHBondContact O-N 3.48Å; V480-L482 PolarHBondContact O-N 2.93Å; L482-L485 PolarHBondContact O-N 3.17Å; L482-R486 WeakPolarHBondContact O-CB 3.09Å; L482-R486 VanDerWaalsContact O-CG 3.29Å; L482-R486 WeakPolarHBondContact O-CG 3.28Å; L482-R486 PolarHBondContact O-N 3.29Å; L482-N504 WeakPolarHBondContact CB-ND2 3.37Å |
| 483 | L | 91.8 | Very high | 86.1 | Confident | 27 Ų | 27 | 40.5 Ų | 40.5 | 14% | 0.141 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -60.9 | -47.5 | 175.9 | -178 | 55.8 | 0 | 0 | 0 | 111.5 | D479 V480 L485 R486 C487 M501 N504 L505 L508 | D479-L483 WeakPolarHBondContact O-CB 3.34Å; D479-L483 PolarHBondContact O-N 3.48Å; V480-L483 PolarHBondContact O-N 3.23Å; L483-L485 PolarHBondContact O-N 3.41Å; L483-R486 PolarHBondContact O-N 2.87Å; L483-C487 WeakPolarHBondContact O-CB 3.37Å; L483-C487 PolarHBondContact O-N 2.96Å; L483-C487 PolarHBondContact O-SG 3.47Å; L483-M501 HydrophobicContact CD1-CG 3.6Å; L483-N504 HydrophobicContact CB-CB 3.95Å; L483-N504 HydrophobicContact CD1-CB 4.42Å; L483-L505 HydrophobicContact CD2-CB 4.49Å; L483-L505 HydrophobicContact CD2-CD1 4.33Å; L483-L508 HydrophobicContact CD2-CD2 4.13Å |
| 484 | A | 91.8 | Very high | 86.6 | Confident | 57 Ų | 57 | 42.6 Ų | 42.6 | 47% | 0.471 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -60.9 | -44.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | V480 P481 C487 L488 | V480-A484 WeakPolarHBondContact O-CB 3.29Å; V480-A484 PolarHBondContact O-N 3.43Å; P481-A484 PolarHBondContact O-N 3.06Å; A484-C487 PolarHBondContact O-N 3.33Å; A484-L488 WeakPolarHBondContact O-CB 3.19Å; A484-L488 PolarHBondContact O-N 2.87Å |
| 485 | L | 90.9 | Very high | 87.2 | Confident | 4 Ų | 4 | 44.8 Ų | 44.8 | 2% | 0.021 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.6 | -45 | 174.6 | -80.2 | 168.3 | 0 | 0 | 0 | 112.3 | L409 L424 L427 L428 V431 P481 L482 L483 L488 L489 | L409-L485 HydrophobicContact CD1-CB 4.41Å; L409-L485 HydrophobicContact CD1-CD1 4.44Å; L424-L485 HydrophobicContact CD1-CD2 3.73Å; L427-L485 HydrophobicContact CD2-CD2 3.72Å; L427-L485 HydrophobicContact CD2-CG 4.49Å; L427-L485 HydrophobicContact CG-CD2 3.95Å; L428-L485 HydrophobicContact CD2-CB 4.47Å; L428-L485 HydrophobicContact CD2-CD1 3.77Å; L428-L485 HydrophobicContact CD2-CD2 3.73Å; L428-L485 HydrophobicContact CD2-CG 4.2Å; V431-L485 HydrophobicContact CB-CD1 3.81Å; V431-L485 HydrophobicContact CG1-CD1 4.01Å; V431-L485 HydrophobicContact CG2-CD1 3.67Å; P481-L485 WeakPolarHBondContact O-CB 3.23Å; P481-L485 WeakPolarHBondContact O-CG 3.21Å; P481-L485 PolarHBondContact O-N 3.28Å; L482-L485 PolarHBondContact O-N 3.17Å; L483-L485 PolarHBondContact O-N 3.41Å; L485-L488 PolarHBondContact O-N 2.98Å; L485-L489 WeakPolarHBondContact O-CB 3.42Å; L485-L489 WeakPolarHBondContact O-CG 3.31Å; L485-L489 PolarHBondContact O-N 2.93Å |
| 486 | R | 91.3 | Very high | 87.8 | Confident | 25 Ų | 25 | 49.7 Ų | 49.7 | 9% | 0.094 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -62.4 | -42.8 | 176 | -74.9 | -71 | -168.7 | -175.7 | 6.9 | 111.7 | D405 T408 L409 L482 L483 L489 V490 S498 M501 | D405-R486 IonicContact OD1-CZ 3.63Å; D405-R486 IonicContact OD1-NE 3.81Å; D405-R486 PolarHBondContact OD1-NE 3.38Å; D405-R486 IonicContact OD1-NH2 3.49Å; D405-R486 PolarHBondContact OD1-NH2 3.09Å; T408-R486 PolarHBondContact OG1-NH2 3.43Å; L409-R486 HydrophobicContact CD2-CG 4.42Å; L482-R486 WeakPolarHBondContact O-CB 3.09Å; L482-R486 VanDerWaalsContact O-CG 3.29Å; L482-R486 WeakPolarHBondContact O-CG 3.28Å; L482-R486 PolarHBondContact O-N 3.29Å; L483-R486 PolarHBondContact O-N 2.87Å; R486-L489 PolarHBondContact O-N 3.33Å; R486-V490 VanDerWaalsContact O-CG2 3.29Å; R486-V490 WeakPolarHBondContact O-CG2 3.39Å; R486-V490 PolarHBondContact O-N 3.06Å; R486-S498 PolarHBondContact NH2-OG 3.41Å; R486-M501 VanDerWaalsContact C-CE 3.45Å; R486-M501 HydrophobicContact CB-CB 4.41Å; R486-M501 HydrophobicContact CB-CE 3.74Å; R486-M501 HydrophobicContact CB-CG 4.49Å; R486-M501 WeakPolarHBondContact O-CE 3.3Å |
| 487 | C | 90.9 | Very high | 88 | Confident | 53 Ų | 53 | 54.4 Ų | 54.4 | 36% | 0.358 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -63.9 | -43.3 | 176.4 | -70.9 | 0 | 0 | 0 | 0 | 111.9 | L483 A484 V490 V491 M501 | L483-C487 WeakPolarHBondContact O-CB 3.37Å; L483-C487 PolarHBondContact O-N 2.96Å; L483-C487 PolarHBondContact O-SG 3.47Å; A484-C487 PolarHBondContact O-N 3.33Å; C487-V490 PolarHBondContact O-N 2.76Å; C487-V491 WeakPolarHBondContact O-CB 3.28Å; C487-V491 WeakPolarHBondContact O-CG2 3.33Å; C487-V491 PolarHBondContact O-N 3.44Å; C487-M501 HydrophobicContact CB-CE 4.49Å |
