| 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 | 39.4 | Very low | 42 | Very low | 232 Ų | 232 | 153.4 Ų | 153.4 | 100% | 1.143 | 82% | 0.816 | S | S | * | * | 0 | 156.8 | 0 | -68.1 | 154.5 | -178.5 | 0 | 0 | 106.9 | |||||
| 2 | E | 39 | Very low | 41.9 | Very low | 165 Ų | 165 | 156.7 Ų | 156.7 | 77% | 0.771 | 82% | 0.823 | S | S | * | * | trans | -17.6 | 129.4 | -161.5 | -67.8 | 100.1 | 109 | 0 | 0 | 118.6 | ||||
| 3 | L | 41.9 | Very low | 41.3 | Very low | 150 Ų | 150 | 148.9 Ų | 148.9 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | 66.2 | 105.4 | 59 | -66.5 | 178.8 | 0 | 0 | 0 | 114.6 | |||||
| 4 | T | 43.8 | Very low | 40.9 | Very low | 120 Ų | 120 | 148.4 Ų | 148.4 | 74% | 0.736 | 81% | 0.808 | S | S | * | * | trans | 33.9 | 128.5 | 135.3 | 58.9 | 0 | 0 | 0 | 0 | 120 | ||||
| 5 | M | 47.1 | Very low | 40.6 | Very low | 169 Ų | 169 | 145.8 Ų | 145.8 | 83% | 0.833 | 81% | 0.805 | S | S | * | * | -168.3 | 138.8 | 94.9 | -100.8 | -175.8 | 74.8 | 0 | 0 | 112.6 | |||||
| 6 | E | 51.8 | Low | 40.5 | Very low | 171 Ų | 171 | 147.9 Ų | 147.9 | 80% | 0.799 | 81% | 0.806 | S | S | * | * | trans | -79.6 | 153.4 | 154 | -60.9 | 171 | 118.9 | 0 | 0 | 108.3 | ||||
| 7 | N | 40.2 | Very low | 40.4 | Very low | 153 Ų | 153 | 144.1 Ų | 144.1 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -128.6 | 143.2 | 167.1 | -170.6 | 37.6 | 0 | 0 | 0 | 111.2 | ||||
| 8 | I | 42.8 | Very low | 40.4 | Very low | 148 Ų | 148 | 144.7 Ų | 144.7 | 76% | 0.759 | 79% | 0.789 | S | S | * | * | trans | -125 | 131.1 | -161.2 | -59.6 | 171.3 | 0 | 0 | 0 | 110.2 | ||||
| 9 | G | 36.4 | Very low | 40.4 | Very low | 66 Ų | 66 | 145.1 Ų | 145.1 | 68% | 0.68 | 79% | 0.785 | S | S | * | * | trans | 74.6 | -173.6 | 165.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 10 | N | 34.1 | Very low | 40.2 | Very low | 160 Ų | 160 | 144.1 Ų | 144.1 | 86% | 0.856 | 78% | 0.784 | S | S | * | * | cis | -144.4 | 166.7 | -1.6 | -160.4 | 17.3 | 0 | 0 | 0 | 112.6 | ||||
| 11 | L | 45.3 | Very low | 40 | Very low | 153 Ų | 153 | 140.5 Ų | 140.5 | 80% | 0.801 | 78% | 0.781 | S | S | * | * | trans | -62.6 | 146.4 | 174.1 | -141.4 | 75.2 | 0 | 0 | 0 | 111.8 | ||||
| 12 | H | 40.6 | Very low | 39.8 | Very low | 193 Ų | 193 | 136.5 Ų | 136.5 | 89% | 0.894 | 76% | 0.764 | S | S | * | * | trans | -144.9 | 153.9 | 160.5 | -132.3 | -100.5 | 0 | 0 | 0 | 110.5 | ||||
| 13 | G | 34.3 | Very low | 39.7 | Very low | 56 Ų | 56 | 135.1 Ų | 135.1 | 58% | 0.577 | 76% | 0.761 | S | S | * | * | trans | -169.6 | -151.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 14 | V | 35.4 | Very low | 39.4 | Very low | 142 Ų | 142 | 136.2 Ų | 136.2 | 86% | 0.861 | 76% | 0.764 | S | S | * | * | trans | 84.1 | 103.2 | 178.4 | -169.3 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 15 | S | 36.9 | Very low | 38.7 | Very low | 109 Ų | 109 | 138.1 Ų | 138.1 | 76% | 0.762 | 77% | 0.77 | S | S | * | * | trans | -30.6 | 160.7 | 154.1 | -40 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 16 | H | 39 | Very low | 38.2 | Very low | 179 Ų | 179 | 133.5 Ų | 133.5 | 83% | 0.829 | 76% | 0.759 | S | S | * | * | trans | -178.7 | 159.3 | 137.4 | -99.1 | -76.7 | 0 | 0 | 0 | 109.1 | ||||
| 17 | S | 38.1 | Very low | 38.5 | Very low | 83 Ų | 83 | 130.1 Ų | 130.1 | 58% | 0.58 | 75% | 0.752 | S | S | * | * | cis | -175 | 175.1 | -41.7 | 53.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 18 | H | 40.6 | Very low | 38.4 | Very low | 155 Ų | 155 | 131.4 Ų | 131.4 | 72% | 0.718 | 75% | 0.752 | S | S | * | * | trans | 76.1 | 149.2 | 166.1 | -82.1 | -153.7 | 0 | 0 | 0 | 118.3 | ||||
| 19 | Q | 40.2 | Very low | 37.8 | Very low | 152 Ų | 152 | 128.9 Ų | 128.9 | 71% | 0.71 | 75% | 0.754 | S | S | * | * | cis | -152 | 166.7 | -1.4 | -134.4 | 167.4 | -14.8 | 0 | 0 | 114.4 | ||||
| 20 | T | 37.1 | Very low | 37.8 | Very low | 126 Ų | 126 | 136.2 Ų | 136.2 | 77% | 0.773 | 76% | 0.761 | S | S | * | * | trans | -19.2 | 159.1 | 160.1 | 52.4 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 21 | G | 36.8 | Very low | 37.9 | Very low | 69 Ų | 69 | 136 Ų | 136 | 71% | 0.711 | 76% | 0.755 | S | S | * | * | cis | 140.2 | 174.3 | 14.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 22 | D | 34 | Very low | 37.3 | Very low | 148 Ų | 148 | 133 Ų | 133 | 79% | 0.791 | 75% | 0.747 | S | S | * | * | cis | -169.8 | -179.3 | -13.4 | -142.1 | -64.8 | 0 | 0 | 0 | 111.5 | ||||
| 23 | L | 36.9 | Very low | 37.1 | Very low | 136 Ų | 136 | 129.2 Ų | 129.2 | 71% | 0.712 | 74% | 0.742 | S | S | * | * | trans | 65.6 | 117.1 | 159 | -65.6 | 172.3 | 0 | 0 | 0 | 124.2 | ||||
| 24 | M | 36 | Very low | 37.1 | Very low | 172 Ų | 172 | 131.1 Ų | 131.1 | 85% | 0.847 | 75% | 0.752 | S | S | * | * | 86.8 | 138.6 | 128.1 | -67 | -70 | -172.8 | 0 | 0 | 125.5 | |||||
| 25 | N | 29.8 | Very low | 37 | Very low | 160 Ų | 160 | 128.9 Ų | 128.9 | 86% | 0.856 | 74% | 0.743 | S | S | * | * | trans | 95.5 | 153.9 | 144.5 | -147.3 | 23.7 | 0 | 0 | 0 | 122.3 | ||||
| 26 | A | 35.8 | Very low | 36.9 | Very low | 73 Ų | 73 | 131.6 Ų | 131.6 | 60% | 0.603 | 74% | 0.743 | S | S | * | * | trans | -141.1 | -159.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 27 | P | 59 | Low | 36.8 | Very low | 99 Ų | 99 | 133.5 Ų | 133.5 | 64% | 0.643 | 74% | 0.743 | S | S | * | * | cis | -134.1 | -165.7 | -16.7 | 25.5 | 1.1 | 0 | 0 | 0 | 114.1 | ||||
| 28 | H | 37.7 | Very low | 36.5 | Very low | 180 Ų | 180 | 135.9 Ų | 135.9 | 83% | 0.833 | 75% | 0.749 | S | S | * | * | trans | 75 | 117.1 | 155.3 | -60.8 | -53.5 | 0 | 0 | 0 | 124.1 | ||||
| 29 | A | 30.5 | Very low | 36.2 | Very low | 96 Ų | 96 | 135.7 Ų | 135.7 | 79% | 0.793 | 75% | 0.753 | S | S | * | * | -179 | 135 | 124.9 | 0 | 0 | 0 | 0 | 0 | 108 | |||||
| 30 | R | 34.9 | Very low | 36 | Very low | 219 Ų | 219 | 134.6 Ų | 134.6 | 83% | 0.826 | 76% | 0.756 | S | S | * | * | 53.5 | 134.2 | 61.5 | -83.8 | -171.2 | 165.8 | -160.9 | -2 | 113.1 | |||||
| 31 | Q | 37.6 | Very low | 35.7 | Very low | 156 Ų | 156 | 133.2 Ų | 133.2 | 73% | 0.729 | 75% | 0.752 | S | S | * | * | cis | -154.5 | -176.2 | 23.5 | -127.4 | 162.2 | 16.7 | 0 | 0 | 109.3 | ||||
| 32 | S | 32.7 | Very low | 35.7 | Very low | 91 Ų | 91 | 139 Ų | 139 | 64% | 0.636 | 76% | 0.76 | S | S | * | * | cis | -163.9 | 161 | 9.4 | 45 | 0 | 0 | 0 | 0 | 113 | ||||
| 33 | S | 35.6 | Very low | 35.5 | Very low | 112 Ų | 112 | 135.8 Ų | 135.8 | 78% | 0.783 | 76% | 0.762 | S | S | * | * | trans | 62.3 | 142.3 | 147 | 54.2 | 0 | 0 | 0 | 0 | 121 | ||||
| 34 | A | 34.8 | Very low | 35.6 | Very low | 96 Ų | 96 | 141 Ų | 141 | 79% | 0.793 | 77% | 0.772 | S | S | * | * | cis | -147.5 | 161.4 | 5.8 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 35 | S | 34 | Very low | 35.4 | Very low | 96 Ų | 96 | 138.9 Ų | 138.9 | 67% | 0.671 | 77% | 0.774 | S | S | * | * | trans | -39.3 | 167.4 | 162.7 | -48.6 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 36 | H | 34.8 | Very low | 35.7 | Very low | 165 Ų | 165 | 135.8 Ų | 135.8 | 76% | 0.764 | 77% | 0.77 | S | S | * | * | cis | -145.1 | 153.7 | 33.3 | -75.5 | -97.8 | 0 | 0 | 0 | 111.6 | ||||
| 37 | R | 35.8 | Very low | 35.8 | Very low | 219 Ų | 219 | 141.6 Ų | 141.6 | 83% | 0.826 | 79% | 0.788 | S | S | * | * | 36.1 | 138.4 | 88.1 | -67 | -172.9 | 177.4 | 175.2 | -1.2 | 114 | |||||
| 38 | N | 31.7 | Very low | 34.7 | Very low | 134 Ų | 134 | 143.4 Ų | 143.4 | 72% | 0.717 | 80% | 0.796 | S | S | * | * | cis | -162.4 | -178.5 | 6.5 | -107.7 | 12.8 | 0 | 0 | 0 | 107.2 | ||||
| 39 | L | 33.8 | Very low | 34.5 | Very low | 151 Ų | 151 | 140.1 Ų | 140.1 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | cis | -151.7 | -138 | 6.3 | -137.5 | 171.7 | 0 | 0 | 0 | 110.5 | ||||
| 40 | V | 36.4 | Very low | 34.7 | Very low | 129 Ų | 129 | 139.5 Ų | 139.5 | 78% | 0.782 | 78% | 0.784 | S | S | * | * | trans | -137.2 | 146.6 | 177 | 164.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 41 | S | 30.5 | Very low | 34.7 | Very low | 97 Ų | 97 | 136.8 Ų | 136.8 | 68% | 0.678 | 78% | 0.782 | S | S | * | * | 158.1 | 131.1 | 129.2 | -164.8 | 0 | 0 | 0 | 0 | 115.9 | |||||
| 42 | H | 37.1 | Very low | 34.6 | Very low | 190 Ų | 190 | 133.2 Ų | 133.2 | 88% | 0.88 | 78% | 0.78 | S | S | * | * | trans | 47.3 | 133.1 | 150.3 | -72.9 | 80.4 | 0 | 0 | 0 | 124.1 | ||||
| 43 | G | 30.1 | Very low | 34.7 | Very low | 81 Ų | 81 | 134 Ų | 134 | 84% | 0.835 | 79% | 0.785 | S | S | * | * | trans | -174.8 | 122.3 | 156.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 44 | R | 40.1 | Very low | 34.7 | Very low | 246 Ų | 246 | 136.5 Ų | 136.5 | 93% | 0.928 | 79% | 0.788 | S | S | * | * | trans | -115.7 | 138.7 | 173.8 | -85.3 | -176.8 | 169.8 | -171.6 | -2.2 | 110 | ||||
| 45 | S | 31 | Very low | 35 | Very low | 127 Ų | 127 | 138.4 Ų | 138.4 | 89% | 0.888 | 78% | 0.784 | S | S | * | * | -176.7 | 161.6 | 129.9 | -84 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 46 | A | 36 | Very low | 34.9 | Very low | 94 Ų | 94 | 141.8 Ų | 141.8 | 78% | 0.777 | 79% | 0.789 | S | S | * | * | trans | -102.8 | 171.8 | 169.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 47 | M | 38.5 | Very low | 34.7 | Very low | 196 Ų | 196 | 137 Ų | 137 | 97% | 0.966 | 78% | 0.784 | S | S | * | * | trans | -174.4 | 172.8 | 138.8 | -88.2 | -104.8 | -145.3 | 0 | 0 | 109.5 | ||||
| 48 | V | 35.7 | Very low | 34.7 | Very low | 136 Ų | 136 | 132.1 Ų | 132.1 | 82% | 0.824 | 79% | 0.791 | S | S | * | * | trans | -124.4 | -179 | -175.8 | 75.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 49 | S | 32.6 | Very low | 34.7 | Very low | 111 Ų | 111 | 129.3 Ų | 129.3 | 78% | 0.776 | 79% | 0.794 | S | S | * | * | trans | 86.4 | 154.5 | 171.8 | -155 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 50 | S | 34.7 | Very low | 34.5 | Very low | 84 Ų | 84 | 128.9 Ų | 128.9 | 59% | 0.587 | 79% | 0.792 | S | S | * | * | cis | -176.1 | 169 | -35.1 | -170.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 51 | M | 36.2 | Very low | 34.3 | Very low | 161 Ų | 161 | 132.8 Ų | 132.8 | 79% | 0.793 | 80% | 0.795 | S | S | * | * | trans | 65.3 | 166.9 | 170.6 | -53.3 | -71.4 | 91.1 | 0 | 0 | 115.6 | ||||
| 52 | A | 35.2 | Very low | 34.2 | Very low | 82 Ų | 82 | 138.5 Ų | 138.5 | 68% | 0.678 | 80% | 0.801 | S | S | * | * | cis | -144.1 | 142.9 | 3.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 53 | S | 34.1 | Very low | 33.8 | Very low | 108 Ų | 108 | 134.5 Ų | 134.5 | 76% | 0.755 | 79% | 0.79 | S | S | * | * | 77.1 | 121.7 | 84.1 | -55 | 0 | 0 | 0 | 0 | 117.4 | |||||
| 54 | I | 36.6 | Very low | 33.7 | Very low | 163 Ų | 163 | 137.6 Ų | 137.6 | 84% | 0.836 | 79% | 0.788 | S | S | * | * | trans | -141.6 | 132 | 153.6 | -66.7 | -171.8 | 0 | 0 | 0 | 109.1 | ||||
| 55 | L | 40.4 | Very low | 33.4 | Very low | 137 Ų | 137 | 134.5 Ų | 134.5 | 72% | 0.717 | 78% | 0.783 | S | S | * | * | trans | 0.3 | 166.6 | 152.5 | -81 | 55 | 0 | 0 | 0 | 120.9 | ||||
| 56 | E | 32.5 | Very low | 33.5 | Very low | 167 Ų | 167 | 133 Ų | 133 | 78% | 0.78 | 78% | 0.779 | S | S | * | * | cis | -161.3 | 154.8 | 34.6 | -169.1 | 78.3 | -101.7 | 0 | 0 | 112.5 | ||||
| 57 | G | 30.4 | Very low | 33.4 | Very low | 64 Ų | 64 | 136.5 Ų | 136.5 | 66% | 0.66 | 78% | 0.784 | S | S | * | * | trans | 68 | 126.1 | 155.1 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 58 | A | 34.3 | Very low | 33.2 | Very low | 117 Ų | 117 | 133.3 Ų | 133.3 | 97% | 0.967 | 78% | 0.78 | S | S | * | * | cis | 82.9 | 123.5 | 22 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 59 | G | 32.4 | Very low | 32.9 | Very low | 75 Ų | 75 | 130.1 Ų | 130.1 | 77% | 0.773 | 78% | 0.775 | S | S | * | * | trans | 150.8 | 130 | 174.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 60 | D | 30.1 | Very low | 33.7 | Very low | 142 Ų | 142 | 130.5 Ų | 130.5 | 76% | 0.759 | 78% | 0.775 | S | S | * | * | trans | -113.4 | 172.9 | -167 | -67.1 | -99.2 | 0 | 0 | 0 | 115.7 | ||||
| 61 | Y | 32.1 | Very low | 33.9 | Very low | 211 Ų | 211 | 134.3 Ų | 134.3 | 83% | 0.827 | 79% | 0.788 | S | S | * | * | trans | 79.8 | 106.1 | 152.7 | -69.8 | -61.7 | 0 | 0 | 0 | 123.4 | ||||
| 62 | R | 27.9 | Very low | 34.1 | Very low | 217 Ų | 217 | 135 Ų | 135 | 82% | 0.819 | 79% | 0.789 | S | S | * | * | 86.3 | 127.6 | 109.2 | -152 | -145.9 | 172.8 | 142 | 0.8 | 122.3 | |||||
| 63 | T | 27.9 | Very low | 34.7 | Very low | 106 Ų | 106 | 137 Ų | 137 | 65% | 0.65 | 80% | 0.795 | S | S | * | * | trans | 60.6 | 122.1 | 148.4 | -70 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 64 | D | 28 | Very low | 34.7 | Very low | 145 Ų | 145 | 135.9 Ų | 135.9 | 78% | 0.775 | 79% | 0.792 | S | S | * | * | -164.5 | -166.9 | 64.4 | -158.4 | -108.9 | 0 | 0 | 0 | 114.4 | |||||
| 65 | H | 35.3 | Very low | 34.8 | Very low | 181 Ų | 181 | 135 Ų | 135 | 84% | 0.838 | 79% | 0.786 | S | S | * | * | trans | -114.4 | 129.8 | -176.5 | -87.5 | -89.5 | 0 | 0 | 0 | 113.4 | ||||
| 66 | A | 31.5 | Very low | 34.9 | Very low | 97 Ų | 97 | 134.2 Ų | 134.2 | 80% | 0.802 | 79% | 0.787 | S | S | * | * | trans | -147.6 | 103.1 | 164.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 67 | L | 35.4 | Very low | 35.5 | Very low | 167 Ų | 167 | 132.9 Ų | 132.9 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | trans | 21 | 118.3 | 131.9 | -54.3 | 172.2 | 0 | 0 | 0 | 119.6 | ||||
| 68 | S | 33.8 | Very low | 35.7 | Very low | 128 Ų | 128 | 134.1 Ų | 134.1 | 90% | 0.895 | 78% | 0.781 | S | S | * | * | 172.1 | 149.8 | 122.7 | -77.7 | 0 | 0 | 0 | 0 | 113 | |||||
| 69 | G | 30.3 | Very low | 35.9 | Very low | 69 Ų | 69 | 134.3 Ų | 134.3 | 71% | 0.711 | 77% | 0.774 | S | S | * | * | trans | -125.9 | -151.6 | 159 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 70 | P | 47.6 | Very low | 36.1 | Very low | 119 Ų | 119 | 137.5 Ų | 137.5 | 77% | 0.773 | 77% | 0.773 | S | S | * | * | cis | -142.5 | -167.9 | -8.3 | 41.2 | -21.9 | 0 | 0 | 0 | 114.5 | ||||
| 71 | L | 40.3 | Very low | 36.4 | Very low | 164 Ų | 164 | 134.7 Ų | 134.7 | 86% | 0.859 | 77% | 0.765 | S | S | * | * | trans | 83.7 | 137.3 | 154.7 | -68.8 | 170.8 | 0 | 0 | 0 | 122.3 | ||||
| 72 | H | 41 | Very low | 36.5 | Very low | 175 Ų | 175 | 127.5 Ų | 127.5 | 81% | 0.81 | 76% | 0.755 | S | S | * | * | trans | -88 | 172.6 | 163.6 | -52.1 | -102.5 | 0 | 0 | 0 | 110.6 | ||||
| 73 | P | 45.9 | Very low | 36.8 | Very low | 126 Ų | 126 | 124.9 Ų | 124.9 | 82% | 0.818 | 75% | 0.754 | S | S | * | * | -143 | 172.9 | 95.3 | 21.1 | 1.2 | 0 | 0 | 0 | 113.1 | |||||
| 74 | A | 36 | Very low | 37.2 | Very low | 83 Ų | 83 | 124.9 Ų | 124.9 | 69% | 0.686 | 76% | 0.759 | S | S | * | * | cis | -157.9 | 147.5 | -18 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 75 | M | 38.4 | Very low | 37.7 | Very low | 145 Ų | 145 | 126.5 Ų | 126.5 | 71% | 0.714 | 77% | 0.766 | S | S | * | * | trans | 25.1 | 133.1 | 132.3 | -36.6 | -161.2 | 89 | 0 | 0 | 119.3 | M77 | M75-M77 HydrophobicContact CE-CE 3.54Å; M75-M77 HydrophobicContact SD-CE 4.29Å | ||
| 76 | T | 42.3 | Very low | 37.8 | Very low | 121 Ų | 121 | 122.8 Ų | 122.8 | 74% | 0.742 | 76% | 0.761 | S | S | * | * | cis | 67.8 | 127.3 | 42.2 | -47.6 | 0 | 0 | 0 | 0 | 114 | ||||
| 77 | M | 44.7 | Very low | 37.8 | Very low | 138 Ų | 138 | 124.1 Ų | 124.1 | 68% | 0.68 | 76% | 0.764 | S | S | * | * | trans | -175.6 | 123.1 | 133.8 | -86 | -25.4 | 176.2 | 0 | 0 | 108.1 | M75 | M75-M77 HydrophobicContact CE-CE 3.54Å; M75-M77 HydrophobicContact SD-CE 4.29Å | ||
| 78 | S | 35.8 | Very low | 37.9 | Very low | 90 Ų | 90 | 122.3 Ų | 122.3 | 63% | 0.629 | 76% | 0.76 | S | S | * | * | 87 | 165 | 73 | -60.3 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 79 | C | 38.2 | Very low | 38 | Very low | 122 Ų | 122 | 126.2 Ų | 126.2 | 82% | 0.824 | 76% | 0.757 | S | S | * | * | cis | -157.3 | 173.9 | 13.1 | 3.7 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 80 | D | 35.6 | Very low | 38.6 | Very low | 141 Ų | 141 | 128.9 Ų | 128.9 | 75% | 0.754 | 76% | 0.759 | S | S | * | * | cis | -168.7 | 165.8 | -17.8 | 176.3 | -136.1 | 0 | 0 | 0 | 109.6 | ||||
| 81 | S | 37.6 | Very low | 38.2 | Very low | 83 Ų | 83 | 129.1 Ų | 129.1 | 58% | 0.58 | 76% | 0.759 | S | S | * | * | trans | 8.4 | 156.8 | 157.3 | -62.1 | 0 | 0 | 0 | 0 | 123.7 | M83 | S81-M83 WeakPolarHBondContact OG-CE 3.44Š| ||
| 82 | G | 32.4 | Very low | 38.5 | Very low | 61 Ų | 61 | 128.8 Ų | 128.8 | 63% | 0.629 | 76% | 0.757 | S | S | * | * | cis | 166.8 | -179.4 | -3.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 83 | M | 35.8 | Very low | 38.7 | Very low | 162 Ų | 162 | 127 Ų | 127 | 80% | 0.798 | 76% | 0.758 | S | S | * | * | trans | 2.8 | 149.8 | 152.6 | 8.7 | -70.8 | 168.8 | 0 | 0 | 119.7 | S81 | S81-M83 WeakPolarHBondContact OG-CE 3.44Š| ||
| 84 | S | 36.3 | Very low | 38.8 | Very low | 106 Ų | 106 | 127 Ų | 127 | 74% | 0.741 | 76% | 0.759 | S | S | * | * | cis | -170.1 | 153.3 | 0.8 | -178.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 85 | L | 37.4 | Very low | 39.5 | Very low | 178 Ų | 178 | 130.7 Ų | 130.7 | 93% | 0.932 | 77% | 0.766 | S | S | * | * | trans | 173 | 164.4 | 130.8 | -93.8 | 167.5 | 0 | 0 | 0 | 111.9 | ||||
| 86 | S | 37.6 | Very low | 40.1 | Very low | 104 Ų | 104 | 131.4 Ų | 131.4 | 73% | 0.727 | 77% | 0.768 | S | S | * | * | trans | -108.6 | 143.5 | -169.6 | -176.8 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 87 | S | 30.8 | Very low | 40 | Very low | 124 Ų | 124 | 133.5 Ų | 133.5 | 87% | 0.867 | 77% | 0.769 | S | S | * | * | trans | -166.8 | 149.1 | 150.9 | -85.1 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 88 | T | 39.2 | Very low | 40.1 | Very low | 130 Ų | 130 | 134.9 Ų | 134.9 | 80% | 0.798 | 78% | 0.778 | S | S | * | * | trans | -110.4 | 122.3 | -174.1 | -59.1 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 89 | Y | 34.7 | Very low | 40.5 | Very low | 210 Ų | 210 | 136 Ų | 136 | 82% | 0.824 | 78% | 0.783 | S | S | * | * | trans | -166.6 | 161.8 | 131.7 | -132.8 | -100.6 | 0 | 0 | 0 | 111.8 | T91 | Y89-T91 HydrophobicContact CD1-CG2 4.09Š| ||
| 90 | T | 42.7 | Very low | 41 | Very low | 124 Ų | 124 | 136.2 Ų | 136.2 | 76% | 0.761 | 78% | 0.783 | S | S | * | * | trans | -118.7 | 125.6 | 169.3 | -179.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 91 | T | 39.5 | Very low | 41.3 | Very low | 124 Ų | 124 | 137.1 Ų | 137.1 | 76% | 0.761 | 79% | 0.786 | S | S | * | * | trans | -137.2 | 153 | 176.4 | 52.1 | 0 | 0 | 0 | 0 | 110 | Y89 | Y89-T91 HydrophobicContact CD1-CG2 4.09Š| ||
| 92 | L | 47.2 | Very low | 41.2 | Very low | 157 Ų | 157 | 138.8 Ų | 138.8 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | trans | -100 | 174.9 | -172.8 | -74.6 | 167.3 | 0 | 0 | 0 | 112.5 | ||||
| 93 | T | 44.4 | Very low | 41.9 | Very low | 137 Ų | 137 | 141.5 Ų | 141.5 | 84% | 0.84 | 80% | 0.802 | S | S | * | * | trans | 69.1 | 158.8 | 164.3 | 35.8 | 0 | 0 | 0 | 0 | 118 | ||||
| 94 | P | 49 | Very low | 41.9 | Very low | 127 Ų | 127 | 140.9 Ų | 140.9 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | cis | -123.5 | -174 | -6.3 | 32.3 | -12.4 | 0 | 0 | 0 | 114.5 | ||||
| 95 | L | 49.1 | Very low | 41.8 | Very low | 161 Ų | 161 | 141.1 Ų | 141.1 | 84% | 0.843 | 81% | 0.809 | S | S | * | * | trans | -100.2 | 174.8 | 172.5 | -112 | 165.9 | 0 | 0 | 0 | 111.2 | ||||
| 96 | Q | 51.7 | Low | 41.7 | Very low | 160 Ų | 160 | 139.7 Ų | 139.7 | 75% | 0.748 | 80% | 0.798 | S | S | * | * | trans | 81.4 | 160.1 | 176.3 | -47 | -166.4 | 11.8 | 0 | 0 | 114.8 | ||||
| 97 | H | 40.8 | Very low | 41.6 | Very low | 164 Ų | 164 | 141 Ų | 141 | 76% | 0.759 | 79% | 0.79 | S | S | * | * | cis | -135.1 | 161.9 | 14.1 | -55.5 | -99.4 | 0 | 0 | 0 | 113.7 | ||||
| 98 | L | 46.1 | Very low | 41.8 | Very low | 167 Ų | 167 | 144.6 Ų | 144.6 | 87% | 0.874 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -87.6 | 147.6 | 170.2 | -80.5 | 155 | 0 | 0 | 0 | 111.3 | ||
| 99 | P | 43.6 | Very low | 41.7 | Very low | 114 Ų | 114 | 145 Ų | 145 | 74% | 0.74 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 151.6 | 168.6 | 32.1 | -34.2 | 0 | 0 | 0 | 111.8 | ||
| 100 | P | 49.7 | Very low | 41.9 | Very low | 126 Ų | 126 | 143.2 Ų | 143.2 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -86.4 | 157.2 | -171.9 | 34.4 | -36.6 | 0 | 0 | 0 | 114.4 | ||
| 101 | I | 42.6 | Very low | 42.3 | Very low | 161 Ų | 161 | 143 Ų | 143 | 83% | 0.826 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 135.9 | 161.6 | -62.2 | 171 | 0 | 0 | 0 | 108.5 | ||
| 102 | S | 34.4 | Very low | 42.3 | Very low | 118 Ų | 118 | 145.7 Ų | 145.7 | 83% | 0.825 | 79% | 0.786 | S | S | * | * | trans | -151.8 | 160.3 | 159.2 | -160.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 103 | T | 46.4 | Very low | 42.6 | Very low | 117 Ų | 117 | 142.8 Ų | 142.8 | 72% | 0.718 | 78% | 0.777 | S | S | * | * | trans | -129.9 | 142 | -160.8 | 53.4 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 104 | V | 36.3 | Very low | 42.1 | Very low | 150 Ų | 150 | 144.2 Ų | 144.2 | 91% | 0.909 | 77% | 0.774 | S | S | * | * | trans | -156.9 | 149.5 | 151.9 | -94.4 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 105 | S | 35.1 | Very low | 41.6 | Very low | 111 Ų | 111 | 142.1 Ų | 142.1 | 78% | 0.776 | 77% | 0.767 | S | S | * | * | trans | -77.1 | 157.1 | 166.1 | -54.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 106 | E | 34.9 | Very low | 41 | Very low | 148 Ų | 148 | 142.6 Ų | 142.6 | 69% | 0.692 | 77% | 0.765 | S | S | * | * | 169.4 | 166.1 | 94.5 | -86.4 | -156.6 | 125.8 | 0 | 0 | 108.6 | |||||
