| 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 | 43.3 | Very low | 44.8 | Very low | 249 Ų | 249 | 149 Ų | 149 | 100% | 1.227 | 82% | 0.818 | S | S | * | * | 0 | 136 | 0 | -73.8 | 161.3 | 171.6 | 0 | 0 | 107.3 | |||||
| 2 | N | 41.3 | Very low | 43.8 | Very low | 164 Ų | 164 | 149.2 Ų | 149.2 | 88% | 0.877 | 82% | 0.817 | S | S | * | * | trans | -86.5 | 145.9 | -176.1 | -77.9 | -39.1 | 0 | 0 | 0 | 112.3 | ||||
| 3 | A | 47.3 | Very low | 43.5 | Very low | 94 Ų | 94 | 147.7 Ų | 147.7 | 78% | 0.777 | 81% | 0.807 | S | S | * | * | trans | -172.6 | 119.3 | 149.1 | 0 | 0 | 0 | 0 | 0 | 105 | ||||
| 4 | Q | 43.1 | Very low | 42.9 | Very low | 178 Ų | 178 | 148.5 Ų | 148.5 | 83% | 0.832 | 80% | 0.802 | S | S | * | * | cis | 64.8 | 90.3 | 26.9 | -158.6 | 174.6 | 1.1 | 0 | 0 | 113.7 | ||||
| 5 | L | 57 | Low | 42.1 | Very low | 179 Ų | 179 | 142.5 Ų | 142.5 | 94% | 0.937 | 79% | 0.789 | S | S | * | * | trans | -137.5 | 143.7 | 152.5 | -78.6 | -179.7 | 0 | 0 | 0 | 109 | ||||
| 6 | S | 45.8 | Very low | 41.5 | Very low | 77 Ų | 77 | 142.9 Ų | 142.9 | 54% | 0.538 | 80% | 0.796 | S | S | . | * | trans | -114.4 | 159.7 | -168.4 | -159.8 | 0 | 0 | 0 | 0 | 112.2 | E8 | S6-E8 PolarHBondContact OG-OE1 3.46Š| ||
| 7 | M | 48.6 | Very low | 40.9 | Very low | 181 Ų | 181 | 141.1 Ų | 141.1 | 89% | 0.892 | 80% | 0.795 | S | S | * | * | trans | 171.4 | 104.4 | 150.6 | -98.4 | -176 | -66.9 | 0 | 0 | 105.4 | ||||
| 8 | E | 50.9 | Low | 40.6 | Very low | 157 Ų | 157 | 142.8 Ų | 142.8 | 73% | 0.734 | 80% | 0.795 | S | S | * | * | cis | 63.6 | 100.9 | 50 | -56.3 | 169.9 | -152.4 | 0 | 0 | 113.2 | S6 | S6-E8 PolarHBondContact OG-OE1 3.46Š| ||
| 9 | N | 36.7 | Very low | 39.8 | Very low | 143 Ų | 143 | 144.5 Ų | 144.5 | 77% | 0.765 | 80% | 0.797 | S | S | * | * | -165.5 | 118.9 | 123.8 | -143.8 | 36.1 | 0 | 0 | 0 | 113.4 | |||||
| 10 | I | 41.6 | Very low | 39.7 | Very low | 157 Ų | 157 | 142 Ų | 142 | 81% | 0.805 | 79% | 0.789 | S | S | * | * | trans | 41.4 | 128.2 | 137.4 | -56.4 | 172.4 | 0 | 0 | 0 | 119.4 | ||||
| 11 | G | 37 | Very low | 39.2 | Very low | 60 Ų | 60 | 142.1 Ų | 142.1 | 62% | 0.619 | 79% | 0.794 | S | S | * | * | cis | 176.5 | 157.3 | -2.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 12 | D | 33.4 | Very low | 38.7 | Very low | 151 Ų | 151 | 135 Ų | 135 | 81% | 0.807 | 77% | 0.774 | S | S | * | * | 15.9 | 146.7 | 119.8 | -88.8 | -77.8 | 0 | 0 | 0 | 120 | |||||
| 13 | L | 39.2 | Very low | 38.4 | Very low | 130 Ų | 130 | 130.2 Ų | 130.2 | 68% | 0.681 | 76% | 0.764 | S | S | * | * | cis | -164.2 | 171.4 | 15.6 | -179.4 | 60.7 | 0 | 0 | 0 | 110.6 | ||||
| 14 | H | 35.8 | Very low | 37.9 | Very low | 159 Ų | 159 | 134.9 Ų | 134.9 | 74% | 0.736 | 77% | 0.769 | S | S | * | * | trans | 69 | 131.1 | 167.6 | -79.4 | -74.6 | 0 | 0 | 0 | 117.7 | ||||
| 15 | G | 31.1 | Very low | 37.3 | Very low | 59 Ų | 59 | 129.4 Ų | 129.4 | 61% | 0.608 | 76% | 0.761 | S | S | * | * | cis | 89.3 | 99.6 | -6.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 16 | V | 32.3 | Very low | 36.1 | Very low | 148 Ų | 148 | 128.9 Ų | 128.9 | 90% | 0.897 | 75% | 0.754 | S | S | * | * | trans | -171.2 | 168.8 | 133.4 | -92.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 17 | S | 30.9 | Very low | 35.6 | Very low | 113 Ų | 113 | 132.2 Ų | 132.2 | 79% | 0.79 | 76% | 0.764 | S | S | * | * | trans | -103.5 | 175 | -160 | -48.7 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 18 | H | 35.2 | Very low | 34.9 | Very low | 172 Ų | 172 | 130.5 Ų | 130.5 | 80% | 0.796 | 76% | 0.758 | S | S | * | * | trans | 78.9 | 122.6 | 144.5 | -141.2 | -105.2 | 0 | 0 | 0 | 118.3 | ||||
| 19 | E | 26.1 | Very low | 34 | Very low | 175 Ų | 175 | 128.5 Ų | 128.5 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | -172 | 160.6 | 102.7 | -154.6 | 168.5 | 78 | 0 | 0 | 111.9 | |||||
| 20 | S | 36.6 | Very low | 33.7 | Very low | 93 Ų | 93 | 125.3 Ų | 125.3 | 65% | 0.65 | 76% | 0.762 | S | S | * | * | trans | -108.1 | 149.2 | 172 | 57.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 21 | V | 30.2 | Very low | 33.4 | Very low | 145 Ų | 145 | 126.5 Ų | 126.5 | 88% | 0.879 | 76% | 0.764 | S | S | * | * | trans | -158.2 | 156.9 | 149 | 123.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 22 | A | 33.1 | Very low | 33.4 | Very low | 100 Ų | 100 | 129.3 Ų | 129.3 | 83% | 0.826 | 77% | 0.774 | S | S | * | * | trans | -131.4 | 166.6 | -174.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 23 | G | 33.7 | Very low | 34.1 | Very low | 64 Ų | 64 | 127.2 Ų | 127.2 | 66% | 0.66 | 77% | 0.769 | S | S | * | * | trans | 112.7 | 153 | 168.9 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 24 | H | 37 | Very low | 33.9 | Very low | 191 Ų | 191 | 129.3 Ų | 129.3 | 88% | 0.884 | 78% | 0.775 | S | S | * | * | cis | -167.2 | 163.8 | -4.4 | -131 | -87.8 | 0 | 0 | 0 | 111.3 | ||||
| 25 | G | 30.6 | Very low | 33.8 | Very low | 63 Ų | 63 | 126.6 Ų | 126.6 | 65% | 0.649 | 77% | 0.773 | S | S | * | * | trans | 95.7 | 101.4 | 163.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 26 | E | 32.4 | Very low | 34 | Very low | 169 Ų | 169 | 135.2 Ų | 135.2 | 79% | 0.79 | 79% | 0.788 | S | S | * | * | 75.7 | 123.9 | 66.6 | -70.6 | -155.2 | 92.2 | 0 | 0 | 116.3 | |||||
| 27 | L | 34.5 | Very low | 34.7 | Very low | 146 Ų | 146 | 134 Ų | 134 | 76% | 0.764 | 78% | 0.783 | S | S | * | * | 174.3 | 116.9 | 109.6 | -85 | 174.5 | 0 | 0 | 0 | 113.4 | |||||
| 28 | L | 35.2 | Very low | 35.1 | Very low | 146 Ų | 146 | 134 Ų | 134 | 76% | 0.764 | 78% | 0.783 | S | S | * | * | trans | 63.6 | 127.3 | 137.4 | -57.5 | 178.6 | 0 | 0 | 0 | 125.3 | ||||
| 29 | S | 30.7 | Very low | 36 | Very low | 115 Ų | 115 | 131.2 Ų | 131.2 | 80% | 0.804 | 78% | 0.78 | S | S | * | * | trans | 78.5 | 129.1 | 134.4 | -63.7 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 30 | G | 31.1 | Very low | 36.7 | Very low | 75 Ų | 75 | 134.9 Ų | 134.9 | 77% | 0.773 | 79% | 0.786 | S | S | * | * | trans | 167.9 | 86.2 | 166.6 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 31 | H | 34.5 | Very low | 36.6 | Very low | 182 Ų | 182 | 133.7 Ų | 133.7 | 84% | 0.843 | 79% | 0.789 | S | S | * | * | trans | -47.6 | 146.7 | 179.6 | -53.8 | 93.9 | 0 | 0 | 0 | 118.9 | ||||
| 32 | S | 37.8 | Very low | 36.9 | Very low | 119 Ų | 119 | 135.9 Ų | 135.9 | 83% | 0.832 | 79% | 0.794 | S | S | * | * | trans | -73.9 | 147.1 | 149.2 | -79 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 33 | P | 49 | Very low | 36.9 | Very low | 108 Ų | 108 | 134.4 Ų | 134.4 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | -150.5 | 150.3 | 121.2 | 33.1 | -14.3 | 0 | 0 | 0 | 117.9 | |||||
| 34 | H | 34.7 | Very low | 37.1 | Very low | 174 Ų | 174 | 140.9 Ų | 140.9 | 81% | 0.806 | 80% | 0.802 | S | S | * | * | trans | 58.2 | 120.1 | 137.5 | -69.2 | -51.9 | 0 | 0 | 0 | 125.6 | ||||
| 35 | S | 32.1 | Very low | 37.1 | Very low | 101 Ų | 101 | 143.4 Ų | 143.4 | 71% | 0.706 | 80% | 0.804 | S | S | * | * | 74 | 119.2 | 117.5 | -55.7 | 0 | 0 | 0 | 0 | 123.2 | |||||
| 36 | R | 36 | Very low | 37.2 | Very low | 241 Ų | 241 | 144.8 Ų | 144.8 | 91% | 0.909 | 81% | 0.809 | S | S | * | * | 33.9 | 144 | 129.1 | -89 | -172.5 | -178.6 | -156.4 | 1.6 | 120.4 | |||||
| 37 | P | 46.7 | Very low | 37.4 | Very low | 122 Ų | 122 | 144.8 Ų | 144.8 | 79% | 0.792 | 81% | 0.811 | S | S | * | * | -154.1 | -174 | 64.7 | 41.8 | -21.1 | 0 | 0 | 0 | 118.2 | |||||
| 38 | S | 40 | Very low | 37.4 | Very low | 113 Ų | 113 | 140.9 Ų | 140.9 | 79% | 0.79 | 81% | 0.806 | S | S | * | * | trans | -129.5 | 146.9 | 168.8 | -46.4 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 39 | P | 54.6 | Low | 37.5 | Very low | 114 Ų | 114 | 141.7 Ų | 141.7 | 74% | 0.74 | 81% | 0.808 | S | S | * | * | trans | -108 | 139.2 | 155 | 25.3 | -9.4 | 0 | 0 | 0 | 110.8 | ||||
| 40 | R | 40.2 | Very low | 37.5 | Very low | 252 Ų | 252 | 141 Ų | 141 | 95% | 0.951 | 81% | 0.81 | S | S | * | * | 57.1 | 132.8 | 73 | -67.1 | -172.4 | 172.8 | -156.6 | -1 | 113.1 | |||||
| 41 | G | 35.4 | Very low | 37.6 | Very low | 68 Ų | 68 | 143.7 Ų | 143.7 | 70% | 0.701 | 81% | 0.811 | S | S | * | * | cis | 163.8 | -179.8 | 0.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 42 | L | 35.9 | Very low | 37.7 | Very low | 190 Ų | 190 | 143.5 Ų | 143.5 | 100% | 0.995 | 82% | 0.815 | S | S | * | * | trans | 134.4 | 136.7 | 167.5 | -78.1 | 163.2 | 0 | 0 | 0 | 110.9 | ||||
| 43 | G | 32.9 | Very low | 37.7 | Very low | 70 Ų | 70 | 145.8 Ų | 145.8 | 72% | 0.722 | 82% | 0.817 | S | S | * | * | cis | -174.2 | 145.8 | -8 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 44 | H | 36.8 | Very low | 36.9 | Very low | 199 Ų | 199 | 147.7 Ų | 147.7 | 92% | 0.921 | 82% | 0.822 | S | S | * | * | trans | -87.3 | 154.9 | 177.2 | -91.3 | -108 | 0 | 0 | 0 | 112.2 | ||||
| 45 | R | 38.3 | Very low | 36.6 | Very low | 244 Ų | 244 | 144.5 Ų | 144.5 | 92% | 0.921 | 82% | 0.818 | S | S | * | * | trans | -132.2 | 129.2 | 156.7 | -118.2 | -178.2 | 173 | -172.6 | -4.1 | 109.8 | ||||
| 46 | A | 32.7 | Very low | 36.5 | Very low | 93 Ų | 93 | 143 Ų | 143 | 77% | 0.769 | 82% | 0.82 | S | S | * | * | trans | -118.7 | 147.2 | 171.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 47 | M | 37.3 | Very low | 36.2 | Very low | 169 Ų | 169 | 138.6 Ų | 138.6 | 83% | 0.833 | 81% | 0.814 | S | S | * | * | trans | -137.6 | 129.5 | 166.8 | -67.3 | -70.3 | -78.9 | 0 | 0 | 106.4 | M49 | M47-M49 HydrophobicContact CE-CE 4.39Š| ||
| 48 | G | 33.9 | Very low | 35.5 | Very low | 63 Ų | 63 | 142.1 Ų | 142.1 | 65% | 0.649 | 81% | 0.813 | S | S | * | * | trans | -140 | 143.7 | 171 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 49 | M | 37.5 | Very low | 35.3 | Very low | 163 Ų | 163 | 144.6 Ų | 144.6 | 80% | 0.803 | 81% | 0.811 | S | S | * | * | trans | -148.6 | 138.2 | 176.1 | -62.3 | -65.1 | 165.5 | 0 | 0 | 110.8 | M47 | M47-M49 HydrophobicContact CE-CE 4.39Š| ||
| 50 | A | 31 | Very low | 34.8 | Very low | 102 Ų | 102 | 144.4 Ų | 144.4 | 84% | 0.843 | 81% | 0.81 | S | S | * | * | trans | 69.6 | 124.1 | 149.5 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 51 | T | 33.2 | Very low | 34.3 | Very low | 130 Ų | 130 | 136.2 Ų | 136.2 | 80% | 0.798 | 80% | 0.804 | S | S | * | * | trans | -71.6 | 153.3 | 162.7 | 42.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 52 | L | 35.7 | Very low | 34.2 | Very low | 179 Ų | 179 | 142 Ų | 142 | 94% | 0.937 | 81% | 0.812 | S | S | * | * | trans | -128.7 | 136.1 | 146.3 | -82 | 171.9 | 0 | 0 | 0 | 109.6 | ||||
| 53 | L | 38.7 | Very low | 34.7 | Very low | 166 Ų | 166 | 138.8 Ų | 138.8 | 87% | 0.869 | 80% | 0.803 | S | S | * | * | trans | -96.2 | 143 | 165.5 | -63 | 160.2 | 0 | 0 | 0 | 107 | ||||
| 54 | D | 30.5 | Very low | 34.6 | Very low | 149 Ų | 149 | 139.3 Ų | 139.3 | 80% | 0.797 | 81% | 0.809 | S | S | * | * | trans | -170.2 | 148 | 132.2 | -158.7 | 26.5 | 0 | 0 | 0 | 112.9 | ||||
| 55 | S | 29.2 | Very low | 34.4 | Very low | 106 Ų | 106 | 138.1 Ų | 138.1 | 74% | 0.741 | 80% | 0.803 | S | S | * | * | trans | -26.7 | 166.6 | 156.5 | -39 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 56 | G | 31.1 | Very low | 34.2 | Very low | 71 Ų | 71 | 133.9 Ų | 133.9 | 73% | 0.732 | 80% | 0.798 | S | S | * | * | cis | 175.1 | -167.8 | 3.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 57 | D | 29.3 | Very low | 34.5 | Very low | 148 Ų | 148 | 137.8 Ų | 137.8 | 79% | 0.791 | 80% | 0.8 | S | S | * | * | trans | 73.8 | 112.7 | 174.9 | -106 | -124.4 | 0 | 0 | 0 | 119.1 | ||||
| 58 | Y | 31 | Very low | 34.9 | Very low | 196 Ų | 196 | 136.1 Ų | 136.1 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | 70.9 | 139.5 | 74.9 | -82 | -79.1 | 0 | 0 | 0 | 113.4 | |||||
| 59 | H | 35.8 | Very low | 34.7 | Very low | 164 Ų | 164 | 137.1 Ų | 137.1 | 76% | 0.759 | 80% | 0.804 | S | S | * | * | cis | -153.3 | -164.6 | -1.2 | -148 | -152.7 | 0 | 0 | 0 | 108.5 | ||||
| 60 | P | 44.9 | Very low | 34.6 | Very low | 110 Ų | 110 | 137.2 Ų | 137.2 | 71% | 0.714 | 81% | 0.806 | S | S | * | * | trans | -124.2 | -169.6 | -144 | 30.8 | -3.2 | 0 | 0 | 0 | 114.9 | ||||
| 61 | G | 29.3 | Very low | 34.7 | Very low | 80 Ų | 80 | 137.5 Ų | 137.5 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | trans | -177.6 | 86.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 62 | H | 33.4 | Very low | 34.8 | Very low | 189 Ų | 189 | 138.9 Ų | 138.9 | 88% | 0.875 | 80% | 0.801 | S | S | * | * | trans | -96.7 | 179.9 | 156.1 | -99.2 | -75.6 | 0 | 0 | 0 | 108.8 | ||||
| 63 | P | 46.3 | Very low | 34.6 | Very low | 124 Ų | 124 | 135.4 Ų | 135.4 | 81% | 0.805 | 79% | 0.79 | S | S | * | * | cis | -131 | -169.7 | -16.8 | 29.4 | -6.7 | 0 | 0 | 0 | 112.4 | ||||
| 64 | G | 30.3 | Very low | 34.2 | Very low | 81 Ų | 81 | 136.2 Ų | 136.2 | 84% | 0.835 | 79% | 0.79 | S | S | * | * | trans | -171.1 | 108.7 | 167.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 65 | H | 33.6 | Very low | 34.5 | Very low | 173 Ų | 173 | 133 Ų | 133 | 80% | 0.801 | 78% | 0.784 | S | S | * | * | trans | -109.4 | 162.6 | -176.8 | -167.1 | -98.8 | 0 | 0 | 0 | 110.4 | ||||
| 66 | L | 33.1 | Very low | 35.3 | Very low | 155 Ų | 155 | 132.5 Ų | 132.5 | 81% | 0.812 | 78% | 0.779 | S | S | * | * | trans | 140.9 | 128.2 | 144 | -73.8 | 160.5 | 0 | 0 | 0 | 115.2 | ||||
| 67 | H | 39.7 | Very low | 35.5 | Very low | 175 Ų | 175 | 138.1 Ų | 138.1 | 81% | 0.81 | 79% | 0.785 | S | S | * | * | trans | -85.7 | 162.5 | 151.9 | -71.6 | -97.8 | 0 | 0 | 0 | 109.4 | ||||
| 68 | P | 44.9 | Very low | 35.7 | Very low | 135 Ų | 135 | 134.6 Ų | 134.6 | 88% | 0.877 | 78% | 0.784 | S | S | * | * | -144.4 | -167.4 | 103.1 | 37.7 | -21 | 0 | 0 | 0 | 113.7 | |||||
| 69 | A | 29.5 | Very low | 35.9 | Very low | 83 Ų | 83 | 134.1 Ų | 134.1 | 69% | 0.686 | 79% | 0.791 | S | S | * | * | trans | -128.4 | 176.6 | -163.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 70 | I | 36.5 | Very low | 35.9 | Very low | 165 Ų | 165 | 132.3 Ų | 132.3 | 85% | 0.846 | 80% | 0.797 | S | S | * | * | trans | 68.1 | 157.9 | 157.3 | 68 | 162.8 | 0 | 0 | 0 | 122.1 | ||||
| 71 | S | 33.5 | Very low | 35.5 | Very low | 109 Ų | 109 | 131.5 Ų | 131.5 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | trans | 89.6 | 139 | 172.8 | -90.9 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 72 | M | 33.9 | Very low | 35.7 | Very low | 159 Ų | 159 | 132.9 Ų | 132.9 | 78% | 0.783 | 80% | 0.797 | S | S | * | * | cis | 169.2 | 153.9 | -24.6 | -101.8 | -85.5 | -78.4 | 0 | 0 | 105.4 | ||||
| 73 | C | 31.6 | Very low | 35.8 | Very low | 105 Ų | 105 | 130.4 Ų | 130.4 | 71% | 0.709 | 80% | 0.795 | S | S | * | * | trans | 64.5 | 158.8 | 175.1 | -52.6 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 74 | E | 31.9 | Very low | 35.4 | Very low | 183 Ų | 183 | 131.2 Ų | 131.2 | 86% | 0.855 | 80% | 0.798 | S | S | * | * | cis | -150.1 | 154 | 7.2 | -154.5 | 162.5 | 107.8 | 0 | 0 | 109.8 | ||||
| 75 | A | 36.6 | Very low | 35.9 | Very low | 83 Ų | 83 | 135.9 Ų | 135.9 | 69% | 0.686 | 79% | 0.791 | S | S | * | * | trans | -129.3 | 154.3 | 168.8 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 76 | P | 46.1 | Very low | 36.1 | Very low | 95 Ų | 95 | 134.2 Ų | 134.2 | 62% | 0.617 | 79% | 0.793 | S | S | * | * | -164.5 | -179.7 | 59.6 | 44.7 | -22.4 | 0 | 0 | 0 | 120.5 | |||||
| 77 | H | 33.7 | Very low | 36.7 | Very low | 188 Ų | 188 | 131.3 Ų | 131.3 | 87% | 0.87 | 78% | 0.782 | S | S | * | * | trans | 67.5 | 123 | 155.2 | -51.9 | 128.8 | 0 | 0 | 0 | 121.2 | ||||
| 78 | G | 33.6 | Very low | 37 | Very low | 74 Ų | 74 | 130.7 Ų | 130.7 | 76% | 0.763 | 78% | 0.784 | S | S | * | * | trans | -178.6 | 37.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 79 | M | 36.4 | Very low | 37.3 | Very low | 186 Ų | 186 | 130.7 Ų | 130.7 | 92% | 0.916 | 78% | 0.782 | S | S | * | * | trans | 34.3 | 119.7 | 157.5 | -32.7 | -162.3 | 96.4 | 0 | 0 | 122.3 | ||||
| 80 | S | 35.9 | Very low | 38.4 | Very low | 126 Ų | 126 | 132.1 Ų | 132.1 | 88% | 0.881 | 78% | 0.784 | S | S | * | * | trans | 107 | 135 | 131 | -148.3 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 81 | A | 34.9 | Very low | 38.9 | Very low | 93 Ų | 93 | 132.5 Ų | 132.5 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | trans | 77.9 | 86.4 | 152.4 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 82 | S | 34.4 | Very low | 40.4 | Very low | 110 Ų | 110 | 136 Ų | 136 | 77% | 0.769 | 79% | 0.791 | S | S | * | * | trans | -2.2 | 130.8 | 144.9 | -55.8 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 83 | T | 35.1 | Very low | 41.4 | Very low | 137 Ų | 137 | 134.2 Ų | 134.2 | 84% | 0.84 | 79% | 0.792 | S | S | * | * | 34 | 106.6 | 126.6 | -43.2 | 0 | 0 | 0 | 0 | 119.5 | |||||
| 84 | T | 38.4 | Very low | 42.1 | Very low | 141 Ų | 141 | 137 Ų | 137 | 87% | 0.865 | 80% | 0.799 | S | S | * | * | trans | -102.4 | 112.5 | 164.4 | -52.5 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 85 | Y | 40.5 | Very low | 43 | Very low | 178 Ų | 178 | 133.6 Ų | 133.6 | 70% | 0.698 | 79% | 0.792 | S | S | * | * | trans | -85.5 | 152.2 | 161.8 | 96 | -75.9 | 0 | 0 | 0 | 109.6 | T87 | Y85-T87 HydrophobicContact CE1-CG2 4.35Å; Y85-T87 HydrophobicContact CE2-CG2 4.07Å | ||
| 86 | T | 37.4 | Very low | 43.8 | Very low | 138 Ų | 138 | 135.9 Ų | 135.9 | 85% | 0.847 | 80% | 0.8 | S | S | * | * | trans | -111 | 154.6 | 173.7 | -159.3 | 0 | 0 | 0 | 0 | 112 | ||||
| 87 | T | 45.5 | Very low | 43.8 | Very low | 94 Ų | 94 | 139.2 Ų | 139.2 | 58% | 0.577 | 81% | 0.811 | S | S | * | * | trans | -109.9 | 142.6 | -138.9 | 55.7 | 0 | 0 | 0 | 0 | 114.6 | Y85 | Y85-T87 HydrophobicContact CE1-CG2 4.35Å; Y85-T87 HydrophobicContact CE2-CG2 4.07Å | ||
| 88 | L | 45.7 | Very low | 43.9 | Very low | 163 Ų | 163 | 135.1 Ų | 135.1 | 85% | 0.853 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -81.4 | 137 | 161.1 | -72.1 | 172.3 | 0 | 0 | 0 | 109.4 | P90 | L88-P90 VanDerWaalsContact O-CD 3.3Å; L88-P90 WeakPolarHBondContact O-CD 3.44Å |
| 89 | T | 52.1 | Low | 44.1 | Very low | 135 Ų | 135 | 138.4 Ų | 138.4 | 83% | 0.828 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 117.7 | -179.8 | -42.8 | 0 | 0 | 0 | 0 | 111.4 | ||
| 90 | P | 52.9 | Low | 44.1 | Very low | 112 Ų | 112 | 136.9 Ų | 136.9 | 73% | 0.727 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 127.5 | 172.4 | 31.5 | -31.3 | 0 | 0 | 0 | 110.4 | L88 | L88-P90 VanDerWaalsContact O-CD 3.3Å; L88-P90 WeakPolarHBondContact O-CD 3.44Å |
| 91 | L | 47.5 | Very low | 44.1 | Very low | 173 Ų | 173 | 137 Ų | 137 | 91% | 0.906 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 135.7 | 168.4 | -73.9 | 165.6 | 0 | 0 | 0 | 109.6 | ||
| 92 | Q | 64.9 | Low | 44.1 | Very low | 183 Ų | 183 | 139.2 Ų | 139.2 | 86% | 0.855 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 143.3 | -178.5 | -72.4 | -158.8 | -19 | 0 | 0 | 112.6 | ||
| 93 | P | 53.7 | Low | 43.9 | Very low | 122 Ų | 122 | 142 Ų | 142 | 79% | 0.792 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -73 | 134.3 | 166.5 | 30.9 | -32.5 | 0 | 0 | 0 | 110.7 | ||