| 488 | L | 90.4 | Very high | 88.2 | Confident | 67 Ų | 67 | 52.1 Ų | 52.1 | 35% | 0.351 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.5 | -45.6 | 175.1 | -170.5 | 162.2 | 0 | 0 | 0 | 111.1 | L424 A484 L485 V490 V491 S492 Y493 | L424-L488 HydrophobicContact CD1-CD1 4.29Å; L424-L488 HydrophobicContact CD1-CD2 4.15Å; L424-L488 HydrophobicContact CD2-CD2 3.91Å; A484-L488 WeakPolarHBondContact O-CB 3.19Å; A484-L488 PolarHBondContact O-N 2.87Å; L485-L488 PolarHBondContact O-N 2.98Å; L488-V490 PolarHBondContact O-N 3.47Å; L488-V491 PolarHBondContact O-N 2.98Å; L488-S492 VanDerWaalsContact O-CB 3.27Å; L488-S492 WeakPolarHBondContact O-CB 3.45Å; L488-S492 PolarHBondContact O-N 3.49Å; L488-S492 PolarHBondContact O-OG 3.03Å; L488-Y493 HydrophobicContact CD2-CD2 4.28Å; L488-Y493 HydrophobicContact CD2-CE2 3.87Å |
| 489 | L | 87.9 | Confident | 88.3 | Confident | 2 Ų | 2 | 59.1 Ų | 59.1 | 1% | 0.01 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -64.1 | -37.1 | 178.2 | -73.8 | 166.9 | 0 | 0 | 0 | 113.3 | L409 L485 R486 Y493 Q494 Q495 | L409-L489 HydrophobicContact CD2-CD1 3.41Å; L409-L489 VanDerWaalsContact CD2-CD1 3.41Å; L485-L489 WeakPolarHBondContact O-CB 3.42Å; L485-L489 WeakPolarHBondContact O-CG 3.31Å; L485-L489 PolarHBondContact O-N 2.93Å; R486-L489 PolarHBondContact O-N 3.33Å; L489-Y493 HydrophobicContact CD2-CD2 4Å; L489-Y493 CarbonylContact O-C 3.36Å; L489-Y493 WeakPolarHBondContact O-CA 3.35Å; L489-Y493 WeakPolarHBondContact O-CB 3.23Å; L489-Y493 PolarHBondContact O-N 3.37Å; L489-Y493 VanDerWaalsContact O-N 3.16Å; L489-Q494 PolarHBondContact O-N 3.23Å; L489-Q495 HydrophobicContact CB-CB 4.43Å; L489-Q495 HydrophobicContact CB-CG 4.2Å; L489-Q495 WeakPolarHBondContact O-CG 3.21Å; L489-Q495 PolarHBondContact O-N 2.96Å |
| 490 | V | 90.1 | Very high | 88.3 | Confident | 32 Ų | 32 | 61.3 Ų | 61.3 | 19% | 0.194 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -69.2 | -49.4 | 175.2 | 171.6 | 0 | 0 | 0 | 0 | 111 | R486 C487 L488 Q494 Q495 L497 M501 | R486-V490 VanDerWaalsContact O-CG2 3.29Å; R486-V490 WeakPolarHBondContact O-CG2 3.39Å; R486-V490 PolarHBondContact O-N 3.06Å; C487-V490 PolarHBondContact O-N 2.76Å; L488-V490 PolarHBondContact O-N 3.47Å; V490-Q494 VanDerWaalsContact O-CA 3.28Å; V490-Q494 WeakPolarHBondContact O-CA 3.5Å; V490-Q494 PolarHBondContact O-N 2.98Å; V490-Q494 VanDerWaalsContact O-N 3.15Å; V490-Q495 WeakPolarHBondContact CG2-O 3.47Å; V490-L497 HydrophobicContact CG1-CD2 3.97Å; V490-L497 HydrophobicContact CG2-CD2 4.14Å; V490-M501 HydrophobicContact CB-CE 4.33Å; V490-M501 HydrophobicContact CG2-CE 3.67Å |
| 491 | V | 89.2 | Confident | 88.1 | Confident | 107 Ų | 107 | 59.4 Ų | 59.4 | 65% | 0.648 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -69.1 | -52.5 | -176.7 | 173.4 | 0 | 0 | 0 | 0 | 111.7 | C487 L488 Q494 | C487-V491 WeakPolarHBondContact O-CB 3.28Å; C487-V491 WeakPolarHBondContact O-CG2 3.33Å; C487-V491 PolarHBondContact O-N 3.44Å; L488-V491 PolarHBondContact O-N 2.98Å; V491-Q494 PolarHBondContact O-NE2 3.42Å; V491-Q494 VanDerWaalsContact O-NE2 3.13Å |
| 492 | S | 86.6 | Confident | 88 | Confident | 76 Ų | 76 | 63.4 Ų | 63.4 | 53% | 0.531 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -85.2 | -24.4 | -171.1 | -54.6 | 0 | 0 | 0 | 0 | 114.4 | L488 | L488-S492 VanDerWaalsContact O-CB 3.27Å; L488-S492 WeakPolarHBondContact O-CB 3.45Å; L488-S492 PolarHBondContact O-N 3.49Å; L488-S492 PolarHBondContact O-OG 3.03Å |
| 493 | Y | 83.6 | Confident | 88 | Confident | 65 Ų | 65 | 64.5 Ų | 64.5 | 26% | 0.255 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -127.9 | 14.6 | -174.3 | -58.3 | -82.8 | 0 | 0 | 0 | 113.7 | V418 P421 L424 L488 L489 Q495 | V418-Y493 HydrophobicContact CG1-CD1 3.26Å; V418-Y493 HydrophobicContact CG1-CE1 3.8Å; V418-Y493 HydrophobicContact CG1-CG 3.83Å; P421-Y493 WeakPolarHBondContact CD-OH 3.4Å; L424-Y493 HydrophobicContact CD2-CE2 3.8Å; L488-Y493 HydrophobicContact CD2-CD2 4.28Å; L488-Y493 HydrophobicContact CD2-CE2 3.87Å; L489-Y493 HydrophobicContact CD2-CD2 4Å; L489-Y493 CarbonylContact O-C 3.36Å; L489-Y493 WeakPolarHBondContact O-CA 3.35Å; L489-Y493 WeakPolarHBondContact O-CB 3.23Å; L489-Y493 PolarHBondContact O-N 3.37Å; L489-Y493 VanDerWaalsContact O-N 3.16Å; Y493-Q495 PolarHBondContact O-N 3.07Å; Y493-Q495 PolarHBondContact O-NE2 3.29Å; Y493-Q495 VanDerWaalsContact O-NE2 3.08Å |
| 494 | Q | 83.1 | Confident | 87.8 | Confident | 159 Ų | 159 | 63.2 Ų | 63.2 | 74% | 0.743 | 35% | 0.348 | S | S | * | . | trans | 49.3 | 33.6 | 174.4 | -62.4 | -63.6 | -60.6 | 0 | 0 | 113.8 | L489 V490 V491 | L489-Q494 PolarHBondContact O-N 3.23Å; V490-Q494 VanDerWaalsContact O-CA 3.28Å; V490-Q494 WeakPolarHBondContact O-CA 3.5Å; V490-Q494 PolarHBondContact O-N 2.98Å; V490-Q494 VanDerWaalsContact O-N 3.15Å; V491-Q494 PolarHBondContact O-NE2 3.42Å; V491-Q494 VanDerWaalsContact O-NE2 3.13Å | ||
| 495 | Q | 84.1 | Confident | 87.7 | Confident | 54 Ų | 54 | 65.3 Ų | 65.3 | 25% | 0.252 | 35% | 0.35 | S | S | . | . | trans | -69.9 | 148.5 | 177.3 | -66.5 | -57 | -63.2 | 0 | 0 | 111.1 | L412 L489 V490 Y493 | L412-Q495 HydrophobicContact CD1-CG 4.32Å; L489-Q495 HydrophobicContact CB-CB 4.43Å; L489-Q495 HydrophobicContact CB-CG 4.2Å; L489-Q495 WeakPolarHBondContact O-CG 3.21Å; L489-Q495 PolarHBondContact O-N 2.96Å; V490-Q495 WeakPolarHBondContact CG2-O 3.47Å; Y493-Q495 PolarHBondContact O-N 3.07Å; Y493-Q495 PolarHBondContact O-NE2 3.29Å; Y493-Q495 VanDerWaalsContact O-NE2 3.08Å | ||