| 107 | K | 36 | Very low | 40.3 | Very low | 130 Ų | 130 | 142.6 Ų | 142.6 | 57% | 0.565 | 76% | 0.764 | S | S | * | * | cis | -169 | 151.9 | -24.1 | 61.4 | -176.4 | 142.4 | -150.2 | 0 | 108.7 | ||||
| 108 | F | 35.3 | Very low | 40.2 | Very low | 201 Ų | 201 | 142.3 Ų | 142.3 | 88% | 0.882 | 76% | 0.763 | S | S | * | * | trans | -173.3 | 169.8 | 143.4 | -102.1 | -67.1 | 0 | 0 | 0 | 109.2 | ||||
| 109 | H | 36.7 | Very low | 40.5 | Very low | 139 Ų | 139 | 140.3 Ų | 140.3 | 64% | 0.644 | 76% | 0.76 | S | S | * | * | trans | -118.3 | 139.3 | -150.6 | -63.5 | 78.6 | 0 | 0 | 0 | 115.6 | ||||
| 110 | H | 39 | Very low | 40.1 | Very low | 171 Ų | 171 | 139.2 Ų | 139.2 | 79% | 0.792 | 76% | 0.76 | S | S | * | * | trans | 40.9 | 159 | 130 | -62.9 | 96 | 0 | 0 | 0 | 122 | ||||
| 111 | P | 50.3 | Low | 39.6 | Very low | 121 Ų | 121 | 141.6 Ų | 141.6 | 79% | 0.786 | 76% | 0.76 | S | S | * | * | cis | -134.6 | -179.3 | 14.1 | 41.9 | -23.7 | 0 | 0 | 0 | 117.6 | ||||
| 112 | H | 40.2 | Very low | 39.2 | Very low | 179 Ų | 179 | 140.9 Ų | 140.9 | 83% | 0.829 | 75% | 0.754 | S | S | * | * | trans | -78.8 | -174.8 | 164 | -104 | -31.4 | 0 | 0 | 0 | 111.5 | ||||
| 113 | P | 52.9 | Low | 39.1 | Very low | 97 Ų | 97 | 145.6 Ų | 145.6 | 63% | 0.63 | 75% | 0.753 | S | S | * | * | cis | -140.2 | 176 | 15.9 | 41.2 | -21.8 | 0 | 0 | 0 | 117.4 | ||||
| 114 | H | 35 | Very low | 38.6 | Very low | 167 Ų | 167 | 147 Ų | 147 | 77% | 0.773 | 76% | 0.756 | S | S | * | * | 177.8 | 149.7 | 114.6 | -101.9 | -74.2 | 0 | 0 | 0 | 112.5 | |||||
| 115 | A | 37.5 | Very low | 38.5 | Very low | 83 Ų | 83 | 144.2 Ų | 144.2 | 69% | 0.686 | 75% | 0.748 | S | S | * | * | trans | -154.9 | 142.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 116 | H | 36.5 | Very low | 38.5 | Very low | 170 Ų | 170 | 144 Ų | 144 | 79% | 0.787 | 75% | 0.753 | S | S | * | * | trans | -140.7 | 132.1 | 161.9 | -72.3 | -82 | 0 | 0 | 0 | 107 | ||||
| 117 | H | 36.5 | Very low | 38.3 | Very low | 160 Ų | 160 | 140.4 Ų | 140.4 | 74% | 0.741 | 76% | 0.756 | S | S | * | * | cis | 93.2 | 142 | 27.1 | -114.9 | 91.4 | 0 | 0 | 0 | 116.2 | ||||
| 118 | H | 39.9 | Very low | 38.4 | Very low | 158 Ų | 158 | 142.2 Ų | 142.2 | 73% | 0.731 | 77% | 0.772 | S | S | * | * | trans | 91.6 | 155.7 | 173 | -57.9 | -66.3 | 0 | 0 | 0 | 118 | ||||
| 119 | P | 51.4 | Low | 38.5 | Very low | 126 Ų | 126 | 139.6 Ų | 139.6 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | -139.9 | -150.8 | -95.2 | 36.1 | -10.1 | 0 | 0 | 0 | 114.9 | |||||
| 120 | A | 35.7 | Very low | 38.6 | Very low | 90 Ų | 90 | 138.8 Ų | 138.8 | 74% | 0.744 | 78% | 0.782 | S | S | * | * | trans | -109.7 | 158.1 | -159.8 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 121 | H | 38.7 | Very low | 38.4 | Very low | 176 Ų | 176 | 134.1 Ų | 134.1 | 82% | 0.815 | 78% | 0.78 | S | S | * | * | trans | -153 | 160.6 | 154.4 | -89.2 | -97.7 | 0 | 0 | 0 | 108.9 | ||||
| 122 | Q | 34.3 | Very low | 37.9 | Very low | 147 Ų | 147 | 134 Ų | 134 | 69% | 0.687 | 78% | 0.782 | S | S | * | * | cis | -173.7 | 124.8 | -33.8 | -176.3 | 176 | 28 | 0 | 0 | 110.3 | ||||
| 123 | R | 33.3 | Very low | 37.5 | Very low | 216 Ų | 216 | 134 Ų | 134 | 82% | 0.815 | 78% | 0.78 | S | S | * | * | trans | 64 | 156.2 | 163.2 | -80.3 | -177.8 | 176 | -132.6 | -2.1 | 116.9 | ||||
| 124 | L | 34.6 | Very low | 37.1 | Very low | 147 Ų | 147 | 134.9 Ų | 134.9 | 77% | 0.77 | 78% | 0.784 | S | S | * | * | cis | -140.3 | 178.4 | -7.6 | -92.4 | 139.7 | 0 | 0 | 0 | 106.3 | ||||
| 125 | A | 34.1 | Very low | 37.4 | Very low | 91 Ų | 91 | 133.4 Ų | 133.4 | 75% | 0.752 | 78% | 0.781 | S | S | * | * | cis | -151.3 | 179.1 | 19.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 126 | A | 35.8 | Very low | 37.3 | Very low | 106 Ų | 106 | 137.7 Ų | 137.7 | 88% | 0.876 | 79% | 0.789 | S | S | * | * | trans | -49 | 154.1 | -172.5 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 127 | G | 31.7 | Very low | 37.5 | Very low | 73 Ų | 73 | 140.5 Ų | 140.5 | 75% | 0.753 | 79% | 0.793 | S | S | * | * | trans | -161.1 | 29.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 128 | N | 37.4 | Very low | 37.6 | Very low | 168 Ų | 168 | 139.9 Ų | 139.9 | 90% | 0.898 | 80% | 0.795 | S | S | * | * | trans | -121.2 | 109.1 | -178.2 | -72.1 | 80.2 | 0 | 0 | 0 | 112.7 | ||||
| 129 | V | 37.9 | Very low | 37.7 | Very low | 146 Ų | 146 | 138.9 Ų | 138.9 | 89% | 0.885 | 80% | 0.795 | S | S | * | * | trans | -143.8 | 132 | 143.8 | 77.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 130 | S | 39 | Very low | 37 | Very low | 122 Ų | 122 | 143.7 Ų | 143.7 | 85% | 0.853 | 80% | 0.796 | S | S | * | * | trans | -95.1 | 131.1 | 172.1 | -174.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 131 | G | 33.6 | Very low | 36.8 | Very low | 73 Ų | 73 | 144.3 Ų | 144.3 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | trans | -146.3 | 83.4 | -172.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 132 | S | 39.9 | Very low | 36.6 | Very low | 119 Ų | 119 | 143.4 Ų | 143.4 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | trans | -91.5 | 121.6 | 168.5 | -176.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 133 | F | 32.9 | Very low | 36.5 | Very low | 179 Ų | 179 | 140.5 Ų | 140.5 | 79% | 0.785 | 80% | 0.797 | S | S | * | * | trans | -145.1 | 153.9 | 155.7 | 85.5 | -89.6 | 0 | 0 | 0 | 110.5 | ||||
| 134 | T | 42.8 | Very low | 36.5 | Very low | 115 Ų | 115 | 134.8 Ų | 134.8 | 71% | 0.706 | 79% | 0.79 | S | S | * | * | trans | -132.6 | 165.2 | 176.2 | 48.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 135 | L | 41.7 | Very low | 36.3 | Very low | 137 Ų | 137 | 135.5 Ų | 135.5 | 72% | 0.717 | 79% | 0.791 | S | S | * | * | trans | 70.7 | 157.4 | -178.4 | -40.9 | 174.3 | 0 | 0 | 0 | 112.7 | ||||
| 136 | M | 35.7 | Very low | 35.9 | Very low | 172 Ų | 172 | 137 Ų | 137 | 85% | 0.847 | 80% | 0.796 | S | S | * | * | cis | -122.8 | 164.9 | 5 | -76.9 | -177.3 | -179.4 | 0 | 0 | 113.3 | ||||
| 137 | R | 40.1 | Very low | 35.7 | Very low | 230 Ų | 230 | 138.3 Ų | 138.3 | 87% | 0.868 | 79% | 0.789 | S | S | * | * | trans | -74.6 | 128.9 | 158.8 | 162.5 | -170.8 | 177.9 | 173.4 | 0 | 108.1 | ||||
| 138 | D | 38.3 | Very low | 35.8 | Very low | 146 Ų | 146 | 142.6 Ų | 142.6 | 78% | 0.781 | 79% | 0.793 | S | S | * | * | trans | -135.4 | 151.5 | 166.1 | -144.7 | -61.8 | 0 | 0 | 0 | 110.2 | ||||
| 139 | D | 42.5 | Very low | 35.5 | Very low | 137 Ų | 137 | 145.9 Ų | 145.9 | 73% | 0.733 | 80% | 0.795 | S | S | * | * | trans | -143.3 | 99.7 | -172.1 | -172.5 | -36.3 | 0 | 0 | 0 | 107.6 | ||||
| 140 | R | 36.8 | Very low | 35.1 | Very low | 227 Ų | 227 | 141.9 Ų | 141.9 | 86% | 0.857 | 78% | 0.783 | S | S | * | * | trans | -149.7 | 121 | 177.4 | -154.2 | 162.4 | -173.7 | 162.3 | 1.7 | 113.9 | ||||
| 141 | S | 31.4 | Very low | 34.6 | Very low | 103 Ų | 103 | 144.1 Ų | 144.1 | 72% | 0.72 | 78% | 0.78 | S | S | * | * | trans | -83.3 | 144.1 | 172.4 | -179.9 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 142 | L | 35.6 | Very low | 34.8 | Very low | 157 Ų | 157 | 150.7 Ų | 150.7 | 82% | 0.822 | 78% | 0.784 | S | S | * | * | trans | 171.3 | 120.9 | 149.2 | -88.7 | 157.7 | 0 | 0 | 0 | 105 | ||||
| 143 | A | 31.4 | Very low | 35.6 | Very low | 86 Ų | 86 | 148.9 Ų | 148.9 | 71% | 0.711 | 77% | 0.769 | S | S | * | * | 65 | 134.3 | 58.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 144 | S | 32.5 | Very low | 35.8 | Very low | 96 Ų | 96 | 148.3 Ų | 148.3 | 67% | 0.671 | 77% | 0.766 | S | S | * | * | cis | -164.6 | -177.9 | -3 | -167.9 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 145 | M | 31 | Very low | 35.4 | Very low | 162 Ų | 162 | 150.7 Ų | 150.7 | 80% | 0.798 | 77% | 0.774 | S | S | * | * | trans | 113.5 | 91.7 | 154.9 | -61.7 | -59.1 | -174.1 | 0 | 0 | 118.2 | ||||
| 146 | S | 26.8 | Very low | 35.3 | Very low | 123 Ų | 123 | 151.1 Ų | 151.1 | 86% | 0.86 | 78% | 0.775 | S | S | * | * | -151.6 | 111.8 | 116.2 | -170 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 147 | N | 30.9 | Very low | 35.4 | Very low | 134 Ų | 134 | 149 Ų | 149 | 72% | 0.717 | 78% | 0.777 | S | S | * | * | trans | -115.7 | 143.7 | 175.5 | -83 | -57.7 | 0 | 0 | 0 | 108.8 | ||||
| 148 | L | 34.1 | Very low | 35 | Very low | 162 Ų | 162 | 141.4 Ų | 141.4 | 85% | 0.848 | 77% | 0.769 | S | S | * | * | trans | -142.3 | 101.2 | 169.8 | -152.9 | 77.6 | 0 | 0 | 0 | 111.3 | ||||
| 149 | Y | 30.5 | Very low | 35.1 | Very low | 237 Ų | 237 | 143.6 Ų | 143.6 | 93% | 0.929 | 78% | 0.777 | S | S | * | * | trans | 57.9 | 139.3 | 162.3 | -102.5 | -111.3 | 0 | 0 | 0 | 118.8 | ||||
| 150 | G | 28.7 | Very low | 34.8 | Very low | 62 Ų | 62 | 140 Ų | 140 | 64% | 0.639 | 77% | 0.773 | S | S | * | * | cis | 169 | 123.6 | -6 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 151 | H | 30.1 | Very low | 34.8 | Very low | 169 Ų | 169 | 138.2 Ų | 138.2 | 78% | 0.782 | 77% | 0.774 | S | S | * | * | cis | 85.9 | 98.3 | 41.1 | -155.7 | -40.8 | 0 | 0 | 0 | 113.7 | ||||
| 152 | Y | 36.8 | Very low | 35.8 | Very low | 212 Ų | 212 | 137.7 Ų | 137.7 | 83% | 0.831 | 77% | 0.768 | S | S | * | * | trans | -172.6 | 162.4 | 139.2 | -115.9 | -122.7 | 0 | 0 | 0 | 110.8 | ||||
| 153 | P | 58.1 | Low | 35.8 | Very low | 80 Ų | 80 | 138.6 Ų | 138.6 | 52% | 0.519 | 77% | 0.773 | S | S | . | * | -148.6 | -174.3 | -109.7 | 42.3 | -19.1 | 0 | 0 | 0 | 117.7 | |||||
| 154 | K | 35.8 | Very low | 36 | Very low | 168 Ų | 168 | 139.5 Ų | 139.5 | 73% | 0.73 | 77% | 0.774 | S | S | * | * | trans | 41.3 | 126.8 | 135.1 | -177.8 | 179.7 | 179 | -176.8 | 0 | 120.4 | ||||
| 155 | D | 33.9 | Very low | 37.1 | Very low | 165 Ų | 165 | 140 Ų | 140 | 88% | 0.882 | 78% | 0.775 | S | S | * | * | -140.6 | 163.6 | 129.7 | -132.2 | -36.1 | 0 | 0 | 0 | 112.2 | |||||
| 156 | M | 39.7 | Very low | 37.3 | Very low | 146 Ų | 146 | 139 Ų | 139 | 72% | 0.719 | 77% | 0.772 | S | S | * | * | trans | -155.3 | 112.8 | -168.2 | -172.8 | 170.7 | 74.9 | 0 | 0 | 116 | ||||
| 157 | S | 37.8 | Very low | 37.8 | Very low | 128 Ų | 128 | 138.7 Ų | 138.7 | 90% | 0.895 | 77% | 0.77 | S | S | * | * | trans | -173 | 160.4 | 161.3 | -78.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 158 | G | 33.6 | Very low | 38 | Very low | 69 Ų | 69 | 139.6 Ų | 139.6 | 71% | 0.711 | 78% | 0.775 | S | S | * | * | cis | 132.7 | 69.5 | -7.1 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 159 | M | 40.4 | Very low | 37.9 | Very low | 192 Ų | 192 | 135.6 Ų | 135.6 | 95% | 0.946 | 77% | 0.773 | S | S | * | * | trans | -163.5 | 151.3 | 173.9 | -151.3 | 62.9 | 163.9 | 0 | 0 | 114.1 | ||||
| 160 | G | 35.8 | Very low | 38.1 | Very low | 62 Ų | 62 | 133 Ų | 133 | 64% | 0.639 | 77% | 0.774 | S | S | * | * | trans | 62.1 | 99 | 157.3 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 161 | Q | 36.8 | Very low | 38.2 | Very low | 190 Ų | 190 | 133.5 Ų | 133.5 | 89% | 0.888 | 78% | 0.779 | S | S | * | * | 85.1 | 143.2 | 65 | -70.3 | -70.2 | -30.8 | 0 | 0 | 115.6 | |||||
| 162 | P | 51.2 | Low | 38.3 | Very low | 92 Ų | 92 | 130.7 Ų | 130.7 | 60% | 0.597 | 78% | 0.778 | S | S | * | * | trans | -115.7 | -178.3 | -164.4 | 44.3 | -34.7 | 0 | 0 | 0 | 114.6 | ||||
| 163 | L | 35.3 | Very low | 38.2 | Very low | 176 Ų | 176 | 128.2 Ų | 128.2 | 92% | 0.921 | 78% | 0.778 | S | S | * | * | trans | -138.2 | 143.2 | 149.4 | -74.8 | -179.9 | 0 | 0 | 0 | 111.6 | ||||
| 164 | S | 35.7 | Very low | 37.1 | Very low | 104 Ų | 104 | 133 Ų | 133 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | trans | -141.1 | -164.5 | 173.7 | -40.2 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 165 | P | 56.5 | Low | 36.6 | Very low | 106 Ų | 106 | 127.5 Ų | 127.5 | 69% | 0.688 | 78% | 0.784 | S | S | * | * | cis | -132.3 | -162.3 | -23.3 | 36.2 | -15.7 | 0 | 0 | 0 | 112.4 | ||||
| 166 | L | 35.6 | Very low | 36.4 | Very low | 143 Ų | 143 | 124.3 Ų | 124.3 | 75% | 0.749 | 78% | 0.775 | S | S | * | * | trans | 73 | 155.5 | 160.4 | -66.3 | 165.9 | 0 | 0 | 0 | 116.8 | ||||
| 167 | S | 37.1 | Very low | 36.1 | Very low | 115 Ų | 115 | 125.1 Ų | 125.1 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | cis | -131.4 | 166.1 | 20.6 | -72.1 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 168 | N | 34.5 | Very low | 36 | Very low | 154 Ų | 154 | 126.1 Ų | 126.1 | 82% | 0.824 | 77% | 0.767 | S | S | * | * | trans | -74.4 | 161 | 179.4 | -61.7 | -6.9 | 0 | 0 | 0 | 114.2 | ||||
| 169 | G | 31.6 | Very low | 35.9 | Very low | 78 Ų | 78 | 128.2 Ų | 128.2 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | trans | -158.4 | 133.8 | 161 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 170 | L | 35.5 | Very low | 35.5 | Very low | 183 Ų | 183 | 126.4 Ų | 126.4 | 96% | 0.958 | 76% | 0.76 | S | S | * | * | trans | -125.2 | 162.5 | -176.3 | -83.3 | 166.7 | 0 | 0 | 0 | 111.4 | ||||
| 171 | G | 30.7 | Very low | 35.3 | Very low | 71 Ų | 71 | 128.5 Ų | 128.5 | 73% | 0.732 | 77% | 0.765 | S | S | * | * | trans | 105.5 | 120.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 172 | S | 32.8 | Very low | 35 | Very low | 110 Ų | 110 | 123 Ų | 123 | 77% | 0.769 | 75% | 0.751 | S | S | * | * | cis | 84.4 | 108.2 | 15.2 | -152.7 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 173 | L | 34.4 | Very low | 34.3 | Very low | 160 Ų | 160 | 129.9 Ų | 129.9 | 84% | 0.838 | 77% | 0.767 | S | S | * | * | trans | 70.5 | 133.1 | 149.5 | -78 | 167 | 0 | 0 | 0 | 122.5 | ||||
| 174 | H | 33.8 | Very low | 34.1 | Very low | 182 Ų | 182 | 124.8 Ų | 124.8 | 84% | 0.843 | 76% | 0.758 | S | S | * | * | trans | 78.5 | 115.1 | 137.4 | -162.8 | -101.4 | 0 | 0 | 0 | 121.5 | ||||
| 175 | G | 26.7 | Very low | 34.6 | Very low | 52 Ų | 52 | 126.5 Ų | 126.5 | 54% | 0.536 | 77% | 0.766 | S | S | . | * | 119.2 | 110.4 | 112.8 | 0 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 176 | S | 28.6 | Very low | 33.4 | Very low | 98 Ų | 98 | 124.7 Ų | 124.7 | 69% | 0.685 | 77% | 0.767 | S | S | * | * | trans | 78.2 | 129.7 | 135.8 | 78.1 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 177 | Q | 33.7 | Very low | 33.2 | Very low | 162 Ų | 162 | 122.8 Ų | 122.8 | 76% | 0.757 | 77% | 0.771 | S | S | * | * | trans | 65.9 | 152.3 | 144.2 | -66.8 | -174.3 | 103.6 | 0 | 0 | 118.9 | ||||
| 178 | Q | 35 | Very low | 33.1 | Very low | 149 Ų | 149 | 125.2 Ų | 125.2 | 70% | 0.696 | 77% | 0.77 | S | S | * | * | cis | -148.1 | 172.5 | -5.6 | -119.4 | 177.2 | 42.4 | 0 | 0 | 106.8 | ||||
| 179 | T | 31.4 | Very low | 33.3 | Very low | 114 Ų | 114 | 124.7 Ų | 124.7 | 70% | 0.699 | 77% | 0.766 | S | S | * | * | cis | -127.3 | -132.9 | 8.6 | -17 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 180 | L | 33.5 | Very low | 33.2 | Very low | 154 Ų | 154 | 126 Ų | 126 | 81% | 0.806 | 76% | 0.763 | S | S | * | * | cis | -149.8 | -168.4 | -3.8 | -135.8 | -164.7 | 0 | 0 | 0 | 109.3 | ||||
| 181 | S | 31.3 | Very low | 32.9 | Very low | 106 Ų | 106 | 123.7 Ų | 123.7 | 74% | 0.741 | 75% | 0.752 | S | S | * | * | trans | -94.2 | 173.1 | -169.6 | -41.6 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 182 | A | 29.8 | Very low | 32.9 | Very low | 73 Ų | 73 | 125 Ų | 125 | 60% | 0.603 | 74% | 0.742 | S | S | * | * | cis | -160 | 161 | 16.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 183 | Y | 36.9 | Very low | 33 | Very low | 237 Ų | 237 | 126.5 Ų | 126.5 | 93% | 0.929 | 74% | 0.735 | S | S | * | * | trans | 58.9 | 136.5 | 167.4 | -50.2 | -77.6 | 0 | 0 | 0 | 118.1 | ||||
| 184 | G | 31.1 | Very low | 33 | Very low | 70 Ų | 70 | 126.5 Ų | 126.5 | 72% | 0.722 | 73% | 0.732 | S | S | * | * | cis | 105 | 143 | -1.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 185 | P | 45.2 | Very low | 33.3 | Very low | 140 Ų | 140 | 126.3 Ų | 126.3 | 91% | 0.909 | 74% | 0.736 | S | S | * | * | cis | -112.9 | -152 | -11.7 | 45.2 | -31.3 | 0 | 0 | 0 | 110.6 | ||||
| 186 | G | 31.9 | Very low | 33.7 | Very low | 68 Ų | 68 | 129.5 Ų | 129.5 | 70% | 0.701 | 75% | 0.751 | S | S | * | * | cis | 156.4 | 146.3 | -15.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 187 | A | 31.7 | Very low | 33.8 | Very low | 102 Ų | 102 | 131.2 Ų | 131.2 | 84% | 0.843 | 76% | 0.762 | S | S | * | * | trans | 63.2 | 151.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 188 | H | 34.7 | Very low | 33.6 | Very low | 167 Ų | 167 | 127 Ų | 127 | 77% | 0.773 | 76% | 0.763 | S | S | * | * | cis | 103.5 | 123.2 | 3.3 | -160.8 | -125 | 0 | 0 | 0 | 118 | ||||
| 189 | L | 38.1 | Very low | 33.3 | Very low | 142 Ų | 142 | 123.8 Ų | 123.8 | 74% | 0.743 | 77% | 0.769 | S | S | * | * | trans | 83.8 | 157 | 163.5 | -80.9 | 170.1 | 0 | 0 | 0 | 123.5 | ||||
| 190 | S | 30.8 | Very low | 33.3 | Very low | 106 Ų | 106 | 127.8 Ų | 127.8 | 74% | 0.741 | 78% | 0.777 | S | S | * | * | trans | 83.7 | 125 | 166.3 | -62.7 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 191 | N | 29.4 | Very low | 33.3 | Very low | 135 Ų | 135 | 127.2 Ų | 127.2 | 72% | 0.722 | 77% | 0.771 | S | S | * | * | cis | 91.1 | 141.1 | 48.5 | -153.4 | 50.9 | 0 | 0 | 0 | 110.8 | ||||
| 192 | D | 29.6 | Very low | 33.4 | Very low | 97 Ų | 97 | 127.4 Ų | 127.4 | 52% | 0.519 | 77% | 0.772 | S | S | . | * | cis | -152.1 | 175.9 | 8.9 | -148.6 | -24.3 | 0 | 0 | 0 | 112.7 | ||||
| 193 | K | 36 | Very low | 33.6 | Very low | 143 Ų | 143 | 132.1 Ų | 132.1 | 62% | 0.622 | 78% | 0.781 | S | S | * | * | trans | 14.9 | 133.1 | 153.7 | -78.8 | 160.5 | -156.1 | 80.5 | 0 | 123.4 | ||||
| 194 | M | 33.8 | Very low | 33.4 | Very low | 159 Ų | 159 | 125.2 Ų | 125.2 | 78% | 0.783 | 77% | 0.773 | S | S | * | * | 58 | 123.8 | 129.4 | -58 | -172.9 | -50.9 | 0 | 0 | 121.9 | |||||
| 195 | L | 39.6 | Very low | 33.5 | Very low | 178 Ų | 178 | 126.3 Ų | 126.3 | 93% | 0.932 | 78% | 0.776 | S | S | * | * | -141.6 | 147 | 113.5 | -78.6 | -173.2 | 0 | 0 | 0 | 109.8 | |||||
| 196 | S | 36.1 | Very low | 33 | Very low | 119 Ų | 119 | 127.3 Ų | 127.3 | 83% | 0.832 | 77% | 0.77 | S | S | * | * | trans | -130.4 | 111.7 | 174.1 | -82.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 197 | S | 30.4 | Very low | 33.1 | Very low | 134 Ų | 134 | 132.2 Ų | 132.2 | 94% | 0.937 | 78% | 0.779 | S | S | * | * | trans | -176.1 | 148.1 | 161.5 | -78.8 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 198 | G | 29.6 | Very low | 33.2 | Very low | 74 Ų | 74 | 132.4 Ų | 132.4 | 76% | 0.763 | 78% | 0.775 | S | S | * | * | cis | 162.7 | 123.9 | -5.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 199 | G | 29.1 | Very low | 33.2 | Very low | 81 Ų | 81 | 134.6 Ų | 134.6 | 84% | 0.835 | 78% | 0.776 | S | S | * | * | trans | 75.3 | 145.1 | -170.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 200 | F | 31 | Very low | 33 | Very low | 198 Ų | 198 | 130.8 Ų | 130.8 | 87% | 0.868 | 77% | 0.771 | S | S | * | * | cis | -152.1 | 162.2 | 43.8 | -171 | -119 | 0 | 0 | 0 | 111.9 | ||||
| 201 | E | 33.1 | Very low | 33 | Very low | 143 Ų | 143 | 131.8 Ų | 131.8 | 67% | 0.668 | 76% | 0.764 | S | S | * | * | trans | -97 | 153.4 | 177.7 | -163.5 | 176.5 | 100.6 | 0 | 0 | 109.8 | H203 | E201-H203 IonicContact OE1-CD2 2.73Š| ||
| 202 | S | 33.8 | Very low | 33.1 | Very low | 109 Ų | 109 | 131.5 Ų | 131.5 | 76% | 0.762 | 76% | 0.758 | S | S | * | * | trans | -146 | 79.1 | -179.1 | -72.2 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 203 | H | 34.4 | Very low | 33.3 | Very low | 172 Ų | 172 | 134.5 Ų | 134.5 | 80% | 0.796 | 77% | 0.769 | S | S | * | * | trans | -86 | 108.7 | 163.7 | -80.5 | -85.5 | 0 | 0 | 0 | 111.3 | E201 | E201-H203 IonicContact OE1-CD2 2.73Š| ||
| 204 | A | 31.3 | Very low | 33.2 | Very low | 93 Ų | 93 | 134.9 Ų | 134.9 | 77% | 0.769 | 78% | 0.777 | S | S | * | * | trans | -161.6 | 124.6 | 152.6 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 205 | A | 34.4 | Very low | 33.1 | Very low | 93 Ų | 93 | 131 Ų | 131 | 77% | 0.769 | 77% | 0.771 | S | S | * | * | cis | 73.8 | 101 | 31.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 206 | M | 35.4 | Very low | 32.8 | Very low | 160 Ų | 160 | 134.7 Ų | 134.7 | 79% | 0.788 | 77% | 0.772 | S | S | * | * | trans | 36.8 | 118.4 | 145.8 | -63.3 | -65.7 | -76.6 | 0 | 0 | 119.4 | ||||
| 207 | L | 33.2 | Very low | 32.5 | Very low | 172 Ų | 172 | 132.5 Ų | 132.5 | 90% | 0.901 | 77% | 0.768 | S | S | * | * | trans | -123.3 | 95.4 | 150.7 | -75 | 178.3 | 0 | 0 | 0 | 110.7 | ||||
| 208 | S | 33.6 | Very low | 32.7 | Very low | 106 Ų | 106 | 134.9 Ų | 134.9 | 74% | 0.741 | 77% | 0.769 | S | S | * | * | trans | -91.2 | 133.2 | 147.4 | -66.9 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 209 | R | 35 | Very low | 32.7 | Very low | 212 Ų | 212 | 135.4 Ų | 135.4 | 80% | 0.8 | 78% | 0.775 | S | S | * | * | trans | -157.8 | 138.1 | 171.4 | -157.4 | 171.1 | -176.1 | -176.2 | -3.4 | 108.9 | E211 | R209-E211 IonicContact CZ-OE2 3.17Å; R209-E211 IonicContact NE-OE2 2.67Å; R209-E211 PolarHBondContact NE-OE2 3.26Å; R209-E211 IonicContact NH2-OE1 3.67Å; R209-E211 IonicContact NH2-OE2 2.79Å; R209-E211 PolarHBondContact NH2-OE2 3.17Å | ||