| 94 | L | 46.8 | Very low | 44.1 | Very low | 163 Ų | 163 | 145.1 Ų | 145.1 | 85% | 0.853 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 146 | 172.4 | -71.1 | 163 | 0 | 0 | 0 | 110.8 | ||
| 95 | P | 49.8 | Very low | 44.9 | Very low | 111 Ų | 111 | 143.6 Ų | 143.6 | 72% | 0.721 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 149.1 | 178 | 29 | -34.9 | 0 | 0 | 0 | 112.1 | ||
| 96 | P | 54.2 | Low | 45.3 | Very low | 131 Ų | 131 | 139.5 Ų | 139.5 | 85% | 0.851 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 144.5 | -178 | 29.5 | -34.9 | 0 | 0 | 0 | 112.8 | ||
| 97 | I | 46.9 | Very low | 45.1 | Very low | 165 Ų | 165 | 140.6 Ų | 140.6 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 119.8 | 176.5 | -60.5 | 170.3 | 0 | 0 | 0 | 109.7 | ||
| 98 | S | 35.5 | Very low | 44.5 | Very low | 103 Ų | 103 | 144 Ų | 144 | 72% | 0.72 | 80% | 0.802 | S | S | * | * | trans | 171.4 | 115.3 | 136.1 | -80.2 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 99 | T | 38.4 | Very low | 44.2 | Very low | 143 Ų | 143 | 144.6 Ų | 144.6 | 88% | 0.877 | 80% | 0.8 | S | S | * | * | trans | 179.4 | 93.3 | 136.6 | 32.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 100 | V | 35.8 | Very low | 43.3 | Very low | 154 Ų | 154 | 147.2 Ų | 147.2 | 93% | 0.933 | 80% | 0.802 | S | S | * | * | trans | -159.6 | 100.1 | 133.9 | -94.6 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 101 | S | 35.7 | Very low | 42.4 | Very low | 127 Ų | 127 | 149.4 Ų | 149.4 | 89% | 0.888 | 80% | 0.803 | S | S | * | * | trans | -96.5 | 124.6 | 166.1 | -74.3 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 102 | D | 34.2 | Very low | 41.7 | Very low | 140 Ų | 140 | 148.1 Ų | 148.1 | 75% | 0.749 | 79% | 0.792 | S | S | * | * | trans | -163.7 | 128.5 | 152 | -143.6 | -125 | 0 | 0 | 0 | 104.8 | ||||
| 103 | K | 31.5 | Very low | 40.2 | Very low | 169 Ų | 169 | 147.4 Ų | 147.4 | 74% | 0.735 | 79% | 0.788 | S | S | * | * | cis | -160.8 | 133 | 5.6 | -163.2 | 155.6 | -179.7 | 162 | 0 | 110.6 | ||||
| 104 | F | 38.3 | Very low | 39.4 | Very low | 202 Ų | 202 | 149 Ų | 149 | 89% | 0.886 | 78% | 0.784 | S | S | * | * | trans | -152.1 | 161.2 | 163.2 | -85.2 | -68.6 | 0 | 0 | 0 | 105.3 | ||||
| 105 | P | 54.6 | Low | 39.5 | Very low | 110 Ų | 110 | 145.9 Ų | 145.9 | 71% | 0.714 | 77% | 0.774 | S | S | * | * | cis | -122.6 | -142.2 | -0.6 | 26.2 | 1.9 | 0 | 0 | 0 | 107.5 | ||||
| 106 | P | 50 | Low | 38.9 | Very low | 91 Ų | 91 | 148.6 Ų | 148.6 | 59% | 0.591 | 78% | 0.777 | S | S | * | * | cis | -156.3 | 173.1 | 7.8 | 49.3 | -28.3 | 0 | 0 | 0 | 123.3 | ||||
| 107 | H | 33.2 | Very low | 38.4 | Very low | 161 Ų | 161 | 149.5 Ų | 149.5 | 75% | 0.745 | 77% | 0.769 | S | S | * | * | trans | 87.5 | 124.1 | 136 | -78.7 | -29.8 | 0 | 0 | 0 | 123 | ||||
| 108 | H | 32.3 | Very low | 38.5 | Very low | 166 Ų | 166 | 147.6 Ų | 147.6 | 77% | 0.769 | 77% | 0.768 | S | S | * | * | trans | 104.9 | 140.6 | 130.6 | -88.4 | 71.2 | 0 | 0 | 0 | 120.8 | ||||
| 109 | H | 40.4 | Very low | 38.8 | Very low | 175 Ų | 175 | 148.5 Ų | 148.5 | 81% | 0.81 | 76% | 0.761 | S | S | * | * | trans | -70.2 | 148.1 | 179.2 | -66 | 9.6 | 0 | 0 | 0 | 112.4 | ||||
| 110 | H | 33.1 | Very low | 39.5 | Very low | 190 Ų | 190 | 147 Ų | 147 | 88% | 0.88 | 75% | 0.753 | S | S | * | * | -161 | 175.5 | 127.1 | -117.7 | 67 | 0 | 0 | 0 | 115.9 | |||||
| 111 | H | 34.1 | Very low | 39.8 | Very low | 159 Ų | 159 | 146.5 Ų | 146.5 | 74% | 0.736 | 74% | 0.74 | S | S | * | * | trans | -92 | 175 | -165.6 | -120 | 47.2 | 0 | 0 | 0 | 115 | ||||
| 112 | H | 32.7 | Very low | 40.6 | Very low | 146 Ų | 146 | 144.6 Ų | 144.6 | 68% | 0.676 | 73% | 0.725 | S | S | * | * | trans | 72.9 | 153.2 | 161.6 | -75.6 | 9.1 | 0 | 0 | 0 | 117.4 | ||||
| 113 | H | 32.9 | Very low | 40.7 | Very low | 167 Ų | 167 | 145.9 Ų | 145.9 | 77% | 0.773 | 73% | 0.726 | S | S | * | * | cis | -149.9 | 169.1 | 4.5 | -119.5 | -36.7 | 0 | 0 | 0 | 112.1 | ||||
| 114 | H | 37.3 | Very low | 41 | Very low | 155 Ų | 155 | 145.7 Ų | 145.7 | 72% | 0.718 | 73% | 0.728 | S | S | * | * | trans | -91 | 167.3 | 174.8 | -139 | -21.8 | 0 | 0 | 0 | 111.1 | ||||
| 115 | P | 49.4 | Very low | 40.8 | Very low | 99 Ų | 99 | 147.1 Ų | 147.1 | 64% | 0.643 | 73% | 0.727 | S | S | * | * | -139.5 | -164.8 | 76.1 | 18.7 | 7.1 | 0 | 0 | 0 | 112 | |||||
| 116 | H | 37.2 | Very low | 39.7 | Very low | 167 Ų | 167 | 149.7 Ų | 149.7 | 77% | 0.773 | 73% | 0.734 | S | S | * | * | cis | -152 | 135.2 | -29.6 | -103.5 | -30.5 | 0 | 0 | 0 | 109.9 | ||||
| 117 | H | 42.8 | Very low | 39.4 | Very low | 150 Ų | 150 | 151 Ų | 151 | 69% | 0.694 | 74% | 0.742 | S | S | * | * | trans | 26.4 | 157.8 | 130.7 | -82.4 | -37.9 | 0 | 0 | 0 | 125.9 | ||||
| 118 | P | 49 | Very low | 39.4 | Very low | 125 Ų | 125 | 146.3 Ų | 146.3 | 81% | 0.812 | 74% | 0.738 | S | S | * | * | cis | -121.6 | -178 | 20.9 | 35.8 | -17.8 | 0 | 0 | 0 | 118.5 | ||||
| 119 | H | 41.2 | Very low | 39.6 | Very low | 123 Ų | 123 | 146.4 Ų | 146.4 | 57% | 0.569 | 74% | 0.744 | S | S | * | * | trans | -112.3 | -177.6 | -170.2 | -125.6 | 38.6 | 0 | 0 | 0 | 110.8 | H121 | H119-H121 AromaticContact CD2-CD2 3.77Å; H119-H121 AromaticContact CD2-CE1 3.38Å; H119-H121 PolarHBondContact CD2-CE1 3.38Å; H119-H121 AromaticContact CD2-CG 3.87Å; H119-H121 AromaticContact CD2-ND1 3.64Å; H119-H121 AromaticContact CD2-NE2 3.46Å; H119-H121 PolarHBondContact CD2-NE2 3.39Å; H119-H121 AromaticContact NE2-CE1 3.14Å; H119-H121 PolarHBondContact NE2-CE1 3.36Å; H119-H121 AromaticContact NE2-ND1 3.36Å; H119-H121 PolarHBondContact NE2-ND1 3.14Å; H119-H121 AromaticContact NE2-NE2 3.73Å | ||
| 120 | P | 52.9 | Low | 39.2 | Very low | 110 Ų | 110 | 145.3 Ų | 145.3 | 71% | 0.714 | 75% | 0.75 | S | S | * | * | cis | -145 | 148.5 | 30.2 | 40.4 | -18.8 | 0 | 0 | 0 | 120.6 | ||||
| 121 | H | 43.8 | Very low | 39.3 | Very low | 144 Ų | 144 | 141.6 Ų | 141.6 | 67% | 0.667 | 75% | 0.745 | S | S | * | * | trans | 44.5 | 161.3 | 131.2 | -70.4 | -33.5 | 0 | 0 | 0 | 125.5 | H119 | H119-H121 AromaticContact CD2-CD2 3.77Å; H119-H121 AromaticContact CD2-CE1 3.38Å; H119-H121 PolarHBondContact CD2-CE1 3.38Å; H119-H121 AromaticContact CD2-CG 3.87Å; H119-H121 AromaticContact CD2-ND1 3.64Å; H119-H121 AromaticContact CD2-NE2 3.46Å; H119-H121 PolarHBondContact CD2-NE2 3.39Å; H119-H121 AromaticContact NE2-CE1 3.14Å; H119-H121 PolarHBondContact NE2-CE1 3.36Å; H119-H121 AromaticContact NE2-ND1 3.36Å; H119-H121 PolarHBondContact NE2-ND1 3.14Å; H119-H121 AromaticContact NE2-NE2 3.73Å | ||
| 122 | P | 51.2 | Low | 39.4 | Very low | 87 Ų | 87 | 137.5 Ų | 137.5 | 57% | 0.565 | 75% | 0.746 | S | S | * | * | cis | -146.4 | 173.4 | -25.6 | 38.3 | -18.8 | 0 | 0 | 0 | 118.4 | ||||
| 123 | H | 37.9 | Very low | 39.3 | Very low | 168 Ų | 168 | 136.3 Ų | 136.3 | 78% | 0.778 | 75% | 0.754 | S | S | * | * | trans | 70.4 | 147.9 | 158.3 | -51.1 | -46 | 0 | 0 | 0 | 119.2 | ||||
| 124 | Q | 37.3 | Very low | 39.4 | Very low | 164 Ų | 164 | 137 Ų | 137 | 77% | 0.766 | 76% | 0.755 | S | S | * | * | cis | -155.2 | 136.7 | -4.5 | -135.9 | -174.5 | 89.5 | 0 | 0 | 112.9 | ||||
| 125 | R | 34.1 | Very low | 39.7 | Very low | 233 Ų | 233 | 135.5 Ų | 135.5 | 88% | 0.879 | 76% | 0.757 | S | S | * | * | trans | 51.3 | 137.1 | 155.2 | -84 | -175.7 | 163.6 | 155.1 | -2.6 | 125.3 | ||||
| 126 | L | 31.2 | Very low | 39.2 | Very low | 164 Ų | 164 | 138 Ų | 138 | 86% | 0.859 | 76% | 0.764 | S | S | * | * | trans | -76.8 | -176 | 177.4 | -86.3 | 78.2 | 0 | 0 | 0 | 114.9 | ||||
| 127 | P | 44.2 | Very low | 39.5 | Very low | 117 Ų | 117 | 139.2 Ų | 139.2 | 76% | 0.76 | 77% | 0.772 | S | S | * | * | cis | -135.2 | 164.4 | -2.8 | 21.6 | 3 | 0 | 0 | 0 | 118 | ||||
| 128 | G | 32.4 | Very low | 39.1 | Very low | 64 Ų | 64 | 141 Ų | 141 | 66% | 0.66 | 77% | 0.773 | S | S | * | * | 82.8 | 106.1 | 128.4 | 0 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 129 | N | 35.8 | Very low | 38.4 | Very low | 168 Ų | 168 | 142.8 Ų | 142.8 | 90% | 0.898 | 77% | 0.77 | S | S | * | * | 177.7 | 144.2 | 102.7 | -90.8 | 2.3 | 0 | 0 | 0 | 112.1 | |||||
| 130 | V | 32.9 | Very low | 38 | Very low | 152 Ų | 152 | 143.1 Ų | 143.1 | 92% | 0.921 | 78% | 0.776 | S | S | * | * | trans | -79.8 | 127.3 | 177.3 | 82.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 131 | S | 35.2 | Very low | 37.3 | Very low | 112 Ų | 112 | 147.6 Ų | 147.6 | 78% | 0.783 | 78% | 0.779 | S | S | * | * | trans | -114.4 | 127.8 | 178.3 | -166.9 | 0 | 0 | 0 | 0 | 109.9 | S133 | S131-S133 PolarHBondContact O-N 3.37Š| ||
| 132 | G | 35.2 | Very low | 36.7 | Very low | 73 Ų | 73 | 146.1 Ų | 146.1 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | trans | -69.5 | 122.4 | -175 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 133 | S | 30.6 | Very low | 36 | Very low | 120 Ų | 120 | 150.5 Ų | 150.5 | 84% | 0.839 | 80% | 0.802 | S | S | * | * | trans | -69.8 | 131.1 | 173.1 | -174.8 | 0 | 0 | 0 | 0 | 110.9 | S131 | S131-S133 PolarHBondContact O-N 3.37Š| ||
| 134 | F | 36.3 | Very low | 35.9 | Very low | 181 Ų | 181 | 147.1 Ų | 147.1 | 79% | 0.794 | 80% | 0.804 | S | S | * | * | trans | -115.7 | 146.4 | 156.4 | 79.3 | -94.5 | 0 | 0 | 0 | 108.9 | ||||
| 135 | T | 43.1 | Very low | 36.4 | Very low | 124 Ų | 124 | 145.5 Ų | 145.5 | 76% | 0.761 | 81% | 0.807 | S | S | * | * | trans | -71.3 | 133.5 | -164.4 | 36.4 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 136 | L | 37.8 | Very low | 36.5 | Very low | 152 Ų | 152 | 143.6 Ų | 143.6 | 80% | 0.796 | 81% | 0.81 | S | S | * | * | trans | -79.7 | 115.1 | 165.5 | -71.1 | 170.3 | 0 | 0 | 0 | 109.5 | ||||
| 137 | M | 44.6 | Very low | 36.6 | Very low | 192 Ų | 192 | 142.7 Ų | 142.7 | 95% | 0.946 | 81% | 0.806 | S | S | * | * | trans | -83.2 | 113.3 | 154.1 | -72.6 | -103.4 | -84.2 | 0 | 0 | 107.1 | ||||
| 138 | R | 33.6 | Very low | 35.8 | Very low | 189 Ų | 189 | 142.6 Ų | 142.6 | 71% | 0.713 | 81% | 0.809 | S | S | * | * | trans | -108.3 | 155.5 | -178.1 | 159.3 | -175.8 | -77.5 | -165.5 | -0.6 | 108.8 | ||||
| 139 | E | 35.3 | Very low | 35.9 | Very low | 162 Ų | 162 | 147.4 Ų | 147.4 | 76% | 0.757 | 82% | 0.819 | S | S | * | * | trans | 69.6 | 141.6 | 171.2 | -79.8 | 138.2 | -162 | 0 | 0 | 115.1 | ||||
| 140 | D | 33.4 | Very low | 35.8 | Very low | 129 Ų | 129 | 150.1 Ų | 150.1 | 69% | 0.69 | 82% | 0.818 | S | S | * | * | cis | -148.3 | 166.9 | 3.8 | -178 | -133.5 | 0 | 0 | 0 | 112 | ||||
| 141 | R | 37.3 | Very low | 36.4 | Very low | 205 Ų | 205 | 148.3 Ų | 148.3 | 77% | 0.774 | 81% | 0.809 | S | S | * | * | trans | 104.9 | 84.2 | 141 | -133.6 | 157.4 | -174.4 | 170.2 | 0.2 | 121.2 | ||||
| 142 | S | 30.7 | Very low | 36.1 | Very low | 112 Ų | 112 | 147.8 Ų | 147.8 | 78% | 0.783 | 81% | 0.811 | S | S | * | * | trans | 79.7 | 124.7 | 130.4 | -64.2 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 143 | L | 37.3 | Very low | 36.1 | Very low | 180 Ų | 180 | 154.9 Ų | 154.9 | 94% | 0.942 | 82% | 0.817 | S | S | * | * | trans | -89.9 | 154.3 | 172 | -58.9 | 162.2 | 0 | 0 | 0 | 110.7 | ||||
| 144 | A | 34.9 | Very low | 36.4 | Very low | 97 Ų | 97 | 157.6 Ų | 157.6 | 80% | 0.802 | 82% | 0.816 | S | S | * | * | trans | -131.4 | 129.7 | 156.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 145 | P | 49 | Very low | 36.3 | Very low | 129 Ų | 129 | 156.7 Ų | 156.7 | 84% | 0.838 | 81% | 0.814 | S | S | * | * | trans | -90.9 | 150.8 | -168.8 | 34.6 | -35.2 | 0 | 0 | 0 | 113.9 | ||||
| 146 | M | 35.6 | Very low | 35.9 | Very low | 193 Ų | 193 | 160.1 Ų | 160.1 | 95% | 0.951 | 82% | 0.818 | S | S | * | * | trans | -85.3 | 118.3 | 162.4 | -75.5 | -93.8 | -175 | 0 | 0 | 109.8 | ||||
| 147 | N | 32.4 | Very low | 35.9 | Very low | 145 Ų | 145 | 159.7 Ų | 159.7 | 78% | 0.775 | 82% | 0.817 | S | S | * | * | trans | -178 | 135 | 132 | -148.4 | 6 | 0 | 0 | 0 | 112.3 | ||||
| 148 | S | 28.3 | Very low | 36.2 | Very low | 115 Ų | 115 | 156.2 Ų | 156.2 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | 164.1 | 147.3 | 134.1 | -75.5 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 149 | L | 34.5 | Very low | 36.1 | Very low | 166 Ų | 166 | 153.2 Ų | 153.2 | 87% | 0.869 | 82% | 0.815 | S | S | * | * | trans | -96.2 | 162.2 | -177.1 | -61.6 | 106.3 | 0 | 0 | 0 | 112.7 | ||||
| 150 | Y | 33.3 | Very low | 36.2 | Very low | 225 Ų | 225 | 154.7 Ų | 154.7 | 88% | 0.882 | 82% | 0.824 | S | S | * | * | trans | -54.8 | 173.9 | 170.6 | -100.5 | -109.8 | 0 | 0 | 0 | 114 | ||||
| 151 | P | 45.6 | Very low | 36.3 | Very low | 113 Ų | 113 | 151.8 Ų | 151.8 | 73% | 0.734 | 83% | 0.825 | S | S | * | * | cis | -134.2 | 171.4 | 1 | 40.8 | -25.1 | 0 | 0 | 0 | 116 | ||||
| 152 | A | 29.6 | Very low | 36.2 | Very low | 101 Ų | 101 | 151.7 Ų | 151.7 | 84% | 0.835 | 83% | 0.833 | S | S | * | * | trans | -154.5 | 134 | 154.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 153 | Y | 35.5 | Very low | 36.8 | Very low | 223 Ų | 223 | 151.2 Ų | 151.2 | 88% | 0.875 | 83% | 0.83 | S | S | * | * | trans | -82 | 142.1 | 174.1 | -91 | -107.1 | 0 | 0 | 0 | 111.6 | ||||
| 154 | H | 35.8 | Very low | 36.8 | Very low | 177 Ų | 177 | 151 Ų | 151 | 82% | 0.819 | 83% | 0.829 | S | S | * | * | trans | -161.2 | 126.1 | 132.7 | -124.6 | -78.2 | 0 | 0 | 0 | 114.5 | ||||
| 155 | H | 34.7 | Very low | 37.1 | Very low | 162 Ų | 162 | 151.2 Ų | 151.2 | 75% | 0.75 | 82% | 0.824 | S | S | * | * | trans | -51.5 | 146.3 | 162.4 | -118.7 | -87 | 0 | 0 | 0 | 112.1 | ||||
| 156 | K | 35.2 | Very low | 37.2 | Very low | 195 Ų | 195 | 150.8 Ų | 150.8 | 85% | 0.848 | 82% | 0.822 | S | S | * | * | -168.7 | 120.4 | 111.1 | -50.6 | -162.4 | -173.6 | 174.2 | 0 | 112.6 | |||||
| 157 | D | 36.6 | Very low | 37.4 | Very low | 144 Ų | 144 | 149.2 Ų | 149.2 | 77% | 0.77 | 82% | 0.816 | S | S | * | * | trans | -87.5 | 170.7 | 149.3 | -80.6 | -68.2 | 0 | 0 | 0 | 108.4 | ||||
| 158 | P | 52.1 | Low | 37.8 | Very low | 119 Ų | 119 | 148.5 Ų | 148.5 | 77% | 0.773 | 82% | 0.823 | S | S | * | * | cis | -144.6 | -176.5 | 24.8 | 43.4 | -23.8 | 0 | 0 | 0 | 117.1 | ||||
| 159 | C | 31.1 | Very low | 38.1 | Very low | 125 Ų | 125 | 146.3 Ų | 146.3 | 85% | 0.845 | 82% | 0.819 | S | S | * | * | 157.3 | 152.8 | 125.3 | -159.1 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 160 | M | 37.6 | Very low | 38.2 | Very low | 193 Ų | 193 | 145 Ų | 145 | 95% | 0.951 | 82% | 0.823 | S | S | * | * | trans | -65.7 | 169.4 | -168.2 | -55.5 | -177 | 174 | 0 | 0 | 119.1 | ||||
| 161 | G | 35.6 | Very low | 38.3 | Very low | 68 Ų | 68 | 137 Ų | 137 | 70% | 0.701 | 81% | 0.81 | S | S | * | * | trans | 140.5 | 85.5 | 154.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 162 | Q | 35.3 | Very low | 38.1 | Very low | 203 Ų | 203 | 140.3 Ų | 140.3 | 95% | 0.949 | 82% | 0.82 | S | S | * | * | 73.3 | 137.6 | 98.4 | -73.8 | -164.3 | 1.9 | 0 | 0 | 117.3 | |||||
| 163 | S | 42.8 | Very low | 38.2 | Very low | 103 Ų | 103 | 140.2 Ų | 140.2 | 72% | 0.72 | 82% | 0.82 | S | S | * | * | trans | -113.1 | 140.4 | -178.7 | 166.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 164 | L | 37.6 | Very low | 38 | Very low | 174 Ų | 174 | 135.3 Ų | 135.3 | 91% | 0.911 | 82% | 0.818 | S | S | * | * | trans | -150.3 | 147.7 | 157.1 | -77.3 | -173.3 | 0 | 0 | 0 | 112.2 | ||||
| 165 | S | 41.6 | Very low | 38.3 | Very low | 102 Ų | 102 | 134.4 Ų | 134.4 | 71% | 0.713 | 82% | 0.818 | S | S | * | * | trans | -90.4 | -176.8 | -174.8 | -45.8 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 166 | P | 50.6 | Low | 38.4 | Very low | 121 Ų | 121 | 134.4 Ų | 134.4 | 79% | 0.786 | 82% | 0.817 | S | S | * | * | -142.3 | 138.8 | 85.5 | 23.7 | -1.3 | 0 | 0 | 0 | 114.6 | |||||
| 167 | L | 38.8 | Very low | 38.1 | Very low | 159 Ų | 159 | 130.1 Ų | 130.1 | 83% | 0.832 | 81% | 0.808 | S | S | * | * | 68.4 | 112.3 | 81.3 | -74.4 | 174.5 | 0 | 0 | 0 | 117.9 | |||||
| 168 | S | 41.9 | Very low | 37.9 | Very low | 130 Ų | 130 | 128 Ų | 128 | 91% | 0.909 | 80% | 0.804 | S | S | * | * | trans | 175.9 | 139.6 | 137.4 | -75.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 169 | G | 35.3 | Very low | 37 | Very low | 70 Ų | 70 | 131.5 Ų | 131.5 | 72% | 0.722 | 81% | 0.81 | S | S | * | * | cis | 160.2 | 116.6 | -9.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 170 | S | 36.5 | Very low | 37.2 | Very low | 137 Ų | 137 | 130.4 Ų | 130.4 | 96% | 0.958 | 81% | 0.81 | S | S | * | * | trans | 57.7 | 146.4 | 163.5 | -59.6 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 171 | G | 34.2 | Very low | 36.8 | Very low | 59 Ų | 59 | 124.9 Ų | 124.9 | 61% | 0.608 | 80% | 0.802 | S | S | * | * | cis | -156.6 | 148.7 | -5.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 172 | L | 41 | Very low | 36.8 | Very low | 181 Ų | 181 | 129.4 Ų | 129.4 | 95% | 0.948 | 81% | 0.809 | S | S | * | * | 58.7 | 132.2 | 93.5 | -55.2 | -175.3 | 0 | 0 | 0 | 113.3 | |||||
| 173 | A | 31.6 | Very low | 38.2 | Very low | 100 Ų | 100 | 124.7 Ų | 124.7 | 83% | 0.826 | 80% | 0.796 | S | S | * | * | cis | -164.6 | -171.5 | 33 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 174 | S | 33 | Very low | 38.5 | Very low | 120 Ų | 120 | 125.1 Ų | 125.1 | 84% | 0.839 | 80% | 0.796 | S | S | * | * | cis | -164.7 | -178.5 | -37 | -174.7 | 0 | 0 | 0 | 0 | 107 | ||||
| 175 | I | 40.8 | Very low | 38.4 | Very low | 158 Ų | 158 | 127.5 Ų | 127.5 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | trans | -103.8 | 152.6 | -166.3 | -55.1 | 171.3 | 0 | 0 | 0 | 112 | ||||
| 176 | H | 36.9 | Very low | 37.9 | Very low | 161 Ų | 161 | 127.1 Ų | 127.1 | 75% | 0.745 | 80% | 0.798 | S | S | * | * | trans | 131.6 | 115.1 | 133.3 | -156.8 | -124.3 | 0 | 0 | 0 | 119.3 | ||||
| 177 | T | 29.7 | Very low | 37.3 | Very low | 105 Ų | 105 | 130.5 Ų | 130.5 | 64% | 0.644 | 80% | 0.803 | S | S | * | * | trans | 75.3 | 141.8 | 135.4 | -142.2 | 0 | 0 | 0 | 0 | 126.8 | ||||
| 178 | S | 32.7 | Very low | 38 | Very low | 100 Ų | 100 | 129 Ų | 129 | 70% | 0.699 | 80% | 0.803 | S | S | * | * | trans | 80.6 | 117.5 | 142.4 | 76.8 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 179 | Q | 33 | Very low | 37.4 | Very low | 193 Ų | 193 | 126 Ų | 126 | 90% | 0.902 | 79% | 0.792 | S | S | * | * | 114.3 | 137 | 121.8 | -141.6 | -176.7 | 36.6 | 0 | 0 | 120.4 | |||||
| 180 | A | 34.1 | Very low | 37.3 | Very low | 101 Ų | 101 | 127.9 Ų | 127.9 | 84% | 0.835 | 80% | 0.8 | S | S | * | * | trans | 89.9 | 123.3 | 152.2 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 181 | G | 29.4 | Very low | 37.2 | Very low | 77 Ų | 77 | 126.2 Ų | 126.2 | 79% | 0.794 | 80% | 0.795 | S | S | * | * | trans | 135.7 | 99.3 | 157.1 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 182 | I | 37.2 | Very low | 37.4 | Very low | 164 Ų | 164 | 131.9 Ų | 131.9 | 84% | 0.841 | 81% | 0.808 | S | S | * | * | trans | -142.9 | 174.3 | 164.5 | -25.8 | -179.3 | 0 | 0 | 0 | 108.9 | ||||
| 183 | P | 64 | Low | 38 | Very low | 103 Ų | 103 | 129.1 Ų | 129.1 | 67% | 0.669 | 80% | 0.801 | S | S | * | * | -104.5 | -157.9 | -93.9 | 37.1 | -19.5 | 0 | 0 | 0 | 113.3 | |||||