| 496 | P | 83.4 | Confident | 87.6 | Confident | 104 Ų | 104 | 71.2 Ų | 71.2 | 68% | 0.675 | 38% | 0.376 | S | S | * | . | trans | -64.1 | 148.5 | 176.8 | 27 | -34.7 | 0 | 0 | 0 | 111.6 | S498 | P496-S498 PolarHBondContact O-N 3.38Š| ||
| 497 | L | 83.1 | Confident | 87.4 | Confident | 132 Ų | 132 | 73 Ų | 73 | 69% | 0.691 | 39% | 0.385 | S | S | * | . | trans | -61.4 | 109.6 | 176.2 | -68.8 | 173.6 | 0 | 0 | 0 | 110.5 | V490 M501 | V490-L497 HydrophobicContact CG1-CD2 3.97Å; V490-L497 HydrophobicContact CG2-CD2 4.14Å; L497-M501 HydrophobicContact CD2-CE 4.33Å; L497-M501 HydrophobicContact CD2-SD 3.92Å | ||
| 498 | S | 86.6 | Confident | 87.3 | Confident | 25 Ų | 25 | 72.6 Ų | 72.6 | 18% | 0.175 | 38% | 0.379 | C | S | . | . | trans | -75.2 | 138.2 | 177.7 | 175.9 | 0 | 0 | 0 | 0 | 111.5 | R486 P496 F500 M501 | R486-S498 PolarHBondContact NH2-OG 3.41Å; P496-S498 PolarHBondContact O-N 3.38Å; S498-F500 PolarHBondContact O-N 3.09Å; S498-F500 VanDerWaalsContact O-N 3.15Å; S498-F500 WeakPolarHBondContact OG-CD2 3.19Å; S498-F500 PolarHBondContact OG-N 3.21Å; S498-M501 WeakPolarHBondContact O-CB 3.47Å; S498-M501 PolarHBondContact O-N 2.73Å | ||
| 499 | I | 88.6 | Confident | 87 | Confident | 149 Ų | 149 | 71.1 Ų | 71.1 | 76% | 0.764 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -56.8 | -30.6 | 173.5 | -59.7 | 170.8 | 0 | 0 | 0 | 111 | M501 L502 K503 | I499-M501 VanDerWaalsContact C-N 3.28Å; I499-M501 PolarHBondContact O-N 3.48Å; I499-L502 WeakPolarHBondContact O-CB 3.27Å; I499-L502 PolarHBondContact O-N 3.07Å; I499-K503 PolarHBondContact O-N 3.44Å; I499-K503 VanDerWaalsContact O-N 3.09Å |
| 500 | F | 89.2 | Confident | 86.9 | Confident | 46 Ų | 46 | 73.5 Ų | 73.5 | 20% | 0.202 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -65.5 | -27.5 | 175.1 | -62.7 | -72.1 | 0 | 0 | 0 | 113.4 | L401 L404 D405 T408 S498 L502 K503 N504 | L401-F500 HydrophobicContact CD2-CE1 4.38Å; L404-F500 HydrophobicContact CB-CE1 4.04Å; L404-F500 HydrophobicContact CB-CZ 3.89Å; D405-F500 HydrophobicContact CB-CB 3.79Å; D405-F500 HydrophobicContact CB-CD1 3.81Å; D405-F500 HydrophobicContact CB-CD2 4.26Å; D405-F500 HydrophobicContact CB-CE1 4.45Å; D405-F500 HydrophobicContact CB-CG 3.71Å; D405-F500 VanDerWaalsContact OD1-CB 3.26Å; D405-F500 WeakPolarHBondContact OD1-CB 3.49Å; T408-F500 HydrophobicContact CG2-CE2 4.45Å; S498-F500 PolarHBondContact O-N 3.09Å; S498-F500 VanDerWaalsContact O-N 3.15Å; S498-F500 WeakPolarHBondContact OG-CD2 3.19Å; S498-F500 PolarHBondContact OG-N 3.21Å; F500-L502 VanDerWaalsContact C-N 3.33Å; F500-L502 PolarHBondContact O-N 3.28Å; F500-K503 WeakPolarHBondContact O-CB 3.36Å; F500-K503 PolarHBondContact O-N 3.42Å; F500-N504 PolarHBondContact O-N 3.21Å; F500-N504 PolarHBondContact O-ND2 3.11Å |
| 501 | M | 87.7 | Confident | 86.6 | Confident | 27 Ų | 27 | 73.7 Ų | 73.7 | 13% | 0.133 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -61.2 | -43.7 | 171.9 | -174.9 | -172.8 | -80.6 | 0 | 0 | 110.8 | L483 R486 C487 V490 L497 S498 I499 N504 L505 | L483-M501 HydrophobicContact CD1-CG 3.6Å; R486-M501 VanDerWaalsContact C-CE 3.45Å; R486-M501 HydrophobicContact CB-CB 4.41Å; R486-M501 HydrophobicContact CB-CE 3.74Å; R486-M501 HydrophobicContact CB-CG 4.49Å; R486-M501 WeakPolarHBondContact O-CE 3.3Å; C487-M501 HydrophobicContact CB-CE 4.49Å; V490-M501 HydrophobicContact CB-CE 4.33Å; V490-M501 HydrophobicContact CG2-CE 3.67Å; L497-M501 HydrophobicContact CD2-CE 4.33Å; L497-M501 HydrophobicContact CD2-SD 3.92Å; S498-M501 WeakPolarHBondContact O-CB 3.47Å; S498-M501 PolarHBondContact O-N 2.73Å; I499-M501 VanDerWaalsContact C-N 3.28Å; I499-M501 PolarHBondContact O-N 3.48Å; M501-N504 PolarHBondContact O-N 2.81Å; M501-L505 WeakPolarHBondContact O-CB 3.24Å; M501-L505 PolarHBondContact O-N 2.97Å |
| 502 | L | 87.8 | Confident | 86.3 | Confident | 121 Ų | 121 | 70.4 Ų | 70.4 | 63% | 0.634 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -66.4 | -38 | 176 | -176.3 | 62.3 | 0 | 0 | 0 | 111.6 | I499 F500 F506 | I499-L502 WeakPolarHBondContact O-CB 3.27Å; I499-L502 PolarHBondContact O-N 3.07Å; F500-L502 VanDerWaalsContact C-N 3.33Å; F500-L502 PolarHBondContact O-N 3.28Å; L502-F506 VanDerWaalsContact O-CB 3.24Å; L502-F506 WeakPolarHBondContact O-CB 3.48Å; L502-F506 PolarHBondContact O-N 3.45Å |