| 210 | G | 32.9 | Very low | 32.8 | Very low | 62 Ų | 62 | 134.5 Ų | 134.5 | 64% | 0.639 | 77% | 0.766 | S | S | * | * | cis | -143.5 | 180 | -1.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 211 | E | 30.9 | Very low | 33.1 | Very low | 128 Ų | 128 | 134.8 Ų | 134.8 | 60% | 0.598 | 77% | 0.769 | S | S | * | * | 95.2 | 128.3 | 71.2 | -78.5 | 179.6 | 31 | 0 | 0 | 111.8 | R209 | R209-E211 IonicContact CZ-OE2 3.17Å; R209-E211 IonicContact NE-OE2 2.67Å; R209-E211 PolarHBondContact NE-OE2 3.26Å; R209-E211 IonicContact NH2-OE1 3.67Å; R209-E211 IonicContact NH2-OE2 2.79Å; R209-E211 PolarHBondContact NH2-OE2 3.17Å | |||
| 212 | E | 33 | Very low | 33 | Very low | 129 Ų | 129 | 131.2 Ų | 131.2 | 60% | 0.603 | 77% | 0.77 | S | S | * | * | cis | -154.9 | 172.6 | -5.2 | -55.8 | -149.5 | 75.1 | 0 | 0 | 114 | ||||
| 213 | H | 33.4 | Very low | 33.2 | Very low | 159 Ų | 159 | 131.6 Ų | 131.6 | 74% | 0.736 | 78% | 0.78 | S | S | * | * | trans | 71.1 | 152 | 144.1 | -66.8 | -9.6 | 0 | 0 | 0 | 120.9 | ||||
| 214 | L | 33.3 | Very low | 33.1 | Very low | 151 Ų | 151 | 126.9 Ų | 126.9 | 79% | 0.791 | 78% | 0.779 | S | S | * | * | cis | -159.6 | 159.7 | -6.5 | -120.3 | 165.5 | 0 | 0 | 0 | 113.3 | ||||
| 215 | A | 32 | Very low | 33.5 | Very low | 79 Ų | 79 | 130.1 Ų | 130.1 | 65% | 0.653 | 78% | 0.782 | S | S | * | * | trans | 81.8 | 111 | 145.3 | 0 | 0 | 0 | 0 | 0 | 125.3 | ||||
| 216 | R | 33.2 | Very low | 33.6 | Very low | 255 Ų | 255 | 133.1 Ų | 133.1 | 96% | 0.962 | 78% | 0.782 | S | S | * | * | 65.3 | 134.7 | 125.3 | -71.7 | -179.8 | 129.9 | 91.7 | -2.1 | 124.7 | |||||
| 217 | G | 29.5 | Very low | 33.6 | Very low | 72 Ų | 72 | 130.4 Ų | 130.4 | 74% | 0.742 | 77% | 0.774 | S | S | * | * | trans | 114.6 | 109.6 | 150.5 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 218 | L | 34.8 | Very low | 33.6 | Very low | 184 Ų | 184 | 127.4 Ų | 127.4 | 96% | 0.963 | 77% | 0.768 | S | S | * | * | cis | 84.2 | 110.8 | 47.1 | -75.8 | 175 | 0 | 0 | 0 | 116.3 | ||||
| 219 | G | 30.4 | Very low | 33.7 | Very low | 86 Ų | 86 | 129.5 Ų | 129.5 | 89% | 0.887 | 77% | 0.77 | S | S | * | * | trans | 90.8 | 145.6 | 163 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 220 | G | 29.6 | Very low | 33.8 | Very low | 62 Ų | 62 | 126.6 Ų | 126.6 | 64% | 0.639 | 77% | 0.77 | S | S | * | * | cis | 151.2 | 127.2 | -14.9 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 221 | H | 37.7 | Very low | 33.7 | Very low | 203 Ų | 203 | 127 Ų | 127 | 94% | 0.94 | 78% | 0.775 | S | S | * | * | trans | 68.5 | 153.3 | 172.1 | -43.4 | 91.6 | 0 | 0 | 0 | 116.6 | ||||
| 222 | G | 32.4 | Very low | 34.2 | Very low | 68 Ų | 68 | 127.7 Ų | 127.7 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | cis | 168.8 | 156.5 | -12.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 223 | A | 37.7 | Very low | 34.4 | Very low | 117 Ų | 117 | 129 Ų | 129 | 97% | 0.967 | 79% | 0.787 | S | S | * | * | trans | 60.9 | 142.3 | 158.3 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 224 | G | 31.8 | Very low | 34.5 | Very low | 74 Ų | 74 | 128.1 Ų | 128.1 | 76% | 0.763 | 78% | 0.783 | S | S | * | * | trans | 165.6 | 79.7 | 166.5 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 225 | L | 39.9 | Very low | 34.7 | Very low | 160 Ų | 160 | 128.3 Ų | 128.3 | 84% | 0.838 | 78% | 0.779 | S | S | * | * | trans | 47.5 | 123.9 | 141 | -55.2 | 178.9 | 0 | 0 | 0 | 124.1 | ||||
| 226 | M | 36.5 | Very low | 34.5 | Very low | 157 Ų | 157 | 129 Ų | 129 | 77% | 0.773 | 78% | 0.779 | S | S | * | * | trans | 71.8 | 169.8 | 131.8 | -63.2 | -63.8 | 96.9 | 0 | 0 | 121.7 | ||||
| 227 | T | 35.1 | Very low | 35 | Very low | 102 Ų | 102 | 126.1 Ų | 126.1 | 63% | 0.626 | 78% | 0.776 | S | S | * | * | -177.4 | 153 | -50.4 | -91.3 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 228 | S | 32.5 | Very low | 36.4 | Very low | 109 Ų | 109 | 127.9 Ų | 127.9 | 76% | 0.762 | 77% | 0.774 | S | S | * | * | trans | 70.2 | 160.8 | 165.9 | -78.8 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 229 | L | 36.8 | Very low | 36.5 | Very low | 150 Ų | 150 | 127.3 Ų | 127.3 | 79% | 0.785 | 77% | 0.766 | S | S | * | * | cis | -171.6 | 145.6 | -24.9 | -178.2 | 70 | 0 | 0 | 0 | 111.3 | ||||
| 230 | N | 36.2 | Very low | 36.7 | Very low | 151 Ų | 151 | 127.9 Ų | 127.9 | 81% | 0.807 | 76% | 0.757 | S | S | * | * | trans | 65 | 143.7 | 162.2 | -103 | 2.3 | 0 | 0 | 0 | 123.6 | ||||
| 231 | G | 31.5 | Very low | 37 | Very low | 71 Ų | 71 | 134.1 Ų | 134.1 | 73% | 0.732 | 77% | 0.77 | S | S | * | * | trans | -171.7 | 151.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 232 | I | 40.3 | Very low | 36.9 | Very low | 143 Ų | 143 | 128.5 Ų | 128.5 | 73% | 0.733 | 76% | 0.758 | S | S | * | * | trans | -148.2 | 138.8 | -158.1 | -76.6 | 167.9 | 0 | 0 | 0 | 115.3 | ||||
| 233 | H | 36.9 | Very low | 36.9 | Very low | 155 Ų | 155 | 133.5 Ų | 133.5 | 72% | 0.718 | 77% | 0.769 | S | S | * | * | trans | 62.4 | 163.7 | 160.1 | -79.1 | 146.4 | 0 | 0 | 0 | 120.8 | ||||
| 234 | H | 35.9 | Very low | 36.7 | Very low | 141 Ų | 141 | 131 Ų | 131 | 65% | 0.653 | 76% | 0.755 | S | S | * | * | cis | -158.6 | 162.8 | -0.3 | -119.7 | -36.1 | 0 | 0 | 0 | 113 | ||||
| 235 | H | 37.3 | Very low | 37.1 | Very low | 156 Ų | 156 | 133.1 Ų | 133.1 | 72% | 0.722 | 76% | 0.758 | S | S | * | * | trans | 75.5 | 105.6 | 145.5 | -89.5 | 55.3 | 0 | 0 | 0 | 126.6 | ||||
| 236 | S | 29.2 | Very low | 36.9 | Very low | 92 Ų | 92 | 134.1 Ų | 134.1 | 64% | 0.643 | 76% | 0.761 | S | S | * | * | 53.2 | 114.5 | 117.2 | 68.7 | 0 | 0 | 0 | 0 | 127.8 | |||||
| 237 | H | 42.6 | Very low | 37.2 | Very low | 195 Ų | 195 | 134.3 Ų | 134.3 | 90% | 0.903 | 76% | 0.764 | S | S | * | * | 71 | 163.4 | 129.1 | -103.4 | 39.2 | 0 | 0 | 0 | 122.9 | |||||
| 238 | P | 59 | Low | 37.1 | Very low | 109 Ų | 109 | 135.3 Ų | 135.3 | 71% | 0.708 | 78% | 0.775 | S | S | * | * | trans | -125.1 | -173.4 | -143.7 | 46.8 | -37.4 | 0 | 0 | 0 | 117.4 | ||||
| 239 | H | 36.6 | Very low | 37.5 | Very low | 172 Ų | 172 | 137.1 Ų | 137.1 | 80% | 0.796 | 78% | 0.776 | S | S | * | * | trans | -141.2 | 170.2 | 169.5 | -160.7 | 62.2 | 0 | 0 | 0 | 113.4 | ||||
| 240 | S | 35.5 | Very low | 37.6 | Very low | 99 Ų | 99 | 141.5 Ų | 141.5 | 69% | 0.692 | 78% | 0.782 | S | S | * | * | trans | -147.7 | 155 | -173.8 | 56.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 241 | Q | 35.3 | Very low | 37.6 | Very low | 192 Ų | 192 | 140.6 Ų | 140.6 | 90% | 0.897 | 78% | 0.777 | S | S | * | * | trans | -156.8 | 166.3 | 168.5 | -126.3 | 176.2 | 29.8 | 0 | 0 | 113.3 | ||||
| 242 | A | 35.8 | Very low | 37.8 | Very low | 85 Ų | 85 | 147.2 Ų | 147.2 | 70% | 0.702 | 78% | 0.78 | S | S | * | * | trans | -146.7 | 152.1 | -174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 243 | N | 33 | Very low | 37.4 | Very low | 173 Ų | 173 | 147.1 Ų | 147.1 | 93% | 0.925 | 78% | 0.777 | S | S | * | * | trans | 169.2 | 162.4 | 157.7 | -90.9 | -18.8 | 0 | 0 | 0 | 108.4 | ||||
| 244 | G | 32.8 | Very low | 37.2 | Very low | 65 Ų | 65 | 145.7 Ų | 145.7 | 67% | 0.67 | 78% | 0.779 | S | S | * | * | cis | 153.6 | 87.7 | -8.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 245 | S | 40.6 | Very low | 37.2 | Very low | 119 Ų | 119 | 145.7 Ų | 145.7 | 83% | 0.832 | 79% | 0.789 | S | S | * | * | trans | 64.5 | 146.3 | 168.1 | -159.5 | 0 | 0 | 0 | 0 | 119 | ||||
| 246 | M | 35.4 | Very low | 37.5 | Very low | 181 Ų | 181 | 145 Ų | 145 | 89% | 0.892 | 80% | 0.795 | S | S | * | * | trans | -174.9 | 141.9 | 134.8 | -96.6 | -64.3 | 176.7 | 0 | 0 | 108.5 | ||||
| 247 | L | 42 | Very low | 37.6 | Very low | 161 Ų | 161 | 144.1 Ų | 144.1 | 84% | 0.843 | 80% | 0.8 | S | S | * | * | trans | -103.7 | 146 | 173.9 | -70.2 | 165.3 | 0 | 0 | 0 | 109.4 | ||||
| 248 | S | 34.6 | Very low | 37.5 | Very low | 122 Ų | 122 | 139 Ų | 139 | 85% | 0.853 | 80% | 0.8 | S | S | * | * | trans | -148.7 | 110.2 | 164.3 | -77.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 249 | D | 39.6 | Very low | 36.2 | Very low | 148 Ų | 148 | 137.2 Ų | 137.2 | 79% | 0.791 | 80% | 0.802 | S | S | * | * | trans | -72.7 | 148.6 | 164.6 | -171.7 | -78.4 | 0 | 0 | 0 | 110 | D251 | D249-D251 PolarHBondContact OD1-N 3.48Å; D249-D251 VanDerWaalsContact OD1-N 3.16Å | ||
| 250 | R | 38.7 | Very low | 36.7 | Very low | 241 Ų | 241 | 139.1 Ų | 139.1 | 91% | 0.909 | 81% | 0.811 | S | S | * | * | trans | -155.1 | 77.7 | 164.5 | -162.9 | 169.2 | -178 | 151.8 | 0.7 | 113.3 | ||||
| 251 | D | 37.7 | Very low | 36.6 | Very low | 133 Ų | 133 | 137.9 Ų | 137.9 | 71% | 0.711 | 81% | 0.813 | S | S | * | * | trans | -60.3 | 134.6 | 161.3 | -147.2 | -40.4 | 0 | 0 | 0 | 111.9 | D249 | D249-D251 PolarHBondContact OD1-N 3.48Å; D249-D251 VanDerWaalsContact OD1-N 3.16Å | ||
| 252 | R | 35.3 | Very low | 37.1 | Very low | 209 Ų | 209 | 133.8 Ų | 133.8 | 79% | 0.789 | 81% | 0.813 | S | S | * | * | trans | -177.6 | 112.4 | 135.2 | -102 | -178.2 | 94.3 | 154.3 | 4 | 114.3 | ||||
| 253 | Q | 31.2 | Very low | 37.4 | Very low | 141 Ų | 141 | 132.1 Ų | 132.1 | 66% | 0.659 | 80% | 0.803 | S | S | * | * | 82.9 | 124.8 | 122.4 | -151.1 | 159 | 21.7 | 0 | 0 | 119.9 | |||||
| 254 | T | 33.6 | Very low | 38.1 | Very low | 125 Ų | 125 | 129.3 Ų | 129.3 | 77% | 0.767 | 80% | 0.797 | S | S | * | * | trans | -70 | 144.5 | 176 | 50.7 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 255 | V | 35.7 | Very low | 38.3 | Very low | 141 Ų | 141 | 129.3 Ų | 129.3 | 86% | 0.855 | 80% | 0.798 | S | S | * | * | trans | -123.9 | 132 | 152.4 | 174.5 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 256 | V | 42.7 | Very low | 38.4 | Very low | 143 Ų | 143 | 131.1 Ų | 131.1 | 87% | 0.867 | 79% | 0.793 | S | S | * | * | trans | -87.4 | 121.1 | 176.2 | 175.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 257 | G | 31.4 | Very low | 39.3 | Very low | 72 Ų | 72 | 124.9 Ų | 124.9 | 74% | 0.742 | 77% | 0.765 | S | S | * | * | trans | -147.9 | 116.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 258 | G | 41.1 | Very low | 40.2 | Very low | 88 Ų | 88 | 125.3 Ų | 125.3 | 91% | 0.907 | 76% | 0.763 | S | S | * | * | trans | -77.8 | 128.4 | -172.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 259 | G | 31.8 | Very low | 42 | Very low | 71 Ų | 71 | 127.4 Ų | 127.4 | 73% | 0.732 | 76% | 0.759 | S | S | * | * | trans | -149.4 | 119.9 | 171 | 0 | 0 | 0 | 0 | 0 | 111 | G261 | G259-G261 PolarHBondContact O-N 2.87Š| ||
| 260 | Q | 47.4 | Very low | 44.2 | Very low | 213 Ų | 213 | 120.6 Ų | 120.6 | 100% | 0.995 | 72% | 0.723 | S | S | * | * | trans | -79.4 | 80.8 | -175.3 | -66.5 | -179.3 | 4.6 | 0 | 0 | 111.7 | ||||
| 261 | G | 34.1 | Very low | 46.7 | Very low | 72 Ų | 72 | 112.9 Ų | 112.9 | 74% | 0.742 | 70% | 0.699 | S | S | * | * | trans | -98 | 87.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | G259 G263 | G259-G261 PolarHBondContact O-N 2.87Å; G261-G263 PolarHBondContact O-N 3.3Å; G261-G263 VanDerWaalsContact O-N 3.07Å | ||
| 262 | A | 44.4 | Very low | 49.4 | Very low | 107 Ų | 107 | 106.7 Ų | 106.7 | 88% | 0.884 | 67% | 0.666 | S | S | * | * | trans | -75 | 97.2 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | S264 | A262-S264 PolarHBondContact O-N 3.39Š| ||
| 263 | G | 43.2 | Very low | 52.1 | Low | 49 Ų | 49 | 101 Ų | 101 | 51% | 0.505 | 65% | 0.647 | S | S | . | * | S | Bend | trans | 82.3 | 13.6 | 140.7 | 0 | 0 | 0 | 0 | 0 | 119.5 | G261 | G261-G263 PolarHBondContact O-N 3.3Å; G261-G263 VanDerWaalsContact O-N 3.07Å |
| 264 | S | 46.1 | Very low | 55.2 | Low | 114 Ų | 114 | 97.4 Ų | 97.4 | 80% | 0.797 | 63% | 0.63 | S | S | * | * | S | Bend | trans | -70.9 | -29.8 | 176.9 | 53.5 | 0 | 0 | 0 | 0 | 114.4 | A262 | A262-S264 PolarHBondContact O-N 3.39Š|
| 265 | G | 37.1 | Very low | 58.1 | Low | 66 Ų | 66 | 91.6 Ų | 91.6 | 68% | 0.68 | 60% | 0.595 | S | S | * | * | G | 310 helix | trans | -79 | -21.7 | -174.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | V267 | G265-V267 VanDerWaalsContact C-N 3.28Å; G265-V267 PolarHBondContact O-N 3.22Å |
| 266 | Q | 43.8 | Very low | 61 | Low | 157 Ų | 157 | 84.9 Ų | 84.9 | 73% | 0.734 | 55% | 0.554 | S | S | * | * | G | 310 helix | trans | -81.4 | 1 | -174.4 | -74 | -168.3 | -10 | 0 | 0 | 114.7 | E268 | Q266-E268 VanDerWaalsContact C-N 3.33Å; Q266-E268 PolarHBondContact O-N 3.3Å |
| 267 | V | 53.3 | Low | 63.6 | Low | 50 Ų | 50 | 84.6 Ų | 84.6 | 30% | 0.303 | 54% | 0.543 | S | S | . | . | G | 310 helix | trans | -81.7 | -12.5 | -172.6 | -161 | 0 | 0 | 0 | 0 | 112.9 | G265 W329 | G265-V267 VanDerWaalsContact C-N 3.28Å; G265-V267 PolarHBondContact O-N 3.22Å; V267-W329 HydrophobicContact CG1-CZ3 4.38Å; V267-W329 HydrophobicContact CG2-CH2 4.28Å; V267-W329 HydrophobicContact CG2-CZ3 4.42Å |
| 268 | E | 61.4 | Low | 66.7 | Low | 170 Ų | 170 | 86.9 Ų | 86.9 | 79% | 0.794 | 53% | 0.53 | S | S | * | . | S | Bend | trans | -84.6 | -25 | -177.9 | -67.5 | -139.3 | 95.5 | 0 | 0 | 114.7 | Q266 W315 | Q266-E268 VanDerWaalsContact C-N 3.33Å; Q266-E268 PolarHBondContact O-N 3.3Å; E268-W315 PolarHBondContact O-NE1 3.08Å |
| 269 | E | 73.1 | Confident | 69.4 | Low | 165 Ų | 165 | 82.7 Ų | 82.7 | 77% | 0.771 | 49% | 0.487 | S | S | * | . | trans | -120.3 | 68.1 | 179.2 | -171.1 | 153.2 | -140.3 | 0 | 0 | 112.4 | N271 | E269-N271 PolarHBondContact O-N 2.55Š| ||
| 270 | I | 85 | Confident | 72.5 | Confident | 6 Ų | 6 | 81.4 Ų | 81.4 | 3% | 0.031 | 46% | 0.464 | C | S | . | . | trans | -73.8 | 109.8 | 174.5 | -59.8 | -176.6 | 0 | 0 | 0 | 109.9 | T272 V275 W315 R326 W329 | I270-T272 PolarHBondContact O-N 3.46Å; I270-V275 HydrophobicContact CG2-CG2 3.62Å; I270-W315 HydrophobicContact CB-CD2 4.34Å; I270-W315 HydrophobicContact CB-CE3 4.08Å; I270-W315 HydrophobicContact CB-CH2 4.12Å; I270-W315 HydrophobicContact CB-CZ2 4.37Å; I270-W315 HydrophobicContact CB-CZ3 3.97Å; I270-W315 HydrophobicContact CD1-CH2 3.86Å; I270-W315 HydrophobicContact CD1-CZ2 4.46Å; I270-W315 HydrophobicContact CD1-CZ3 4.26Å; I270-W315 HydrophobicContact CG1-CH2 4.15Å; I270-W315 HydrophobicContact CG1-CZ2 4.35Å; I270-W315 HydrophobicContact CG1-CZ3 4.46Å; I270-R326 HydrophobicContact CD1-CG 3.85Å; I270-W329 HydrophobicContact CD1-CB 4.21Å; I270-W329 HydrophobicContact CD1-CD2 4.36Å; I270-W329 HydrophobicContact CD1-CE3 4.46Å; I270-W329 HydrophobicContact CD1-CG 4.26Å; I270-W329 HydrophobicContact CG2-CB 4.4Å | ||
| 271 | N | 91.7 | Very high | 74.8 | Confident | 78 Ų | 78 | 74.1 Ų | 74.1 | 42% | 0.417 | 44% | 0.441 | S | S | . | . | trans | -63.1 | 101.5 | 171.4 | -178.2 | -2.9 | 0 | 0 | 0 | 111.1 | E269 K273 E274 V275 | E269-N271 PolarHBondContact O-N 2.55Å; N271-K273 VanDerWaalsContact C-N 3.31Å; N271-K273 PolarHBondContact O-N 3.11Å; N271-K273 PolarHBondContact OD1-N 3Å; N271-E274 HydrophobicContact CB-CB 3.94Å; N271-E274 WeakPolarHBondContact CB-OE2 3.41Å; N271-E274 VanDerWaalsContact CG-CB 3.49Å; N271-E274 VanDerWaalsContact ND2-CB 3.31Å; N271-E274 WeakPolarHBondContact ND2-CB 3.24Å; N271-E274 PolarHBondContact ND2-OE2 3.1Å; N271-E274 PolarHBondContact O-N 3.42Å; N271-E274 PolarHBondContact OD1-N 3.09Å; N271-V275 WeakPolarHBondContact O-CG2 3.46Å; N271-V275 PolarHBondContact O-N 2.98Å | ||
| 272 | T | 94 | Very high | 77.8 | Confident | 4 Ų | 4 | 72 Ų | 72 | 3% | 0.025 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -68.9 | -27 | -173.8 | 53.7 | 0 | 0 | 0 | 0 | 113.5 | I270 A276 P312 K313 W315 L318 F325 | I270-T272 PolarHBondContact O-N 3.46Å; T272-A276 VanDerWaalsContact O-CB 3.3Å; T272-A276 WeakPolarHBondContact O-CB 3.25Å; T272-A276 PolarHBondContact O-N 3.27Å; T272-A276 VanDerWaalsContact O-N 3.13Å; T272-P312 WeakPolarHBondContact O-CB 3.39Å; T272-K313 WeakPolarHBondContact CB-O 3.25Å; T272-K313 PolarHBondContact OG1-O 3.44Å; T272-W315 HydrophobicContact CG2-CB 4.09Å; T272-W315 HydrophobicContact CG2-CE3 3.87Å; T272-L318 HydrophobicContact CG2-CD1 3.84Å; T272-F325 HydrophobicContact CG2-CB 4.45Å; T272-F325 HydrophobicContact CG2-CD1 3.89Å; T272-F325 HydrophobicContact CG2-CD2 4.04Å; T272-F325 HydrophobicContact CG2-CE1 4.08Å; T272-F325 HydrophobicContact CG2-CE2 4.21Å; T272-F325 HydrophobicContact CG2-CG 3.87Å; T272-F325 HydrophobicContact CG2-CZ 4.23Å; T272-F325 WeakPolarHBondContact O-CE1 3.33Å |
| 273 | K | 93 | Very high | 80.2 | Confident | 89 Ų | 89 | 67.4 Ų | 67.4 | 39% | 0.387 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -66.7 | -50.8 | 173.5 | -69.6 | -176.7 | 176.6 | -177.1 | 0 | 110.6 | N271 A276 Q277 P312 H423 | N271-K273 VanDerWaalsContact C-N 3.31Å; N271-K273 PolarHBondContact O-N 3.11Å; N271-K273 PolarHBondContact OD1-N 3Å; K273-A276 PolarHBondContact O-N 2.87Å; K273-Q277 WeakPolarHBondContact O-CG 3.38Å; K273-Q277 PolarHBondContact O-N 3.49Å; K273-P312 HydrophobicContact CG-CG 4.22Å; K273-H423 PolarHBondContact NZ-CD2 3.03Å; K273-H423 PolarHBondContact NZ-CE1 3.38Å; K273-H423 PolarHBondContact NZ-NE2 2.8Å |
| 274 | E | 94.5 | Very high | 82.8 | Confident | 65 Ų | 65 | 72.8 Ų | 72.8 | 30% | 0.304 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -63.8 | -42.7 | -179.4 | 178.1 | -175 | 163.6 | 0 | 0 | 112.3 | N271 A276 Q277 R278 | N271-E274 HydrophobicContact CB-CB 3.94Å; N271-E274 WeakPolarHBondContact CB-OE2 3.41Å; N271-E274 VanDerWaalsContact CG-CB 3.49Å; N271-E274 VanDerWaalsContact ND2-CB 3.31Å; N271-E274 WeakPolarHBondContact ND2-CB 3.24Å; N271-E274 PolarHBondContact ND2-OE2 3.1Å; N271-E274 PolarHBondContact O-N 3.42Å; N271-E274 PolarHBondContact OD1-N 3.09Å; E274-A276 PolarHBondContact O-N 3.26Å; E274-Q277 PolarHBondContact O-N 2.89Å; E274-R278 WeakPolarHBondContact O-CB 3.49Å; E274-R278 PolarHBondContact O-N 2.88Å; E274-R278 IonicContact OE1-CZ 3.72Å; E274-R278 IonicContact OE1-NH1 3.71Å; E274-R278 PolarHBondContact OE1-NH1 3.44Å; E274-R278 IonicContact OE1-NH2 2.72Å; E274-R278 PolarHBondContact OE1-NH2 3.39Å |
| 275 | V | 96 | Very high | 85.1 | Confident | 3 Ų | 3 | 75.4 Ų | 75.4 | 2% | 0.018 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.5 | -41.6 | 174.3 | 171.8 | 0 | 0 | 0 | 0 | 111.5 | I270 N271 R278 I279 F325 M328 W329 L332 | I270-V275 HydrophobicContact CG2-CG2 3.62Å; N271-V275 WeakPolarHBondContact O-CG2 3.46Å; N271-V275 PolarHBondContact O-N 2.98Å; V275-R278 PolarHBondContact O-N 3.38Å; V275-I279 HydrophobicContact CG1-CG1 4.36Å; V275-I279 WeakPolarHBondContact O-CB 3.31Å; V275-I279 VanDerWaalsContact O-CG1 3.28Å; V275-I279 WeakPolarHBondContact O-CG1 3.34Å; V275-I279 PolarHBondContact O-N 3.45Å; V275-F325 HydrophobicContact CB-CD1 4.38Å; V275-F325 HydrophobicContact CG1-CD1 4.11Å; V275-M328 HydrophobicContact CG1-CB 3.53Å; V275-M328 HydrophobicContact CG1-SD 4.25Å; V275-W329 HydrophobicContact CG1-CB 4.5Å; V275-W329 HydrophobicContact CG2-CB 4.16Å; V275-W329 HydrophobicContact CG2-CG 4.43Å; V275-L332 HydrophobicContact CG1-CD1 4.36Å |
| 276 | A | 96.6 | Very high | 87.8 | Confident | 1 Ų | 1 | 74.8 Ų | 74.8 | 1% | 0.008 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -63.8 | -40 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | T272 K273 E274 T280 L309 P312 | T272-A276 VanDerWaalsContact O-CB 3.3Å; T272-A276 WeakPolarHBondContact O-CB 3.25Å; T272-A276 PolarHBondContact O-N 3.27Å; T272-A276 VanDerWaalsContact O-N 3.13Å; K273-A276 PolarHBondContact O-N 2.87Å; E274-A276 PolarHBondContact O-N 3.26Å; A276-T280 VanDerWaalsContact O-CB 3.31Å; A276-T280 WeakPolarHBondContact O-CB 3.19Å; A276-T280 PolarHBondContact O-N 2.86Å; A276-T280 PolarHBondContact O-OG1 3.12Å; A276-L309 HydrophobicContact CB-CD2 3.99Å; A276-P312 HydrophobicContact CB-CB 3.83Å; A276-P312 HydrophobicContact CB-CG 3.84Å |
| 277 | Q | 96.8 | Very high | 90.3 | Very high | 136 Ų | 136 | 72.2 Ų | 72.2 | 64% | 0.636 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -65.1 | -50 | 175.1 | -73.9 | 169.9 | -19.3 | 0 | 0 | 111.7 | K273 E274 I279 T280 A281 | K273-Q277 WeakPolarHBondContact O-CG 3.38Å; K273-Q277 PolarHBondContact O-N 3.49Å; E274-Q277 PolarHBondContact O-N 2.89Å; Q277-I279 PolarHBondContact O-N 2.71Å; Q277-T280 PolarHBondContact O-N 3.39Å; Q277-T280 VanDerWaalsContact O-N 3.1Å; Q277-A281 PolarHBondContact O-N 2.96Å |
| 278 | R | 96.6 | Very high | 92.2 | Very high | 121 Ų | 121 | 70.7 Ų | 70.7 | 46% | 0.457 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -59.9 | -46.2 | 177.4 | -76.2 | -165.7 | -177.6 | 116.1 | 15.9 | 112.2 | E274 V275 T280 A281 E282 L332 | E274-R278 WeakPolarHBondContact O-CB 3.49Å; E274-R278 PolarHBondContact O-N 2.88Å; E274-R278 IonicContact OE1-CZ 3.72Å; E274-R278 IonicContact OE1-NH1 3.71Å; E274-R278 PolarHBondContact OE1-NH1 3.44Å; E274-R278 IonicContact OE1-NH2 2.72Å; E274-R278 PolarHBondContact OE1-NH2 3.39Å; V275-R278 PolarHBondContact O-N 3.38Å; R278-T280 VanDerWaalsContact C-N 3.3Å; R278-T280 PolarHBondContact O-N 2.94Å; R278-A281 PolarHBondContact O-N 3.39Å; R278-E282 WeakPolarHBondContact O-CB 3.29Å; R278-E282 PolarHBondContact O-N 3.3Å; R278-L332 HydrophobicContact CB-CD1 3.54Å; R278-L332 HydrophobicContact CB-CD2 4.1Å; R278-L332 HydrophobicContact CB-CG 4.49Å |
