| 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 | Very low | 42.3 | Very low | 240 Ų | 240 | 142.9 Ų | 142.9 | 100% | 1.182 | 83% | 0.832 | S | S | * | * | 0 | 120.5 | 0 | -53.8 | -160.5 | 125.4 | 0 | 0 | 106.3 | |||||
| 2 | S | 41.4 | Very low | 42.2 | Very low | 114 Ų | 114 | 146.5 Ų | 146.5 | 80% | 0.797 | 83% | 0.831 | S | S | * | * | cis | -159.4 | 150.6 | 1.4 | -72.2 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 3 | C | 40.8 | Very low | 42.3 | Very low | 119 Ų | 119 | 147.5 Ų | 147.5 | 80% | 0.804 | 83% | 0.83 | S | S | * | * | trans | -77.1 | 159.8 | 173.2 | -51.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 4 | Q | 45.6 | Very low | 42.7 | Very low | 173 Ų | 173 | 144.1 Ų | 144.1 | 81% | 0.808 | 82% | 0.817 | S | S | * | * | trans | 172.8 | 123.6 | 138.4 | -93.2 | 167.7 | 48.2 | 0 | 0 | 107.6 | ||||
| 5 | S | 40.6 | Very low | 42.8 | Very low | 101 Ų | 101 | 146.7 Ų | 146.7 | 71% | 0.706 | 83% | 0.827 | S | S | * | * | cis | 63.1 | 106.9 | 46.5 | 69 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 6 | F | 43.1 | Very low | 42.5 | Very low | 211 Ų | 211 | 146.3 Ų | 146.3 | 93% | 0.925 | 82% | 0.822 | S | S | * | * | trans | -119.8 | 119.7 | 159 | -93.3 | -82.1 | 0 | 0 | 0 | 109.5 | ||||
| 7 | T | 45.7 | Very low | 42.3 | Very low | 128 Ų | 128 | 142.5 Ų | 142.5 | 79% | 0.785 | 81% | 0.807 | S | S | * | * | trans | -97.2 | 141.4 | 162.5 | 47.4 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 8 | S | 45.8 | Very low | 41.9 | Very low | 132 Ų | 132 | 144 Ų | 144 | 92% | 0.923 | 81% | 0.812 | S | S | * | * | trans | -150.8 | 130.7 | 143.7 | -108.9 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 9 | A | 48.2 | Very low | 41.9 | Very low | 81 Ų | 81 | 141.1 Ų | 141.1 | 67% | 0.669 | 81% | 0.808 | S | S | * | * | trans | -97.9 | -175.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 10 | D | 36.5 | Very low | 42.8 | Very low | 151 Ų | 151 | 140.1 Ų | 140.1 | 81% | 0.807 | 81% | 0.807 | S | S | * | * | trans | 89.4 | 132.4 | 166 | -64.2 | -52.2 | 0 | 0 | 0 | 117.5 | ||||
| 11 | T | 39 | Very low | 42.5 | Very low | 122 Ų | 122 | 137.7 Ų | 137.7 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | cis | -165.1 | 155.9 | 0.4 | -111.1 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 12 | F | 41.2 | Very low | 42.4 | Very low | 186 Ų | 186 | 131.9 Ų | 131.9 | 82% | 0.816 | 78% | 0.782 | S | S | * | * | trans | -64.3 | 153.5 | 177.9 | -82.3 | -107.6 | 0 | 0 | 0 | 115.5 | ||||
| 13 | I | 42.7 | Very low | 42.5 | Very low | 160 Ų | 160 | 133.4 Ų | 133.4 | 82% | 0.821 | 78% | 0.781 | S | S | * | * | trans | -139.3 | 127.3 | 132.7 | -66.3 | -167.4 | 0 | 0 | 0 | 109.8 | ||||
| 14 | P | 48.1 | Very low | 43 | Very low | 99 Ų | 99 | 133.2 Ų | 133.2 | 64% | 0.643 | 78% | 0.778 | S | S | * | * | trans | -93.5 | 145.2 | 169.8 | 35.3 | -28 | 0 | 0 | 0 | 111.4 | ||||
| 15 | L | 43.9 | Very low | 42.5 | Very low | 184 Ų | 184 | 131.8 Ų | 131.8 | 96% | 0.963 | 78% | 0.775 | S | S | * | * | trans | -95.3 | 124.3 | 165.3 | -76.6 | 170.5 | 0 | 0 | 0 | 109.6 | ||||
| 16 | N | 37.9 | Very low | 42.5 | Very low | 140 Ų | 140 | 133.2 Ų | 133.2 | 75% | 0.749 | 77% | 0.773 | S | S | * | * | trans | -116.3 | 144.3 | -178.6 | -170.8 | 26.3 | 0 | 0 | 0 | 110.1 | ||||
| 17 | S | 39.9 | Very low | 42.5 | Very low | 81 Ų | 81 | 130 Ų | 130 | 57% | 0.566 | 76% | 0.763 | S | S | * | * | trans | 61.9 | 125.6 | 148.1 | -75.6 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 18 | D | 34.3 | Very low | 42.3 | Very low | 170 Ų | 170 | 132.1 Ų | 132.1 | 91% | 0.909 | 76% | 0.764 | S | S | * | * | -155.9 | 147.9 | 101.5 | -97.8 | -32.4 | 0 | 0 | 0 | 111.6 | |||||
| 19 | A | 42.7 | Very low | 41.9 | Very low | 88 Ų | 88 | 133.2 Ų | 133.2 | 73% | 0.727 | 75% | 0.754 | S | S | * | * | trans | -104.3 | -140.7 | -158.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 20 | P | 59 | Low | 41.1 | Very low | 122 Ų | 122 | 135.4 Ų | 135.4 | 79% | 0.792 | 76% | 0.764 | S | S | * | * | -121 | 161.9 | -109.9 | 36.2 | -18.9 | 0 | 0 | 0 | 113.5 | |||||
| 21 | A | 36.6 | Very low | 41.1 | Very low | 89 Ų | 89 | 132.7 Ų | 132.7 | 74% | 0.736 | 76% | 0.762 | S | S | * | * | trans | -170.1 | 141.9 | 149.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 22 | T | 37.1 | Very low | 40.9 | Very low | 119 Ų | 119 | 131.4 Ų | 131.4 | 73% | 0.73 | 76% | 0.764 | S | S | * | * | trans | 68.6 | 95.5 | 141.1 | 22.8 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 23 | L | 44 | Very low | 40.3 | Very low | 146 Ų | 146 | 131.2 Ų | 131.2 | 76% | 0.764 | 77% | 0.766 | S | S | * | * | 160.1 | 134.6 | 93.6 | -88.6 | 171.6 | 0 | 0 | 0 | 112 | |||||
| 24 | P | 50.3 | Low | 39.9 | Very low | 114 Ų | 114 | 129.1 Ų | 129.1 | 74% | 0.74 | 76% | 0.764 | S | S | * | * | trans | -107.8 | 119.7 | 168.2 | 34.8 | -22.3 | 0 | 0 | 0 | 111.2 | ||||
| 25 | L | 35 | Very low | 39.2 | Very low | 143 Ų | 143 | 131.9 Ų | 131.9 | 75% | 0.749 | 77% | 0.773 | S | S | * | * | trans | -162.4 | 135.1 | 173.4 | -79.4 | -174.6 | 0 | 0 | 0 | 106.6 | ||||
| 26 | I | 41.3 | Very low | 39.4 | Very low | 131 Ų | 131 | 128 Ų | 128 | 67% | 0.672 | 76% | 0.758 | S | S | * | * | cis | -154 | 142.2 | 12.7 | -93.7 | 147.6 | 0 | 0 | 0 | 107.8 | ||||
| 27 | M | 44.1 | Very low | 39 | Very low | 144 Ų | 144 | 127.3 Ų | 127.3 | 71% | 0.709 | 76% | 0.759 | S | S | * | * | trans | -76.8 | 129.7 | 168.6 | -174.6 | -168.3 | 69.1 | 0 | 0 | 109.4 | ||||
| 28 | H | 40.8 | Very low | 38.7 | Very low | 173 Ų | 173 | 128.8 Ų | 128.8 | 80% | 0.801 | 77% | 0.769 | S | S | * | * | trans | -136.7 | 95.2 | 154.6 | -104.4 | -82.2 | 0 | 0 | 0 | 109.7 | ||||
| 29 | H | 37.8 | Very low | 38.6 | Very low | 154 Ų | 154 | 126.8 Ų | 126.8 | 71% | 0.713 | 76% | 0.759 | S | S | * | * | trans | -71.8 | 130 | 150.2 | -64.5 | -81.8 | 0 | 0 | 0 | 107.3 | ||||
| 30 | S | 31.5 | Very low | 38.5 | Very low | 128 Ų | 128 | 131.5 Ų | 131.5 | 90% | 0.895 | 77% | 0.765 | S | S | * | * | trans | -99.9 | 108.5 | 157.7 | -83 | 0 | 0 | 0 | 0 | 108 | ||||
| 31 | A | 36.8 | Very low | 37.2 | Very low | 93 Ų | 93 | 129.6 Ų | 129.6 | 77% | 0.769 | 76% | 0.76 | S | S | * | * | trans | -136 | 159.9 | 161.5 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 32 | A | 34.4 | Very low | 37.4 | Very low | 95 Ų | 95 | 132.1 Ų | 132.1 | 79% | 0.785 | 77% | 0.766 | S | S | * | * | trans | 91.2 | 130 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 33 | E | 28.8 | Very low | 37.2 | Very low | 183 Ų | 183 | 133.7 Ų | 133.7 | 86% | 0.855 | 77% | 0.77 | S | S | * | * | cis | -150.1 | 135 | 26.5 | -65.3 | 170.8 | 148.4 | 0 | 0 | 107.9 | ||||
| 34 | C | 33 | Very low | 36.8 | Very low | 115 Ų | 115 | 133.2 Ų | 133.2 | 78% | 0.777 | 77% | 0.773 | S | S | * | * | 47.8 | 96.3 | 63.7 | -84.1 | 0 | 0 | 0 | 0 | 113 | |||||
| 35 | L | 33.7 | Very low | 35.9 | Very low | 157 Ų | 157 | 136.3 Ų | 136.3 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | 149.7 | -175.8 | 78.1 | -87.7 | 180 | 0 | 0 | 0 | 107.2 | |||||
| 36 | P | 49 | Very low | 35.7 | Very low | 102 Ų | 102 | 134.1 Ų | 134.1 | 66% | 0.662 | 78% | 0.776 | S | S | * | * | cis | -135.3 | 169.2 | -37.3 | 31.8 | -11.8 | 0 | 0 | 0 | 115.3 | ||||
| 37 | V | 29.8 | Very low | 35.4 | Very low | 126 Ų | 126 | 134.4 Ų | 134.4 | 76% | 0.764 | 78% | 0.784 | S | S | * | * | trans | 52.7 | 123 | 136.6 | 177.6 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 38 | S | 32.1 | Very low | 35.2 | Very low | 112 Ų | 112 | 133.9 Ų | 133.9 | 78% | 0.783 | 79% | 0.789 | S | S | * | * | -158.3 | 137.1 | 119.7 | -165.5 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 39 | N | 33.9 | Very low | 35.4 | Very low | 129 Ų | 129 | 131.4 Ų | 131.4 | 69% | 0.69 | 79% | 0.788 | S | S | * | * | trans | -91.2 | 146.5 | -178.1 | -70.2 | -70.4 | 0 | 0 | 0 | 111.5 | ||||
| 40 | H | 38.8 | Very low | 35.3 | Very low | 187 Ų | 187 | 129.3 Ų | 129.3 | 87% | 0.866 | 79% | 0.791 | S | S | * | * | trans | -139.4 | 102.6 | 141.7 | -76.5 | -73.6 | 0 | 0 | 0 | 105.7 | ||||
| 41 | A | 33 | Very low | 35.5 | Very low | 81 Ų | 81 | 130.7 Ų | 130.7 | 67% | 0.669 | 79% | 0.787 | S | S | * | * | 66.6 | 103 | 73.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 42 | T | 40.4 | Very low | 35.4 | Very low | 142 Ų | 142 | 133.7 Ų | 133.7 | 87% | 0.871 | 79% | 0.789 | S | S | * | * | trans | 175.8 | 95.7 | 132 | 35.6 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 43 | N | 33.1 | Very low | 35.4 | Very low | 153 Ų | 153 | 134.1 Ų | 134.1 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | 43.8 | 121.5 | 95.8 | -115.6 | -18.4 | 0 | 0 | 0 | 112.8 | |||||
| 44 | V | 35.2 | Very low | 35.6 | Very low | 135 Ų | 135 | 132.7 Ų | 132.7 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | -165.7 | 150.7 | 64.5 | -76.7 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 45 | M | 32.3 | Very low | 35.6 | Very low | 180 Ų | 180 | 133.1 Ų | 133.1 | 89% | 0.887 | 78% | 0.777 | S | S | * | * | trans | -112.1 | 149.2 | 162.4 | 178.6 | 87 | -177.9 | 0 | 0 | 108.8 | ||||
| 46 | S | 30.3 | Very low | 35.6 | Very low | 97 Ų | 97 | 133.8 Ų | 133.8 | 68% | 0.678 | 78% | 0.776 | S | S | * | * | trans | 95.1 | 115.5 | 154.5 | -154.7 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 47 | T | 34.6 | Very low | 35.2 | Very low | 137 Ų | 137 | 134.4 Ų | 134.4 | 84% | 0.84 | 78% | 0.778 | S | S | * | * | -177.8 | 127 | 116.6 | 36.2 | 0 | 0 | 0 | 0 | 109.4 | |||||
| 48 | V | 39.2 | Very low | 36.2 | Very low | 132 Ų | 132 | 134.4 Ų | 134.4 | 80% | 0.8 | 78% | 0.78 | S | S | * | * | trans | -75.1 | 152.4 | 161.4 | -147.3 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 49 | P | 46.5 | Very low | 36.4 | Very low | 121 Ų | 121 | 136.2 Ų | 136.2 | 79% | 0.786 | 78% | 0.781 | S | S | * | * | -148.2 | 163.6 | 90.5 | 33.8 | -13.4 | 0 | 0 | 0 | 116.4 | |||||
| 50 | S | 35.6 | Very low | 36.4 | Very low | 110 Ų | 110 | 135.7 Ų | 135.7 | 77% | 0.769 | 79% | 0.786 | S | S | * | * | trans | -48.8 | 144.1 | 177.4 | -42.6 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 51 | I | 35.8 | Very low | 36 | Very low | 158 Ų | 158 | 134.7 Ų | 134.7 | 81% | 0.81 | 79% | 0.786 | S | S | * | * | trans | -140.7 | 137.5 | 145.5 | -55.8 | -176.4 | 0 | 0 | 0 | 109.1 | ||||
| 52 | L | 33 | Very low | 36.2 | Very low | 156 Ų | 156 | 137.7 Ų | 137.7 | 82% | 0.817 | 79% | 0.786 | S | S | * | * | trans | -29.9 | 148.7 | 172.3 | -64.5 | 90.8 | 0 | 0 | 0 | 114.5 | ||||
| 53 | S | 35 | Very low | 35.8 | Very low | 103 Ų | 103 | 137.7 Ų | 137.7 | 72% | 0.72 | 79% | 0.786 | S | S | * | * | 175.5 | 124.9 | 65.8 | 44.8 | 0 | 0 | 0 | 0 | 107.3 | |||||
| 54 | L | 32.3 | Very low | 35.8 | Very low | 153 Ų | 153 | 139.7 Ų | 139.7 | 80% | 0.801 | 78% | 0.784 | S | S | * | * | 79.7 | 116.9 | 94.6 | -160.4 | 70.1 | 0 | 0 | 0 | 113.7 | |||||
| 55 | I | 33.8 | Very low | 35.5 | Very low | 125 Ų | 125 | 142.5 Ų | 142.5 | 64% | 0.641 | 79% | 0.785 | S | S | * | * | trans | 94.7 | 113.4 | 145.9 | -77.6 | 164.9 | 0 | 0 | 0 | 121.1 | ||||
| 56 | Q | 34.3 | Very low | 35.4 | Very low | 171 Ų | 171 | 138.5 Ų | 138.5 | 80% | 0.799 | 78% | 0.775 | S | S | * | * | trans | 78.7 | 107.5 | 134.8 | -79.7 | 168 | -21.1 | 0 | 0 | 123.2 | ||||
| 57 | T | 40.8 | Very low | 35.7 | Very low | 115 Ų | 115 | 140 Ų | 140 | 71% | 0.706 | 78% | 0.78 | S | S | * | * | -54.5 | 163.6 | 128.3 | 58.5 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 58 | P | 49.4 | Very low | 35.7 | Very low | 125 Ų | 125 | 140.3 Ų | 140.3 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | -145.6 | 166.1 | 96.2 | 32.5 | -13.7 | 0 | 0 | 0 | 116.4 | |||||
| 59 | N | 36.7 | Very low | 35.6 | Very low | 150 Ų | 150 | 139 Ų | 139 | 80% | 0.802 | 77% | 0.774 | S | S | * | * | trans | -67.2 | 161 | 178.7 | -71.3 | -39.5 | 0 | 0 | 0 | 115.2 | ||||
| 60 | C | 35 | Very low | 35 | Very low | 118 Ų | 118 | 141.7 Ų | 141.7 | 80% | 0.797 | 78% | 0.778 | S | S | * | * | trans | -22.8 | 137.5 | 150 | -169.8 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 61 | L | 29.5 | Very low | 34.7 | Very low | 166 Ų | 166 | 139.4 Ų | 139.4 | 87% | 0.869 | 77% | 0.772 | S | S | * | * | trans | -157.9 | 136.1 | 144.6 | -109.4 | 161 | 0 | 0 | 0 | 113.4 | ||||
| 62 | H | 36.6 | Very low | 34.5 | Very low | 145 Ų | 145 | 139.7 Ų | 139.7 | 67% | 0.671 | 78% | 0.775 | S | S | * | * | trans | -35.2 | 139.2 | 160.2 | -124.6 | -97 | 0 | 0 | 0 | 115.9 | Y64 | H62-Y64 AromaticContact CE1-CD2 3.96Å; H62-Y64 AromaticContact CE1-CE2 3.67Å; H62-Y64 AromaticContact ND1-CD2 3.75Å; H62-Y64 AromaticContact ND1-CE2 3.92Å | ||
| 63 | T | 33.4 | Very low | 34.6 | Very low | 142 Ų | 142 | 139 Ų | 139 | 87% | 0.871 | 78% | 0.778 | S | S | * | * | trans | -142.9 | 127.2 | 146.2 | 42.3 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 64 | Y | 33.2 | Very low | 34.6 | Very low | 194 Ų | 194 | 138.5 Ų | 138.5 | 76% | 0.761 | 78% | 0.78 | S | S | * | * | trans | -69.9 | 175.2 | 165.1 | -96.2 | -100.6 | 0 | 0 | 0 | 112.5 | H62 | H62-Y64 AromaticContact CE1-CD2 3.96Å; H62-Y64 AromaticContact CE1-CE2 3.67Å; H62-Y64 AromaticContact ND1-CD2 3.75Å; H62-Y64 AromaticContact ND1-CE2 3.92Å | ||
| 65 | F | 28.3 | Very low | 34.9 | Very low | 195 Ų | 195 | 138.1 Ų | 138.1 | 86% | 0.855 | 78% | 0.784 | S | S | * | * | trans | 107.9 | 137.9 | 167.8 | -80.5 | -98.2 | 0 | 0 | 0 | 114 | ||||
| 66 | S | 30.1 | Very low | 35 | Very low | 96 Ų | 96 | 135.6 Ų | 135.6 | 67% | 0.671 | 79% | 0.789 | S | S | * | * | cis | -177.8 | 154 | -26.2 | -96.7 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 67 | V | 36.9 | Very low | 34.9 | Very low | 128 Ų | 128 | 136.1 Ų | 136.1 | 78% | 0.776 | 80% | 0.797 | S | S | * | * | trans | -47.9 | 142.9 | 174.2 | 165.3 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 68 | T | 34.4 | Very low | 34.6 | Very low | 143 Ų | 143 | 138 Ų | 138 | 88% | 0.877 | 80% | 0.797 | S | S | * | * | trans | -145.8 | 128.8 | 148.7 | -26.3 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 69 | T | 36.2 | Very low | 33.9 | Very low | 106 Ų | 106 | 143.1 Ų | 143.1 | 65% | 0.65 | 80% | 0.802 | S | S | * | * | trans | -89.5 | 171.3 | 176.3 | -44.1 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 70 | M | 34.5 | Very low | 33.8 | Very low | 176 Ų | 176 | 140.4 Ų | 140.4 | 87% | 0.867 | 80% | 0.795 | S | S | * | * | trans | 104.1 | 128.6 | 176.1 | -56.6 | -68.5 | 91.7 | 0 | 0 | 111.9 | ||||
| 71 | G | 29.3 | Very low | 34 | Very low | 62 Ų | 62 | 141.1 Ų | 141.1 | 64% | 0.639 | 80% | 0.795 | S | S | * | * | cis | 149.1 | 120.1 | 4.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 72 | N | 32 | Very low | 34.9 | Very low | 164 Ų | 164 | 139.1 Ų | 139.1 | 88% | 0.877 | 79% | 0.792 | S | S | * | * | trans | 59 | 147.2 | 160.4 | -57.5 | 7.2 | 0 | 0 | 0 | 117.7 | ||||
| 73 | T | 35.2 | Very low | 34.7 | Very low | 141 Ų | 141 | 137.6 Ų | 137.6 | 87% | 0.865 | 80% | 0.797 | S | S | * | * | cis | -155.2 | 166.8 | 38.6 | 42.3 | 0 | 0 | 0 | 0 | 112 | ||||
| 74 | A | 35.1 | Very low | 34.6 | Very low | 93 Ų | 93 | 136.8 Ų | 136.8 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | trans | -84.6 | 149 | -171.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 75 | T | 39 | Very low | 34.9 | Very low | 146 Ų | 146 | 136.3 Ų | 136.3 | 90% | 0.896 | 80% | 0.801 | S | S | * | * | trans | -161.4 | 128.2 | 130.7 | 50 | 0 | 0 | 0 | 0 | 104.5 | ||||
| 76 | G | 34.9 | Very low | 35.2 | Very low | 72 Ų | 72 | 138 Ų | 138 | 74% | 0.742 | 80% | 0.803 | S | S | * | * | cis | 120.2 | 93.8 | 31.7 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 77 | L | 32.8 | Very low | 35.4 | Very low | 182 Ų | 182 | 137.2 Ų | 137.2 | 95% | 0.953 | 81% | 0.81 | S | S | * | * | trans | -179.9 | 124.4 | 141.7 | -94.3 | 171.5 | 0 | 0 | 0 | 109.9 | ||||
| 78 | H | 34.6 | Very low | 35.4 | Very low | 155 Ų | 155 | 137.5 Ų | 137.5 | 72% | 0.718 | 81% | 0.807 | S | S | * | * | trans | -114.3 | 127.9 | -163.5 | -165.8 | -93.9 | 0 | 0 | 0 | 108.5 | S80 | H78-S80 PolarHBondContact CE1-OG 3.44Å; H78-S80 PolarHBondContact ND1-OG 3.12Å | ||
| 79 | Y | 34.7 | Very low | 35.6 | Very low | 231 Ų | 231 | 138.3 Ų | 138.3 | 91% | 0.906 | 80% | 0.801 | S | S | * | * | trans | -127 | 119.8 | 158.1 | -90.8 | -80.1 | 0 | 0 | 0 | 109 | ||||
| 80 | S | 33.7 | Very low | 36 | Very low | 94 Ų | 94 | 138.5 Ų | 138.5 | 66% | 0.657 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 140.3 | -170.7 | -57.9 | 0 | 0 | 0 | 0 | 112.9 | H78 | H78-S80 PolarHBondContact CE1-OG 3.44Å; H78-S80 PolarHBondContact ND1-OG 3.12Å |
| 81 | V | 40.7 | Very low | 36.3 | Very low | 132 Ų | 132 | 135.7 Ų | 135.7 | 80% | 0.8 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -104 | 132.5 | 166 | 178.3 | 0 | 0 | 0 | 0 | 108.2 | ||
| 82 | P | 46.8 | Very low | 36.6 | Very low | 125 Ų | 125 | 138 Ų | 138 | 81% | 0.812 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 125 | 174 | -7.3 | 24.4 | 0 | 0 | 0 | 111.3 | ||
| 83 | S | 32.5 | Very low | 36.7 | Very low | 112 Ų | 112 | 140.1 Ų | 140.1 | 78% | 0.783 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 125.9 | 173 | -158.7 | 0 | 0 | 0 | 0 | 110.1 | ||
| 84 | C | 31.9 | Very low | 36.8 | Very low | 125 Ų | 125 | 136.9 Ų | 136.9 | 85% | 0.845 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 124.3 | 173.4 | 43.5 | 0 | 0 | 0 | 0 | 110.8 | ||
| 85 | H | 39 | Very low | 36.9 | Very low | 185 Ų | 185 | 139 Ų | 139 | 86% | 0.856 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 130.5 | 171.2 | -105.2 | 62.7 | 0 | 0 | 0 | 110 | ||
| 86 | Y | 35.9 | Very low | 37 | Very low | 230 Ų | 230 | 140.5 Ų | 140.5 | 90% | 0.902 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -88.5 | 129.3 | 168.5 | -138.9 | -94.3 | 0 | 0 | 0 | 108.1 | ||
| 87 | G | 33.6 | Very low | 37 | Very low | 79 Ų | 79 | 142.2 Ų | 142.2 | 81% | 0.814 | 80% | 0.804 | S | S | * | * | trans | -147.6 | 124.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 88 | N | 36.8 | Very low | 37 | Very low | 135 Ų | 135 | 137.5 Ų | 137.5 | 72% | 0.722 | 80% | 0.8 | S | S | * | * | trans | -109.7 | 161.2 | -167.4 | -158.3 | -10.9 | 0 | 0 | 0 | 110.2 | ||||