| 503 | K | 90.2 | Very high | 86.1 | Confident | 23 Ų | 23 | 71.7 Ų | 71.7 | 10% | 0.1 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -58.2 | -53.8 | 170.7 | -176.8 | -147.9 | 68.6 | 76.7 | 0 | 111 | L401 D402 D479 I499 F500 L505 F506 F507 | L401-K503 HydrophobicContact CB-CD 3.53Å; L401-K503 HydrophobicContact CD1-CD 3.88Å; L401-K503 HydrophobicContact CD1-CG 4.47Å; L401-K503 HydrophobicContact CG-CD 4.32Å; D402-K503 WeakPolarHBondContact OD1-CE 3.39Å; D402-K503 IonicContact OD1-NZ 3.94Å; D402-K503 PolarHBondContact OD1-NZ 3.05Å; D479-K503 IonicContact OD1-NZ 2.67Å; D479-K503 PolarHBondContact OD1-NZ 3.42Å; I499-K503 PolarHBondContact O-N 3.44Å; I499-K503 VanDerWaalsContact O-N 3.09Å; F500-K503 WeakPolarHBondContact O-CB 3.36Å; F500-K503 PolarHBondContact O-N 3.42Å; K503-L505 VanDerWaalsContact C-N 3.31Å; K503-L505 PolarHBondContact O-N 3.27Å; K503-F506 PolarHBondContact O-N 3.37Å; K503-F507 HydrophobicContact CG-CD2 3.65Å; K503-F507 HydrophobicContact CG-CE2 3.73Å; K503-F507 HydrophobicContact CG-CG 4.48Å; K503-F507 WeakPolarHBondContact O-CB 3.29Å; K503-F507 WeakPolarHBondContact O-CD2 3.31Å; K503-F507 PolarHBondContact O-N 3.47Å |
| 504 | N | 88.6 | Confident | 86.1 | Confident | 0 Ų | 0 | 73.1 Ų | 73.1 | 0% | 0 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -59 | -44.8 | -176.7 | -62.6 | -25.4 | 0 | 0 | 0 | 110.7 | D405 D479 L482 L483 F500 M501 L508 | D405-N504 PolarHBondContact OD2-ND2 3.15Å; D479-N504 HydrophobicContact CB-CB 4.49Å; D479-N504 WeakPolarHBondContact OD1-CA 3.47Å; D479-N504 PolarHBondContact OD1-OD1 2.76Å; L482-N504 WeakPolarHBondContact CB-ND2 3.37Å; L483-N504 HydrophobicContact CB-CB 3.95Å; L483-N504 HydrophobicContact CD1-CB 4.42Å; F500-N504 PolarHBondContact O-N 3.21Å; F500-N504 PolarHBondContact O-ND2 3.11Å; M501-N504 PolarHBondContact O-N 2.81Å; N504-L508 WeakPolarHBondContact O-CB 3.4Å; N504-L508 PolarHBondContact O-N 3.17Å |
| 505 | L | 89.3 | Confident | 85.9 | Confident | 100 Ų | 100 | 66.9 Ų | 66.9 | 52% | 0.524 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -62.7 | -44.9 | 176 | -176.5 | 63.5 | 0 | 0 | 0 | 112.7 | L483 M501 K503 G509 | L483-L505 HydrophobicContact CD2-CB 4.49Å; L483-L505 HydrophobicContact CD2-CD1 4.33Å; M501-L505 WeakPolarHBondContact O-CB 3.24Å; M501-L505 PolarHBondContact O-N 2.97Å; K503-L505 VanDerWaalsContact C-N 3.31Å; K503-L505 PolarHBondContact O-N 3.27Å; L505-G509 PolarHBondContact O-N 3.34Å |
| 506 | F | 89.3 | Confident | 85.7 | Confident | 128 Ų | 128 | 69.7 Ų | 69.7 | 56% | 0.561 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -65.9 | -48 | 179 | 179.9 | -99.3 | 0 | 0 | 0 | 112.2 | L502 K503 L508 G509 C510 | L502-F506 VanDerWaalsContact O-CB 3.24Å; L502-F506 WeakPolarHBondContact O-CB 3.48Å; L502-F506 PolarHBondContact O-N 3.45Å; K503-F506 PolarHBondContact O-N 3.37Å; F506-L508 PolarHBondContact O-N 2.73Å; F506-G509 PolarHBondContact O-N 3.26Å; F506-C510 PolarHBondContact O-N 3.26Å; F506-C510 PolarHBondContact O-SG 3.4Å; F506-C510 VanDerWaalsContact O-SG 3.38Å |
| 507 | F | 86.4 | Confident | 85.7 | Confident | 63 Ų | 63 | 70.9 Ų | 70.9 | 28% | 0.276 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -65.1 | -38.8 | 178.8 | -85.3 | -113.9 | 0 | 0 | 0 | 111.7 | K503 R511 | K503-F507 HydrophobicContact CG-CD2 3.65Å; K503-F507 HydrophobicContact CG-CE2 3.73Å; K503-F507 HydrophobicContact CG-CG 4.48Å; K503-F507 WeakPolarHBondContact O-CB 3.29Å; K503-F507 WeakPolarHBondContact O-CD2 3.31Å; K503-F507 PolarHBondContact O-N 3.47Å; F507-R511 WeakPolarHBondContact O-CG 3.37Å; F507-R511 PolarHBondContact O-N 3.24Å; F507-R511 VanDerWaalsContact O-N 3.07Å |
| 508 | L | 87.7 | Confident | 85.2 | Confident | 44 Ų | 44 | 65.1 Ų | 65.1 | 23% | 0.23 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -63.8 | -43.8 | 172.7 | -175.4 | 62.8 | 0 | 0 | 0 | 111.5 | C476 V480 L483 N504 F506 R511 G512 | C476-L508 HydrophobicContact CB-CD1 4.35Å; C476-L508 WeakPolarHBondContact SG-CD1 3.22Å; V480-L508 HydrophobicContact CG2-CD1 3.76Å; V480-L508 HydrophobicContact CG2-CD2 3.87Å; V480-L508 HydrophobicContact CG2-CG 4.49Å; L483-L508 HydrophobicContact CD2-CD2 4.13Å; N504-L508 WeakPolarHBondContact O-CB 3.4Å; N504-L508 PolarHBondContact O-N 3.17Å; F506-L508 PolarHBondContact O-N 2.73Å; L508-R511 PolarHBondContact O-N 3.37Å; L508-G512 PolarHBondContact O-N 3.28Å |
| 509 | G | 85.8 | Confident | 84.4 | Confident | 37 Ų | 37 | 68.2 Ų | 68.2 | 38% | 0.381 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -60.6 | -49.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | L505 F506 R511 G512 L513 | L505-G509 PolarHBondContact O-N 3.34Å; F506-G509 PolarHBondContact O-N 3.26Å; G509-R511 PolarHBondContact O-N 3.15Å; G509-G512 WeakPolarHBondContact O-CA 3.46Å; G509-G512 PolarHBondContact O-N 3.22Å; G509-G512 VanDerWaalsContact O-N 3.14Å; G509-L513 WeakPolarHBondContact O-CG 3.23Å; G509-L513 PolarHBondContact O-N 2.78Å |
| 510 | C | 85.7 | Confident | 83.6 | Confident | 51 Ų | 51 | 71 Ų | 71 | 35% | 0.345 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -60 | -43.8 | 176.7 | -69.7 | 0 | 0 | 0 | 0 | 112.4 | F506 G512 L513 E514 | F506-C510 PolarHBondContact O-N 3.26Å; F506-C510 PolarHBondContact O-SG 3.4Å; F506-C510 VanDerWaalsContact O-SG 3.38Å; C510-G512 VanDerWaalsContact C-N 3.34Å; C510-L513 PolarHBondContact O-N 3.33Å; C510-E514 PolarHBondContact O-N 2.92Å |