| 279 | I | 97.2 | Very high | 93.8 | Very high | 0 Ų | 0 | 66.3 Ų | 66.3 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -57.8 | -44.1 | 172.9 | -70.4 | -64.3 | 0 | 0 | 0 | 110.9 | V275 Q277 A281 E282 L283 F293 L309 M328 W331 L332 | V275-I279 HydrophobicContact CG1-CG1 4.36Å; V275-I279 WeakPolarHBondContact O-CB 3.31Å; V275-I279 VanDerWaalsContact O-CG1 3.28Å; V275-I279 WeakPolarHBondContact O-CG1 3.34Å; V275-I279 PolarHBondContact O-N 3.45Å; Q277-I279 PolarHBondContact O-N 2.71Å; I279-A281 VanDerWaalsContact C-N 3.34Å; I279-A281 PolarHBondContact O-N 3.33Å; I279-E282 PolarHBondContact O-N 3.48Å; I279-L283 HydrophobicContact CG2-CD1 3.62Å; I279-L283 HydrophobicContact CG2-CG 4.06Å; I279-L283 WeakPolarHBondContact O-CB 3.23Å; I279-L283 WeakPolarHBondContact O-CG 3.26Å; I279-L283 PolarHBondContact O-N 3.32Å; I279-F293 HydrophobicContact CD1-CE1 4.05Å; I279-F293 HydrophobicContact CD1-CE2 4.32Å; I279-F293 HydrophobicContact CD1-CZ 3.59Å; I279-F293 HydrophobicContact CG2-CD1 4.3Å; I279-F293 HydrophobicContact CG2-CE1 3.86Å; I279-F293 HydrophobicContact CG2-CZ 4.43Å; I279-L309 HydrophobicContact CB-CD2 3.97Å; I279-L309 HydrophobicContact CG2-CD1 4.02Å; I279-L309 HydrophobicContact CG2-CD2 3.69Å; I279-M328 HydrophobicContact CD1-CB 4.02Å; I279-M328 HydrophobicContact CD1-CG 4.38Å; I279-M328 HydrophobicContact CG1-CB 3.84Å; I279-M328 HydrophobicContact CG1-CG 4.07Å; I279-M328 HydrophobicContact CG1-SD 4.43Å; I279-W331 HydrophobicContact CD1-CE3 3.69Å; I279-W331 HydrophobicContact CD1-CZ3 3.9Å; I279-L332 HydrophobicContact CD1-CD1 4Å; I279-L332 HydrophobicContact CD1-CD2 3.92Å; I279-L332 HydrophobicContact CD1-CG 3.69Å; I279-L332 HydrophobicContact CG1-CD1 4.04Å; I279-L332 HydrophobicContact CG1-CG 4.3Å |
| 280 | T | 96.8 | Very high | 94.7 | Very high | 43 Ų | 43 | 61.2 Ų | 61.2 | 26% | 0.264 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -64.8 | -37.3 | -179.8 | -59 | 0 | 0 | 0 | 0 | 112.4 | A276 Q277 R278 K284 | A276-T280 VanDerWaalsContact O-CB 3.31Å; A276-T280 WeakPolarHBondContact O-CB 3.19Å; A276-T280 PolarHBondContact O-N 2.86Å; A276-T280 PolarHBondContact O-OG1 3.12Å; Q277-T280 PolarHBondContact O-N 3.39Å; Q277-T280 VanDerWaalsContact O-N 3.1Å; R278-T280 VanDerWaalsContact C-N 3.3Å; R278-T280 PolarHBondContact O-N 2.94Å; T280-K284 WeakPolarHBondContact O-CG 3.4Å; T280-K284 PolarHBondContact O-N 2.85Å |
| 281 | A | 96.9 | Very high | 95.1 | Very high | 60 Ų | 60 | 62.5 Ų | 62.5 | 50% | 0.496 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -69 | -48.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q277 R278 I279 L283 K284 R285 | Q277-A281 PolarHBondContact O-N 2.96Å; R278-A281 PolarHBondContact O-N 3.39Å; I279-A281 VanDerWaalsContact C-N 3.34Å; I279-A281 PolarHBondContact O-N 3.33Å; A281-L283 PolarHBondContact O-N 2.85Å; A281-K284 WeakPolarHBondContact O-CB 3.34Å; A281-K284 PolarHBondContact O-N 3Å; A281-K284 VanDerWaalsContact O-N 3.17Å; A281-R285 WeakPolarHBondContact O-CB 3.17Å; A281-R285 PolarHBondContact O-N 2.95Å |
| 282 | E | 96.1 | Very high | 95.1 | Very high | 28 Ų | 28 | 62 Ų | 62 | 13% | 0.131 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -66.9 | -39 | -176.1 | -152.5 | 76.7 | -82 | 0 | 0 | 112.1 | R278 I279 K284 R285 Y286 W331 L332 R339 | R278-E282 WeakPolarHBondContact O-CB 3.29Å; R278-E282 PolarHBondContact O-N 3.3Å; I279-E282 PolarHBondContact O-N 3.48Å; E282-K284 VanDerWaalsContact C-N 3.32Å; E282-K284 PolarHBondContact O-N 3.28Å; E282-R285 PolarHBondContact O-N 2.73Å; E282-R285 VanDerWaalsContact OE1-CD 3.24Å; E282-R285 WeakPolarHBondContact OE1-CD 3.41Å; E282-R285 IonicContact OE1-NH1 3.3Å; E282-R285 PolarHBondContact OE1-NH1 2.67Å; E282-Y286 HydrophobicContact CG-CD2 4.01Å; E282-Y286 HydrophobicContact CG-CE2 3.72Å; E282-Y286 WeakPolarHBondContact O-CD2 3.49Å; E282-Y286 PolarHBondContact O-N 3.3Å; E282-Y286 VanDerWaalsContact OE1-CE2 3.25Å; E282-Y286 WeakPolarHBondContact OE1-CE2 2.96Å; E282-W331 HydrophobicContact CB-CZ3 4.28Å; E282-W331 HydrophobicContact CG-CH2 4.11Å; E282-W331 HydrophobicContact CG-CZ3 4.08Å; E282-L332 HydrophobicContact CB-CD2 4.22Å; E282-L332 HydrophobicContact CG-CD2 4.38Å; E282-R339 IonicContact OE1-NH2 3.77Å; E282-R339 IonicContact OE2-CZ 3.65Å; E282-R339 IonicContact OE2-NH1 3.74Å; E282-R339 PolarHBondContact OE2-NH1 3.28Å; E282-R339 IonicContact OE2-NH2 2.85Å; E282-R339 PolarHBondContact OE2-NH2 3.25Å |
| 283 | L | 95.9 | Very high | 95.2 | Very high | 10 Ų | 10 | 61.8 Ų | 61.8 | 5% | 0.052 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -64.9 | -34.1 | 173.8 | -67.8 | 178.5 | 0 | 0 | 0 | 112.4 | I279 A281 S287 I288 Q290 F293 L305 L309 | I279-L283 HydrophobicContact CG2-CD1 3.62Å; I279-L283 HydrophobicContact CG2-CG 4.06Å; I279-L283 WeakPolarHBondContact O-CB 3.23Å; I279-L283 WeakPolarHBondContact O-CG 3.26Å; I279-L283 PolarHBondContact O-N 3.32Å; A281-L283 PolarHBondContact O-N 2.85Å; L283-S287 CarbonylContact O-C 3.55Å; L283-S287 PolarHBondContact O-N 2.89Å; L283-I288 HydrophobicContact CD2-CB 3.66Å; L283-I288 HydrophobicContact CD2-CD1 4.12Å; L283-I288 HydrophobicContact CD2-CG2 3.58Å; L283-I288 PolarHBondContact O-N 2.88Å; L283-Q290 HydrophobicContact CD1-CG 4.33Å; L283-F293 HydrophobicContact CD1-CB 4.2Å; L283-F293 HydrophobicContact CD1-CD1 4.01Å; L283-F293 HydrophobicContact CD1-CG 4.19Å; L283-F293 HydrophobicContact CD2-CB 3.58Å; L283-F293 HydrophobicContact CD2-CD1 4.32Å; L283-F293 HydrophobicContact CD2-CD2 4.01Å; L283-F293 HydrophobicContact CD2-CG 3.71Å; L283-L305 HydrophobicContact CD1-CD2 4.4Å; L283-L309 HydrophobicContact CD1-CD1 4.43Å |
| 284 | K | 96.3 | Very high | 95.2 | Very high | 163 Ų | 163 | 57.5 Ų | 57.5 | 71% | 0.709 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -69.8 | -46.1 | 171.8 | -75.1 | 176.6 | 176.4 | -172.4 | 0 | 111.4 | T280 A281 E282 Y286 S287 | T280-K284 WeakPolarHBondContact O-CG 3.4Å; T280-K284 PolarHBondContact O-N 2.85Å; A281-K284 WeakPolarHBondContact O-CB 3.34Å; A281-K284 PolarHBondContact O-N 3Å; A281-K284 VanDerWaalsContact O-N 3.17Å; E282-K284 VanDerWaalsContact C-N 3.32Å; E282-K284 PolarHBondContact O-N 3.28Å; K284-Y286 PolarHBondContact O-N 2.92Å; K284-S287 PolarHBondContact O-N 2.85Å; K284-S287 VanDerWaalsContact O-N 3.08Å |
| 285 | R | 95.9 | Very high | 95.1 | Very high | 169 Ų | 169 | 57.8 Ų | 57.8 | 64% | 0.638 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -57.5 | -45 | -174.3 | -173.5 | -172.4 | -177.4 | -168.7 | -1.2 | 113.3 | A281 E282 | A281-R285 WeakPolarHBondContact O-CB 3.17Å; A281-R285 PolarHBondContact O-N 2.95Å; E282-R285 PolarHBondContact O-N 2.73Å; E282-R285 VanDerWaalsContact OE1-CD 3.24Å; E282-R285 WeakPolarHBondContact OE1-CD 3.41Å; E282-R285 IonicContact OE1-NH1 3.3Å; E282-R285 PolarHBondContact OE1-NH1 2.67Å |
| 286 | Y | 94.3 | Very high | 94.8 | Very high | 53 Ų | 53 | 60.5 Ų | 60.5 | 21% | 0.208 | 30% | 0.303 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.2 | 15.5 | 177.6 | -54.8 | -77.8 | 0 | 0 | 0 | 113.1 | E282 K284 I288 E336 R339 M340 | E282-Y286 HydrophobicContact CG-CD2 4.01Å; E282-Y286 HydrophobicContact CG-CE2 3.72Å; E282-Y286 WeakPolarHBondContact O-CD2 3.49Å; E282-Y286 PolarHBondContact O-N 3.3Å; E282-Y286 VanDerWaalsContact OE1-CE2 3.25Å; E282-Y286 WeakPolarHBondContact OE1-CE2 2.96Å; K284-Y286 PolarHBondContact O-N 2.92Å; Y286-I288 HydrophobicContact CD2-CD1 4.28Å; Y286-I288 HydrophobicContact CG-CD1 4.45Å; Y286-I288 PolarHBondContact O-N 2.84Å; Y286-I288 VanDerWaalsContact O-N 3.09Å; Y286-E336 VanDerWaalsContact CE1-CD 3.43Å; Y286-E336 HydrophobicContact CE1-CG 4.09Å; Y286-E336 WeakPolarHBondContact CE1-OE1 3.43Å; Y286-E336 WeakPolarHBondContact CE1-OE2 3.41Å; Y286-E336 PolarHBondContact OH-OE2 2.85Å; Y286-R339 PolarHBondContact OH-NH2 3.02Å; Y286-M340 HydrophobicContact CD1-CE 4.49Å; Y286-M340 HydrophobicContact CG-CE 4.48Å |
| 287 | S | 94.6 | Very high | 94.6 | Very high | 103 Ų | 103 | 62 Ų | 62 | 72% | 0.72 | 31% | 0.31 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52 | 31 | -178.6 | -62.4 | 0 | 0 | 0 | 0 | 115 | L283 K284 P289 | L283-S287 CarbonylContact O-C 3.55Å; L283-S287 PolarHBondContact O-N 2.89Å; K284-S287 PolarHBondContact O-N 2.85Å; K284-S287 VanDerWaalsContact O-N 3.08Å; S287-P289 VanDerWaalsContact O-CD 3.29Å; S287-P289 WeakPolarHBondContact O-CD 3.46Å |
| 288 | I | 93.6 | Very high | 94.3 | Very high | 17 Ų | 17 | 55.5 Ų | 55.5 | 9% | 0.087 | 28% | 0.28 | C | S | . | . | trans | -78 | 116.3 | -177.2 | -58.8 | 156.6 | 0 | 0 | 0 | 109.2 | L283 Y286 Q290 F293 W331 L343 | L283-I288 HydrophobicContact CD2-CB 3.66Å; L283-I288 HydrophobicContact CD2-CD1 4.12Å; L283-I288 HydrophobicContact CD2-CG2 3.58Å; L283-I288 PolarHBondContact O-N 2.88Å; Y286-I288 HydrophobicContact CD2-CD1 4.28Å; Y286-I288 HydrophobicContact CG-CD1 4.45Å; Y286-I288 PolarHBondContact O-N 2.84Å; Y286-I288 VanDerWaalsContact O-N 3.09Å; I288-Q290 PolarHBondContact O-N 3.4Å; I288-F293 HydrophobicContact CG2-CB 4.34Å; I288-W331 HydrophobicContact CD1-CH2 4.1Å; I288-W331 HydrophobicContact CD1-CZ2 4.21Å; I288-L343 HydrophobicContact CD1-CD1 3.72Å; I288-L343 HydrophobicContact CG1-CD1 4.07Å; I288-L343 HydrophobicContact CG2-CD1 4.11Å; I288-L343 HydrophobicContact CG2-CD2 4.33Å | ||
| 289 | P | 94.6 | Very high | 94 | Very high | 78 Ų | 78 | 54 Ų | 54 | 51% | 0.506 | 29% | 0.287 | S | S | . | . | trans | -65.3 | 135.1 | -179.8 | -19.4 | 32.1 | 0 | 0 | 0 | 111.1 | S287 A291 I292 F293 | S287-P289 VanDerWaalsContact O-CD 3.29Å; S287-P289 WeakPolarHBondContact O-CD 3.46Å; P289-A291 PolarHBondContact O-N 3.5Å; P289-I292 HydrophobicContact CB-CG1 4.17Å; P289-I292 HydrophobicContact CG-CG1 4.17Å; P289-I292 WeakPolarHBondContact O-CB 3.33Å; P289-I292 PolarHBondContact O-N 3.34Å; P289-F293 PolarHBondContact O-N 3.26Å | ||
| 290 | Q | 93.2 | Very high | 93.8 | Very high | 58 Ų | 58 | 59.6 Ų | 59.6 | 27% | 0.271 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -49.5 | -34.7 | 178.7 | -77.4 | -171.7 | -5.8 | 0 | 0 | 113.1 | L283 I288 I292 A294 Q302 L305 S306 | L283-Q290 HydrophobicContact CD1-CG 4.33Å; I288-Q290 PolarHBondContact O-N 3.4Å; Q290-I292 PolarHBondContact O-N 3.14Å; Q290-A294 WeakPolarHBondContact O-CB 3.43Å; Q290-A294 PolarHBondContact O-N 2.72Å; Q290-Q302 HydrophobicContact CB-CG 3.97Å; Q290-L305 HydrophobicContact CB-CD2 3.95Å; Q290-L305 HydrophobicContact CG-CD2 4.21Å; Q290-L305 VanDerWaalsContact O-CD2 3.3Å; Q290-L305 WeakPolarHBondContact O-CD2 3.43Å; Q290-S306 PolarHBondContact OE1-OG 3.18Å |
| 291 | A | 93.1 | Very high | 93.5 | Very high | 33 Ų | 33 | 60.6 Ų | 60.6 | 27% | 0.273 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -63.1 | -37.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | P289 Q295 Q302 | P289-A291 PolarHBondContact O-N 3.5Å; A291-Q295 VanDerWaalsContact O-CB 3.25Å; A291-Q295 WeakPolarHBondContact O-CB 3.43Å; A291-Q295 WeakPolarHBondContact O-CG 3.35Å; A291-Q295 PolarHBondContact O-N 2.93Å; A291-Q302 HydrophobicContact CB-CB 4.01Å; A291-Q302 HydrophobicContact CB-CG 4.1Å |
| 292 | I | 92.3 | Very high | 93.3 | Very high | 67 Ų | 67 | 61.7 Ų | 61.7 | 34% | 0.344 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -69.6 | -52.4 | 177.7 | -55.3 | -57.1 | 0 | 0 | 0 | 109.4 | P289 Q290 A294 Q295 R296 L343 | P289-I292 HydrophobicContact CB-CG1 4.17Å; P289-I292 HydrophobicContact CG-CG1 4.17Å; P289-I292 WeakPolarHBondContact O-CB 3.33Å; P289-I292 PolarHBondContact O-N 3.34Å; Q290-I292 PolarHBondContact O-N 3.14Å; I292-A294 PolarHBondContact O-N 2.83Å; I292-Q295 PolarHBondContact O-N 3.5Å; I292-R296 HydrophobicContact CG2-CG 3.88Å; I292-R296 VanDerWaalsContact O-CB 3.23Å; I292-R296 WeakPolarHBondContact O-CB 3.49Å; I292-R296 WeakPolarHBondContact O-CG 3.37Å; I292-R296 PolarHBondContact O-N 3.08Å; I292-L343 HydrophobicContact CG2-CD2 4.24Å |
| 293 | F | 94.8 | Very high | 93.2 | Very high | 0 Ų | 0 | 61.8 Ų | 61.8 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -59.4 | -47.1 | 179.7 | -178.3 | -104.6 | 0 | 0 | 0 | 112.7 | I279 L283 I288 P289 Q295 R296 I297 L298 L305 M328 W331 L343 | I279-F293 HydrophobicContact CD1-CE1 4.05Å; I279-F293 HydrophobicContact CD1-CE2 4.32Å; I279-F293 HydrophobicContact CD1-CZ 3.59Å; I279-F293 HydrophobicContact CG2-CD1 4.3Å; I279-F293 HydrophobicContact CG2-CE1 3.86Å; I279-F293 HydrophobicContact CG2-CZ 4.43Å; L283-F293 HydrophobicContact CD1-CB 4.2Å; L283-F293 HydrophobicContact CD1-CD1 4.01Å; L283-F293 HydrophobicContact CD1-CG 4.19Å; L283-F293 HydrophobicContact CD2-CB 3.58Å; L283-F293 HydrophobicContact CD2-CD1 4.32Å; L283-F293 HydrophobicContact CD2-CD2 4.01Å; L283-F293 HydrophobicContact CD2-CG 3.71Å; I288-F293 HydrophobicContact CG2-CB 4.34Å; P289-F293 PolarHBondContact O-N 3.26Å; F293-Q295 VanDerWaalsContact C-N 3.31Å; F293-Q295 PolarHBondContact O-N 3.11Å; F293-R296 PolarHBondContact O-N 3.33Å; F293-I297 HydrophobicContact CD2-CB 3.92Å; F293-I297 HydrophobicContact CD2-CG1 3.54Å; F293-I297 HydrophobicContact CE2-CB 3.66Å; F293-I297 HydrophobicContact CE2-CG1 3.58Å; F293-I297 HydrophobicContact CE2-CG2 3.76Å; F293-I297 HydrophobicContact CG-CG1 4.49Å; F293-I297 HydrophobicContact CZ-CB 4.19Å; F293-I297 HydrophobicContact CZ-CG2 4.07Å; F293-I297 PolarHBondContact O-N 3.4Å; F293-L298 HydrophobicContact CD1-CD1 4.24Å; F293-L298 HydrophobicContact CE1-CD1 3.79Å; F293-L298 HydrophobicContact CE1-CD2 4.42Å; F293-L298 HydrophobicContact CE1-CG 4.07Å; F293-L298 HydrophobicContact CZ-CD2 4.44Å; F293-L298 HydrophobicContact CZ-CG 4.45Å; F293-L305 HydrophobicContact CB-CD2 4.49Å; F293-L305 HydrophobicContact CD1-CD1 4.18Å; F293-L305 HydrophobicContact CD1-CD2 3.77Å; F293-L305 HydrophobicContact CE1-CD1 4.28Å; F293-M328 HydrophobicContact CE1-CG 4.24Å; F293-M328 HydrophobicContact CZ-CG 4.36Å; F293-W331 HydrophobicContact CD2-CD2 4.36Å; F293-W331 HydrophobicContact CD2-CE3 4.47Å; F293-W331 HydrophobicContact CD2-CZ2 4.41Å; F293-W331 AromaticContact CE2-CD2 3.53Å; F293-W331 HydrophobicContact CE2-CD2 3.53Å; F293-W331 AromaticContact CE2-CE2 3.92Å; F293-W331 AromaticContact CE2-CE3 3.59Å; F293-W331 HydrophobicContact CE2-CE3 3.59Å; F293-W331 AromaticContact CE2-CG 3.95Å; F293-W331 HydrophobicContact CE2-CG 3.95Å; F293-W331 HydrophobicContact CE2-CH2 4.39Å; F293-W331 HydrophobicContact CE2-CZ2 4.34Å; F293-W331 HydrophobicContact CE2-CZ3 4.04Å; F293-W331 HydrophobicContact CZ-CD2 4.35Å; F293-W331 HydrophobicContact CZ-CE3 4.11Å; F293-L343 HydrophobicContact CD2-CD2 4.38Å |
| 294 | A | 94.2 | Very high | 93 | Very high | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -56.3 | -44.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q290 I292 L298 C299 R300 L305 | Q290-A294 WeakPolarHBondContact O-CB 3.43Å; Q290-A294 PolarHBondContact O-N 2.72Å; I292-A294 PolarHBondContact O-N 2.83Å; A294-L298 CarbonylContact O-C 3.56Å; A294-L298 WeakPolarHBondContact O-CB 3.28Å; A294-C299 PolarHBondContact O-N 3.26Å; A294-R300 CarbonylContact C-O 3.57Å; A294-R300 VanDerWaalsContact C-O 3.28Å; A294-R300 PolarHBondContact O-N 2.84Å; A294-L305 HydrophobicContact CB-CB 3.74Å; A294-L305 HydrophobicContact CB-CD2 3.79Å; A294-L305 HydrophobicContact CB-CG 4.39Å |
| 295 | Q | 91.1 | Very high | 92.9 | Very high | 71 Ų | 71 | 56.3 Ų | 56.3 | 33% | 0.332 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -76.4 | -37.4 | -177.7 | -76.9 | -177.1 | 45.3 | 0 | 0 | 113.9 | A291 I292 F293 | A291-Q295 VanDerWaalsContact O-CB 3.25Å; A291-Q295 WeakPolarHBondContact O-CB 3.43Å; A291-Q295 WeakPolarHBondContact O-CG 3.35Å; A291-Q295 PolarHBondContact O-N 2.93Å; I292-Q295 PolarHBondContact O-N 3.5Å; F293-Q295 VanDerWaalsContact C-N 3.31Å; F293-Q295 PolarHBondContact O-N 3.11Å |
| 296 | R | 89.4 | Confident | 92.9 | Very high | 60 Ų | 60 | 48.8 Ų | 48.8 | 23% | 0.226 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -92.3 | -37.5 | -168.2 | -62.4 | -64.7 | 174.9 | -160.7 | -0.7 | 113.2 | I292 F293 L343 A346 A347 | I292-R296 HydrophobicContact CG2-CG 3.88Å; I292-R296 VanDerWaalsContact O-CB 3.23Å; I292-R296 WeakPolarHBondContact O-CB 3.49Å; I292-R296 WeakPolarHBondContact O-CG 3.37Å; I292-R296 PolarHBondContact O-N 3.08Å; F293-R296 PolarHBondContact O-N 3.33Å; R296-L343 HydrophobicContact CB-CD2 4.47Å; R296-A346 HydrophobicContact CB-CB 3.77Å; R296-A346 VanDerWaalsContact CD-C 3.49Å; R296-A346 WeakPolarHBondContact CD-O 3.45Å; R296-A346 HydrophobicContact CG-CB 4.23Å; R296-A346 PolarHBondContact NH1-O 3.05Å; R296-A347 PolarHBondContact NH1-O 2.97Å; R296-A347 VanDerWaalsContact NH1-O 3.1Å |
| 297 | I | 92.7 | Very high | 92.8 | Very high | 31 Ų | 31 | 50.5 Ų | 50.5 | 16% | 0.159 | 29% | 0.287 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -100.7 | -33.8 | -176.8 | -52.2 | -55.6 | 0 | 0 | 0 | 112 | F293 W331 A342 L343 | F293-I297 HydrophobicContact CD2-CB 3.92Å; F293-I297 HydrophobicContact CD2-CG1 3.54Å; F293-I297 HydrophobicContact CE2-CB 3.66Å; F293-I297 HydrophobicContact CE2-CG1 3.58Å; F293-I297 HydrophobicContact CE2-CG2 3.76Å; F293-I297 HydrophobicContact CG-CG1 4.49Å; F293-I297 HydrophobicContact CZ-CB 4.19Å; F293-I297 HydrophobicContact CZ-CG2 4.07Å; F293-I297 PolarHBondContact O-N 3.4Å; I297-W331 HydrophobicContact CG2-CB 3.96Å; I297-W331 HydrophobicContact CG2-CG 4.09Å; I297-A342 HydrophobicContact CD1-CB 3.79Å; I297-L343 HydrophobicContact CD1-CD2 4.17Å; I297-L343 HydrophobicContact CD1-CG 4.49Å; I297-L343 HydrophobicContact CG1-CD2 3.95Å |
| 298 | L | 91.3 | Very high | 92.8 | Very high | 1 Ų | 1 | 47.4 Ų | 47.4 | 1% | 0.005 | 26% | 0.262 | C | S | . | . | S | Bend | trans | -107.6 | -16.4 | -173.3 | -51.9 | -179.7 | 0 | 0 | 0 | 114.5 | F293 A294 R300 L305 T324 R327 M328 | F293-L298 HydrophobicContact CD1-CD1 4.24Å; F293-L298 HydrophobicContact CE1-CD1 3.79Å; F293-L298 HydrophobicContact CE1-CD2 4.42Å; F293-L298 HydrophobicContact CE1-CG 4.07Å; F293-L298 HydrophobicContact CZ-CD2 4.44Å; F293-L298 HydrophobicContact CZ-CG 4.45Å; A294-L298 CarbonylContact O-C 3.56Å; A294-L298 WeakPolarHBondContact O-CB 3.28Å; L298-R300 HydrophobicContact CB-CB 4.36Å; L298-R300 HydrophobicContact CB-CG 4.1Å; L298-L305 HydrophobicContact CD1-CD1 3.82Å; L298-T324 HydrophobicContact CB-CG2 4.49Å; L298-T324 HydrophobicContact CD1-CG2 4.07Å; L298-T324 HydrophobicContact CD2-CG2 4.32Å; L298-R327 HydrophobicContact CD2-CB 3.68Å; L298-M328 HydrophobicContact CD1-CE 3.59Å; L298-M328 HydrophobicContact CD1-CG 4.18Å; L298-M328 HydrophobicContact CD2-CG 3.93Å |
| 299 | C | 90.3 | Very high | 92.8 | Very high | 89 Ų | 89 | 47.5 Ų | 47.5 | 60% | 0.601 | 26% | 0.263 | S | S | * | . | trans | 51.8 | 50.8 | -168.8 | -59.4 | 0 | 0 | 0 | 0 | 112.4 | A294 | A294-C299 PolarHBondContact O-N 3.26Š| ||
| 300 | R | 92 | Very high | 92.7 | Very high | 117 Ų | 117 | 50.7 Ų | 50.7 | 44% | 0.442 | 27% | 0.265 | S | S | . | . | trans | -131.7 | 165.7 | -180 | -63.3 | -62.3 | 174 | -111.1 | 8.7 | 111.8 | A294 L298 T304 | A294-R300 CarbonylContact C-O 3.57Å; A294-R300 VanDerWaalsContact C-O 3.28Å; A294-R300 PolarHBondContact O-N 2.84Å; L298-R300 HydrophobicContact CB-CB 4.36Å; L298-R300 HydrophobicContact CB-CG 4.1Å; R300-T304 HydrophobicContact CB-CG2 4.34Å; R300-T304 HydrophobicContact CG-CG2 4.49Å | ||
| 301 | S | 92.1 | Very high | 92.5 | Very high | 65 Ų | 65 | 52.2 Ų | 52.2 | 46% | 0.455 | 28% | 0.275 | S | S | . | . | trans | -73.3 | 155 | 172.6 | 84.4 | 0 | 0 | 0 | 0 | 111.3 | G303 T304 L305 | S301-G303 VanDerWaalsContact C-N 3.29Å; S301-G303 PolarHBondContact O-N 3.4Å; S301-T304 WeakPolarHBondContact O-CB 3.4Å; S301-T304 PolarHBondContact O-N 3.48Å; S301-T304 PolarHBondContact OG-N 2.94Å; S301-T304 VanDerWaalsContact OG-N 3.13Å; S301-T304 PolarHBondContact OG-OG1 3.43Å; S301-L305 PolarHBondContact O-N 2.84Å; S301-L305 VanDerWaalsContact O-N 3.16Å | ||
| 302 | Q | 92.8 | Very high | 92.4 | Very high | 82 Ų | 82 | 51.9 Ų | 51.9 | 38% | 0.383 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -55.5 | -45.2 | 174.2 | -177.7 | -81.5 | -23.3 | 0 | 0 | 111.3 | Q290 A291 T304 L305 S306 | Q290-Q302 HydrophobicContact CB-CG 3.97Å; A291-Q302 HydrophobicContact CB-CB 4.01Å; A291-Q302 HydrophobicContact CB-CG 4.1Å; Q302-T304 VanDerWaalsContact C-N 3.32Å; Q302-T304 PolarHBondContact O-N 3.42Å; Q302-L305 PolarHBondContact O-N 3.16Å; Q302-S306 PolarHBondContact NE2-OG 2.85Å; Q302-S306 WeakPolarHBondContact O-CB 3.36Å; Q302-S306 PolarHBondContact O-N 3.13Å |
| 303 | G | 92.4 | Very high | 92.3 | Very high | 30 Ų | 30 | 52.7 Ų | 52.7 | 31% | 0.309 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -59.9 | -41.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | S301 L305 S306 D307 | S301-G303 VanDerWaalsContact C-N 3.29Å; S301-G303 PolarHBondContact O-N 3.4Å; G303-L305 PolarHBondContact O-N 3.03Å; G303-S306 PolarHBondContact O-N 3.07Å; G303-D307 PolarHBondContact O-N 3.23Å |
| 304 | T | 92.3 | Very high | 92.1 | Very high | 59 Ų | 59 | 55.5 Ų | 55.5 | 36% | 0.362 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -59.6 | -44.7 | 175.4 | -48.3 | 0 | 0 | 0 | 0 | 111.9 | R300 S301 Q302 L308 | R300-T304 HydrophobicContact CB-CG2 4.34Å; R300-T304 HydrophobicContact CG-CG2 4.49Å; S301-T304 WeakPolarHBondContact O-CB 3.4Å; S301-T304 PolarHBondContact O-N 3.48Å; S301-T304 PolarHBondContact OG-N 2.94Å; S301-T304 VanDerWaalsContact OG-N 3.13Å; S301-T304 PolarHBondContact OG-OG1 3.43Å; Q302-T304 VanDerWaalsContact C-N 3.32Å; Q302-T304 PolarHBondContact O-N 3.42Å; T304-L308 HydrophobicContact CG2-CD1 4.3Å; T304-L308 WeakPolarHBondContact O-CD1 3.41Å; T304-L308 VanDerWaalsContact O-CG 3.25Å; T304-L308 WeakPolarHBondContact O-CG 3.49Å; T304-L308 PolarHBondContact O-N 3.38Å; T304-L308 VanDerWaalsContact O-N 3.16Å |