| 184 | P | 48.6 | Very low | 38 | Very low | 112 Ų | 112 | 127.6 Ų | 127.6 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | -146.8 | 150.2 | 102.3 | 36 | -19.3 | 0 | 0 | 0 | 118.4 | |||||
| 185 | Y | 35.9 | Very low | 37.9 | Very low | 225 Ų | 225 | 129.2 Ų | 129.2 | 88% | 0.882 | 79% | 0.789 | S | S | * | * | trans | 28.6 | 139.4 | 140.9 | -73.3 | -97.9 | 0 | 0 | 0 | 121.5 | ||||
| 186 | A | 30.6 | Very low | 37.6 | Very low | 94 Ų | 94 | 129.4 Ų | 129.4 | 78% | 0.777 | 78% | 0.784 | S | S | * | * | -171.8 | 162.8 | 55.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 187 | H | 37.7 | Very low | 37.3 | Very low | 191 Ų | 191 | 129.6 Ų | 129.6 | 88% | 0.884 | 79% | 0.787 | S | S | * | * | trans | -104 | -162.7 | 168.7 | -92.3 | -73 | 0 | 0 | 0 | 110 | ||||
| 188 | P | 53.7 | Low | 37.6 | Very low | 129 Ų | 129 | 131.5 Ų | 131.5 | 84% | 0.838 | 79% | 0.793 | S | S | * | * | cis | -139.2 | -168.7 | -4.9 | 34.4 | -10.3 | 0 | 0 | 0 | 116.4 | ||||
| 189 | G | 29.3 | Very low | 37.8 | Very low | 66 Ų | 66 | 132.4 Ų | 132.4 | 68% | 0.68 | 79% | 0.794 | S | S | * | * | trans | 152.7 | 96.2 | 155.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 190 | A | 33.8 | Very low | 38.1 | Very low | 109 Ų | 109 | 129.5 Ų | 129.5 | 90% | 0.901 | 79% | 0.792 | S | S | * | * | 72.8 | 135.8 | 88.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 191 | A | 33.2 | Very low | 38 | Very low | 102 Ų | 102 | 130.8 Ų | 130.8 | 84% | 0.843 | 80% | 0.795 | S | S | * | * | cis | -156.3 | -180 | 1.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 192 | M | 39.7 | Very low | 38 | Very low | 179 Ų | 179 | 130.7 Ų | 130.7 | 88% | 0.882 | 79% | 0.794 | S | S | * | * | trans | -89.5 | -167.5 | 174.4 | -50.5 | -88.1 | -77.3 | 0 | 0 | 111.1 | ||||
| 193 | P | 52.9 | Low | 37.7 | Very low | 122 Ų | 122 | 132 Ų | 132 | 79% | 0.792 | 79% | 0.794 | S | S | * | * | cis | -131.9 | -167.6 | -23 | 36.3 | -16.5 | 0 | 0 | 0 | 113 | ||||
| 194 | G | 31.8 | Very low | 36 | Very low | 68 Ų | 68 | 135.9 Ų | 135.9 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | trans | 122 | 100.1 | 137.7 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 195 | E | 31.6 | Very low | 35.3 | Very low | 154 Ų | 154 | 133.3 Ų | 133.3 | 72% | 0.72 | 79% | 0.791 | S | S | * | * | trans | 34.6 | 133 | 133.1 | -44.3 | -172.8 | -179 | 0 | 0 | 124.4 | ||||
| 196 | K | 34.3 | Very low | 35.2 | Very low | 162 Ų | 162 | 131.1 Ų | 131.1 | 70% | 0.704 | 79% | 0.789 | S | S | * | * | trans | 62 | 110.7 | 137.9 | 75.9 | -154.6 | 165.4 | -160.9 | 0 | 122.3 | ||||
| 197 | M | 30.2 | Very low | 35.4 | Very low | 165 Ų | 165 | 135.2 Ų | 135.2 | 81% | 0.813 | 79% | 0.791 | S | S | * | * | 145.1 | 146.7 | 115.5 | -76.7 | -150.1 | 177.2 | 0 | 0 | 116.8 | |||||
| 198 | L | 36.3 | Very low | 35.9 | Very low | 145 Ų | 145 | 132.3 Ų | 132.3 | 76% | 0.759 | 79% | 0.79 | S | S | * | * | trans | 74.8 | 112.2 | 152.1 | -68.6 | 153.6 | 0 | 0 | 0 | 122.1 | ||||
| 199 | T | 35.8 | Very low | 35 | Very low | 119 Ų | 119 | 130.7 Ų | 130.7 | 73% | 0.73 | 79% | 0.787 | S | S | * | * | trans | 54.3 | 119.6 | 140.3 | 57.4 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 200 | P | 39.1 | Very low | 35.6 | Very low | 133 Ų | 133 | 136 Ų | 136 | 86% | 0.864 | 80% | 0.796 | S | S | * | * | trans | -102.6 | 126.4 | 149.1 | 34.2 | -24.5 | 0 | 0 | 0 | 111.7 | ||||
| 201 | S | 32.2 | Very low | 35.7 | Very low | 127 Ų | 127 | 138.9 Ų | 138.9 | 89% | 0.888 | 80% | 0.795 | S | S | * | * | trans | -119.1 | 128 | 163.8 | -75.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 202 | G | 29.9 | Very low | 35.5 | Very low | 75 Ų | 75 | 138.8 Ų | 138.8 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | trans | 157.8 | 61.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 203 | F | 31.2 | Very low | 35.2 | Very low | 192 Ų | 192 | 142.3 Ų | 142.3 | 84% | 0.842 | 79% | 0.792 | S | S | * | * | trans | 49.6 | 103.6 | 149.6 | 174.5 | -102.8 | 0 | 0 | 0 | 118.8 | A205 | F203-A205 HydrophobicContact CE2-CB 4Å; F203-A205 HydrophobicContact CZ-CB 4.27Å | ||
| 204 | E | 28.5 | Very low | 34.2 | Very low | 185 Ų | 185 | 145 Ų | 145 | 86% | 0.864 | 79% | 0.794 | S | S | * | * | trans | -132.9 | 135.2 | 150.8 | -172.3 | 158.1 | 115.6 | 0 | 0 | 110.1 | ||||
| 205 | A | 32.9 | Very low | 34.2 | Very low | 58 Ų | 58 | 145 Ų | 145 | 48% | 0.479 | 79% | 0.787 | S | S | . | * | trans | -111.2 | 105.4 | -166.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | F203 | F203-A205 HydrophobicContact CE2-CB 4Å; F203-A205 HydrophobicContact CZ-CB 4.27Å | ||
| 206 | H | 35.2 | Very low | 34.3 | Very low | 179 Ų | 179 | 146 Ų | 146 | 83% | 0.829 | 79% | 0.792 | S | S | * | * | trans | 65.4 | 90.5 | 151.4 | -54.8 | -62.9 | 0 | 0 | 0 | 120.5 | ||||
| 207 | H | 34 | Very low | 34.2 | Very low | 180 Ų | 180 | 147 Ų | 147 | 83% | 0.833 | 80% | 0.799 | S | S | * | * | trans | -97.5 | 137.9 | 140 | -74.7 | -84.4 | 0 | 0 | 0 | 110.4 | ||||
| 208 | P | 48.8 | Very low | 34.3 | Very low | 130 Ų | 130 | 146.5 Ų | 146.5 | 84% | 0.844 | 79% | 0.794 | S | S | * | * | trans | -99.4 | 130.4 | 169.1 | 33.9 | -29 | 0 | 0 | 0 | 112.5 | ||||
| 209 | A | 34 | Very low | 33.9 | Very low | 95 Ų | 95 | 146.8 Ų | 146.8 | 79% | 0.785 | 79% | 0.793 | S | S | * | * | trans | -139.5 | 118.2 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 210 | M | 42.8 | Very low | 33.5 | Very low | 178 Ų | 178 | 146.7 Ų | 146.7 | 88% | 0.877 | 79% | 0.793 | S | S | * | * | trans | 26.6 | 120.2 | 143.8 | -63.3 | -70.4 | -141 | 0 | 0 | 121.1 | ||||
| 211 | L | 36.2 | Very low | 33 | Very low | 168 Ų | 168 | 145.3 Ų | 145.3 | 88% | 0.88 | 79% | 0.786 | S | S | * | * | 177.8 | 162.9 | 125.5 | -117.2 | 75.3 | 0 | 0 | 0 | 107.7 | |||||
| 212 | S | 28.4 | Very low | 32.9 | Very low | 100 Ų | 100 | 144.4 Ų | 144.4 | 70% | 0.699 | 78% | 0.78 | S | S | * | * | cis | -158.7 | 160.6 | -15.8 | -150.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 213 | R | 33.3 | Very low | 32.9 | Very low | 253 Ų | 253 | 146 Ų | 146 | 96% | 0.955 | 79% | 0.786 | S | S | * | * | trans | -137.6 | 137.2 | 165.3 | -82.1 | -169.5 | 172.8 | -166.9 | -2 | 110.6 | ||||
| 214 | H | 32.1 | Very low | 32.9 | Very low | 178 Ų | 178 | 139.8 Ų | 139.8 | 82% | 0.824 | 78% | 0.776 | S | S | * | * | trans | -130.5 | 122.3 | -178.6 | -152 | -111.5 | 0 | 0 | 0 | 105.8 | ||||
| 215 | A | 32.2 | Very low | 33.2 | Very low | 68 Ų | 68 | 138.4 Ų | 138.4 | 56% | 0.562 | 77% | 0.771 | S | S | * | * | 59.3 | 128.9 | 79.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 216 | E | 32.2 | Very low | 33.4 | Very low | 175 Ų | 175 | 142.7 Ų | 142.7 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | cis | -166.6 | -177.9 | 1.7 | -113 | -172.8 | 131.4 | 0 | 0 | 110.5 | ||||
| 217 | Q | 32.6 | Very low | 33.4 | Very low | 184 Ų | 184 | 141.8 Ų | 141.8 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | trans | 82.1 | 149.9 | 163.6 | -52.3 | -172 | 9.9 | 0 | 0 | 119.9 | ||||
| 218 | H | 32.9 | Very low | 33.5 | Very low | 155 Ų | 155 | 141 Ų | 141 | 72% | 0.718 | 79% | 0.788 | S | S | * | * | cis | -169.6 | 146.2 | -30.9 | -158.5 | -148.3 | 0 | 0 | 0 | 112.1 | ||||
| 219 | M | 27.3 | Very low | 32.7 | Very low | 150 Ų | 150 | 142 Ų | 142 | 74% | 0.739 | 79% | 0.786 | S | S | * | * | trans | 80 | 149.7 | 154.6 | -73.2 | -67.7 | 176 | 0 | 0 | 126.3 | ||||
| 220 | T | 28.8 | Very low | 32.6 | Very low | 118 Ų | 118 | 140.9 Ų | 140.9 | 72% | 0.724 | 78% | 0.784 | S | S | * | * | trans | 82.1 | 98.3 | 153.5 | -176.8 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 221 | S | 27.3 | Very low | 32.1 | Very low | 103 Ų | 103 | 139.4 Ų | 139.4 | 72% | 0.72 | 78% | 0.779 | S | S | * | * | 83.3 | 135 | 122.6 | -51.9 | 0 | 0 | 0 | 0 | 125.4 | |||||
| 222 | S | 29.7 | Very low | 31.9 | Very low | 108 Ų | 108 | 138.6 Ų | 138.6 | 76% | 0.755 | 77% | 0.771 | S | S | * | * | trans | 69.2 | 130.6 | 136.8 | 64.5 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 223 | A | 31.3 | Very low | 32.1 | Very low | 108 Ų | 108 | 141.6 Ų | 141.6 | 89% | 0.893 | 77% | 0.773 | S | S | * | * | trans | 61.3 | 153.5 | 154.3 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 224 | G | 30.5 | Very low | 32.1 | Very low | 62 Ų | 62 | 138 Ų | 138 | 64% | 0.639 | 77% | 0.767 | S | S | * | * | cis | -170.6 | 148.8 | -6.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 225 | M | 35 | Very low | 33.1 | Very low | 156 Ų | 156 | 135.2 Ų | 135.2 | 77% | 0.768 | 76% | 0.764 | S | S | * | * | trans | 3.8 | 118.7 | 142.7 | -174.5 | 173.3 | -177.8 | 0 | 0 | 117.3 | Q227 | M225-Q227 HydrophobicContact CE-CG 3.66Å; M225-Q227 HydrophobicContact CG-CG 4.31Å | ||
| 226 | V | 37.7 | Very low | 33.1 | Very low | 148 Ų | 148 | 140.3 Ų | 140.3 | 90% | 0.897 | 78% | 0.776 | S | S | * | * | trans | -124.2 | 122.2 | 153.9 | -81.1 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 227 | Q | 33.5 | Very low | 33 | Very low | 161 Ų | 161 | 136.6 Ų | 136.6 | 75% | 0.752 | 78% | 0.775 | S | S | * | * | trans | -89.6 | 157.8 | -178.5 | -75.8 | -166.1 | -29.1 | 0 | 0 | 112.2 | M225 | M225-Q227 HydrophobicContact CE-CG 3.66Å; M225-Q227 HydrophobicContact CG-CG 4.31Å | ||
| 228 | I | 37.4 | Very low | 33 | Very low | 162 Ų | 162 | 135.2 Ų | 135.2 | 83% | 0.831 | 77% | 0.769 | S | S | * | * | trans | -86.1 | 121.3 | 167.6 | -74.5 | 175.7 | 0 | 0 | 0 | 109.3 | ||||
| 229 | N | 32.2 | Very low | 32.9 | Very low | 151 Ų | 151 | 134.9 Ų | 134.9 | 81% | 0.807 | 77% | 0.772 | S | S | * | * | trans | 64.2 | 113.3 | 147.8 | -150.8 | 66.1 | 0 | 0 | 0 | 119.6 | ||||
| 230 | G | 30.3 | Very low | 33 | Very low | 73 Ų | 73 | 131.7 Ų | 131.7 | 75% | 0.753 | 78% | 0.777 | S | S | * | * | trans | -177.1 | 74.7 | 176 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 231 | L | 33.6 | Very low | 33 | Very low | 147 Ų | 147 | 130.5 Ų | 130.5 | 77% | 0.77 | 78% | 0.779 | S | S | * | * | trans | 2.9 | 141.2 | 151.4 | -74 | 142.5 | 0 | 0 | 0 | 121.4 | ||||
| 232 | H | 31.2 | Very low | 33.1 | Very low | 151 Ų | 151 | 135.2 Ų | 135.2 | 70% | 0.699 | 79% | 0.79 | S | S | * | * | trans | 103.3 | 110.4 | 144 | -78.2 | 27.4 | 0 | 0 | 0 | 122.4 | ||||
| 233 | H | 32.6 | Very low | 33.1 | Very low | 162 Ų | 162 | 133.5 Ų | 133.5 | 75% | 0.75 | 79% | 0.789 | S | S | * | * | trans | 79.3 | 120.9 | 135.6 | -67.8 | 84.7 | 0 | 0 | 0 | 124.1 | ||||
| 234 | H | 34.8 | Very low | 33.1 | Very low | 178 Ų | 178 | 138 Ų | 138 | 82% | 0.824 | 79% | 0.791 | S | S | * | * | trans | -66.8 | 171.7 | 155.9 | -76.7 | -46.1 | 0 | 0 | 0 | 112.1 | ||||
| 235 | P | 51.2 | Low | 33 | Very low | 119 Ų | 119 | 138.7 Ų | 138.7 | 77% | 0.773 | 80% | 0.799 | S | S | * | * | cis | -149.9 | 150.8 | 35 | 40.8 | -18.4 | 0 | 0 | 0 | 122.2 | ||||
| 236 | H | 32.6 | Very low | 32.8 | Very low | 175 Ų | 175 | 141 Ų | 141 | 81% | 0.81 | 81% | 0.807 | S | S | * | * | 28.8 | 120.3 | 127.1 | -151.2 | -1.2 | 0 | 0 | 0 | 123.6 | |||||
| 237 | A | 29.7 | Very low | 32.4 | Very low | 97 Ų | 97 | 137.3 Ų | 137.3 | 80% | 0.802 | 80% | 0.799 | S | S | * | * | trans | -177.5 | 159.4 | 137.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 238 | H | 34.4 | Very low | 32.2 | Very low | 155 Ų | 155 | 138.6 Ų | 138.6 | 72% | 0.718 | 81% | 0.81 | S | S | * | * | cis | -156.2 | 169.1 | -34 | 170.4 | -95.3 | 0 | 0 | 0 | 107.1 | ||||
| 239 | L | 30.4 | Very low | 31.9 | Very low | 149 Ų | 149 | 134.7 Ų | 134.7 | 78% | 0.78 | 81% | 0.81 | S | S | * | * | trans | -51.1 | 154.8 | -176 | -77.8 | 58.6 | 0 | 0 | 0 | 116.2 | ||||
| 240 | G | 29.3 | Very low | 31.7 | Very low | 82 Ų | 82 | 133.2 Ų | 133.2 | 85% | 0.845 | 81% | 0.811 | S | S | * | * | trans | -176.1 | 107.6 | 155.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 241 | A | 28.6 | Very low | 31.5 | Very low | 94 Ų | 94 | 135.9 Ų | 135.9 | 78% | 0.777 | 81% | 0.808 | S | S | * | * | trans | -111.4 | 168.2 | -180 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 242 | Q | 29.9 | Very low | 31.4 | Very low | 202 Ų | 202 | 138.3 Ų | 138.3 | 94% | 0.944 | 81% | 0.807 | S | S | * | * | trans | 86.4 | 132.7 | 151.5 | -161.7 | 163.3 | -24.1 | 0 | 0 | 118.7 | ||||
| 243 | G | 28.3 | Very low | 31.3 | Very low | 72 Ų | 72 | 138.6 Ų | 138.6 | 74% | 0.742 | 81% | 0.809 | S | S | * | * | trans | 149.5 | 88.1 | 162 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 244 | H | 31.8 | Very low | 31.3 | Very low | 202 Ų | 202 | 139.8 Ų | 139.8 | 94% | 0.935 | 82% | 0.815 | S | S | * | * | trans | -33.9 | 153.7 | 162.9 | -90 | 64.2 | 0 | 0 | 0 | 117.6 | ||||
| 245 | G | 28.2 | Very low | 31 | Very low | 77 Ų | 77 | 135.3 Ų | 135.3 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | 154 | 101.3 | 145.3 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 246 | Q | 31 | Very low | 30 | Very low | 204 Ų | 204 | 135.8 Ų | 135.8 | 95% | 0.953 | 82% | 0.815 | S | S | * | * | trans | -25.3 | 151.5 | 161.6 | -60.4 | 167.4 | -9.1 | 0 | 0 | 118.9 | ||||
| 247 | G | 29.1 | Very low | 29.8 | Very low | 70 Ų | 70 | 130.7 Ų | 130.7 | 72% | 0.722 | 81% | 0.81 | S | S | * | * | trans | 137.9 | 107.1 | 138.3 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 248 | L | 30.6 | Very low | 30.7 | Very low | 188 Ų | 188 | 132.6 Ų | 132.6 | 98% | 0.984 | 81% | 0.814 | S | S | * | * | trans | 29.2 | 131.4 | 139.9 | -56.1 | 170.7 | 0 | 0 | 0 | 120.3 | ||||
| 249 | G | 29.7 | Very low | 30.4 | Very low | 80 Ų | 80 | 128.4 Ų | 128.4 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | trans | 167.5 | 84.5 | 162.3 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 250 | S | 29.3 | Very low | 30.8 | Very low | 120 Ų | 120 | 129.1 Ų | 129.1 | 84% | 0.839 | 81% | 0.812 | S | S | * | * | trans | -26.6 | 139.5 | 161.4 | -57.7 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 251 | N | 25.9 | Very low | 31.1 | Very low | 129 Ų | 129 | 133.6 Ų | 133.6 | 69% | 0.69 | 81% | 0.811 | S | S | * | * | 78.3 | 106 | 121.5 | -170.8 | 80.2 | 0 | 0 | 0 | 121.6 | |||||
| 252 | R | 30.2 | Very low | 31.3 | Very low | 198 Ų | 198 | 133 Ų | 133 | 75% | 0.747 | 81% | 0.813 | S | S | * | * | 83.1 | 165.9 | 125.6 | -160.7 | -170.8 | 160.4 | 124.1 | -5.1 | 119.2 | |||||
| 253 | E | 30.6 | Very low | 31.4 | Very low | 158 Ų | 158 | 127.3 Ų | 127.3 | 74% | 0.738 | 81% | 0.809 | S | S | * | * | trans | 81.6 | 103.5 | 169.1 | -50.6 | -172 | 95 | 0 | 0 | 112.7 | ||||
| 254 | Q | 31.2 | Very low | 31.6 | Very low | 186 Ų | 186 | 127.8 Ų | 127.8 | 87% | 0.869 | 81% | 0.814 | S | S | * | * | cis | 57 | 95.5 | 46.1 | -171.4 | 175 | 66 | 0 | 0 | 113.5 | ||||
| 255 | A | 29.3 | Very low | 31.7 | Very low | 85 Ų | 85 | 122.3 Ų | 122.3 | 70% | 0.702 | 81% | 0.812 | S | S | * | * | trans | -178.4 | 146.1 | 133.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 256 | S | 30.1 | Very low | 31.9 | Very low | 129 Ų | 129 | 122.7 Ų | 122.7 | 90% | 0.902 | 82% | 0.817 | S | S | * | * | trans | 60.8 | 144.5 | 151.8 | -53.9 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 257 | G | 27.9 | Very low | 32.2 | Very low | 68 Ų | 68 | 116.9 Ų | 116.9 | 70% | 0.701 | 81% | 0.811 | S | S | * | * | cis | 163.2 | 177.9 | 17.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 258 | P | 49.5 | Very low | 32.6 | Very low | 136 Ų | 136 | 117.9 Ų | 117.9 | 88% | 0.883 | 82% | 0.821 | S | S | * | * | trans | -121.9 | 176.9 | -130 | 41.5 | -33.6 | 0 | 0 | 0 | 116.9 | ||||
| 259 | G | 28.3 | Very low | 32.9 | Very low | 67 Ų | 67 | 112.7 Ų | 112.7 | 69% | 0.691 | 81% | 0.814 | S | S | * | * | trans | 103.7 | 159.8 | 169.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 260 | H | 37.3 | Very low | 33.2 | Very low | 164 Ų | 164 | 113.1 Ų | 113.1 | 76% | 0.759 | 82% | 0.818 | S | S | * | * | cis | -146.2 | 133.4 | -2.1 | -110.5 | 72.8 | 0 | 0 | 0 | 106.4 | ||||
| 261 | Q | 35.8 | Very low | 33.6 | Very low | 176 Ų | 176 | 111.1 Ų | 111.1 | 82% | 0.822 | 82% | 0.816 | S | S | * | * | 76.1 | 128.7 | 94.3 | -164.8 | 179.1 | 100.7 | 0 | 0 | 115.7 | |||||
| 262 | G | 32.4 | Very low | 34.1 | Very low | 81 Ų | 81 | 108.4 Ų | 108.4 | 84% | 0.835 | 82% | 0.818 | S | S | * | * | trans | 95.8 | 131.1 | 171 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 263 | G | 33 | Very low | 34.3 | Very low | 83 Ų | 83 | 102.8 Ų | 102.8 | 86% | 0.856 | 82% | 0.823 | S | S | * | * | cis | 158.8 | 151.4 | -7.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 264 | G | 32.6 | Very low | 35 | Very low | 83 Ų | 83 | 101.9 Ų | 101.9 | 86% | 0.856 | 83% | 0.828 | S | S | * | * | trans | 99.5 | 121.1 | 156.9 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 265 | G | 33 | Very low | 35.7 | Very low | 86 Ų | 86 | 97.5 Ų | 97.5 | 89% | 0.887 | 82% | 0.817 | S | S | * | * | trans | 77.2 | 128 | 156.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 266 | G | 33.8 | Very low | 36.2 | Very low | 86 Ų | 86 | 97 Ų | 97 | 89% | 0.887 | 82% | 0.821 | S | S | * | * | cis | 125.5 | 108.2 | 10.2 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 267 | G | 35.9 | Very low | 36.4 | Very low | 82 Ų | 82 | 94.4 Ų | 94.4 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | trans | 162.4 | 79.5 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 268 | G | 38.8 | Very low | 36.9 | Very low | 90 Ų | 90 | 99 Ų | 99 | 93% | 0.928 | 82% | 0.817 | S | S | * | * | trans | -70.3 | 137.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 269 | G | 35.5 | Very low | 37 | Very low | 80 Ų | 80 | 99.9 Ų | 99.9 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | trans | -161.1 | 49.8 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 270 | G | 37.6 | Very low | 38.6 | Very low | 88 Ų | 88 | 104 Ų | 104 | 91% | 0.907 | 81% | 0.812 | S | S | * | * | trans | -77.9 | 131 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 271 | G | 36 | Very low | 40.4 | Very low | 79 Ų | 79 | 103.3 Ų | 103.3 | 81% | 0.814 | 81% | 0.81 | S | S | * | * | trans | 167.6 | 120.2 | 169.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 272 | G | 37.3 | Very low | 42.8 | Very low | 71 Ų | 71 | 95.4 Ų | 95.4 | 73% | 0.732 | 77% | 0.774 | S | S | * | * | trans | 95.8 | 24 | 154.2 | 0 | 0 | 0 | 0 | 0 | 118.7 | V274 | G272-V274 VanDerWaalsContact C-N 3.25Å; G272-V274 PolarHBondContact O-N 2.86Å | ||
| 273 | G | 34.3 | Very low | 45.6 | Very low | 81 Ų | 81 | 95.3 Ų | 95.3 | 84% | 0.835 | 75% | 0.754 | S | S | * | * | trans | -67.3 | 79.1 | 165.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | S275 | G273-S275 PolarHBondContact O-N 3.36Š| ||
| 274 | V | 46.3 | Very low | 48.5 | Very low | 139 Ų | 139 | 91.6 Ų | 91.6 | 84% | 0.842 | 71% | 0.714 | S | S | * | * | trans | -60.3 | 127.9 | 176.4 | 173.7 | 0 | 0 | 0 | 0 | 109.8 | G272 G276 | G272-V274 VanDerWaalsContact C-N 3.25Å; G272-V274 PolarHBondContact O-N 2.86Å; V274-G276 VanDerWaalsContact C-N 3.35Å; V274-G276 PolarHBondContact O-N 3.04Å | ||
| 275 | S | 45.5 | Very low | 51.4 | Low | 93 Ų | 93 | 93.1 Ų | 93.1 | 65% | 0.65 | 70% | 0.698 | S | S | * | * | trans | -68.9 | 77.9 | -167.6 | -44.7 | 0 | 0 | 0 | 0 | 113.9 | G273 G277 | G273-S275 PolarHBondContact O-N 3.36Å; S275-G277 PolarHBondContact O-N 3.24Å; S275-G277 VanDerWaalsContact O-N 3.16Å | ||