| 511 | R | 83.3 | Confident | 82.3 | Confident | 37 Ų | 37 | 74 Ų | 74 | 14% | 0.14 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -66.4 | -36.5 | 174.6 | -66 | -165.2 | -149.5 | 99.3 | -7.1 | 111.8 | L472 D479 F507 L508 G509 L513 E514 A515 | L472-R511 HydrophobicContact CD2-CB 4.02Å; L472-R511 WeakPolarHBondContact CD2-O 3.43Å; D479-R511 IonicContact OD2-CZ 2.8Å; D479-R511 IonicContact OD2-NH1 2.76Å; D479-R511 PolarHBondContact OD2-NH1 2.94Å; D479-R511 IonicContact OD2-NH2 2.8Å; D479-R511 PolarHBondContact OD2-NH2 2.86Å; F507-R511 WeakPolarHBondContact O-CG 3.37Å; F507-R511 PolarHBondContact O-N 3.24Å; F507-R511 VanDerWaalsContact O-N 3.07Å; L508-R511 PolarHBondContact O-N 3.37Å; G509-R511 PolarHBondContact O-N 3.15Å; R511-L513 VanDerWaalsContact C-N 3.33Å; R511-L513 PolarHBondContact O-N 3.22Å; R511-E514 PolarHBondContact O-N 2.98Å; R511-A515 PolarHBondContact O-N 3.34Å |
| 512 | G | 81.9 | Confident | 80.8 | Confident | 38 Ų | 38 | 80.3 Ų | 80.3 | 39% | 0.392 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -60.3 | -39.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | L508 G509 C510 A515 L516 | L508-G512 PolarHBondContact O-N 3.28Å; G509-G512 WeakPolarHBondContact O-CA 3.46Å; G509-G512 PolarHBondContact O-N 3.22Å; G509-G512 VanDerWaalsContact O-N 3.14Å; C510-G512 VanDerWaalsContact C-N 3.34Å; G512-A515 WeakPolarHBondContact O-CB 3.36Å; G512-A515 PolarHBondContact O-N 3.11Å; G512-L516 PolarHBondContact O-N 3.26Å |
| 513 | L | 83.8 | Confident | 79 | Confident | 102 Ų | 102 | 76.9 Ų | 76.9 | 53% | 0.534 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -66.6 | -46.9 | 173.4 | -69 | 169.3 | 0 | 0 | 0 | 111.7 | G509 C510 R511 A515 L516 E517 | G509-L513 WeakPolarHBondContact O-CG 3.23Å; G509-L513 PolarHBondContact O-N 2.78Å; C510-L513 PolarHBondContact O-N 3.33Å; R511-L513 VanDerWaalsContact C-N 3.33Å; R511-L513 PolarHBondContact O-N 3.22Å; L513-A515 PolarHBondContact O-N 3.09Å; L513-L516 PolarHBondContact O-N 2.99Å; L513-E517 WeakPolarHBondContact O-CG 3.46Å; L513-E517 PolarHBondContact O-N 3.2Å |
| 514 | E | 83 | Confident | 77 | Confident | 96 Ų | 96 | 80 Ų | 80 | 45% | 0.449 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -56.6 | -34.2 | 173 | -73.2 | -164.9 | -153 | 0 | 0 | 112.7 | R391 C510 R511 G518 | R391-E514 IonicContact CZ-OE1 2.86Å; R391-E514 IonicContact CZ-OE2 2.68Å; R391-E514 IonicContact NH2-OE1 3.81Å; R391-E514 PolarHBondContact NH2-OE1 3.32Å; R391-E514 IonicContact NH2-OE2 2.72Å; R391-E514 PolarHBondContact NH2-OE2 3.42Å; C510-E514 PolarHBondContact O-N 2.92Å; R511-E514 PolarHBondContact O-N 2.98Å; E514-G518 PolarHBondContact O-N 3.4Å; E514-G518 VanDerWaalsContact O-N 3.07Å |
| 515 | A | 77.8 | Confident | 75 | Confident | 28 Ų | 28 | 90.7 Ų | 90.7 | 23% | 0.231 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -67.6 | -44.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L472 R511 G512 L513 G518 C519 | L472-A515 HydrophobicContact CD1-CB 3.48Å; L472-A515 VanDerWaalsContact CD1-CB 3.48Å; L472-A515 HydrophobicContact CD2-CB 3.83Å; L472-A515 HydrophobicContact CG-CB 4.28Å; R511-A515 PolarHBondContact O-N 3.34Å; G512-A515 WeakPolarHBondContact O-CB 3.36Å; G512-A515 PolarHBondContact O-N 3.11Å; L513-A515 PolarHBondContact O-N 3.09Å; A515-G518 PolarHBondContact O-N 3.19Å; A515-C519 PolarHBondContact O-N 2.93Å; A515-C519 PolarHBondContact O-SG 2.86Å |
| 516 | L | 80.7 | Confident | 72.7 | Confident | 113 Ų | 113 | 89.3 Ų | 89.3 | 59% | 0.592 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -67.3 | -48.7 | -177.4 | -170.8 | 67.3 | 0 | 0 | 0 | 111.3 | G512 L513 G518 C519 W520 | G512-L516 PolarHBondContact O-N 3.26Å; L513-L516 PolarHBondContact O-N 2.99Å; L516-G518 VanDerWaalsContact C-N 3.31Å; L516-G518 PolarHBondContact O-N 3.48Å; L516-C519 PolarHBondContact O-N 2.96Å; L516-C519 VanDerWaalsContact O-N 3.13Å; L516-W520 PolarHBondContact O-N 3.34Å |
| 517 | E | 82.6 | Confident | 70 | Confident | 128 Ų | 128 | 87.3 Ų | 87.3 | 60% | 0.598 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -54.2 | -49 | 170.9 | -69.8 | 173.1 | 179.3 | 0 | 0 | 110.7 | L513 C519 W520 D521 | L513-E517 WeakPolarHBondContact O-CG 3.46Å; L513-E517 PolarHBondContact O-N 3.2Å; E517-C519 PolarHBondContact O-N 3.08Å; E517-C519 VanDerWaalsContact O-N 3.14Å; E517-W520 PolarHBondContact O-N 3.47Å; E517-W520 VanDerWaalsContact O-N 3.08Å; E517-D521 PolarHBondContact O-N 3.28Å |
| 518 | G | 73.4 | Confident | 67.9 | Low | 12 Ų | 12 | 90.3 Ų | 90.3 | 12% | 0.124 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -62.9 | -20.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | R468 E514 A515 L516 | R468-G518 PolarHBondContact NH1-O 3.06Å; E514-G518 PolarHBondContact O-N 3.4Å; E514-G518 VanDerWaalsContact O-N 3.07Å; A515-G518 PolarHBondContact O-N 3.19Å; L516-G518 VanDerWaalsContact C-N 3.31Å; L516-G518 PolarHBondContact O-N 3.48Å |