| 89 | Q | 38.3 | Very low | 36.9 | Very low | 159 Ų | 159 | 134.2 Ų | 134.2 | 74% | 0.743 | 81% | 0.808 | S | S | * | * | trans | 97.2 | 158.2 | 167.3 | -53 | -72.2 | 22.2 | 0 | 0 | 118.3 | ||||
| 90 | P | 43.6 | Very low | 37 | Very low | 110 Ų | 110 | 131 Ų | 131 | 71% | 0.714 | 81% | 0.806 | S | S | * | * | -132 | -177.8 | -75.9 | 34.3 | -13.3 | 0 | 0 | 0 | 113.9 | |||||
| 91 | S | 40.9 | Very low | 37.3 | Very low | 118 Ų | 118 | 133.2 Ų | 133.2 | 83% | 0.825 | 82% | 0.815 | S | S | * | * | trans | -51.3 | 144.7 | -178.9 | -167 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 92 | T | 36.9 | Very low | 37.6 | Very low | 110 Ų | 110 | 132.7 Ų | 132.7 | 68% | 0.675 | 81% | 0.814 | S | S | * | * | trans | -148 | 147.6 | 164.7 | -43.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 93 | Y | 34.5 | Very low | 37 | Very low | 209 Ų | 209 | 133.5 Ų | 133.5 | 82% | 0.82 | 82% | 0.821 | S | S | * | * | trans | -84.4 | 158.6 | -158.1 | 45.8 | -95.7 | 0 | 0 | 0 | 117.2 | ||||
| 94 | G | 35.9 | Very low | 37.1 | Very low | 72 Ų | 72 | 135.6 Ų | 135.6 | 74% | 0.742 | 82% | 0.823 | S | S | * | * | trans | 65.7 | 143.8 | 149.4 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 95 | V | 38.6 | Very low | 37.1 | Very low | 138 Ų | 138 | 139.3 Ų | 139.3 | 84% | 0.836 | 82% | 0.821 | S | S | * | * | cis | -167 | 132.9 | 40.5 | 167.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 96 | M | 41.2 | Very low | 36.8 | Very low | 178 Ų | 178 | 139.7 Ų | 139.7 | 88% | 0.877 | 82% | 0.82 | S | S | * | * | trans | 43.3 | 145.4 | 144.5 | -57.6 | -63.4 | -151.6 | 0 | 0 | 127.5 | ||||
| 97 | A | 34.5 | Very low | 36.9 | Very low | 107 Ų | 107 | 137 Ų | 137 | 88% | 0.884 | 81% | 0.813 | S | S | * | * | trans | 82.8 | 129.3 | 153.9 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 98 | G | 31.5 | Very low | 37.5 | Very low | 84 Ų | 84 | 138.4 Ų | 138.4 | 87% | 0.866 | 81% | 0.808 | S | S | * | * | cis | 152.5 | 135.7 | 8.8 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 99 | G | 32.8 | Very low | 37.4 | Very low | 86 Ų | 86 | 139.7 Ų | 139.7 | 89% | 0.887 | 82% | 0.815 | S | S | * | * | trans | 146.3 | 103.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 100 | L | 38 | Very low | 37.4 | Very low | 164 Ų | 164 | 140.5 Ų | 140.5 | 86% | 0.859 | 82% | 0.818 | S | S | * | * | trans | -82.8 | 139.2 | 174.7 | -64.9 | 160.6 | 0 | 0 | 0 | 110.8 | ||||
| 101 | T | 40.3 | Very low | 37.1 | Very low | 139 Ų | 139 | 141.2 Ų | 141.2 | 85% | 0.853 | 82% | 0.821 | S | S | * | * | 170.9 | 152.6 | 121.5 | 31.2 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 102 | P | 46.8 | Very low | 36.7 | Very low | 121 Ų | 121 | 143.2 Ų | 143.2 | 79% | 0.786 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -99.9 | 146.9 | -172 | 31.7 | -18 | 0 | 0 | 0 | 113.2 | ||
| 103 | C | 34.5 | Very low | 36.4 | Very low | 142 Ų | 142 | 142.4 Ų | 142.4 | 96% | 0.959 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -82.6 | 119.2 | -177.4 | -150.4 | 0 | 0 | 0 | 0 | 111.7 | ||
| 104 | L | 33.7 | Very low | 36.6 | Very low | 156 Ų | 156 | 141.6 Ų | 141.6 | 82% | 0.817 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -90.6 | 130.8 | 178 | -166.8 | 80.8 | 0 | 0 | 0 | 110 | ||
| 105 | Y | 32.8 | Very low | 36.2 | Very low | 203 Ų | 203 | 142 Ų | 142 | 80% | 0.796 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 135.6 | 175.6 | -142.1 | -97.7 | 0 | 0 | 0 | 111.2 | F107 | Y105-F107 HydrophobicContact CD1-CD2 4.35Å; Y105-F107 HydrophobicContact CD1-CE2 4.28Å; Y105-F107 HydrophobicContact CE1-CD2 4.27Å; Y105-F107 AromaticContact CE1-CE2 3.85Å; Y105-F107 HydrophobicContact CE1-CE2 3.85Å; Y105-F107 HydrophobicContact CE1-CZ 4.49Å |
| 106 | K | 32.5 | Very low | 35.8 | Very low | 194 Ų | 194 | 145.3 Ų | 145.3 | 84% | 0.843 | 83% | 0.832 | S | S | * | * | trans | -147.2 | 120.9 | 171.1 | -152.4 | 153.7 | -178.9 | 174 | 0 | 111.6 | ||||
| 107 | F | 37.2 | Very low | 36.1 | Very low | 172 Ų | 172 | 142.1 Ų | 142.1 | 75% | 0.754 | 82% | 0.824 | S | S | * | * | trans | -75.8 | 163.4 | 169.4 | -87.3 | -90.7 | 0 | 0 | 0 | 111.7 | Y105 | Y105-F107 HydrophobicContact CD1-CD2 4.35Å; Y105-F107 HydrophobicContact CD1-CE2 4.28Å; Y105-F107 HydrophobicContact CE1-CD2 4.27Å; Y105-F107 AromaticContact CE1-CE2 3.85Å; Y105-F107 HydrophobicContact CE1-CE2 3.85Å; Y105-F107 HydrophobicContact CE1-CZ 4.49Å | ||
| 108 | P | 46.3 | Very low | 37 | Very low | 110 Ų | 110 | 142.2 Ų | 142.2 | 71% | 0.714 | 82% | 0.816 | S | S | * | * | trans | -131.6 | 137.8 | 143.5 | 30.1 | -13.5 | 0 | 0 | 0 | 114.3 | ||||
| 109 | D | 35.2 | Very low | 37 | Very low | 161 Ų | 161 | 145.1 Ų | 145.1 | 86% | 0.861 | 81% | 0.811 | S | S | * | * | trans | -82.8 | 150.9 | 162.4 | -85 | -49.8 | 0 | 0 | 0 | 111.2 | ||||
| 110 | H | 38.4 | Very low | 37.2 | Very low | 176 Ų | 176 | 149 Ų | 149 | 82% | 0.815 | 81% | 0.805 | S | S | * | * | trans | -166.9 | 148.3 | 140.8 | 42 | -75 | 0 | 0 | 0 | 112.8 | ||||
| 111 | T | 35.8 | Very low | 37.4 | Very low | 126 Ų | 126 | 148.3 Ų | 148.3 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | trans | -94.8 | 163.7 | -171.6 | 46.3 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 112 | L | 33.8 | Very low | 37.5 | Very low | 160 Ų | 160 | 147.7 Ų | 147.7 | 84% | 0.838 | 80% | 0.796 | S | S | * | * | trans | 90.5 | 108.9 | 149.9 | -81.9 | 161.8 | 0 | 0 | 0 | 122.1 | ||||
| 113 | S | 31.1 | Very low | 37.3 | Very low | 92 Ų | 92 | 148.2 Ų | 148.2 | 64% | 0.643 | 79% | 0.791 | S | S | * | * | 53.3 | 129.4 | 123.1 | -150.2 | 0 | 0 | 0 | 0 | 122.5 | |||||
| 114 | H | 37.2 | Very low | 37.3 | Very low | 193 Ų | 193 | 149.5 Ų | 149.5 | 89% | 0.894 | 79% | 0.788 | S | S | * | * | 166 | 132.8 | 126.3 | -89.1 | -70 | 0 | 0 | 0 | 113.2 | |||||
| 115 | G | 28.6 | Very low | 37.4 | Very low | 81 Ų | 81 | 146.8 Ų | 146.8 | 84% | 0.835 | 79% | 0.788 | S | S | * | * | trans | 115.6 | 110.7 | 145.4 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 116 | F | 30.1 | Very low | 37.6 | Very low | 207 Ų | 207 | 145.2 Ų | 145.2 | 91% | 0.908 | 79% | 0.787 | S | S | * | * | trans | -81.7 | -173.5 | 171.1 | -83.2 | -89.2 | 0 | 0 | 0 | 113.8 | ||||
| 117 | P | 47.2 | Very low | 37.6 | Very low | 111 Ų | 111 | 142.2 Ų | 142.2 | 72% | 0.721 | 78% | 0.781 | S | S | * | * | cis | -131.4 | -138.4 | -35.4 | 30.8 | -5.5 | 0 | 0 | 0 | 111.9 | ||||
| 118 | P | 53.9 | Low | 38 | Very low | 109 Ų | 109 | 138 Ų | 138 | 71% | 0.708 | 77% | 0.771 | S | S | * | * | -119.3 | 178.3 | -86.7 | 35.2 | -15.7 | 0 | 0 | 0 | 115.2 | |||||
| 119 | L | 31.4 | Very low | 37.9 | Very low | 145 Ų | 145 | 138.3 Ų | 138.3 | 76% | 0.759 | 77% | 0.771 | S | S | * | * | trans | 124.2 | 135.6 | 140.4 | -82.2 | 178.2 | 0 | 0 | 0 | 121.2 | ||||
| 120 | H | 35.7 | Very low | 38.4 | Very low | 167 Ų | 167 | 134.4 Ų | 134.4 | 77% | 0.773 | 76% | 0.761 | S | S | * | * | trans | 82.7 | 113.7 | 152 | -75.1 | -74.6 | 0 | 0 | 0 | 122.5 | ||||
| 121 | Q | 42.4 | Very low | 38.4 | Very low | 150 Ų | 150 | 129.8 Ų | 129.8 | 70% | 0.701 | 75% | 0.748 | S | S | * | * | trans | -60.8 | 161 | 158.5 | -148.2 | 177.4 | 4.5 | 0 | 0 | 111.5 | ||||
| 122 | P | 43.6 | Very low | 38.8 | Very low | 125 Ų | 125 | 130.9 Ų | 130.9 | 81% | 0.812 | 75% | 0.745 | S | S | * | * | -142.4 | 153.2 | 94.4 | 29.6 | -10.6 | 0 | 0 | 0 | 115.4 | |||||
| 123 | L | 41.8 | Very low | 39.2 | Very low | 133 Ų | 133 | 131.8 Ų | 131.8 | 70% | 0.696 | 74% | 0.742 | S | S | * | * | trans | -51.9 | 146.7 | 167.2 | -65.9 | 161.9 | 0 | 0 | 0 | 112 | ||||
| 124 | L | 34.9 | Very low | 40 | Very low | 169 Ų | 169 | 135.4 Ų | 135.4 | 89% | 0.885 | 75% | 0.746 | S | S | * | * | -171.1 | 130.3 | 121.6 | -85 | -161.9 | 0 | 0 | 0 | 112.1 | |||||
| 125 | A | 35.1 | Very low | 40.4 | Very low | 98 Ų | 98 | 131.2 Ų | 131.2 | 81% | 0.81 | 73% | 0.727 | S | S | * | * | trans | 66.5 | 111.4 | 141.4 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 126 | E | 37.5 | Very low | 41 | Very low | 170 Ų | 170 | 134.3 Ų | 134.3 | 79% | 0.794 | 72% | 0.72 | S | S | * | * | trans | -28.5 | 139.5 | 155.2 | -63.6 | -87 | 111 | 0 | 0 | 118.6 | ||||
| 127 | D | 33.4 | Very low | 41.9 | Very low | 131 Ų | 131 | 131 Ų | 131 | 70% | 0.701 | 71% | 0.711 | S | S | * | * | trans | -144.3 | 109.6 | 138.8 | -172.8 | -7.2 | 0 | 0 | 0 | 109 | T129 | D127-T129 PolarHBondContact OD1-OG1 3.38Å; D127-T129 VanDerWaalsContact OD1-OG1 3.11Å | ||
| 128 | P | 44.8 | Very low | 41.5 | Very low | 85 Ų | 85 | 135.8 Ų | 135.8 | 55% | 0.552 | 72% | 0.715 | S | S | * | * | trans | -102.6 | 73 | -177.2 | 37.4 | -28.3 | 0 | 0 | 0 | 111 | ||||
| 129 | T | 44 | Very low | 40.8 | Very low | 115 Ų | 115 | 139.6 Ų | 139.6 | 71% | 0.706 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -132.7 | -6.1 | 173.4 | 50.1 | 0 | 0 | 0 | 0 | 115.4 | D127 | D127-T129 PolarHBondContact OD1-OG1 3.38Å; D127-T129 VanDerWaalsContact OD1-OG1 3.11Å |
| 130 | A | 45.2 | Very low | 41.2 | Very low | 80 Ų | 80 | 141.4 Ų | 141.4 | 66% | 0.661 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -109.2 | -7.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 131 | S | 39.5 | Very low | 41.5 | Very low | 78 Ų | 78 | 138.3 Ų | 138.3 | 55% | 0.545 | 71% | 0.714 | S | S | . | * | S | Bend | trans | -93 | -29.7 | -172.9 | -162.3 | 0 | 0 | 0 | 0 | 113.7 | F133 K134 Q135 | S131-F133 PolarHBondContact O-N 3.21Å; S131-K134 PolarHBondContact O-N 3.45Å; S131-Q135 PolarHBondContact O-N 3.32Å; S131-Q135 VanDerWaalsContact O-N 3.12Å |
| 132 | E | 43.1 | Very low | 41.7 | Very low | 149 Ų | 149 | 140.8 Ų | 140.8 | 70% | 0.696 | 72% | 0.722 | S | S | * | * | H | α-helix | trans | -65.2 | -40.3 | -177.5 | -79.1 | -173.1 | 137.2 | 0 | 0 | 112.5 | K134 Q135 E136 | E132-K134 VanDerWaalsContact C-N 3.25Å; E132-K134 PolarHBondContact O-N 2.95Å; E132-Q135 PolarHBondContact O-N 3.32Å; E132-Q135 VanDerWaalsContact O-N 3.09Å; E132-E136 PolarHBondContact O-N 2.87Å |
| 133 | F | 43.2 | Very low | 41.6 | Very low | 179 Ų | 179 | 142.3 Ų | 142.3 | 79% | 0.785 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -65.6 | -28.7 | -178.6 | -153.3 | -93.5 | 0 | 0 | 0 | 113.2 | S131 | S131-F133 PolarHBondContact O-N 3.21Å |
| 134 | K | 48 | Very low | 41.8 | Very low | 169 Ų | 169 | 141.9 Ų | 141.9 | 74% | 0.735 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -83.8 | -26.9 | 175.3 | -72.9 | -178.1 | 178.9 | 174.9 | 0 | 112.6 | S131 E132 | S131-K134 PolarHBondContact O-N 3.45Å; E132-K134 VanDerWaalsContact C-N 3.25Å; E132-K134 PolarHBondContact O-N 2.95Å |
| 135 | Q | 44.6 | Very low | 42.5 | Very low | 105 Ų | 105 | 143.3 Ų | 143.3 | 49% | 0.491 | 73% | 0.728 | S | S | . | * | H | α-helix | trans | -75.8 | -35 | 175.9 | -110.7 | -172.9 | 29 | 0 | 0 | 112.3 | S131 E132 L137 R138 R139 | S131-Q135 PolarHBondContact O-N 3.32Å; S131-Q135 VanDerWaalsContact O-N 3.12Å; E132-Q135 PolarHBondContact O-N 3.32Å; E132-Q135 VanDerWaalsContact O-N 3.09Å; Q135-L137 VanDerWaalsContact C-N 3.33Å; Q135-L137 PolarHBondContact O-N 3.4Å; Q135-R138 PolarHBondContact O-N 3.02Å; Q135-R139 PolarHBondContact O-N 3.49Å; Q135-R139 VanDerWaalsContact OE1-NH1 3.14Å |
| 136 | E | 42.4 | Very low | 43.3 | Very low | 146 Ų | 146 | 146 Ų | 146 | 68% | 0.682 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -61.4 | -40.9 | 177.3 | -153.4 | 66.3 | -148.6 | 0 | 0 | 111.5 | E132 R138 | E132-E136 PolarHBondContact O-N 2.87Å; E136-R138 VanDerWaalsContact C-N 3.33Å; E136-R138 PolarHBondContact O-N 3.44Å |
| 137 | L | 47.9 | Very low | 44.1 | Very low | 137 Ų | 137 | 143.4 Ų | 143.4 | 72% | 0.717 | 72% | 0.721 | S | S | * | * | H | α-helix | trans | -71.9 | -24.8 | 178.4 | -143.2 | 99.6 | 0 | 0 | 0 | 113.4 | Q135 | Q135-L137 VanDerWaalsContact C-N 3.33Å; Q135-L137 PolarHBondContact O-N 3.4Å |
| 138 | R | 39.4 | Very low | 45.1 | Very low | 211 Ų | 211 | 142.5 Ų | 142.5 | 80% | 0.796 | 72% | 0.715 | S | S | * | * | H | α-helix | trans | -90.8 | -30.7 | -177.7 | -119.1 | -173.9 | -178.8 | 164.3 | 1.2 | 113.2 | Q135 E136 K140 S141 | Q135-R138 PolarHBondContact O-N 3.02Å; E136-R138 VanDerWaalsContact C-N 3.33Å; E136-R138 PolarHBondContact O-N 3.44Å; R138-K140 PolarHBondContact O-N 3.5Å; R138-S141 PolarHBondContact O-N 3.33Å |
| 139 | R | 39.3 | Very low | 45.9 | Very low | 190 Ų | 190 | 143.5 Ų | 143.5 | 72% | 0.717 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -68.1 | -20.2 | 177.9 | -94.5 | -170.3 | 162.6 | 89.8 | -0 | 113.8 | Q135 | Q135-R139 PolarHBondContact O-N 3.49Å; Q135-R139 VanDerWaalsContact OE1-NH1 3.14Å |
| 140 | K | 39.1 | Very low | 46.5 | Very low | 182 Ų | 182 | 144.5 Ų | 144.5 | 79% | 0.791 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.1 | -8 | 176.3 | -146.3 | 75.4 | 109.2 | -175.1 | 0 | 114.7 | R138 K142 | R138-K140 PolarHBondContact O-N 3.5Å; K140-K142 VanDerWaalsContact C-N 3.34Å; K140-K142 PolarHBondContact O-N 3.39Å |
| 141 | S | 43.3 | Very low | 47.1 | Very low | 103 Ų | 103 | 146.8 Ų | 146.8 | 72% | 0.72 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -89.5 | 14.4 | -174.3 | -71.4 | 0 | 0 | 0 | 0 | 115.2 | R138 | R138-S141 PolarHBondContact O-N 3.33Š|
| 142 | K | 46.4 | Very low | 48.8 | Very low | 202 Ų | 202 | 144.9 Ų | 144.9 | 88% | 0.878 | 70% | 0.702 | S | S | * | * | trans | -137.2 | 65.7 | 173.7 | -138.5 | -177.1 | -169.3 | -167.4 | 0 | 110.5 | K140 | K140-K142 VanDerWaalsContact C-N 3.34Å; K140-K142 PolarHBondContact O-N 3.39Å | ||
| 143 | L | 39.8 | Very low | 50.7 | Low | 157 Ų | 157 | 142.5 Ų | 142.5 | 82% | 0.822 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -124.7 | 134.8 | 160.8 | -156.1 | 100 | 0 | 0 | 0 | 107.9 | ||
| 144 | V | 47.6 | Very low | 52.6 | Low | 123 Ų | 123 | 138.8 Ų | 138.8 | 75% | 0.745 | 69% | 0.685 | S | S | * | * | trans | -41.8 | 137.4 | 175.5 | 170.5 | 0 | 0 | 0 | 0 | 110.7 | E146 | V144-E146 PolarHBondContact O-N 3.39Š| ||
| 145 | E | 49.8 | Very low | 54.5 | Low | 200 Ų | 200 | 132 Ų | 132 | 94% | 0.935 | 66% | 0.656 | S | S | * | * | trans | -68 | 76.2 | 176.3 | -164 | 169.4 | -157.3 | 0 | 0 | 109 | ||||
| 146 | E | 51.1 | Low | 56.6 | Low | 154 Ų | 154 | 133.6 Ų | 133.6 | 72% | 0.72 | 66% | 0.658 | S | S | * | * | trans | -76.5 | 149 | 163.7 | -100 | -151.7 | 147.6 | 0 | 0 | 109.9 | V144 I148 | V144-E146 PolarHBondContact O-N 3.39Å; E146-I148 PolarHBondContact O-N 3.39Å | ||
| 147 | P | 53.6 | Low | 59 | Low | 116 Ų | 116 | 131.6 Ų | 131.6 | 75% | 0.753 | 65% | 0.648 | S | S | * | * | trans | -51.6 | 127.3 | 173.6 | -20.8 | 31.5 | 0 | 0 | 0 | 109.6 | D149 | P147-D149 PolarHBondContact O-N 2.85Š| ||
| 148 | I | 54.8 | Low | 61.2 | Low | 112 Ų | 112 | 125.5 Ų | 125.5 | 57% | 0.574 | 62% | 0.616 | S | S | * | * | trans | -58.8 | 104.1 | 177.9 | -57.2 | 169.6 | 0 | 0 | 0 | 107.5 | E146 M150 I155 | E146-I148 PolarHBondContact O-N 3.39Å; I148-M150 HydrophobicContact CB-CE 4.44Å; I148-M150 HydrophobicContact CG2-CE 4.12Å; I148-M150 WeakPolarHBondContact O-CE 3.4Å; I148-M150 PolarHBondContact O-N 3.37Å; I148-I155 HydrophobicContact CG2-CD1 4.25Å | ||
| 149 | D | 62.2 | Low | 63.7 | Low | 106 Ų | 106 | 119.6 Ų | 119.6 | 57% | 0.567 | 60% | 0.598 | S | S | * | * | trans | -59.4 | 121.6 | 174.8 | -175.9 | 18.3 | 0 | 0 | 0 | 108.8 | P147 D151 S152 I155 | P147-D149 PolarHBondContact O-N 2.85Å; D149-D151 PolarHBondContact O-N 3.35Å; D149-D151 VanDerWaalsContact O-N 3.12Å; D149-S152 WeakPolarHBondContact O-CB 3.3Å; D149-S152 PolarHBondContact O-N 3.19Å; D149-I155 WeakPolarHBondContact O-CD1 3.33Å | ||
| 150 | M | 57.3 | Low | 66.4 | Low | 136 Ų | 136 | 115.9 Ų | 115.9 | 67% | 0.67 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.1 | -13.2 | -175.9 | -71 | -72.2 | 95.9 | 0 | 0 | 112.7 | I148 I155 | I148-M150 HydrophobicContact CB-CE 4.44Å; I148-M150 HydrophobicContact CG2-CE 4.12Å; I148-M150 WeakPolarHBondContact O-CE 3.4Å; I148-M150 PolarHBondContact O-N 3.37Å; M150-I155 HydrophobicContact CE-CD1 4.28Å |
| 151 | D | 57.1 | Low | 69.1 | Low | 127 Ų | 127 | 108.1 Ų | 108.1 | 68% | 0.679 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.7 | 16.1 | 175.2 | -77.8 | -40 | 0 | 0 | 0 | 114.1 | D149 | D149-D151 PolarHBondContact O-N 3.35Å; D149-D151 VanDerWaalsContact O-N 3.12Å |
| 152 | S | 75.6 | Confident | 71.7 | Confident | 38 Ų | 38 | 103.3 Ų | 103.3 | 27% | 0.266 | 52% | 0.521 | S | S | . | . | trans | -58.2 | 136 | 176.8 | -174.1 | 0 | 0 | 0 | 0 | 111.5 | D149 E154 I155 R156 | D149-S152 WeakPolarHBondContact O-CB 3.3Å; D149-S152 PolarHBondContact O-N 3.19Å; S152-E154 PolarHBondContact O-N 2.87Å; S152-I155 WeakPolarHBondContact O-CB 3.42Å; S152-I155 PolarHBondContact O-N 3.01Å; S152-R156 PolarHBondContact O-N 3.34Å | ||
| 153 | P | 82.3 | Confident | 74 | Confident | 100 Ų | 100 | 98 Ų | 98 | 65% | 0.649 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -55.7 | -28.3 | -176.3 | 17.4 | -30.2 | 0 | 0 | 0 | 113.8 | R156 E157 | P153-R156 PolarHBondContact O-N 3.5Å; P153-E157 PolarHBondContact O-N 3.46Å |
| 154 | E | 83.6 | Confident | 76.7 | Confident | 101 Ų | 101 | 94.5 Ų | 94.5 | 47% | 0.472 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -69.7 | -32.6 | 177.8 | -161 | 179.1 | 167.3 | 0 | 0 | 112.6 | S152 L158 F206 | S152-E154 PolarHBondContact O-N 2.87Å; E154-L158 WeakPolarHBondContact O-CB 3.44Å; E154-L158 PolarHBondContact O-N 3.15Å; E154-F206 HydrophobicContact CB-CZ 4.05Å; E154-F206 HydrophobicContact CG-CZ 3.78Å |
| 155 | I | 86.5 | Confident | 79.1 | Confident | 26 Ų | 26 | 88.6 Ų | 88.6 | 13% | 0.133 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -66.2 | -49.7 | 173.7 | -62.5 | 171.6 | 0 | 0 | 0 | 108.9 | I148 D149 M150 S152 E157 L158 E159 F206 | I148-I155 HydrophobicContact CG2-CD1 4.25Å; D149-I155 WeakPolarHBondContact O-CD1 3.33Å; M150-I155 HydrophobicContact CE-CD1 4.28Å; S152-I155 WeakPolarHBondContact O-CB 3.42Å; S152-I155 PolarHBondContact O-N 3.01Å; I155-E157 VanDerWaalsContact C-N 3.28Å; I155-E157 PolarHBondContact O-N 2.91Å; I155-L158 WeakPolarHBondContact O-CA 3.31Å; I155-L158 WeakPolarHBondContact O-CB 3.44Å; I155-L158 PolarHBondContact O-N 2.9Å; I155-E159 HydrophobicContact CG2-CG 4.46Å; I155-E159 WeakPolarHBondContact O-CG 3.44Å; I155-E159 PolarHBondContact O-N 3.35Å; I155-F206 HydrophobicContact CB-CE2 4.42Å; I155-F206 HydrophobicContact CG1-CD2 4.03Å; I155-F206 HydrophobicContact CG1-CE2 3.6Å; I155-F206 HydrophobicContact CG1-CZ 4.27Å |