| 276 | G | 39.5 | Very low | 54.4 | Low | 76 Ų | 76 | 91.8 Ų | 91.8 | 78% | 0.784 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.9 | -8.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | V274 | V274-G276 VanDerWaalsContact C-N 3.35Å; V274-G276 PolarHBondContact O-N 3.04Å |
| 277 | G | 35.1 | Very low | 57.4 | Low | 73 Ų | 73 | 87.7 Ų | 87.7 | 75% | 0.753 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | -0.4 | -173.4 | 0 | 0 | 0 | 0 | 0 | 117.1 | S275 | S275-G277 PolarHBondContact O-N 3.24Å; S275-G277 VanDerWaalsContact O-N 3.16Å |
| 278 | Q | 37.7 | Very low | 60.3 | Low | 165 Ų | 165 | 83.9 Ų | 83.9 | 77% | 0.771 | 59% | 0.586 | S | S | * | * | trans | -117.2 | 24.3 | -174.4 | -74.6 | -170.7 | -18.1 | 0 | 0 | 114.9 | E280 | Q278-E280 VanDerWaalsContact C-N 3.32Š| ||
| 279 | M | 52.1 | Low | 63 | Low | 155 Ų | 155 | 85.8 Ų | 85.8 | 76% | 0.764 | 57% | 0.571 | S | S | * | * | S | Bend | trans | -81.5 | -8.5 | 176.3 | -150.3 | -174.7 | -172.5 | 0 | 0 | 114.1 | ||
| 280 | E | 61.3 | Low | 66 | Low | 152 Ų | 152 | 87.2 Ų | 87.2 | 71% | 0.71 | 55% | 0.552 | S | S | * | * | S | Bend | trans | -86.3 | -19.5 | -171.3 | -81.2 | -147.2 | 102.7 | 0 | 0 | 116 | Q278 W327 | Q278-E280 VanDerWaalsContact C-N 3.32Å; E280-W327 VanDerWaalsContact O-CE2 3.27Å; E280-W327 WeakPolarHBondContact O-CZ2 3.31Å; E280-W327 PolarHBondContact O-NE1 3.12Å |
| 281 | E | 74.9 | Confident | 68.8 | Low | 150 Ų | 150 | 83 Ų | 83 | 70% | 0.701 | 51% | 0.508 | S | S | * | . | trans | -119.1 | 88.8 | -178.2 | -171.6 | 153.1 | -140.8 | 0 | 0 | 112.8 | ||||
| 282 | V | 85.3 | Confident | 71.7 | Confident | 11 Ų | 11 | 81.1 Ų | 81.1 | 7% | 0.067 | 48% | 0.481 | C | S | . | . | trans | -83.4 | 116.2 | 175.5 | 177.7 | 0 | 0 | 0 | 0 | 109.6 | T284 V287 W327 W341 | V282-T284 VanDerWaalsContact C-N 3.34Å; V282-T284 PolarHBondContact O-N 2.69Å; V282-V287 HydrophobicContact CG1-CG2 3.4Å; V282-W327 HydrophobicContact CB-CD2 4.32Å; V282-W327 HydrophobicContact CB-CE3 3.93Å; V282-W327 HydrophobicContact CB-CH2 4Å; V282-W327 HydrophobicContact CB-CZ2 4.38Å; V282-W327 HydrophobicContact CB-CZ3 3.77Å; V282-W327 HydrophobicContact CG1-CZ3 4.47Å; V282-W327 HydrophobicContact CG2-CH2 3.91Å; V282-W327 HydrophobicContact CG2-CZ2 4.29Å; V282-W327 HydrophobicContact CG2-CZ3 4.16Å; V282-W341 HydrophobicContact CG1-CB 4.32Å | ||
| 283 | N | 92.3 | Very high | 74.6 | Confident | 79 Ų | 79 | 81.3 Ų | 81.3 | 42% | 0.422 | 47% | 0.468 | S | S | . | . | trans | -66.9 | 88 | 175.2 | -176.3 | -8.3 | 0 | 0 | 0 | 111.7 | K285 E286 V287 | N283-K285 PolarHBondContact O-N 3.12Å; N283-K285 VanDerWaalsContact O-N 3.1Å; N283-K285 PolarHBondContact OD1-N 2.92Å; N283-E286 HydrophobicContact CB-CB 3.98Å; N283-E286 PolarHBondContact ND2-OE2 3.28Å; N283-E286 WeakPolarHBondContact O-CB 3.36Å; N283-E286 PolarHBondContact O-N 2.91Å; N283-E286 PolarHBondContact OD1-N 3.4Å; N283-V287 WeakPolarHBondContact O-CG2 3.36Å; N283-V287 PolarHBondContact O-N 3.39Å | ||
| 284 | T | 94.6 | Very high | 77.5 | Confident | 4 Ų | 4 | 78.5 Ų | 78.5 | 3% | 0.025 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -49.9 | -35.3 | -177.7 | 52.7 | 0 | 0 | 0 | 0 | 115.2 | V282 A288 K325 W327 L330 F337 | V282-T284 VanDerWaalsContact C-N 3.34Å; V282-T284 PolarHBondContact O-N 2.69Å; T284-A288 WeakPolarHBondContact O-CB 3.2Å; T284-A288 PolarHBondContact O-N 2.81Å; T284-A288 VanDerWaalsContact O-N 3.12Å; T284-K325 WeakPolarHBondContact CB-O 3.34Å; T284-K325 WeakPolarHBondContact CG2-O 3.46Å; T284-K325 PolarHBondContact OG1-O 2.82Å; T284-K325 VanDerWaalsContact OG1-O 3.1Å; T284-W327 HydrophobicContact CG2-CB 4.02Å; T284-W327 HydrophobicContact CG2-CE3 3.88Å; T284-L330 HydrophobicContact CG2-CD1 3.67Å; T284-F337 HydrophobicContact CG2-CD1 4.08Å; T284-F337 HydrophobicContact CG2-CD2 4.14Å; T284-F337 HydrophobicContact CG2-CE1 4.22Å; T284-F337 HydrophobicContact CG2-CE2 4.26Å; T284-F337 HydrophobicContact CG2-CG 4.04Å; T284-F337 HydrophobicContact CG2-CZ 4.3Å; T284-F337 WeakPolarHBondContact O-CE1 3.48Å |
| 285 | K | 93.5 | Very high | 79.9 | Confident | 115 Ų | 115 | 72.2 Ų | 72.2 | 50% | 0.5 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -68.8 | -48.7 | 177.9 | -71.1 | 178.5 | 178.1 | 174.6 | 0 | 110.4 | N283 A288 Q289 P324 | N283-K285 PolarHBondContact O-N 3.12Å; N283-K285 VanDerWaalsContact O-N 3.1Å; N283-K285 PolarHBondContact OD1-N 2.92Å; K285-A288 PolarHBondContact O-N 3.28Å; K285-Q289 WeakPolarHBondContact O-CG 3.02Å; K285-Q289 PolarHBondContact O-N 2.93Å; K285-P324 HydrophobicContact CB-CG 4.49Å; K285-P324 HydrophobicContact CG-CG 4.14Å |
| 286 | E | 94.9 | Very high | 82.3 | Confident | 59 Ų | 59 | 75.4 Ų | 75.4 | 28% | 0.276 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -64.2 | -44 | 178.2 | -176 | -176.6 | -177.3 | 0 | 0 | 112 | N283 A288 Q289 R290 | N283-E286 HydrophobicContact CB-CB 3.98Å; N283-E286 PolarHBondContact ND2-OE2 3.28Å; N283-E286 WeakPolarHBondContact O-CB 3.36Å; N283-E286 PolarHBondContact O-N 2.91Å; N283-E286 PolarHBondContact OD1-N 3.4Å; E286-A288 VanDerWaalsContact C-N 3.32Å; E286-A288 PolarHBondContact O-N 3.29Å; E286-Q289 PolarHBondContact O-N 2.91Å; E286-R290 HydrophobicContact CG-CG 4.26Å; E286-R290 WeakPolarHBondContact O-CB 3.15Å; E286-R290 WeakPolarHBondContact O-CG 3.4Å; E286-R290 PolarHBondContact O-N 3.09Å; E286-R290 IonicContact OE1-CZ 3.2Å; E286-R290 IonicContact OE1-NE 2.74Å; E286-R290 PolarHBondContact OE1-NE 3.43Å; E286-R290 IonicContact OE1-NH2 2.8Å; E286-R290 PolarHBondContact OE1-NH2 3.32Å |
| 287 | V | 96.3 | Very high | 85 | Confident | 0 Ų | 0 | 79.2 Ų | 79.2 | 0% | 0 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -59.8 | -43.4 | 176.3 | -179 | 0 | 0 | 0 | 0 | 111.2 | V282 N283 Q289 I291 F337 M340 W341 L344 | V282-V287 HydrophobicContact CG1-CG2 3.4Å; N283-V287 WeakPolarHBondContact O-CG2 3.36Å; N283-V287 PolarHBondContact O-N 3.39Å; V287-Q289 PolarHBondContact O-N 3.3Å; V287-I291 HydrophobicContact CG1-CG1 4.31Å; V287-I291 WeakPolarHBondContact O-CB 3.45Å; V287-I291 VanDerWaalsContact O-CG1 3.25Å; V287-I291 WeakPolarHBondContact O-CG1 3.36Å; V287-I291 PolarHBondContact O-N 2.92Å; V287-F337 HydrophobicContact CB-CD1 4.25Å; V287-F337 HydrophobicContact CG1-CD1 4.2Å; V287-M340 HydrophobicContact CG1-CB 3.55Å; V287-M340 HydrophobicContact CG1-SD 4.3Å; V287-W341 HydrophobicContact CG2-CD2 4.38Å; V287-W341 HydrophobicContact CG2-CE3 3.47Å; V287-W341 VanDerWaalsContact CG2-CE3 3.47Å; V287-W341 HydrophobicContact CG2-CZ3 4.01Å; V287-L344 HydrophobicContact CG1-CD1 4.28Å |
| 288 | A | 96.9 | Very high | 87.8 | Confident | 1 Ų | 1 | 78.9 Ų | 78.9 | 1% | 0.008 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -62.5 | -40.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | T284 K285 E286 T292 L321 P324 | T284-A288 WeakPolarHBondContact O-CB 3.2Å; T284-A288 PolarHBondContact O-N 2.81Å; T284-A288 VanDerWaalsContact O-N 3.12Å; K285-A288 PolarHBondContact O-N 3.28Å; E286-A288 VanDerWaalsContact C-N 3.32Å; E286-A288 PolarHBondContact O-N 3.29Å; A288-T292 WeakPolarHBondContact O-CB 3.47Å; A288-T292 PolarHBondContact O-N 3.47Å; A288-T292 PolarHBondContact O-OG1 3.2Å; A288-L321 HydrophobicContact CB-CD2 4.01Å; A288-P324 HydrophobicContact CB-CB 3.95Å; A288-P324 HydrophobicContact CB-CG 3.89Å |
| 289 | Q | 96.9 | Very high | 90.5 | Very high | 130 Ų | 130 | 75.9 Ų | 75.9 | 61% | 0.607 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -66 | -52 | 175.5 | -72.8 | 173.2 | -11.8 | 0 | 0 | 111.7 | K285 E286 V287 I291 T292 T293 | K285-Q289 WeakPolarHBondContact O-CG 3.02Å; K285-Q289 PolarHBondContact O-N 2.93Å; E286-Q289 PolarHBondContact O-N 2.91Å; V287-Q289 PolarHBondContact O-N 3.3Å; Q289-I291 PolarHBondContact O-N 2.7Å; Q289-T292 WeakPolarHBondContact O-CB 3.4Å; Q289-T292 PolarHBondContact O-N 3.4Å; Q289-T293 PolarHBondContact O-N 3.31Å; Q289-T293 PolarHBondContact O-OG1 2.98Å |
| 290 | R | 96.9 | Very high | 92.5 | Very high | 110 Ų | 110 | 69.4 Ų | 69.4 | 42% | 0.415 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -55.8 | -48.2 | 177.7 | -72 | -178 | -178.8 | -143.9 | 3.5 | 111.4 | E286 T292 T293 E294 L344 | E286-R290 HydrophobicContact CG-CG 4.26Å; E286-R290 WeakPolarHBondContact O-CB 3.15Å; E286-R290 WeakPolarHBondContact O-CG 3.4Å; E286-R290 PolarHBondContact O-N 3.09Å; E286-R290 IonicContact OE1-CZ 3.2Å; E286-R290 IonicContact OE1-NE 2.74Å; E286-R290 PolarHBondContact OE1-NE 3.43Å; E286-R290 IonicContact OE1-NH2 2.8Å; E286-R290 PolarHBondContact OE1-NH2 3.32Å; R290-T292 VanDerWaalsContact C-N 3.34Å; R290-T292 PolarHBondContact O-N 3.27Å; R290-T293 PolarHBondContact O-N 3.16Å; R290-E294 WeakPolarHBondContact O-CB 3.05Å; R290-E294 PolarHBondContact O-N 3.28Å; R290-L344 HydrophobicContact CB-CD1 3.56Å; R290-L344 HydrophobicContact CB-CD2 4.2Å |
| 291 | I | 97.5 | Very high | 94.1 | Very high | 0 Ų | 0 | 65.9 Ų | 65.9 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -57.6 | -45.4 | 173.4 | -70.8 | -65.7 | 0 | 0 | 0 | 111.5 | V287 Q289 T293 E294 L295 F305 L321 M340 W343 L344 | V287-I291 HydrophobicContact CG1-CG1 4.31Å; V287-I291 WeakPolarHBondContact O-CB 3.45Å; V287-I291 VanDerWaalsContact O-CG1 3.25Å; V287-I291 WeakPolarHBondContact O-CG1 3.36Å; V287-I291 PolarHBondContact O-N 2.92Å; Q289-I291 PolarHBondContact O-N 2.7Å; I291-T293 VanDerWaalsContact C-N 3.34Å; I291-T293 PolarHBondContact O-N 2.91Å; I291-E294 PolarHBondContact O-N 2.87Å; I291-L295 HydrophobicContact CG2-CD1 3.69Å; I291-L295 HydrophobicContact CG2-CG 4.08Å; I291-L295 WeakPolarHBondContact O-CB 3.47Å; I291-L295 VanDerWaalsContact O-CG 3.22Å; I291-L295 WeakPolarHBondContact O-CG 3.42Å; I291-L295 PolarHBondContact O-N 3.02Å; I291-F305 HydrophobicContact CD1-CE1 4.04Å; I291-F305 HydrophobicContact CD1-CE2 4.39Å; I291-F305 HydrophobicContact CD1-CZ 3.62Å; I291-F305 HydrophobicContact CG2-CD1 4.29Å; I291-F305 HydrophobicContact CG2-CE1 3.84Å; I291-F305 HydrophobicContact CG2-CZ 4.44Å; I291-L321 HydrophobicContact CB-CD2 4.01Å; I291-L321 HydrophobicContact CG2-CD1 4.02Å; I291-L321 HydrophobicContact CG2-CD2 3.72Å; I291-M340 HydrophobicContact CD1-CB 3.97Å; I291-M340 HydrophobicContact CD1-CG 4.34Å; I291-M340 HydrophobicContact CG1-CB 3.83Å; I291-M340 HydrophobicContact CG1-CG 4.08Å; I291-M340 HydrophobicContact CG1-SD 4.18Å; I291-W343 HydrophobicContact CD1-CE3 3.65Å; I291-W343 HydrophobicContact CD1-CZ3 3.89Å; I291-L344 HydrophobicContact CD1-CD1 4.01Å; I291-L344 HydrophobicContact CD1-CD2 3.88Å; I291-L344 HydrophobicContact CD1-CG 3.67Å; I291-L344 HydrophobicContact CG1-CD1 4.04Å; I291-L344 HydrophobicContact CG1-CG 4.26Å |
| 292 | T | 97.1 | Very high | 95 | Very high | 39 Ų | 39 | 61.7 Ų | 61.7 | 24% | 0.239 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62 | -41.7 | -179.2 | -60.9 | 0 | 0 | 0 | 0 | 112 | A288 Q289 R290 K296 | A288-T292 WeakPolarHBondContact O-CB 3.47Å; A288-T292 PolarHBondContact O-N 3.47Å; A288-T292 PolarHBondContact O-OG1 3.2Å; Q289-T292 WeakPolarHBondContact O-CB 3.4Å; Q289-T292 PolarHBondContact O-N 3.4Å; R290-T292 VanDerWaalsContact C-N 3.34Å; R290-T292 PolarHBondContact O-N 3.27Å; T292-K296 WeakPolarHBondContact O-CG 3.34Å; T292-K296 PolarHBondContact O-N 3.34Å |
| 293 | T | 97.2 | Very high | 95.4 | Very high | 76 Ų | 76 | 62.7 Ų | 62.7 | 47% | 0.466 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -66 | -45 | 175.4 | -60.9 | 0 | 0 | 0 | 0 | 111.5 | Q289 R290 I291 K296 R297 | Q289-T293 PolarHBondContact O-N 3.31Å; Q289-T293 PolarHBondContact O-OG1 2.98Å; R290-T293 PolarHBondContact O-N 3.16Å; I291-T293 VanDerWaalsContact C-N 3.34Å; I291-T293 PolarHBondContact O-N 2.91Å; T293-K296 WeakPolarHBondContact O-CB 3.45Å; T293-K296 PolarHBondContact O-N 3.12Å; T293-R297 WeakPolarHBondContact O-CB 3.41Å; T293-R297 PolarHBondContact O-N 3.31Å |
| 294 | E | 96.1 | Very high | 95.4 | Very high | 21 Ų | 21 | 61.5 Ų | 61.5 | 10% | 0.098 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -69.6 | -38.1 | -175.4 | -148.4 | 66 | 179.8 | 0 | 0 | 112.7 | R290 I291 K296 R297 Y298 W343 L344 R351 | R290-E294 WeakPolarHBondContact O-CB 3.05Å; R290-E294 PolarHBondContact O-N 3.28Å; I291-E294 PolarHBondContact O-N 2.87Å; E294-K296 VanDerWaalsContact C-N 3.31Å; E294-K296 PolarHBondContact O-N 2.92Å; E294-R297 PolarHBondContact O-N 2.93Å; E294-R297 IonicContact OE1-NH1 3.39Å; E294-R297 PolarHBondContact OE1-NH1 2.98Å; E294-R297 IonicContact OE2-CZ 3.62Å; E294-R297 IonicContact OE2-NE 3.99Å; E294-R297 IonicContact OE2-NH1 2.81Å; E294-R297 PolarHBondContact OE2-NH1 2.82Å; E294-Y298 HydrophobicContact CG-CD2 4.08Å; E294-Y298 HydrophobicContact CG-CE2 3.72Å; E294-Y298 WeakPolarHBondContact O-CD2 3.3Å; E294-Y298 PolarHBondContact O-N 3.07Å; E294-Y298 WeakPolarHBondContact OE1-CE2 3.45Å; E294-Y298 PolarHBondContact OE1-OH 2.83Å; E294-W343 HydrophobicContact CB-CH2 4.5Å; E294-W343 HydrophobicContact CB-CZ3 4.22Å; E294-W343 HydrophobicContact CG-CH2 4.18Å; E294-W343 HydrophobicContact CG-CZ3 4.12Å; E294-L344 HydrophobicContact CB-CD2 4.24Å; E294-L344 HydrophobicContact CG-CD2 4.37Å; E294-R351 VanDerWaalsContact CG-NH1 3.3Å; E294-R351 IonicContact OE1-CZ 3.82Å; E294-R351 IonicContact OE1-NH1 2.7Å; E294-R351 PolarHBondContact OE1-NH1 3.32Å; E294-R351 IonicContact OE1-NH2 3.61Å |
| 295 | L | 96 | Very high | 95.5 | Very high | 8 Ų | 8 | 61.3 Ų | 61.3 | 4% | 0.042 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63.8 | -36.6 | 172.6 | -67.1 | 178.7 | 0 | 0 | 0 | 112 | I291 S299 I300 Q302 F305 L317 L321 | I291-L295 HydrophobicContact CG2-CD1 3.69Å; I291-L295 HydrophobicContact CG2-CG 4.08Å; I291-L295 WeakPolarHBondContact O-CB 3.47Å; I291-L295 VanDerWaalsContact O-CG 3.22Å; I291-L295 WeakPolarHBondContact O-CG 3.42Å; I291-L295 PolarHBondContact O-N 3.02Å; L295-S299 CarbonylContact O-C 3.58Å; L295-S299 PolarHBondContact O-N 3.27Å; L295-I300 HydrophobicContact CD2-CB 3.68Å; L295-I300 HydrophobicContact CD2-CD1 4.13Å; L295-I300 HydrophobicContact CD2-CG2 3.61Å; L295-I300 PolarHBondContact O-N 2.68Å; L295-Q302 HydrophobicContact CD1-CG 4.3Å; L295-F305 HydrophobicContact CD1-CB 4.2Å; L295-F305 HydrophobicContact CD1-CD1 3.99Å; L295-F305 HydrophobicContact CD1-CG 4.21Å; L295-F305 HydrophobicContact CD2-CB 3.54Å; L295-F305 HydrophobicContact CD2-CD1 4.23Å; L295-F305 HydrophobicContact CD2-CD2 4.01Å; L295-F305 HydrophobicContact CD2-CG 3.66Å; L295-F305 HydrophobicContact CG-CG 4.5Å; L295-L317 HydrophobicContact CD1-CD2 4.44Å; L295-L321 HydrophobicContact CD1-CD1 4.41Å |
| 296 | K | 96.4 | Very high | 95.5 | Very high | 159 Ų | 159 | 55.9 Ų | 55.9 | 69% | 0.691 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -68.8 | -46.6 | 173.5 | -73.7 | 175.6 | 176.8 | -173.8 | 0 | 111.6 | T292 T293 E294 Y298 S299 | T292-K296 WeakPolarHBondContact O-CG 3.34Å; T292-K296 PolarHBondContact O-N 3.34Å; T293-K296 WeakPolarHBondContact O-CB 3.45Å; T293-K296 PolarHBondContact O-N 3.12Å; E294-K296 VanDerWaalsContact C-N 3.31Å; E294-K296 PolarHBondContact O-N 2.92Å; K296-Y298 PolarHBondContact O-N 2.97Å; K296-S299 PolarHBondContact O-N 3.43Å |
| 297 | R | 95.9 | Very high | 95.4 | Very high | 157 Ų | 157 | 56.2 Ų | 56.2 | 59% | 0.592 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -53.7 | -47.9 | -177.4 | 176.5 | 179.7 | -75.4 | 163.9 | -12.3 | 112.5 | T293 E294 | T293-R297 WeakPolarHBondContact O-CB 3.41Å; T293-R297 PolarHBondContact O-N 3.31Å; E294-R297 PolarHBondContact O-N 2.93Å; E294-R297 IonicContact OE1-NH1 3.39Å; E294-R297 PolarHBondContact OE1-NH1 2.98Å; E294-R297 IonicContact OE2-CZ 3.62Å; E294-R297 IonicContact OE2-NE 3.99Å; E294-R297 IonicContact OE2-NH1 2.81Å; E294-R297 PolarHBondContact OE2-NH1 2.82Å |
| 298 | Y | 94.4 | Very high | 95.1 | Very high | 65 Ų | 65 | 59.1 Ų | 59.1 | 26% | 0.255 | 29% | 0.291 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.9 | 13.7 | 178.9 | -53.9 | -67.6 | 0 | 0 | 0 | 113.6 | E294 K296 I300 E348 R351 M352 | E294-Y298 HydrophobicContact CG-CD2 4.08Å; E294-Y298 HydrophobicContact CG-CE2 3.72Å; E294-Y298 WeakPolarHBondContact O-CD2 3.3Å; E294-Y298 PolarHBondContact O-N 3.07Å; E294-Y298 WeakPolarHBondContact OE1-CE2 3.45Å; E294-Y298 PolarHBondContact OE1-OH 2.83Å; K296-Y298 PolarHBondContact O-N 2.97Å; Y298-I300 HydrophobicContact CD2-CD1 4.1Å; Y298-I300 HydrophobicContact CG-CD1 4.37Å; Y298-I300 PolarHBondContact O-N 3.03Å; Y298-I300 VanDerWaalsContact O-N 3.12Å; Y298-E348 HydrophobicContact CE1-CG 4.42Å; Y298-E348 PolarHBondContact OH-OE2 2.92Å; Y298-R351 PolarHBondContact OH-NH2 3.19Å; Y298-M352 HydrophobicContact CG-CE 4.45Å |
| 299 | S | 94.8 | Very high | 94.9 | Very high | 103 Ų | 103 | 60.4 Ų | 60.4 | 72% | 0.72 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.4 | 33.4 | -177.2 | -60.6 | 0 | 0 | 0 | 0 | 114.6 | L295 K296 P301 | L295-S299 CarbonylContact O-C 3.58Å; L295-S299 PolarHBondContact O-N 3.27Å; K296-S299 PolarHBondContact O-N 3.43Å; S299-P301 VanDerWaalsContact O-CD 3.31Å; S299-P301 WeakPolarHBondContact O-CD 3.22Å |
| 300 | I | 93.9 | Very high | 94.7 | Very high | 18 Ų | 18 | 54.3 Ų | 54.3 | 9% | 0.092 | 27% | 0.27 | C | S | . | . | trans | -79.2 | 117.3 | -178.8 | -59.2 | 156.4 | 0 | 0 | 0 | 109.1 | L295 Y298 Q302 F305 W343 L355 | L295-I300 HydrophobicContact CD2-CB 3.68Å; L295-I300 HydrophobicContact CD2-CD1 4.13Å; L295-I300 HydrophobicContact CD2-CG2 3.61Å; L295-I300 PolarHBondContact O-N 2.68Å; Y298-I300 HydrophobicContact CD2-CD1 4.1Å; Y298-I300 HydrophobicContact CG-CD1 4.37Å; Y298-I300 PolarHBondContact O-N 3.03Å; Y298-I300 VanDerWaalsContact O-N 3.12Å; I300-Q302 PolarHBondContact O-N 2.92Å; I300-F305 HydrophobicContact CG2-CB 4.28Å; I300-W343 HydrophobicContact CD1-CH2 4.15Å; I300-W343 HydrophobicContact CD1-CZ2 4.23Å; I300-L355 HydrophobicContact CD1-CD1 3.63Å; I300-L355 HydrophobicContact CG1-CD1 3.93Å; I300-L355 HydrophobicContact CG2-CD1 4.1Å; I300-L355 HydrophobicContact CG2-CD2 4.09Å | ||
| 301 | P | 94.6 | Very high | 94.4 | Very high | 79 Ų | 79 | 53.1 Ų | 53.1 | 51% | 0.513 | 28% | 0.278 | S | S | . | . | trans | -65 | 135.2 | 178.6 | -19.3 | 32.1 | 0 | 0 | 0 | 111.1 | S299 A303 I304 F305 | S299-P301 VanDerWaalsContact O-CD 3.31Å; S299-P301 WeakPolarHBondContact O-CD 3.22Å; P301-A303 PolarHBondContact O-N 3.41Å; P301-I304 HydrophobicContact CB-CG1 4.16Å; P301-I304 HydrophobicContact CG-CG1 4.16Å; P301-I304 PolarHBondContact O-N 2.8Å; P301-F305 PolarHBondContact O-N 3.42Å | ||
| 302 | Q | 93.8 | Very high | 94.2 | Very high | 61 Ų | 61 | 58.7 Ų | 58.7 | 29% | 0.285 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -50.1 | -35.3 | 178.1 | -75.9 | -172.1 | -6.9 | 0 | 0 | 112.9 | L295 I300 I304 A306 Q314 L317 S318 | L295-Q302 HydrophobicContact CD1-CG 4.3Å; I300-Q302 PolarHBondContact O-N 2.92Å; Q302-I304 VanDerWaalsContact C-N 3.35Å; Q302-I304 PolarHBondContact O-N 3.07Å; Q302-A306 WeakPolarHBondContact O-CB 3.42Å; Q302-A306 PolarHBondContact O-N 3.08Å; Q302-Q314 HydrophobicContact CB-CG 4.05Å; Q302-L317 HydrophobicContact CB-CD2 4.02Å; Q302-L317 HydrophobicContact CG-CD2 4.31Å; Q302-L317 WeakPolarHBondContact O-CD2 3.46Å; Q302-S318 PolarHBondContact OE1-OG 3.03Å |