| 519 | C | 70.8 | Confident | 65.5 | Low | 89 Ų | 89 | 93.3 Ų | 93.3 | 60% | 0.601 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -88.4 | -40.3 | 171.1 | -67.3 | 0 | 0 | 0 | 0 | 112 | A515 L516 E517 R522 G523 | A515-C519 PolarHBondContact O-N 2.93Å; A515-C519 PolarHBondContact O-SG 2.86Å; L516-C519 PolarHBondContact O-N 2.96Å; L516-C519 VanDerWaalsContact O-N 3.13Å; E517-C519 PolarHBondContact O-N 3.08Å; E517-C519 VanDerWaalsContact O-N 3.14Å; C519-R522 WeakPolarHBondContact O-CA 3.49Å; C519-R522 WeakPolarHBondContact O-CB 3.44Å; C519-R522 PolarHBondContact O-N 3.47Å; C519-G523 PolarHBondContact O-N 3.37Å |
| 520 | W | 70.6 | Confident | 63.5 | Low | 208 Ų | 208 | 103.3 Ų | 103.3 | 79% | 0.788 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -61.3 | -45.4 | 178.7 | -163.4 | -96.4 | 0 | 0 | 0 | 112 | L516 E517 R522 G523 S524 | L516-W520 PolarHBondContact O-N 3.34Å; E517-W520 PolarHBondContact O-N 3.47Å; E517-W520 VanDerWaalsContact O-N 3.08Å; W520-R522 PolarHBondContact O-N 3.06Å; W520-R522 VanDerWaalsContact O-N 3.15Å; W520-G523 PolarHBondContact O-N 3.38Å; W520-S524 PolarHBondContact O-N 3.14Å |
| 521 | D | 61.3 | Low | 61 | Low | 110 Ų | 110 | 105.3 Ų | 105.3 | 59% | 0.588 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -59.4 | -23.1 | 172.2 | -91.7 | -7.2 | 0 | 0 | 0 | 113.9 | E517 S524 | E517-D521 PolarHBondContact O-N 3.28Å; D521-S524 PolarHBondContact O-OG 2.82Å |
| 522 | R | 56.2 | Low | 58.7 | Low | 158 Ų | 158 | 115.7 Ų | 115.7 | 60% | 0.596 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -87 | -32 | 176.8 | -162.2 | 172.7 | -177.4 | -173.6 | -5.8 | 111.6 | S465 C519 W520 A526 | S465-R522 PolarHBondContact OG-NH1 3.45Å; S465-R522 VanDerWaalsContact OG-NH1 3.16Å; C519-R522 WeakPolarHBondContact O-CA 3.49Å; C519-R522 WeakPolarHBondContact O-CB 3.44Å; C519-R522 PolarHBondContact O-N 3.47Å; W520-R522 PolarHBondContact O-N 3.06Å; W520-R522 VanDerWaalsContact O-N 3.15Å; R522-A526 WeakPolarHBondContact O-CB 3.42Å; R522-A526 PolarHBondContact O-N 3.47Å |
| 523 | G | 50.5 | Low | 56.1 | Low | 50 Ų | 50 | 117.5 Ų | 117.5 | 52% | 0.515 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -64.8 | -47.1 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | C519 W520 R525 A526 | C519-G523 PolarHBondContact O-N 3.37Å; W520-G523 PolarHBondContact O-N 3.38Å; G523-R525 VanDerWaalsContact C-N 3.26Å; G523-R525 PolarHBondContact O-N 3.38Å; G523-A526 PolarHBondContact O-N 3.41Å |
| 524 | S | 48.8 | Very low | 53.9 | Low | 88 Ų | 88 | 115.7 Ų | 115.7 | 62% | 0.615 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -62.1 | -31.1 | 179.2 | 65.3 | 0 | 0 | 0 | 0 | 113.5 | W520 D521 | W520-S524 PolarHBondContact O-N 3.14Å; D521-S524 PolarHBondContact O-OG 2.82Å |
| 525 | R | 46 | Very low | 51.6 | Low | 225 Ų | 225 | 122.8 Ų | 122.8 | 85% | 0.849 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.8 | -0.7 | 175.9 | -153.7 | 177.4 | -68.1 | -149.6 | -1.2 | 114 | G523 S527 | G523-R525 VanDerWaalsContact C-N 3.26Å; G523-R525 PolarHBondContact O-N 3.38Å; R525-S527 PolarHBondContact O-N 3.22Å |
| 526 | A | 41 | Very low | 49.4 | Very low | 71 Ų | 71 | 125.2 Ų | 125.2 | 59% | 0.587 | 69% | 0.691 | S | S | * | * | trans | -96 | 32.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | R522 G523 P528 | R522-A526 WeakPolarHBondContact O-CB 3.42Å; R522-A526 PolarHBondContact O-N 3.47Å; G523-A526 PolarHBondContact O-N 3.41Å; A526-P528 WeakPolarHBondContact O-CD 3.46Å | ||
| 527 | S | 33.1 | Very low | 47.6 | Very low | 86 Ų | 86 | 124.2 Ų | 124.2 | 60% | 0.601 | 70% | 0.698 | S | S | * | * | trans | -71.1 | 123.9 | 171.4 | -173 | 0 | 0 | 0 | 0 | 110.5 | R525 S529 | R525-S527 PolarHBondContact O-N 3.22Å; S527-S529 PolarHBondContact O-N 3.24Å | ||
| 528 | P | 41.4 | Very low | 45.6 | Very low | 125 Ų | 125 | 123.6 Ų | 123.6 | 81% | 0.812 | 71% | 0.706 | S | S | * | * | trans | -81.1 | 42.2 | -173.3 | 34 | -36.8 | 0 | 0 | 0 | 113.6 | A526 R530 | A526-P528 WeakPolarHBondContact O-CD 3.46Å; P528-R530 PolarHBondContact O-N 3.2Å | ||
| 529 | S | 38.3 | Very low | 44 | Very low | 108 Ų | 108 | 129.2 Ų | 129.2 | 76% | 0.755 | 74% | 0.74 | S | S | * | * | trans | -81 | 41.9 | -177.8 | 54.5 | 0 | 0 | 0 | 0 | 114.1 | S527 | S527-S529 PolarHBondContact O-N 3.24Š| ||
| 530 | R | 43.2 | Very low | 42.4 | Very low | 247 Ų | 247 | 130.5 Ų | 130.5 | 93% | 0.932 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -142.5 | 38.6 | 176.5 | -137.4 | -178.7 | -158.3 | -170.9 | 6.6 | 116.5 | P528 | P528-R530 PolarHBondContact O-N 3.2Š|
| 531 | A | 33.6 | Very low | 41.3 | Very low | 93 Ų | 93 | 124.8 Ų | 124.8 | 77% | 0.769 | 75% | 0.747 | S | S | * | * | S | Bend | trans | -151.2 | 138.3 | 156 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 532 | R | 34 | Very low | 40.7 | Very low | 254 Ų | 254 | 125.2 Ų | 125.2 | 96% | 0.958 | 76% | 0.756 | S | S | * | * | trans | 74.9 | 92.8 | 167.5 | -150.7 | 173.2 | -141.2 | -173.8 | 4.9 | 117.6 | ||||