| 156 | R | 89.1 | Confident | 81.3 | Confident | 139 Ų | 139 | 82.5 Ų | 82.5 | 53% | 0.525 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -58.3 | -40.4 | 178.4 | -67.2 | 178.8 | 60.8 | -144.4 | -3.1 | 112.5 | S152 P153 L158 E159 Q160 | S152-R156 PolarHBondContact O-N 3.34Å; P153-R156 PolarHBondContact O-N 3.5Å; R156-L158 VanDerWaalsContact C-N 3.34Å; R156-E159 PolarHBondContact O-N 3.01Å; R156-Q160 VanDerWaalsContact O-CG 3.27Å; R156-Q160 WeakPolarHBondContact O-CG 3.19Å; R156-Q160 PolarHBondContact O-N 2.86Å |
| 157 | E | 93.1 | Very high | 83.4 | Confident | 104 Ų | 104 | 79.9 Ų | 79.9 | 49% | 0.486 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -65.9 | -37.3 | 176.5 | -161.1 | -158.4 | 145.2 | 0 | 0 | 112 | P153 I155 F161 K213 | P153-E157 PolarHBondContact O-N 3.46Å; I155-E157 VanDerWaalsContact C-N 3.28Å; I155-E157 PolarHBondContact O-N 2.91Å; E157-F161 WeakPolarHBondContact O-CB 3.47Å; E157-F161 PolarHBondContact O-N 2.57Å; E157-K213 IonicContact OE1-NZ 3.51Å; E157-K213 PolarHBondContact OE1-NZ 3.38Å; E157-K213 IonicContact OE2-NZ 2.66Å |
| 158 | L | 94 | Very high | 85.3 | Confident | 8 Ų | 8 | 78.2 Ų | 78.2 | 4% | 0.042 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -66.9 | -40.1 | 175 | 179.3 | 66.6 | 0 | 0 | 0 | 111.7 | E154 I155 R156 F161 A162 F199 L202 F206 A209 K213 | E154-L158 WeakPolarHBondContact O-CB 3.44Å; E154-L158 PolarHBondContact O-N 3.15Å; I155-L158 WeakPolarHBondContact O-CA 3.31Å; I155-L158 WeakPolarHBondContact O-CB 3.44Å; I155-L158 PolarHBondContact O-N 2.9Å; R156-L158 VanDerWaalsContact C-N 3.34Å; L158-F161 PolarHBondContact O-N 3.44Å; L158-A162 WeakPolarHBondContact O-CB 3.39Å; L158-A162 PolarHBondContact O-N 2.99Å; L158-F199 HydrophobicContact CD1-CE2 4.14Å; L158-F199 HydrophobicContact CD1-CZ 4.32Å; L158-L202 HydrophobicContact CG-CD2 4.4Å; L158-F206 HydrophobicContact CD2-CD2 4.04Å; L158-F206 HydrophobicContact CD2-CE2 4.11Å; L158-A209 HydrophobicContact CD1-CB 4.19Å; L158-A209 HydrophobicContact CD2-CB 3.54Å; L158-A209 HydrophobicContact CG-CB 4.41Å; L158-K213 HydrophobicContact CD1-CB 3.91Å; L158-K213 HydrophobicContact CD1-CD 3.79Å; L158-K213 HydrophobicContact CD1-CG 4.33Å |
| 159 | E | 93.3 | Very high | 87.2 | Confident | 87 Ų | 87 | 73.5 Ų | 73.5 | 41% | 0.407 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -63.6 | -44.9 | 175.2 | -63 | -172.9 | 147.2 | 0 | 0 | 112.1 | I155 R156 A162 N163 L202 | I155-E159 HydrophobicContact CG2-CG 4.46Å; I155-E159 WeakPolarHBondContact O-CG 3.44Å; I155-E159 PolarHBondContact O-N 3.35Å; R156-E159 PolarHBondContact O-N 3.01Å; E159-A162 PolarHBondContact O-N 3.26Å; E159-N163 PolarHBondContact O-N 3.11Å; E159-N163 VanDerWaalsContact O-N 3.1Å; E159-N163 PolarHBondContact O-ND2 3.35Å; E159-L202 HydrophobicContact CB-CD1 4.19Å; E159-L202 HydrophobicContact CG-CD1 3.66Å; E159-L202 HydrophobicContact CG-CD2 4.39Å |
| 160 | Q | 94.4 | Very high | 88.5 | Confident | 113 Ų | 113 | 73 Ų | 73 | 53% | 0.528 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -58.4 | -50.3 | 175 | -73.6 | 170.8 | 14.5 | 0 | 0 | 110.5 | R156 A162 N163 E164 | R156-Q160 VanDerWaalsContact O-CG 3.27Å; R156-Q160 WeakPolarHBondContact O-CG 3.19Å; R156-Q160 PolarHBondContact O-N 2.86Å; Q160-A162 PolarHBondContact O-N 2.89Å; Q160-N163 PolarHBondContact O-N 3.49Å; Q160-E164 WeakPolarHBondContact O-CB 3.44Å; Q160-E164 PolarHBondContact O-N 2.88Å |
| 161 | F | 97.5 | Very high | 90.1 | Very high | 19 Ų | 19 | 75.2 Ų | 75.2 | 8% | 0.083 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -60.1 | -44.7 | 178.2 | 177.9 | -88.7 | 0 | 0 | 0 | 112.2 | E157 L158 N163 E164 F165 F199 K213 L216 | E157-F161 WeakPolarHBondContact O-CB 3.47Å; E157-F161 PolarHBondContact O-N 2.57Å; L158-F161 PolarHBondContact O-N 3.44Å; F161-N163 VanDerWaalsContact C-N 3.29Å; F161-N163 PolarHBondContact O-N 3.44Å; F161-E164 PolarHBondContact O-N 2.68Å; F161-F165 HydrophobicContact CD1-CB 4.4Å; F161-F165 HydrophobicContact CE1-CB 4.05Å; F161-F165 HydrophobicContact CE1-CD2 4.37Å; F161-F165 HydrophobicContact CE1-CG 4.36Å; F161-F165 HydrophobicContact CZ-CB 4.3Å; F161-F165 HydrophobicContact CZ-CD2 4.21Å; F161-F165 WeakPolarHBondContact O-CB 3.49Å; F161-F165 PolarHBondContact O-N 3.03Å; F161-F199 AromaticContact CD1-CE1 3.86Å; F161-F199 HydrophobicContact CD1-CE1 3.86Å; F161-F199 AromaticContact CD1-CZ 3.55Å; F161-F199 HydrophobicContact CD1-CZ 3.55Å; F161-F199 AromaticContact CE1-CE1 3.67Å; F161-F199 HydrophobicContact CE1-CE1 3.67Å; F161-F199 AromaticContact CE1-CZ 3.49Å; F161-F199 HydrophobicContact CE1-CZ 3.49Å; F161-F199 VanDerWaalsContact CE1-CZ 3.49Å; F161-K213 HydrophobicContact CB-CD 4.22Å; F161-K213 HydrophobicContact CD1-CB 4.26Å; F161-K213 HydrophobicContact CD1-CD 4.26Å; F161-K213 HydrophobicContact CD1-CG 3.69Å; F161-K213 HydrophobicContact CD2-CG 4.26Å; F161-K213 HydrophobicContact CE1-CB 4.28Å; F161-K213 HydrophobicContact CE1-CG 3.92Å; F161-K213 HydrophobicContact CE2-CG 4.46Å; F161-K213 HydrophobicContact CG-CD 4.12Å; F161-K213 HydrophobicContact CG-CG 3.87Å; F161-K213 HydrophobicContact CZ-CG 4.3Å; F161-L216 HydrophobicContact CE1-CB 4.17Å; F161-L216 HydrophobicContact CZ-CB 4.15Å |
| 162 | A | 97 | Very high | 91.6 | Very high | 1 Ų | 1 | 71.8 Ų | 71.8 | 1% | 0.008 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -61.3 | -39.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112 | L158 E159 Q160 K166 F199 L202 | L158-A162 WeakPolarHBondContact O-CB 3.39Å; L158-A162 PolarHBondContact O-N 2.99Å; E159-A162 PolarHBondContact O-N 3.26Å; Q160-A162 PolarHBondContact O-N 2.89Å; A162-K166 WeakPolarHBondContact O-CB 3.45Å; A162-K166 PolarHBondContact O-N 3.25Å; A162-K166 VanDerWaalsContact O-N 3.14Å; A162-F199 HydrophobicContact CB-CE1 4.23Å; A162-L202 HydrophobicContact CB-CD2 3.77Å; A162-L202 HydrophobicContact CB-CG 4.44Å |
| 163 | N | 95.5 | Very high | 92.2 | Very high | 92 Ų | 92 | 72.6 Ų | 72.6 | 49% | 0.492 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -68.4 | -47 | 176.1 | -75.3 | -53.1 | 0 | 0 | 0 | 112 | E159 Q160 F161 K166 V167 | E159-N163 PolarHBondContact O-N 3.11Å; E159-N163 VanDerWaalsContact O-N 3.1Å; E159-N163 PolarHBondContact O-ND2 3.35Å; Q160-N163 PolarHBondContact O-N 3.49Å; F161-N163 VanDerWaalsContact C-N 3.29Å; F161-N163 PolarHBondContact O-N 3.44Å; N163-K166 WeakPolarHBondContact O-CB 3.4Å; N163-K166 PolarHBondContact O-N 3.44Å; N163-V167 WeakPolarHBondContact O-CG2 3.33Å; N163-V167 PolarHBondContact O-N 3.29Å |
| 164 | E | 96.5 | Very high | 92.7 | Very high | 82 Ų | 82 | 71.6 Ų | 71.6 | 38% | 0.383 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -61.5 | -47.5 | 178.3 | -177 | -179.3 | 143.7 | 0 | 0 | 111.8 | Q160 F161 K166 V167 R168 | Q160-E164 WeakPolarHBondContact O-CB 3.44Å; Q160-E164 PolarHBondContact O-N 2.88Å; F161-E164 PolarHBondContact O-N 2.68Å; E164-K166 VanDerWaalsContact C-N 3.29Å; E164-K166 PolarHBondContact O-N 2.87Å; E164-V167 PolarHBondContact O-N 3.45Å; E164-R168 WeakPolarHBondContact O-CB 3.49Å; E164-R168 WeakPolarHBondContact O-CG 3.18Å; E164-R168 PolarHBondContact O-N 2.63Å; E164-R168 IonicContact OE1-CZ 2.91Å; E164-R168 IonicContact OE1-NE 3.44Å; E164-R168 PolarHBondContact OE1-NE 3.42Å; E164-R168 IonicContact OE1-NH1 3.44Å; E164-R168 PolarHBondContact OE1-NH1 3.18Å; E164-R168 IonicContact OE1-NH2 2.57Å; E164-R168 PolarHBondContact OE1-NH2 3.02Å |
| 165 | F | 97.6 | Very high | 93.2 | Very high | 0 Ų | 0 | 68.1 Ų | 68.1 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -53.8 | -47.1 | 174.6 | 175.5 | -92.9 | 0 | 0 | 0 | 111 | F161 R168 R169 V179 I196 F199 E200 L216 W219 L220 | F161-F165 HydrophobicContact CD1-CB 4.4Å; F161-F165 HydrophobicContact CE1-CB 4.05Å; F161-F165 HydrophobicContact CE1-CD2 4.37Å; F161-F165 HydrophobicContact CE1-CG 4.36Å; F161-F165 HydrophobicContact CZ-CB 4.3Å; F161-F165 HydrophobicContact CZ-CD2 4.21Å; F161-F165 WeakPolarHBondContact O-CB 3.49Å; F161-F165 PolarHBondContact O-N 3.03Å; F165-R168 PolarHBondContact O-N 3.39Å; F165-R169 WeakPolarHBondContact O-CB 3.34Å; F165-R169 PolarHBondContact O-N 3.45Å; F165-V179 HydrophobicContact CZ-CG1 3.98Å; F165-I196 HydrophobicContact CE1-CG2 4.19Å; F165-F199 HydrophobicContact CD1-CE1 4.47Å; F165-E200 HydrophobicContact CD1-CG 4.26Å; F165-E200 HydrophobicContact CE1-CG 4.48Å; F165-L216 HydrophobicContact CD2-CB 4.03Å; F165-L216 HydrophobicContact CE1-CD1 4.46Å; F165-L216 HydrophobicContact CE2-CB 3.77Å; F165-L216 HydrophobicContact CE2-CD2 4Å; F165-L216 HydrophobicContact CE2-CG 4.31Å; F165-L216 HydrophobicContact CZ-CB 4.32Å; F165-L216 HydrophobicContact CZ-CD1 4.37Å; F165-L216 HydrophobicContact CZ-CD2 3.77Å; F165-L216 HydrophobicContact CZ-CG 4.38Å; F165-W219 AromaticContact CE2-CE3 3.97Å; F165-W219 HydrophobicContact CE2-CE3 3.97Å; F165-W219 HydrophobicContact CE2-CZ3 4.03Å; F165-W219 HydrophobicContact CZ-CE3 4.38Å; F165-W219 HydrophobicContact CZ-CZ3 4.22Å; F165-L220 HydrophobicContact CD2-CB 4.35Å; F165-L220 HydrophobicContact CD2-CD1 4.19Å; F165-L220 HydrophobicContact CD2-CD2 3.99Å; F165-L220 HydrophobicContact CD2-CG 4.43Å; F165-L220 HydrophobicContact CE2-CB 4.41Å; F165-L220 HydrophobicContact CE2-CD1 4.23Å |
| 166 | K | 95.9 | Very high | 93.5 | Very high | 72 Ų | 72 | 67.8 Ų | 67.8 | 31% | 0.313 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -62 | -45.9 | 178.8 | -178.3 | 179.5 | -177.5 | 179.9 | 0 | 111.9 | A162 N163 E164 I170 E200 | A162-K166 WeakPolarHBondContact O-CB 3.45Å; A162-K166 PolarHBondContact O-N 3.25Å; A162-K166 VanDerWaalsContact O-N 3.14Å; N163-K166 WeakPolarHBondContact O-CB 3.4Å; N163-K166 PolarHBondContact O-N 3.44Å; E164-K166 VanDerWaalsContact C-N 3.29Å; E164-K166 PolarHBondContact O-N 2.87Å; K166-I170 HydrophobicContact CG-CD1 4.04Å; K166-I170 WeakPolarHBondContact O-CD1 3.18Å; K166-I170 WeakPolarHBondContact O-CG1 3.21Å; K166-I170 PolarHBondContact O-N 3.14Å; K166-I170 VanDerWaalsContact O-N 3.11Å; K166-E200 HydrophobicContact CB-CG 4.15Å; K166-E200 HydrophobicContact CD-CB 4.45Å; K166-E200 HydrophobicContact CG-CG 4.4Å |
| 167 | V | 93.8 | Very high | 93.6 | Very high | 98 Ų | 98 | 63.7 Ų | 63.7 | 59% | 0.594 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -62.7 | -49.8 | 179.1 | 170.8 | 0 | 0 | 0 | 0 | 110.6 | N163 E164 I170 K171 | N163-V167 WeakPolarHBondContact O-CG2 3.33Å; N163-V167 PolarHBondContact O-N 3.29Å; E164-V167 PolarHBondContact O-N 3.45Å; V167-I170 PolarHBondContact O-N 3.34Å; V167-K171 WeakPolarHBondContact O-CB 3.47Å; V167-K171 PolarHBondContact O-N 3.26Å |
| 168 | R | 94.3 | Very high | 93.6 | Very high | 82 Ų | 82 | 61.8 Ų | 61.8 | 31% | 0.309 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -65.1 | -42.5 | -179.4 | -72 | 176 | 176.2 | -171.1 | 17.6 | 112.5 | E164 F165 I170 K171 L172 L220 E224 | E164-R168 WeakPolarHBondContact O-CB 3.49Å; E164-R168 WeakPolarHBondContact O-CG 3.18Å; E164-R168 PolarHBondContact O-N 2.63Å; E164-R168 IonicContact OE1-CZ 2.91Å; E164-R168 IonicContact OE1-NE 3.44Å; E164-R168 PolarHBondContact OE1-NE 3.42Å; E164-R168 IonicContact OE1-NH1 3.44Å; E164-R168 PolarHBondContact OE1-NH1 3.18Å; E164-R168 IonicContact OE1-NH2 2.57Å; E164-R168 PolarHBondContact OE1-NH2 3.02Å; F165-R168 PolarHBondContact O-N 3.39Å; R168-I170 VanDerWaalsContact C-N 3.3Å; R168-I170 PolarHBondContact O-N 3.27Å; R168-K171 WeakPolarHBondContact O-CB 3.37Å; R168-K171 PolarHBondContact O-N 3.19Å; R168-K171 VanDerWaalsContact O-N 3.15Å; R168-L172 WeakPolarHBondContact O-CG 3.26Å; R168-L172 PolarHBondContact O-N 2.9Å; R168-L220 HydrophobicContact CB-CD1 3.96Å; R168-L220 HydrophobicContact CB-CD2 4.1Å; R168-L220 HydrophobicContact CB-CG 4.45Å; R168-E224 WeakPolarHBondContact CD-OE1 3.41Å; R168-E224 IonicContact CZ-OE1 3.91Å; R168-E224 IonicContact CZ-OE2 3.86Å; R168-E224 IonicContact NE-OE1 3.57Å; R168-E224 IonicContact NH1-OE1 3.69Å; R168-E224 IonicContact NH1-OE2 2.99Å; R168-E224 PolarHBondContact NH1-OE2 3.46Å |
| 169 | R | 94.5 | Very high | 93.6 | Very high | 13 Ų | 13 | 61.4 Ų | 61.4 | 5% | 0.049 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -54.6 | -47.5 | 173.1 | -179.1 | -168.5 | 59 | 73.8 | -0.3 | 111.4 | F165 L172 G173 Y174 V179 E200 | F165-R169 WeakPolarHBondContact O-CB 3.34Å; F165-R169 PolarHBondContact O-N 3.45Å; R169-L172 PolarHBondContact O-N 3.08Å; R169-G173 PolarHBondContact O-N 2.95Å; R169-Y174 WeakPolarHBondContact CG-O 3.27Å; R169-Y174 PolarHBondContact NH1-O 2.92Å; R169-Y174 PolarHBondContact O-N 3.02Å; R169-V179 HydrophobicContact CG-CG2 3.68Å; R169-E200 IonicContact CZ-OE1 3.25Å; R169-E200 VanDerWaalsContact CZ-OE1 3.25Å; R169-E200 IonicContact NE-OE1 2.7Å; R169-E200 PolarHBondContact NE-OE1 2.94Å; R169-E200 IonicContact NH2-OE1 2.94Å; R169-E200 PolarHBondContact NH2-OE1 3.18Å; R169-E200 IonicContact NH2-OE2 3.45Å; R169-E200 PolarHBondContact NH2-OE2 3.02Å |
| 170 | I | 90.8 | Very high | 93.7 | Very high | 95 Ų | 95 | 57.3 Ų | 57.3 | 49% | 0.487 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -64.8 | -43.4 | 178.8 | -67.3 | 165.7 | 0 | 0 | 0 | 110.4 | K166 V167 R168 L172 G173 | K166-I170 HydrophobicContact CG-CD1 4.04Å; K166-I170 WeakPolarHBondContact O-CD1 3.18Å; K166-I170 WeakPolarHBondContact O-CG1 3.21Å; K166-I170 PolarHBondContact O-N 3.14Å; K166-I170 VanDerWaalsContact O-N 3.11Å; V167-I170 PolarHBondContact O-N 3.34Å; R168-I170 VanDerWaalsContact C-N 3.3Å; R168-I170 PolarHBondContact O-N 3.27Å; I170-L172 VanDerWaalsContact C-N 3.29Å; I170-L172 PolarHBondContact O-N 2.79Å; I170-G173 WeakPolarHBondContact O-CA 3.4Å; I170-G173 PolarHBondContact O-N 2.7Å |
| 171 | K | 89.7 | Confident | 93.5 | Very high | 183 Ų | 183 | 56.9 Ų | 56.9 | 80% | 0.796 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -59.1 | -39.3 | 177.6 | -174.1 | -178.1 | 178.4 | -174 | 0 | 112.5 | V167 R168 G173 | V167-K171 WeakPolarHBondContact O-CB 3.47Å; V167-K171 PolarHBondContact O-N 3.26Å; R168-K171 WeakPolarHBondContact O-CB 3.37Å; R168-K171 PolarHBondContact O-N 3.19Å; R168-K171 VanDerWaalsContact O-N 3.15Å; K171-G173 PolarHBondContact O-N 3.06Å |
| 172 | L | 89.4 | Confident | 93.1 | Very high | 55 Ų | 55 | 57.6 Ų | 57.6 | 29% | 0.288 | 30% | 0.3 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.8 | -2.2 | 174.6 | -68.2 | 169.4 | 0 | 0 | 0 | 113.2 | R168 R169 I170 Y174 L220 A223 E224 | R168-L172 WeakPolarHBondContact O-CG 3.26Å; R168-L172 PolarHBondContact O-N 2.9Å; R169-L172 PolarHBondContact O-N 3.08Å; I170-L172 VanDerWaalsContact C-N 3.29Å; I170-L172 PolarHBondContact O-N 2.79Å; L172-Y174 VanDerWaalsContact C-N 3.29Å; L172-Y174 HydrophobicContact CB-CD2 3.61Å; L172-Y174 HydrophobicContact CB-CE2 3.98Å; L172-Y174 PolarHBondContact O-N 3.37Å; L172-L220 HydrophobicContact CD1-CD1 4.35Å; L172-A223 HydrophobicContact CD1-CB 4.13Å; L172-E224 HydrophobicContact CD1-CG 3.86Å |
| 173 | G | 87.9 | Confident | 92.9 | Very high | 54 Ų | 54 | 57.6 Ų | 57.6 | 56% | 0.557 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.3 | 10.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 115 | R169 I170 K171 | R169-G173 PolarHBondContact O-N 2.95Å; I170-G173 WeakPolarHBondContact O-CA 3.4Å; I170-G173 PolarHBondContact O-N 2.7Å; K171-G173 PolarHBondContact O-N 3.06Å |
| 174 | Y | 91.7 | Very high | 92.5 | Very high | 80 Ų | 80 | 55.1 Ų | 55.1 | 31% | 0.314 | 29% | 0.292 | S | S | . | . | trans | -77.6 | 133.9 | 179.7 | -77.9 | -84 | 0 | 0 | 0 | 111.3 | R169 L172 N178 W219 A223 | R169-Y174 WeakPolarHBondContact CG-O 3.27Å; R169-Y174 PolarHBondContact NH1-O 2.92Å; R169-Y174 PolarHBondContact O-N 3.02Å; L172-Y174 VanDerWaalsContact C-N 3.29Å; L172-Y174 HydrophobicContact CB-CD2 3.61Å; L172-Y174 HydrophobicContact CB-CE2 3.98Å; L172-Y174 PolarHBondContact O-N 3.37Å; Y174-N178 HydrophobicContact CD1-CB 3.96Å; Y174-W219 HydrophobicContact CD1-CH2 4.24Å; Y174-W219 HydrophobicContact CD1-CZ2 4.02Å; Y174-W219 AromaticContact CD2-CH2 3.95Å; Y174-W219 HydrophobicContact CD2-CH2 3.95Å; Y174-W219 HydrophobicContact CD2-CZ2 4.32Å; Y174-W219 HydrophobicContact CE1-CZ2 4.14Å; Y174-W219 HydrophobicContact CE2-CH2 4.4Å; Y174-W219 HydrophobicContact CE2-CZ2 4.43Å; Y174-W219 AromaticContact CG-CH2 3.87Å; Y174-W219 HydrophobicContact CG-CH2 3.87Å; Y174-W219 HydrophobicContact CG-CZ2 4.12Å; Y174-A223 HydrophobicContact CE2-CB 4.35Å | ||
| 175 | T | 94.1 | Very high | 91.6 | Very high | 28 Ų | 28 | 55.8 Ų | 55.8 | 17% | 0.172 | 31% | 0.311 | C | S | . | . | trans | -82 | 157 | 166.3 | 77.7 | 0 | 0 | 0 | 0 | 110.6 | T177 N178 V179 R241 | T175-T177 PolarHBondContact O-N 3.43Å; T175-N178 WeakPolarHBondContact CB-OD1 3.43Å; T175-N178 WeakPolarHBondContact CG2-OD1 3.4Å; T175-N178 PolarHBondContact N-OD1 3.2Å; T175-N178 PolarHBondContact O-N 3.37Å; T175-N178 PolarHBondContact OG1-N 2.95Å; T175-N178 PolarHBondContact OG1-OD1 3.34Å; T175-V179 WeakPolarHBondContact O-CG2 3.46Å; T175-V179 PolarHBondContact O-N 2.89Å; T175-R241 HydrophobicContact CG2-CG 4.1Å | ||
| 176 | Q | 93.5 | Very high | 90.5 | Very high | 19 Ų | 19 | 57.6 Ų | 57.6 | 9% | 0.089 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -55.6 | -33.3 | 174.7 | -71.1 | 170 | -21.9 | 0 | 0 | 112.7 | G180 Q193 I196 E200 | Q176-G180 PolarHBondContact O-N 3Å; Q176-G180 VanDerWaalsContact O-N 3.08Å; Q176-Q193 HydrophobicContact CB-CG 3.82Å; Q176-I196 HydrophobicContact CB-CB 4.15Å; Q176-I196 HydrophobicContact CB-CG2 4.1Å; Q176-I196 HydrophobicContact CG-CB 4.37Å; Q176-I196 HydrophobicContact CG-CG2 3.95Å; Q176-E200 PolarHBondContact NE2-OE2 2.88Å |
| 177 | T | 92 | Very high | 89.7 | Confident | 53 Ų | 53 | 58.8 Ų | 58.8 | 33% | 0.325 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -66.8 | -46.7 | 173.9 | -49 | 0 | 0 | 0 | 0 | 110.7 | T175 V179 G180 E181 | T175-T177 PolarHBondContact O-N 3.43Å; T177-V179 VanDerWaalsContact C-N 3.31Å; T177-V179 PolarHBondContact O-N 3.29Å; T177-G180 WeakPolarHBondContact O-CA 3.45Å; T177-G180 PolarHBondContact O-N 3.17Å; T177-E181 HydrophobicContact CG2-CG 4.5Å; T177-E181 WeakPolarHBondContact CG2-OE1 3.18Å; T177-E181 WeakPolarHBondContact O-CG 3.45Å; T177-E181 PolarHBondContact O-N 3.09Å |