| 305 | L | 94.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 56.5 Ų | 56.5 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.8 | -47.1 | 173.9 | 172.9 | 66.3 | 0 | 0 | 0 | 111 | L283 Q290 F293 A294 L298 S301 Q302 G303 D307 L308 L309 M328 | L283-L305 HydrophobicContact CD1-CD2 4.4Å; Q290-L305 HydrophobicContact CB-CD2 3.95Å; Q290-L305 HydrophobicContact CG-CD2 4.21Å; Q290-L305 VanDerWaalsContact O-CD2 3.3Å; Q290-L305 WeakPolarHBondContact O-CD2 3.43Å; F293-L305 HydrophobicContact CB-CD2 4.49Å; F293-L305 HydrophobicContact CD1-CD1 4.18Å; F293-L305 HydrophobicContact CD1-CD2 3.77Å; F293-L305 HydrophobicContact CE1-CD1 4.28Å; A294-L305 HydrophobicContact CB-CB 3.74Å; A294-L305 HydrophobicContact CB-CD2 3.79Å; A294-L305 HydrophobicContact CB-CG 4.39Å; L298-L305 HydrophobicContact CD1-CD1 3.82Å; S301-L305 PolarHBondContact O-N 2.84Å; S301-L305 VanDerWaalsContact O-N 3.16Å; Q302-L305 PolarHBondContact O-N 3.16Å; G303-L305 PolarHBondContact O-N 3.03Å; L305-D307 VanDerWaalsContact C-N 3.27Å; L305-D307 PolarHBondContact O-N 3.38Å; L305-L308 PolarHBondContact O-N 3.19Å; L305-L308 VanDerWaalsContact O-N 3.1Å; L305-L309 HydrophobicContact CD1-CD1 3.73Å; L305-L309 HydrophobicContact CD1-CD2 4.09Å; L305-L309 HydrophobicContact CD1-CG 3.71Å; L305-L309 HydrophobicContact CD2-CD1 4.3Å; L305-L309 HydrophobicContact CG-CD1 3.79Å; L305-L309 HydrophobicContact CG-CG 4.12Å; L305-L309 WeakPolarHBondContact O-CG 3.37Å; L305-L309 PolarHBondContact O-N 2.78Å; L305-M328 HydrophobicContact CD1-CE 3.45Å; L305-M328 VanDerWaalsContact CD1-CE 3.45Å |
| 306 | S | 95.6 | Very high | 91.8 | Very high | 10 Ų | 10 | 57.8 Ų | 57.8 | 7% | 0.07 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60.1 | -37.5 | -176 | -141.2 | 0 | 0 | 0 | 0 | 111.9 | Q290 Q302 G303 R310 | Q290-S306 PolarHBondContact OE1-OG 3.18Å; Q302-S306 PolarHBondContact NE2-OG 2.85Å; Q302-S306 WeakPolarHBondContact O-CB 3.36Å; Q302-S306 PolarHBondContact O-N 3.13Å; G303-S306 PolarHBondContact O-N 3.07Å; S306-R310 WeakPolarHBondContact O-CB 3.36Å; S306-R310 WeakPolarHBondContact O-CG 3.3Å; S306-R310 VanDerWaalsContact O-CZ 3.27Å; S306-R310 PolarHBondContact O-N 3.46Å; S306-R310 VanDerWaalsContact O-N 3.14Å; S306-R310 PolarHBondContact O-NE 3.09Å; S306-R310 PolarHBondContact OG-NH1 2.93Å |
| 307 | D | 92 | Very high | 91.7 | Very high | 90 Ų | 90 | 61.2 Ų | 61.2 | 48% | 0.481 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -71.8 | -40.7 | 173.3 | -72.5 | -23.4 | 0 | 0 | 0 | 112.7 | G303 L305 L309 R310 N311 | G303-D307 PolarHBondContact O-N 3.23Å; L305-D307 VanDerWaalsContact C-N 3.27Å; L305-D307 PolarHBondContact O-N 3.38Å; D307-L309 VanDerWaalsContact C-N 3.32Å; D307-L309 PolarHBondContact O-N 3.04Å; D307-R310 PolarHBondContact O-N 3.1Å; D307-R310 IonicContact OD1-CZ 3.21Å; D307-R310 IonicContact OD1-NE 3.67Å; D307-R310 IonicContact OD1-NH2 2.71Å; D307-R310 PolarHBondContact OD1-NH2 3.38Å; D307-N311 PolarHBondContact O-N 2.94Å |
| 308 | L | 93.5 | Very high | 91.5 | Very high | 38 Ų | 38 | 60.6 Ų | 60.6 | 20% | 0.199 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62.8 | -35.5 | 175.7 | -74.5 | 168.5 | 0 | 0 | 0 | 112.9 | T304 L305 P312 T324 F325 M328 | T304-L308 HydrophobicContact CG2-CD1 4.3Å; T304-L308 WeakPolarHBondContact O-CD1 3.41Å; T304-L308 VanDerWaalsContact O-CG 3.25Å; T304-L308 WeakPolarHBondContact O-CG 3.49Å; T304-L308 PolarHBondContact O-N 3.38Å; T304-L308 VanDerWaalsContact O-N 3.16Å; L305-L308 PolarHBondContact O-N 3.19Å; L305-L308 VanDerWaalsContact O-N 3.1Å; L308-P312 WeakPolarHBondContact O-CA 3.19Å; L308-P312 WeakPolarHBondContact O-CB 3.17Å; L308-T324 HydrophobicContact CD1-CG2 3.83Å; L308-F325 HydrophobicContact CD2-CE2 3.9Å; L308-F325 HydrophobicContact CD2-CZ 4.22Å; L308-M328 HydrophobicContact CB-CE 4.42Å; L308-M328 HydrophobicContact CD1-CE 4.35Å |
| 309 | L | 94 | Very high | 91.4 | Very high | 19 Ų | 19 | 69.8 Ų | 69.8 | 10% | 0.099 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -78.9 | -33.1 | 178.3 | -63.8 | -179.7 | 0 | 0 | 0 | 112.8 | A276 I279 L283 L305 D307 M328 | A276-L309 HydrophobicContact CB-CD2 3.99Å; I279-L309 HydrophobicContact CB-CD2 3.97Å; I279-L309 HydrophobicContact CG2-CD1 4.02Å; I279-L309 HydrophobicContact CG2-CD2 3.69Å; L283-L309 HydrophobicContact CD1-CD1 4.43Å; L305-L309 HydrophobicContact CD1-CD1 3.73Å; L305-L309 HydrophobicContact CD1-CD2 4.09Å; L305-L309 HydrophobicContact CD1-CG 3.71Å; L305-L309 HydrophobicContact CD2-CD1 4.3Å; L305-L309 HydrophobicContact CG-CD1 3.79Å; L305-L309 HydrophobicContact CG-CG 4.12Å; L305-L309 WeakPolarHBondContact O-CG 3.37Å; L305-L309 PolarHBondContact O-N 2.78Å; D307-L309 VanDerWaalsContact C-N 3.32Å; D307-L309 PolarHBondContact O-N 3.04Å; L309-M328 HydrophobicContact CD2-CE 4.28Å |
| 310 | R | 92.4 | Very high | 91.2 | Very high | 144 Ų | 144 | 71 Ų | 71 | 54% | 0.543 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -74 | -43.8 | 176.3 | -79.3 | -173.5 | -69.5 | -90.4 | -1.7 | 113.1 | S306 D307 P312 | S306-R310 WeakPolarHBondContact O-CB 3.36Å; S306-R310 WeakPolarHBondContact O-CG 3.3Å; S306-R310 VanDerWaalsContact O-CZ 3.27Å; S306-R310 PolarHBondContact O-N 3.46Å; S306-R310 VanDerWaalsContact O-N 3.14Å; S306-R310 PolarHBondContact O-NE 3.09Å; S306-R310 PolarHBondContact OG-NH1 2.93Å; D307-R310 PolarHBondContact O-N 3.1Å; D307-R310 IonicContact OD1-CZ 3.21Å; D307-R310 IonicContact OD1-NE 3.67Å; D307-R310 IonicContact OD1-NH2 2.71Å; D307-R310 PolarHBondContact OD1-NH2 3.38Å; R310-P312 VanDerWaalsContact C-CD 3.49Å |
| 311 | N | 89.1 | Confident | 91.1 | Very high | 90 Ų | 90 | 66.4 Ų | 66.4 | 48% | 0.481 | 36% | 0.362 | S | S | . | . | S | Bend | trans | -130.8 | 69.4 | -175.7 | -62.3 | -87.6 | 0 | 0 | 0 | 110.1 | D307 K313 | D307-N311 PolarHBondContact O-N 2.94Å; N311-K313 PolarHBondContact O-N 2.96Å |
| 312 | P | 91.1 | Very high | 91.2 | Very high | 26 Ų | 26 | 67.3 Ų | 67.3 | 17% | 0.169 | 36% | 0.355 | C | S | . | . | trans | -67.1 | 105.4 | 178.1 | 26.9 | -34.3 | 0 | 0 | 0 | 110.6 | T272 K273 A276 L308 R310 F325 | T272-P312 WeakPolarHBondContact O-CB 3.39Å; K273-P312 HydrophobicContact CG-CG 4.22Å; A276-P312 HydrophobicContact CB-CB 3.83Å; A276-P312 HydrophobicContact CB-CG 3.84Å; L308-P312 WeakPolarHBondContact O-CA 3.19Å; L308-P312 WeakPolarHBondContact O-CB 3.17Å; R310-P312 VanDerWaalsContact C-CD 3.49Å; P312-F325 HydrophobicContact CB-CE1 4.21Å; P312-F325 HydrophobicContact CB-CZ 3.98Å | ||
| 313 | K | 90.4 | Very high | 91.2 | Very high | 85 Ų | 85 | 66.9 Ų | 66.9 | 37% | 0.37 | 35% | 0.353 | S | S | . | . | trans | -56.9 | 142.1 | 173.6 | -61.7 | -169.8 | 74.5 | -145.8 | 0 | 110.7 | T272 N311 K317 L318 | T272-K313 WeakPolarHBondContact CB-O 3.25Å; T272-K313 PolarHBondContact OG1-O 3.44Å; N311-K313 PolarHBondContact O-N 2.96Å; K313-K317 PolarHBondContact NZ-O 3.06Å; K313-L318 HydrophobicContact CB-CD2 3.89Å; K313-L318 HydrophobicContact CD-CD2 4.42Å | ||
| 314 | P | 89.9 | Confident | 91.3 | Very high | 58 Ų | 58 | 66.2 Ų | 66.2 | 38% | 0.377 | 34% | 0.343 | S | S | . | . | trans | -63.3 | 144 | 178 | 26.4 | -34.4 | 0 | 0 | 0 | 111.3 | S316 K317 | P314-S316 VanDerWaalsContact C-N 3.34Å; P314-S316 PolarHBondContact O-N 2.97Å; P314-K317 HydrophobicContact CG-CB 4.16Å; P314-K317 HydrophobicContact CG-CD 3.91Å; P314-K317 HydrophobicContact CG-CG 4.08Å; P314-K317 CarbonylContact O-C 3.6Å; P314-K317 WeakPolarHBondContact O-CA 3.23Å; P314-K317 PolarHBondContact O-N 3.48Å | ||
| 315 | W | 90.3 | Very high | 91.4 | Very high | 21 Ų | 21 | 63.4 Ų | 63.4 | 8% | 0.08 | 33% | 0.326 | C | S | . | . | G | 310 helix | trans | -50.3 | -46 | -171.2 | -178.3 | -115.3 | 0 | 0 | 0 | 114.2 | E268 I270 T272 K317 L318 R322 F325 R326 | E268-W315 PolarHBondContact O-NE1 3.08Å; I270-W315 HydrophobicContact CB-CD2 4.34Å; I270-W315 HydrophobicContact CB-CE3 4.08Å; I270-W315 HydrophobicContact CB-CH2 4.12Å; I270-W315 HydrophobicContact CB-CZ2 4.37Å; I270-W315 HydrophobicContact CB-CZ3 3.97Å; I270-W315 HydrophobicContact CD1-CH2 3.86Å; I270-W315 HydrophobicContact CD1-CZ2 4.46Å; I270-W315 HydrophobicContact CD1-CZ3 4.26Å; I270-W315 HydrophobicContact CG1-CH2 4.15Å; I270-W315 HydrophobicContact CG1-CZ2 4.35Å; I270-W315 HydrophobicContact CG1-CZ3 4.46Å; T272-W315 HydrophobicContact CG2-CB 4.09Å; T272-W315 HydrophobicContact CG2-CE3 3.87Å; W315-K317 PolarHBondContact O-N 3.28Å; W315-L318 HydrophobicContact CE3-CD1 4.09Å; W315-L318 WeakPolarHBondContact O-CB 3.18Å; W315-L318 PolarHBondContact O-N 3.4Å; W315-R322 HydrophobicContact CD2-CG 4.19Å; W315-R322 HydrophobicContact CE3-CB 4.26Å; W315-R322 HydrophobicContact CE3-CG 3.93Å; W315-R322 HydrophobicContact CH2-CB 3.66Å; W315-R322 HydrophobicContact CH2-CG 3.99Å; W315-R322 HydrophobicContact CZ2-CB 4.28Å; W315-R322 HydrophobicContact CZ2-CG 4.22Å; W315-R322 HydrophobicContact CZ3-CB 3.64Å; W315-R322 HydrophobicContact CZ3-CG 3.82Å; W315-R322 PolarHBondContact O-NE 3.45Å; W315-F325 HydrophobicContact CZ3-CB 4.09Å; W315-R326 HydrophobicContact CH2-CG 3.94Å |
| 316 | S | 88.8 | Confident | 91.4 | Very high | 98 Ų | 98 | 68.2 Ų | 68.2 | 69% | 0.685 | 34% | 0.344 | S | S | * | . | G | 310 helix | trans | -59.7 | -31.9 | 178.8 | -15.5 | 0 | 0 | 0 | 0 | 112.4 | P314 L318 | P314-S316 VanDerWaalsContact C-N 3.34Å; P314-S316 PolarHBondContact O-N 2.97Å; S316-L318 VanDerWaalsContact C-N 3.32Å; S316-L318 PolarHBondContact O-N 3.07Å |
| 317 | K | 88.2 | Confident | 91.3 | Very high | 133 Ų | 133 | 72.5 Ų | 72.5 | 58% | 0.578 | 36% | 0.358 | S | S | * | . | G | 310 helix | trans | -89.8 | 14.8 | 177.1 | -58.1 | -175.6 | -175.5 | 173.5 | 0 | 113.4 | K313 P314 W315 | K313-K317 PolarHBondContact NZ-O 3.06Å; P314-K317 HydrophobicContact CG-CB 4.16Å; P314-K317 HydrophobicContact CG-CD 3.91Å; P314-K317 HydrophobicContact CG-CG 4.08Å; P314-K317 CarbonylContact O-C 3.6Å; P314-K317 WeakPolarHBondContact O-CA 3.23Å; P314-K317 PolarHBondContact O-N 3.48Å; W315-K317 PolarHBondContact O-N 3.28Å |
| 318 | L | 89.3 | Confident | 91.4 | Very high | 18 Ų | 18 | 68.2 Ų | 68.2 | 9% | 0.094 | 34% | 0.335 | C | S | . | . | trans | -102.4 | 131.9 | 169 | -65 | 178.9 | 0 | 0 | 0 | 111.2 | T272 K313 W315 S316 R322 F325 | T272-L318 HydrophobicContact CG2-CD1 3.84Å; K313-L318 HydrophobicContact CB-CD2 3.89Å; K313-L318 HydrophobicContact CD-CD2 4.42Å; W315-L318 HydrophobicContact CE3-CD1 4.09Å; W315-L318 WeakPolarHBondContact O-CB 3.18Å; W315-L318 PolarHBondContact O-N 3.4Å; S316-L318 VanDerWaalsContact C-N 3.32Å; S316-L318 PolarHBondContact O-N 3.07Å; L318-R322 HydrophobicContact CB-CG 3.56Å; L318-R322 HydrophobicContact CD1-CG 4.34Å; L318-R322 PolarHBondContact O-NE 2.89Å; L318-F325 HydrophobicContact CD1-CD2 3.53Å; L318-F325 HydrophobicContact CD1-CE2 3.78Å; L318-F325 HydrophobicContact CD1-CG 4.46Å | ||
| 319 | K | 87.6 | Confident | 91.5 | Very high | 194 Ų | 194 | 69.3 Ų | 69.3 | 84% | 0.843 | 34% | 0.337 | S | S | * | . | S | Bend | trans | -96.7 | -107.6 | 164.5 | -166.4 | 170.4 | -177.4 | 173.8 | 0 | 109 | G321 R322 | K319-G321 PolarHBondContact O-N 3.36Å; K319-R322 PolarHBondContact O-N 3.41Å |
| 320 | S | 87.3 | Confident | 91.5 | Very high | 113 Ų | 113 | 74.7 Ų | 74.7 | 79% | 0.79 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59 | -16.7 | 177 | 51.3 | 0 | 0 | 0 | 0 | 115.3 | R322 | S320-R322 VanDerWaalsContact C-N 3.34Å; S320-R322 PolarHBondContact O-N 2.87Å |
| 321 | G | 90 | Very high | 91.6 | Very high | 22 Ų | 22 | 68.1 Ų | 68.1 | 23% | 0.227 | 34% | 0.335 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.5 | -22.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | K319 E323 T324 | K319-G321 PolarHBondContact O-N 3.36Å; G321-E323 PolarHBondContact O-N 3.13Å; G321-T324 WeakPolarHBondContact O-CB 3.18Å; G321-T324 PolarHBondContact O-N 2.99Å |
| 322 | R | 93.2 | Very high | 91.9 | Very high | 84 Ų | 84 | 64.6 Ų | 64.6 | 32% | 0.317 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -54.1 | -42.2 | -177.4 | -70.3 | -170.9 | -169 | -161.9 | 2.8 | 112.2 | W315 L318 K319 S320 T324 F325 R326 | W315-R322 HydrophobicContact CD2-CG 4.19Å; W315-R322 HydrophobicContact CE3-CB 4.26Å; W315-R322 HydrophobicContact CE3-CG 3.93Å; W315-R322 HydrophobicContact CH2-CB 3.66Å; W315-R322 HydrophobicContact CH2-CG 3.99Å; W315-R322 HydrophobicContact CZ2-CB 4.28Å; W315-R322 HydrophobicContact CZ2-CG 4.22Å; W315-R322 HydrophobicContact CZ3-CB 3.64Å; W315-R322 HydrophobicContact CZ3-CG 3.82Å; W315-R322 PolarHBondContact O-NE 3.45Å; L318-R322 HydrophobicContact CB-CG 3.56Å; L318-R322 HydrophobicContact CD1-CG 4.34Å; L318-R322 PolarHBondContact O-NE 2.89Å; K319-R322 PolarHBondContact O-N 3.41Å; S320-R322 VanDerWaalsContact C-N 3.34Å; S320-R322 PolarHBondContact O-N 2.87Å; R322-T324 PolarHBondContact O-N 2.97Å; R322-F325 PolarHBondContact O-N 2.83Å; R322-F325 VanDerWaalsContact O-N 3.08Å; R322-R326 PolarHBondContact O-N 3.31Å |
| 323 | E | 92.8 | Very high | 92 | Very high | 73 Ų | 73 | 69.2 Ų | 69.2 | 34% | 0.341 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -62 | -28.9 | -179.7 | 178.7 | 55.1 | -163.8 | 0 | 0 | 113.8 | G321 R326 R327 | G321-E323 PolarHBondContact O-N 3.13Å; E323-R326 PolarHBondContact O-N 3.02Å; E323-R326 IonicContact OE2-NH1 3.04Å; E323-R327 WeakPolarHBondContact O-CG 3.46Å; E323-R327 PolarHBondContact O-N 2.85Å; E323-R327 IonicContact OE1-CZ 3.52Å; E323-R327 IonicContact OE1-NE 2.67Å; E323-R327 PolarHBondContact OE1-NE 3.47Å; E323-R327 IonicContact OE1-NH2 2.76Å; E323-R327 PolarHBondContact OE1-NH2 2.86Å |
| 324 | T | 94.1 | Very high | 92.1 | Very high | 15 Ų | 15 | 66.7 Ų | 66.7 | 9% | 0.092 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -71.6 | -37.4 | 175.8 | -53.7 | 0 | 0 | 0 | 0 | 110.9 | L298 L308 G321 R322 M328 | L298-T324 HydrophobicContact CB-CG2 4.49Å; L298-T324 HydrophobicContact CD1-CG2 4.07Å; L298-T324 HydrophobicContact CD2-CG2 4.32Å; L308-T324 HydrophobicContact CD1-CG2 3.83Å; G321-T324 WeakPolarHBondContact O-CB 3.18Å; G321-T324 PolarHBondContact O-N 2.99Å; R322-T324 PolarHBondContact O-N 2.97Å; T324-M328 HydrophobicContact CG2-CE 4.33Å; T324-M328 WeakPolarHBondContact O-CG 2.97Å; T324-M328 PolarHBondContact O-N 3.1Å |
| 325 | F | 95.1 | Very high | 92.3 | Very high | 0 Ų | 0 | 66.8 Ų | 66.8 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -72.6 | -33.6 | 173.2 | -77.8 | -84.2 | 0 | 0 | 0 | 112.8 | T272 V275 L308 P312 W315 L318 R322 R327 M328 W329 | T272-F325 HydrophobicContact CG2-CB 4.45Å; T272-F325 HydrophobicContact CG2-CD1 3.89Å; T272-F325 HydrophobicContact CG2-CD2 4.04Å; T272-F325 HydrophobicContact CG2-CE1 4.08Å; T272-F325 HydrophobicContact CG2-CE2 4.21Å; T272-F325 HydrophobicContact CG2-CG 3.87Å; T272-F325 HydrophobicContact CG2-CZ 4.23Å; T272-F325 WeakPolarHBondContact O-CE1 3.33Å; V275-F325 HydrophobicContact CB-CD1 4.38Å; V275-F325 HydrophobicContact CG1-CD1 4.11Å; L308-F325 HydrophobicContact CD2-CE2 3.9Å; L308-F325 HydrophobicContact CD2-CZ 4.22Å; P312-F325 HydrophobicContact CB-CE1 4.21Å; P312-F325 HydrophobicContact CB-CZ 3.98Å; W315-F325 HydrophobicContact CZ3-CB 4.09Å; L318-F325 HydrophobicContact CD1-CD2 3.53Å; L318-F325 HydrophobicContact CD1-CE2 3.78Å; L318-F325 HydrophobicContact CD1-CG 4.46Å; R322-F325 PolarHBondContact O-N 2.83Å; R322-F325 VanDerWaalsContact O-N 3.08Å; F325-R327 VanDerWaalsContact C-N 3.31Å; F325-R327 PolarHBondContact O-N 3.4Å; F325-M328 HydrophobicContact CD1-SD 3.84Å; F325-M328 HydrophobicContact CE1-SD 4.1Å; F325-M328 HydrophobicContact CG-SD 4.4Å; F325-M328 WeakPolarHBondContact O-CB 3.46Å; F325-M328 PolarHBondContact O-N 3.29Å; F325-W329 WeakPolarHBondContact O-CB 3.31Å; F325-W329 PolarHBondContact O-N 2.92Å |
| 326 | R | 93.9 | Very high | 92.4 | Very high | 101 Ų | 101 | 70.9 Ų | 70.9 | 38% | 0.381 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -59.5 | -40 | 172 | -69 | -165.9 | -173.6 | 115.6 | -4.8 | 112.5 | I270 W315 R322 E323 W329 K330 | I270-R326 HydrophobicContact CD1-CG 3.85Å; W315-R326 HydrophobicContact CH2-CG 3.94Å; R322-R326 PolarHBondContact O-N 3.31Å; E323-R326 PolarHBondContact O-N 3.02Å; E323-R326 IonicContact OE2-NH1 3.04Å; R326-W329 PolarHBondContact O-N 3.31Å; R326-K330 WeakPolarHBondContact O-CB 3.24Å; R326-K330 PolarHBondContact O-N 3.28Å |
| 327 | R | 93.5 | Very high | 92.5 | Very high | 100 Ų | 100 | 73.4 Ų | 73.4 | 38% | 0.377 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -69.3 | -39.4 | 176.7 | -67.6 | 172.3 | -163.4 | -165.5 | -1.6 | 112.6 | L298 E323 F325 W331 | L298-R327 HydrophobicContact CD2-CB 3.68Å; E323-R327 WeakPolarHBondContact O-CG 3.46Å; E323-R327 PolarHBondContact O-N 2.85Å; E323-R327 IonicContact OE1-CZ 3.52Å; E323-R327 IonicContact OE1-NE 2.67Å; E323-R327 PolarHBondContact OE1-NE 3.47Å; E323-R327 IonicContact OE1-NH2 2.76Å; E323-R327 PolarHBondContact OE1-NH2 2.86Å; F325-R327 VanDerWaalsContact C-N 3.31Å; F325-R327 PolarHBondContact O-N 3.4Å; R327-W331 WeakPolarHBondContact O-CB 3.47Å; R327-W331 PolarHBondContact O-N 2.72Å |
| 328 | M | 95.6 | Very high | 92.6 | Very high | 0 Ų | 0 | 70.5 Ų | 70.5 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -58.7 | -51.4 | 170.6 | -70.5 | 173 | 177 | 0 | 0 | 111.4 | V275 I279 F293 L298 L305 L308 L309 T324 F325 W331 L332 | V275-M328 HydrophobicContact CG1-CB 3.53Å; V275-M328 HydrophobicContact CG1-SD 4.25Å; I279-M328 HydrophobicContact CD1-CB 4.02Å; I279-M328 HydrophobicContact CD1-CG 4.38Å; I279-M328 HydrophobicContact CG1-CB 3.84Å; I279-M328 HydrophobicContact CG1-CG 4.07Å; I279-M328 HydrophobicContact CG1-SD 4.43Å; F293-M328 HydrophobicContact CE1-CG 4.24Å; F293-M328 HydrophobicContact CZ-CG 4.36Å; L298-M328 HydrophobicContact CD1-CE 3.59Å; L298-M328 HydrophobicContact CD1-CG 4.18Å; L298-M328 HydrophobicContact CD2-CG 3.93Å; L305-M328 HydrophobicContact CD1-CE 3.45Å; L305-M328 VanDerWaalsContact CD1-CE 3.45Å; L308-M328 HydrophobicContact CB-CE 4.42Å; L308-M328 HydrophobicContact CD1-CE 4.35Å; L309-M328 HydrophobicContact CD2-CE 4.28Å; T324-M328 HydrophobicContact CG2-CE 4.33Å; T324-M328 WeakPolarHBondContact O-CG 2.97Å; T324-M328 PolarHBondContact O-N 3.1Å; F325-M328 HydrophobicContact CD1-SD 3.84Å; F325-M328 HydrophobicContact CE1-SD 4.1Å; F325-M328 HydrophobicContact CG-SD 4.4Å; F325-M328 WeakPolarHBondContact O-CB 3.46Å; F325-M328 PolarHBondContact O-N 3.29Å; M328-W331 PolarHBondContact O-N 3.16Å; M328-L332 WeakPolarHBondContact O-CG 3.36Å; M328-L332 PolarHBondContact O-N 3.38Å |
| 329 | W | 94.6 | Very high | 92.8 | Very high | 61 Ų | 61 | 70.8 Ų | 70.8 | 23% | 0.231 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -62.4 | -49.8 | -179.9 | -178.6 | 80.2 | 0 | 0 | 0 | 111.5 | V267 I270 V275 F325 R326 W331 L332 Q333 | V267-W329 HydrophobicContact CG1-CZ3 4.38Å; V267-W329 HydrophobicContact CG2-CH2 4.28Å; V267-W329 HydrophobicContact CG2-CZ3 4.42Å; I270-W329 HydrophobicContact CD1-CB 4.21Å; I270-W329 HydrophobicContact CD1-CD2 4.36Å; I270-W329 HydrophobicContact CD1-CE3 4.46Å; I270-W329 HydrophobicContact CD1-CG 4.26Å; I270-W329 HydrophobicContact CG2-CB 4.4Å; V275-W329 HydrophobicContact CG1-CB 4.5Å; V275-W329 HydrophobicContact CG2-CB 4.16Å; V275-W329 HydrophobicContact CG2-CG 4.43Å; F325-W329 WeakPolarHBondContact O-CB 3.31Å; F325-W329 PolarHBondContact O-N 2.92Å; R326-W329 PolarHBondContact O-N 3.31Å; W329-W331 VanDerWaalsContact C-N 3.32Å; W329-W331 PolarHBondContact O-N 3.19Å; W329-L332 WeakPolarHBondContact O-CB 3.37Å; W329-L332 PolarHBondContact O-N 2.84Å; W329-Q333 HydrophobicContact CD2-CG 4.14Å; W329-Q333 HydrophobicContact CE3-CG 4.41Å; W329-Q333 HydrophobicContact CH2-CG 4.3Å; W329-Q333 HydrophobicContact CZ2-CG 4Å; W329-Q333 HydrophobicContact CZ3-CG 4.48Å; W329-Q333 WeakPolarHBondContact O-CG 3.46Å; W329-Q333 PolarHBondContact O-N 2.82Å; W329-Q333 VanDerWaalsContact O-N 3.08Å |
| 330 | K | 94.2 | Very high | 92.9 | Very high | 133 Ų | 133 | 64.8 Ų | 64.8 | 58% | 0.578 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -54 | -47.5 | 175.8 | 179.3 | 174.8 | 176.1 | 175.6 | 0 | 111.6 | R326 L332 Q333 E334 | R326-K330 WeakPolarHBondContact O-CB 3.24Å; R326-K330 PolarHBondContact O-N 3.28Å; K330-L332 VanDerWaalsContact C-N 3.3Å; K330-L332 PolarHBondContact O-N 3.22Å; K330-Q333 PolarHBondContact O-N 3.06Å; K330-Q333 VanDerWaalsContact O-N 3.11Å; K330-E334 PolarHBondContact O-N 3.37Å; K330-E334 VanDerWaalsContact O-N 3.16Å |
| 331 | W | 94.8 | Very high | 92.9 | Very high | 5 Ų | 5 | 61 Ų | 61 | 2% | 0.019 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -65.1 | -30.7 | 178.7 | -180 | 83.6 | 0 | 0 | 0 | 112.9 | I279 E282 I288 F293 I297 R327 M328 W329 Q333 E334 R339 L343 | I279-W331 HydrophobicContact CD1-CE3 3.69Å; I279-W331 HydrophobicContact CD1-CZ3 3.9Å; E282-W331 HydrophobicContact CB-CZ3 4.28Å; E282-W331 HydrophobicContact CG-CH2 4.11Å; E282-W331 HydrophobicContact CG-CZ3 4.08Å; I288-W331 HydrophobicContact CD1-CH2 4.1Å; I288-W331 HydrophobicContact CD1-CZ2 4.21Å; F293-W331 HydrophobicContact CD2-CD2 4.36Å; F293-W331 HydrophobicContact CD2-CE3 4.47Å; F293-W331 HydrophobicContact CD2-CZ2 4.41Å; F293-W331 AromaticContact CE2-CD2 3.53Å; F293-W331 HydrophobicContact CE2-CD2 3.53Å; F293-W331 AromaticContact CE2-CE2 3.92Å; F293-W331 AromaticContact CE2-CE3 3.59Å; F293-W331 HydrophobicContact CE2-CE3 3.59Å; F293-W331 AromaticContact CE2-CG 3.95Å; F293-W331 HydrophobicContact CE2-CG 3.95Å; F293-W331 HydrophobicContact CE2-CH2 4.39Å; F293-W331 HydrophobicContact CE2-CZ2 4.34Å; F293-W331 HydrophobicContact CE2-CZ3 4.04Å; F293-W331 HydrophobicContact CZ-CD2 4.35Å; F293-W331 HydrophobicContact CZ-CE3 4.11Å; I297-W331 HydrophobicContact CG2-CB 3.96Å; I297-W331 HydrophobicContact CG2-CG 4.09Å; R327-W331 WeakPolarHBondContact O-CB 3.47Å; R327-W331 PolarHBondContact O-N 2.72Å; M328-W331 PolarHBondContact O-N 3.16Å; W329-W331 VanDerWaalsContact C-N 3.32Å; W329-W331 PolarHBondContact O-N 3.19Å; W331-Q333 VanDerWaalsContact C-N 3.35Å; W331-E334 PolarHBondContact O-N 3.13Å; W331-R339 HydrophobicContact CD2-CG 4.41Å; W331-R339 HydrophobicContact CZ2-CB 3.84Å; W331-R339 HydrophobicContact CZ2-CG 4.41Å; W331-R339 PolarHBondContact NE1-O 3.49Å; W331-R339 WeakPolarHBondContact O-CD 3.49Å; W331-R339 VanDerWaalsContact O-CG 3.26Å; W331-R339 WeakPolarHBondContact O-CG 3.32Å; W331-L343 HydrophobicContact CZ2-CD1 4.13Å |