| 533 | G | 28.3 | Very low | 40.4 | Very low | 77 Ų | 77 | 123.2 Ų | 123.2 | 79% | 0.794 | 76% | 0.763 | S | S | * | * | trans | -166.7 | 70 | 169.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 534 | G | 37.7 | Very low | 40.5 | Very low | 63 Ų | 63 | 126.3 Ų | 126.3 | 65% | 0.649 | 77% | 0.774 | S | S | * | * | trans | -87.9 | 161.7 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 535 | Y | 35.1 | Very low | 40.8 | Very low | 246 Ų | 246 | 127.9 Ų | 127.9 | 97% | 0.965 | 78% | 0.782 | S | S | * | * | trans | 72.3 | 144.5 | -170.8 | -50.3 | -74.1 | 0 | 0 | 0 | 115.1 | ||||
| 536 | G | 31.8 | Very low | 40.9 | Very low | 79 Ų | 79 | 122.9 Ų | 122.9 | 81% | 0.814 | 78% | 0.779 | S | S | * | * | trans | 104.6 | 88 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 537 | A | 41.5 | Very low | 41.5 | Very low | 91 Ų | 91 | 124.9 Ų | 124.9 | 75% | 0.752 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 148.7 | 152.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||
| 538 | P | 42.1 | Very low | 42.2 | Very low | 116 Ų | 116 | 126.4 Ų | 126.4 | 75% | 0.753 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 139.1 | 177 | 27.5 | -34.3 | 0 | 0 | 0 | 110.4 | S540 | P538-S540 PolarHBondContact O-N 3.42Š|
| 539 | P | 38.8 | Very low | 42.1 | Very low | 129 Ų | 129 | 126.6 Ų | 126.6 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 129.2 | 178.2 | 27.2 | -33.7 | 0 | 0 | 0 | 110.7 | ||
| 540 | S | 37 | Very low | 42 | Very low | 116 Ų | 116 | 130.8 Ų | 130.8 | 81% | 0.811 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 149.2 | 175 | -53.5 | 0 | 0 | 0 | 0 | 111.7 | P538 | P538-S540 PolarHBondContact O-N 3.42Š|
| 541 | A | 46.8 | Very low | 41.4 | Very low | 88 Ų | 88 | 123 Ų | 123 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 150.4 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 542 | P | 48.4 | Very low | 41.3 | Very low | 119 Ų | 119 | 122.3 Ų | 122.3 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 143.3 | 177.8 | 26.9 | -34.9 | 0 | 0 | 0 | 111.4 | ||
| 543 | P | 51.2 | Low | 41.1 | Very low | 117 Ų | 117 | 115 Ų | 115 | 76% | 0.76 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 149.7 | -179.4 | 29.8 | -35.2 | 0 | 0 | 0 | 112.1 | ||
| 544 | P | 53 | Low | 41.3 | Very low | 115 Ų | 115 | 120 Ų | 120 | 75% | 0.747 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -69 | 157.7 | 172.3 | 30.6 | -35.4 | 0 | 0 | 0 | 111.8 | ||
| 545 | P | 53.8 | Low | 40.9 | Very low | 120 Ų | 120 | 124.4 Ų | 124.4 | 78% | 0.779 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 152.3 | 177.8 | 28.6 | -35.5 | 0 | 0 | 0 | 112.4 | ||
| 546 | P | 49.4 | Very low | 40.7 | Very low | 120 Ų | 120 | 115.8 Ų | 115.8 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 139.7 | -174.7 | 29.7 | -35.2 | 0 | 0 | 0 | 112.9 | ||
| 547 | P | 53.5 | Low | 40.5 | Very low | 114 Ų | 114 | 120.4 Ų | 120.4 | 74% | 0.74 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 157.9 | 167.7 | 32.2 | -34.5 | 0 | 0 | 0 | 111.7 | ||
| 548 | P | 46.9 | Very low | 40.1 | Very low | 117 Ų | 117 | 121.7 Ų | 121.7 | 76% | 0.76 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 154.4 | 178.9 | 29.7 | -35.8 | 0 | 0 | 0 | 112.7 | Q550 | P548-Q550 PolarHBondContact O-N 3.47Š|
| 549 | P | 39.3 | Very low | 39.4 | Very low | 129 Ų | 129 | 123.3 Ų | 123.3 | 84% | 0.838 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 121.5 | -172.6 | 31 | -34.5 | 0 | 0 | 0 | 112.9 | ||
| 550 | Q | 37.4 | Very low | 39.1 | Very low | 197 Ų | 197 | 122.5 Ų | 122.5 | 92% | 0.921 | 79% | 0.786 | S | S | * | * | trans | -133 | 133.4 | 156.4 | -67.8 | -171.5 | -10.6 | 0 | 0 | 108.4 | P548 | P548-Q550 PolarHBondContact O-N 3.47Š| ||
| 551 | G | 30.6 | Very low | 38.7 | Very low | 84 Ų | 84 | 126.1 Ų | 126.1 | 87% | 0.866 | 79% | 0.79 | S | S | * | * | trans | -93.1 | 153.4 | -173.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 552 | G | 30.2 | Very low | 38 | Very low | 78 Ų | 78 | 128.8 Ų | 128.8 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | trans | 177.5 | 99 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 553 | S | 31 | Very low | 37.1 | Very low | 101 Ų | 101 | 132.1 Ų | 132.1 | 71% | 0.706 | 80% | 0.798 | S | S | * | * | trans | -39.8 | 151.7 | 169.4 | 52 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 554 | Q | 31.7 | Very low | 36.2 | Very low | 182 Ų | 182 | 130.2 Ų | 130.2 | 85% | 0.85 | 80% | 0.799 | S | S | * | * | trans | 71.7 | 166.6 | 150.8 | -70.1 | 173.2 | 34.1 | 0 | 0 | 118.9 | ||||
| 555 | L | 29.8 | Very low | 35 | Very low | 154 Ų | 154 | 128.8 Ų | 128.8 | 81% | 0.806 | 81% | 0.805 | S | S | * | * | cis | -168.4 | 119.4 | -40.9 | -176.6 | 147.2 | 0 | 0 | 0 | 108.2 | ||||