| 178 | N | 92.7 | Very high | 89 | Confident | 64 Ų | 64 | 57.5 Ų | 57.5 | 34% | 0.342 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -63.3 | -37.1 | 179.2 | -59.9 | 126.5 | 0 | 0 | 0 | 112.7 | Y174 T175 E181 A182 | Y174-N178 HydrophobicContact CD1-CB 3.96Å; T175-N178 WeakPolarHBondContact CB-OD1 3.43Å; T175-N178 WeakPolarHBondContact CG2-OD1 3.4Å; T175-N178 PolarHBondContact N-OD1 3.2Å; T175-N178 PolarHBondContact O-N 3.37Å; T175-N178 PolarHBondContact OG1-N 2.95Å; T175-N178 PolarHBondContact OG1-OD1 3.34Å; N178-E181 PolarHBondContact ND2-OE2 3.39Å; N178-A182 WeakPolarHBondContact O-CB 3.5Å; N178-A182 PolarHBondContact O-N 3.19Å |
| 179 | V | 94.4 | Very high | 88.6 | Confident | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.6 | -49.9 | 171.5 | 174.6 | 0 | 0 | 0 | 0 | 110.1 | F165 R169 T175 T177 E181 A182 L183 I196 L216 W219 | F165-V179 HydrophobicContact CZ-CG1 3.98Å; R169-V179 HydrophobicContact CG-CG2 3.68Å; T175-V179 WeakPolarHBondContact O-CG2 3.46Å; T175-V179 PolarHBondContact O-N 2.89Å; T177-V179 VanDerWaalsContact C-N 3.31Å; T177-V179 PolarHBondContact O-N 3.29Å; V179-E181 VanDerWaalsContact C-N 3.3Å; V179-E181 PolarHBondContact O-N 3.25Å; V179-A182 PolarHBondContact O-N 3.16Å; V179-L183 HydrophobicContact CG1-CD1 3.88Å; V179-L183 HydrophobicContact CG1-CG 4.32Å; V179-L183 WeakPolarHBondContact O-CG 3.31Å; V179-L183 PolarHBondContact O-N 3.31Å; V179-I196 HydrophobicContact CG1-CD1 3.99Å; V179-I196 HydrophobicContact CG1-CG1 4.29Å; V179-I196 HydrophobicContact CG1-CG2 4.41Å; V179-L216 HydrophobicContact CG1-CD2 4.19Å; V179-W219 HydrophobicContact CB-CH2 4.32Å; V179-W219 HydrophobicContact CB-CZ2 4.45Å; V179-W219 HydrophobicContact CG1-CD2 4.43Å; V179-W219 HydrophobicContact CG1-CE3 4.21Å; V179-W219 HydrophobicContact CG1-CH2 4.32Å; V179-W219 HydrophobicContact CG1-CZ2 4.48Å; V179-W219 HydrophobicContact CG1-CZ3 4.15Å; V179-W219 HydrophobicContact CG2-CH2 3.47Å; V179-W219 VanDerWaalsContact CG2-CH2 3.47Å; V179-W219 HydrophobicContact CG2-CZ2 3.97Å; V179-W219 HydrophobicContact CG2-CZ3 3.87Å |
| 180 | G | 93.8 | Very high | 88.2 | Confident | 0 Ų | 0 | 62.7 Ų | 62.7 | 0% | 0 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -55.2 | -43.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q176 T177 E190 F191 | Q176-G180 PolarHBondContact O-N 3Å; Q176-G180 VanDerWaalsContact O-N 3.08Å; T177-G180 WeakPolarHBondContact O-CA 3.45Å; T177-G180 PolarHBondContact O-N 3.17Å; G180-E190 WeakPolarHBondContact O-CA 3.21Å; G180-F191 CarbonylContact C-O 3.59Å; G180-F191 WeakPolarHBondContact CA-O 3.36Å; G180-F191 PolarHBondContact O-N 3.1Å |
| 181 | E | 90.3 | Very high | 88.2 | Confident | 105 Ų | 105 | 60.2 Ų | 60.2 | 49% | 0.491 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -68.4 | -46.4 | 175.9 | -68.4 | 164.3 | 174.3 | 0 | 0 | 111.8 | T177 N178 V179 L183 A184 | T177-E181 HydrophobicContact CG2-CG 4.5Å; T177-E181 WeakPolarHBondContact CG2-OE1 3.18Å; T177-E181 WeakPolarHBondContact O-CG 3.45Å; T177-E181 PolarHBondContact O-N 3.09Å; N178-E181 PolarHBondContact ND2-OE2 3.39Å; V179-E181 VanDerWaalsContact C-N 3.3Å; V179-E181 PolarHBondContact O-N 3.25Å; E181-L183 PolarHBondContact O-N 2.95Å; E181-A184 VanDerWaalsContact O-CB 3.31Å; E181-A184 WeakPolarHBondContact O-CB 3.16Å; E181-A184 PolarHBondContact O-N 3.23Å; E181-A184 VanDerWaalsContact O-N 3.16Å |
| 182 | A | 90.4 | Very high | 88.4 | Confident | 34 Ų | 34 | 54.5 Ų | 54.5 | 28% | 0.281 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -66.3 | -26.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | N178 V179 A184 A185 W219 | N178-A182 WeakPolarHBondContact O-CB 3.5Å; N178-A182 PolarHBondContact O-N 3.19Å; V179-A182 PolarHBondContact O-N 3.16Å; A182-A184 PolarHBondContact O-N 2.9Å; A182-A185 WeakPolarHBondContact O-CB 3.34Å; A182-A185 PolarHBondContact O-N 3.2Å; A182-A185 VanDerWaalsContact O-N 3.17Å; A182-W219 HydrophobicContact CB-CZ2 4.42Å |
| 183 | L | 91.4 | Very high | 88.5 | Confident | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -65.3 | -19.1 | 176.3 | -76 | 169.2 | 0 | 0 | 0 | 113.6 | V179 E181 A185 V186 H187 F191 I196 I215 L216 W219 | V179-L183 HydrophobicContact CG1-CD1 3.88Å; V179-L183 HydrophobicContact CG1-CG 4.32Å; V179-L183 WeakPolarHBondContact O-CG 3.31Å; V179-L183 PolarHBondContact O-N 3.31Å; E181-L183 PolarHBondContact O-N 2.95Å; L183-A185 PolarHBondContact O-N 3.11Å; L183-V186 PolarHBondContact O-N 2.89Å; L183-H187 PolarHBondContact O-N 2.91Å; L183-F191 HydrophobicContact CB-CD2 3.91Å; L183-F191 HydrophobicContact CB-CE2 4.45Å; L183-F191 HydrophobicContact CD1-CB 4.49Å; L183-F191 HydrophobicContact CD1-CD2 3.55Å; L183-F191 HydrophobicContact CD1-CE2 4.26Å; L183-F191 HydrophobicContact CD1-CG 4.44Å; L183-F191 HydrophobicContact CG-CD2 4.34Å; L183-I196 HydrophobicContact CD1-CD1 3.88Å; L183-I215 HydrophobicContact CD2-CG2 3.87Å; L183-L216 HydrophobicContact CD1-CD2 3.57Å; L183-L216 HydrophobicContact CD2-CD2 4.41Å; L183-W219 HydrophobicContact CD2-CB 3.46Å; L183-W219 VanDerWaalsContact CD2-CB 3.46Å; L183-W219 HydrophobicContact CD2-CD2 4.44Å; L183-W219 HydrophobicContact CD2-CG 3.6Å; L183-W219 HydrophobicContact CG-CG 4.3Å |
| 184 | A | 87.8 | Confident | 88.8 | Confident | 41 Ų | 41 | 55 Ų | 55 | 34% | 0.339 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.3 | -34.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | E181 A182 G188 E190 | E181-A184 VanDerWaalsContact O-CB 3.31Å; E181-A184 WeakPolarHBondContact O-CB 3.16Å; E181-A184 PolarHBondContact O-N 3.23Å; E181-A184 VanDerWaalsContact O-N 3.16Å; A182-A184 PolarHBondContact O-N 2.9Å; A184-G188 WeakPolarHBondContact O-CA 3.27Å; A184-G188 PolarHBondContact O-N 3.28Å; A184-E190 HydrophobicContact CB-CB 4.3Å |
| 185 | A | 78.6 | Confident | 89.1 | Confident | 96 Ų | 96 | 53 Ų | 53 | 79% | 0.793 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -71.6 | -32.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | A182 L183 | A182-A185 WeakPolarHBondContact O-CB 3.34Å; A182-A185 PolarHBondContact O-N 3.2Å; A182-A185 VanDerWaalsContact O-N 3.17Å; L183-A185 PolarHBondContact O-N 3.11Å |
| 186 | V | 74.5 | Confident | 89.2 | Confident | 37 Ų | 37 | 51.7 Ų | 51.7 | 22% | 0.224 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -92.4 | -35.6 | -174.2 | -175.6 | 0 | 0 | 0 | 0 | 112.2 | L183 K218 E222 | L183-V186 PolarHBondContact O-N 2.89Å; V186-K218 HydrophobicContact CG1-CD 3.91Å; V186-K218 HydrophobicContact CG1-CG 4.21Å; V186-E222 VanDerWaalsContact CG2-OE2 3.26Å; V186-E222 WeakPolarHBondContact CG2-OE2 3.35Å |
| 187 | H | 78.8 | Confident | 89.3 | Confident | 98 Ų | 98 | 52.3 Ų | 52.3 | 45% | 0.454 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -117.8 | -6.1 | -171.8 | -172.1 | -93.3 | 0 | 0 | 0 | 113.4 | L183 S189 I215 | L183-H187 PolarHBondContact O-N 2.91Å; H187-S189 VanDerWaalsContact C-N 3.3Å; H187-S189 PolarHBondContact O-N 3.42Å; H187-I215 HydrophobicContact CB-CG2 4.05Å; H187-I215 WeakPolarHBondContact NE2-CD1 3.43Å |
| 188 | G | 79.3 | Confident | 89.5 | Confident | 70 Ų | 70 | 54.9 Ų | 54.9 | 72% | 0.722 | 33% | 0.328 | S | S | * | . | S | Bend | trans | 78.5 | 8.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | A184 | A184-G188 WeakPolarHBondContact O-CA 3.27Å; A184-G188 PolarHBondContact O-N 3.28Å |
| 189 | S | 84.5 | Confident | 89.7 | Confident | 63 Ų | 63 | 52 Ų | 52 | 44% | 0.441 | 31% | 0.312 | S | S | . | . | S | Bend | trans | -150.4 | 137.5 | 176.6 | -176.9 | 0 | 0 | 0 | 0 | 111 | H187 | H187-S189 VanDerWaalsContact C-N 3.3Å; H187-S189 PolarHBondContact O-N 3.42Å |
| 190 | E | 85.8 | Confident | 89.9 | Confident | 141 Ų | 141 | 52.4 Ų | 52.4 | 66% | 0.659 | 31% | 0.314 | S | S | * | . | trans | -73.7 | 143.4 | 174.5 | 67.2 | 174.2 | -151.8 | 0 | 0 | 111 | G180 A184 | G180-E190 WeakPolarHBondContact O-CA 3.21Å; A184-E190 HydrophobicContact CB-CB 4.3Å | ||
| 191 | F | 92.8 | Very high | 89.9 | Confident | 44 Ų | 44 | 56 Ų | 56 | 19% | 0.193 | 33% | 0.333 | C | S | . | . | trans | -104.4 | 140.5 | 169.3 | -70.1 | -71.9 | 0 | 0 | 0 | 110.4 | G180 L183 T195 I196 L212 I215 | G180-F191 CarbonylContact C-O 3.59Å; G180-F191 WeakPolarHBondContact CA-O 3.36Å; G180-F191 PolarHBondContact O-N 3.1Å; L183-F191 HydrophobicContact CB-CD2 3.91Å; L183-F191 HydrophobicContact CB-CE2 4.45Å; L183-F191 HydrophobicContact CD1-CB 4.49Å; L183-F191 HydrophobicContact CD1-CD2 3.55Å; L183-F191 HydrophobicContact CD1-CE2 4.26Å; L183-F191 HydrophobicContact CD1-CG 4.44Å; L183-F191 HydrophobicContact CG-CD2 4.34Å; F191-T195 HydrophobicContact CB-CG2 4.38Å; F191-T195 HydrophobicContact CD1-CG2 3.93Å; F191-T195 HydrophobicContact CG-CG2 4.43Å; F191-I196 HydrophobicContact CB-CD1 4.13Å; F191-L212 HydrophobicContact CD1-CD2 4.38Å; F191-L212 HydrophobicContact CE1-CD2 3.91Å; F191-L212 HydrophobicContact CE2-CD2 4.31Å; F191-L212 HydrophobicContact CZ-CD2 3.86Å; F191-I215 HydrophobicContact CE2-CD1 4.44Å; F191-I215 HydrophobicContact CE2-CG2 4.2Å; F191-I215 HydrophobicContact CZ-CD1 4.14Å | ||
| 192 | S | 92.4 | Very high | 90.1 | Very high | 63 Ų | 63 | 54.4 Ų | 54.4 | 44% | 0.441 | 33% | 0.328 | S | S | . | . | trans | -65.3 | 151.3 | 173.8 | 78 | 0 | 0 | 0 | 0 | 111.4 | T194 T195 I196 | S192-T194 PolarHBondContact O-N 3.32Å; S192-T194 VanDerWaalsContact O-N 3.11Å; S192-T194 PolarHBondContact OG-N 3.36Å; S192-T195 WeakPolarHBondContact O-CA 3.11Å; S192-T195 VanDerWaalsContact O-CB 3.29Å; S192-T195 WeakPolarHBondContact O-CB 3.36Å; S192-T195 PolarHBondContact O-N 2.88Å; S192-T195 PolarHBondContact OG-N 2.97Å; S192-T195 VanDerWaalsContact OG-N 3.09Å; S192-T195 PolarHBondContact OG-OG1 3.43Å; S192-I196 PolarHBondContact O-N 2.66Å | ||
| 193 | Q | 92.8 | Very high | 90.3 | Very high | 55 Ų | 55 | 59.1 Ų | 59.1 | 26% | 0.257 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -50.8 | -36.3 | 169.3 | 174.6 | -82.3 | -33 | 0 | 0 | 112.2 | Q176 T195 I196 C197 | Q176-Q193 HydrophobicContact CB-CG 3.82Å; Q193-T195 VanDerWaalsContact C-N 3.31Å; Q193-T195 PolarHBondContact O-N 3.37Å; Q193-I196 PolarHBondContact O-N 2.75Å; Q193-C197 WeakPolarHBondContact O-CB 3.31Å; Q193-C197 PolarHBondContact O-N 3.42Å |
| 194 | T | 94.3 | Very high | 90.3 | Very high | 65 Ų | 65 | 60.6 Ų | 60.6 | 40% | 0.399 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -66.1 | -34.2 | 178.3 | -65.7 | 0 | 0 | 0 | 0 | 111.7 | S192 C197 R198 | S192-T194 PolarHBondContact O-N 3.32Å; S192-T194 VanDerWaalsContact O-N 3.11Å; S192-T194 PolarHBondContact OG-N 3.36Å; T194-C197 PolarHBondContact O-N 3.47Å; T194-R198 HydrophobicContact CG2-CG 4.41Å; T194-R198 WeakPolarHBondContact O-CB 3.38Å; T194-R198 VanDerWaalsContact O-CG 3.3Å; T194-R198 WeakPolarHBondContact O-CG 3.39Å; T194-R198 PolarHBondContact O-N 3.42Å |
| 195 | T | 96.1 | Very high | 90.6 | Very high | 36 Ų | 36 | 62.6 Ų | 62.6 | 22% | 0.221 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -63.1 | -50.6 | 175.1 | -54.2 | 0 | 0 | 0 | 0 | 110.8 | F191 S192 Q193 C197 R198 F199 L212 | F191-T195 HydrophobicContact CB-CG2 4.38Å; F191-T195 HydrophobicContact CD1-CG2 3.93Å; F191-T195 HydrophobicContact CG-CG2 4.43Å; S192-T195 WeakPolarHBondContact O-CA 3.11Å; S192-T195 VanDerWaalsContact O-CB 3.29Å; S192-T195 WeakPolarHBondContact O-CB 3.36Å; S192-T195 PolarHBondContact O-N 2.88Å; S192-T195 PolarHBondContact OG-N 2.97Å; S192-T195 VanDerWaalsContact OG-N 3.09Å; S192-T195 PolarHBondContact OG-OG1 3.43Å; Q193-T195 VanDerWaalsContact C-N 3.31Å; Q193-T195 PolarHBondContact O-N 3.37Å; T195-C197 VanDerWaalsContact C-N 3.31Å; T195-C197 PolarHBondContact O-N 2.82Å; T195-R198 PolarHBondContact O-N 3.17Å; T195-F199 PolarHBondContact O-N 3.37Å; T195-L212 HydrophobicContact CG2-CD1 3.97Å; T195-L212 HydrophobicContact CG2-CD2 4.44Å |
| 196 | I | 96.5 | Very high | 91.1 | Very high | 1 Ų | 1 | 61.2 Ų | 61.2 | 1% | 0.005 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -60.9 | -42.4 | 177.9 | -50.4 | -55.2 | 0 | 0 | 0 | 110.7 | F165 Q176 V179 L183 F191 S192 Q193 R198 F199 E200 L216 | F165-I196 HydrophobicContact CE1-CG2 4.19Å; Q176-I196 HydrophobicContact CB-CB 4.15Å; Q176-I196 HydrophobicContact CB-CG2 4.1Å; Q176-I196 HydrophobicContact CG-CB 4.37Å; Q176-I196 HydrophobicContact CG-CG2 3.95Å; V179-I196 HydrophobicContact CG1-CD1 3.99Å; V179-I196 HydrophobicContact CG1-CG1 4.29Å; V179-I196 HydrophobicContact CG1-CG2 4.41Å; L183-I196 HydrophobicContact CD1-CD1 3.88Å; F191-I196 HydrophobicContact CB-CD1 4.13Å; S192-I196 PolarHBondContact O-N 2.66Å; Q193-I196 PolarHBondContact O-N 2.75Å; I196-R198 PolarHBondContact O-N 3Å; I196-F199 PolarHBondContact O-N 3.3Å; I196-E200 PolarHBondContact O-N 3.46Å; I196-L216 HydrophobicContact CD1-CD2 4.05Å |
| 197 | C | 96.4 | Very high | 91.9 | Very high | 32 Ų | 32 | 67 Ų | 67 | 22% | 0.216 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -62.5 | -40.5 | 176.6 | -173.6 | 0 | 0 | 0 | 0 | 112.7 | Q193 T194 T195 F199 N201 | Q193-C197 WeakPolarHBondContact O-CB 3.31Å; Q193-C197 PolarHBondContact O-N 3.42Å; T194-C197 PolarHBondContact O-N 3.47Å; T195-C197 VanDerWaalsContact C-N 3.31Å; T195-C197 PolarHBondContact O-N 2.82Å; C197-F199 VanDerWaalsContact C-N 3.34Å; C197-N201 PolarHBondContact O-N 3.41Å; C197-N201 PolarHBondContact O-ND2 3.47Å; C197-N201 PolarHBondContact SG-ND2 3.34Å; C197-N201 VanDerWaalsContact SG-ND2 3.43Å |
| 198 | R | 96.1 | Very high | 92.6 | Very high | 108 Ų | 108 | 65.6 Ų | 65.6 | 41% | 0.408 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -68.3 | -36.3 | 177.7 | -74.3 | 178.2 | -174.7 | -170.4 | 4.8 | 111.7 | T194 T195 I196 L202 Q203 L204 | T194-R198 HydrophobicContact CG2-CG 4.41Å; T194-R198 WeakPolarHBondContact O-CB 3.38Å; T194-R198 VanDerWaalsContact O-CG 3.3Å; T194-R198 WeakPolarHBondContact O-CG 3.39Å; T194-R198 PolarHBondContact O-N 3.42Å; T195-R198 PolarHBondContact O-N 3.17Å; I196-R198 PolarHBondContact O-N 3Å; R198-L202 PolarHBondContact O-N 2.95Å; R198-L202 VanDerWaalsContact O-N 3.16Å; R198-Q203 HydrophobicContact CB-CB 4.3Å; R198-Q203 HydrophobicContact CG-CB 4.4Å; R198-Q203 PolarHBondContact O-N 3.34Å; R198-L204 HydrophobicContact CB-CD1 4.38Å; R198-L204 HydrophobicContact CB-CD2 3.58Å; R198-L204 HydrophobicContact CB-CG 3.8Å; R198-L204 HydrophobicContact CG-CD2 4.37Å |
| 199 | F | 97.5 | Very high | 93.3 | Very high | 2 Ų | 2 | 62.5 Ų | 62.5 | 1% | 0.009 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.9 | -52.6 | 173.8 | -179.2 | -93.3 | 0 | 0 | 0 | 111.7 | L158 F161 A162 F165 T195 I196 C197 N201 L202 L204 A209 L212 K213 L216 | L158-F199 HydrophobicContact CD1-CE2 4.14Å; L158-F199 HydrophobicContact CD1-CZ 4.32Å; F161-F199 AromaticContact CD1-CE1 3.86Å; F161-F199 HydrophobicContact CD1-CE1 3.86Å; F161-F199 AromaticContact CD1-CZ 3.55Å; F161-F199 HydrophobicContact CD1-CZ 3.55Å; F161-F199 AromaticContact CE1-CE1 3.67Å; F161-F199 HydrophobicContact CE1-CE1 3.67Å; F161-F199 AromaticContact CE1-CZ 3.49Å; F161-F199 HydrophobicContact CE1-CZ 3.49Å; F161-F199 VanDerWaalsContact CE1-CZ 3.49Å; A162-F199 HydrophobicContact CB-CE1 4.23Å; F165-F199 HydrophobicContact CD1-CE1 4.47Å; T195-F199 PolarHBondContact O-N 3.37Å; I196-F199 PolarHBondContact O-N 3.3Å; C197-F199 VanDerWaalsContact C-N 3.34Å; F199-N201 PolarHBondContact O-N 3.45Å; F199-N201 VanDerWaalsContact O-N 3.14Å; F199-L202 PolarHBondContact O-N 3.44Å; F199-L204 HydrophobicContact CB-CD1 4.03Å; F199-L204 HydrophobicContact CD2-CD1 4.41Å; F199-A209 WeakPolarHBondContact CE2-O 3.36Å; F199-L212 HydrophobicContact CB-CD1 4.41Å; F199-L212 HydrophobicContact CD2-CB 3.64Å; F199-L212 HydrophobicContact CD2-CD1 4.15Å; F199-L212 HydrophobicContact CE2-CB 3.86Å; F199-K213 HydrophobicContact CE2-CB 4.19Å; F199-K213 HydrophobicContact CZ-CB 4.13Å; F199-L216 HydrophobicContact CB-CD1 4.38Å; F199-L216 HydrophobicContact CD1-CD1 3.3Å; F199-L216 HydrophobicContact CD2-CD1 3.97Å; F199-L216 HydrophobicContact CE1-CD1 3.41Å; F199-L216 VanDerWaalsContact CE1-CD1 3.41Å; F199-L216 HydrophobicContact CE2-CD1 4.05Å; F199-L216 HydrophobicContact CG-CD1 3.6Å; F199-L216 HydrophobicContact CZ-CD1 3.78Å |
| 200 | E | 97.1 | Very high | 93.7 | Very high | 9 Ų | 9 | 61.2 Ų | 61.2 | 4% | 0.042 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.8 | -24.8 | -180 | -73.9 | -176.2 | 172.5 | 0 | 0 | 114.1 | F165 K166 R169 Q176 I196 | F165-E200 HydrophobicContact CD1-CG 4.26Å; F165-E200 HydrophobicContact CE1-CG 4.48Å; K166-E200 HydrophobicContact CB-CG 4.15Å; K166-E200 HydrophobicContact CD-CB 4.45Å; K166-E200 HydrophobicContact CG-CG 4.4Å; R169-E200 IonicContact CZ-OE1 3.25Å; R169-E200 VanDerWaalsContact CZ-OE1 3.25Å; R169-E200 IonicContact NE-OE1 2.7Å; R169-E200 PolarHBondContact NE-OE1 2.94Å; R169-E200 IonicContact NH2-OE1 2.94Å; R169-E200 PolarHBondContact NH2-OE1 3.18Å; R169-E200 IonicContact NH2-OE2 3.45Å; R169-E200 PolarHBondContact NH2-OE2 3.02Å; Q176-E200 PolarHBondContact NE2-OE2 2.88Å; I196-E200 PolarHBondContact O-N 3.46Å |
| 201 | N | 94.6 | Very high | 94.1 | Very high | 75 Ų | 75 | 61 Ų | 61 | 40% | 0.401 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -102.9 | 10.4 | 178.3 | -62.5 | -64.4 | 0 | 0 | 0 | 112.7 | C197 F199 Q203 | C197-N201 PolarHBondContact O-N 3.41Å; C197-N201 PolarHBondContact O-ND2 3.47Å; C197-N201 PolarHBondContact SG-ND2 3.34Å; C197-N201 VanDerWaalsContact SG-ND2 3.43Å; F199-N201 PolarHBondContact O-N 3.45Å; F199-N201 VanDerWaalsContact O-N 3.14Å; N201-Q203 HydrophobicContact CB-CG 3.97Å; N201-Q203 WeakPolarHBondContact O-CG 3.2Å; N201-Q203 PolarHBondContact O-N 3.21Å |
| 202 | L | 94.4 | Very high | 94.2 | Very high | 73 Ų | 73 | 59.1 Ų | 59.1 | 38% | 0.382 | 31% | 0.305 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.2 | 32.3 | 178 | -54.8 | 164.3 | 0 | 0 | 0 | 113.4 | L158 E159 A162 R198 F199 L204 | L158-L202 HydrophobicContact CG-CD2 4.4Å; E159-L202 HydrophobicContact CB-CD1 4.19Å; E159-L202 HydrophobicContact CG-CD1 3.66Å; E159-L202 HydrophobicContact CG-CD2 4.39Å; A162-L202 HydrophobicContact CB-CD2 3.77Å; A162-L202 HydrophobicContact CB-CG 4.44Å; R198-L202 PolarHBondContact O-N 2.95Å; R198-L202 VanDerWaalsContact O-N 3.16Å; F199-L202 PolarHBondContact O-N 3.44Å; L202-L204 VanDerWaalsContact C-N 3.34Å |