| 332 | L | 94.6 | Very high | 92.8 | Very high | 17 Ų | 17 | 61.2 Ų | 61.2 | 9% | 0.089 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -66.2 | -36.7 | 171.2 | -73.6 | 169.3 | 0 | 0 | 0 | 112.4 | V275 R278 I279 E282 M328 W329 K330 E334 R339 | V275-L332 HydrophobicContact CG1-CD1 4.36Å; R278-L332 HydrophobicContact CB-CD1 3.54Å; R278-L332 HydrophobicContact CB-CD2 4.1Å; R278-L332 HydrophobicContact CB-CG 4.49Å; I279-L332 HydrophobicContact CD1-CD1 4Å; I279-L332 HydrophobicContact CD1-CD2 3.92Å; I279-L332 HydrophobicContact CD1-CG 3.69Å; I279-L332 HydrophobicContact CG1-CD1 4.04Å; I279-L332 HydrophobicContact CG1-CG 4.3Å; E282-L332 HydrophobicContact CB-CD2 4.22Å; E282-L332 HydrophobicContact CG-CD2 4.38Å; M328-L332 WeakPolarHBondContact O-CG 3.36Å; M328-L332 PolarHBondContact O-N 3.38Å; W329-L332 WeakPolarHBondContact O-CB 3.37Å; W329-L332 PolarHBondContact O-N 2.84Å; K330-L332 VanDerWaalsContact C-N 3.3Å; K330-L332 PolarHBondContact O-N 3.22Å; L332-E334 VanDerWaalsContact C-N 3.31Å; L332-R339 PolarHBondContact O-NH1 3.03Å |
| 333 | Q | 93.6 | Very high | 92.5 | Very high | 122 Ų | 122 | 58 Ų | 58 | 57% | 0.57 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -75.3 | -13.9 | 177.8 | -57.6 | -58.2 | 105.7 | 0 | 0 | 113.8 | W329 K330 W331 | W329-Q333 HydrophobicContact CD2-CG 4.14Å; W329-Q333 HydrophobicContact CE3-CG 4.41Å; W329-Q333 HydrophobicContact CH2-CG 4.3Å; W329-Q333 HydrophobicContact CZ2-CG 4Å; W329-Q333 HydrophobicContact CZ3-CG 4.48Å; W329-Q333 WeakPolarHBondContact O-CG 3.46Å; W329-Q333 PolarHBondContact O-N 2.82Å; W329-Q333 VanDerWaalsContact O-N 3.08Å; K330-Q333 PolarHBondContact O-N 3.06Å; K330-Q333 VanDerWaalsContact O-N 3.11Å; W331-Q333 VanDerWaalsContact C-N 3.35Å |
| 334 | E | 93.1 | Very high | 91.9 | Very high | 33 Ų | 33 | 62.2 Ų | 62.2 | 15% | 0.154 | 28% | 0.283 | C | S | . | . | S | Bend | trans | -71.7 | 143.2 | 176.2 | -72.8 | 179.6 | 154.6 | 0 | 0 | 111 | K330 W331 L332 Q338 R339 | K330-E334 PolarHBondContact O-N 3.37Å; K330-E334 VanDerWaalsContact O-N 3.16Å; W331-E334 PolarHBondContact O-N 3.13Å; L332-E334 VanDerWaalsContact C-N 3.31Å; E334-Q338 HydrophobicContact CB-CB 4.3Å; E334-Q338 HydrophobicContact CB-CG 4.09Å; E334-Q338 HydrophobicContact CG-CG 4.15Å; E334-Q338 PolarHBondContact OE1-NE2 3.21Å; E334-R339 HydrophobicContact CB-CG 3.73Å; E334-R339 WeakPolarHBondContact O-CD 3.25Å; E334-R339 VanDerWaalsContact O-CG 3.23Å; E334-R339 WeakPolarHBondContact O-CG 3.46Å |
| 335 | P | 93.4 | Very high | 90.4 | Very high | 60 Ų | 60 | 67.6 Ų | 67.6 | 39% | 0.39 | 31% | 0.311 | S | S | . | . | trans | -66 | 153.4 | 176.3 | 28.4 | -35.1 | 0 | 0 | 0 | 111 | F337 Q338 R339 | P335-F337 VanDerWaalsContact C-N 3.31Å; P335-F337 HydrophobicContact CB-CD1 3.97Å; P335-F337 HydrophobicContact CB-CE1 3.59Å; P335-F337 HydrophobicContact CB-CZ 4.24Å; P335-F337 HydrophobicContact CG-CD1 4.17Å; P335-F337 HydrophobicContact CG-CE1 3.51Å; P335-F337 HydrophobicContact CG-CE2 4.37Å; P335-F337 HydrophobicContact CG-CZ 3.62Å; P335-F337 PolarHBondContact O-N 3.46Å; P335-F337 VanDerWaalsContact O-N 3.12Å; P335-Q338 HydrophobicContact CG-CB 3.91Å; P335-Q338 WeakPolarHBondContact O-CA 3.3Å; P335-Q338 WeakPolarHBondContact O-CB 3.5Å; P335-Q338 PolarHBondContact O-N 3.37Å; P335-R339 PolarHBondContact O-N 3.17Å | ||
| 336 | E | 91.9 | Very high | 88.6 | Confident | 106 Ų | 106 | 69 Ų | 69 | 50% | 0.495 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -52.9 | -43.2 | -168.3 | -173.5 | 175 | 136.1 | 0 | 0 | 114.1 | Y286 Q338 R339 M340 | Y286-E336 VanDerWaalsContact CE1-CD 3.43Å; Y286-E336 HydrophobicContact CE1-CG 4.09Å; Y286-E336 WeakPolarHBondContact CE1-OE1 3.43Å; Y286-E336 WeakPolarHBondContact CE1-OE2 3.41Å; Y286-E336 PolarHBondContact OH-OE2 2.85Å; E336-Q338 VanDerWaalsContact C-N 3.26Å; E336-Q338 PolarHBondContact O-N 3.16Å; E336-R339 PolarHBondContact O-N 2.73Å; E336-M340 WeakPolarHBondContact O-CB 3.41Å; E336-M340 PolarHBondContact O-N 3.2Å |
| 337 | F | 91.3 | Very high | 86.7 | Confident | 151 Ų | 151 | 66.4 Ų | 66.4 | 66% | 0.662 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -61.6 | -34 | 177.9 | 70 | -94.7 | 0 | 0 | 0 | 112.7 | P335 S341 | P335-F337 VanDerWaalsContact C-N 3.31Å; P335-F337 HydrophobicContact CB-CD1 3.97Å; P335-F337 HydrophobicContact CB-CE1 3.59Å; P335-F337 HydrophobicContact CB-CZ 4.24Å; P335-F337 HydrophobicContact CG-CD1 4.17Å; P335-F337 HydrophobicContact CG-CE1 3.51Å; P335-F337 HydrophobicContact CG-CE2 4.37Å; P335-F337 HydrophobicContact CG-CZ 3.62Å; P335-F337 PolarHBondContact O-N 3.46Å; P335-F337 VanDerWaalsContact O-N 3.12Å; F337-S341 WeakPolarHBondContact O-CB 3.21Å; F337-S341 PolarHBondContact O-N 3.06Å |
| 338 | Q | 91.8 | Very high | 84.5 | Confident | 73 Ų | 73 | 66.7 Ų | 66.7 | 34% | 0.341 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -77.2 | -40.5 | 176.5 | -179.1 | 169.9 | -23.7 | 0 | 0 | 111.3 | E334 P335 E336 M340 S341 A342 | E334-Q338 HydrophobicContact CB-CB 4.3Å; E334-Q338 HydrophobicContact CB-CG 4.09Å; E334-Q338 HydrophobicContact CG-CG 4.15Å; E334-Q338 PolarHBondContact OE1-NE2 3.21Å; P335-Q338 HydrophobicContact CG-CB 3.91Å; P335-Q338 WeakPolarHBondContact O-CA 3.3Å; P335-Q338 WeakPolarHBondContact O-CB 3.5Å; P335-Q338 PolarHBondContact O-N 3.37Å; E336-Q338 VanDerWaalsContact C-N 3.26Å; E336-Q338 PolarHBondContact O-N 3.16Å; Q338-M340 PolarHBondContact O-N 3.31Å; Q338-S341 WeakPolarHBondContact CA-OG 3.35Å; Q338-S341 PolarHBondContact O-N 3.41Å; Q338-S341 VanDerWaalsContact O-N 3.13Å; Q338-S341 PolarHBondContact O-OG 3.34Å; Q338-S341 VanDerWaalsContact O-OG 3.07Å; Q338-A342 WeakPolarHBondContact O-CB 3.5Å; Q338-A342 PolarHBondContact O-N 3.01Å |
| 339 | R | 91.7 | Very high | 82.4 | Confident | 24 Ų | 24 | 75.6 Ų | 75.6 | 9% | 0.091 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -56.3 | -42.6 | 172.6 | -62.8 | -166.5 | -58.8 | -174.4 | 11.8 | 111.5 | E282 Y286 W331 L332 E334 P335 E336 L343 | E282-R339 IonicContact OE1-NH2 3.77Å; E282-R339 IonicContact OE2-CZ 3.65Å; E282-R339 IonicContact OE2-NH1 3.74Å; E282-R339 PolarHBondContact OE2-NH1 3.28Å; E282-R339 IonicContact OE2-NH2 2.85Å; E282-R339 PolarHBondContact OE2-NH2 3.25Å; Y286-R339 PolarHBondContact OH-NH2 3.02Å; W331-R339 HydrophobicContact CD2-CG 4.41Å; W331-R339 HydrophobicContact CZ2-CB 3.84Å; W331-R339 HydrophobicContact CZ2-CG 4.41Å; W331-R339 PolarHBondContact NE1-O 3.49Å; W331-R339 WeakPolarHBondContact O-CD 3.49Å; W331-R339 VanDerWaalsContact O-CG 3.26Å; W331-R339 WeakPolarHBondContact O-CG 3.32Å; L332-R339 PolarHBondContact O-NH1 3.03Å; E334-R339 HydrophobicContact CB-CG 3.73Å; E334-R339 WeakPolarHBondContact O-CD 3.25Å; E334-R339 VanDerWaalsContact O-CG 3.23Å; E334-R339 WeakPolarHBondContact O-CG 3.46Å; P335-R339 PolarHBondContact O-N 3.17Å; E336-R339 PolarHBondContact O-N 2.73Å; R339-L343 WeakPolarHBondContact O-CG 3.41Å; R339-L343 PolarHBondContact O-N 2.8Å |
| 340 | M | 90.9 | Very high | 80.2 | Confident | 68 Ų | 68 | 75.6 Ų | 75.6 | 34% | 0.335 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -79.3 | -23.9 | 178.2 | -162.9 | 59.6 | 71.7 | 0 | 0 | 113.3 | Y286 E336 Q338 L343 R344 | Y286-M340 HydrophobicContact CD1-CE 4.49Å; Y286-M340 HydrophobicContact CG-CE 4.48Å; E336-M340 WeakPolarHBondContact O-CB 3.41Å; E336-M340 PolarHBondContact O-N 3.2Å; Q338-M340 PolarHBondContact O-N 3.31Å; M340-L343 HydrophobicContact SD-CD1 4.4Å; M340-R344 WeakPolarHBondContact O-CG 3.48Å; M340-R344 PolarHBondContact O-NE 3.23Å |
| 341 | S | 87.8 | Confident | 77.9 | Confident | 34 Ų | 34 | 77.9 Ų | 77.9 | 24% | 0.238 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -77.4 | -39.5 | 171.8 | 78.2 | 0 | 0 | 0 | 0 | 111.6 | F337 Q338 L343 R344 L345 | F337-S341 WeakPolarHBondContact O-CB 3.21Å; F337-S341 PolarHBondContact O-N 3.06Å; Q338-S341 WeakPolarHBondContact CA-OG 3.35Å; Q338-S341 PolarHBondContact O-N 3.41Å; Q338-S341 VanDerWaalsContact O-N 3.13Å; Q338-S341 PolarHBondContact O-OG 3.34Å; Q338-S341 VanDerWaalsContact O-OG 3.07Å; S341-L343 VanDerWaalsContact C-N 3.34Å; S341-L343 PolarHBondContact O-N 2.98Å; S341-R344 CarbonylContact O-C 3.58Å; S341-R344 PolarHBondContact O-N 3.28Å; S341-L345 WeakPolarHBondContact O-CB 3.39Å; S341-L345 WeakPolarHBondContact O-CG 3.44Å; S341-L345 PolarHBondContact O-N 3.23Å |
| 342 | A | 86.8 | Confident | 75.6 | Confident | 25 Ų | 25 | 85.7 Ų | 85.7 | 21% | 0.207 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -59.2 | -42.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | I297 Q338 R344 A346 | I297-A342 HydrophobicContact CD1-CB 3.79Å; Q338-A342 WeakPolarHBondContact O-CB 3.5Å; Q338-A342 PolarHBondContact O-N 3.01Å; A342-R344 VanDerWaalsContact C-N 3.28Å; A342-R344 PolarHBondContact O-N 3.04Å; A342-A346 VanDerWaalsContact O-CB 3.24Å; A342-A346 WeakPolarHBondContact O-CB 3.3Å; A342-A346 PolarHBondContact O-N 2.87Å |
| 343 | L | 87.3 | Confident | 73.3 | Confident | 16 Ų | 16 | 92.5 Ų | 92.5 | 8% | 0.084 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -61.7 | -33.7 | 174.6 | -69.8 | 168.8 | 0 | 0 | 0 | 113 | I288 I292 F293 R296 I297 W331 R339 M340 S341 | I288-L343 HydrophobicContact CD1-CD1 3.72Å; I288-L343 HydrophobicContact CG1-CD1 4.07Å; I288-L343 HydrophobicContact CG2-CD1 4.11Å; I288-L343 HydrophobicContact CG2-CD2 4.33Å; I292-L343 HydrophobicContact CG2-CD2 4.24Å; F293-L343 HydrophobicContact CD2-CD2 4.38Å; R296-L343 HydrophobicContact CB-CD2 4.47Å; I297-L343 HydrophobicContact CD1-CD2 4.17Å; I297-L343 HydrophobicContact CD1-CG 4.49Å; I297-L343 HydrophobicContact CG1-CD2 3.95Å; W331-L343 HydrophobicContact CZ2-CD1 4.13Å; R339-L343 WeakPolarHBondContact O-CG 3.41Å; R339-L343 PolarHBondContact O-N 2.8Å; M340-L343 HydrophobicContact SD-CD1 4.4Å; S341-L343 VanDerWaalsContact C-N 3.34Å; S341-L343 PolarHBondContact O-N 2.98Å |
| 344 | R | 80.2 | Confident | 71 | Confident | 162 Ų | 162 | 91.9 Ų | 91.9 | 61% | 0.611 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -83 | -48.9 | 179.3 | -72.2 | -179.9 | -72 | 162.3 | -2.2 | 112.9 | M340 S341 A342 A346 A347 | M340-R344 WeakPolarHBondContact O-CG 3.48Å; M340-R344 PolarHBondContact O-NE 3.23Å; S341-R344 CarbonylContact O-C 3.58Å; S341-R344 PolarHBondContact O-N 3.28Å; A342-R344 VanDerWaalsContact C-N 3.28Å; A342-R344 PolarHBondContact O-N 3.04Å; R344-A346 VanDerWaalsContact C-N 3.32Å; R344-A346 PolarHBondContact O-N 2.71Å; R344-A347 WeakPolarHBondContact O-CB 3.41Å; R344-A347 PolarHBondContact O-N 3.46Å |
| 345 | L | 62.5 | Low | 68.7 | Low | 129 Ų | 129 | 97.9 Ų | 97.9 | 68% | 0.675 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -63.4 | -37.3 | -178 | -73.7 | 166 | 0 | 0 | 0 | 112.2 | S341 A347 C348 | S341-L345 WeakPolarHBondContact O-CB 3.39Å; S341-L345 WeakPolarHBondContact O-CG 3.44Å; S341-L345 PolarHBondContact O-N 3.23Å; L345-A347 PolarHBondContact O-N 3.18Å; L345-A347 VanDerWaalsContact O-N 3.09Å; L345-C348 PolarHBondContact O-N 3.24Å |
| 346 | A | 57 | Low | 66.4 | Low | 29 Ų | 29 | 103.3 Ų | 103.3 | 24% | 0.24 | 50% | 0.5 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -5.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | R296 A342 R344 | R296-A346 HydrophobicContact CB-CB 3.77Å; R296-A346 VanDerWaalsContact CD-C 3.49Å; R296-A346 WeakPolarHBondContact CD-O 3.45Å; R296-A346 HydrophobicContact CG-CB 4.23Å; R296-A346 PolarHBondContact NH1-O 3.05Å; A342-A346 VanDerWaalsContact O-CB 3.24Å; A342-A346 WeakPolarHBondContact O-CB 3.3Å; A342-A346 PolarHBondContact O-N 2.87Å; R344-A346 VanDerWaalsContact C-N 3.32Å; R344-A346 PolarHBondContact O-N 2.71Å |
| 347 | A | 54 | Low | 64.3 | Low | 47 Ų | 47 | 106.2 Ų | 106.2 | 39% | 0.388 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62 | -50 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | R296 R344 L345 | R296-A347 PolarHBondContact NH1-O 2.97Å; R296-A347 VanDerWaalsContact NH1-O 3.1Å; R344-A347 WeakPolarHBondContact O-CB 3.41Å; R344-A347 PolarHBondContact O-N 3.46Å; L345-A347 PolarHBondContact O-N 3.18Å; L345-A347 VanDerWaalsContact O-N 3.09Å |
| 348 | C | 48.6 | Very low | 62 | Low | 106 Ų | 106 | 104.1 Ų | 104.1 | 72% | 0.716 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.4 | -39 | -169 | -56.8 | 0 | 0 | 0 | 0 | 113.2 | L345 R350 K351 | L345-C348 PolarHBondContact O-N 3.24Å; C348-R350 PolarHBondContact O-N 3.06Å; C348-K351 PolarHBondContact O-N 3.36Å |
| 349 | K | 51.1 | Low | 59.8 | Low | 186 Ų | 186 | 112.2 Ų | 112.2 | 81% | 0.809 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.4 | 31.6 | -169 | -149.2 | -176.5 | -177.1 | 176.6 | 0 | 115.4 | ||
| 350 | R | 48 | Very low | 57.7 | Low | 62 Ų | 62 | 117.2 Ų | 117.2 | 23% | 0.234 | 56% | 0.563 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -134.7 | -11.7 | 173.4 | -134.3 | -156 | -54.7 | 138.5 | 1.9 | 116.6 | C348 E352 Q353 E354 | C348-R350 PolarHBondContact O-N 3.06Å; R350-E352 PolarHBondContact O-N 3.13Å; R350-Q353 PolarHBondContact O-N 3.27Å; R350-Q353 VanDerWaalsContact O-N 3.16Å; R350-E354 WeakPolarHBondContact O-CB 3.45Å; R350-E354 PolarHBondContact O-N 3.08Å |
| 351 | K | 45.1 | Very low | 55.9 | Low | 181 Ų | 181 | 119.7 Ų | 119.7 | 79% | 0.787 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -55.8 | -38.1 | 174.6 | -89.6 | -166.3 | 168.6 | -170.8 | 0 | 112.1 | C348 Q355 | C348-K351 PolarHBondContact O-N 3.36Å; K351-Q355 PolarHBondContact O-N 2.94Å |
| 352 | E | 47.6 | Very low | 54.7 | Low | 169 Ų | 169 | 120.9 Ų | 120.9 | 79% | 0.79 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -65.7 | -38 | 178.4 | -170.7 | 176 | -155.8 | 0 | 0 | 113.6 | R350 | R350-E352 PolarHBondContact O-N 3.13Å |
| 353 | Q | 46 | Very low | 53.6 | Low | 160 Ų | 160 | 125.7 Ų | 125.7 | 75% | 0.748 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -86.8 | -17.8 | -179.5 | -173.4 | 167.6 | 79.1 | 0 | 0 | 113.3 | R350 | R350-Q353 PolarHBondContact O-N 3.27Å; R350-Q353 VanDerWaalsContact O-N 3.16Å |
| 354 | E | 46 | Very low | 53.1 | Low | 108 Ų | 108 | 134.8 Ų | 134.8 | 51% | 0.505 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -75.9 | -42.7 | 177.9 | -158.8 | 139.8 | -130.4 | 0 | 0 | 110.9 | R350 H356 K357 | R350-E354 WeakPolarHBondContact O-CB 3.45Å; R350-E354 PolarHBondContact O-N 3.08Å; E354-H356 VanDerWaalsContact C-N 3.27Å; E354-H356 PolarHBondContact O-N 3.02Å; E354-H356 VanDerWaalsContact O-N 3.15Å; E354-K357 VanDerWaalsContact O-CB 3.31Å; E354-K357 WeakPolarHBondContact O-CB 3.21Å; E354-K357 PolarHBondContact O-N 3.22Å |
| 355 | Q | 44.4 | Very low | 53 | Low | 160 Ų | 160 | 136.8 Ų | 136.8 | 75% | 0.748 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.3 | -23.4 | -175 | -170 | 170.8 | 72.4 | 0 | 0 | 115.1 | K351 K357 | K351-Q355 PolarHBondContact O-N 2.94Å; Q355-K357 PolarHBondContact O-N 3.49Å |
| 356 | H | 44.3 | Very low | 54.1 | Low | 173 Ų | 173 | 139.6 Ų | 139.6 | 80% | 0.801 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.4 | -14.7 | 174.1 | -164.9 | 3.6 | 0 | 0 | 0 | 112.6 | E354 | E354-H356 VanDerWaalsContact C-N 3.27Å; E354-H356 PolarHBondContact O-N 3.02Å; E354-H356 VanDerWaalsContact O-N 3.15Å |
| 357 | K | 47 | Very low | 55.6 | Low | 168 Ų | 168 | 149 Ų | 149 | 73% | 0.73 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -95.1 | -14.5 | -168.8 | -164.5 | 157 | -173.7 | 161.5 | 0 | 115.3 | E354 Q355 R359 | E354-K357 VanDerWaalsContact O-CB 3.31Å; E354-K357 WeakPolarHBondContact O-CB 3.21Å; E354-K357 PolarHBondContact O-N 3.22Å; Q355-K357 PolarHBondContact O-N 3.49Å; K357-R359 VanDerWaalsContact C-N 3.26Å; K357-R359 PolarHBondContact O-N 3.25Å |
| 358 | D | 43.4 | Very low | 57.5 | Low | 107 Ų | 107 | 151.7 Ų | 151.7 | 57% | 0.572 | 72% | 0.721 | S | S | * | * | G | 310 helix | trans | -71.2 | -18 | -176.4 | -65.3 | -60.5 | 0 | 0 | 0 | 113.9 | N360 | D358-N360 PolarHBondContact O-N 3.3Å; D358-N360 VanDerWaalsContact O-N 3.12Å |
| 359 | R | 46.8 | Very low | 59.6 | Low | 243 Ų | 243 | 152.1 Ų | 152.1 | 92% | 0.917 | 72% | 0.72 | S | S | * | * | G | 310 helix | trans | -77 | 10.1 | -179.1 | -144.5 | 174.8 | 81.5 | 178.4 | 5.2 | 115.2 | K357 | K357-R359 VanDerWaalsContact C-N 3.26Å; K357-R359 PolarHBondContact O-N 3.25Å |
| 360 | N | 46.5 | Very low | 61.7 | Low | 129 Ų | 129 | 145.2 Ų | 145.2 | 69% | 0.69 | 69% | 0.691 | S | S | * | * | G | 310 helix | trans | -154.7 | 69.5 | 171.5 | -162.7 | -20.9 | 0 | 0 | 0 | 112.6 | D358 A362 | D358-N360 PolarHBondContact O-N 3.3Å; D358-N360 VanDerWaalsContact O-N 3.12Å; N360-A362 PolarHBondContact O-N 3.19Å; N360-A362 VanDerWaalsContact O-N 3.12Å |
| 361 | T | 53.3 | Low | 64.1 | Low | 119 Ų | 119 | 145.9 Ų | 145.9 | 73% | 0.73 | 70% | 0.702 | S | S | * | * | trans | -82.7 | 43.1 | 175.7 | 43.7 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 362 | A | 63.5 | Low | 66.5 | Low | 60 Ų | 60 | 141.9 Ų | 141.9 | 50% | 0.496 | 69% | 0.689 | S | S | . | * | trans | -51.7 | 139 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | N360 K364 | N360-A362 PolarHBondContact O-N 3.19Å; N360-A362 VanDerWaalsContact O-N 3.12Å; A362-K364 PolarHBondContact O-N 3.27Å; A362-K364 VanDerWaalsContact O-N 3.14Å | ||
| 363 | P | 63.8 | Low | 68.8 | Low | 126 Ų | 126 | 139.1 Ų | 139.1 | 82% | 0.818 | 68% | 0.679 | S | S | * | * | trans | -60.6 | 120.1 | -174.6 | 22.9 | -33 | 0 | 0 | 0 | 110.9 | K365 | P363-K365 PolarHBondContact O-N 3.23Å; P363-K365 VanDerWaalsContact O-N 3.11Å | ||
| 364 | K | 75.6 | Confident | 71.3 | Confident | 206 Ų | 206 | 132.8 Ų | 132.8 | 90% | 0.896 | 65% | 0.649 | S | S | * | * | trans | -65.1 | 112.8 | -180 | -67.3 | 164 | -173.3 | 157.5 | 0 | 108.5 | A362 Q366 | A362-K364 PolarHBondContact O-N 3.27Å; A362-K364 VanDerWaalsContact O-N 3.14Å; K364-Q366 PolarHBondContact O-N 2.83Å | ||
| 365 | K | 78.8 | Confident | 73.7 | Confident | 204 Ų | 204 | 132.4 Ų | 132.4 | 89% | 0.887 | 64% | 0.643 | S | S | * | * | trans | -43.2 | 122.4 | 178.5 | -64.9 | -170.9 | 177.5 | -170.3 | 0 | 110.5 | P363 R367 | P363-K365 PolarHBondContact O-N 3.23Å; P363-K365 VanDerWaalsContact O-N 3.11Å; K365-R367 PolarHBondContact O-N 2.74Å | ||
| 366 | Q | 85.9 | Confident | 76.2 | Confident | 189 Ų | 189 | 132.8 Ų | 132.8 | 88% | 0.883 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 135.2 | 179.2 | -172.1 | 175.7 | 4.5 | 0 | 0 | 109.3 | K364 L368 | K364-Q366 PolarHBondContact O-N 2.83Å; Q366-L368 PolarHBondContact O-N 3.41Å |
| 367 | R | 88.4 | Confident | 78.7 | Confident | 225 Ų | 225 | 126.6 Ų | 126.6 | 85% | 0.849 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 122.4 | 179.3 | -71.4 | -178.2 | 173.9 | -178.5 | -1.7 | 109.2 | K365 V369 | K365-R367 PolarHBondContact O-N 2.74Å; R367-V369 PolarHBondContact O-N 3.33Å |
| 368 | L | 92.9 | Very high | 81.1 | Confident | 104 Ų | 104 | 118.6 Ų | 118.6 | 55% | 0.545 | 58% | 0.578 | S | S | . | * | P | Polyproline II helix | trans | -58.2 | 131.4 | 168.1 | -176 | 151.7 | 0 | 0 | 0 | 109.5 | Q366 F370 L402 T406 | Q366-L368 PolarHBondContact O-N 3.41Å; L368-F370 HydrophobicContact CD2-CD1 3.95Å; L368-F370 HydrophobicContact CD2-CE1 3.91Å; L368-F370 HydrophobicContact CD2-CG 4.48Å; L368-F370 HydrophobicContact CD2-CZ 4.41Å; L368-L402 HydrophobicContact CD2-CD2 4.46Å; L368-T406 HydrophobicContact CD1-CG2 4.44Å; L368-T406 HydrophobicContact CD2-CG2 4.12Å |
| 369 | V | 93.1 | Very high | 83.6 | Confident | 115 Ų | 115 | 117.3 Ų | 117.3 | 70% | 0.697 | 57% | 0.57 | S | S | * | * | trans | -116.2 | 125 | 174.4 | -178.9 | 0 | 0 | 0 | 0 | 107.6 | R367 | R367-V369 PolarHBondContact O-N 3.33Š| ||
| 370 | F | 96 | Very high | 86 | Confident | 42 Ų | 42 | 107.9 Ų | 107.9 | 18% | 0.184 | 54% | 0.544 | C | S | . | . | trans | -66.4 | 137.1 | 175.5 | -64.1 | -63.1 | 0 | 0 | 0 | 111.4 | L368 Q374 R375 L378 L402 T406 F410 | L368-F370 HydrophobicContact CD2-CD1 3.95Å; L368-F370 HydrophobicContact CD2-CE1 3.91Å; L368-F370 HydrophobicContact CD2-CG 4.48Å; L368-F370 HydrophobicContact CD2-CZ 4.41Å; F370-Q374 HydrophobicContact CB-CB 4.27Å; F370-Q374 HydrophobicContact CD1-CB 4.29Å; F370-R375 HydrophobicContact CB-CB 4.38Å; F370-R375 PolarHBondContact O-NH2 3.15Å; F370-L378 HydrophobicContact CD1-CD1 4.15Å; F370-L378 HydrophobicContact CE1-CD1 3.91Å; F370-L378 HydrophobicContact CZ-CD1 4.18Å; F370-L402 HydrophobicContact CD1-CD1 4.03Å; F370-L402 HydrophobicContact CD1-CD2 4.09Å; F370-L402 HydrophobicContact CE1-CD1 3.74Å; F370-L402 HydrophobicContact CE1-CD2 3.96Å; F370-T406 HydrophobicContact CE1-CG2 3.49Å; F370-T406 VanDerWaalsContact CE1-CG2 3.49Å; F370-T406 HydrophobicContact CZ-CG2 3.59Å; F370-F410 HydrophobicContact CE2-CD2 4.05Å; F370-F410 HydrophobicContact CZ-CB 4.32Å; F370-F410 HydrophobicContact CZ-CD2 4.41Å | ||