| 303 | A | 93.6 | Very high | 94 | Very high | 33 Ų | 33 | 59.9 Ų | 59.9 | 27% | 0.273 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -61.4 | -40.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | P301 Q307 Q314 | P301-A303 PolarHBondContact O-N 3.41Å; A303-Q307 WeakPolarHBondContact O-CB 3.36Å; A303-Q307 WeakPolarHBondContact O-CG 3.47Å; A303-Q307 PolarHBondContact O-N 3.46Å; A303-Q307 VanDerWaalsContact O-N 3.17Å; A303-Q314 HydrophobicContact CB-CB 4.01Å; A303-Q314 HydrophobicContact CB-CG 4.06Å |
| 304 | I | 92.9 | Very high | 93.9 | Very high | 54 Ų | 54 | 60.1 Ų | 60.1 | 28% | 0.277 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -68.5 | -52.2 | 178.1 | -55.3 | -57 | 0 | 0 | 0 | 109.4 | P301 Q302 A306 Q307 R308 L355 | P301-I304 HydrophobicContact CB-CG1 4.16Å; P301-I304 HydrophobicContact CG-CG1 4.16Å; P301-I304 PolarHBondContact O-N 2.8Å; Q302-I304 VanDerWaalsContact C-N 3.35Å; Q302-I304 PolarHBondContact O-N 3.07Å; I304-A306 PolarHBondContact O-N 3.32Å; I304-Q307 PolarHBondContact O-N 3.28Å; I304-R308 HydrophobicContact CG2-CG 3.77Å; I304-R308 VanDerWaalsContact O-CB 3.28Å; I304-R308 WeakPolarHBondContact O-CB 3.42Å; I304-R308 WeakPolarHBondContact O-CG 3.35Å; I304-R308 PolarHBondContact O-N 2.87Å; I304-L355 HydrophobicContact CG2-CD2 4.15Å |
| 305 | F | 95.2 | Very high | 93.8 | Very high | 0 Ų | 0 | 60.6 Ų | 60.6 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -59.2 | -47.5 | -179.9 | -179.2 | -106.8 | 0 | 0 | 0 | 113 | I291 L295 I300 P301 Q307 R308 V309 L310 L317 M340 W343 L355 | I291-F305 HydrophobicContact CD1-CE1 4.04Å; I291-F305 HydrophobicContact CD1-CE2 4.39Å; I291-F305 HydrophobicContact CD1-CZ 3.62Å; I291-F305 HydrophobicContact CG2-CD1 4.29Å; I291-F305 HydrophobicContact CG2-CE1 3.84Å; I291-F305 HydrophobicContact CG2-CZ 4.44Å; L295-F305 HydrophobicContact CD1-CB 4.2Å; L295-F305 HydrophobicContact CD1-CD1 3.99Å; L295-F305 HydrophobicContact CD1-CG 4.21Å; L295-F305 HydrophobicContact CD2-CB 3.54Å; L295-F305 HydrophobicContact CD2-CD1 4.23Å; L295-F305 HydrophobicContact CD2-CD2 4.01Å; L295-F305 HydrophobicContact CD2-CG 3.66Å; L295-F305 HydrophobicContact CG-CG 4.5Å; I300-F305 HydrophobicContact CG2-CB 4.28Å; P301-F305 PolarHBondContact O-N 3.42Å; F305-Q307 VanDerWaalsContact C-N 3.26Å; F305-Q307 PolarHBondContact O-N 3Å; F305-R308 PolarHBondContact O-N 3.39Å; F305-V309 HydrophobicContact CD2-CB 3.87Å; F305-V309 HydrophobicContact CD2-CG1 4.46Å; F305-V309 HydrophobicContact CD2-CG2 3.59Å; F305-V309 HydrophobicContact CE2-CB 3.6Å; F305-V309 HydrophobicContact CE2-CG1 3.69Å; F305-V309 HydrophobicContact CE2-CG2 3.6Å; F305-V309 HydrophobicContact CZ-CB 4.17Å; F305-V309 HydrophobicContact CZ-CG1 4.04Å; F305-V309 PolarHBondContact O-N 3.34Å; F305-L310 HydrophobicContact CD1-CD1 4.22Å; F305-L310 HydrophobicContact CE1-CD1 3.75Å; F305-L310 HydrophobicContact CE1-CD2 4.46Å; F305-L310 HydrophobicContact CE1-CG 4.08Å; F305-L310 HydrophobicContact CZ-CD1 4.48Å; F305-L310 HydrophobicContact CZ-CD2 4.41Å; F305-L310 HydrophobicContact CZ-CG 4.39Å; F305-L317 HydrophobicContact CD1-CD1 4.26Å; F305-L317 HydrophobicContact CD1-CD2 3.73Å; F305-L317 HydrophobicContact CE1-CD1 4.32Å; F305-M340 HydrophobicContact CE1-CG 4.21Å; F305-M340 HydrophobicContact CZ-CG 4.32Å; F305-W343 HydrophobicContact CD2-CD2 4.33Å; F305-W343 HydrophobicContact CD2-CZ2 4.35Å; F305-W343 HydrophobicContact CE2-CB 4.45Å; F305-W343 AromaticContact CE2-CD2 3.48Å; F305-W343 HydrophobicContact CE2-CD2 3.48Å; F305-W343 VanDerWaalsContact CE2-CD2 3.48Å; F305-W343 AromaticContact CE2-CE2 3.82Å; F305-W343 AromaticContact CE2-CE3 3.64Å; F305-W343 HydrophobicContact CE2-CE3 3.64Å; F305-W343 AromaticContact CE2-CG 3.86Å; F305-W343 HydrophobicContact CE2-CG 3.86Å; F305-W343 HydrophobicContact CE2-CH2 4.39Å; F305-W343 HydrophobicContact CE2-CZ2 4.27Å; F305-W343 HydrophobicContact CE2-CZ3 4.1Å; F305-W343 HydrophobicContact CZ-CD2 4.26Å; F305-W343 HydrophobicContact CZ-CE3 4.09Å; F305-L355 HydrophobicContact CD2-CD2 4.4Å |
| 306 | A | 94.8 | Very high | 93.6 | Very high | 0 Ų | 0 | 63.1 Ų | 63.1 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -55.4 | -42.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q302 I304 L310 C311 R312 L317 | Q302-A306 WeakPolarHBondContact O-CB 3.42Å; Q302-A306 PolarHBondContact O-N 3.08Å; I304-A306 PolarHBondContact O-N 3.32Å; A306-L310 CarbonylContact O-C 3.45Å; A306-L310 WeakPolarHBondContact O-CB 3.3Å; A306-C311 PolarHBondContact O-N 2.93Å; A306-R312 CarbonylContact C-O 3.53Å; A306-R312 PolarHBondContact O-N 3.47Å; A306-L317 HydrophobicContact CB-CB 3.72Å; A306-L317 HydrophobicContact CB-CD2 3.75Å; A306-L317 HydrophobicContact CB-CG 4.36Å |
| 307 | Q | 91.9 | Very high | 93.6 | Very high | 67 Ų | 67 | 55.5 Ų | 55.5 | 31% | 0.313 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -77.6 | -37.9 | -176 | -78.2 | -178.4 | 39.3 | 0 | 0 | 113.9 | A303 I304 F305 | A303-Q307 WeakPolarHBondContact O-CB 3.36Å; A303-Q307 WeakPolarHBondContact O-CG 3.47Å; A303-Q307 PolarHBondContact O-N 3.46Å; A303-Q307 VanDerWaalsContact O-N 3.17Å; I304-Q307 PolarHBondContact O-N 3.28Å; F305-Q307 VanDerWaalsContact C-N 3.26Å; F305-Q307 PolarHBondContact O-N 3Å |
| 308 | R | 89.8 | Confident | 93.6 | Very high | 61 Ų | 61 | 48.6 Ų | 48.6 | 23% | 0.23 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -91.2 | -40.2 | -169.4 | -59.1 | -68.8 | 170.8 | 79.9 | -2.6 | 112.8 | I304 F305 L355 A358 | I304-R308 HydrophobicContact CG2-CG 3.77Å; I304-R308 VanDerWaalsContact O-CB 3.28Å; I304-R308 WeakPolarHBondContact O-CB 3.42Å; I304-R308 WeakPolarHBondContact O-CG 3.35Å; I304-R308 PolarHBondContact O-N 2.87Å; F305-R308 PolarHBondContact O-N 3.39Å; R308-L355 PolarHBondContact NH1-O 3.17Å; R308-A358 HydrophobicContact CB-CB 3.99Å; R308-A358 WeakPolarHBondContact CD-O 3.18Å; R308-A358 HydrophobicContact CG-CB 4.22Å; R308-A358 PolarHBondContact NE-O 3.14Å; R308-A358 VanDerWaalsContact NE-O 3.1Å |
| 309 | V | 92.7 | Very high | 93.5 | Very high | 27 Ų | 27 | 48.9 Ų | 48.9 | 16% | 0.164 | 28% | 0.28 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.5 | -34.6 | -175.5 | -176.8 | 0 | 0 | 0 | 0 | 111.9 | F305 W343 L355 | F305-V309 HydrophobicContact CD2-CB 3.87Å; F305-V309 HydrophobicContact CD2-CG1 4.46Å; F305-V309 HydrophobicContact CD2-CG2 3.59Å; F305-V309 HydrophobicContact CE2-CB 3.6Å; F305-V309 HydrophobicContact CE2-CG1 3.69Å; F305-V309 HydrophobicContact CE2-CG2 3.6Å; F305-V309 HydrophobicContact CZ-CB 4.17Å; F305-V309 HydrophobicContact CZ-CG1 4.04Å; F305-V309 PolarHBondContact O-N 3.34Å; V309-W343 HydrophobicContact CG1-CB 3.87Å; V309-W343 HydrophobicContact CG1-CG 3.97Å; V309-W343 HydrophobicContact CG2-CG 4.44Å; V309-L355 HydrophobicContact CG2-CD2 4.24Å |
| 310 | L | 92.5 | Very high | 93.5 | Very high | 2 Ų | 2 | 45.9 Ų | 45.9 | 1% | 0.01 | 26% | 0.255 | C | S | . | . | S | Bend | trans | -107.7 | -15.9 | -172.5 | -52 | 179.6 | 0 | 0 | 0 | 114.4 | F305 A306 R312 L317 T336 R339 M340 | F305-L310 HydrophobicContact CD1-CD1 4.22Å; F305-L310 HydrophobicContact CE1-CD1 3.75Å; F305-L310 HydrophobicContact CE1-CD2 4.46Å; F305-L310 HydrophobicContact CE1-CG 4.08Å; F305-L310 HydrophobicContact CZ-CD1 4.48Å; F305-L310 HydrophobicContact CZ-CD2 4.41Å; F305-L310 HydrophobicContact CZ-CG 4.39Å; A306-L310 CarbonylContact O-C 3.45Å; A306-L310 WeakPolarHBondContact O-CB 3.3Å; L310-R312 HydrophobicContact CB-CB 4.39Å; L310-R312 HydrophobicContact CB-CG 4.14Å; L310-L317 HydrophobicContact CD1-CD1 3.78Å; L310-T336 HydrophobicContact CB-CG2 4.49Å; L310-T336 HydrophobicContact CD1-CG2 4.19Å; L310-T336 HydrophobicContact CD2-CG2 4.44Å; L310-R339 HydrophobicContact CD2-CB 3.66Å; L310-M340 HydrophobicContact CD1-CE 3.6Å; L310-M340 HydrophobicContact CD1-CG 4.06Å; L310-M340 HydrophobicContact CD2-CG 3.86Å |
| 311 | C | 91.3 | Very high | 93.5 | Very high | 86 Ų | 86 | 45.8 Ų | 45.8 | 58% | 0.581 | 26% | 0.255 | S | S | * | . | trans | 52.1 | 51.1 | -169.9 | -58.8 | 0 | 0 | 0 | 0 | 112.2 | A306 | A306-C311 PolarHBondContact O-N 2.93Š| ||
| 312 | R | 93.1 | Very high | 93.4 | Very high | 117 Ų | 117 | 48.9 Ų | 48.9 | 44% | 0.442 | 26% | 0.256 | S | S | . | . | trans | -132.1 | 165.2 | -180 | -64.3 | -62.9 | 173.4 | -112.3 | 9 | 111.8 | A306 L310 T316 | A306-R312 CarbonylContact C-O 3.53Å; A306-R312 PolarHBondContact O-N 3.47Å; L310-R312 HydrophobicContact CB-CB 4.39Å; L310-R312 HydrophobicContact CB-CG 4.14Å; R312-T316 HydrophobicContact CB-CG2 4.36Å; R312-T316 HydrophobicContact CG-CG2 4.48Å | ||
| 313 | S | 93.9 | Very high | 93.3 | Very high | 64 Ų | 64 | 50.3 Ų | 50.3 | 45% | 0.448 | 27% | 0.266 | S | S | . | . | trans | -72.4 | 154.7 | 172 | 84.1 | 0 | 0 | 0 | 0 | 111.2 | G315 T316 L317 | S313-G315 VanDerWaalsContact C-N 3.3Å; S313-G315 PolarHBondContact O-N 3.28Å; S313-T316 WeakPolarHBondContact O-CB 3.36Å; S313-T316 PolarHBondContact O-N 3.02Å; S313-T316 PolarHBondContact OG-N 3.18Å; S313-T316 VanDerWaalsContact OG-N 3.11Å; S313-T316 PolarHBondContact OG-OG1 3.41Å; S313-L317 PolarHBondContact O-N 2.86Å | ||
| 314 | Q | 93.8 | Very high | 93.2 | Very high | 80 Ų | 80 | 50 Ų | 50 | 37% | 0.374 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -55.9 | -45.7 | 174.3 | -177.8 | -81.1 | -26.1 | 0 | 0 | 111.2 | Q302 A303 T316 L317 S318 | Q302-Q314 HydrophobicContact CB-CG 4.05Å; A303-Q314 HydrophobicContact CB-CB 4.01Å; A303-Q314 HydrophobicContact CB-CG 4.06Å; Q314-T316 VanDerWaalsContact C-N 3.31Å; Q314-T316 PolarHBondContact O-N 2.86Å; Q314-L317 PolarHBondContact O-N 3.1Å; Q314-S318 PolarHBondContact NE2-OG 3.49Å; Q314-S318 WeakPolarHBondContact O-CB 3.08Å; Q314-S318 PolarHBondContact O-N 2.76Å |
| 315 | G | 93.6 | Very high | 93.1 | Very high | 31 Ų | 31 | 51.3 Ų | 51.3 | 32% | 0.32 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.3 | -39.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | S313 S318 D319 | S313-G315 VanDerWaalsContact C-N 3.3Å; S313-G315 PolarHBondContact O-N 3.28Å; G315-S318 PolarHBondContact O-N 3.4Å; G315-D319 PolarHBondContact O-N 2.65Å |
| 316 | T | 93.3 | Very high | 92.9 | Very high | 61 Ų | 61 | 52.9 Ų | 52.9 | 37% | 0.374 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60.6 | -47 | 175 | -50.8 | 0 | 0 | 0 | 0 | 111.7 | R312 S313 Q314 L320 | R312-T316 HydrophobicContact CB-CG2 4.36Å; R312-T316 HydrophobicContact CG-CG2 4.48Å; S313-T316 WeakPolarHBondContact O-CB 3.36Å; S313-T316 PolarHBondContact O-N 3.02Å; S313-T316 PolarHBondContact OG-N 3.18Å; S313-T316 VanDerWaalsContact OG-N 3.11Å; S313-T316 PolarHBondContact OG-OG1 3.41Å; Q314-T316 VanDerWaalsContact C-N 3.31Å; Q314-T316 PolarHBondContact O-N 2.86Å; T316-L320 HydrophobicContact CG2-CD1 4.28Å; T316-L320 VanDerWaalsContact O-CG 3.29Å; T316-L320 WeakPolarHBondContact O-CG 3.19Å; T316-L320 PolarHBondContact O-N 3.01Å; T316-L320 VanDerWaalsContact O-N 3.15Å |
| 317 | L | 95.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -62.1 | -46.2 | 175 | 173.1 | 65.9 | 0 | 0 | 0 | 111 | L295 Q302 F305 A306 L310 S313 Q314 D319 L320 L321 M340 | L295-L317 HydrophobicContact CD1-CD2 4.44Å; Q302-L317 HydrophobicContact CB-CD2 4.02Å; Q302-L317 HydrophobicContact CG-CD2 4.31Å; Q302-L317 WeakPolarHBondContact O-CD2 3.46Å; F305-L317 HydrophobicContact CD1-CD1 4.26Å; F305-L317 HydrophobicContact CD1-CD2 3.73Å; F305-L317 HydrophobicContact CE1-CD1 4.32Å; A306-L317 HydrophobicContact CB-CB 3.72Å; A306-L317 HydrophobicContact CB-CD2 3.75Å; A306-L317 HydrophobicContact CB-CG 4.36Å; L310-L317 HydrophobicContact CD1-CD1 3.78Å; S313-L317 PolarHBondContact O-N 2.86Å; Q314-L317 PolarHBondContact O-N 3.1Å; L317-D319 VanDerWaalsContact C-N 3.29Å; L317-D319 PolarHBondContact O-N 2.9Å; L317-L320 WeakPolarHBondContact O-CB 3.17Å; L317-L320 PolarHBondContact O-N 3.49Å; L317-L320 VanDerWaalsContact O-N 3.08Å; L317-L321 HydrophobicContact CD1-CD1 3.75Å; L317-L321 HydrophobicContact CD1-CD2 4.06Å; L317-L321 HydrophobicContact CD1-CG 3.7Å; L317-L321 HydrophobicContact CD2-CD1 4.28Å; L317-L321 HydrophobicContact CG-CD1 3.8Å; L317-L321 HydrophobicContact CG-CG 4.1Å; L317-L321 WeakPolarHBondContact O-CG 3.1Å; L317-L321 PolarHBondContact O-N 3.18Å; L317-M340 HydrophobicContact CD1-CE 3.6Å |
| 318 | S | 96.1 | Very high | 92.6 | Very high | 11 Ų | 11 | 53.9 Ų | 53.9 | 8% | 0.077 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -59.3 | -39.4 | -176.8 | -140.3 | 0 | 0 | 0 | 0 | 111.9 | Q302 Q314 G315 R322 | Q302-S318 PolarHBondContact OE1-OG 3.03Å; Q314-S318 PolarHBondContact NE2-OG 3.49Å; Q314-S318 WeakPolarHBondContact O-CB 3.08Å; Q314-S318 PolarHBondContact O-N 2.76Å; G315-S318 PolarHBondContact O-N 3.4Å; S318-R322 WeakPolarHBondContact O-CB 3.28Å; S318-R322 WeakPolarHBondContact O-CG 3.11Å; S318-R322 VanDerWaalsContact O-CZ 3.29Å; S318-R322 PolarHBondContact O-N 2.72Å; S318-R322 VanDerWaalsContact O-N 3.12Å; S318-R322 PolarHBondContact O-NE 3.01Å; S318-R322 PolarHBondContact OG-NH1 3.35Å |
| 319 | D | 92.7 | Very high | 92.6 | Very high | 72 Ų | 72 | 56 Ų | 56 | 39% | 0.385 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -70.1 | -39 | 173.5 | -81.2 | -19.6 | 0 | 0 | 0 | 113 | G315 L317 L321 R322 N323 | G315-D319 PolarHBondContact O-N 2.65Å; L317-D319 VanDerWaalsContact C-N 3.29Å; L317-D319 PolarHBondContact O-N 2.9Å; D319-L321 VanDerWaalsContact C-N 3.35Å; D319-R322 IonicContact OD1-CZ 3.62Å; D319-R322 IonicContact OD1-NE 2.65Å; D319-R322 IonicContact OD1-NH2 3.12Å; D319-R322 PolarHBondContact OD1-NH2 3.4Å; D319-N323 PolarHBondContact O-N 3.12Å |
| 320 | L | 94.2 | Very high | 92.5 | Very high | 39 Ų | 39 | 55.4 Ų | 55.4 | 20% | 0.204 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -63.9 | -37.5 | 176.1 | -72.5 | 169.1 | 0 | 0 | 0 | 112.6 | T316 L317 P324 T336 F337 M340 | T316-L320 HydrophobicContact CG2-CD1 4.28Å; T316-L320 VanDerWaalsContact O-CG 3.29Å; T316-L320 WeakPolarHBondContact O-CG 3.19Å; T316-L320 PolarHBondContact O-N 3.01Å; T316-L320 VanDerWaalsContact O-N 3.15Å; L317-L320 WeakPolarHBondContact O-CB 3.17Å; L317-L320 PolarHBondContact O-N 3.49Å; L317-L320 VanDerWaalsContact O-N 3.08Å; L320-P324 WeakPolarHBondContact O-CA 3.38Å; L320-P324 WeakPolarHBondContact O-CB 3.5Å; L320-T336 HydrophobicContact CD1-CG2 3.83Å; L320-F337 HydrophobicContact CD2-CE2 3.93Å; L320-F337 HydrophobicContact CD2-CZ 4.28Å; L320-M340 HydrophobicContact CB-CE 4.36Å; L320-M340 HydrophobicContact CD1-CE 4.14Å |
| 321 | L | 94.7 | Very high | 92.3 | Very high | 17 Ų | 17 | 64.6 Ų | 64.6 | 9% | 0.089 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -77.9 | -35.1 | 179.6 | -63.1 | -179.3 | 0 | 0 | 0 | 112.8 | A288 I291 L295 L317 D319 M340 | A288-L321 HydrophobicContact CB-CD2 4.01Å; I291-L321 HydrophobicContact CB-CD2 4.01Å; I291-L321 HydrophobicContact CG2-CD1 4.02Å; I291-L321 HydrophobicContact CG2-CD2 3.72Å; L295-L321 HydrophobicContact CD1-CD1 4.41Å; L317-L321 HydrophobicContact CD1-CD1 3.75Å; L317-L321 HydrophobicContact CD1-CD2 4.06Å; L317-L321 HydrophobicContact CD1-CG 3.7Å; L317-L321 HydrophobicContact CD2-CD1 4.28Å; L317-L321 HydrophobicContact CG-CD1 3.8Å; L317-L321 HydrophobicContact CG-CG 4.1Å; L317-L321 WeakPolarHBondContact O-CG 3.1Å; L317-L321 PolarHBondContact O-N 3.18Å; D319-L321 VanDerWaalsContact C-N 3.35Å; L321-M340 HydrophobicContact CD2-CE 4.48Å; L321-M340 HydrophobicContact CD2-SD 4.31Å |
| 322 | R | 92.6 | Very high | 92.1 | Very high | 143 Ų | 143 | 65.8 Ų | 65.8 | 54% | 0.54 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -72.5 | -44 | 177.2 | -78.6 | -172.9 | -67.2 | -90.1 | -4.4 | 113.1 | S318 D319 P324 | S318-R322 WeakPolarHBondContact O-CB 3.28Å; S318-R322 WeakPolarHBondContact O-CG 3.11Å; S318-R322 VanDerWaalsContact O-CZ 3.29Å; S318-R322 PolarHBondContact O-N 2.72Å; S318-R322 VanDerWaalsContact O-N 3.12Å; S318-R322 PolarHBondContact O-NE 3.01Å; S318-R322 PolarHBondContact OG-NH1 3.35Å; D319-R322 IonicContact OD1-CZ 3.62Å; D319-R322 IonicContact OD1-NE 2.65Å; D319-R322 IonicContact OD1-NH2 3.12Å; D319-R322 PolarHBondContact OD1-NH2 3.4Å; R322-P324 VanDerWaalsContact C-CD 3.49Å |
| 323 | N | 90.1 | Very high | 92 | Very high | 92 Ų | 92 | 61.2 Ų | 61.2 | 49% | 0.492 | 33% | 0.332 | S | S | . | . | S | Bend | trans | -132.3 | 66.3 | -173.9 | -64.2 | -76.1 | 0 | 0 | 0 | 110.4 | D319 K325 L432 | D319-N323 PolarHBondContact O-N 3.12Å; N323-K325 PolarHBondContact O-N 2.91Å; N323-L432 WeakPolarHBondContact OD1-CD1 3.29Å |
| 324 | P | 91.7 | Very high | 92 | Very high | 25 Ų | 25 | 61.7 Ų | 61.7 | 16% | 0.162 | 32% | 0.324 | C | S | . | . | P | Polyproline II helix | trans | -62.1 | 119.6 | 177.5 | 25.6 | -33.9 | 0 | 0 | 0 | 110.2 | K285 A288 L320 R322 F337 | K285-P324 HydrophobicContact CB-CG 4.49Å; K285-P324 HydrophobicContact CG-CG 4.14Å; A288-P324 HydrophobicContact CB-CB 3.95Å; A288-P324 HydrophobicContact CB-CG 3.89Å; L320-P324 WeakPolarHBondContact O-CA 3.38Å; L320-P324 WeakPolarHBondContact O-CB 3.5Å; R322-P324 VanDerWaalsContact C-CD 3.49Å; P324-F337 HydrophobicContact CB-CE1 4.27Å; P324-F337 HydrophobicContact CB-CZ 3.98Å |
| 325 | K | 91.4 | Very high | 92 | Very high | 83 Ų | 83 | 61.4 Ų | 61.4 | 36% | 0.361 | 32% | 0.323 | S | S | . | . | P | Polyproline II helix | trans | -71 | 141.4 | 172.6 | -74.1 | -176.1 | 67.1 | -161.5 | 0 | 110.3 | T284 N323 K329 L330 | T284-K325 WeakPolarHBondContact CB-O 3.34Å; T284-K325 WeakPolarHBondContact CG2-O 3.46Å; T284-K325 PolarHBondContact OG1-O 2.82Å; T284-K325 VanDerWaalsContact OG1-O 3.1Å; N323-K325 PolarHBondContact O-N 2.91Å; K325-K329 PolarHBondContact NZ-O 3.05Å; K325-L330 HydrophobicContact CB-CD2 3.8Å; K325-L330 HydrophobicContact CB-CG 4.47Å; K325-L330 HydrophobicContact CD-CD2 4.39Å |
| 326 | P | 91.1 | Very high | 92.1 | Very high | 33 Ų | 33 | 60.6 Ų | 60.6 | 21% | 0.214 | 31% | 0.312 | C | S | . | . | P | Polyproline II helix | trans | -59.3 | 145.8 | 177.2 | 25.8 | -34.8 | 0 | 0 | 0 | 112 | S328 K329 L330 W435 | P326-S328 PolarHBondContact O-N 3.48Å; P326-K329 HydrophobicContact CG-CB 4.22Å; P326-K329 HydrophobicContact CG-CG 3.94Å; P326-K329 PolarHBondContact O-N 3.49Å; P326-L330 PolarHBondContact O-N 2.75Å; P326-W435 HydrophobicContact CG-CB 4.14Å; P326-W435 HydrophobicContact CG-CD2 3.97Å; P326-W435 HydrophobicContact CG-CE3 3.93Å; P326-W435 HydrophobicContact CG-CG 4.1Å |
| 327 | W | 91.6 | Very high | 92.2 | Very high | 15 Ų | 15 | 57.7 Ų | 57.7 | 6% | 0.057 | 29% | 0.294 | C | S | . | . | G | 310 helix | trans | -54.3 | -47.9 | -169.6 | 180 | -112.6 | 0 | 0 | 0 | 113.6 | E280 V282 T284 K329 L330 R334 F337 R338 | E280-W327 VanDerWaalsContact O-CE2 3.27Å; E280-W327 WeakPolarHBondContact O-CZ2 3.31Å; E280-W327 PolarHBondContact O-NE1 3.12Å; V282-W327 HydrophobicContact CB-CD2 4.32Å; V282-W327 HydrophobicContact CB-CE3 3.93Å; V282-W327 HydrophobicContact CB-CH2 4Å; V282-W327 HydrophobicContact CB-CZ2 4.38Å; V282-W327 HydrophobicContact CB-CZ3 3.77Å; V282-W327 HydrophobicContact CG1-CZ3 4.47Å; V282-W327 HydrophobicContact CG2-CH2 3.91Å; V282-W327 HydrophobicContact CG2-CZ2 4.29Å; V282-W327 HydrophobicContact CG2-CZ3 4.16Å; T284-W327 HydrophobicContact CG2-CB 4.02Å; T284-W327 HydrophobicContact CG2-CE3 3.88Å; W327-K329 PolarHBondContact O-N 3.32Å; W327-K329 VanDerWaalsContact O-N 3.08Å; W327-L330 HydrophobicContact CE3-CD1 3.99Å; W327-L330 WeakPolarHBondContact O-CB 3.34Å; W327-L330 PolarHBondContact O-N 2.81Å; W327-R334 HydrophobicContact CD2-CG 4.25Å; W327-R334 HydrophobicContact CE3-CB 4.36Å; W327-R334 HydrophobicContact CE3-CG 4.01Å; W327-R334 HydrophobicContact CH2-CB 3.63Å; W327-R334 HydrophobicContact CH2-CG 3.94Å; W327-R334 HydrophobicContact CZ2-CB 4.24Å; W327-R334 HydrophobicContact CZ2-CG 4.15Å; W327-R334 HydrophobicContact CZ3-CB 3.69Å; W327-R334 HydrophobicContact CZ3-CG 3.85Å; W327-R334 PolarHBondContact O-NE 3.47Å; W327-F337 HydrophobicContact CZ3-CB 4.11Å; W327-R338 HydrophobicContact CH2-CG 3.88Å |