| 203 | Q | 94.3 | Very high | 94.3 | Very high | 133 Ų | 133 | 57.8 Ų | 57.8 | 62% | 0.621 | 29% | 0.291 | S | S | * | . | trans | -96.6 | 22.1 | -177.2 | -62.7 | -178 | 4.6 | 0 | 0 | 113 | R198 N201 | R198-Q203 HydrophobicContact CB-CB 4.3Å; R198-Q203 HydrophobicContact CG-CB 4.4Å; R198-Q203 PolarHBondContact O-N 3.34Å; N201-Q203 HydrophobicContact CB-CG 3.97Å; N201-Q203 WeakPolarHBondContact O-CG 3.2Å; N201-Q203 PolarHBondContact O-N 3.21Å | ||
| 204 | L | 92.4 | Very high | 94.3 | Very high | 31 Ų | 31 | 58.5 Ų | 58.5 | 16% | 0.162 | 31% | 0.306 | C | S | . | . | S | Bend | trans | -109.9 | 156.9 | 177.4 | -63.8 | 178.3 | 0 | 0 | 0 | 109.4 | R198 F199 L202 A209 L212 | R198-L204 HydrophobicContact CB-CD1 4.38Å; R198-L204 HydrophobicContact CB-CD2 3.58Å; R198-L204 HydrophobicContact CB-CG 3.8Å; R198-L204 HydrophobicContact CG-CD2 4.37Å; F199-L204 HydrophobicContact CB-CD1 4.03Å; F199-L204 HydrophobicContact CD2-CD1 4.41Å; L202-L204 VanDerWaalsContact C-N 3.34Å; L204-A209 HydrophobicContact CB-CB 4.27Å; L204-L212 HydrophobicContact CD1-CD1 3.27Å |
| 205 | S | 93.1 | Very high | 94.3 | Very high | 82 Ų | 82 | 56.7 Ų | 56.7 | 57% | 0.573 | 29% | 0.294 | S | S | * | . | trans | -59.9 | 144.4 | 167.9 | 60.5 | 0 | 0 | 0 | 0 | 109.5 | K207 N208 A209 | S205-K207 VanDerWaalsContact C-N 3.31Å; S205-K207 PolarHBondContact O-N 2.93Å; S205-N208 WeakPolarHBondContact O-CA 3.29Å; S205-N208 WeakPolarHBondContact O-CB 3.01Å; S205-N208 PolarHBondContact O-N 3.19Å; S205-N208 VanDerWaalsContact OG-CB 3.31Å; S205-N208 WeakPolarHBondContact OG-CB 3.44Å; S205-A209 PolarHBondContact O-N 3.3Å | ||
| 206 | F | 89.2 | Confident | 94.3 | Very high | 67 Ų | 67 | 55 Ų | 55 | 29% | 0.294 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -50.7 | -50.1 | -176.4 | -177.4 | -107.3 | 0 | 0 | 0 | 112.3 | E154 I155 L158 N208 A209 C210 | E154-F206 HydrophobicContact CB-CZ 4.05Å; E154-F206 HydrophobicContact CG-CZ 3.78Å; I155-F206 HydrophobicContact CB-CE2 4.42Å; I155-F206 HydrophobicContact CG1-CD2 4.03Å; I155-F206 HydrophobicContact CG1-CE2 3.6Å; I155-F206 HydrophobicContact CG1-CZ 4.27Å; L158-F206 HydrophobicContact CD2-CD2 4.04Å; L158-F206 HydrophobicContact CD2-CE2 4.11Å; F206-N208 VanDerWaalsContact C-N 3.26Å; F206-N208 PolarHBondContact O-N 2.99Å; F206-A209 WeakPolarHBondContact O-CB 3.27Å; F206-A209 PolarHBondContact O-N 3.02Å; F206-C210 PolarHBondContact O-N 3.25Å; F206-C210 PolarHBondContact O-SG 3.38Å; F206-C210 VanDerWaalsContact O-SG 3.36Å |
| 207 | K | 90.6 | Very high | 94.2 | Very high | 160 Ų | 160 | 56.8 Ų | 56.8 | 70% | 0.696 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -58.5 | -33.3 | 177.4 | -168.4 | 171.8 | -172.4 | 169.5 | 0 | 113.9 | S205 K211 | S205-K207 VanDerWaalsContact C-N 3.31Å; S205-K207 PolarHBondContact O-N 2.93Å; K207-K211 WeakPolarHBondContact O-CG 3.36Å; K207-K211 PolarHBondContact O-N 3.34Å |
| 208 | N | 93.8 | Very high | 94.1 | Very high | 67 Ų | 67 | 60.4 Ų | 60.4 | 36% | 0.358 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -78.2 | -39.4 | 176.5 | -169.4 | 21 | 0 | 0 | 0 | 111.2 | S205 F206 K211 L212 | S205-N208 WeakPolarHBondContact O-CA 3.29Å; S205-N208 WeakPolarHBondContact O-CB 3.01Å; S205-N208 PolarHBondContact O-N 3.19Å; S205-N208 VanDerWaalsContact OG-CB 3.31Å; S205-N208 WeakPolarHBondContact OG-CB 3.44Å; F206-N208 VanDerWaalsContact C-N 3.26Å; F206-N208 PolarHBondContact O-N 2.99Å; N208-K211 PolarHBondContact O-N 3.02Å; N208-L212 PolarHBondContact O-N 2.88Å |
| 209 | A | 94.1 | Very high | 94 | Very high | 6 Ų | 6 | 55.8 Ų | 55.8 | 5% | 0.05 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.2 | -44.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | L158 F199 L204 S205 F206 K211 L212 K213 | L158-A209 HydrophobicContact CD1-CB 4.19Å; L158-A209 HydrophobicContact CD2-CB 3.54Å; L158-A209 HydrophobicContact CG-CB 4.41Å; F199-A209 WeakPolarHBondContact CE2-O 3.36Å; L204-A209 HydrophobicContact CB-CB 4.27Å; S205-A209 PolarHBondContact O-N 3.3Å; F206-A209 WeakPolarHBondContact O-CB 3.27Å; F206-A209 PolarHBondContact O-N 3.02Å; A209-K211 VanDerWaalsContact C-N 3.31Å; A209-K211 PolarHBondContact O-N 3.36Å; A209-L212 PolarHBondContact O-N 3.42Å; A209-L212 VanDerWaalsContact O-N 3.15Å; A209-K213 WeakPolarHBondContact O-CB 3.26Å; A209-K213 PolarHBondContact O-N 2.95Å |
| 210 | C | 94.3 | Very high | 93.8 | Very high | 36 Ų | 36 | 55.9 Ų | 55.9 | 24% | 0.243 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.5 | -39.2 | 176 | -62.1 | 0 | 0 | 0 | 0 | 112.4 | F206 K213 A214 | F206-C210 PolarHBondContact O-N 3.25Å; F206-C210 PolarHBondContact O-SG 3.38Å; F206-C210 VanDerWaalsContact O-SG 3.36Å; C210-K213 PolarHBondContact O-N 3.43Å; C210-A214 PolarHBondContact O-N 2.75Å |
| 211 | K | 92.6 | Very high | 93.6 | Very high | 136 Ų | 136 | 61.1 Ų | 61.1 | 59% | 0.591 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -62 | -46.2 | 174.1 | -72.9 | 178.1 | 179.5 | -170 | 0 | 111.9 | K207 N208 A209 A214 I215 | K207-K211 WeakPolarHBondContact O-CG 3.36Å; K207-K211 PolarHBondContact O-N 3.34Å; N208-K211 PolarHBondContact O-N 3.02Å; A209-K211 VanDerWaalsContact C-N 3.31Å; A209-K211 PolarHBondContact O-N 3.36Å; K211-A214 PolarHBondContact O-N 2.99Å; K211-I215 WeakPolarHBondContact O-CG1 3.37Å; K211-I215 PolarHBondContact O-N 3.16Å |
| 212 | L | 94.8 | Very high | 93.4 | Very high | 5 Ų | 5 | 61.5 Ų | 61.5 | 3% | 0.026 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -67.8 | -35.4 | 178.3 | -74.4 | 173.1 | 0 | 0 | 0 | 112.3 | F191 T195 F199 L204 N208 A209 A214 I215 L216 | F191-L212 HydrophobicContact CD1-CD2 4.38Å; F191-L212 HydrophobicContact CE1-CD2 3.91Å; F191-L212 HydrophobicContact CE2-CD2 4.31Å; F191-L212 HydrophobicContact CZ-CD2 3.86Å; T195-L212 HydrophobicContact CG2-CD1 3.97Å; T195-L212 HydrophobicContact CG2-CD2 4.44Å; F199-L212 HydrophobicContact CB-CD1 4.41Å; F199-L212 HydrophobicContact CD2-CB 3.64Å; F199-L212 HydrophobicContact CD2-CD1 4.15Å; F199-L212 HydrophobicContact CE2-CB 3.86Å; L204-L212 HydrophobicContact CD1-CD1 3.27Å; N208-L212 PolarHBondContact O-N 2.88Å; A209-L212 PolarHBondContact O-N 3.42Å; A209-L212 VanDerWaalsContact O-N 3.15Å; L212-A214 VanDerWaalsContact C-N 3.31Å; L212-A214 PolarHBondContact O-N 3.01Å; L212-I215 HydrophobicContact CD2-CD1 4.48Å; L212-I215 PolarHBondContact O-N 3.02Å; L212-I215 VanDerWaalsContact O-N 3.17Å; L212-L216 HydrophobicContact CB-CD1 4.27Å; L212-L216 VanDerWaalsContact O-CB 3.29Å; L212-L216 WeakPolarHBondContact O-CB 3.49Å; L212-L216 WeakPolarHBondContact O-CG 3.4Å; L212-L216 PolarHBondContact O-N 3.24Å |
| 213 | K | 95.1 | Very high | 93.2 | Very high | 35 Ų | 35 | 58.4 Ų | 58.4 | 15% | 0.152 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -53.9 | -48.3 | 175.5 | 174.9 | 175.6 | 174 | -175.8 | 0 | 111 | E157 L158 F161 F199 A209 C210 I215 L216 S217 | E157-K213 IonicContact OE1-NZ 3.51Å; E157-K213 PolarHBondContact OE1-NZ 3.38Å; E157-K213 IonicContact OE2-NZ 2.66Å; L158-K213 HydrophobicContact CD1-CB 3.91Å; L158-K213 HydrophobicContact CD1-CD 3.79Å; L158-K213 HydrophobicContact CD1-CG 4.33Å; F161-K213 HydrophobicContact CB-CD 4.22Å; F161-K213 HydrophobicContact CD1-CB 4.26Å; F161-K213 HydrophobicContact CD1-CD 4.26Å; F161-K213 HydrophobicContact CD1-CG 3.69Å; F161-K213 HydrophobicContact CD2-CG 4.26Å; F161-K213 HydrophobicContact CE1-CB 4.28Å; F161-K213 HydrophobicContact CE1-CG 3.92Å; F161-K213 HydrophobicContact CE2-CG 4.46Å; F161-K213 HydrophobicContact CG-CD 4.12Å; F161-K213 HydrophobicContact CG-CG 3.87Å; F161-K213 HydrophobicContact CZ-CG 4.3Å; F199-K213 HydrophobicContact CE2-CB 4.19Å; F199-K213 HydrophobicContact CZ-CB 4.13Å; A209-K213 WeakPolarHBondContact O-CB 3.26Å; A209-K213 PolarHBondContact O-N 2.95Å; C210-K213 PolarHBondContact O-N 3.43Å; K213-I215 PolarHBondContact O-N 3.14Å; K213-L216 PolarHBondContact O-N 2.94Å; K213-S217 VanDerWaalsContact O-CB 3.31Å; K213-S217 WeakPolarHBondContact O-CB 3.48Å; K213-S217 PolarHBondContact O-N 3.03Å |
| 214 | A | 93.8 | Very high | 93 | Very high | 69 Ų | 69 | 55 Ų | 55 | 57% | 0.57 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -60.2 | -43.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | C210 K211 L212 K218 | C210-A214 PolarHBondContact O-N 2.75Å; K211-A214 PolarHBondContact O-N 2.99Å; L212-A214 VanDerWaalsContact C-N 3.31Å; L212-A214 PolarHBondContact O-N 3.01Å; A214-K218 PolarHBondContact O-N 3.41Å |
| 215 | I | 94 | Very high | 92.7 | Very high | 28 Ų | 28 | 59.4 Ų | 59.4 | 14% | 0.144 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -68.4 | -45.8 | -179.4 | -60.8 | 165.8 | 0 | 0 | 0 | 111 | L183 H187 F191 K211 L212 K213 W219 | L183-I215 HydrophobicContact CD2-CG2 3.87Å; H187-I215 HydrophobicContact CB-CG2 4.05Å; H187-I215 WeakPolarHBondContact NE2-CD1 3.43Å; F191-I215 HydrophobicContact CE2-CD1 4.44Å; F191-I215 HydrophobicContact CE2-CG2 4.2Å; F191-I215 HydrophobicContact CZ-CD1 4.14Å; K211-I215 WeakPolarHBondContact O-CG1 3.37Å; K211-I215 PolarHBondContact O-N 3.16Å; L212-I215 HydrophobicContact CD2-CD1 4.48Å; L212-I215 PolarHBondContact O-N 3.02Å; L212-I215 VanDerWaalsContact O-N 3.17Å; K213-I215 PolarHBondContact O-N 3.14Å; I215-W219 PolarHBondContact O-N 3.14Å |
| 216 | L | 95.4 | Very high | 92.2 | Very high | 1 Ų | 1 | 59.1 Ų | 59.1 | 1% | 0.005 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -70.5 | -32.6 | -177.5 | -67.8 | 174.2 | 0 | 0 | 0 | 112.2 | F161 F165 V179 L183 I196 F199 L212 K213 L220 | F161-L216 HydrophobicContact CE1-CB 4.17Å; F161-L216 HydrophobicContact CZ-CB 4.15Å; F165-L216 HydrophobicContact CD2-CB 4.03Å; F165-L216 HydrophobicContact CE1-CD1 4.46Å; F165-L216 HydrophobicContact CE2-CB 3.77Å; F165-L216 HydrophobicContact CE2-CD2 4Å; F165-L216 HydrophobicContact CE2-CG 4.31Å; F165-L216 HydrophobicContact CZ-CB 4.32Å; F165-L216 HydrophobicContact CZ-CD1 4.37Å; F165-L216 HydrophobicContact CZ-CD2 3.77Å; F165-L216 HydrophobicContact CZ-CG 4.38Å; V179-L216 HydrophobicContact CG1-CD2 4.19Å; L183-L216 HydrophobicContact CD1-CD2 3.57Å; L183-L216 HydrophobicContact CD2-CD2 4.41Å; I196-L216 HydrophobicContact CD1-CD2 4.05Å; F199-L216 HydrophobicContact CB-CD1 4.38Å; F199-L216 HydrophobicContact CD1-CD1 3.3Å; F199-L216 HydrophobicContact CD2-CD1 3.97Å; F199-L216 HydrophobicContact CE1-CD1 3.41Å; F199-L216 VanDerWaalsContact CE1-CD1 3.41Å; F199-L216 HydrophobicContact CE2-CD1 4.05Å; F199-L216 HydrophobicContact CG-CD1 3.6Å; F199-L216 HydrophobicContact CZ-CD1 3.78Å; L212-L216 HydrophobicContact CB-CD1 4.27Å; L212-L216 VanDerWaalsContact O-CB 3.29Å; L212-L216 WeakPolarHBondContact O-CB 3.49Å; L212-L216 WeakPolarHBondContact O-CG 3.4Å; L212-L216 PolarHBondContact O-N 3.24Å; K213-L216 PolarHBondContact O-N 2.94Å; L216-L220 VanDerWaalsContact O-CB 3.27Å; L216-L220 WeakPolarHBondContact O-CB 3.24Å; L216-L220 PolarHBondContact O-N 3.24Å |
| 217 | S | 95.1 | Very high | 91.4 | Very high | 37 Ų | 37 | 57.2 Ų | 57.2 | 26% | 0.259 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -62.7 | -51.3 | 175.8 | -162.9 | 0 | 0 | 0 | 0 | 110.4 | K213 W219 L220 E221 | K213-S217 VanDerWaalsContact O-CB 3.31Å; K213-S217 WeakPolarHBondContact O-CB 3.48Å; K213-S217 PolarHBondContact O-N 3.03Å; S217-W219 VanDerWaalsContact C-N 3.34Å; S217-W219 PolarHBondContact O-N 2.99Å; S217-L220 PolarHBondContact O-N 2.92Å; S217-L220 VanDerWaalsContact O-N 3.09Å; S217-E221 WeakPolarHBondContact O-CG 3.3Å; S217-E221 PolarHBondContact O-N 3.09Å; S217-E221 PolarHBondContact OG-OE1 3.07Å |
| 218 | K | 93.3 | Very high | 90.1 | Very high | 109 Ų | 109 | 52.5 Ų | 52.5 | 47% | 0.474 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -57.6 | -47.2 | 178.7 | -175.9 | -179.4 | 176.1 | -172.4 | 0 | 111.9 | V186 A214 L220 E221 E222 | V186-K218 HydrophobicContact CG1-CD 3.91Å; V186-K218 HydrophobicContact CG1-CG 4.21Å; A214-K218 PolarHBondContact O-N 3.41Å; K218-L220 VanDerWaalsContact C-N 3.31Å; K218-L220 PolarHBondContact O-N 2.92Å; K218-E221 PolarHBondContact O-N 2.99Å; K218-E222 WeakPolarHBondContact CE-OE1 3.23Å; K218-E222 WeakPolarHBondContact O-CG 3.42Å; K218-E222 PolarHBondContact O-N 2.91Å |
| 219 | W | 94.1 | Very high | 88.5 | Confident | 11 Ų | 11 | 55.5 Ų | 55.5 | 4% | 0.042 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -62.9 | -38.4 | 177.6 | 174.5 | 84.9 | 0 | 0 | 0 | 112.6 | F165 Y174 V179 A182 L183 I215 S217 E222 A223 | F165-W219 AromaticContact CE2-CE3 3.97Å; F165-W219 HydrophobicContact CE2-CE3 3.97Å; F165-W219 HydrophobicContact CE2-CZ3 4.03Å; F165-W219 HydrophobicContact CZ-CE3 4.38Å; F165-W219 HydrophobicContact CZ-CZ3 4.22Å; Y174-W219 HydrophobicContact CD1-CH2 4.24Å; Y174-W219 HydrophobicContact CD1-CZ2 4.02Å; Y174-W219 AromaticContact CD2-CH2 3.95Å; Y174-W219 HydrophobicContact CD2-CH2 3.95Å; Y174-W219 HydrophobicContact CD2-CZ2 4.32Å; Y174-W219 HydrophobicContact CE1-CZ2 4.14Å; Y174-W219 HydrophobicContact CE2-CH2 4.4Å; Y174-W219 HydrophobicContact CE2-CZ2 4.43Å; Y174-W219 AromaticContact CG-CH2 3.87Å; Y174-W219 HydrophobicContact CG-CH2 3.87Å; Y174-W219 HydrophobicContact CG-CZ2 4.12Å; V179-W219 HydrophobicContact CB-CH2 4.32Å; V179-W219 HydrophobicContact CB-CZ2 4.45Å; V179-W219 HydrophobicContact CG1-CD2 4.43Å; V179-W219 HydrophobicContact CG1-CE3 4.21Å; V179-W219 HydrophobicContact CG1-CH2 4.32Å; V179-W219 HydrophobicContact CG1-CZ2 4.48Å; V179-W219 HydrophobicContact CG1-CZ3 4.15Å; V179-W219 HydrophobicContact CG2-CH2 3.47Å; V179-W219 VanDerWaalsContact CG2-CH2 3.47Å; V179-W219 HydrophobicContact CG2-CZ2 3.97Å; V179-W219 HydrophobicContact CG2-CZ3 3.87Å; A182-W219 HydrophobicContact CB-CZ2 4.42Å; L183-W219 HydrophobicContact CD2-CB 3.46Å; L183-W219 VanDerWaalsContact CD2-CB 3.46Å; L183-W219 HydrophobicContact CD2-CD2 4.44Å; L183-W219 HydrophobicContact CD2-CG 3.6Å; L183-W219 HydrophobicContact CG-CG 4.3Å; I215-W219 PolarHBondContact O-N 3.14Å; S217-W219 VanDerWaalsContact C-N 3.34Å; S217-W219 PolarHBondContact O-N 2.99Å; W219-E222 PolarHBondContact O-N 3.43Å; W219-A223 HydrophobicContact CH2-CB 4.11Å; W219-A223 HydrophobicContact CZ2-CB 4.07Å; W219-A223 HydrophobicContact CZ3-CB 4.41Å; W219-A223 WeakPolarHBondContact O-CB 3.44Å; W219-A223 PolarHBondContact O-N 2.95Å |
| 220 | L | 94.7 | Very high | 86.7 | Confident | 4 Ų | 4 | 64.1 Ų | 64.1 | 2% | 0.021 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -66.1 | -43 | -179.1 | -168.7 | 69.8 | 0 | 0 | 0 | 111.3 | F165 R168 L172 L216 S217 K218 A223 E224 | F165-L220 HydrophobicContact CD2-CB 4.35Å; F165-L220 HydrophobicContact CD2-CD1 4.19Å; F165-L220 HydrophobicContact CD2-CD2 3.99Å; F165-L220 HydrophobicContact CD2-CG 4.43Å; F165-L220 HydrophobicContact CE2-CB 4.41Å; F165-L220 HydrophobicContact CE2-CD1 4.23Å; R168-L220 HydrophobicContact CB-CD1 3.96Å; R168-L220 HydrophobicContact CB-CD2 4.1Å; R168-L220 HydrophobicContact CB-CG 4.45Å; L172-L220 HydrophobicContact CD1-CD1 4.35Å; L216-L220 VanDerWaalsContact O-CB 3.27Å; L216-L220 WeakPolarHBondContact O-CB 3.24Å; L216-L220 PolarHBondContact O-N 3.24Å; S217-L220 PolarHBondContact O-N 2.92Å; S217-L220 VanDerWaalsContact O-N 3.09Å; K218-L220 VanDerWaalsContact C-N 3.31Å; K218-L220 PolarHBondContact O-N 2.92Å; L220-A223 PolarHBondContact O-N 3.38Å; L220-E224 WeakPolarHBondContact O-CB 3.33Å; L220-E224 WeakPolarHBondContact O-CG 3.3Å; L220-E224 PolarHBondContact O-N 2.88Å |
| 221 | E | 92.6 | Very high | 84.6 | Confident | 119 Ų | 119 | 67 Ų | 67 | 56% | 0.556 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -59.2 | -46 | 175.1 | -71.1 | 163.9 | -148.3 | 0 | 0 | 111.5 | S217 K218 E224 Q225 | S217-E221 WeakPolarHBondContact O-CG 3.3Å; S217-E221 PolarHBondContact O-N 3.09Å; S217-E221 PolarHBondContact OG-OE1 3.07Å; K218-E221 PolarHBondContact O-N 2.99Å; E221-E224 PolarHBondContact O-N 3.4Å; E221-Q225 PolarHBondContact O-N 2.8Å |
| 222 | E | 90.5 | Very high | 82.6 | Confident | 83 Ų | 83 | 68.7 Ų | 68.7 | 39% | 0.388 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.1 | -43.4 | 176.2 | -70.5 | 175.5 | -168.7 | 0 | 0 | 111.8 | V186 K218 W219 E224 Q225 V226 | V186-E222 VanDerWaalsContact CG2-OE2 3.26Å; V186-E222 WeakPolarHBondContact CG2-OE2 3.35Å; K218-E222 WeakPolarHBondContact CE-OE1 3.23Å; K218-E222 WeakPolarHBondContact O-CG 3.42Å; K218-E222 PolarHBondContact O-N 2.91Å; W219-E222 PolarHBondContact O-N 3.43Å; E222-E224 PolarHBondContact O-N 3.18Å; E222-Q225 PolarHBondContact O-N 3.46Å; E222-V226 VanDerWaalsContact O-CG2 3.31Å; E222-V226 WeakPolarHBondContact O-CG2 3.36Å; E222-V226 PolarHBondContact O-N 3.15Å |
| 223 | A | 90.4 | Very high | 80.2 | Confident | 7 Ų | 7 | 77.5 Ų | 77.5 | 6% | 0.058 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -66.5 | -36.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L172 Y174 W219 L220 G227 | L172-A223 HydrophobicContact CD1-CB 4.13Å; Y174-A223 HydrophobicContact CE2-CB 4.35Å; W219-A223 HydrophobicContact CH2-CB 4.11Å; W219-A223 HydrophobicContact CZ2-CB 4.07Å; W219-A223 HydrophobicContact CZ3-CB 4.41Å; W219-A223 WeakPolarHBondContact O-CB 3.44Å; W219-A223 PolarHBondContact O-N 2.95Å; L220-A223 PolarHBondContact O-N 3.38Å; A223-G227 PolarHBondContact O-N 3.34Å |
| 224 | E | 89.5 | Confident | 77.7 | Confident | 62 Ų | 62 | 81 Ų | 81 | 29% | 0.29 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -67.4 | -41 | 174.5 | -74.9 | -173.4 | 138 | 0 | 0 | 111.4 | R168 L172 L220 E221 E222 G227 A228 | R168-E224 WeakPolarHBondContact CD-OE1 3.41Å; R168-E224 IonicContact CZ-OE1 3.91Å; R168-E224 IonicContact CZ-OE2 3.86Å; R168-E224 IonicContact NE-OE1 3.57Å; R168-E224 IonicContact NH1-OE1 3.69Å; R168-E224 IonicContact NH1-OE2 2.99Å; R168-E224 PolarHBondContact NH1-OE2 3.46Å; L172-E224 HydrophobicContact CD1-CG 3.86Å; L220-E224 WeakPolarHBondContact O-CB 3.33Å; L220-E224 WeakPolarHBondContact O-CG 3.3Å; L220-E224 PolarHBondContact O-N 2.88Å; E221-E224 PolarHBondContact O-N 3.4Å; E222-E224 PolarHBondContact O-N 3.18Å; E224-G227 PolarHBondContact O-N 3.03Å; E224-A228 WeakPolarHBondContact O-CB 3.5Å; E224-A228 PolarHBondContact O-N 3.31Å |