| 371 | T | 96.9 | Very high | 88.3 | Confident | 75 Ų | 75 | 102.8 Ų | 102.8 | 46% | 0.46 | 52% | 0.516 | S | S | . | . | trans | -65 | 158.8 | 165.4 | 73.5 | 0 | 0 | 0 | 0 | 110.2 | L373 Q374 R375 | T371-L373 PolarHBondContact O-N 3.42Å; T371-Q374 PolarHBondContact O-N 3.06Å; T371-Q374 WeakPolarHBondContact OG1-CG 3.39Å; T371-Q374 PolarHBondContact OG1-N 3.16Å; T371-R375 WeakPolarHBondContact O-CB 3.49Å; T371-R375 PolarHBondContact O-N 3.24Å | ||
| 372 | D | 96.4 | Very high | 90.4 | Very high | 98 Ų | 98 | 98.4 Ų | 98.4 | 52% | 0.524 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -74.5 | -12.4 | -177.5 | -61 | -58.1 | 0 | 0 | 0 | 114 | R375 R376 | D372-R375 IonicContact OD1-CZ 3.19Å; D372-R375 IonicContact OD1-NE 2.89Å; D372-R375 PolarHBondContact OD1-NE 3.45Å; D372-R375 IonicContact OD1-NH2 2.76Å; D372-R376 WeakPolarHBondContact O-CB 3.32Å; D372-R376 WeakPolarHBondContact O-CG 3.21Å; D372-R376 PolarHBondContact O-N 2.92Å; D372-R376 PolarHBondContact O-NE 3.41Å |
| 373 | L | 96.1 | Very high | 91.9 | Very high | 110 Ų | 110 | 103 Ų | 103 | 58% | 0.576 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -71.4 | -57.1 | 162.9 | -178.6 | 59.1 | 0 | 0 | 0 | 110.3 | T371 R375 R376 T377 | T371-L373 PolarHBondContact O-N 3.42Å; L373-R375 VanDerWaalsContact C-N 3.28Å; L373-R375 PolarHBondContact O-N 3.17Å; L373-R376 PolarHBondContact O-N 3.16Å; L373-R376 VanDerWaalsContact O-N 3.13Å; L373-T377 PolarHBondContact O-N 3.32Å; L373-T377 PolarHBondContact O-OG1 2.71Å |
| 374 | Q | 97.4 | Very high | 93.4 | Very high | 28 Ų | 28 | 104.8 Ų | 104.8 | 13% | 0.131 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -53.1 | -46.1 | 177.8 | -68.8 | 169.9 | -20.8 | 0 | 0 | 111.6 | F370 T371 L378 L400 L402 | F370-Q374 HydrophobicContact CB-CB 4.27Å; F370-Q374 HydrophobicContact CD1-CB 4.29Å; T371-Q374 PolarHBondContact O-N 3.06Å; T371-Q374 WeakPolarHBondContact OG1-CG 3.39Å; T371-Q374 PolarHBondContact OG1-N 3.16Å; Q374-L378 VanDerWaalsContact O-CB 3.27Å; Q374-L378 WeakPolarHBondContact O-CB 3.43Å; Q374-L378 WeakPolarHBondContact O-CG 3.41Å; Q374-L378 PolarHBondContact O-N 2.81Å; Q374-L400 HydrophobicContact CG-CB 4.25Å; Q374-L400 HydrophobicContact CG-CD2 4.41Å; Q374-L400 PolarHBondContact NE2-O 3.47Å; Q374-L402 HydrophobicContact CB-CD1 4.44Å; Q374-L402 HydrophobicContact CG-CD1 4.31Å |
| 375 | R | 96.9 | Very high | 94.3 | Very high | 99 Ų | 99 | 97.7 Ų | 97.7 | 37% | 0.374 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -58.8 | -48.9 | 177.8 | -173.3 | -167.5 | -53.8 | -74.6 | -10.9 | 112 | F370 T371 D372 L373 I379 | F370-R375 HydrophobicContact CB-CB 4.38Å; F370-R375 PolarHBondContact O-NH2 3.15Å; T371-R375 WeakPolarHBondContact O-CB 3.49Å; T371-R375 PolarHBondContact O-N 3.24Å; D372-R375 IonicContact OD1-CZ 3.19Å; D372-R375 IonicContact OD1-NE 2.89Å; D372-R375 PolarHBondContact OD1-NE 3.45Å; D372-R375 IonicContact OD1-NH2 2.76Å; L373-R375 VanDerWaalsContact C-N 3.28Å; L373-R375 PolarHBondContact O-N 3.17Å; R375-I379 HydrophobicContact CG-CD1 3.97Å; R375-I379 WeakPolarHBondContact O-CB 3.47Å; R375-I379 WeakPolarHBondContact O-CD1 3.23Å; R375-I379 WeakPolarHBondContact O-CG1 3.46Å; R375-I379 PolarHBondContact O-N 3.23Å |
| 376 | R | 97.1 | Very high | 95 | Very high | 168 Ų | 168 | 92.5 Ų | 92.5 | 63% | 0.634 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -66.8 | -45.9 | -178.6 | -77 | -179 | -66 | 165.3 | 1.2 | 111.4 | D372 L373 I379 A380 | D372-R376 WeakPolarHBondContact O-CB 3.32Å; D372-R376 WeakPolarHBondContact O-CG 3.21Å; D372-R376 PolarHBondContact O-N 2.92Å; D372-R376 PolarHBondContact O-NE 3.41Å; L373-R376 PolarHBondContact O-N 3.16Å; L373-R376 VanDerWaalsContact O-N 3.13Å; R376-I379 PolarHBondContact O-N 2.7Å; R376-A380 WeakPolarHBondContact O-CB 3.38Å; R376-A380 PolarHBondContact O-N 3.07Å |
| 377 | T | 96.9 | Very high | 95.5 | Very high | 44 Ų | 44 | 93 Ų | 93 | 27% | 0.27 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.4 | -46.1 | 178.3 | -53.6 | 0 | 0 | 0 | 0 | 111.9 | L373 I379 A380 I381 L400 | L373-T377 PolarHBondContact O-N 3.32Å; L373-T377 PolarHBondContact O-OG1 2.71Å; T377-I379 VanDerWaalsContact C-N 3.3Å; T377-I379 PolarHBondContact O-N 3.48Å; T377-A380 PolarHBondContact O-N 2.97Å; T377-I381 HydrophobicContact CG2-CD1 3.92Å; T377-I381 HydrophobicContact CG2-CG1 4.5Å; T377-I381 WeakPolarHBondContact O-CG1 3.28Å; T377-I381 PolarHBondContact O-N 3.27Å; T377-L400 HydrophobicContact CG2-CD1 4.45Å; T377-L400 HydrophobicContact CG2-CD2 4.1Å |
| 378 | L | 97.3 | Very high | 95.8 | Very high | 0 Ų | 0 | 82.6 Ų | 82.6 | 0% | 0 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -61.9 | -35.8 | 176.1 | -73.7 | 170.6 | 0 | 0 | 0 | 112.7 | F370 Q374 F382 I396 L400 L402 V407 F410 F411 | F370-L378 HydrophobicContact CD1-CD1 4.15Å; F370-L378 HydrophobicContact CE1-CD1 3.91Å; F370-L378 HydrophobicContact CZ-CD1 4.18Å; Q374-L378 VanDerWaalsContact O-CB 3.27Å; Q374-L378 WeakPolarHBondContact O-CB 3.43Å; Q374-L378 WeakPolarHBondContact O-CG 3.41Å; Q374-L378 PolarHBondContact O-N 2.81Å; L378-F382 VanDerWaalsContact O-CB 3.28Å; L378-F382 WeakPolarHBondContact O-CB 3.46Å; L378-F382 PolarHBondContact O-N 3.4Å; L378-F382 VanDerWaalsContact O-N 3.07Å; L378-I396 HydrophobicContact CD2-CG2 3.71Å; L378-L400 HydrophobicContact CD1-CD1 4.28Å; L378-L400 HydrophobicContact CD2-CD1 3.84Å; L378-L400 HydrophobicContact CG-CD1 3.66Å; L378-L402 HydrophobicContact CD1-CD1 4.05Å; L378-V407 HydrophobicContact CD2-CG1 4.33Å; L378-F410 HydrophobicContact CB-CD1 3.91Å; L378-F410 HydrophobicContact CB-CD2 4.27Å; L378-F410 HydrophobicContact CB-CE1 3.64Å; L378-F410 HydrophobicContact CB-CE2 3.99Å; L378-F410 HydrophobicContact CB-CG 4.24Å; L378-F410 HydrophobicContact CB-CZ 3.68Å; L378-F410 HydrophobicContact CD1-CB 4.41Å; L378-F410 HydrophobicContact CD1-CD1 4.41Å; L378-F410 HydrophobicContact CD1-CD2 4.05Å; L378-F410 HydrophobicContact CD1-CE2 4.49Å; L378-F410 HydrophobicContact CD1-CG 4.02Å; L378-F410 HydrophobicContact CD2-CD1 4.11Å; L378-F410 HydrophobicContact CD2-CG 4.42Å; L378-F410 HydrophobicContact CG-CD1 4.37Å; L378-F410 HydrophobicContact CG-CG 4.47Å; L378-F410 WeakPolarHBondContact O-CE1 3.32Å; L378-F411 HydrophobicContact CD2-CE2 4.08Å; L378-F411 HydrophobicContact CD2-CZ 4.18Å |
| 379 | I | 96.6 | Very high | 96 | Very high | 80 Ų | 80 | 80.5 Ų | 80.5 | 41% | 0.41 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -70.7 | -41.6 | 174.8 | -71.8 | 169.4 | 0 | 0 | 0 | 111.6 | R375 R376 T377 F382 K383 F410 | R375-I379 HydrophobicContact CG-CD1 3.97Å; R375-I379 WeakPolarHBondContact O-CB 3.47Å; R375-I379 WeakPolarHBondContact O-CD1 3.23Å; R375-I379 WeakPolarHBondContact O-CG1 3.46Å; R375-I379 PolarHBondContact O-N 3.23Å; R376-I379 PolarHBondContact O-N 2.7Å; T377-I379 VanDerWaalsContact C-N 3.3Å; T377-I379 PolarHBondContact O-N 3.48Å; I379-F382 CarbonylContact O-C 3.28Å; I379-F382 PolarHBondContact O-N 2.87Å; I379-K383 PolarHBondContact O-N 3.24Å; I379-F410 HydrophobicContact CG1-CZ 4.11Å |
| 380 | A | 96.4 | Very high | 96.2 | Very high | 44 Ų | 44 | 82.6 Ų | 82.6 | 36% | 0.364 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -61.1 | -52.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | R376 T377 F382 K383 E384 | R376-A380 WeakPolarHBondContact O-CB 3.38Å; R376-A380 PolarHBondContact O-N 3.07Å; T377-A380 PolarHBondContact O-N 2.97Å; A380-F382 PolarHBondContact O-N 3.32Å; A380-K383 WeakPolarHBondContact O-CA 3.35Å; A380-K383 VanDerWaalsContact O-CB 3.3Å; A380-K383 WeakPolarHBondContact O-CB 3.33Å; A380-K383 PolarHBondContact O-N 2.84Å; A380-E384 PolarHBondContact O-N 2.91Å |
| 381 | I | 96.3 | Very high | 96.3 | Very high | 23 Ų | 23 | 87.6 Ų | 87.6 | 12% | 0.118 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -61 | -34.3 | 176.7 | -61.7 | 172.7 | 0 | 0 | 0 | 111.1 | T377 K383 E384 N385 M392 I396 F411 | T377-I381 HydrophobicContact CG2-CD1 3.92Å; T377-I381 HydrophobicContact CG2-CG1 4.5Å; T377-I381 WeakPolarHBondContact O-CG1 3.28Å; T377-I381 PolarHBondContact O-N 3.27Å; I381-K383 VanDerWaalsContact C-N 3.32Å; I381-K383 PolarHBondContact O-N 3.48Å; I381-E384 PolarHBondContact O-N 3.21Å; I381-N385 PolarHBondContact O-N 2.87Å; I381-M392 HydrophobicContact CG2-CE 3.89Å; I381-I396 HydrophobicContact CD1-CD1 3.88Å; I381-I396 HydrophobicContact CD1-CG1 3.79Å; I381-I396 HydrophobicContact CG2-CD1 3.85Å; I381-F411 HydrophobicContact CB-CZ 4.31Å; I381-F411 HydrophobicContact CG2-CE1 4.23Å; I381-F411 HydrophobicContact CG2-CZ 3.86Å |
| 382 | F | 96.4 | Very high | 96.3 | Very high | 26 Ų | 26 | 87.1 Ų | 87.1 | 11% | 0.114 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -73.4 | -17 | 173.2 | -175.7 | -110.4 | 0 | 0 | 0 | 114.4 | L378 I379 A380 K386 F410 F411 A414 R415 C418 | L378-F382 VanDerWaalsContact O-CB 3.28Å; L378-F382 WeakPolarHBondContact O-CB 3.46Å; L378-F382 PolarHBondContact O-N 3.4Å; L378-F382 VanDerWaalsContact O-N 3.07Å; I379-F382 CarbonylContact O-C 3.28Å; I379-F382 PolarHBondContact O-N 2.87Å; A380-F382 PolarHBondContact O-N 3.32Å; F382-K386 HydrophobicContact CD2-CD 4.26Å; F382-K386 HydrophobicContact CE2-CB 4.19Å; F382-K386 HydrophobicContact CE2-CD 3.88Å; F382-K386 HydrophobicContact CZ-CD 4.06Å; F382-K386 VanDerWaalsContact O-CD 3.23Å; F382-K386 WeakPolarHBondContact O-CD 3.35Å; F382-K386 PolarHBondContact O-NZ 3.07Å; F382-F410 HydrophobicContact CB-CE1 4.2Å; F382-F411 HydrophobicContact CB-CD1 4.25Å; F382-F411 HydrophobicContact CB-CE1 3.9Å; F382-F411 AromaticContact CD2-CD1 3.92Å; F382-F411 HydrophobicContact CD2-CD1 3.92Å; F382-F411 HydrophobicContact CD2-CE1 4.33Å; F382-F411 HydrophobicContact CG-CD1 4.49Å; F382-A414 HydrophobicContact CD1-CB 3.77Å; F382-A414 HydrophobicContact CD2-CB 3.91Å; F382-A414 HydrophobicContact CE1-CB 3.73Å; F382-A414 HydrophobicContact CE2-CB 3.85Å; F382-A414 HydrophobicContact CG-CB 3.86Å; F382-A414 VanDerWaalsContact CZ-C 3.47Å; F382-A414 HydrophobicContact CZ-CB 3.76Å; F382-R415 HydrophobicContact CE2-CG 3.83Å; F382-R415 HydrophobicContact CZ-CG 4.33Å; F382-C418 HydrophobicContact CE1-CB 4.22Å; F382-C418 HydrophobicContact CZ-CB 4.08Å |
| 383 | K | 94.4 | Very high | 96.3 | Very high | 158 Ų | 158 | 83.6 Ų | 83.6 | 69% | 0.687 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -69.7 | -48.2 | 168.4 | -73.3 | -178.3 | 176.3 | -174.2 | 0 | 109.9 | I379 A380 I381 K386 | I379-K383 PolarHBondContact O-N 3.24Å; A380-K383 WeakPolarHBondContact O-CA 3.35Å; A380-K383 VanDerWaalsContact O-CB 3.3Å; A380-K383 WeakPolarHBondContact O-CB 3.33Å; A380-K383 PolarHBondContact O-N 2.84Å; I381-K383 VanDerWaalsContact C-N 3.32Å; I381-K383 PolarHBondContact O-N 3.48Å; K383-K386 PolarHBondContact O-NZ 2.98Å |
| 384 | E | 95.6 | Very high | 96.4 | Very high | 162 Ų | 162 | 81.2 Ų | 81.2 | 76% | 0.757 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -73.3 | -57.9 | -179.1 | -66.7 | 159.1 | -170.7 | 0 | 0 | 112 | A380 I381 | A380-E384 PolarHBondContact O-N 2.91Å; I381-E384 PolarHBondContact O-N 3.21Å |
| 385 | N | 94.4 | Very high | 96.5 | Very high | 57 Ų | 57 | 82.7 Ų | 82.7 | 31% | 0.305 | 39% | 0.388 | S | S | . | . | trans | -116.2 | 110.6 | -175.2 | -166.6 | -20.9 | 0 | 0 | 0 | 112.4 | I381 R387 P388 | I381-N385 PolarHBondContact O-N 2.87Å; N385-R387 VanDerWaalsContact C-N 3.32Å; N385-R387 PolarHBondContact O-N 2.8Å; N385-R387 WeakPolarHBondContact OD1-CA 3.28Å; N385-R387 PolarHBondContact OD1-N 3.07Å; N385-R387 PolarHBondContact OD1-O 3.45Å; N385-P388 VanDerWaalsContact OD1-N 3.16Å | ||
| 386 | K | 94.5 | Very high | 96.4 | Very high | 95 Ų | 95 | 78.2 Ų | 78.2 | 41% | 0.413 | 37% | 0.371 | S | S | . | . | S | Bend | trans | -73.1 | -23.1 | 177.4 | -50.4 | -47.5 | -176.3 | -154.5 | 0 | 113.2 | F382 K383 R415 | F382-K386 HydrophobicContact CD2-CD 4.26Å; F382-K386 HydrophobicContact CE2-CB 4.19Å; F382-K386 HydrophobicContact CE2-CD 3.88Å; F382-K386 HydrophobicContact CZ-CD 4.06Å; F382-K386 VanDerWaalsContact O-CD 3.23Å; F382-K386 WeakPolarHBondContact O-CD 3.35Å; F382-K386 PolarHBondContact O-NZ 3.07Å; K383-K386 PolarHBondContact O-NZ 2.98Å; K386-R415 VanDerWaalsContact O-CD 3.24Å; K386-R415 WeakPolarHBondContact O-CD 3.37Å; K386-R415 WeakPolarHBondContact O-CG 3.27Å; K386-R415 PolarHBondContact O-NH1 2.95Å |
| 387 | R | 95.5 | Very high | 96.5 | Very high | 201 Ų | 201 | 70.7 Ų | 70.7 | 76% | 0.758 | 34% | 0.344 | S | S | * | . | S | Bend | trans | -139.2 | 61.2 | -170.7 | -62.1 | -179 | 80.5 | 158.5 | 1.7 | 110.4 | N385 | N385-R387 VanDerWaalsContact C-N 3.32Å; N385-R387 PolarHBondContact O-N 2.8Å; N385-R387 WeakPolarHBondContact OD1-CA 3.28Å; N385-R387 PolarHBondContact OD1-N 3.07Å; N385-R387 PolarHBondContact OD1-O 3.45Å |
| 388 | P | 95.3 | Very high | 96.5 | Very high | 6 Ų | 6 | 75.3 Ų | 75.3 | 4% | 0.039 | 36% | 0.363 | C | S | . | . | trans | -56.3 | 143.7 | 177.2 | 25.2 | -35.4 | 0 | 0 | 0 | 111 | N385 M392 Q393 F411 | N385-P388 VanDerWaalsContact OD1-N 3.16Å; P388-M392 HydrophobicContact CB-CB 4.12Å; P388-M392 HydrophobicContact CB-CG 4.05Å; P388-M392 HydrophobicContact CB-SD 3.51Å; P388-M392 VanDerWaalsContact CB-SD 3.51Å; P388-Q393 HydrophobicContact CB-CG 4.12Å; P388-Q393 HydrophobicContact CG-CG 3.89Å; P388-Q393 PolarHBondContact O-NE2 2.77Å; P388-F411 HydrophobicContact CG-CB 4.48Å; P388-F411 HydrophobicContact CG-CD1 3.84Å; P388-F411 HydrophobicContact CG-CD2 3.66Å; P388-F411 HydrophobicContact CG-CE1 3.9Å; P388-F411 HydrophobicContact CG-CE2 3.73Å; P388-F411 HydrophobicContact CG-CG 3.73Å; P388-F411 HydrophobicContact CG-CZ 3.87Å | ||
| 389 | S | 97.4 | Very high | 96.5 | Very high | 60 Ų | 60 | 81.9 Ų | 81.9 | 42% | 0.42 | 39% | 0.393 | S | S | . | . | trans | -63.2 | 166.3 | 179.4 | 69.2 | 0 | 0 | 0 | 0 | 111.6 | E391 M392 Q393 | S389-E391 PolarHBondContact O-N 3.3Å; S389-M392 PolarHBondContact O-N 3.47Å; S389-M392 WeakPolarHBondContact OG-CB 3.42Å; S389-M392 PolarHBondContact OG-N 3.08Å; S389-Q393 WeakPolarHBondContact O-CB 3.24Å; S389-Q393 VanDerWaalsContact O-CG 3.29Å; S389-Q393 WeakPolarHBondContact O-CG 3.36Å; S389-Q393 PolarHBondContact O-N 2.86Å | ||
| 390 | K | 97 | Very high | 96.5 | Very high | 159 Ų | 159 | 79.1 Ų | 79.1 | 69% | 0.691 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -58.7 | -41 | 175.3 | -175 | -175.7 | 175.9 | -170.7 | 0 | 111 | Q393 I394 | K390-Q393 PolarHBondContact O-N 3.44Å; K390-I394 HydrophobicContact CG-CD1 4.46Å; K390-I394 WeakPolarHBondContact O-CG1 3.37Å; K390-I394 PolarHBondContact O-N 2.95Å |
| 391 | E | 97.4 | Very high | 96.5 | Very high | 147 Ų | 147 | 80.3 Ų | 80.3 | 69% | 0.687 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -61.9 | -52.2 | 174.6 | 179.8 | 178.6 | -151.7 | 0 | 0 | 112.2 | S389 Q393 I394 T395 | S389-E391 PolarHBondContact O-N 3.3Å; E391-Q393 PolarHBondContact O-N 3.2Å; E391-I394 WeakPolarHBondContact O-CA 3.31Å; E391-I394 VanDerWaalsContact O-CB 3.3Å; E391-I394 WeakPolarHBondContact O-CB 3.49Å; E391-I394 PolarHBondContact O-N 3.32Å; E391-T395 PolarHBondContact O-N 3.22Å; E391-T395 PolarHBondContact O-OG1 2.76Å |
| 392 | M | 97.1 | Very high | 96.5 | Very high | 64 Ų | 64 | 80.1 Ų | 80.1 | 32% | 0.315 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -58.9 | -36.6 | 176.9 | -170 | -174.5 | -173 | 0 | 0 | 111.6 | I381 P388 S389 I394 T395 I396 | I381-M392 HydrophobicContact CG2-CE 3.89Å; P388-M392 HydrophobicContact CB-CB 4.12Å; P388-M392 HydrophobicContact CB-CG 4.05Å; P388-M392 HydrophobicContact CB-SD 3.51Å; P388-M392 VanDerWaalsContact CB-SD 3.51Å; S389-M392 PolarHBondContact O-N 3.47Å; S389-M392 WeakPolarHBondContact OG-CB 3.42Å; S389-M392 PolarHBondContact OG-N 3.08Å; M392-I394 VanDerWaalsContact C-N 3.34Å; M392-T395 PolarHBondContact O-N 3.01Å; M392-I396 HydrophobicContact CG-CD1 4.01Å; M392-I396 WeakPolarHBondContact O-CB 3.15Å; M392-I396 VanDerWaalsContact O-CD1 3.31Å; M392-I396 WeakPolarHBondContact O-CD1 3.31Å; M392-I396 WeakPolarHBondContact O-CG1 3.47Å; M392-I396 PolarHBondContact O-N 3.14Å |
| 393 | Q | 97.3 | Very high | 96.5 | Very high | 24 Ų | 24 | 85.2 Ų | 85.2 | 11% | 0.112 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -67.3 | -31.1 | 173.1 | -69.4 | 173.4 | 53.2 | 0 | 0 | 113.1 | P388 S389 K390 E391 S397 L404 V407 S408 F411 | P388-Q393 HydrophobicContact CB-CG 4.12Å; P388-Q393 HydrophobicContact CG-CG 3.89Å; P388-Q393 PolarHBondContact O-NE2 2.77Å; S389-Q393 WeakPolarHBondContact O-CB 3.24Å; S389-Q393 VanDerWaalsContact O-CG 3.29Å; S389-Q393 WeakPolarHBondContact O-CG 3.36Å; S389-Q393 PolarHBondContact O-N 2.86Å; K390-Q393 PolarHBondContact O-N 3.44Å; E391-Q393 PolarHBondContact O-N 3.2Å; Q393-S397 VanDerWaalsContact O-CB 3.27Å; Q393-S397 WeakPolarHBondContact O-CB 3.24Å; Q393-S397 PolarHBondContact O-N 2.76Å; Q393-S397 PolarHBondContact O-OG 3.14Å; Q393-L404 HydrophobicContact CB-CD1 3.64Å; Q393-V407 HydrophobicContact CB-CG1 4.13Å; Q393-V407 HydrophobicContact CG-CG1 4.25Å; Q393-S408 VanDerWaalsContact OE1-CB 3.23Å; Q393-F411 HydrophobicContact CG-CD2 4.22Å; Q393-F411 HydrophobicContact CG-CE2 4.49Å |
| 394 | I | 98.1 | Very high | 96.7 | Very high | 61 Ų | 61 | 80.5 Ų | 80.5 | 31% | 0.313 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -65.5 | -50.7 | 171.2 | -69.9 | 160.9 | 0 | 0 | 0 | 109.5 | K390 E391 M392 I396 S397 Q398 L404 | K390-I394 HydrophobicContact CG-CD1 4.46Å; K390-I394 WeakPolarHBondContact O-CG1 3.37Å; K390-I394 PolarHBondContact O-N 2.95Å; E391-I394 WeakPolarHBondContact O-CA 3.31Å; E391-I394 VanDerWaalsContact O-CB 3.3Å; E391-I394 WeakPolarHBondContact O-CB 3.49Å; E391-I394 PolarHBondContact O-N 3.32Å; M392-I394 VanDerWaalsContact C-N 3.34Å; I394-I396 VanDerWaalsContact C-N 3.32Å; I394-I396 PolarHBondContact O-N 2.76Å; I394-S397 WeakPolarHBondContact CA-OG 3.43Å; I394-S397 WeakPolarHBondContact O-CB 3.38Å; I394-S397 PolarHBondContact O-N 2.85Å; I394-S397 PolarHBondContact O-OG 2.92Å; I394-Q398 WeakPolarHBondContact O-CG 3.45Å; I394-Q398 PolarHBondContact O-N 3.12Å; I394-L404 HydrophobicContact CD1-CD2 4.38Å; I394-L404 HydrophobicContact CG1-CD1 3.83Å; I394-L404 HydrophobicContact CG1-CD2 3.77Å; I394-L404 HydrophobicContact CG1-CG 4.38Å |
| 395 | T | 97.7 | Very high | 96.7 | Very high | 59 Ų | 59 | 75.2 Ų | 75.2 | 36% | 0.362 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -55.4 | -46.8 | 177.2 | -44.1 | 0 | 0 | 0 | 0 | 111.6 | E391 M392 S397 Q398 Q399 | E391-T395 PolarHBondContact O-N 3.22Å; E391-T395 PolarHBondContact O-OG1 2.76Å; M392-T395 PolarHBondContact O-N 3.01Å; T395-S397 VanDerWaalsContact C-N 3.33Å; T395-S397 PolarHBondContact O-N 3.11Å; T395-Q398 PolarHBondContact O-N 3.12Å; T395-Q399 WeakPolarHBondContact O-CB 3.27Å; T395-Q399 WeakPolarHBondContact O-CG 3.28Å; T395-Q399 PolarHBondContact O-N 3.38Å |
| 396 | I | 96.8 | Very high | 96.8 | Very high | 4 Ų | 4 | 73.7 Ų | 73.7 | 2% | 0.021 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -62.8 | -39.2 | 176.7 | -66.9 | 162.3 | 0 | 0 | 0 | 111.5 | L378 I381 M392 I394 L400 V407 F411 | L378-I396 HydrophobicContact CD2-CG2 3.71Å; I381-I396 HydrophobicContact CD1-CD1 3.88Å; I381-I396 HydrophobicContact CD1-CG1 3.79Å; I381-I396 HydrophobicContact CG2-CD1 3.85Å; M392-I396 HydrophobicContact CG-CD1 4.01Å; M392-I396 WeakPolarHBondContact O-CB 3.15Å; M392-I396 VanDerWaalsContact O-CD1 3.31Å; M392-I396 WeakPolarHBondContact O-CD1 3.31Å; M392-I396 WeakPolarHBondContact O-CG1 3.47Å; M392-I396 PolarHBondContact O-N 3.14Å; I394-I396 VanDerWaalsContact C-N 3.32Å; I394-I396 PolarHBondContact O-N 2.76Å; I396-L400 HydrophobicContact CG2-CD1 3.79Å; I396-L400 HydrophobicContact CG2-CG 4.42Å; I396-L400 VanDerWaalsContact O-CB 3.28Å; I396-L400 WeakPolarHBondContact O-CB 3.49Å; I396-L400 WeakPolarHBondContact O-CG 3.25Å; I396-L400 PolarHBondContact O-N 2.79Å; I396-L400 VanDerWaalsContact O-N 3.09Å; I396-V407 HydrophobicContact CB-CG1 4.14Å; I396-V407 HydrophobicContact CG2-CG1 3.74Å; I396-V407 HydrophobicContact CG2-CG2 4.23Å; I396-F411 HydrophobicContact CD1-CE2 3.96Å; I396-F411 HydrophobicContact CD1-CZ 4.01Å |
| 397 | S | 97.9 | Very high | 97 | Very high | 11 Ų | 11 | 69.2 Ų | 69.2 | 8% | 0.077 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -65.5 | -41.6 | 179.4 | 74.9 | 0 | 0 | 0 | 0 | 112 | Q393 I394 T395 G401 L402 | Q393-S397 VanDerWaalsContact O-CB 3.27Å; Q393-S397 WeakPolarHBondContact O-CB 3.24Å; Q393-S397 PolarHBondContact O-N 2.76Å; Q393-S397 PolarHBondContact O-OG 3.14Å; I394-S397 WeakPolarHBondContact CA-OG 3.43Å; I394-S397 WeakPolarHBondContact O-CB 3.38Å; I394-S397 PolarHBondContact O-N 2.85Å; I394-S397 PolarHBondContact O-OG 2.92Å; T395-S397 VanDerWaalsContact C-N 3.33Å; T395-S397 PolarHBondContact O-N 3.11Å; S397-G401 PolarHBondContact O-N 2.81Å; S397-G401 VanDerWaalsContact O-N 3.15Å; S397-L402 CarbonylContact C-O 3.53Å; S397-L402 VanDerWaalsContact CB-O 3.28Å; S397-L402 WeakPolarHBondContact CB-O 3.32Å; S397-L402 PolarHBondContact O-N 3.41Å; S397-L402 VanDerWaalsContact O-O 3.13Å |
| 398 | Q | 97.5 | Very high | 97 | Very high | 140 Ų | 140 | 61.7 Ų | 61.7 | 65% | 0.654 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -65.3 | -52.2 | 174.7 | -68.4 | 168 | -21.1 | 0 | 0 | 111.5 | I394 T395 L400 G401 | I394-Q398 WeakPolarHBondContact O-CG 3.45Å; I394-Q398 PolarHBondContact O-N 3.12Å; T395-Q398 PolarHBondContact O-N 3.12Å; Q398-L400 PolarHBondContact O-N 2.87Å; Q398-G401 PolarHBondContact O-N 3.3Å |
| 399 | Q | 96.6 | Very high | 97.1 | Very high | 138 Ų | 138 | 65.1 Ų | 65.1 | 65% | 0.645 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -60.1 | -27.8 | -179.4 | -74.7 | 177 | -8.7 | 0 | 0 | 113.9 | T395 | T395-Q399 WeakPolarHBondContact O-CB 3.27Å; T395-Q399 WeakPolarHBondContact O-CG 3.28Å; T395-Q399 PolarHBondContact O-N 3.38Å |