| 556 | G | 29.5 | Very low | 34.1 | Very low | 65 Ų | 65 | 127.2 Ų | 127.2 | 67% | 0.67 | 80% | 0.802 | S | S | * | * | trans | 51.2 | 128 | 157.5 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 557 | H | 28.9 | Very low | 33.5 | Very low | 176 Ų | 176 | 130.9 Ų | 130.9 | 82% | 0.815 | 81% | 0.809 | S | S | * | * | -160 | 144.2 | 123.6 | -128.9 | -78.2 | 0 | 0 | 0 | 112.3 | |||||
| 558 | C | 32.2 | Very low | 32.6 | Very low | 119 Ų | 119 | 128.6 Ų | 128.6 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -101.6 | 140.2 | 157 | -62.1 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 559 | I | 28.1 | Very low | 31.8 | Very low | 150 Ų | 150 | 134.3 Ų | 134.3 | 77% | 0.769 | 81% | 0.814 | S | S | * | * | trans | -157.3 | 154.4 | 156.3 | -100.9 | 147.8 | 0 | 0 | 0 | 106.7 | ||||
| 560 | S | 32.8 | Very low | 31.7 | Very low | 112 Ų | 112 | 134.6 Ų | 134.6 | 78% | 0.783 | 81% | 0.813 | S | S | * | * | trans | -134.4 | 127.9 | -173.6 | 151 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 561 | E | 28.6 | Very low | 31.5 | Very low | 191 Ų | 191 | 132.1 Ų | 132.1 | 89% | 0.893 | 81% | 0.806 | S | S | * | * | trans | -130 | 158.6 | 167.8 | -67.5 | -162 | 122.7 | 0 | 0 | 111.7 | ||||
| 562 | N | 31.6 | Very low | 31.9 | Very low | 145 Ų | 145 | 134.1 Ų | 134.1 | 78% | 0.775 | 80% | 0.802 | S | S | * | * | trans | -134.1 | 126 | -162.8 | 150.4 | 100.6 | 0 | 0 | 0 | 109.9 | ||||
| 563 | E | 30.8 | Very low | 32.2 | Very low | 189 Ų | 189 | 138.3 Ų | 138.3 | 88% | 0.883 | 81% | 0.805 | S | S | * | * | trans | -177.5 | 158.4 | 153.6 | -104.8 | 163.8 | -167.1 | 0 | 0 | 107.1 | ||||
| 564 | G | 31.3 | Very low | 32.5 | Very low | 77 Ų | 77 | 138.2 Ų | 138.2 | 79% | 0.794 | 81% | 0.81 | S | S | * | * | cis | 150.3 | 102.3 | 0.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 565 | G | 27.9 | Very low | 32.7 | Very low | 85 Ų | 85 | 136.1 Ų | 136.1 | 88% | 0.876 | 81% | 0.81 | S | S | * | * | trans | 170.4 | 146.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 566 | A | 35.4 | Very low | 33 | Very low | 87 Ų | 87 | 133.7 Ų | 133.7 | 72% | 0.719 | 81% | 0.812 | S | S | * | * | trans | -123.7 | 171.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 567 | H | 36.5 | Very low | 33.3 | Very low | 196 Ų | 196 | 135.3 Ų | 135.3 | 91% | 0.907 | 81% | 0.813 | S | S | * | * | trans | 80.1 | 132.5 | -178 | -54.5 | -84.5 | 0 | 0 | 0 | 116.2 | ||||
| 568 | G | 33.6 | Very low | 33.6 | Very low | 67 Ų | 67 | 135.3 Ų | 135.3 | 69% | 0.691 | 81% | 0.813 | S | S | * | * | trans | 175.6 | 59.7 | -175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | V570 | G568-V570 PolarHBondContact O-N 2.84Š| ||
| 569 | Y | 31.6 | Very low | 33.7 | Very low | 237 Ų | 237 | 140.6 Ų | 140.6 | 93% | 0.929 | 83% | 0.833 | S | S | * | * | trans | -66 | 114 | 168.2 | -97.6 | -94.2 | 0 | 0 | 0 | 108.8 | ||||
| 570 | V | 36 | Very low | 34 | Very low | 135 Ų | 135 | 140.1 Ų | 140.1 | 82% | 0.818 | 84% | 0.836 | S | S | * | * | trans | -102.7 | 107.7 | 171.1 | -177.9 | 0 | 0 | 0 | 0 | 108.6 | G568 | G568-V570 PolarHBondContact O-N 2.84Š| ||
| 571 | N | 33.1 | Very low | 34 | Very low | 144 Ų | 144 | 141.6 Ų | 141.6 | 77% | 0.77 | 84% | 0.839 | S | S | * | * | trans | -89.8 | 125.2 | -178.6 | -155.9 | 7.5 | 0 | 0 | 0 | 109.5 | L573 | N571-L573 PolarHBondContact O-N 3.47Š| ||
| 572 | T | 40 | Very low | 34.3 | Very low | 127 Ų | 127 | 138.8 Ų | 138.8 | 78% | 0.779 | 84% | 0.836 | S | S | * | * | trans | -82.1 | 86.9 | -172.1 | 50.7 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 573 | L | 35.8 | Very low | 34.5 | Very low | 165 Ų | 165 | 138.5 Ų | 138.5 | 86% | 0.864 | 84% | 0.84 | S | S | * | * | trans | -136.8 | 103.3 | 161.9 | -77.2 | 178.6 | 0 | 0 | 0 | 110.5 | N571 | N571-L573 PolarHBondContact O-N 3.47Š| ||
| 574 | A | 36.8 | Very low | 34.7 | Very low | 99 Ų | 99 | 135.3 Ų | 135.3 | 82% | 0.818 | 84% | 0.837 | S | S | * | * | trans | -127.8 | 119 | 163.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 575 | V | 36.8 | Very low | 35 | Very low | 138 Ų | 138 | 139.2 Ų | 139.2 | 84% | 0.836 | 84% | 0.84 | S | S | * | * | trans | -75.7 | 132.4 | 177.7 | 172.6 | 0 | 0 | 0 | 0 | 109 | ||||
| 576 | A | 35.2 | Very low | 35.5 | Very low | 104 Ų | 104 | 143.1 Ų | 143.1 | 86% | 0.86 | 84% | 0.837 | S | S | * | * | trans | -121.7 | 89.7 | 170.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 577 | S | 37.2 | Very low | 35.5 | Very low | 99 Ų | 99 | 147.4 Ų | 147.4 | 69% | 0.692 | 85% | 0.847 | S | S | * | * | trans | -86.6 | 107.1 | 172.6 | 52 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 578 | H | 34 | Very low | 35.4 | Very low | 176 Ų | 176 | 143.3 Ų | 143.3 | 82% | 0.815 | 84% | 0.841 | S | S | * | * | trans | -165.6 | 98.4 | 150.8 | -123 | -75.6 | 0 | 0 | 0 | 113.5 | ||||
| 579 | N | 34.4 | Very low | 35.5 | Very low | 229 Ų | 229 | 150.3 Ų | 150.3 | 100% | 1.225 | 86% | 0.855 | S | S | * | * | -179 | 0 | 120 | -91.6 | -11.4 | 0 | 0 | 0 | 109.8 |
Retrieved 579 of 579 residues in 937.9 ms
(Link to these results)