| 225 | Q | 87 | Confident | 75.3 | Confident | 124 Ų | 124 | 80.9 Ų | 80.9 | 58% | 0.579 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -64.2 | -42 | 176.4 | -169.3 | 65.1 | 66.2 | 0 | 0 | 112 | E221 E222 L229 | E221-Q225 PolarHBondContact O-N 2.8Å; E222-Q225 PolarHBondContact O-N 3.46Å; Q225-L229 WeakPolarHBondContact O-CG 3.41Å; Q225-L229 PolarHBondContact O-N 2.95Å |
| 226 | V | 81.6 | Confident | 73.1 | Confident | 75 Ų | 75 | 84.1 Ų | 84.1 | 46% | 0.455 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -67.8 | -43.5 | 175.3 | 175.7 | 0 | 0 | 0 | 0 | 110.6 | E222 A228 L229 Y230 | E222-V226 VanDerWaalsContact O-CG2 3.31Å; E222-V226 WeakPolarHBondContact O-CG2 3.36Å; E222-V226 PolarHBondContact O-N 3.15Å; V226-A228 VanDerWaalsContact C-N 3.34Å; V226-A228 PolarHBondContact O-N 2.63Å; V226-L229 PolarHBondContact O-N 3.09Å; V226-Y230 HydrophobicContact CG1-CD2 4.26Å; V226-Y230 HydrophobicContact CG1-CE2 4.35Å; V226-Y230 WeakPolarHBondContact O-CD2 3.47Å; V226-Y230 PolarHBondContact O-N 2.9Å |
| 227 | G | 71.9 | Confident | 70.4 | Confident | 28 Ų | 28 | 90.7 Ų | 90.7 | 29% | 0.289 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.8 | -38.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | A223 E224 L229 Y230 S231 | A223-G227 PolarHBondContact O-N 3.34Å; E224-G227 PolarHBondContact O-N 3.03Å; G227-L229 PolarHBondContact O-N 3.19Å; G227-Y230 PolarHBondContact O-N 2.78Å; G227-S231 VanDerWaalsContact O-CB 3.3Å; G227-S231 WeakPolarHBondContact O-CB 3.45Å; G227-S231 PolarHBondContact O-N 3.11Å |
| 228 | A | 63.4 | Low | 68.2 | Low | 61 Ų | 61 | 96.7 Ų | 96.7 | 50% | 0.504 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.9 | -38.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | E224 V226 Y230 | E224-A228 WeakPolarHBondContact O-CB 3.5Å; E224-A228 PolarHBondContact O-N 3.31Å; V226-A228 VanDerWaalsContact C-N 3.34Å; V226-A228 PolarHBondContact O-N 2.63Å; A228-Y230 PolarHBondContact O-N 3.32Å |
| 229 | L | 60.1 | Low | 66.3 | Low | 129 Ų | 129 | 102.6 Ų | 102.6 | 68% | 0.675 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -71.3 | -27.1 | 179.6 | -68.1 | 171.7 | 0 | 0 | 0 | 113.5 | Q225 V226 G227 | Q225-L229 WeakPolarHBondContact O-CG 3.41Å; Q225-L229 PolarHBondContact O-N 2.95Å; V226-L229 PolarHBondContact O-N 3.09Å; G227-L229 PolarHBondContact O-N 3.19Å |
| 230 | Y | 56 | Low | 64.1 | Low | 188 Ų | 188 | 111.5 Ų | 111.5 | 74% | 0.737 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -93.9 | -18.9 | 178 | -80.7 | -92.1 | 0 | 0 | 0 | 113.7 | V226 G227 A228 E232 | V226-Y230 HydrophobicContact CG1-CD2 4.26Å; V226-Y230 HydrophobicContact CG1-CE2 4.35Å; V226-Y230 WeakPolarHBondContact O-CD2 3.47Å; V226-Y230 PolarHBondContact O-N 2.9Å; G227-Y230 PolarHBondContact O-N 2.78Å; A228-Y230 PolarHBondContact O-N 3.32Å; Y230-E232 VanDerWaalsContact C-N 3.29Å; Y230-E232 PolarHBondContact O-N 3.42Å |
| 231 | S | 51.8 | Low | 62.1 | Low | 95 Ų | 95 | 117.8 Ų | 117.8 | 66% | 0.664 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.6 | -15 | -177.5 | -171.9 | 0 | 0 | 0 | 0 | 114.1 | G227 K233 | G227-S231 VanDerWaalsContact O-CB 3.3Å; G227-S231 WeakPolarHBondContact O-CB 3.45Å; G227-S231 PolarHBondContact O-N 3.11Å; S231-K233 VanDerWaalsContact C-N 3.31Å; S231-K233 PolarHBondContact O-N 3.39Å |
| 232 | E | 48.9 | Very low | 60.2 | Low | 172 Ų | 172 | 122 Ų | 122 | 80% | 0.804 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | -13.1 | -178.1 | -167 | 167.1 | -177.9 | 0 | 0 | 113.4 | Y230 | Y230-E232 VanDerWaalsContact C-N 3.29Å; Y230-E232 PolarHBondContact O-N 3.42Å |
| 233 | K | 44 | Very low | 58.3 | Low | 191 Ų | 191 | 129.5 Ų | 129.5 | 83% | 0.83 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128 | -12.5 | -173.2 | -71 | -165.1 | 177.1 | -173 | 0 | 118.8 | S231 | S231-K233 VanDerWaalsContact C-N 3.31Å; S231-K233 PolarHBondContact O-N 3.39Å |
| 234 | V | 42.7 | Very low | 57.1 | Low | 107 Ų | 107 | 139.6 Ų | 139.6 | 65% | 0.648 | 68% | 0.684 | S | S | * | * | trans | -145.7 | 114.2 | -179.8 | -174.7 | 0 | 0 | 0 | 0 | 111.3 | A236 | V234-A236 PolarHBondContact O-N 3.5Š| ||
| 235 | G | 44.6 | Very low | 56.3 | Low | 67 Ų | 67 | 140.4 Ų | 140.4 | 69% | 0.691 | 69% | 0.693 | S | S | * | * | trans | -57.7 | 130.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | N237 | G235-N237 PolarHBondContact O-N 3.02Å; G235-N237 VanDerWaalsContact O-N 3.12Å | ||
| 236 | A | 47.2 | Very low | 55.9 | Low | 97 Ų | 97 | 140.6 Ų | 140.6 | 80% | 0.802 | 70% | 0.703 | S | S | * | * | trans | 36.7 | 62.9 | 144.1 | 0 | 0 | 0 | 0 | 0 | 117.1 | V234 E238 | V234-A236 PolarHBondContact O-N 3.5Å; A236-E238 PolarHBondContact O-N 3.3Å | ||
| 237 | N | 39.8 | Very low | 56 | Low | 138 Ų | 138 | 139.6 Ų | 139.6 | 74% | 0.738 | 69% | 0.694 | S | S | * | * | trans | -86.6 | 75.3 | 156 | -97.1 | -46.8 | 0 | 0 | 0 | 109.4 | G235 R239 | G235-N237 PolarHBondContact O-N 3.02Å; G235-N237 VanDerWaalsContact O-N 3.12Å; N237-R239 PolarHBondContact O-N 3.23Å | ||
| 238 | E | 48.4 | Very low | 56.9 | Low | 164 Ų | 164 | 141.6 Ų | 141.6 | 77% | 0.766 | 70% | 0.704 | S | S | * | * | trans | -66.4 | 94.9 | 172.2 | -172.1 | 152.8 | -155.5 | 0 | 0 | 109.2 | A236 K240 | A236-E238 PolarHBondContact O-N 3.3Å; E238-K240 VanDerWaalsContact C-N 3.32Å; E238-K240 PolarHBondContact O-N 3.46Å | ||
| 239 | R | 53.1 | Low | 58 | Low | 233 Ų | 233 | 145 Ų | 145 | 88% | 0.879 | 71% | 0.712 | S | S | * | * | trans | -64.9 | 94 | 173 | -67 | -174.4 | -176.5 | 98 | -2.6 | 108.2 | N237 R241 | N237-R239 PolarHBondContact O-N 3.23Å; R239-R241 PolarHBondContact O-N 3.34Å | ||
| 240 | K | 49 | Very low | 59.4 | Low | 198 Ų | 198 | 142.3 Ų | 142.3 | 86% | 0.861 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 116.5 | -177.9 | -76.9 | 174.8 | 178.9 | 171 | 0 | 111.4 | E238 | E238-K240 VanDerWaalsContact C-N 3.32Å; E238-K240 PolarHBondContact O-N 3.46Å |
| 241 | R | 52.7 | Low | 61.1 | Low | 136 Ų | 136 | 133.6 Ų | 133.6 | 51% | 0.513 | 68% | 0.675 | S | S | . | * | P | Polyproline II helix | trans | -67.9 | 141.8 | 172.5 | -172.3 | -178.8 | -177 | 159.7 | -0.2 | 111.4 | T175 R239 R243 | T175-R241 HydrophobicContact CG2-CG 4.1Å; R239-R241 PolarHBondContact O-N 3.34Å; R241-R243 PolarHBondContact O-N 3.09Å |
| 242 | K | 51 | Low | 63 | Low | 207 Ų | 207 | 133.7 Ų | 133.7 | 90% | 0.9 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 127.1 | 171.9 | -129.4 | 155 | 178.9 | 174.3 | 0 | 110.2 | ||
| 243 | R | 52 | Low | 65.1 | Low | 241 Ų | 241 | 129.2 Ų | 129.2 | 91% | 0.909 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 144.6 | -177.7 | -73.5 | -169.4 | 177.7 | -117.4 | 1.1 | 111.3 | R241 | R241-R243 PolarHBondContact O-N 3.09Š|
| 244 | R | 64.3 | Low | 67.5 | Low | 219 Ų | 219 | 120.3 Ų | 120.3 | 83% | 0.826 | 61% | 0.607 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 138.5 | 171.5 | 172.5 | -176.7 | -88.9 | -173.3 | -4.4 | 110 | ||
| 245 | T | 73.7 | Confident | 70.1 | Confident | 78 Ų | 78 | 115.2 Ų | 115.2 | 48% | 0.479 | 58% | 0.577 | S | S | . | * | P | Polyproline II helix | trans | -71.5 | 123.3 | 170.8 | -44.5 | 0 | 0 | 0 | 0 | 110.8 | V283 | T245-V283 HydrophobicContact CG2-CG2 4.26Š|
| 246 | T | 77.5 | Confident | 72.5 | Confident | 128 Ų | 128 | 115.7 Ų | 115.7 | 79% | 0.785 | 56% | 0.561 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 119.7 | 171.4 | 48.5 | 0 | 0 | 0 | 0 | 109.5 | ||
| 247 | I | 84.5 | Confident | 74.7 | Confident | 55 Ų | 55 | 118.1 Ų | 118.1 | 28% | 0.282 | 55% | 0.549 | S | S | . | . | P | Polyproline II helix | trans | -83.7 | 125.7 | 173.6 | -57 | 173.3 | 0 | 0 | 0 | 107.5 | A251 K252 L255 L279 V283 W287 | I247-A251 HydrophobicContact CG2-CB 3.81Å; I247-K252 HydrophobicContact CG2-CB 4.36Å; I247-L255 HydrophobicContact CG2-CD1 4.49Å; I247-L279 HydrophobicContact CG2-CD1 4.12Å; I247-V283 HydrophobicContact CD1-CG1 3.62Å; I247-V283 HydrophobicContact CG1-CG1 3.79Å; I247-W287 HydrophobicContact CD1-CG 4.49Å |
| 248 | S | 89.4 | Confident | 77.3 | Confident | 69 Ų | 69 | 113.8 Ų | 113.8 | 48% | 0.483 | 52% | 0.524 | S | S | . | . | P | Polyproline II helix | trans | -63.5 | 155.5 | 177.2 | 68.5 | 0 | 0 | 0 | 0 | 111.1 | A250 A251 K252 | S248-A250 VanDerWaalsContact C-N 3.3Å; S248-A250 PolarHBondContact O-N 3.46Å; S248-A251 PolarHBondContact O-N 3.12Å; S248-A251 VanDerWaalsContact OG-CB 3.27Å; S248-A251 WeakPolarHBondContact OG-CB 3.29Å; S248-A251 PolarHBondContact OG-N 2.91Å; S248-K252 PolarHBondContact O-N 3.41Å |
| 249 | I | 87.9 | Confident | 79.5 | Confident | 134 Ų | 134 | 106.8 Ų | 106.8 | 69% | 0.687 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -58.8 | -45.7 | 179.3 | -61.3 | 165.7 | 0 | 0 | 0 | 110 | A251 K252 D253 | I249-A251 VanDerWaalsContact C-N 3.34Å; I249-A251 PolarHBondContact O-N 3.11Å; I249-K252 WeakPolarHBondContact O-CB 3.33Å; I249-K252 PolarHBondContact O-N 3.35Å; I249-K252 VanDerWaalsContact O-N 3.11Å; I249-D253 VanDerWaalsContact O-CG 3.27Å; I249-D253 PolarHBondContact O-N 3.42Å |
| 250 | A | 89.1 | Confident | 81.3 | Confident | 71 Ų | 71 | 99 Ų | 99 | 59% | 0.587 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -58.2 | -42.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | S248 D253 A254 | S248-A250 VanDerWaalsContact C-N 3.3Å; S248-A250 PolarHBondContact O-N 3.46Å; A250-D253 PolarHBondContact O-N 3.45Å; A250-A254 PolarHBondContact O-N 3.03Å |
| 251 | A | 91.2 | Very high | 83.3 | Confident | 5 Ų | 5 | 97.2 Ų | 97.2 | 4% | 0.041 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -68.5 | -36.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | I247 S248 I249 A254 L255 L277 L279 | I247-A251 HydrophobicContact CG2-CB 3.81Å; S248-A251 PolarHBondContact O-N 3.12Å; S248-A251 VanDerWaalsContact OG-CB 3.27Å; S248-A251 WeakPolarHBondContact OG-CB 3.29Å; S248-A251 PolarHBondContact OG-N 2.91Å; I249-A251 VanDerWaalsContact C-N 3.34Å; I249-A251 PolarHBondContact O-N 3.11Å; A251-A254 PolarHBondContact O-N 3.07Å; A251-L255 VanDerWaalsContact O-CG 3.23Å; A251-L255 WeakPolarHBondContact O-CG 3.48Å; A251-L255 PolarHBondContact O-N 3.42Å; A251-L277 HydrophobicContact CB-CB 4.41Å; A251-L277 HydrophobicContact CB-CD2 4.43Å; A251-L279 HydrophobicContact CB-CD1 4.14Å |
| 252 | K | 93.2 | Very high | 85 | Confident | 98 Ų | 98 | 94.4 Ų | 94.4 | 43% | 0.426 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62.9 | -45.4 | 174.2 | -173.1 | -169.4 | 171.1 | -140.4 | 0 | 111.3 | I247 S248 I249 A254 L255 E256 | I247-K252 HydrophobicContact CG2-CB 4.36Å; S248-K252 PolarHBondContact O-N 3.41Å; I249-K252 WeakPolarHBondContact O-CB 3.33Å; I249-K252 PolarHBondContact O-N 3.35Å; I249-K252 VanDerWaalsContact O-N 3.11Å; K252-A254 VanDerWaalsContact C-N 3.3Å; K252-A254 PolarHBondContact O-N 2.84Å; K252-L255 PolarHBondContact O-N 3.03Å; K252-E256 WeakPolarHBondContact CE-OE1 3.36Å; K252-E256 IonicContact NZ-OE1 2.7Å; K252-E256 WeakPolarHBondContact O-CG 3.44Å; K252-E256 PolarHBondContact O-N 2.93Å |
| 253 | D | 93 | Very high | 86.9 | Confident | 77 Ų | 77 | 86.8 Ų | 86.8 | 41% | 0.412 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.6 | -37.2 | 180 | -63.1 | -18.9 | 0 | 0 | 0 | 111.6 | I249 A250 E256 R257 | I249-D253 VanDerWaalsContact O-CG 3.27Å; I249-D253 PolarHBondContact O-N 3.42Å; A250-D253 PolarHBondContact O-N 3.45Å; D253-E256 PolarHBondContact O-N 3.18Å; D253-R257 PolarHBondContact O-N 3.1Å |
| 254 | A | 94.3 | Very high | 88.8 | Confident | 5 Ų | 5 | 82.4 Ų | 82.4 | 4% | 0.041 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -62.4 | -46.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A250 A251 K252 E256 R257 H258 L277 | A250-A254 PolarHBondContact O-N 3.03Å; A251-A254 PolarHBondContact O-N 3.07Å; K252-A254 VanDerWaalsContact C-N 3.3Å; K252-A254 PolarHBondContact O-N 2.84Å; A254-E256 VanDerWaalsContact C-N 3.29Å; A254-E256 PolarHBondContact O-N 2.95Å; A254-R257 VanDerWaalsContact CA-NH2 3.32Å; A254-R257 WeakPolarHBondContact O-CB 3.38Å; A254-R257 PolarHBondContact O-N 3.3Å; A254-H258 PolarHBondContact O-CD2 3.41Å; A254-H258 PolarHBondContact O-N 3.01Å; A254-L277 HydrophobicContact CB-CD1 4.25Å; A254-L277 HydrophobicContact CB-CD2 3.6Å |
| 255 | L | 95.6 | Very high | 90.2 | Very high | 0 Ų | 0 | 73 Ų | 73 | 0% | 0 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -61.5 | -36.5 | 175.8 | -69.1 | 168.7 | 0 | 0 | 0 | 112.2 | I247 A251 K252 H258 F259 M273 L277 L279 V284 W287 F288 | I247-L255 HydrophobicContact CG2-CD1 4.49Å; A251-L255 VanDerWaalsContact O-CG 3.23Å; A251-L255 WeakPolarHBondContact O-CG 3.48Å; A251-L255 PolarHBondContact O-N 3.42Å; K252-L255 PolarHBondContact O-N 3.03Å; L255-H258 PolarHBondContact O-N 3.06Å; L255-F259 WeakPolarHBondContact O-CB 3.23Å; L255-F259 PolarHBondContact O-N 3.27Å; L255-M273 HydrophobicContact CD2-SD 4.42Å; L255-L277 HydrophobicContact CD1-CD1 4.32Å; L255-L277 HydrophobicContact CD2-CD1 3.68Å; L255-L277 HydrophobicContact CG-CD1 3.63Å; L255-L279 HydrophobicContact CD1-CD1 4.36Å; L255-V284 HydrophobicContact CD2-CG1 3.8Å; L255-V284 HydrophobicContact CD2-CG2 4.5Å; L255-W287 HydrophobicContact CB-CD2 3.88Å; L255-W287 HydrophobicContact CB-CE3 3.77Å; L255-W287 HydrophobicContact CB-CH2 3.58Å; L255-W287 HydrophobicContact CB-CZ2 3.65Å; L255-W287 HydrophobicContact CB-CZ3 3.63Å; L255-W287 HydrophobicContact CD1-CB 4.42Å; L255-W287 HydrophobicContact CD1-CD2 3.82Å; L255-W287 HydrophobicContact CD1-CE3 4.28Å; L255-W287 HydrophobicContact CD1-CG 3.84Å; L255-W287 HydrophobicContact CD2-CE3 4.41Å; L255-W287 HydrophobicContact CG-CD2 4.36Å; L255-W287 HydrophobicContact CG-CE3 4.38Å; L255-W287 VanDerWaalsContact O-CH2 3.32Å; L255-W287 WeakPolarHBondContact O-CH2 3.42Å; L255-W287 WeakPolarHBondContact O-CZ3 3.33Å; L255-F288 HydrophobicContact CD2-CE2 3.74Å; L255-F288 HydrophobicContact CD2-CZ 4.41Å |
| 256 | E | 95.4 | Very high | 91.2 | Very high | 76 Ų | 76 | 71.6 Ų | 71.6 | 36% | 0.355 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -66 | -40.5 | 174.9 | -71.8 | -171 | -171 | 0 | 0 | 112.7 | K252 D253 A254 F259 G260 W287 | K252-E256 WeakPolarHBondContact CE-OE1 3.36Å; K252-E256 IonicContact NZ-OE1 2.7Å; K252-E256 WeakPolarHBondContact O-CG 3.44Å; K252-E256 PolarHBondContact O-N 2.93Å; D253-E256 PolarHBondContact O-N 3.18Å; A254-E256 VanDerWaalsContact C-N 3.29Å; A254-E256 PolarHBondContact O-N 2.95Å; E256-F259 PolarHBondContact O-N 2.91Å; E256-G260 PolarHBondContact O-N 3.37Å; E256-G260 VanDerWaalsContact O-N 3.08Å; E256-W287 HydrophobicContact CG-CH2 3.88Å; E256-W287 HydrophobicContact CG-CZ2 3.68Å |
| 257 | R | 94.4 | Very high | 92.1 | Very high | 149 Ų | 149 | 69 Ų | 69 | 56% | 0.562 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -60.1 | -48.1 | 172 | -86.1 | -175.6 | -77.4 | 97.9 | -6.4 | 112.2 | D253 A254 F259 G260 Q261 | D253-R257 PolarHBondContact O-N 3.1Å; A254-R257 VanDerWaalsContact CA-NH2 3.32Å; A254-R257 WeakPolarHBondContact O-CB 3.38Å; A254-R257 PolarHBondContact O-N 3.3Å; R257-F259 VanDerWaalsContact C-N 3.3Å; R257-F259 PolarHBondContact O-N 2.97Å; R257-G260 PolarHBondContact O-N 3.43Å; R257-Q261 PolarHBondContact O-N 2.81Å |
| 258 | H | 94.1 | Very high | 92.6 | Very high | 47 Ų | 47 | 73.1 Ų | 73.1 | 22% | 0.218 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -62.7 | -38 | 176.7 | -74.4 | -70.1 | 0 | 0 | 0 | 112.1 | A254 L255 G260 Q261 Q262 M273 F288 | A254-H258 PolarHBondContact O-CD2 3.41Å; A254-H258 PolarHBondContact O-N 3.01Å; L255-H258 PolarHBondContact O-N 3.06Å; H258-G260 VanDerWaalsContact C-N 3.31Å; H258-G260 PolarHBondContact O-N 3.19Å; H258-Q261 PolarHBondContact O-N 3.4Å; H258-Q262 PolarHBondContact O-N 3.24Å; H258-M273 HydrophobicContact CB-SD 3.65Å; H258-M273 VanDerWaalsContact CG-SD 3.58Å; H258-F288 HydrophobicContact CB-CZ 4.12Å |
| 259 | F | 94.8 | Very high | 92.8 | Very high | 17 Ų | 17 | 72.1 Ų | 72.1 | 8% | 0.075 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -62 | -37.4 | 176.4 | -173.7 | -90 | 0 | 0 | 0 | 112.9 | L255 E256 R257 Q261 Q262 S263 W287 F288 R291 R292 | L255-F259 WeakPolarHBondContact O-CB 3.23Å; L255-F259 PolarHBondContact O-N 3.27Å; E256-F259 PolarHBondContact O-N 2.91Å; R257-F259 VanDerWaalsContact C-N 3.3Å; R257-F259 PolarHBondContact O-N 2.97Å; F259-Q261 VanDerWaalsContact C-N 3.29Å; F259-Q261 PolarHBondContact O-N 3.48Å; F259-Q262 CarbonylContact O-C 3.45Å; F259-S263 PolarHBondContact O-N 2.92Å; F259-W287 HydrophobicContact CB-CH2 4.11Å; F259-W287 HydrophobicContact CB-CZ3 4.06Å; F259-W287 HydrophobicContact CD2-CZ3 4.3Å; F259-W287 HydrophobicContact CG-CZ3 4.49Å; F259-F288 HydrophobicContact CB-CE1 4.07Å; F259-F288 AromaticContact CD2-CD1 3.77Å; F259-F288 HydrophobicContact CD2-CD1 3.77Å; F259-F288 AromaticContact CD2-CE1 3.97Å; F259-F288 HydrophobicContact CD2-CE1 3.97Å; F259-R291 HydrophobicContact CD1-CG 4.05Å; F259-R291 HydrophobicContact CD2-CB 4.16Å; F259-R291 HydrophobicContact CD2-CG 3.61Å; F259-R291 HydrophobicContact CE1-CG 4.09Å; F259-R291 HydrophobicContact CE2-CB 4.07Å; F259-R291 HydrophobicContact CE2-CG 3.66Å; F259-R291 HydrophobicContact CG-CG 3.82Å; F259-R291 HydrophobicContact CZ-CG 3.91Å; F259-R292 HydrophobicContact CE2-CB 4.25Å |
| 260 | G | 90.3 | Very high | 93.2 | Very high | 69 Ų | 69 | 66.5 Ų | 66.5 | 71% | 0.711 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -63.9 | -33.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | E256 R257 H258 | E256-G260 PolarHBondContact O-N 3.37Å; E256-G260 VanDerWaalsContact O-N 3.08Å; R257-G260 PolarHBondContact O-N 3.43Å; H258-G260 VanDerWaalsContact C-N 3.31Å; H258-G260 PolarHBondContact O-N 3.19Å |
| 261 | Q | 91.8 | Very high | 93.5 | Very high | 160 Ų | 160 | 67.2 Ų | 67.2 | 75% | 0.748 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -79.8 | -45.9 | 175.9 | -62.3 | 173 | 7.2 | 0 | 0 | 111.4 | R257 H258 F259 | R257-Q261 PolarHBondContact O-N 2.81Å; H258-Q261 PolarHBondContact O-N 3.4Å; F259-Q261 VanDerWaalsContact C-N 3.29Å; F259-Q261 PolarHBondContact O-N 3.48Å |
| 262 | Q | 87.4 | Confident | 93.7 | Very high | 77 Ų | 77 | 73.5 Ų | 73.5 | 36% | 0.36 | 37% | 0.371 | S | S | . | . | trans | -145.7 | 105.8 | -176.2 | -170.2 | -177.7 | -8.4 | 0 | 0 | 111.4 | H258 F259 K264 E269 | H258-Q262 PolarHBondContact O-N 3.24Å; F259-Q262 CarbonylContact O-C 3.45Å; Q262-K264 PolarHBondContact NE2-O 3.26Å; Q262-K264 PolarHBondContact O-N 3.33Å; Q262-E269 PolarHBondContact NE2-OE2 3.26Å; Q262-E269 VanDerWaalsContact OE1-CD 3.31Å; Q262-E269 PolarHBondContact OE1-OE1 2.88Å; Q262-E269 PolarHBondContact OE1-OE2 3.07Å | ||