| 400 | L | 96.7 | Very high | 97.1 | Very high | 22 Ų | 22 | 64 Ų | 64 | 12% | 0.115 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -102.8 | -1.9 | -176.9 | -66.7 | -175.6 | 0 | 0 | 0 | 114.5 | Q374 T377 L378 I396 Q398 L402 | Q374-L400 HydrophobicContact CG-CB 4.25Å; Q374-L400 HydrophobicContact CG-CD2 4.41Å; Q374-L400 PolarHBondContact NE2-O 3.47Å; T377-L400 HydrophobicContact CG2-CD1 4.45Å; T377-L400 HydrophobicContact CG2-CD2 4.1Å; L378-L400 HydrophobicContact CD1-CD1 4.28Å; L378-L400 HydrophobicContact CD2-CD1 3.84Å; L378-L400 HydrophobicContact CG-CD1 3.66Å; I396-L400 HydrophobicContact CG2-CD1 3.79Å; I396-L400 HydrophobicContact CG2-CG 4.42Å; I396-L400 VanDerWaalsContact O-CB 3.28Å; I396-L400 WeakPolarHBondContact O-CB 3.49Å; I396-L400 WeakPolarHBondContact O-CG 3.25Å; I396-L400 PolarHBondContact O-N 2.79Å; I396-L400 VanDerWaalsContact O-N 3.09Å; Q398-L400 PolarHBondContact O-N 2.87Å; L400-L402 VanDerWaalsContact C-N 3.34Å; L400-L402 HydrophobicContact CB-CD1 3.81Å; L400-L402 HydrophobicContact CB-CG 4.03Å; L400-L402 HydrophobicContact CD1-CD1 4.12Å |
| 401 | G | 96.5 | Very high | 97.1 | Very high | 69 Ų | 69 | 56.4 Ų | 56.4 | 71% | 0.711 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.4 | 40.6 | -174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | S397 Q398 | S397-G401 PolarHBondContact O-N 2.81Å; S397-G401 VanDerWaalsContact O-N 3.15Å; Q398-G401 PolarHBondContact O-N 3.3Å |
| 402 | L | 96.9 | Very high | 96.9 | Very high | 20 Ų | 20 | 53.8 Ų | 53.8 | 11% | 0.105 | 30% | 0.295 | C | S | . | . | trans | -120.1 | 154.4 | -176.6 | -70.6 | 173.4 | 0 | 0 | 0 | 110.8 | L368 F370 Q374 L378 S397 L400 T406 V407 | L368-L402 HydrophobicContact CD2-CD2 4.46Å; F370-L402 HydrophobicContact CD1-CD1 4.03Å; F370-L402 HydrophobicContact CD1-CD2 4.09Å; F370-L402 HydrophobicContact CE1-CD1 3.74Å; F370-L402 HydrophobicContact CE1-CD2 3.96Å; Q374-L402 HydrophobicContact CB-CD1 4.44Å; Q374-L402 HydrophobicContact CG-CD1 4.31Å; L378-L402 HydrophobicContact CD1-CD1 4.05Å; S397-L402 CarbonylContact C-O 3.53Å; S397-L402 VanDerWaalsContact CB-O 3.28Å; S397-L402 WeakPolarHBondContact CB-O 3.32Å; S397-L402 PolarHBondContact O-N 3.41Å; S397-L402 VanDerWaalsContact O-O 3.13Å; L400-L402 VanDerWaalsContact C-N 3.34Å; L400-L402 HydrophobicContact CB-CD1 3.81Å; L400-L402 HydrophobicContact CB-CG 4.03Å; L400-L402 HydrophobicContact CD1-CD1 4.12Å; L402-T406 HydrophobicContact CD2-CG2 4.26Å; L402-V407 HydrophobicContact CB-CG2 3.95Å; L402-V407 HydrophobicContact CD1-CG2 4.12Å | ||
| 403 | E | 96.8 | Very high | 96.8 | Very high | 132 Ų | 132 | 52.9 Ų | 52.9 | 62% | 0.617 | 29% | 0.292 | S | S | * | . | trans | -65.9 | 142.6 | 166 | -68.8 | -167.3 | 164.2 | 0 | 0 | 111.4 | S405 T406 V407 | E403-S405 WeakPolarHBondContact CB-OG 3.4Å; E403-S405 PolarHBondContact O-N 3.5Å; E403-S405 WeakPolarHBondContact OE2-CB 3.38Å; E403-S405 PolarHBondContact OE2-OG 3.09Å; E403-T406 WeakPolarHBondContact O-CA 3.47Å; E403-T406 WeakPolarHBondContact O-CB 3.37Å; E403-T406 PolarHBondContact O-N 3.06Å; E403-V407 PolarHBondContact O-N 3.18Å | ||
| 404 | L | 96.9 | Very high | 96.6 | Very high | 59 Ų | 59 | 52.5 Ų | 52.5 | 31% | 0.309 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -52.7 | -35.2 | 167 | 179 | 62.9 | 0 | 0 | 0 | 112.1 | Q393 I394 T406 V407 S408 | Q393-L404 HydrophobicContact CB-CD1 3.64Å; I394-L404 HydrophobicContact CD1-CD2 4.38Å; I394-L404 HydrophobicContact CG1-CD1 3.83Å; I394-L404 HydrophobicContact CG1-CD2 3.77Å; I394-L404 HydrophobicContact CG1-CG 4.38Å; L404-T406 PolarHBondContact O-N 3.34Å; L404-V407 PolarHBondContact O-N 2.94Å; L404-S408 VanDerWaalsContact O-CB 3.28Å; L404-S408 WeakPolarHBondContact O-CB 3.3Å; L404-S408 PolarHBondContact O-N 3.37Å |
| 405 | S | 96.8 | Very high | 96.4 | Very high | 52 Ų | 52 | 53.3 Ų | 53.3 | 36% | 0.364 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -54.8 | -42.7 | 173.4 | 84.1 | 0 | 0 | 0 | 0 | 111.3 | E403 N409 | E403-S405 WeakPolarHBondContact CB-OG 3.4Å; E403-S405 PolarHBondContact O-N 3.5Å; E403-S405 WeakPolarHBondContact OE2-CB 3.38Å; E403-S405 PolarHBondContact OE2-OG 3.09Å; S405-N409 VanDerWaalsContact O-CB 3.25Å; S405-N409 WeakPolarHBondContact O-CB 3.37Å; S405-N409 VanDerWaalsContact O-CG 3.29Å; S405-N409 PolarHBondContact O-N 2.97Å; S405-N409 PolarHBondContact O-ND2 2.93Å |
| 406 | T | 96.8 | Very high | 96 | Very high | 25 Ų | 25 | 56.9 Ų | 56.9 | 15% | 0.153 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -80.5 | -38.5 | -172.2 | -70.4 | 0 | 0 | 0 | 0 | 110.6 | L368 F370 L402 E403 L404 N409 F410 | L368-T406 HydrophobicContact CD1-CG2 4.44Å; L368-T406 HydrophobicContact CD2-CG2 4.12Å; F370-T406 HydrophobicContact CE1-CG2 3.49Å; F370-T406 VanDerWaalsContact CE1-CG2 3.49Å; F370-T406 HydrophobicContact CZ-CG2 3.59Å; L402-T406 HydrophobicContact CD2-CG2 4.26Å; E403-T406 WeakPolarHBondContact O-CA 3.47Å; E403-T406 WeakPolarHBondContact O-CB 3.37Å; E403-T406 PolarHBondContact O-N 3.06Å; L404-T406 PolarHBondContact O-N 3.34Å; T406-N409 PolarHBondContact O-N 3.44Å; T406-F410 PolarHBondContact O-N 2.97Å |
| 407 | V | 97.3 | Very high | 95.5 | Very high | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -64.4 | -47.5 | 172.5 | 177.4 | 0 | 0 | 0 | 0 | 111.2 | L378 Q393 I396 L402 E403 L404 N409 F410 F411 | L378-V407 HydrophobicContact CD2-CG1 4.33Å; Q393-V407 HydrophobicContact CB-CG1 4.13Å; Q393-V407 HydrophobicContact CG-CG1 4.25Å; I396-V407 HydrophobicContact CB-CG1 4.14Å; I396-V407 HydrophobicContact CG2-CG1 3.74Å; I396-V407 HydrophobicContact CG2-CG2 4.23Å; L402-V407 HydrophobicContact CB-CG2 3.95Å; L402-V407 HydrophobicContact CD1-CG2 4.12Å; E403-V407 PolarHBondContact O-N 3.18Å; L404-V407 PolarHBondContact O-N 2.94Å; V407-N409 PolarHBondContact O-N 3.03Å; V407-F410 WeakPolarHBondContact O-CB 3.29Å; V407-F410 PolarHBondContact O-N 3.35Å; V407-F410 VanDerWaalsContact O-N 3.14Å; V407-F411 HydrophobicContact CG1-CD2 3.82Å; V407-F411 HydrophobicContact CG1-CE2 3.58Å; V407-F411 VanDerWaalsContact O-CD2 3.24Å; V407-F411 WeakPolarHBondContact O-CD2 3.49Å; V407-F411 PolarHBondContact O-N 2.98Å |
| 408 | S | 97.2 | Very high | 94.7 | Very high | 43 Ų | 43 | 66.8 Ų | 66.8 | 30% | 0.301 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -59.7 | -44.8 | 175.2 | 179.5 | 0 | 0 | 0 | 0 | 112 | Q393 L404 F410 F411 M412 | Q393-S408 VanDerWaalsContact OE1-CB 3.23Å; L404-S408 VanDerWaalsContact O-CB 3.28Å; L404-S408 WeakPolarHBondContact O-CB 3.3Å; L404-S408 PolarHBondContact O-N 3.37Å; S408-F410 VanDerWaalsContact C-N 3.35Å; S408-F410 PolarHBondContact O-N 3.44Å; S408-F411 PolarHBondContact O-N 2.93Å; S408-M412 WeakPolarHBondContact O-CB 3.36Å; S408-M412 PolarHBondContact O-N 3.49Å |
| 409 | N | 96.8 | Very high | 93.1 | Very high | 79 Ų | 79 | 63.9 Ų | 63.9 | 42% | 0.422 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61.1 | -39.4 | 173.7 | -84.9 | -52.5 | 0 | 0 | 0 | 112.6 | S405 T406 V407 N413 | S405-N409 VanDerWaalsContact O-CB 3.25Å; S405-N409 WeakPolarHBondContact O-CB 3.37Å; S405-N409 VanDerWaalsContact O-CG 3.29Å; S405-N409 PolarHBondContact O-N 2.97Å; S405-N409 PolarHBondContact O-ND2 2.93Å; T406-N409 PolarHBondContact O-N 3.44Å; V407-N409 PolarHBondContact O-N 3.03Å; N409-N413 WeakPolarHBondContact O-CB 3.46Å; N409-N413 PolarHBondContact O-N 3.28Å; N409-N413 PolarHBondContact O-ND2 2.88Å |
| 410 | F | 97.1 | Very high | 91.2 | Very high | 35 Ų | 35 | 60 Ų | 60 | 15% | 0.154 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -58.4 | -55.3 | 173.9 | 174.5 | -87.1 | 0 | 0 | 0 | 110.7 | F370 L378 I379 F382 T406 V407 S408 M412 N413 A414 | F370-F410 HydrophobicContact CE2-CD2 4.05Å; F370-F410 HydrophobicContact CZ-CB 4.32Å; F370-F410 HydrophobicContact CZ-CD2 4.41Å; L378-F410 HydrophobicContact CB-CD1 3.91Å; L378-F410 HydrophobicContact CB-CD2 4.27Å; L378-F410 HydrophobicContact CB-CE1 3.64Å; L378-F410 HydrophobicContact CB-CE2 3.99Å; L378-F410 HydrophobicContact CB-CG 4.24Å; L378-F410 HydrophobicContact CB-CZ 3.68Å; L378-F410 HydrophobicContact CD1-CB 4.41Å; L378-F410 HydrophobicContact CD1-CD1 4.41Å; L378-F410 HydrophobicContact CD1-CD2 4.05Å; L378-F410 HydrophobicContact CD1-CE2 4.49Å; L378-F410 HydrophobicContact CD1-CG 4.02Å; L378-F410 HydrophobicContact CD2-CD1 4.11Å; L378-F410 HydrophobicContact CD2-CG 4.42Å; L378-F410 HydrophobicContact CG-CD1 4.37Å; L378-F410 HydrophobicContact CG-CG 4.47Å; L378-F410 WeakPolarHBondContact O-CE1 3.32Å; I379-F410 HydrophobicContact CG1-CZ 4.11Å; F382-F410 HydrophobicContact CB-CE1 4.2Å; T406-F410 PolarHBondContact O-N 2.97Å; V407-F410 WeakPolarHBondContact O-CB 3.29Å; V407-F410 PolarHBondContact O-N 3.35Å; V407-F410 VanDerWaalsContact O-N 3.14Å; S408-F410 VanDerWaalsContact C-N 3.35Å; S408-F410 PolarHBondContact O-N 3.44Å; F410-M412 VanDerWaalsContact C-N 3.3Å; F410-M412 PolarHBondContact O-N 3.47Å; F410-N413 PolarHBondContact O-N 2.93Å; F410-N413 VanDerWaalsContact O-N 3.08Å; F410-A414 HydrophobicContact CD1-CB 4.48Å; F410-A414 HydrophobicContact CE1-CB 4.06Å; F410-A414 HydrophobicContact CZ-CB 4.34Å; F410-A414 WeakPolarHBondContact O-CB 3.45Å; F410-A414 PolarHBondContact O-N 2.53Å |
| 411 | F | 96.5 | Very high | 89.1 | Confident | 0 Ų | 0 | 68.2 Ų | 68.2 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -64.5 | -33.8 | -177.2 | -73.6 | -67.7 | 0 | 0 | 0 | 112.8 | L378 I381 F382 P388 Q393 I396 V407 S408 R415 | L378-F411 HydrophobicContact CD2-CE2 4.08Å; L378-F411 HydrophobicContact CD2-CZ 4.18Å; I381-F411 HydrophobicContact CB-CZ 4.31Å; I381-F411 HydrophobicContact CG2-CE1 4.23Å; I381-F411 HydrophobicContact CG2-CZ 3.86Å; F382-F411 HydrophobicContact CB-CD1 4.25Å; F382-F411 HydrophobicContact CB-CE1 3.9Å; F382-F411 AromaticContact CD2-CD1 3.92Å; F382-F411 HydrophobicContact CD2-CD1 3.92Å; F382-F411 HydrophobicContact CD2-CE1 4.33Å; F382-F411 HydrophobicContact CG-CD1 4.49Å; P388-F411 HydrophobicContact CG-CB 4.48Å; P388-F411 HydrophobicContact CG-CD1 3.84Å; P388-F411 HydrophobicContact CG-CD2 3.66Å; P388-F411 HydrophobicContact CG-CE1 3.9Å; P388-F411 HydrophobicContact CG-CE2 3.73Å; P388-F411 HydrophobicContact CG-CG 3.73Å; P388-F411 HydrophobicContact CG-CZ 3.87Å; Q393-F411 HydrophobicContact CG-CD2 4.22Å; Q393-F411 HydrophobicContact CG-CE2 4.49Å; I396-F411 HydrophobicContact CD1-CE2 3.96Å; I396-F411 HydrophobicContact CD1-CZ 4.01Å; V407-F411 HydrophobicContact CG1-CD2 3.82Å; V407-F411 HydrophobicContact CG1-CE2 3.58Å; V407-F411 VanDerWaalsContact O-CD2 3.24Å; V407-F411 WeakPolarHBondContact O-CD2 3.49Å; V407-F411 PolarHBondContact O-N 2.98Å; S408-F411 PolarHBondContact O-N 2.93Å; F411-R415 WeakPolarHBondContact O-CG 3.28Å; F411-R415 PolarHBondContact O-N 3.21Å; F411-R415 VanDerWaalsContact O-N 3.07Å; F411-R415 PolarHBondContact O-NH1 2.96Å |
| 412 | M | 94.4 | Very high | 86.8 | Confident | 92 Ų | 92 | 75.2 Ų | 75.2 | 45% | 0.453 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -63.9 | -44 | 171.5 | -168.3 | -162.4 | -59.7 | 0 | 0 | 112.1 | S408 F410 R416 | S408-M412 WeakPolarHBondContact O-CB 3.36Å; S408-M412 PolarHBondContact O-N 3.49Å; F410-M412 VanDerWaalsContact C-N 3.3Å; F410-M412 PolarHBondContact O-N 3.47Å; M412-R416 PolarHBondContact O-N 3.07Å |
| 413 | N | 94.2 | Very high | 84.2 | Confident | 46 Ų | 46 | 81.3 Ų | 81.3 | 25% | 0.246 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -68.2 | -41.2 | 177.3 | -83.6 | -80.6 | 0 | 0 | 0 | 112.4 | N409 F410 R416 R417 | N409-N413 WeakPolarHBondContact O-CB 3.46Å; N409-N413 PolarHBondContact O-N 3.28Å; N409-N413 PolarHBondContact O-ND2 2.88Å; F410-N413 PolarHBondContact O-N 2.93Å; F410-N413 VanDerWaalsContact O-N 3.08Å; N413-R416 PolarHBondContact O-N 3.15Å; N413-R416 VanDerWaalsContact OD1-CZ 3.3Å; N413-R416 PolarHBondContact OD1-NH1 2.97Å; N413-R416 PolarHBondContact OD1-NH2 2.88Å; N413-R417 WeakPolarHBondContact O-CG 3.47Å; N413-R417 PolarHBondContact O-N 3.18Å |
| 414 | A | 94.2 | Very high | 81.3 | Confident | 15 Ų | 15 | 82.7 Ų | 82.7 | 12% | 0.124 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -62.9 | -48.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | F382 F410 R416 R417 C418 | F382-A414 HydrophobicContact CD1-CB 3.77Å; F382-A414 HydrophobicContact CD2-CB 3.91Å; F382-A414 HydrophobicContact CE1-CB 3.73Å; F382-A414 HydrophobicContact CE2-CB 3.85Å; F382-A414 HydrophobicContact CG-CB 3.86Å; F382-A414 VanDerWaalsContact CZ-C 3.47Å; F382-A414 HydrophobicContact CZ-CB 3.76Å; F410-A414 HydrophobicContact CD1-CB 4.48Å; F410-A414 HydrophobicContact CE1-CB 4.06Å; F410-A414 HydrophobicContact CZ-CB 4.34Å; F410-A414 WeakPolarHBondContact O-CB 3.45Å; F410-A414 PolarHBondContact O-N 2.53Å; A414-R416 VanDerWaalsContact C-N 3.35Å; A414-R416 PolarHBondContact O-N 2.83Å; A414-R417 PolarHBondContact O-N 3.02Å; A414-C418 WeakPolarHBondContact O-CB 3.41Å; A414-C418 PolarHBondContact O-N 3.22Å |
| 415 | R | 93.3 | Very high | 78.3 | Confident | 79 Ų | 79 | 86.6 Ų | 86.6 | 30% | 0.298 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -54.8 | -48.3 | 171.8 | -76.9 | -168.9 | -66.3 | -82.6 | 0.3 | 112.1 | F382 K386 F411 R417 C418 | F382-R415 HydrophobicContact CE2-CG 3.83Å; F382-R415 HydrophobicContact CZ-CG 4.33Å; K386-R415 VanDerWaalsContact O-CD 3.24Å; K386-R415 WeakPolarHBondContact O-CD 3.37Å; K386-R415 WeakPolarHBondContact O-CG 3.27Å; K386-R415 PolarHBondContact O-NH1 2.95Å; F411-R415 WeakPolarHBondContact O-CG 3.28Å; F411-R415 PolarHBondContact O-N 3.21Å; F411-R415 VanDerWaalsContact O-N 3.07Å; F411-R415 PolarHBondContact O-NH1 2.96Å; R415-R417 VanDerWaalsContact C-N 3.29Å; R415-R417 PolarHBondContact O-N 3.4Å; R415-C418 PolarHBondContact O-N 3.42Å |
| 416 | R | 88.8 | Confident | 75.5 | Confident | 133 Ų | 133 | 93.3 Ų | 93.3 | 50% | 0.502 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -60 | -37.6 | -177.9 | -157.9 | -161.5 | -45.1 | 104.2 | 1.3 | 112.7 | M412 N413 A414 | M412-R416 PolarHBondContact O-N 3.07Å; N413-R416 PolarHBondContact O-N 3.15Å; N413-R416 VanDerWaalsContact OD1-CZ 3.3Å; N413-R416 PolarHBondContact OD1-NH1 2.97Å; N413-R416 PolarHBondContact OD1-NH2 2.88Å; A414-R416 VanDerWaalsContact C-N 3.35Å; A414-R416 PolarHBondContact O-N 2.83Å |
| 417 | R | 87.2 | Confident | 72.4 | Confident | 176 Ų | 176 | 95.6 Ų | 95.6 | 66% | 0.664 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -83.5 | -17.4 | -179.2 | -68.6 | 172.8 | 177.1 | 168.9 | -0.7 | 113.9 | N413 A414 R415 | N413-R417 WeakPolarHBondContact O-CG 3.47Å; N413-R417 PolarHBondContact O-N 3.18Å; A414-R417 PolarHBondContact O-N 3.02Å; R415-R417 VanDerWaalsContact C-N 3.29Å; R415-R417 PolarHBondContact O-N 3.4Å |
| 418 | C | 81.4 | Confident | 69.7 | Low | 47 Ų | 47 | 99.9 Ų | 99.9 | 32% | 0.318 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -79.3 | -19 | -177.2 | -162.7 | 0 | 0 | 0 | 0 | 113.4 | F382 A414 R415 | F382-C418 HydrophobicContact CE1-CB 4.22Å; F382-C418 HydrophobicContact CZ-CB 4.08Å; A414-C418 WeakPolarHBondContact O-CB 3.41Å; A414-C418 PolarHBondContact O-N 3.22Å; R415-C418 PolarHBondContact O-N 3.42Å |
| 419 | V | 63.5 | Low | 66.5 | Low | 79 Ų | 79 | 103.2 Ų | 103.2 | 48% | 0.479 | 52% | 0.524 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.1 | -13.2 | -173.7 | 178.5 | 0 | 0 | 0 | 0 | 113.1 | W422 | V419-W422 VanDerWaalsContact O-CD1 3.31Š|
| 420 | D | 55.9 | Low | 64.1 | Low | 58 Ų | 58 | 105.6 Ų | 105.6 | 31% | 0.31 | 54% | 0.544 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.4 | -3.7 | -175.4 | -58.1 | -52.3 | 0 | 0 | 0 | 113.8 | W422 | D420-W422 PolarHBondContact O-N 2.94Š|
| 421 | R | 52.5 | Low | 61.2 | Low | 193 Ų | 193 | 107 Ų | 107 | 73% | 0.728 | 57% | 0.568 | S | S | * | * | trans | -87.1 | 9.4 | 179 | -67.7 | -158.2 | -64.8 | 176.6 | 2.3 | 115.8 | H423 | R421-H423 PolarHBondContact O-N 3.34Š| ||
| 422 | W | 48.7 | Very low | 58.2 | Low | 216 Ų | 216 | 116.3 Ų | 116.3 | 82% | 0.818 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.8 | 53.1 | -177.1 | -73.4 | 82.1 | 0 | 0 | 0 | 113.3 | V419 D420 | V419-W422 VanDerWaalsContact O-CD1 3.31Å; D420-W422 PolarHBondContact O-N 2.94Å |
| 423 | H | 43 | Very low | 55.8 | Low | 149 Ų | 149 | 118.4 Ų | 118.4 | 69% | 0.69 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -156.7 | -3.5 | 177.1 | -105.5 | 71.4 | 0 | 0 | 0 | 115.1 | K273 R421 | K273-H423 PolarHBondContact NZ-CD2 3.03Å; K273-H423 PolarHBondContact NZ-CE1 3.38Å; K273-H423 PolarHBondContact NZ-NE2 2.8Å; R421-H423 PolarHBondContact O-N 3.34Å |
| 424 | D | 35.5 | Very low | 52.9 | Low | 160 Ų | 160 | 119.1 Ų | 119.1 | 86% | 0.856 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -123.4 | 9.1 | -169.4 | -148.2 | -134.1 | 0 | 0 | 0 | 112.9 | ||
| 425 | D | 33.2 | Very low | 50.1 | Low | 141 Ų | 141 | 124.7 Ų | 124.7 | 75% | 0.754 | 68% | 0.683 | S | S | * | * | trans | -117.2 | 31 | -176.4 | -147.7 | -122 | 0 | 0 | 0 | 111.5 | ||||
| 426 | H | 38 | Very low | 47.5 | Very low | 194 Ų | 194 | 126.6 Ų | 126.6 | 90% | 0.898 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -118.5 | 74 | 170.5 | -72.4 | -34.7 | 0 | 0 | 0 | 108.9 | ||
| 427 | G | 32.3 | Very low | 45 | Very low | 73 Ų | 73 | 126.3 Ų | 126.3 | 75% | 0.753 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -168.8 | -28.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | S429 | G427-S429 PolarHBondContact O-N 2.67Å; G427-S429 VanDerWaalsContact O-N 3.11Å |
| 428 | A | 40.3 | Very low | 43 | Very low | 89 Ų | 89 | 123.5 Ų | 123.5 | 74% | 0.736 | 72% | 0.724 | S | S | * | * | trans | -78.2 | 89.3 | 169.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 429 | S | 29.1 | Very low | 40.8 | Very low | 114 Ų | 114 | 127 Ų | 127 | 80% | 0.797 | 74% | 0.744 | S | S | * | * | trans | -68.5 | 129.2 | 176.3 | -169.1 | 0 | 0 | 0 | 0 | 111.3 | G427 G431 | G427-S429 PolarHBondContact O-N 2.67Å; G427-S429 VanDerWaalsContact O-N 3.11Å; S429-G431 PolarHBondContact O-N 3.38Å | ||
| 430 | P | 47.6 | Very low | 39.6 | Very low | 129 Ų | 129 | 132.4 Ų | 132.4 | 84% | 0.838 | 76% | 0.761 | S | S | * | * | trans | -86 | 95 | -178.5 | 33.2 | -33.2 | 0 | 0 | 0 | 111.5 | ||||
| 431 | G | 36.2 | Very low | 39 | Very low | 65 Ų | 65 | 135.4 Ų | 135.4 | 67% | 0.67 | 79% | 0.787 | S | S | * | * | trans | 177.2 | 91.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 117.7 | S429 | S429-G431 PolarHBondContact O-N 3.38Š| ||
| 432 | Q | 33.6 | Very low | 38.4 | Very low | 194 Ų | 194 | 135.9 Ų | 135.9 | 91% | 0.907 | 79% | 0.794 | S | S | * | * | -174.9 | 115.8 | 127.6 | -107.6 | -176.8 | -4.4 | 0 | 0 | 111.9 | |||||
| 433 | P | 43.2 | Very low | 37.8 | Very low | 137 Ų | 137 | 134 Ų | 134 | 89% | 0.89 | 83% | 0.825 | S | S | * | * | trans | -94.1 | 114.8 | 157.3 | 32.5 | -24.8 | 0 | 0 | 0 | 109.4 | ||||
| 434 | G | 33.9 | Very low | 37.5 | Very low | 60 Ų | 60 | 133.3 Ų | 133.3 | 62% | 0.619 | 83% | 0.832 | S | S | * | * | trans | -153.1 | 100.8 | -173.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 435 | T | 35.8 | Very low | 37.6 | Very low | 133 Ų | 133 | 131.9 Ų | 131.9 | 82% | 0.816 | 83% | 0.83 | S | S | * | * | trans | 40.3 | 104.2 | 154.1 | 57.9 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 436 | S | 39.1 | Very low | 37.8 | Very low | 119 Ų | 119 | 131.4 Ų | 131.4 | 83% | 0.832 | 84% | 0.835 | S | S | * | * | trans | -141.8 | 95.4 | 147.3 | -75.8 | 0 | 0 | 0 | 0 | 108.6 | T438 | S436-T438 PolarHBondContact O-N 3.35Š| ||
| 437 | T | 36.2 | Very low | 37.8 | Very low | 127 Ų | 127 | 127.7 Ų | 127.7 | 78% | 0.779 | 83% | 0.831 | S | S | * | * | trans | -84.7 | 95.8 | -173.1 | -52.6 | 0 | 0 | 0 | 0 | 110.5 | T439 | T437-T439 PolarHBondContact O-N 2.67Š| ||
| 438 | T | 43.2 | Very low | 38.2 | Very low | 117 Ų | 117 | 131.1 Ų | 131.1 | 72% | 0.718 | 84% | 0.836 | S | S | * | * | trans | -73 | 111.5 | 172.6 | -54.6 | 0 | 0 | 0 | 0 | 110.2 | S436 F440 | S436-T438 PolarHBondContact O-N 3.35Å; T438-F440 HydrophobicContact CG2-CD2 4.25Å; T438-F440 HydrophobicContact CG2-CE2 4.48Å; T438-F440 PolarHBondContact O-N 2.79Å | ||
| 439 | T | 37 | Very low | 38 | Very low | 119 Ų | 119 | 133.9 Ų | 133.9 | 73% | 0.73 | 84% | 0.842 | S | S | * | * | trans | -71.7 | 121.3 | 175 | 40.5 | 0 | 0 | 0 | 0 | 111.3 | T437 | T437-T439 PolarHBondContact O-N 2.67Š| ||
| 440 | F | 37 | Very low | 38.7 | Very low | 194 Ų | 194 | 135.4 Ų | 135.4 | 85% | 0.851 | 85% | 0.846 | S | S | * | * | trans | -117.4 | 101.1 | 169.3 | -110.8 | -87.4 | 0 | 0 | 0 | 109.4 | T438 | T438-F440 HydrophobicContact CG2-CD2 4.25Å; T438-F440 HydrophobicContact CG2-CE2 4.48Å; T438-F440 PolarHBondContact O-N 2.79Å | ||
| 441 | S | 44.1 | Very low | 38 | Very low | 121 Ų | 121 | 135.8 Ų | 135.8 | 85% | 0.846 | 85% | 0.846 | S | S | * | * | trans | -105.5 | 96.8 | 177.2 | -59.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 442 | K | 39.6 | Very low | 38.1 | Very low | 203 Ų | 203 | 141.8 Ų | 141.8 | 88% | 0.883 | 86% | 0.861 | S | S | * | * | trans | -161.6 | 92.8 | 162.2 | -165.5 | 170.6 | -175.6 | 175.1 | 0 | 114 | ||||
| 443 | A | 35.2 | Very low | 38.6 | Very low | 177 Ų | 177 | 137 Ų | 137 | 100% | 1.463 | 86% | 0.857 | S | S | * | * | trans | -160.7 | 0 | 147.7 | 0 | 0 | 0 | 0 | 0 | 107.1 |
Retrieved 443 of 443 residues in 1414.3 ms
(Link to these results)