| 328 | S | 89.8 | Confident | 92.1 | Very high | 73 Ų | 73 | 62.1 Ų | 62.1 | 51% | 0.51 | 31% | 0.311 | S | S | . | . | G | 310 helix | trans | -55.6 | -30.9 | 179.6 | -37.3 | 0 | 0 | 0 | 0 | 112.6 | P326 R334 | P326-S328 PolarHBondContact O-N 3.48Å; S328-R334 PolarHBondContact O-NH2 2.9Å |
| 329 | K | 88.6 | Confident | 92 | Very high | 105 Ų | 105 | 66.3 Ų | 66.3 | 46% | 0.457 | 33% | 0.325 | S | S | . | . | G | 310 helix | trans | -97.9 | 7.4 | -176.5 | -47.8 | -77.3 | -171.9 | 173.3 | 0 | 112.6 | K325 P326 W327 W435 | K325-K329 PolarHBondContact NZ-O 3.05Å; P326-K329 HydrophobicContact CG-CB 4.22Å; P326-K329 HydrophobicContact CG-CG 3.94Å; P326-K329 PolarHBondContact O-N 3.49Å; W327-K329 PolarHBondContact O-N 3.32Å; W327-K329 VanDerWaalsContact O-N 3.08Å; K329-W435 HydrophobicContact CB-CE3 4.35Å; K329-W435 HydrophobicContact CB-CH2 3.81Å; K329-W435 HydrophobicContact CB-CZ2 4.46Å; K329-W435 HydrophobicContact CB-CZ3 3.78Å; K329-W435 HydrophobicContact CD-CE3 4.31Å; K329-W435 HydrophobicContact CD-CH2 4.09Å; K329-W435 HydrophobicContact CD-CZ3 3.48Å; K329-W435 VanDerWaalsContact CD-CZ3 3.48Å; K329-W435 HydrophobicContact CG-CE3 3.81Å; K329-W435 HydrophobicContact CG-CH2 3.9Å; K329-W435 HydrophobicContact CG-CZ3 3.33Å |
| 330 | L | 90.2 | Very high | 92.2 | Very high | 14 Ų | 14 | 62.9 Ų | 62.9 | 7% | 0.073 | 31% | 0.306 | C | S | . | . | trans | -89.1 | 133.3 | 167.4 | -65.8 | 178.4 | 0 | 0 | 0 | 110.7 | T284 K325 P326 W327 R334 F337 | T284-L330 HydrophobicContact CG2-CD1 3.67Å; K325-L330 HydrophobicContact CB-CD2 3.8Å; K325-L330 HydrophobicContact CB-CG 4.47Å; K325-L330 HydrophobicContact CD-CD2 4.39Å; P326-L330 PolarHBondContact O-N 2.75Å; W327-L330 HydrophobicContact CE3-CD1 3.99Å; W327-L330 WeakPolarHBondContact O-CB 3.34Å; W327-L330 PolarHBondContact O-N 2.81Å; L330-R334 HydrophobicContact CB-CG 3.55Å; L330-R334 HydrophobicContact CD1-CG 4.33Å; L330-R334 PolarHBondContact O-NE 3.44Å; L330-F337 HydrophobicContact CD1-CD2 3.51Å; L330-F337 HydrophobicContact CD1-CE2 3.79Å; L330-F337 HydrophobicContact CD1-CG 4.41Å; L330-F337 HydrophobicContact CD2-CE2 4.45Å | ||
| 331 | K | 88.4 | Confident | 92.2 | Very high | 196 Ų | 196 | 64.6 Ų | 64.6 | 85% | 0.852 | 31% | 0.31 | S | S | * | . | S | Bend | trans | -96.2 | -110.8 | 166.8 | -166.5 | 171.6 | -178 | 173.3 | 0 | 109 | G333 R334 | K331-G333 PolarHBondContact O-N 2.97Å; K331-R334 PolarHBondContact O-N 3.32Å |
| 332 | S | 88.2 | Confident | 92.2 | Very high | 110 Ų | 110 | 70.2 Ų | 70.2 | 77% | 0.769 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.1 | -17.2 | 175.8 | 52.7 | 0 | 0 | 0 | 0 | 115 | R334 | S332-R334 VanDerWaalsContact C-N 3.29Å; S332-R334 PolarHBondContact O-N 3.03Å |
| 333 | G | 91.1 | Very high | 92.3 | Very high | 21 Ų | 21 | 63.6 Ų | 63.6 | 22% | 0.216 | 31% | 0.309 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.4 | -21.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | K331 E335 T336 | K331-G333 PolarHBondContact O-N 2.97Å; G333-E335 VanDerWaalsContact C-N 3.27Å; G333-E335 PolarHBondContact O-N 2.86Å; G333-T336 WeakPolarHBondContact O-CB 3.39Å; G333-T336 PolarHBondContact O-N 2.86Å |
| 334 | R | 93.9 | Very high | 92.6 | Very high | 74 Ų | 74 | 60.4 Ų | 60.4 | 28% | 0.279 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -54.5 | -43.4 | -178.6 | -70.5 | -172.9 | -169.9 | -162.2 | 1.4 | 112.1 | W327 S328 L330 K331 S332 T336 F337 R338 | W327-R334 HydrophobicContact CD2-CG 4.25Å; W327-R334 HydrophobicContact CE3-CB 4.36Å; W327-R334 HydrophobicContact CE3-CG 4.01Å; W327-R334 HydrophobicContact CH2-CB 3.63Å; W327-R334 HydrophobicContact CH2-CG 3.94Å; W327-R334 HydrophobicContact CZ2-CB 4.24Å; W327-R334 HydrophobicContact CZ2-CG 4.15Å; W327-R334 HydrophobicContact CZ3-CB 3.69Å; W327-R334 HydrophobicContact CZ3-CG 3.85Å; W327-R334 PolarHBondContact O-NE 3.47Å; S328-R334 PolarHBondContact O-NH2 2.9Å; L330-R334 HydrophobicContact CB-CG 3.55Å; L330-R334 HydrophobicContact CD1-CG 4.33Å; L330-R334 PolarHBondContact O-NE 3.44Å; K331-R334 PolarHBondContact O-N 3.32Å; S332-R334 VanDerWaalsContact C-N 3.29Å; S332-R334 PolarHBondContact O-N 3.03Å; R334-T336 PolarHBondContact O-N 3.18Å; R334-F337 PolarHBondContact O-N 3.18Å; R334-F337 VanDerWaalsContact O-N 3.08Å; R334-R338 PolarHBondContact O-N 3.22Å |
| 335 | E | 93.4 | Very high | 92.7 | Very high | 75 Ų | 75 | 64.9 Ų | 64.9 | 35% | 0.35 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.5 | -32 | 179.9 | 177.2 | 55.8 | -165.7 | 0 | 0 | 113.5 | G333 R338 R339 | G333-E335 VanDerWaalsContact C-N 3.27Å; G333-E335 PolarHBondContact O-N 2.86Å; E335-R338 PolarHBondContact O-N 3.26Å; E335-R338 IonicContact OE2-NH1 2.75Å; E335-R339 WeakPolarHBondContact O-CG 3.34Å; E335-R339 PolarHBondContact O-N 3.28Å; E335-R339 VanDerWaalsContact O-N 3.12Å; E335-R339 IonicContact OE1-CZ 2.9Å; E335-R339 IonicContact OE1-NE 3.69Å; E335-R339 PolarHBondContact OE1-NE 3.38Å; E335-R339 IonicContact OE1-NH2 3.48Å; E335-R339 PolarHBondContact OE1-NH2 2.97Å |
| 336 | T | 94.7 | Very high | 92.7 | Very high | 13 Ų | 13 | 62.4 Ų | 62.4 | 8% | 0.08 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -70.2 | -36.5 | 177.6 | -53.1 | 0 | 0 | 0 | 0 | 110.9 | L310 L320 G333 R334 M340 | L310-T336 HydrophobicContact CB-CG2 4.49Å; L310-T336 HydrophobicContact CD1-CG2 4.19Å; L310-T336 HydrophobicContact CD2-CG2 4.44Å; L320-T336 HydrophobicContact CD1-CG2 3.83Å; G333-T336 WeakPolarHBondContact O-CB 3.39Å; G333-T336 PolarHBondContact O-N 2.86Å; R334-T336 PolarHBondContact O-N 3.18Å; T336-M340 HydrophobicContact CG2-CE 4.17Å; T336-M340 WeakPolarHBondContact O-CG 3.42Å; T336-M340 PolarHBondContact O-N 2.82Å |
| 337 | F | 95.7 | Very high | 92.9 | Very high | 0 Ų | 0 | 63.8 Ų | 63.8 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -72.8 | -35.1 | 172.3 | -79.3 | -83.2 | 0 | 0 | 0 | 112.8 | T284 V287 L320 P324 W327 L330 R334 R339 M340 W341 | T284-F337 HydrophobicContact CG2-CD1 4.08Å; T284-F337 HydrophobicContact CG2-CD2 4.14Å; T284-F337 HydrophobicContact CG2-CE1 4.22Å; T284-F337 HydrophobicContact CG2-CE2 4.26Å; T284-F337 HydrophobicContact CG2-CG 4.04Å; T284-F337 HydrophobicContact CG2-CZ 4.3Å; T284-F337 WeakPolarHBondContact O-CE1 3.48Å; V287-F337 HydrophobicContact CB-CD1 4.25Å; V287-F337 HydrophobicContact CG1-CD1 4.2Å; L320-F337 HydrophobicContact CD2-CE2 3.93Å; L320-F337 HydrophobicContact CD2-CZ 4.28Å; P324-F337 HydrophobicContact CB-CE1 4.27Å; P324-F337 HydrophobicContact CB-CZ 3.98Å; W327-F337 HydrophobicContact CZ3-CB 4.11Å; L330-F337 HydrophobicContact CD1-CD2 3.51Å; L330-F337 HydrophobicContact CD1-CE2 3.79Å; L330-F337 HydrophobicContact CD1-CG 4.41Å; L330-F337 HydrophobicContact CD2-CE2 4.45Å; R334-F337 PolarHBondContact O-N 3.18Å; R334-F337 VanDerWaalsContact O-N 3.08Å; F337-R339 VanDerWaalsContact C-N 3.3Å; F337-R339 PolarHBondContact O-N 3.35Å; F337-M340 HydrophobicContact CD1-SD 4.11Å; F337-M340 HydrophobicContact CE1-SD 4.32Å; F337-M340 WeakPolarHBondContact O-CB 3.39Å; F337-M340 PolarHBondContact O-N 3.11Å; F337-W341 WeakPolarHBondContact O-CB 3.25Å; F337-W341 PolarHBondContact O-N 3.39Å |
| 338 | R | 94.4 | Very high | 92.9 | Very high | 94 Ų | 94 | 67.9 Ų | 67.9 | 36% | 0.355 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -60.5 | -38.6 | 173.1 | -67.5 | -166.6 | -172.5 | 109.4 | -4.1 | 112.5 | W327 R334 E335 W341 K342 | W327-R338 HydrophobicContact CH2-CG 3.88Å; R334-R338 PolarHBondContact O-N 3.22Å; E335-R338 PolarHBondContact O-N 3.26Å; E335-R338 IonicContact OE2-NH1 2.75Å; R338-W341 PolarHBondContact O-N 2.76Å; R338-K342 WeakPolarHBondContact O-CB 3.44Å; R338-K342 PolarHBondContact O-N 3.22Å |
| 339 | R | 94.1 | Very high | 92.9 | Very high | 99 Ų | 99 | 71.4 Ų | 71.4 | 37% | 0.374 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -68.3 | -40.1 | 175.2 | -68.8 | 174.8 | -164 | -172.2 | -0.8 | 112.8 | L310 E335 F337 W343 | L310-R339 HydrophobicContact CD2-CB 3.66Å; E335-R339 WeakPolarHBondContact O-CG 3.34Å; E335-R339 PolarHBondContact O-N 3.28Å; E335-R339 VanDerWaalsContact O-N 3.12Å; E335-R339 IonicContact OE1-CZ 2.9Å; E335-R339 IonicContact OE1-NE 3.69Å; E335-R339 PolarHBondContact OE1-NE 3.38Å; E335-R339 IonicContact OE1-NH2 3.48Å; E335-R339 PolarHBondContact OE1-NH2 2.97Å; F337-R339 VanDerWaalsContact C-N 3.3Å; F337-R339 PolarHBondContact O-N 3.35Å; R339-W343 WeakPolarHBondContact O-CB 3.32Å; R339-W343 PolarHBondContact O-N 3.48Å |
| 340 | M | 96.1 | Very high | 93.1 | Very high | 0 Ų | 0 | 69.9 Ų | 69.9 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -59.4 | -49 | 171.4 | -70.4 | -179.4 | -163.5 | 0 | 0 | 111.3 | V287 I291 F305 L310 L317 L320 L321 T336 F337 W343 L344 | V287-M340 HydrophobicContact CG1-CB 3.55Å; V287-M340 HydrophobicContact CG1-SD 4.3Å; I291-M340 HydrophobicContact CD1-CB 3.97Å; I291-M340 HydrophobicContact CD1-CG 4.34Å; I291-M340 HydrophobicContact CG1-CB 3.83Å; I291-M340 HydrophobicContact CG1-CG 4.08Å; I291-M340 HydrophobicContact CG1-SD 4.18Å; F305-M340 HydrophobicContact CE1-CG 4.21Å; F305-M340 HydrophobicContact CZ-CG 4.32Å; L310-M340 HydrophobicContact CD1-CE 3.6Å; L310-M340 HydrophobicContact CD1-CG 4.06Å; L310-M340 HydrophobicContact CD2-CG 3.86Å; L317-M340 HydrophobicContact CD1-CE 3.6Å; L320-M340 HydrophobicContact CB-CE 4.36Å; L320-M340 HydrophobicContact CD1-CE 4.14Å; L321-M340 HydrophobicContact CD2-CE 4.48Å; L321-M340 HydrophobicContact CD2-SD 4.31Å; T336-M340 HydrophobicContact CG2-CE 4.17Å; T336-M340 WeakPolarHBondContact O-CG 3.42Å; T336-M340 PolarHBondContact O-N 2.82Å; F337-M340 HydrophobicContact CD1-SD 4.11Å; F337-M340 HydrophobicContact CE1-SD 4.32Å; F337-M340 WeakPolarHBondContact O-CB 3.39Å; F337-M340 PolarHBondContact O-N 3.11Å; M340-W343 PolarHBondContact O-N 3.29Å; M340-L344 WeakPolarHBondContact O-CG 3.48Å; M340-L344 PolarHBondContact O-N 3.05Å |
| 341 | W | 94.9 | Very high | 93.1 | Very high | 74 Ų | 74 | 70.4 Ų | 70.4 | 28% | 0.28 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -60.5 | -51.2 | 177.9 | -177.5 | -104.8 | 0 | 0 | 0 | 111.7 | V282 V287 F337 R338 W343 L344 Q345 | V282-W341 HydrophobicContact CG1-CB 4.32Å; V287-W341 HydrophobicContact CG2-CD2 4.38Å; V287-W341 HydrophobicContact CG2-CE3 3.47Å; V287-W341 VanDerWaalsContact CG2-CE3 3.47Å; V287-W341 HydrophobicContact CG2-CZ3 4.01Å; F337-W341 WeakPolarHBondContact O-CB 3.25Å; F337-W341 PolarHBondContact O-N 3.39Å; R338-W341 PolarHBondContact O-N 2.76Å; W341-W343 VanDerWaalsContact C-N 3.3Å; W341-W343 PolarHBondContact O-N 2.85Å; W341-L344 WeakPolarHBondContact O-CB 3.46Å; W341-L344 PolarHBondContact O-N 3.04Å; W341-Q345 WeakPolarHBondContact O-CG 3.37Å; W341-Q345 PolarHBondContact O-N 3.39Å; W341-Q345 VanDerWaalsContact O-N 3.08Å |
| 342 | K | 94.4 | Very high | 93.2 | Very high | 135 Ų | 135 | 64 Ų | 64 | 59% | 0.587 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -53.7 | -48.5 | 176.6 | -178.4 | 177.3 | 176.3 | 177.3 | 0 | 111.1 | R338 L344 Q345 E346 | R338-K342 WeakPolarHBondContact O-CB 3.44Å; R338-K342 PolarHBondContact O-N 3.22Å; K342-L344 VanDerWaalsContact C-N 3.31Å; K342-L344 PolarHBondContact O-N 3.32Å; K342-Q345 PolarHBondContact O-N 2.92Å; K342-E346 WeakPolarHBondContact O-CG 3.45Å; K342-E346 PolarHBondContact O-N 3.37Å; K342-E346 VanDerWaalsContact O-N 3.14Å |
| 343 | W | 95 | Very high | 93.2 | Very high | 4 Ų | 4 | 60.6 Ų | 60.6 | 2% | 0.015 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -62.7 | -34.5 | 178.1 | -178.6 | 83.3 | 0 | 0 | 0 | 112.8 | I291 E294 I300 F305 V309 R339 M340 W341 Q345 E346 R351 L355 | I291-W343 HydrophobicContact CD1-CE3 3.65Å; I291-W343 HydrophobicContact CD1-CZ3 3.89Å; E294-W343 HydrophobicContact CB-CH2 4.5Å; E294-W343 HydrophobicContact CB-CZ3 4.22Å; E294-W343 HydrophobicContact CG-CH2 4.18Å; E294-W343 HydrophobicContact CG-CZ3 4.12Å; I300-W343 HydrophobicContact CD1-CH2 4.15Å; I300-W343 HydrophobicContact CD1-CZ2 4.23Å; F305-W343 HydrophobicContact CD2-CD2 4.33Å; F305-W343 HydrophobicContact CD2-CZ2 4.35Å; F305-W343 HydrophobicContact CE2-CB 4.45Å; F305-W343 AromaticContact CE2-CD2 3.48Å; F305-W343 HydrophobicContact CE2-CD2 3.48Å; F305-W343 VanDerWaalsContact CE2-CD2 3.48Å; F305-W343 AromaticContact CE2-CE2 3.82Å; F305-W343 AromaticContact CE2-CE3 3.64Å; F305-W343 HydrophobicContact CE2-CE3 3.64Å; F305-W343 AromaticContact CE2-CG 3.86Å; F305-W343 HydrophobicContact CE2-CG 3.86Å; F305-W343 HydrophobicContact CE2-CH2 4.39Å; F305-W343 HydrophobicContact CE2-CZ2 4.27Å; F305-W343 HydrophobicContact CE2-CZ3 4.1Å; F305-W343 HydrophobicContact CZ-CD2 4.26Å; F305-W343 HydrophobicContact CZ-CE3 4.09Å; V309-W343 HydrophobicContact CG1-CB 3.87Å; V309-W343 HydrophobicContact CG1-CG 3.97Å; V309-W343 HydrophobicContact CG2-CG 4.44Å; R339-W343 WeakPolarHBondContact O-CB 3.32Å; R339-W343 PolarHBondContact O-N 3.48Å; M340-W343 PolarHBondContact O-N 3.29Å; W341-W343 VanDerWaalsContact C-N 3.3Å; W341-W343 PolarHBondContact O-N 2.85Å; W343-Q345 VanDerWaalsContact C-N 3.3Å; W343-Q345 PolarHBondContact O-N 3.31Å; W343-E346 PolarHBondContact O-N 3.21Å; W343-R351 HydrophobicContact CD2-CG 4.22Å; W343-R351 HydrophobicContact CG-CG 4.42Å; W343-R351 HydrophobicContact CZ2-CB 3.86Å; W343-R351 HydrophobicContact CZ2-CG 4.29Å; W343-R351 PolarHBondContact NE1-O 3.3Å; W343-R351 WeakPolarHBondContact O-CD 3.22Å; W343-R351 WeakPolarHBondContact O-CG 3.44Å; W343-L355 HydrophobicContact CZ2-CD1 4.34Å |
| 344 | L | 95 | Very high | 92.9 | Very high | 25 Ų | 25 | 61 Ų | 61 | 13% | 0.131 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -65.5 | -32.3 | 172.7 | -73.7 | 170.1 | 0 | 0 | 0 | 113 | V287 R290 I291 E294 M340 W341 K342 E346 | V287-L344 HydrophobicContact CG1-CD1 4.28Å; R290-L344 HydrophobicContact CB-CD1 3.56Å; R290-L344 HydrophobicContact CB-CD2 4.2Å; I291-L344 HydrophobicContact CD1-CD1 4.01Å; I291-L344 HydrophobicContact CD1-CD2 3.88Å; I291-L344 HydrophobicContact CD1-CG 3.67Å; I291-L344 HydrophobicContact CG1-CD1 4.04Å; I291-L344 HydrophobicContact CG1-CG 4.26Å; E294-L344 HydrophobicContact CB-CD2 4.24Å; E294-L344 HydrophobicContact CG-CD2 4.37Å; M340-L344 WeakPolarHBondContact O-CG 3.48Å; M340-L344 PolarHBondContact O-N 3.05Å; W341-L344 WeakPolarHBondContact O-CB 3.46Å; W341-L344 PolarHBondContact O-N 3.04Å; K342-L344 VanDerWaalsContact C-N 3.31Å; K342-L344 PolarHBondContact O-N 3.32Å; L344-E346 VanDerWaalsContact C-N 3.34Å |
| 345 | Q | 94 | Very high | 92.6 | Very high | 119 Ų | 119 | 58.1 Ų | 58.1 | 56% | 0.556 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -80.3 | -12.8 | 177.6 | -59 | -61.4 | 102.9 | 0 | 0 | 113.2 | W341 K342 W343 | W341-Q345 WeakPolarHBondContact O-CG 3.37Å; W341-Q345 PolarHBondContact O-N 3.39Å; W341-Q345 VanDerWaalsContact O-N 3.08Å; K342-Q345 PolarHBondContact O-N 2.92Å; W343-Q345 VanDerWaalsContact C-N 3.3Å; W343-Q345 PolarHBondContact O-N 3.31Å |
| 346 | E | 93.2 | Very high | 92 | Very high | 32 Ų | 32 | 62.1 Ų | 62.1 | 15% | 0.15 | 28% | 0.284 | C | S | . | . | S | Bend | trans | -72.4 | 141.9 | 178.1 | -74.3 | 177.2 | 161.7 | 0 | 0 | 111.1 | K342 W343 L344 Q350 R351 | K342-E346 WeakPolarHBondContact O-CG 3.45Å; K342-E346 PolarHBondContact O-N 3.37Å; K342-E346 VanDerWaalsContact O-N 3.14Å; W343-E346 PolarHBondContact O-N 3.21Å; L344-E346 VanDerWaalsContact C-N 3.34Å; E346-Q350 HydrophobicContact CB-CB 4.29Å; E346-Q350 HydrophobicContact CB-CG 4.1Å; E346-Q350 HydrophobicContact CG-CG 4.11Å; E346-Q350 PolarHBondContact OE1-NE2 2.84Å; E346-R351 HydrophobicContact CB-CG 3.69Å; E346-R351 WeakPolarHBondContact O-CD 3.35Å; E346-R351 VanDerWaalsContact O-CG 3.3Å; E346-R351 WeakPolarHBondContact O-CG 3.3Å; E346-R351 PolarHBondContact O-NE 2.86Å; E346-R351 VanDerWaalsContact O-NE 3.09Å |
| 347 | P | 93.4 | Very high | 90.3 | Very high | 61 Ų | 61 | 67.9 Ų | 67.9 | 40% | 0.396 | 31% | 0.313 | S | S | . | . | trans | -62.5 | 153 | 175.1 | 28 | -35 | 0 | 0 | 0 | 110.6 | F349 Q350 R351 | P347-F349 VanDerWaalsContact C-N 3.3Å; P347-F349 HydrophobicContact CB-CD1 3.89Å; P347-F349 HydrophobicContact CB-CE1 3.52Å; P347-F349 HydrophobicContact CB-CZ 4.19Å; P347-F349 HydrophobicContact CG-CD1 4.11Å; P347-F349 HydrophobicContact CG-CE1 3.46Å; P347-F349 VanDerWaalsContact CG-CE1 3.46Å; P347-F349 HydrophobicContact CG-CE2 4.33Å; P347-F349 HydrophobicContact CG-CZ 3.59Å; P347-F349 PolarHBondContact O-N 3.16Å; P347-F349 VanDerWaalsContact O-N 3.16Å; P347-Q350 HydrophobicContact CG-CB 3.94Å; P347-Q350 WeakPolarHBondContact O-CA 3.3Å; P347-Q350 WeakPolarHBondContact O-CB 3.37Å; P347-Q350 PolarHBondContact O-N 3.21Å; P347-R351 PolarHBondContact O-N 3.05Å | ||
| 348 | E | 91.9 | Very high | 88.3 | Confident | 102 Ų | 102 | 69.4 Ų | 69.4 | 48% | 0.477 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -54 | -41.8 | -170.1 | -170.5 | 173.2 | 131.6 | 0 | 0 | 114 | Y298 Q350 R351 M352 | Y298-E348 HydrophobicContact CE1-CG 4.42Å; Y298-E348 PolarHBondContact OH-OE2 2.92Å; E348-Q350 VanDerWaalsContact C-N 3.27Å; E348-Q350 PolarHBondContact O-N 3.1Å; E348-R351 PolarHBondContact O-N 3.1Å; E348-R351 IonicContact OE2-NH2 3.77Å; E348-M352 WeakPolarHBondContact O-CB 3.5Å; E348-M352 PolarHBondContact O-N 2.81Å |
| 349 | F | 91 | Very high | 86.3 | Confident | 147 Ų | 147 | 67.1 Ų | 67.1 | 65% | 0.645 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -61.2 | -35.1 | 177.8 | 70 | -95.1 | 0 | 0 | 0 | 112.7 | P347 S353 | P347-F349 VanDerWaalsContact C-N 3.3Å; P347-F349 HydrophobicContact CB-CD1 3.89Å; P347-F349 HydrophobicContact CB-CE1 3.52Å; P347-F349 HydrophobicContact CB-CZ 4.19Å; P347-F349 HydrophobicContact CG-CD1 4.11Å; P347-F349 HydrophobicContact CG-CE1 3.46Å; P347-F349 VanDerWaalsContact CG-CE1 3.46Å; P347-F349 HydrophobicContact CG-CE2 4.33Å; P347-F349 HydrophobicContact CG-CZ 3.59Å; P347-F349 PolarHBondContact O-N 3.16Å; P347-F349 VanDerWaalsContact O-N 3.16Å; F349-S353 WeakPolarHBondContact O-CB 3.36Å; F349-S353 PolarHBondContact O-N 3.08Å |
| 350 | Q | 91.4 | Very high | 84.1 | Confident | 73 Ų | 73 | 67.5 Ų | 67.5 | 34% | 0.341 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -76.8 | -40.9 | 177.3 | -179.6 | 171 | -21.4 | 0 | 0 | 111.4 | E346 P347 E348 M352 S353 A354 | E346-Q350 HydrophobicContact CB-CB 4.29Å; E346-Q350 HydrophobicContact CB-CG 4.1Å; E346-Q350 HydrophobicContact CG-CG 4.11Å; E346-Q350 PolarHBondContact OE1-NE2 2.84Å; P347-Q350 HydrophobicContact CG-CB 3.94Å; P347-Q350 WeakPolarHBondContact O-CA 3.3Å; P347-Q350 WeakPolarHBondContact O-CB 3.37Å; P347-Q350 PolarHBondContact O-N 3.21Å; E348-Q350 VanDerWaalsContact C-N 3.27Å; E348-Q350 PolarHBondContact O-N 3.1Å; Q350-M352 PolarHBondContact O-N 3.43Å; Q350-S353 WeakPolarHBondContact CA-OG 3.39Å; Q350-S353 PolarHBondContact O-N 3.26Å; Q350-S353 VanDerWaalsContact O-N 3.12Å; Q350-S353 PolarHBondContact O-OG 3.35Å; Q350-A354 PolarHBondContact O-N 2.8Å |