| 263 | S | 90.4 | Very high | 93.8 | Very high | 47 Ų | 47 | 69.3 Ų | 69.3 | 33% | 0.329 | 35% | 0.353 | S | S | . | . | S | Bend | trans | -74.9 | -10.6 | -179.4 | 64.2 | 0 | 0 | 0 | 0 | 114.7 | F259 | F259-S263 PolarHBondContact O-N 2.92Š|
| 264 | K | 92.7 | Very high | 93.9 | Very high | 150 Ų | 150 | 66 Ų | 66 | 65% | 0.652 | 34% | 0.336 | S | S | * | . | S | Bend | trans | -133.4 | 74.8 | 178.5 | -65.6 | -178.1 | -175.7 | 174.6 | 0 | 110.1 | Q262 | Q262-K264 PolarHBondContact NE2-O 3.26Å; Q262-K264 PolarHBondContact O-N 3.33Å |
| 265 | P | 93.1 | Very high | 94 | Very high | 20 Ų | 20 | 72.2 Ų | 72.2 | 13% | 0.13 | 36% | 0.364 | C | S | . | . | trans | -64 | 143.5 | 174.9 | 28.9 | -35.9 | 0 | 0 | 0 | 110.8 | E269 I270 M273 F288 | P265-E269 WeakPolarHBondContact CA-OE2 3.46Å; P265-E269 HydrophobicContact CB-CB 3.86Å; P265-I270 HydrophobicContact CB-CG1 4Å; P265-I270 HydrophobicContact CG-CD1 4.23Å; P265-I270 HydrophobicContact CG-CG1 3.8Å; P265-M273 HydrophobicContact CB-CE 3.71Å; P265-M273 HydrophobicContact CG-CE 3.96Å; P265-F288 VanDerWaalsContact CD-CD1 3.42Å; P265-F288 HydrophobicContact CG-CB 4.39Å; P265-F288 HydrophobicContact CG-CD1 3.55Å; P265-F288 HydrophobicContact CG-CD2 3.87Å; P265-F288 HydrophobicContact CG-CE1 3.67Å; P265-F288 HydrophobicContact CG-CE2 4Å; P265-F288 HydrophobicContact CG-CG 3.67Å; P265-F288 HydrophobicContact CG-CZ 3.91Å | ||
| 266 | S | 96.1 | Very high | 93.9 | Very high | 49 Ų | 49 | 78.8 Ų | 78.8 | 34% | 0.343 | 40% | 0.395 | S | S | . | . | trans | -67.1 | 164.9 | 169.9 | 67 | 0 | 0 | 0 | 0 | 111.4 | Q268 E269 I270 | S266-Q268 PolarHBondContact O-N 3.36Å; S266-E269 VanDerWaalsContact CB-OE2 3.3Å; S266-E269 WeakPolarHBondContact CB-OE2 3.21Å; S266-E269 PolarHBondContact N-OE2 3.17Å; S266-E269 PolarHBondContact O-N 2.88Å; S266-E269 VanDerWaalsContact O-N 3.17Å; S266-E269 WeakPolarHBondContact OG-CG 3.42Å; S266-E269 PolarHBondContact OG-N 3.19Å; S266-E269 PolarHBondContact OG-OE2 3.26Å; S266-I270 WeakPolarHBondContact O-CG1 3.42Å; S266-I270 PolarHBondContact O-N 3.47Å | ||
| 267 | S | 94.8 | Very high | 93.8 | Very high | 73 Ų | 73 | 76.8 Ų | 76.8 | 51% | 0.51 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -57.8 | -36 | 176.9 | -175.1 | 0 | 0 | 0 | 0 | 112.5 | M271 K281 | S267-M271 PolarHBondContact O-N 3.12Å; S267-M271 VanDerWaalsContact O-N 3.1Å; S267-K281 PolarHBondContact OG-NZ 3.05Å |
| 268 | Q | 95.2 | Very high | 93.8 | Very high | 143 Ų | 143 | 76.9 Ų | 76.9 | 67% | 0.668 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -69.8 | -40.8 | 177.4 | -71.7 | -178.2 | -13.1 | 0 | 0 | 111.8 | S266 M271 R272 | S266-Q268 PolarHBondContact O-N 3.36Å; Q268-M271 WeakPolarHBondContact O-CB 3.39Å; Q268-M271 PolarHBondContact O-N 3.43Å; Q268-R272 WeakPolarHBondContact O-CG 3.39Å; Q268-R272 PolarHBondContact O-N 3.18Å |
| 269 | E | 94.2 | Very high | 93.7 | Very high | 47 Ų | 47 | 76 Ų | 76 | 22% | 0.22 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -65 | -40.7 | 175.2 | -76.8 | 154.2 | 167.8 | 0 | 0 | 112.1 | Q262 P265 S266 M271 R272 M273 | Q262-E269 PolarHBondContact NE2-OE2 3.26Å; Q262-E269 VanDerWaalsContact OE1-CD 3.31Å; Q262-E269 PolarHBondContact OE1-OE1 2.88Å; Q262-E269 PolarHBondContact OE1-OE2 3.07Å; P265-E269 WeakPolarHBondContact CA-OE2 3.46Å; P265-E269 HydrophobicContact CB-CB 3.86Å; S266-E269 VanDerWaalsContact CB-OE2 3.3Å; S266-E269 WeakPolarHBondContact CB-OE2 3.21Å; S266-E269 PolarHBondContact N-OE2 3.17Å; S266-E269 PolarHBondContact O-N 2.88Å; S266-E269 VanDerWaalsContact O-N 3.17Å; S266-E269 WeakPolarHBondContact OG-CG 3.42Å; S266-E269 PolarHBondContact OG-N 3.19Å; S266-E269 PolarHBondContact OG-OE2 3.26Å; E269-M271 VanDerWaalsContact C-N 3.27Å; E269-M271 PolarHBondContact O-N 3.42Å; E269-R272 PolarHBondContact O-N 3.13Å; E269-R272 IonicContact OE1-NH2 3.63Å; E269-M273 HydrophobicContact CB-CE 4.38Å; E269-M273 WeakPolarHBondContact O-CE 3.2Å; E269-M273 WeakPolarHBondContact O-CG 3.35Å; E269-M273 PolarHBondContact O-N 3.38Å |
| 270 | I | 95.6 | Very high | 93.6 | Very high | 17 Ų | 17 | 81.3 Ų | 81.3 | 9% | 0.087 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -60.3 | -40.4 | 174.7 | -66.5 | 170.7 | 0 | 0 | 0 | 110.8 | P265 S266 M273 A274 K281 V284 R285 | P265-I270 HydrophobicContact CB-CG1 4Å; P265-I270 HydrophobicContact CG-CD1 4.23Å; P265-I270 HydrophobicContact CG-CG1 3.8Å; S266-I270 WeakPolarHBondContact O-CG1 3.42Å; S266-I270 PolarHBondContact O-N 3.47Å; I270-M273 HydrophobicContact CG1-CE 4.33Å; I270-A274 VanDerWaalsContact O-CB 3.24Å; I270-A274 WeakPolarHBondContact O-CB 3.41Å; I270-A274 PolarHBondContact O-N 3.22Å; I270-K281 HydrophobicContact CG2-CG 3.9Å; I270-V284 HydrophobicContact CG2-CB 4.09Å; I270-V284 HydrophobicContact CG2-CG1 3.98Å; I270-R285 HydrophobicContact CD1-CB 4.34Å; I270-R285 HydrophobicContact CD1-CG 4.16Å; I270-R285 HydrophobicContact CG2-CB 4.19Å |
| 271 | M | 95.2 | Very high | 93.8 | Very high | 85 Ų | 85 | 82.2 Ų | 82.2 | 42% | 0.419 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -63.5 | -48.9 | 176.4 | -177 | -179.2 | -71.9 | 0 | 0 | 111.3 | S267 Q268 E269 M273 A274 E275 | S267-M271 PolarHBondContact O-N 3.12Å; S267-M271 VanDerWaalsContact O-N 3.1Å; Q268-M271 WeakPolarHBondContact O-CB 3.39Å; Q268-M271 PolarHBondContact O-N 3.43Å; E269-M271 VanDerWaalsContact C-N 3.27Å; E269-M271 PolarHBondContact O-N 3.42Å; M271-M273 PolarHBondContact O-N 2.99Å; M271-A274 WeakPolarHBondContact O-CB 3.47Å; M271-A274 PolarHBondContact O-N 2.99Å; M271-A274 VanDerWaalsContact O-N 3.14Å; M271-E275 WeakPolarHBondContact CG-OE1 3.49Å; M271-E275 WeakPolarHBondContact O-CG 3.29Å; M271-E275 PolarHBondContact O-N 3.04Å |
| 272 | R | 95.9 | Very high | 93.8 | Very high | 138 Ų | 138 | 78.6 Ų | 78.6 | 52% | 0.521 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -59.5 | -44.9 | 178 | -68 | -165.2 | -57.1 | -95.2 | 7.7 | 112.7 | Q268 E269 A274 E275 E276 | Q268-R272 WeakPolarHBondContact O-CG 3.39Å; Q268-R272 PolarHBondContact O-N 3.18Å; E269-R272 PolarHBondContact O-N 3.13Å; E269-R272 IonicContact OE1-NH2 3.63Å; R272-A274 VanDerWaalsContact C-N 3.31Å; R272-A274 PolarHBondContact O-N 3.05Å; R272-E275 PolarHBondContact O-N 3.43Å; R272-E276 WeakPolarHBondContact O-CB 3.42Å; R272-E276 PolarHBondContact O-N 3.22Å |
| 273 | M | 95.4 | Very high | 94.1 | Very high | 10 Ų | 10 | 76 Ų | 76 | 5% | 0.049 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -65.2 | -35.2 | 176.9 | -71.8 | -177 | -71.8 | 0 | 0 | 112.4 | L255 H258 P265 E269 I270 M271 L277 V284 F288 | L255-M273 HydrophobicContact CD2-SD 4.42Å; H258-M273 HydrophobicContact CB-SD 3.65Å; H258-M273 VanDerWaalsContact CG-SD 3.58Å; P265-M273 HydrophobicContact CB-CE 3.71Å; P265-M273 HydrophobicContact CG-CE 3.96Å; E269-M273 HydrophobicContact CB-CE 4.38Å; E269-M273 WeakPolarHBondContact O-CE 3.2Å; E269-M273 WeakPolarHBondContact O-CG 3.35Å; E269-M273 PolarHBondContact O-N 3.38Å; I270-M273 HydrophobicContact CG1-CE 4.33Å; M271-M273 PolarHBondContact O-N 2.99Å; M273-L277 VanDerWaalsContact O-CB 3.26Å; M273-L277 WeakPolarHBondContact O-CB 3.49Å; M273-L277 WeakPolarHBondContact O-CG 3.45Å; M273-L277 PolarHBondContact O-N 3.12Å; M273-V284 HydrophobicContact CB-CG1 4.21Å; M273-V284 HydrophobicContact CE-CG1 4.28Å; M273-F288 HydrophobicContact CE-CD2 4.34Å; M273-F288 HydrophobicContact CE-CE2 3.41Å; M273-F288 VanDerWaalsContact CE-CE2 3.41Å; M273-F288 HydrophobicContact CE-CZ 3.63Å; M273-F288 HydrophobicContact SD-CE2 3.74Å; M273-F288 HydrophobicContact SD-CZ 3.68Å |
| 274 | A | 95.6 | Very high | 94.3 | Very high | 7 Ų | 7 | 73.8 Ų | 73.8 | 6% | 0.058 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -65.6 | -41.7 | 177 | 0 | 0 | 0 | 0 | 0 | 111.4 | I270 M271 R272 N278 L279 K281 V284 | I270-A274 VanDerWaalsContact O-CB 3.24Å; I270-A274 WeakPolarHBondContact O-CB 3.41Å; I270-A274 PolarHBondContact O-N 3.22Å; M271-A274 WeakPolarHBondContact O-CB 3.47Å; M271-A274 PolarHBondContact O-N 2.99Å; M271-A274 VanDerWaalsContact O-N 3.14Å; R272-A274 VanDerWaalsContact C-N 3.31Å; R272-A274 PolarHBondContact O-N 3.05Å; A274-N278 CarbonylContact O-C 3.37Å; A274-N278 WeakPolarHBondContact O-CA 3.47Å; A274-N278 PolarHBondContact O-N 3.05Å; A274-L279 CarbonylContact C-O 3.58Å; A274-L279 WeakPolarHBondContact CB-O 3.33Å; A274-L279 PolarHBondContact O-N 3.46Å; A274-K281 HydrophobicContact CB-CB 4.46Å; A274-V284 HydrophobicContact CB-CG2 3.94Å |
| 275 | E | 96 | Very high | 94.5 | Very high | 136 Ų | 136 | 71.5 Ų | 71.5 | 64% | 0.636 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -66.3 | -47.9 | 175.3 | -70 | 165.5 | -169.8 | 0 | 0 | 111.9 | M271 R272 L277 N278 | M271-E275 WeakPolarHBondContact CG-OE1 3.49Å; M271-E275 WeakPolarHBondContact O-CG 3.29Å; M271-E275 PolarHBondContact O-N 3.04Å; R272-E275 PolarHBondContact O-N 3.43Å; E275-L277 VanDerWaalsContact C-N 3.32Å; E275-L277 PolarHBondContact O-N 3.36Å; E275-N278 PolarHBondContact O-N 2.92Å |
| 276 | E | 93.9 | Very high | 94.5 | Very high | 137 Ų | 137 | 73 Ų | 73 | 64% | 0.64 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -61.4 | -39.3 | 179.4 | -174.9 | -178.5 | 172.4 | 0 | 0 | 112.5 | R272 | R272-E276 WeakPolarHBondContact O-CB 3.42Å; R272-E276 PolarHBondContact O-N 3.22Å |
| 277 | L | 93.4 | Very high | 94.5 | Very high | 34 Ų | 34 | 72.1 Ų | 72.1 | 18% | 0.178 | 35% | 0.346 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.1 | -0.2 | -177.8 | -58.1 | 177.2 | 0 | 0 | 0 | 113.4 | A251 A254 L255 M273 E275 L279 | A251-L277 HydrophobicContact CB-CB 4.41Å; A251-L277 HydrophobicContact CB-CD2 4.43Å; A254-L277 HydrophobicContact CB-CD1 4.25Å; A254-L277 HydrophobicContact CB-CD2 3.6Å; L255-L277 HydrophobicContact CD1-CD1 4.32Å; L255-L277 HydrophobicContact CD2-CD1 3.68Å; L255-L277 HydrophobicContact CG-CD1 3.63Å; M273-L277 VanDerWaalsContact O-CB 3.26Å; M273-L277 WeakPolarHBondContact O-CB 3.49Å; M273-L277 WeakPolarHBondContact O-CG 3.45Å; M273-L277 PolarHBondContact O-N 3.12Å; E275-L277 VanDerWaalsContact C-N 3.32Å; E275-L277 PolarHBondContact O-N 3.36Å; L277-L279 VanDerWaalsContact C-N 3.26Å; L277-L279 HydrophobicContact CB-CD1 4.04Å; L277-L279 HydrophobicContact CB-CG 4.05Å; L277-L279 HydrophobicContact CD1-CD1 4.45Å; L277-L279 PolarHBondContact O-N 3.26Å |
| 278 | N | 93.8 | Very high | 94.5 | Very high | 152 Ų | 152 | 68.8 Ų | 68.8 | 81% | 0.813 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.5 | 46.5 | -173.8 | -161.5 | 51.7 | 0 | 0 | 0 | 112.8 | A274 E275 | A274-N278 CarbonylContact O-C 3.37Å; A274-N278 WeakPolarHBondContact O-CA 3.47Å; A274-N278 PolarHBondContact O-N 3.05Å; E275-N278 PolarHBondContact O-N 2.92Å |
| 279 | L | 92.6 | Very high | 94.4 | Very high | 28 Ų | 28 | 63.5 Ų | 63.5 | 15% | 0.147 | 30% | 0.301 | C | S | . | . | trans | -114.9 | 157.2 | 177.6 | -66 | 177.6 | 0 | 0 | 0 | 110.2 | I247 A251 L255 A274 L277 V284 | I247-L279 HydrophobicContact CG2-CD1 4.12Å; A251-L279 HydrophobicContact CB-CD1 4.14Å; L255-L279 HydrophobicContact CD1-CD1 4.36Å; A274-L279 CarbonylContact C-O 3.58Å; A274-L279 WeakPolarHBondContact CB-O 3.33Å; A274-L279 PolarHBondContact O-N 3.46Å; L277-L279 VanDerWaalsContact C-N 3.26Å; L277-L279 HydrophobicContact CB-CD1 4.04Å; L277-L279 HydrophobicContact CB-CG 4.05Å; L277-L279 HydrophobicContact CD1-CD1 4.45Å; L277-L279 PolarHBondContact O-N 3.26Å; L279-V284 HydrophobicContact CB-CG2 3.98Å; L279-V284 HydrophobicContact CD1-CG2 4.21Å | ||
| 280 | E | 91.7 | Very high | 94.3 | Very high | 128 Ų | 128 | 65.5 Ų | 65.5 | 60% | 0.598 | 31% | 0.313 | S | S | * | . | trans | -67.8 | 139.8 | 171.2 | -171.9 | 178.5 | -177.8 | 0 | 0 | 110.5 | E282 V283 V284 | E280-E282 HydrophobicContact CG-CB 4.32Å; E280-E282 PolarHBondContact O-N 3.42Å; E280-E282 VanDerWaalsContact O-N 3.09Å; E280-V283 HydrophobicContact CB-CB 4.46Å; E280-V283 HydrophobicContact CB-CG2 3.99Å; E280-V283 WeakPolarHBondContact O-CB 3.45Å; E280-V283 PolarHBondContact O-N 3.36Å; E280-V284 PolarHBondContact O-N 2.9Å | ||
| 281 | K | 94.3 | Very high | 94.2 | Very high | 88 Ų | 88 | 68.1 Ų | 68.1 | 38% | 0.383 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -48.9 | -40.6 | 177.4 | -175.2 | -174.8 | 177.5 | 178.9 | 0 | 112.5 | S267 I270 A274 V284 R285 | S267-K281 PolarHBondContact OG-NZ 3.05Å; I270-K281 HydrophobicContact CG2-CG 3.9Å; A274-K281 HydrophobicContact CB-CB 4.46Å; K281-V284 PolarHBondContact O-N 3.32Å; K281-R285 WeakPolarHBondContact O-CB 3.31Å; K281-R285 PolarHBondContact O-N 2.9Å |
| 282 | E | 92.3 | Very high | 94 | Very high | 84 Ų | 84 | 67.2 Ų | 67.2 | 39% | 0.393 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -67.9 | -36.4 | -179.4 | -175.6 | 56.7 | -162.8 | 0 | 0 | 112.4 | E280 R285 V286 | E280-E282 HydrophobicContact CG-CB 4.32Å; E280-E282 PolarHBondContact O-N 3.42Å; E280-E282 VanDerWaalsContact O-N 3.09Å; E282-R285 PolarHBondContact O-N 3.49Å; E282-R285 IonicContact OE1-CZ 3.62Å; E282-R285 IonicContact OE1-NE 2.78Å; E282-R285 PolarHBondContact OE1-NE 3.4Å; E282-R285 IonicContact OE1-NH2 3.31Å; E282-R285 PolarHBondContact OE1-NH2 2.84Å; E282-R285 IonicContact OE2-CZ 3.66Å; E282-R285 IonicContact OE2-NE 3.37Å; E282-R285 PolarHBondContact OE2-NE 3.33Å; E282-R285 IonicContact OE2-NH2 3.99Å; E282-V286 HydrophobicContact CG-CG2 4.34Å; E282-V286 WeakPolarHBondContact O-CB 3.37Å; E282-V286 VanDerWaalsContact O-CG2 3.23Å; E282-V286 WeakPolarHBondContact O-CG2 3.5Å; E282-V286 PolarHBondContact O-N 3.05Å; E282-V286 WeakPolarHBondContact OE1-CG2 3.32Å |
| 283 | V | 93.6 | Very high | 93.3 | Very high | 24 Ų | 24 | 65.9 Ų | 65.9 | 15% | 0.145 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -62.7 | -46.1 | 176.2 | 174 | 0 | 0 | 0 | 0 | 110.3 | T245 I247 E280 W287 | T245-V283 HydrophobicContact CG2-CG2 4.26Å; I247-V283 HydrophobicContact CD1-CG1 3.62Å; I247-V283 HydrophobicContact CG1-CG1 3.79Å; E280-V283 HydrophobicContact CB-CB 4.46Å; E280-V283 HydrophobicContact CB-CG2 3.99Å; E280-V283 WeakPolarHBondContact O-CB 3.45Å; E280-V283 PolarHBondContact O-N 3.36Å; V283-W287 VanDerWaalsContact O-CB 3.3Å; V283-W287 WeakPolarHBondContact O-CB 3.41Å; V283-W287 PolarHBondContact O-N 3.49Å |
| 284 | V | 95.1 | Very high | 92.8 | Very high | 0 Ų | 0 | 73 Ų | 73 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -64 | -46.6 | 177.5 | 179.5 | 0 | 0 | 0 | 0 | 110.7 | L255 I270 M273 A274 L279 E280 K281 V286 W287 F288 | L255-V284 HydrophobicContact CD2-CG1 3.8Å; L255-V284 HydrophobicContact CD2-CG2 4.5Å; I270-V284 HydrophobicContact CG2-CB 4.09Å; I270-V284 HydrophobicContact CG2-CG1 3.98Å; M273-V284 HydrophobicContact CB-CG1 4.21Å; M273-V284 HydrophobicContact CE-CG1 4.28Å; A274-V284 HydrophobicContact CB-CG2 3.94Å; L279-V284 HydrophobicContact CB-CG2 3.98Å; L279-V284 HydrophobicContact CD1-CG2 4.21Å; E280-V284 PolarHBondContact O-N 2.9Å; K281-V284 PolarHBondContact O-N 3.32Å; V284-V286 PolarHBondContact O-N 2.74Å; V284-W287 WeakPolarHBondContact O-CB 3.39Å; V284-W287 PolarHBondContact O-N 2.84Å; V284-F288 HydrophobicContact CG1-CD2 3.94Å; V284-F288 HydrophobicContact CG1-CE2 3.85Å; V284-F288 WeakPolarHBondContact O-CD2 3.49Å; V284-F288 PolarHBondContact O-N 2.72Å |
| 285 | R | 96 | Very high | 92.2 | Very high | 102 Ų | 102 | 75.3 Ų | 75.3 | 39% | 0.385 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -57.6 | -48.9 | 177.5 | -170 | -163.9 | 71.9 | 77.5 | 0.3 | 112.2 | I270 K281 E282 W287 F288 C289 | I270-R285 HydrophobicContact CD1-CB 4.34Å; I270-R285 HydrophobicContact CD1-CG 4.16Å; I270-R285 HydrophobicContact CG2-CB 4.19Å; K281-R285 WeakPolarHBondContact O-CB 3.31Å; K281-R285 PolarHBondContact O-N 2.9Å; E282-R285 PolarHBondContact O-N 3.49Å; E282-R285 IonicContact OE1-CZ 3.62Å; E282-R285 IonicContact OE1-NE 2.78Å; E282-R285 PolarHBondContact OE1-NE 3.4Å; E282-R285 IonicContact OE1-NH2 3.31Å; E282-R285 PolarHBondContact OE1-NH2 2.84Å; E282-R285 IonicContact OE2-CZ 3.66Å; E282-R285 IonicContact OE2-NE 3.37Å; E282-R285 PolarHBondContact OE2-NE 3.33Å; E282-R285 IonicContact OE2-NH2 3.99Å; R285-W287 VanDerWaalsContact C-N 3.31Å; R285-W287 PolarHBondContact O-N 3.38Å; R285-F288 PolarHBondContact O-N 3.41Å; R285-C289 PolarHBondContact O-N 3.01Å; R285-C289 VanDerWaalsContact O-N 3.12Å; R285-C289 PolarHBondContact O-SG 3.3Å |
| 286 | V | 94.1 | Very high | 91.3 | Very high | 50 Ų | 50 | 75.5 Ų | 75.5 | 30% | 0.303 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -64.1 | -38 | 178.6 | 170.6 | 0 | 0 | 0 | 0 | 110.8 | E282 V284 C289 N290 | E282-V286 HydrophobicContact CG-CG2 4.34Å; E282-V286 WeakPolarHBondContact O-CB 3.37Å; E282-V286 VanDerWaalsContact O-CG2 3.23Å; E282-V286 WeakPolarHBondContact O-CG2 3.5Å; E282-V286 PolarHBondContact O-N 3.05Å; E282-V286 WeakPolarHBondContact OE1-CG2 3.32Å; V284-V286 PolarHBondContact O-N 2.74Å; V286-C289 WeakPolarHBondContact O-CB 3.32Å; V286-C289 PolarHBondContact O-N 3.19Å; V286-N290 WeakPolarHBondContact O-CB 3.43Å; V286-N290 VanDerWaalsContact O-CG 3.32Å; V286-N290 PolarHBondContact O-N 3.42Å |
| 287 | W | 95.3 | Very high | 90.2 | Very high | 32 Ų | 32 | 75.8 Ų | 75.8 | 12% | 0.121 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -59.1 | -49.2 | 175.7 | -173.9 | 99.3 | 0 | 0 | 0 | 111.7 | I247 L255 E256 F259 V283 V284 R285 C289 N290 R291 | I247-W287 HydrophobicContact CD1-CG 4.49Å; L255-W287 HydrophobicContact CB-CD2 3.88Å; L255-W287 HydrophobicContact CB-CE3 3.77Å; L255-W287 HydrophobicContact CB-CH2 3.58Å; L255-W287 HydrophobicContact CB-CZ2 3.65Å; L255-W287 HydrophobicContact CB-CZ3 3.63Å; L255-W287 HydrophobicContact CD1-CB 4.42Å; L255-W287 HydrophobicContact CD1-CD2 3.82Å; L255-W287 HydrophobicContact CD1-CE3 4.28Å; L255-W287 HydrophobicContact CD1-CG 3.84Å; L255-W287 HydrophobicContact CD2-CE3 4.41Å; L255-W287 HydrophobicContact CG-CD2 4.36Å; L255-W287 HydrophobicContact CG-CE3 4.38Å; L255-W287 VanDerWaalsContact O-CH2 3.32Å; L255-W287 WeakPolarHBondContact O-CH2 3.42Å; L255-W287 WeakPolarHBondContact O-CZ3 3.33Å; E256-W287 HydrophobicContact CG-CH2 3.88Å; E256-W287 HydrophobicContact CG-CZ2 3.68Å; F259-W287 HydrophobicContact CB-CH2 4.11Å; F259-W287 HydrophobicContact CB-CZ3 4.06Å; F259-W287 HydrophobicContact CD2-CZ3 4.3Å; F259-W287 HydrophobicContact CG-CZ3 4.49Å; V283-W287 VanDerWaalsContact O-CB 3.3Å; V283-W287 WeakPolarHBondContact O-CB 3.41Å; V283-W287 PolarHBondContact O-N 3.49Å; V284-W287 WeakPolarHBondContact O-CB 3.39Å; V284-W287 PolarHBondContact O-N 2.84Å; R285-W287 VanDerWaalsContact C-N 3.31Å; R285-W287 PolarHBondContact O-N 3.38Å; W287-C289 VanDerWaalsContact C-N 3.34Å; W287-C289 PolarHBondContact O-N 3.47Å; W287-N290 PolarHBondContact O-N 3.08Å; W287-R291 HydrophobicContact CE3-CB 4.2Å; W287-R291 HydrophobicContact CH2-CB 4.12Å; W287-R291 HydrophobicContact CH2-CG 3.78Å; W287-R291 HydrophobicContact CZ2-CB 4.46Å; W287-R291 HydrophobicContact CZ2-CG 4.3Å; W287-R291 HydrophobicContact CZ3-CB 3.99Å; W287-R291 HydrophobicContact CZ3-CG 4.03Å; W287-R291 VanDerWaalsContact O-CB 3.29Å; W287-R291 WeakPolarHBondContact O-CB 3.35Å; W287-R291 PolarHBondContact O-N 2.85Å |
| 288 | F | 96 | Very high | 89.1 | Confident | 3 Ų | 3 | 77.6 Ų | 77.6 | 1% | 0.013 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -63.1 | -38.4 | 177.9 | -86 | -87.3 | 0 | 0 | 0 | 112.5 | L255 H258 F259 P265 M273 V284 R285 R292 | L255-F288 HydrophobicContact CD2-CE2 3.74Å; L255-F288 HydrophobicContact CD2-CZ 4.41Å; H258-F288 HydrophobicContact CB-CZ 4.12Å; F259-F288 HydrophobicContact CB-CE1 4.07Å; F259-F288 AromaticContact CD2-CD1 3.77Å; F259-F288 HydrophobicContact CD2-CD1 3.77Å; F259-F288 AromaticContact CD2-CE1 3.97Å; F259-F288 HydrophobicContact CD2-CE1 3.97Å; P265-F288 VanDerWaalsContact CD-CD1 3.42Å; P265-F288 HydrophobicContact CG-CB 4.39Å; P265-F288 HydrophobicContact CG-CD1 3.55Å; P265-F288 HydrophobicContact CG-CD2 3.87Å; P265-F288 HydrophobicContact CG-CE1 3.67Å; P265-F288 HydrophobicContact CG-CE2 4Å; P265-F288 HydrophobicContact CG-CG 3.67Å; P265-F288 HydrophobicContact CG-CZ 3.91Å; M273-F288 HydrophobicContact CE-CD2 4.34Å; M273-F288 HydrophobicContact CE-CE2 3.41Å; M273-F288 VanDerWaalsContact CE-CE2 3.41Å; M273-F288 HydrophobicContact CE-CZ 3.63Å; M273-F288 HydrophobicContact SD-CE2 3.74Å; M273-F288 HydrophobicContact SD-CZ 3.68Å; V284-F288 HydrophobicContact CG1-CD2 3.94Å; V284-F288 HydrophobicContact CG1-CE2 3.85Å; V284-F288 WeakPolarHBondContact O-CD2 3.49Å; V284-F288 PolarHBondContact O-N 2.72Å; R285-F288 PolarHBondContact O-N 3.41Å; F288-R292 WeakPolarHBondContact O-CB 3.3Å; F288-R292 PolarHBondContact O-N 3.3Å |
| 289 | C | 92.1 | Very high | 87.9 | Confident | 32 Ų | 32 | 75.7 Ų | 75.7 | 22% | 0.216 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -60.1 | -50.9 | 173.3 | -75.4 | 0 | 0 | 0 | 0 | 111.8 | R285 V286 W287 R291 R292 Q293 | R285-C289 PolarHBondContact O-N 3.01Å; R285-C289 VanDerWaalsContact O-N 3.12Å; R285-C289 PolarHBondContact O-SG 3.3Å; V286-C289 WeakPolarHBondContact O-CB 3.32Å; V286-C289 PolarHBondContact O-N 3.19Å; W287-C289 VanDerWaalsContact C-N 3.34Å; W287-C289 PolarHBondContact O-N 3.47Å; C289-R291 PolarHBondContact O-N 3.22Å; C289-R292 PolarHBondContact O-N 3.41Å; C289-Q293 WeakPolarHBondContact O-CG 3.36Å; C289-Q293 PolarHBondContact O-N 3.24Å |
| 290 | N | 92.1 | Very high | 86.3 | Confident | 88 Ų | 88 | 78.8 Ų | 78.8 | 47% | 0.471 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64.6 | -40.6 | 179.8 | -73.2 | -15 | 0 | 0 | 0 | 111.9 | V286 W287 R292 Q293 R294 | V286-N290 WeakPolarHBondContact O-CB 3.43Å; V286-N290 VanDerWaalsContact O-CG 3.32Å; V286-N290 PolarHBondContact O-N 3.42Å; W287-N290 PolarHBondContact O-N 3.08Å; N290-R292 PolarHBondContact O-N 3.46Å; N290-Q293 PolarHBondContact O-N 3.3Å; N290-R294 PolarHBondContact O-N 3.1Å |
| 291 | R | 93.2 | Very high | 84.7 | Confident | 73 Ų | 73 | 76.1 Ų | 76.1 | 28% | 0.275 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -64 | -41 | 179.3 | -175.9 | 62.7 | -173 | 78.7 | -1.7 | 112 | F259 W287 C289 R294 E295 | F259-R291 HydrophobicContact CD1-CG 4.05Å; F259-R291 HydrophobicContact CD2-CB 4.16Å; F259-R291 HydrophobicContact CD2-CG 3.61Å; F259-R291 HydrophobicContact CE1-CG 4.09Å; F259-R291 HydrophobicContact CE2-CB 4.07Å; F259-R291 HydrophobicContact CE2-CG 3.66Å; F259-R291 HydrophobicContact CG-CG 3.82Å; F259-R291 HydrophobicContact CZ-CG 3.91Å; W287-R291 HydrophobicContact CE3-CB 4.2Å; W287-R291 HydrophobicContact CH2-CB 4.12Å; W287-R291 HydrophobicContact CH2-CG 3.78Å; W287-R291 HydrophobicContact CZ2-CB 4.46Å; W287-R291 HydrophobicContact CZ2-CG 4.3Å; W287-R291 HydrophobicContact CZ3-CB 3.99Å; W287-R291 HydrophobicContact CZ3-CG 4.03Å; W287-R291 VanDerWaalsContact O-CB 3.29Å; W287-R291 WeakPolarHBondContact O-CB 3.35Å; W287-R291 PolarHBondContact O-N 2.85Å; C289-R291 PolarHBondContact O-N 3.22Å; R291-R294 PolarHBondContact O-N 3.32Å; R291-E295 PolarHBondContact O-N 3.19Å |
| 292 | R | 92.1 | Very high | 83.1 | Confident | 66 Ų | 66 | 76.6 Ų | 76.6 | 25% | 0.249 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -69.2 | -38 | 175.7 | -168.1 | 174.3 | 60.2 | -107.1 | -3.3 | 112.2 | F259 F288 C289 N290 R294 E295 K296 | F259-R292 HydrophobicContact CE2-CB 4.25Å; F288-R292 WeakPolarHBondContact O-CB 3.3Å; F288-R292 PolarHBondContact O-N 3.3Å; C289-R292 PolarHBondContact O-N 3.41Å; N290-R292 PolarHBondContact O-N 3.46Å; R292-R294 VanDerWaalsContact C-N 3.35Å; R292-E295 PolarHBondContact O-N 3.46Å; R292-K296 PolarHBondContact O-N 3.07Å; R292-K296 VanDerWaalsContact O-N 3.1Å |
| 293 | Q | 81.2 | Confident | 81.4 | Confident | 110 Ų | 110 | 76.5 Ų | 76.5 | 51% | 0.514 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.9 | -39.4 | 172.2 | -73.2 | 178 | 6.8 | 0 | 0 | 112 | C289 N290 K296 R297 | C289-Q293 WeakPolarHBondContact O-CG 3.36Å; C289-Q293 PolarHBondContact O-N 3.24Å; N290-Q293 PolarHBondContact O-N 3.3Å; Q293-K296 PolarHBondContact O-N 2.98Å; Q293-R297 WeakPolarHBondContact O-CG 3.39Å; Q293-R297 PolarHBondContact O-N 3.43Å |
| 294 | R | 84 | Confident | 79.4 | Confident | 158 Ų | 158 | 81.7 Ų | 81.7 | 60% | 0.596 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -62.1 | -43.9 | 174.5 | -174.5 | 176.8 | 177 | 100.1 | 0.7 | 111.4 | N290 R291 R292 K296 R297 V298 | N290-R294 PolarHBondContact O-N 3.1Å; R291-R294 PolarHBondContact O-N 3.32Å; R292-R294 VanDerWaalsContact C-N 3.35Å; R294-K296 PolarHBondContact O-N 3.35Å; R294-R297 PolarHBondContact O-N 2.96Å; R294-V298 WeakPolarHBondContact O-CG2 3.3Å; R294-V298 PolarHBondContact O-N 3.35Å |
| 295 | E | 83.1 | Confident | 77.4 | Confident | 56 Ų | 56 | 84.1 Ų | 84.1 | 26% | 0.262 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -59.9 | -44.7 | 177.2 | -168.5 | -171.3 | -169.8 | 0 | 0 | 112.3 | R291 R292 R297 V298 K299 | R291-E295 PolarHBondContact O-N 3.19Å; R292-E295 PolarHBondContact O-N 3.46Å; E295-R297 PolarHBondContact O-N 3.38Å; E295-V298 PolarHBondContact O-N 2.99Å; E295-K299 HydrophobicContact CG-CD 4.32Å; E295-K299 WeakPolarHBondContact O-CG 3.42Å; E295-K299 PolarHBondContact O-N 3.23Å; E295-K299 VanDerWaalsContact OE1-CE 3.3Å; E295-K299 WeakPolarHBondContact OE1-CE 3.46Å; E295-K299 IonicContact OE1-NZ 2.63Å; E295-K299 PolarHBondContact OE1-NZ 3.46Å |
| 296 | K | 77.7 | Confident | 75.7 | Confident | 141 Ų | 141 | 84.1 Ų | 84.1 | 61% | 0.613 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -60.6 | -43.1 | 175.3 | -71.7 | -174.8 | 176.8 | -168.1 | 0 | 112.2 | R292 Q293 R294 K299 T300 | R292-K296 PolarHBondContact O-N 3.07Å; R292-K296 VanDerWaalsContact O-N 3.1Å; Q293-K296 PolarHBondContact O-N 2.98Å; R294-K296 PolarHBondContact O-N 3.35Å; K296-K299 PolarHBondContact O-N 2.7Å; K296-T300 PolarHBondContact O-N 2.98Å; K296-T300 PolarHBondContact O-OG1 3.11Å; K296-T300 VanDerWaalsContact O-OG1 3.09Å |
| 297 | R | 71.4 | Confident | 73.8 | Confident | 143 Ų | 143 | 88.8 Ų | 88.8 | 54% | 0.54 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -60.9 | -46.3 | 176.9 | -75.4 | -171.7 | -76.9 | 163.9 | -6.9 | 112 | Q293 R294 E295 T300 S301 | Q293-R297 WeakPolarHBondContact O-CG 3.39Å; Q293-R297 PolarHBondContact O-N 3.43Å; R294-R297 PolarHBondContact O-N 2.96Å; E295-R297 PolarHBondContact O-N 3.38Å; R297-T300 PolarHBondContact O-N 3Å; R297-S301 PolarHBondContact O-N 3.09Å; R297-S301 PolarHBondContact O-OG 2.78Å; R297-S301 VanDerWaalsContact O-OG 3.11Å |
| 298 | V | 70 | Confident | 71.6 | Confident | 72 Ų | 72 | 90.6 Ų | 90.6 | 44% | 0.436 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -62.9 | -44.2 | 178 | 174.1 | 0 | 0 | 0 | 0 | 111.2 | R294 E295 T300 S301 L302 | R294-V298 WeakPolarHBondContact O-CG2 3.3Å; R294-V298 PolarHBondContact O-N 3.35Å; E295-V298 PolarHBondContact O-N 2.99Å; V298-T300 PolarHBondContact O-N 3.01Å; V298-S301 PolarHBondContact O-N 3.01Å; V298-L302 HydrophobicContact CG1-CD1 3.9Å; V298-L302 HydrophobicContact CG1-CG 4.33Å; V298-L302 WeakPolarHBondContact O-CB 3.36Å; V298-L302 WeakPolarHBondContact O-CG 3.35Å; V298-L302 PolarHBondContact O-N 3.41Å |
| 299 | K | 67.6 | Low | 69.8 | Low | 111 Ų | 111 | 95.7 Ų | 95.7 | 48% | 0.483 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62.4 | -41.2 | 177.3 | -73 | 177.7 | -176.2 | 171.9 | 0 | 112.2 | E295 K296 N303 | E295-K299 HydrophobicContact CG-CD 4.32Å; E295-K299 WeakPolarHBondContact O-CG 3.42Å; E295-K299 PolarHBondContact O-N 3.23Å; E295-K299 VanDerWaalsContact OE1-CE 3.3Å; E295-K299 WeakPolarHBondContact OE1-CE 3.46Å; E295-K299 IonicContact OE1-NZ 2.63Å; E295-K299 PolarHBondContact OE1-NZ 3.46Å; K296-K299 PolarHBondContact O-N 2.7Å; K299-N303 WeakPolarHBondContact O-CB 3.47Å; K299-N303 PolarHBondContact O-N 2.93Å; K299-N303 PolarHBondContact O-ND2 3.32Å |
| 300 | T | 60.7 | Low | 68 | Low | 94 Ų | 94 | 97.6 Ų | 97.6 | 58% | 0.577 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -66.4 | -41.8 | 176.2 | -57.7 | 0 | 0 | 0 | 0 | 111.9 | K296 R297 V298 N303 Q304 | K296-T300 PolarHBondContact O-N 2.98Å; K296-T300 PolarHBondContact O-OG1 3.11Å; K296-T300 VanDerWaalsContact O-OG1 3.09Å; R297-T300 PolarHBondContact O-N 3Å; V298-T300 PolarHBondContact O-N 3.01Å; T300-N303 PolarHBondContact O-N 2.79Å; T300-Q304 WeakPolarHBondContact O-CB 3.49Å; T300-Q304 PolarHBondContact O-N 3.38Å |
| 301 | S | 57.1 | Low | 65.9 | Low | 71 Ų | 71 | 100.6 Ų | 100.6 | 50% | 0.497 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.7 | -39.5 | 176.6 | -61.8 | 0 | 0 | 0 | 0 | 113 | R297 V298 Q304 S305 | R297-S301 PolarHBondContact O-N 3.09Å; R297-S301 PolarHBondContact O-OG 2.78Å; R297-S301 VanDerWaalsContact O-OG 3.11Å; V298-S301 PolarHBondContact O-N 3.01Å; S301-Q304 PolarHBondContact O-N 3.38Å; S301-S305 PolarHBondContact O-N 2.95Å; S301-S305 PolarHBondContact O-OG 3.48Å |
| 302 | L | 61.5 | Low | 63.8 | Low | 99 Ų | 99 | 104.1 Ų | 104.1 | 52% | 0.518 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -70 | -37 | 176.5 | -71.1 | 174.9 | 0 | 0 | 0 | 112.8 | V298 Q304 S305 L306 | V298-L302 HydrophobicContact CG1-CD1 3.9Å; V298-L302 HydrophobicContact CG1-CG 4.33Å; V298-L302 WeakPolarHBondContact O-CB 3.36Å; V298-L302 WeakPolarHBondContact O-CG 3.35Å; V298-L302 PolarHBondContact O-N 3.41Å; L302-Q304 VanDerWaalsContact C-N 3.35Å; L302-S305 WeakPolarHBondContact CA-OG 3.39Å; L302-S305 PolarHBondContact O-N 3Å; L302-S305 PolarHBondContact O-OG 3.05Å; L302-L306 WeakPolarHBondContact O-CB 3.5Å; L302-L306 WeakPolarHBondContact O-CG 3.44Å; L302-L306 PolarHBondContact O-N 3.22Å |
| 303 | N | 56.8 | Low | 61.8 | Low | 82 Ų | 82 | 108.2 Ų | 108.2 | 44% | 0.439 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.3 | -43.2 | 172.3 | -83.6 | -76 | 0 | 0 | 0 | 110.4 | K299 T300 S305 L306 F307 | K299-N303 WeakPolarHBondContact O-CB 3.47Å; K299-N303 PolarHBondContact O-N 2.93Å; K299-N303 PolarHBondContact O-ND2 3.32Å; T300-N303 PolarHBondContact O-N 2.79Å; N303-S305 VanDerWaalsContact C-N 3.33Å; N303-S305 PolarHBondContact O-N 3.32Å; N303-L306 PolarHBondContact O-N 2.93Å; N303-F307 HydrophobicContact CB-CD2 4.41Å; N303-F307 HydrophobicContact CB-CE2 4.22Å; N303-F307 WeakPolarHBondContact O-CD2 2.99Å; N303-F307 PolarHBondContact O-N 2.81Å |
| 304 | Q | 49.7 | Very low | 60.4 | Low | 133 Ų | 133 | 109.8 Ų | 109.8 | 62% | 0.621 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -58.6 | -42.7 | 175.8 | -170.9 | 170.3 | 23.4 | 0 | 0 | 112.1 | T300 S301 L302 F307 S308 | T300-Q304 WeakPolarHBondContact O-CB 3.49Å; T300-Q304 PolarHBondContact O-N 3.38Å; S301-Q304 PolarHBondContact O-N 3.38Å; L302-Q304 VanDerWaalsContact C-N 3.35Å; Q304-F307 PolarHBondContact O-N 3.4Å; Q304-S308 PolarHBondContact O-N 3.18Å; Q304-S308 PolarHBondContact O-OG 2.98Å |
| 305 | S | 54.7 | Low | 58.8 | Low | 50 Ų | 50 | 110.1 Ų | 110.1 | 35% | 0.35 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -67 | -37 | 175.1 | 57.2 | 0 | 0 | 0 | 0 | 113.4 | S301 L302 N303 S308 I309 | S301-S305 PolarHBondContact O-N 2.95Å; S301-S305 PolarHBondContact O-OG 3.48Å; L302-S305 WeakPolarHBondContact CA-OG 3.39Å; L302-S305 PolarHBondContact O-N 3Å; L302-S305 PolarHBondContact O-OG 3.05Å; N303-S305 VanDerWaalsContact C-N 3.33Å; N303-S305 PolarHBondContact O-N 3.32Å; S305-S308 PolarHBondContact O-N 3.4Å; S305-I309 VanDerWaalsContact O-CG1 3.3Å; S305-I309 WeakPolarHBondContact O-CG1 3.45Å; S305-I309 PolarHBondContact O-N 3.41Å |
| 306 | L | 58.6 | Low | 57 | Low | 103 Ų | 103 | 113 Ų | 113 | 54% | 0.539 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -68.1 | -37.6 | 176.8 | -78.1 | 167 | 0 | 0 | 0 | 112.5 | L302 N303 S308 I309 S310 | L302-L306 WeakPolarHBondContact O-CB 3.5Å; L302-L306 WeakPolarHBondContact O-CG 3.44Å; L302-L306 PolarHBondContact O-N 3.22Å; N303-L306 PolarHBondContact O-N 2.93Å; L306-S308 VanDerWaalsContact C-N 3.35Å; L306-I309 PolarHBondContact O-N 2.78Å; L306-S310 WeakPolarHBondContact O-CB 3.3Å; L306-S310 PolarHBondContact O-N 3.03Å; L306-S310 PolarHBondContact O-OG 3.47Å |
| 307 | F | 55 | Low | 55.2 | Low | 147 Ų | 147 | 120.3 Ų | 120.3 | 65% | 0.645 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -67.2 | -35.4 | 172.8 | -74.9 | -64.9 | 0 | 0 | 0 | 112 | N303 Q304 K311 | N303-F307 HydrophobicContact CB-CD2 4.41Å; N303-F307 HydrophobicContact CB-CE2 4.22Å; N303-F307 WeakPolarHBondContact O-CD2 2.99Å; N303-F307 PolarHBondContact O-N 2.81Å; Q304-F307 PolarHBondContact O-N 3.4Å; F307-K311 PolarHBondContact O-N 3.41Å |
| 308 | S | 49.9 | Very low | 54.3 | Low | 71 Ų | 71 | 119.2 Ų | 119.2 | 50% | 0.497 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -64.7 | -45.3 | 172.9 | -69.9 | 0 | 0 | 0 | 0 | 112.4 | Q304 S305 L306 S310 K311 E312 | Q304-S308 PolarHBondContact O-N 3.18Å; Q304-S308 PolarHBondContact O-OG 2.98Å; S305-S308 PolarHBondContact O-N 3.4Å; L306-S308 VanDerWaalsContact C-N 3.35Å; S308-S310 VanDerWaalsContact C-N 3.31Å; S308-S310 PolarHBondContact O-N 3.44Å; S308-K311 PolarHBondContact O-N 3.17Å; S308-E312 PolarHBondContact O-N 3.22Å |
| 309 | I | 56.9 | Low | 53.5 | Low | 110 Ų | 110 | 121.7 Ų | 121.7 | 56% | 0.564 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -64.5 | -36.7 | 178.1 | -66.2 | 164.6 | 0 | 0 | 0 | 111.4 | S305 L306 K311 E312 H313 | S305-I309 VanDerWaalsContact O-CG1 3.3Å; S305-I309 WeakPolarHBondContact O-CG1 3.45Å; S305-I309 PolarHBondContact O-N 3.41Å; L306-I309 PolarHBondContact O-N 2.78Å; I309-K311 VanDerWaalsContact C-N 3.27Å; I309-K311 PolarHBondContact O-N 3.14Å; I309-E312 PolarHBondContact O-N 3.19Å; I309-H313 PolarHBondContact O-N 3.35Å |
| 310 | S | 54.6 | Low | 52.7 | Low | 72 Ų | 72 | 122.3 Ų | 122.3 | 50% | 0.503 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -68.8 | -26.8 | 177.8 | -56.3 | 0 | 0 | 0 | 0 | 112.8 | L306 S308 | L306-S310 WeakPolarHBondContact O-CB 3.3Å; L306-S310 PolarHBondContact O-N 3.03Å; L306-S310 PolarHBondContact O-OG 3.47Å; S308-S310 VanDerWaalsContact C-N 3.31Å; S308-S310 PolarHBondContact O-N 3.44Å |
| 311 | K | 48.6 | Very low | 52.3 | Low | 151 Ų | 151 | 123.9 Ų | 123.9 | 66% | 0.657 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -77.9 | -38.7 | 178.2 | -150.8 | -179.7 | -177.5 | -172 | 0 | 111.5 | F307 S308 I309 H313 L314 E315 | F307-K311 PolarHBondContact O-N 3.41Å; S308-K311 PolarHBondContact O-N 3.17Å; I309-K311 VanDerWaalsContact C-N 3.27Å; I309-K311 PolarHBondContact O-N 3.14Å; K311-H313 VanDerWaalsContact C-N 3.27Å; K311-H313 PolarHBondContact O-N 3.36Å; K311-L314 PolarHBondContact O-N 3.41Å; K311-L314 VanDerWaalsContact O-N 3.14Å; K311-E315 PolarHBondContact O-N 3.31Å |
| 312 | E | 49.6 | Very low | 52 | Low | 146 Ų | 146 | 127.3 Ų | 127.3 | 68% | 0.682 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -63 | -32.9 | 174.8 | -69.6 | -165 | 167.3 | 0 | 0 | 112.7 | S308 I309 L314 | S308-E312 PolarHBondContact O-N 3.22Å; I309-E312 PolarHBondContact O-N 3.19Å; E312-L314 VanDerWaalsContact C-N 3.31Å; E312-L314 PolarHBondContact O-N 3.48Å |
| 313 | H | 49.2 | Very low | 51.3 | Low | 152 Ų | 152 | 129.1 Ų | 129.1 | 70% | 0.704 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -76 | -14.9 | 177.1 | -163.8 | -78.9 | 0 | 0 | 0 | 113.8 | I309 K311 | I309-H313 PolarHBondContact O-N 3.35Å; K311-H313 VanDerWaalsContact C-N 3.27Å; K311-H313 PolarHBondContact O-N 3.36Å |
| 314 | L | 51.8 | Low | 51 | Low | 144 Ų | 144 | 132.5 Ų | 132.5 | 75% | 0.754 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -92.4 | -20.7 | 174 | -106.5 | 82.9 | 0 | 0 | 0 | 113.4 | K311 E312 | K311-L314 PolarHBondContact O-N 3.41Å; K311-L314 VanDerWaalsContact O-N 3.14Å; E312-L314 VanDerWaalsContact C-N 3.31Å; E312-L314 PolarHBondContact O-N 3.48Å |
| 315 | E | 49.5 | Very low | 51.1 | Low | 165 Ų | 165 | 132.5 Ų | 132.5 | 77% | 0.771 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -85.7 | -6.6 | 175.8 | -88 | -179.9 | 134.7 | 0 | 0 | 113.7 | K311 | K311-E315 PolarHBondContact O-N 3.31Å |
| 316 | C | 46.6 | Very low | 50.7 | Low | 116 Ų | 116 | 139.3 Ų | 139.3 | 78% | 0.784 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.7 | 22.4 | -179.5 | -154.4 | 0 | 0 | 0 | 0 | 114.2 | ||
| 317 | R | 38.8 | Very low | 50 | Low | 295 Ų | 295 | 142.6 Ų | 142.6 | 100% | 1.113 | 70% | 0.698 | S | S | * | * | trans | -131.5 | 0 | 178.6 | -138.5 | -175 | -161.3 | -152 | 4.5 | 113.6 |
Retrieved 317 of 317 residues in 192.3 ms
(Link to these results)