| 351 | R | 91.2 | Very high | 82 | Confident | 24 Ų | 24 | 76.1 Ų | 76.1 | 9% | 0.091 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -56.2 | -42.5 | 171.9 | -68.2 | -174.6 | -66.6 | 150.9 | 4.5 | 111.3 | E294 Y298 W343 E346 P347 E348 L355 | E294-R351 VanDerWaalsContact CG-NH1 3.3Å; E294-R351 IonicContact OE1-CZ 3.82Å; E294-R351 IonicContact OE1-NH1 2.7Å; E294-R351 PolarHBondContact OE1-NH1 3.32Å; E294-R351 IonicContact OE1-NH2 3.61Å; Y298-R351 PolarHBondContact OH-NH2 3.19Å; W343-R351 HydrophobicContact CD2-CG 4.22Å; W343-R351 HydrophobicContact CG-CG 4.42Å; W343-R351 HydrophobicContact CZ2-CB 3.86Å; W343-R351 HydrophobicContact CZ2-CG 4.29Å; W343-R351 PolarHBondContact NE1-O 3.3Å; W343-R351 WeakPolarHBondContact O-CD 3.22Å; W343-R351 WeakPolarHBondContact O-CG 3.44Å; E346-R351 HydrophobicContact CB-CG 3.69Å; E346-R351 WeakPolarHBondContact O-CD 3.35Å; E346-R351 VanDerWaalsContact O-CG 3.3Å; E346-R351 WeakPolarHBondContact O-CG 3.3Å; E346-R351 PolarHBondContact O-NE 2.86Å; E346-R351 VanDerWaalsContact O-NE 3.09Å; P347-R351 PolarHBondContact O-N 3.05Å; E348-R351 PolarHBondContact O-N 3.1Å; E348-R351 IonicContact OE2-NH2 3.77Å; R351-L355 WeakPolarHBondContact O-CG 3.46Å |
| 352 | M | 90.8 | Very high | 79.7 | Confident | 63 Ų | 63 | 77.5 Ų | 77.5 | 31% | 0.31 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -76.9 | -25.8 | 178 | -156.1 | 63 | 70.6 | 0 | 0 | 113.3 | Y298 E348 Q350 L355 R356 | Y298-M352 HydrophobicContact CG-CE 4.45Å; E348-M352 WeakPolarHBondContact O-CB 3.5Å; E348-M352 PolarHBondContact O-N 2.81Å; Q350-M352 PolarHBondContact O-N 3.43Å; M352-L355 HydrophobicContact SD-CD1 4.18Å; M352-R356 WeakPolarHBondContact O-CG 3.48Å; M352-R356 PolarHBondContact O-N 3.25Å; M352-R356 PolarHBondContact O-NE 3.15Å |
| 353 | S | 87.6 | Confident | 77.4 | Confident | 37 Ų | 37 | 78.3 Ų | 78.3 | 26% | 0.259 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -75.3 | -39 | 173.7 | 76.7 | 0 | 0 | 0 | 0 | 111.7 | F349 Q350 L355 R356 L357 | F349-S353 WeakPolarHBondContact O-CB 3.36Å; F349-S353 PolarHBondContact O-N 3.08Å; Q350-S353 WeakPolarHBondContact CA-OG 3.39Å; Q350-S353 PolarHBondContact O-N 3.26Å; Q350-S353 VanDerWaalsContact O-N 3.12Å; Q350-S353 PolarHBondContact O-OG 3.35Å; S353-L355 VanDerWaalsContact C-N 3.29Å; S353-L355 PolarHBondContact O-N 3.4Å; S353-R356 PolarHBondContact O-N 3.39Å; S353-R356 VanDerWaalsContact O-N 3.07Å; S353-L357 PolarHBondContact O-N 3.08Å |
| 354 | A | 85.7 | Confident | 75 | Confident | 30 Ų | 30 | 86.1 Ų | 86.1 | 25% | 0.248 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -59.5 | -38 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q350 | Q350-A354 PolarHBondContact O-N 2.8Å |
| 355 | L | 87.1 | Confident | 72.6 | Confident | 13 Ų | 13 | 92.1 Ų | 92.1 | 7% | 0.068 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -67.1 | -37.9 | 174.7 | -65.6 | 169.3 | 0 | 0 | 0 | 112.2 | I300 I304 F305 R308 V309 W343 R351 M352 S353 | I300-L355 HydrophobicContact CD1-CD1 3.63Å; I300-L355 HydrophobicContact CG1-CD1 3.93Å; I300-L355 HydrophobicContact CG2-CD1 4.1Å; I300-L355 HydrophobicContact CG2-CD2 4.09Å; I304-L355 HydrophobicContact CG2-CD2 4.15Å; F305-L355 HydrophobicContact CD2-CD2 4.4Å; R308-L355 PolarHBondContact NH1-O 3.17Å; V309-L355 HydrophobicContact CG2-CD2 4.24Å; W343-L355 HydrophobicContact CZ2-CD1 4.34Å; R351-L355 WeakPolarHBondContact O-CG 3.46Å; M352-L355 HydrophobicContact SD-CD1 4.18Å; S353-L355 VanDerWaalsContact C-N 3.29Å; S353-L355 PolarHBondContact O-N 3.4Å |
| 356 | R | 79.4 | Confident | 70.1 | Confident | 160 Ų | 160 | 91.6 Ų | 91.6 | 60% | 0.604 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -76.8 | -52.9 | -178.8 | -74.7 | -179.2 | -74.8 | 171.7 | -3.2 | 113.2 | M352 S353 A358 A359 | M352-R356 WeakPolarHBondContact O-CG 3.48Å; M352-R356 PolarHBondContact O-N 3.25Å; M352-R356 PolarHBondContact O-NE 3.15Å; S353-R356 PolarHBondContact O-N 3.39Å; S353-R356 VanDerWaalsContact O-N 3.07Å; R356-A358 VanDerWaalsContact C-N 3.31Å; R356-A358 PolarHBondContact O-N 2.93Å; R356-A359 WeakPolarHBondContact O-CB 3.45Å; R356-A359 PolarHBondContact O-N 3.25Å |
| 357 | L | 59.5 | Low | 67.8 | Low | 133 Ų | 133 | 95.9 Ų | 95.9 | 70% | 0.696 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -61.2 | -36.2 | -172.9 | -76.1 | 165.9 | 0 | 0 | 0 | 113.2 | S353 A359 | S353-L357 PolarHBondContact O-N 3.08Å; L357-A359 PolarHBondContact O-N 3.05Å |
| 358 | A | 53.7 | Low | 65.3 | Low | 32 Ų | 32 | 96.4 Ų | 96.4 | 26% | 0.264 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.6 | 5.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | R308 R356 | R308-A358 HydrophobicContact CB-CB 3.99Å; R308-A358 WeakPolarHBondContact CD-O 3.18Å; R308-A358 HydrophobicContact CG-CB 4.22Å; R308-A358 PolarHBondContact NE-O 3.14Å; R308-A358 VanDerWaalsContact NE-O 3.1Å; R356-A358 VanDerWaalsContact C-N 3.31Å; R356-A358 PolarHBondContact O-N 2.93Å |
| 359 | A | 52.2 | Low | 63.1 | Low | 46 Ų | 46 | 101.1 Ų | 101.1 | 38% | 0.38 | 51% | 0.505 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.3 | -41.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | R356 L357 | R356-A359 WeakPolarHBondContact O-CB 3.45Å; R356-A359 PolarHBondContact O-N 3.25Å; L357-A359 PolarHBondContact O-N 3.05Å |
| 360 | C | 48.6 | Very low | 60.6 | Low | 107 Ų | 107 | 98.9 Ų | 98.9 | 72% | 0.723 | 51% | 0.508 | S | S | * | . | G | 310 helix | trans | -77.9 | -35.3 | -174.5 | -55.8 | 0 | 0 | 0 | 0 | 112.1 | R362 | C360-R362 PolarHBondContact O-N 3.12Š|
| 361 | K | 51.1 | Low | 58.2 | Low | 181 Ų | 181 | 103.9 Ų | 103.9 | 79% | 0.787 | 53% | 0.531 | S | S | * | . | G | 310 helix | trans | -72 | 0.3 | -168.8 | -153.6 | 173.8 | -178.9 | 172.6 | 0 | 116.1 | ||
| 362 | R | 47.3 | Very low | 56.1 | Low | 104 Ų | 104 | 112.8 Ų | 112.8 | 39% | 0.392 | 57% | 0.565 | S | S | . | * | G | 310 helix | trans | -128.6 | 15.7 | 177.4 | -119 | -151.6 | -49.6 | 124.7 | 15.7 | 117 | C360 Q365 | C360-R362 PolarHBondContact O-N 3.12Å; R362-Q365 HydrophobicContact CG-CB 4.29Å |
| 363 | K | 45.9 | Very low | 53.9 | Low | 151 Ų | 151 | 112.8 Ų | 112.8 | 66% | 0.657 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.5 | -38.6 | 159.8 | -152.1 | 178.8 | -177.8 | -170 | 0 | 110.5 | H367 | K363-H367 PolarHBondContact O-ND1 3.37Š|
| 364 | E | 44.7 | Very low | 51.9 | Low | 168 Ų | 168 | 118.4 Ų | 118.4 | 79% | 0.785 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -65.3 | -48.2 | -177.1 | -161.2 | -179.5 | 147.5 | 0 | 0 | 114 | D366 | E364-D366 VanDerWaalsContact C-N 3.28Å; E364-D366 PolarHBondContact O-N 3.37Å |
| 365 | Q | 44.3 | Very low | 50.7 | Low | 152 Ų | 152 | 122.4 Ų | 122.4 | 71% | 0.71 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -71.3 | -17.3 | -177.9 | -176 | 169.2 | 80.7 | 0 | 0 | 114.4 | R362 | R362-Q365 HydrophobicContact CG-CB 4.29Å |
| 366 | D | 42.3 | Very low | 49.7 | Very low | 108 Ų | 108 | 127.4 Ų | 127.4 | 58% | 0.578 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -84.2 | -40.2 | 179.7 | -151.6 | -120.4 | 0 | 0 | 0 | 111.5 | E364 G368 R369 | E364-D366 VanDerWaalsContact C-N 3.28Å; E364-D366 PolarHBondContact O-N 3.37Å; D366-G368 PolarHBondContact O-N 2.8Å; D366-R369 PolarHBondContact O-N 2.74Å |
| 367 | H | 44.1 | Very low | 49.6 | Very low | 121 Ų | 121 | 129.1 Ų | 129.1 | 56% | 0.56 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -70 | -34.7 | -178 | -68.6 | 65.2 | 0 | 0 | 0 | 112.1 | K363 R369 S370 | K363-H367 PolarHBondContact O-ND1 3.37Å; H367-R369 PolarHBondContact O-N 3.47Å; H367-S370 PolarHBondContact O-N 3.02Å |
| 368 | G | 41.8 | Very low | 50.7 | Low | 73 Ų | 73 | 132.1 Ų | 132.1 | 75% | 0.753 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | -1.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | D366 | D366-G368 PolarHBondContact O-N 2.8Š|
| 369 | R | 45.2 | Very low | 52.4 | Low | 200 Ų | 200 | 136.5 Ų | 136.5 | 76% | 0.755 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.1 | 1.1 | 177.5 | -138 | -165.4 | -144 | -72.2 | 0 | 114.5 | D366 H367 | D366-R369 PolarHBondContact O-N 2.74Å; H367-R369 PolarHBondContact O-N 3.47Å |
| 370 | S | 38.1 | Very low | 54.2 | Low | 101 Ų | 101 | 145.5 Ų | 145.5 | 71% | 0.706 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.6 | -20.2 | 177.2 | -158.6 | 0 | 0 | 0 | 0 | 112.9 | H367 R372 | H367-S370 PolarHBondContact O-N 3.02Å; S370-R372 PolarHBondContact O-N 2.93Å |
| 371 | E | 41.4 | Very low | 56.4 | Low | 178 Ų | 178 | 145.5 Ų | 145.5 | 83% | 0.832 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -86.4 | 39.1 | 176.5 | -104.7 | -67.9 | 94.2 | 0 | 0 | 112.9 | ||
| 372 | R | 46.4 | Very low | 58.5 | Low | 211 Ų | 211 | 142.2 Ų | 142.2 | 80% | 0.796 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -141.6 | 68.2 | 169.5 | -71.2 | -159 | -158.4 | -156.1 | 6.1 | 112.3 | S370 | S370-R372 PolarHBondContact O-N 2.93Š|
| 373 | G | 46.2 | Very low | 60.8 | Low | 63 Ų | 63 | 139.5 Ų | 139.5 | 65% | 0.649 | 71% | 0.708 | S | S | * | * | trans | 73.3 | 135.3 | 162.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | V375 | G373-V375 PolarHBondContact O-N 3.05Š| ||
| 374 | N | 44.3 | Very low | 63.3 | Low | 155 Ų | 155 | 135.6 Ų | 135.6 | 83% | 0.829 | 70% | 0.697 | S | S | * | * | trans | -72.1 | 72 | 168.3 | -172.3 | 6.8 | 0 | 0 | 0 | 110.1 | T376 | N374-T376 PolarHBondContact O-N 2.81Š| ||
| 375 | V | 60.2 | Low | 65.8 | Low | 113 Ų | 113 | 132.1 Ų | 132.1 | 69% | 0.685 | 68% | 0.684 | S | S | * | * | trans | -70.7 | 103.4 | 175.4 | -174.2 | 0 | 0 | 0 | 0 | 107.9 | G373 K377 | G373-V375 PolarHBondContact O-N 3.05Å; V375-K377 PolarHBondContact O-N 2.82Å | ||
| 376 | T | 66.4 | Low | 68.3 | Low | 118 Ų | 118 | 128.9 Ų | 128.9 | 72% | 0.724 | 67% | 0.674 | S | S | * | * | trans | -55.4 | 106.4 | 175.4 | 46 | 0 | 0 | 0 | 0 | 109.3 | N374 K378 | N374-T376 PolarHBondContact O-N 2.81Å; T376-K378 PolarHBondContact O-N 3.31Å | ||
| 377 | K | 77.8 | Confident | 70.9 | Confident | 196 Ų | 196 | 125 Ų | 125 | 85% | 0.852 | 65% | 0.653 | S | S | * | * | trans | -64.6 | 112 | -176.1 | -69.8 | 169.9 | -175.4 | 160.7 | 0 | 108 | V375 | V375-K377 PolarHBondContact O-N 2.82Š| ||
| 378 | K | 82.1 | Confident | 73.4 | Confident | 196 Ų | 196 | 124.2 Ų | 124.2 | 85% | 0.852 | 65% | 0.645 | S | S | * | * | trans | -44.5 | 124.2 | 178.5 | -68.6 | -173.9 | 176.4 | -173.5 | 0 | 109.6 | T376 R380 | T376-K378 PolarHBondContact O-N 3.31Å; K378-R380 PolarHBondContact O-N 3.01Å | ||
| 379 | P | 89.8 | Confident | 76.1 | Confident | 125 Ų | 125 | 128.9 Ų | 128.9 | 81% | 0.812 | 64% | 0.639 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 140.6 | -177.3 | 24 | -33.2 | 0 | 0 | 0 | 109.5 | L381 | P379-L381 PolarHBondContact O-N 3.29Š|
| 380 | R | 91.1 | Very high | 78.5 | Confident | 234 Ų | 234 | 121.9 Ų | 121.9 | 88% | 0.883 | 62% | 0.619 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 126.7 | -179.8 | -65.5 | -174.4 | -178.8 | -157.4 | 1 | 109 | K378 V382 | K378-R380 PolarHBondContact O-N 3.01Å; R380-V382 PolarHBondContact O-N 2.9Å |
| 381 | L | 94.4 | Very high | 81.4 | Confident | 108 Ų | 108 | 117 Ų | 117 | 57% | 0.565 | 59% | 0.585 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 129.7 | 171.1 | -176.9 | 144.1 | 0 | 0 | 0 | 110 | P379 F383 T419 | P379-L381 PolarHBondContact O-N 3.29Å; L381-F383 HydrophobicContact CD2-CD1 4.05Å; L381-F383 HydrophobicContact CD2-CE1 3.93Å; L381-F383 HydrophobicContact CD2-CZ 4.35Å; L381-T419 HydrophobicContact CD2-CG2 4Å |
| 382 | V | 94.3 | Very high | 84 | Confident | 112 Ų | 112 | 113.3 Ų | 113.3 | 68% | 0.679 | 57% | 0.568 | S | S | * | * | trans | -116 | 126.3 | 174.2 | -179.3 | 0 | 0 | 0 | 0 | 107.4 | R380 | R380-V382 PolarHBondContact O-N 2.9Š| ||
| 383 | F | 96.8 | Very high | 86.4 | Confident | 46 Ų | 46 | 106 Ų | 106 | 20% | 0.202 | 55% | 0.552 | C | S | . | * | trans | -66.7 | 135.9 | 174.9 | -64.8 | -64.1 | 0 | 0 | 0 | 111.1 | L381 Q387 R388 L391 L415 T419 F423 | L381-F383 HydrophobicContact CD2-CD1 4.05Å; L381-F383 HydrophobicContact CD2-CE1 3.93Å; L381-F383 HydrophobicContact CD2-CZ 4.35Å; F383-Q387 HydrophobicContact CB-CB 4.31Å; F383-Q387 HydrophobicContact CD1-CB 4.32Å; F383-R388 HydrophobicContact CB-CB 4.39Å; F383-R388 PolarHBondContact O-NH2 2.98Å; F383-L391 HydrophobicContact CD1-CD1 4.15Å; F383-L391 HydrophobicContact CE1-CD1 3.94Å; F383-L391 HydrophobicContact CZ-CD1 4.25Å; F383-L415 HydrophobicContact CD1-CD1 4.01Å; F383-L415 HydrophobicContact CD1-CD2 4.17Å; F383-L415 HydrophobicContact CE1-CD1 3.74Å; F383-L415 HydrophobicContact CE1-CD2 4.06Å; F383-T419 HydrophobicContact CE1-CG2 3.49Å; F383-T419 VanDerWaalsContact CE1-CG2 3.49Å; F383-T419 HydrophobicContact CZ-CG2 3.62Å; F383-F423 HydrophobicContact CE2-CD2 4.12Å; F383-F423 HydrophobicContact CZ-CB 4.3Å; F383-F423 HydrophobicContact CZ-CD2 4.45Å | ||
| 384 | T | 97.2 | Very high | 88.8 | Confident | 70 Ų | 70 | 105 Ų | 105 | 43% | 0.429 | 53% | 0.532 | S | S | . | . | trans | -64.1 | 160 | 165.5 | 71.5 | 0 | 0 | 0 | 0 | 110.1 | V386 Q387 R388 | T384-V386 VanDerWaalsContact C-N 3.3Å; T384-V386 PolarHBondContact O-N 3.13Å; T384-V386 VanDerWaalsContact OG1-CG1 3.3Å; T384-V386 WeakPolarHBondContact OG1-CG1 3.44Å; T384-Q387 PolarHBondContact O-N 3.3Å; T384-Q387 WeakPolarHBondContact OG1-CG 3.49Å; T384-Q387 PolarHBondContact OG1-N 2.92Å; T384-Q387 PolarHBondContact OG1-OE1 3.44Å; T384-R388 WeakPolarHBondContact O-CB 3.29Å; T384-R388 PolarHBondContact O-N 3.08Å | ||
| 385 | D | 96.9 | Very high | 91.3 | Very high | 94 Ų | 94 | 98.9 Ų | 98.9 | 50% | 0.503 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -68.8 | -28.8 | -176.7 | -64.4 | -52.8 | 0 | 0 | 0 | 113.5 | R388 R389 | D385-R388 IonicContact OD1-NE 3.95Å; D385-R388 PolarHBondContact OD1-NE 2.94Å; D385-R389 WeakPolarHBondContact O-CB 3.27Å; D385-R389 VanDerWaalsContact O-CG 3.3Å; D385-R389 WeakPolarHBondContact O-CG 3.36Å; D385-R389 PolarHBondContact O-N 3.37Å |
| 386 | V | 96.6 | Very high | 92.9 | Very high | 85 Ų | 85 | 100.6 Ų | 100.6 | 52% | 0.515 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66.1 | -48.9 | 170.5 | 59.4 | 0 | 0 | 0 | 0 | 111.1 | T384 R388 R389 T390 | T384-V386 VanDerWaalsContact C-N 3.3Å; T384-V386 PolarHBondContact O-N 3.13Å; T384-V386 VanDerWaalsContact OG1-CG1 3.3Å; T384-V386 WeakPolarHBondContact OG1-CG1 3.44Å; V386-R388 VanDerWaalsContact C-N 3.32Å; V386-R388 PolarHBondContact O-N 3.07Å; V386-R389 PolarHBondContact O-N 2.75Å; V386-T390 WeakPolarHBondContact O-CB 3.4Å; V386-T390 PolarHBondContact O-N 3.38Å; V386-T390 PolarHBondContact O-OG1 3.19Å; V386-T390 VanDerWaalsContact O-OG1 3.08Å |
| 387 | Q | 97.6 | Very high | 94.3 | Very high | 26 Ų | 26 | 102.2 Ų | 102.2 | 12% | 0.121 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -57.1 | -47 | 175.3 | -70.3 | 170.2 | -18.1 | 0 | 0 | 111.1 | F383 T384 L391 L413 L415 | F383-Q387 HydrophobicContact CB-CB 4.31Å; F383-Q387 HydrophobicContact CD1-CB 4.32Å; T384-Q387 PolarHBondContact O-N 3.3Å; T384-Q387 WeakPolarHBondContact OG1-CG 3.49Å; T384-Q387 PolarHBondContact OG1-N 2.92Å; T384-Q387 PolarHBondContact OG1-OE1 3.44Å; Q387-L391 VanDerWaalsContact O-CB 3.27Å; Q387-L391 WeakPolarHBondContact O-CB 3.49Å; Q387-L391 WeakPolarHBondContact O-CD1 3.48Å; Q387-L391 WeakPolarHBondContact O-CG 3.43Å; Q387-L391 PolarHBondContact O-N 3.09Å; Q387-L413 HydrophobicContact CG-CB 4.19Å; Q387-L413 HydrophobicContact CG-CD2 4.33Å; Q387-L413 PolarHBondContact NE2-O 3.06Å; Q387-L415 HydrophobicContact CB-CD1 4.39Å; Q387-L415 HydrophobicContact CG-CD1 4.23Å; Q387-L415 HydrophobicContact CG-CG 4.49Å |
| 388 | R | 97.3 | Very high | 95.1 | Very high | 105 Ų | 105 | 95.7 Ų | 95.7 | 40% | 0.396 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -58.6 | -51.9 | 178.4 | -174 | -166.2 | -55.2 | -92.8 | -8.4 | 111.3 | F383 T384 D385 V386 H392 | F383-R388 HydrophobicContact CB-CB 4.39Å; F383-R388 PolarHBondContact O-NH2 2.98Å; T384-R388 WeakPolarHBondContact O-CB 3.29Å; T384-R388 PolarHBondContact O-N 3.08Å; D385-R388 IonicContact OD1-NE 3.95Å; D385-R388 PolarHBondContact OD1-NE 2.94Å; V386-R388 VanDerWaalsContact C-N 3.32Å; V386-R388 PolarHBondContact O-N 3.07Å; R388-H392 PolarHBondContact O-N 2.96Å; R388-H392 VanDerWaalsContact O-N 3.09Å; R388-H392 PolarHBondContact O-ND1 3.02Å |
| 389 | R | 97.5 | Very high | 95.7 | Very high | 170 Ų | 170 | 91.2 Ų | 91.2 | 64% | 0.642 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -62.9 | -48.2 | -178.2 | -75 | -172.5 | -62.1 | -105.2 | 3.9 | 111.4 | D385 V386 L391 H392 A393 | D385-R389 WeakPolarHBondContact O-CB 3.27Å; D385-R389 VanDerWaalsContact O-CG 3.3Å; D385-R389 WeakPolarHBondContact O-CG 3.36Å; D385-R389 PolarHBondContact O-N 3.37Å; V386-R389 PolarHBondContact O-N 2.75Å; R389-L391 PolarHBondContact O-N 3.44Å; R389-H392 PolarHBondContact O-N 3.18Å; R389-A393 PolarHBondContact O-N 3.45Å |
| 390 | T | 97.1 | Very high | 95.9 | Very high | 53 Ų | 53 | 94.8 Ų | 94.8 | 33% | 0.325 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.2 | -45.3 | 178.7 | -57.2 | 0 | 0 | 0 | 0 | 111.9 | V386 H392 A393 I394 L413 | V386-T390 WeakPolarHBondContact O-CB 3.4Å; V386-T390 PolarHBondContact O-N 3.38Å; V386-T390 PolarHBondContact O-OG1 3.19Å; V386-T390 VanDerWaalsContact O-OG1 3.08Å; T390-H392 VanDerWaalsContact C-N 3.33Å; T390-H392 PolarHBondContact O-N 2.89Å; T390-A393 PolarHBondContact O-N 3.32Å; T390-I394 HydrophobicContact CG2-CD1 3.94Å; T390-I394 WeakPolarHBondContact O-CG1 3.39Å; T390-I394 PolarHBondContact O-N 3.16Å; T390-L413 HydrophobicContact CG2-CD1 4.39Å; T390-L413 HydrophobicContact CG2-CD2 4.1Å |
| 391 | L | 97.6 | Very high | 96.1 | Very high | 0 Ų | 0 | 83.9 Ų | 83.9 | 0% | 0 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -61.8 | -37 | 176.8 | -75.1 | 170.3 | 0 | 0 | 0 | 113 | F383 Q387 R389 F395 I409 L413 L415 V420 F423 F424 | F383-L391 HydrophobicContact CD1-CD1 4.15Å; F383-L391 HydrophobicContact CE1-CD1 3.94Å; F383-L391 HydrophobicContact CZ-CD1 4.25Å; Q387-L391 VanDerWaalsContact O-CB 3.27Å; Q387-L391 WeakPolarHBondContact O-CB 3.49Å; Q387-L391 WeakPolarHBondContact O-CD1 3.48Å; Q387-L391 WeakPolarHBondContact O-CG 3.43Å; Q387-L391 PolarHBondContact O-N 3.09Å; R389-L391 PolarHBondContact O-N 3.44Å; L391-F395 VanDerWaalsContact O-CB 3.29Å; L391-F395 WeakPolarHBondContact O-CB 3.43Å; L391-F395 PolarHBondContact O-N 2.8Å; L391-I409 HydrophobicContact CD2-CG2 3.69Å; L391-L413 HydrophobicContact CD1-CD1 4.29Å; L391-L413 HydrophobicContact CD2-CD1 3.93Å; L391-L413 HydrophobicContact CG-CD1 3.7Å; L391-L415 HydrophobicContact CD1-CD1 4.12Å; L391-V420 HydrophobicContact CD2-CG1 4.25Å; L391-F423 HydrophobicContact CB-CD1 3.9Å; L391-F423 HydrophobicContact CB-CD2 4.31Å; L391-F423 HydrophobicContact CB-CE1 3.61Å; L391-F423 HydrophobicContact CB-CE2 4.02Å; L391-F423 HydrophobicContact CB-CG 4.27Å; L391-F423 HydrophobicContact CB-CZ 3.68Å; L391-F423 HydrophobicContact CD1-CB 4.42Å; L391-F423 HydrophobicContact CD1-CD1 4.36Å; L391-F423 HydrophobicContact CD1-CD2 4.05Å; L391-F423 HydrophobicContact CD1-CE2 4.48Å; L391-F423 HydrophobicContact CD1-CG 4Å; L391-F423 HydrophobicContact CD2-CD1 4.04Å; L391-F423 HydrophobicContact CD2-CG 4.38Å; L391-F423 HydrophobicContact CG-CD1 4.33Å; L391-F423 HydrophobicContact CG-CG 4.46Å; L391-F423 WeakPolarHBondContact O-CE1 3.14Å; L391-F424 HydrophobicContact CD2-CE2 4.01Å; L391-F424 HydrophobicContact CD2-CZ 4.25Å |
| 392 | H | 97 | Very high | 96.3 | Very high | 99 Ų | 99 | 81.6 Ų | 81.6 | 46% | 0.458 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -73.8 | -37.6 | 175.7 | -74.1 | 80.4 | 0 | 0 | 0 | 112.8 | R388 R389 T390 F395 K396 F423 | R388-H392 PolarHBondContact O-N 2.96Å; R388-H392 VanDerWaalsContact O-N 3.09Å; R388-H392 PolarHBondContact O-ND1 3.02Å; R389-H392 PolarHBondContact O-N 3.18Å; T390-H392 VanDerWaalsContact C-N 3.33Å; T390-H392 PolarHBondContact O-N 2.89Å; H392-F395 CarbonylContact O-C 3.33Å; H392-F395 PolarHBondContact O-N 3.12Å; H392-K396 PolarHBondContact O-N 2.95Å; H392-F423 AromaticContact CE1-CE2 3.6Å; H392-F423 AromaticContact CE1-CZ 3.72Å; H392-F423 AromaticContact ND1-CE2 3.95Å; H392-F423 AromaticContact ND1-CZ 3.74Å |
| 393 | A | 96.7 | Very high | 96.4 | Very high | 57 Ų | 57 | 83.7 Ų | 83.7 | 47% | 0.471 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -60.8 | -49.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | R389 T390 F395 K396 E397 | R389-A393 PolarHBondContact O-N 3.45Å; T390-A393 PolarHBondContact O-N 3.32Å; A393-F395 VanDerWaalsContact C-N 3.3Å; A393-F395 PolarHBondContact O-N 2.84Å; A393-K396 WeakPolarHBondContact O-CA 3.47Å; A393-K396 WeakPolarHBondContact O-CB 3.2Å; A393-K396 PolarHBondContact O-N 2.69Å; A393-E397 PolarHBondContact O-N 3.27Å |
| 394 | I | 96.3 | Very high | 96.4 | Very high | 44 Ų | 44 | 88.6 Ų | 88.6 | 23% | 0.226 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -63.2 | -37.5 | 176.3 | -61.7 | 172.6 | 0 | 0 | 0 | 111.2 | T390 K396 E397 N398 I409 F424 | T390-I394 HydrophobicContact CG2-CD1 3.94Å; T390-I394 WeakPolarHBondContact O-CG1 3.39Å; T390-I394 PolarHBondContact O-N 3.16Å; I394-K396 PolarHBondContact O-N 3.5Å; I394-E397 PolarHBondContact O-N 3.39Å; I394-N398 PolarHBondContact O-N 2.85Å; I394-I409 HydrophobicContact CD1-CD1 3.75Å; I394-I409 HydrophobicContact CD1-CG1 3.68Å; I394-I409 HydrophobicContact CD1-CG2 4.48Å; I394-I409 HydrophobicContact CG2-CD1 3.83Å; I394-F424 HydrophobicContact CB-CZ 4.28Å; I394-F424 HydrophobicContact CG2-CE1 4.25Å; I394-F424 HydrophobicContact CG2-CZ 3.85Å |
| 395 | F | 96.3 | Very high | 96.4 | Very high | 25 Ų | 25 | 88.1 Ų | 88.1 | 11% | 0.11 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -67.9 | -21 | 173.8 | -176.9 | -112.6 | 0 | 0 | 0 | 113.5 | L391 H392 A393 K399 F423 F424 A427 R428 | L391-F395 VanDerWaalsContact O-CB 3.29Å; L391-F395 WeakPolarHBondContact O-CB 3.43Å; L391-F395 PolarHBondContact O-N 2.8Å; H392-F395 CarbonylContact O-C 3.33Å; H392-F395 PolarHBondContact O-N 3.12Å; A393-F395 VanDerWaalsContact C-N 3.3Å; A393-F395 PolarHBondContact O-N 2.84Å; F395-K399 HydrophobicContact CD2-CD 4.25Å; F395-K399 HydrophobicContact CE1-CD 4.41Å; F395-K399 HydrophobicContact CE2-CB 4.14Å; F395-K399 HydrophobicContact CE2-CD 3.8Å; F395-K399 HydrophobicContact CZ-CD 3.9Å; F395-K399 VanDerWaalsContact O-CD 3.31Å; F395-K399 WeakPolarHBondContact O-CD 3.34Å; F395-K399 WeakPolarHBondContact O-CE 3.47Å; F395-K399 PolarHBondContact O-NZ 3.05Å; F395-F423 HydrophobicContact CB-CE1 4.24Å; F395-F424 HydrophobicContact CB-CD1 4.28Å; F395-F424 HydrophobicContact CB-CE1 3.87Å; F395-F424 AromaticContact CD2-CD1 3.88Å; F395-F424 HydrophobicContact CD2-CD1 3.88Å; F395-F424 HydrophobicContact CD2-CE1 4.24Å; F395-A427 HydrophobicContact CD1-CB 3.84Å; F395-A427 HydrophobicContact CD2-CB 3.89Å; F395-A427 HydrophobicContact CE1-CB 3.74Å; F395-A427 HydrophobicContact CE2-CB 3.79Å; F395-A427 HydrophobicContact CG-CB 3.91Å; F395-A427 HydrophobicContact CZ-CB 3.71Å; F395-R428 HydrophobicContact CE2-CG 3.77Å; F395-R428 HydrophobicContact CZ-CG 4.28Å |
| 396 | K | 94.6 | Very high | 96.4 | Very high | 150 Ų | 150 | 84.8 Ų | 84.8 | 65% | 0.652 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -66.4 | -52.5 | 172.3 | -166.6 | -174.2 | 173.6 | -164.2 | 0 | 109.6 | H392 A393 I394 K399 | H392-K396 PolarHBondContact O-N 2.95Å; A393-K396 WeakPolarHBondContact O-CA 3.47Å; A393-K396 WeakPolarHBondContact O-CB 3.2Å; A393-K396 PolarHBondContact O-N 2.69Å; I394-K396 PolarHBondContact O-N 3.5Å; K396-K399 WeakPolarHBondContact O-CE 3.38Å; K396-K399 PolarHBondContact O-NZ 3.02Å |
| 397 | E | 95.5 | Very high | 96.4 | Very high | 151 Ų | 151 | 84.9 Ų | 84.9 | 71% | 0.706 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -74.5 | -44.6 | -176.9 | -52 | -46.4 | 123.5 | 0 | 0 | 113 | A393 I394 | A393-E397 PolarHBondContact O-N 3.27Å; I394-E397 PolarHBondContact O-N 3.39Å |
| 398 | N | 94.4 | Very high | 96.4 | Very high | 60 Ų | 60 | 87.5 Ų | 87.5 | 32% | 0.321 | 42% | 0.415 | S | S | . | . | trans | -129.2 | 108.1 | -177.2 | -167.8 | -23.8 | 0 | 0 | 0 | 112.2 | I394 R400 P401 | I394-N398 PolarHBondContact O-N 2.85Å; N398-R400 VanDerWaalsContact C-N 3.31Å; N398-R400 PolarHBondContact O-N 3.22Å; N398-R400 PolarHBondContact OD1-N 3.4Å; N398-R400 PolarHBondContact OD1-O 3.1Å; N398-P401 VanDerWaalsContact OD1-N 3.16Å | ||
| 399 | K | 94.1 | Very high | 96.4 | Very high | 102 Ų | 102 | 82.9 Ų | 82.9 | 44% | 0.443 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -71.1 | -23.6 | 178.5 | -50.2 | -61.1 | 165.7 | -157 | 0 | 113.2 | F395 K396 R428 | F395-K399 HydrophobicContact CD2-CD 4.25Å; F395-K399 HydrophobicContact CE1-CD 4.41Å; F395-K399 HydrophobicContact CE2-CB 4.14Å; F395-K399 HydrophobicContact CE2-CD 3.8Å; F395-K399 HydrophobicContact CZ-CD 3.9Å; F395-K399 VanDerWaalsContact O-CD 3.31Å; F395-K399 WeakPolarHBondContact O-CD 3.34Å; F395-K399 WeakPolarHBondContact O-CE 3.47Å; F395-K399 PolarHBondContact O-NZ 3.05Å; K396-K399 WeakPolarHBondContact O-CE 3.38Å; K396-K399 PolarHBondContact O-NZ 3.02Å; K399-R428 VanDerWaalsContact O-CD 3.23Å; K399-R428 WeakPolarHBondContact O-CD 3.45Å; K399-R428 WeakPolarHBondContact O-CG 3.3Å; K399-R428 PolarHBondContact O-NH1 2.84Å |
| 400 | R | 95.6 | Very high | 96.4 | Very high | 199 Ų | 199 | 75 Ų | 75 | 75% | 0.751 | 37% | 0.369 | S | S | * | . | S | Bend | trans | -138 | 62.2 | -171 | -61.4 | -177.8 | 87.1 | 152.7 | 1.4 | 110.4 | N398 | N398-R400 VanDerWaalsContact C-N 3.31Å; N398-R400 PolarHBondContact O-N 3.22Å; N398-R400 PolarHBondContact OD1-N 3.4Å; N398-R400 PolarHBondContact OD1-O 3.1Å |
| 401 | P | 95.1 | Very high | 96.5 | Very high | 5 Ų | 5 | 80.6 Ų | 80.6 | 3% | 0.032 | 39% | 0.392 | C | S | . | . | trans | -57.4 | 143.4 | 178 | 25.8 | -35.4 | 0 | 0 | 0 | 110.9 | N398 L405 Q406 F424 | N398-P401 VanDerWaalsContact OD1-N 3.16Å; P401-L405 HydrophobicContact CB-CB 4.17Å; P401-L405 HydrophobicContact CB-CD2 3.64Å; P401-L405 HydrophobicContact CB-CG 3.88Å; P401-Q406 HydrophobicContact CB-CG 4.12Å; P401-Q406 HydrophobicContact CG-CG 3.84Å; P401-Q406 PolarHBondContact O-NE2 2.81Å; P401-F424 HydrophobicContact CG-CD1 3.77Å; P401-F424 HydrophobicContact CG-CD2 3.73Å; P401-F424 HydrophobicContact CG-CE1 3.81Å; P401-F424 HydrophobicContact CG-CE2 3.78Å; P401-F424 HydrophobicContact CG-CG 3.75Å; P401-F424 HydrophobicContact CG-CZ 3.83Å | ||
| 402 | S | 97.3 | Very high | 96.4 | Very high | 61 Ų | 61 | 88.1 Ų | 88.1 | 43% | 0.427 | 43% | 0.427 | S | S | . | . | trans | -62.1 | 165.8 | 177 | 66.9 | 0 | 0 | 0 | 0 | 111.6 | E404 L405 Q406 | S402-E404 PolarHBondContact O-N 3.37Å; S402-L405 PolarHBondContact O-N 3.36Å; S402-L405 WeakPolarHBondContact OG-CB 3.49Å; S402-L405 PolarHBondContact OG-N 3.01Å; S402-L405 VanDerWaalsContact OG-N 3.1Å; S402-Q406 WeakPolarHBondContact O-CB 3.31Å; S402-Q406 VanDerWaalsContact O-CG 3.3Å; S402-Q406 WeakPolarHBondContact O-CG 3.4Å; S402-Q406 PolarHBondContact O-N 3.36Å | ||
| 403 | K | 96.7 | Very high | 96.4 | Very high | 155 Ų | 155 | 84.5 Ų | 84.5 | 67% | 0.674 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -59.8 | -37.9 | 176.3 | -173.6 | -176.9 | 177.1 | -171 | 0 | 111.5 | Q406 L407 | K403-Q406 PolarHBondContact O-N 3.01Å; K403-L407 WeakPolarHBondContact O-CG 3.21Å; K403-L407 PolarHBondContact O-N 3.36Å |
| 404 | E | 97.1 | Very high | 96.4 | Very high | 149 Ų | 149 | 85.1 Ų | 85.1 | 70% | 0.696 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -64.7 | -50.1 | 175.2 | -177.6 | 179.2 | -163.1 | 0 | 0 | 112.1 | S402 Q406 L407 T408 | S402-E404 PolarHBondContact O-N 3.37Å; E404-Q406 VanDerWaalsContact C-N 3.26Å; E404-Q406 PolarHBondContact O-N 2.8Å; E404-L407 WeakPolarHBondContact O-CA 3.39Å; E404-L407 VanDerWaalsContact O-CB 3.29Å; E404-L407 WeakPolarHBondContact O-CB 3.49Å; E404-L407 PolarHBondContact O-N 2.97Å; E404-T408 PolarHBondContact O-N 2.79Å; E404-T408 PolarHBondContact O-OG1 3.3Å |
| 405 | L | 96.4 | Very high | 96.5 | Very high | 61 Ų | 61 | 84 Ų | 84 | 32% | 0.319 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -61.7 | -36.3 | 175.7 | 179.4 | 55.5 | 0 | 0 | 0 | 111.5 | P401 S402 L407 T408 I409 | P401-L405 HydrophobicContact CB-CB 4.17Å; P401-L405 HydrophobicContact CB-CD2 3.64Å; P401-L405 HydrophobicContact CB-CG 3.88Å; S402-L405 PolarHBondContact O-N 3.36Å; S402-L405 WeakPolarHBondContact OG-CB 3.49Å; S402-L405 PolarHBondContact OG-N 3.01Å; S402-L405 VanDerWaalsContact OG-N 3.1Å; L405-L407 VanDerWaalsContact C-N 3.35Å; L405-T408 PolarHBondContact O-N 3.08Å; L405-I409 HydrophobicContact CD1-CD1 4.14Å; L405-I409 HydrophobicContact CD1-CG1 4.31Å; L405-I409 HydrophobicContact CG-CD1 3.95Å; L405-I409 WeakPolarHBondContact O-CB 3.47Å; L405-I409 VanDerWaalsContact O-CD1 3.3Å; L405-I409 WeakPolarHBondContact O-CD1 3.29Å; L405-I409 WeakPolarHBondContact O-CG1 3.36Å; L405-I409 PolarHBondContact O-N 3.17Å |
| 406 | Q | 97.1 | Very high | 96.5 | Very high | 23 Ų | 23 | 89.4 Ų | 89.4 | 11% | 0.107 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -66.3 | -32.8 | 172.9 | -70.3 | 174.9 | 50.5 | 0 | 0 | 113.1 | P401 S402 K403 E404 A410 L417 V420 S421 F424 | P401-Q406 HydrophobicContact CB-CG 4.12Å; P401-Q406 HydrophobicContact CG-CG 3.84Å; P401-Q406 PolarHBondContact O-NE2 2.81Å; S402-Q406 WeakPolarHBondContact O-CB 3.31Å; S402-Q406 VanDerWaalsContact O-CG 3.3Å; S402-Q406 WeakPolarHBondContact O-CG 3.4Å; S402-Q406 PolarHBondContact O-N 3.36Å; K403-Q406 PolarHBondContact O-N 3.01Å; E404-Q406 VanDerWaalsContact C-N 3.26Å; E404-Q406 PolarHBondContact O-N 2.8Å; Q406-A410 WeakPolarHBondContact O-CB 3.29Å; Q406-A410 PolarHBondContact O-N 3.08Å; Q406-L417 HydrophobicContact CB-CD1 3.63Å; Q406-V420 HydrophobicContact CB-CG1 4.19Å; Q406-V420 HydrophobicContact CG-CG1 4.28Å; Q406-S421 VanDerWaalsContact OE1-CA 3.25Å; Q406-S421 VanDerWaalsContact OE1-CB 3.24Å; Q406-F424 HydrophobicContact CG-CD2 4.33Å |
| 407 | L | 98.1 | Very high | 96.6 | Very high | 88 Ų | 88 | 84.8 Ų | 84.8 | 46% | 0.461 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.5 | -47.4 | 171.3 | -82.4 | 162.5 | 0 | 0 | 0 | 110.9 | K403 E404 L405 I409 A410 Q411 L417 | K403-L407 WeakPolarHBondContact O-CG 3.21Å; K403-L407 PolarHBondContact O-N 3.36Å; E404-L407 WeakPolarHBondContact O-CA 3.39Å; E404-L407 VanDerWaalsContact O-CB 3.29Å; E404-L407 WeakPolarHBondContact O-CB 3.49Å; E404-L407 PolarHBondContact O-N 2.97Å; L405-L407 VanDerWaalsContact C-N 3.35Å; L407-I409 VanDerWaalsContact C-N 3.32Å; L407-I409 PolarHBondContact O-N 3.14Å; L407-A410 WeakPolarHBondContact O-CB 3.38Å; L407-A410 PolarHBondContact O-N 3.34Å; L407-Q411 PolarHBondContact O-N 2.97Å; L407-L417 HydrophobicContact CD2-CB 4.42Å; L407-L417 HydrophobicContact CD2-CD1 4.22Å; L407-L417 HydrophobicContact CD2-CD2 3.84Å; L407-L417 HydrophobicContact CD2-CG 4.38Å; L407-L417 HydrophobicContact CG-CD1 3.99Å; L407-L417 HydrophobicContact CG-CD2 4.04Å |
| 408 | T | 97.5 | Very high | 96.7 | Very high | 80 Ų | 80 | 80.2 Ų | 80.2 | 49% | 0.491 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -57.8 | -45.3 | 176.1 | -47.2 | 0 | 0 | 0 | 0 | 111.4 | E404 L405 Q411 Q412 | E404-T408 PolarHBondContact O-N 2.79Å; E404-T408 PolarHBondContact O-OG1 3.3Å; L405-T408 PolarHBondContact O-N 3.08Å; T408-Q411 PolarHBondContact O-N 2.78Å; T408-Q412 VanDerWaalsContact O-CB 3.29Å; T408-Q412 WeakPolarHBondContact O-CB 3.34Å; T408-Q412 PolarHBondContact O-N 3.46Å |
| 409 | I | 96.8 | Very high | 96.8 | Very high | 9 Ų | 9 | 78.5 Ų | 78.5 | 5% | 0.046 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -64.3 | -41.5 | 177.1 | -66.5 | 162.4 | 0 | 0 | 0 | 111.5 | L391 I394 L405 L407 L413 V420 F424 | L391-I409 HydrophobicContact CD2-CG2 3.69Å; I394-I409 HydrophobicContact CD1-CD1 3.75Å; I394-I409 HydrophobicContact CD1-CG1 3.68Å; I394-I409 HydrophobicContact CD1-CG2 4.48Å; I394-I409 HydrophobicContact CG2-CD1 3.83Å; L405-I409 HydrophobicContact CD1-CD1 4.14Å; L405-I409 HydrophobicContact CD1-CG1 4.31Å; L405-I409 HydrophobicContact CG-CD1 3.95Å; L405-I409 WeakPolarHBondContact O-CB 3.47Å; L405-I409 VanDerWaalsContact O-CD1 3.3Å; L405-I409 WeakPolarHBondContact O-CD1 3.29Å; L405-I409 WeakPolarHBondContact O-CG1 3.36Å; L405-I409 PolarHBondContact O-N 3.17Å; L407-I409 VanDerWaalsContact C-N 3.32Å; L407-I409 PolarHBondContact O-N 3.14Å; I409-L413 HydrophobicContact CG2-CD1 3.77Å; I409-L413 HydrophobicContact CG2-CG 4.39Å; I409-L413 VanDerWaalsContact O-CB 3.24Å; I409-L413 WeakPolarHBondContact O-CB 3.24Å; I409-L413 WeakPolarHBondContact O-CG 3.26Å; I409-L413 PolarHBondContact O-N 2.98Å; I409-V420 HydrophobicContact CB-CG1 4.18Å; I409-V420 HydrophobicContact CG2-CG1 3.79Å; I409-V420 HydrophobicContact CG2-CG2 4.26Å; I409-F424 HydrophobicContact CD1-CE2 4Å; I409-F424 HydrophobicContact CD1-CZ 4.06Å |
| 410 | A | 97.9 | Very high | 96.9 | Very high | 5 Ų | 5 | 73.7 Ų | 73.7 | 4% | 0.041 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -60.2 | -48.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q406 L407 L413 G414 L415 L417 V420 | Q406-A410 WeakPolarHBondContact O-CB 3.29Å; Q406-A410 PolarHBondContact O-N 3.08Å; L407-A410 WeakPolarHBondContact O-CB 3.38Å; L407-A410 PolarHBondContact O-N 3.34Å; A410-L413 PolarHBondContact O-N 3.22Å; A410-G414 PolarHBondContact O-N 3.31Å; A410-G414 VanDerWaalsContact O-N 3.08Å; A410-L415 CarbonylContact C-O 3.53Å; A410-L415 WeakPolarHBondContact CA-O 3.37Å; A410-L415 VanDerWaalsContact CB-O 3.29Å; A410-L415 WeakPolarHBondContact CB-O 3.36Å; A410-L415 PolarHBondContact O-N 2.79Å; A410-L417 HydrophobicContact CB-CB 4.5Å; A410-V420 HydrophobicContact CB-CG2 3.88Å |
| 411 | Q | 97.6 | Very high | 97 | Very high | 169 Ų | 169 | 66.1 Ų | 66.1 | 79% | 0.79 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -62.9 | -49.5 | 176.8 | -171.6 | 174 | 5.3 | 0 | 0 | 112 | L407 T408 L413 G414 | L407-Q411 PolarHBondContact O-N 2.97Å; T408-Q411 PolarHBondContact O-N 2.78Å; Q411-L413 PolarHBondContact O-N 3.45Å; Q411-G414 PolarHBondContact O-N 3.06Å |
| 412 | Q | 96.7 | Very high | 97.1 | Very high | 159 Ų | 159 | 69.7 Ų | 69.7 | 74% | 0.743 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -63.2 | -27 | -178.4 | -168.2 | 62.9 | 46.6 | 0 | 0 | 113.5 | T408 | T408-Q412 VanDerWaalsContact O-CB 3.29Å; T408-Q412 WeakPolarHBondContact O-CB 3.34Å; T408-Q412 PolarHBondContact O-N 3.46Å |
| 413 | L | 96.9 | Very high | 97.1 | Very high | 22 Ų | 22 | 68 Ų | 68 | 12% | 0.115 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -102.2 | -2.1 | -177.9 | -67.8 | -174.8 | 0 | 0 | 0 | 114.4 | Q387 T390 L391 I409 A410 Q411 L415 | Q387-L413 HydrophobicContact CG-CB 4.19Å; Q387-L413 HydrophobicContact CG-CD2 4.33Å; Q387-L413 PolarHBondContact NE2-O 3.06Å; T390-L413 HydrophobicContact CG2-CD1 4.39Å; T390-L413 HydrophobicContact CG2-CD2 4.1Å; L391-L413 HydrophobicContact CD1-CD1 4.29Å; L391-L413 HydrophobicContact CD2-CD1 3.93Å; L391-L413 HydrophobicContact CG-CD1 3.7Å; I409-L413 HydrophobicContact CG2-CD1 3.77Å; I409-L413 HydrophobicContact CG2-CG 4.39Å; I409-L413 VanDerWaalsContact O-CB 3.24Å; I409-L413 WeakPolarHBondContact O-CB 3.24Å; I409-L413 WeakPolarHBondContact O-CG 3.26Å; I409-L413 PolarHBondContact O-N 2.98Å; A410-L413 PolarHBondContact O-N 3.22Å; Q411-L413 PolarHBondContact O-N 3.45Å; L413-L415 VanDerWaalsContact C-N 3.32Å; L413-L415 HydrophobicContact CB-CD1 3.84Å; L413-L415 HydrophobicContact CB-CG 4.03Å; L413-L415 HydrophobicContact CD1-CD1 4.12Å; L413-L415 PolarHBondContact O-N 2.92Å |
| 414 | G | 96.7 | Very high | 97.1 | Very high | 70 Ų | 70 | 60.6 Ų | 60.6 | 72% | 0.722 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.8 | 38.8 | -174.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | A410 Q411 | A410-G414 PolarHBondContact O-N 3.31Å; A410-G414 VanDerWaalsContact O-N 3.08Å; Q411-G414 PolarHBondContact O-N 3.06Å |
| 415 | L | 97.2 | Very high | 97 | Very high | 20 Ų | 20 | 58.1 Ų | 58.1 | 11% | 0.105 | 32% | 0.323 | C | S | . | . | trans | -118.4 | 152.5 | -177.4 | -69.6 | 173.4 | 0 | 0 | 0 | 110.9 | F383 Q387 L391 A410 L413 T419 V420 | F383-L415 HydrophobicContact CD1-CD1 4.01Å; F383-L415 HydrophobicContact CD1-CD2 4.17Å; F383-L415 HydrophobicContact CE1-CD1 3.74Å; F383-L415 HydrophobicContact CE1-CD2 4.06Å; Q387-L415 HydrophobicContact CB-CD1 4.39Å; Q387-L415 HydrophobicContact CG-CD1 4.23Å; Q387-L415 HydrophobicContact CG-CG 4.49Å; L391-L415 HydrophobicContact CD1-CD1 4.12Å; A410-L415 CarbonylContact C-O 3.53Å; A410-L415 WeakPolarHBondContact CA-O 3.37Å; A410-L415 VanDerWaalsContact CB-O 3.29Å; A410-L415 WeakPolarHBondContact CB-O 3.36Å; A410-L415 PolarHBondContact O-N 2.79Å; L413-L415 VanDerWaalsContact C-N 3.32Å; L413-L415 HydrophobicContact CB-CD1 3.84Å; L413-L415 HydrophobicContact CB-CG 4.03Å; L413-L415 HydrophobicContact CD1-CD1 4.12Å; L413-L415 PolarHBondContact O-N 2.92Å; L415-T419 HydrophobicContact CD2-CG2 4.22Å; L415-V420 HydrophobicContact CB-CG2 3.96Å; L415-V420 HydrophobicContact CD1-CG2 4.18Å | ||
| 416 | E | 96.8 | Very high | 96.9 | Very high | 140 Ų | 140 | 57.5 Ų | 57.5 | 65% | 0.654 | 32% | 0.32 | S | S | * | . | trans | -68.1 | 143.6 | 168.9 | -63.7 | -175.4 | 130.4 | 0 | 0 | 111.5 | A418 T419 V420 | E416-A418 PolarHBondContact O-N 3.08Å; E416-T419 WeakPolarHBondContact O-CA 3.5Å; E416-T419 WeakPolarHBondContact O-CB 3.29Å; E416-T419 PolarHBondContact O-N 3.46Å; E416-V420 PolarHBondContact O-N 3Å; E416-V420 VanDerWaalsContact O-N 3.1Å | ||
| 417 | L | 96.8 | Very high | 96.8 | Very high | 52 Ų | 52 | 57.1 Ų | 57.1 | 27% | 0.272 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -52.7 | -39.2 | 174.1 | 178.1 | 64.4 | 0 | 0 | 0 | 112.4 | Q406 L407 A410 T419 V420 S421 | Q406-L417 HydrophobicContact CB-CD1 3.63Å; L407-L417 HydrophobicContact CD2-CB 4.42Å; L407-L417 HydrophobicContact CD2-CD1 4.22Å; L407-L417 HydrophobicContact CD2-CD2 3.84Å; L407-L417 HydrophobicContact CD2-CG 4.38Å; L407-L417 HydrophobicContact CG-CD1 3.99Å; L407-L417 HydrophobicContact CG-CD2 4.04Å; A410-L417 HydrophobicContact CB-CB 4.5Å; L417-T419 VanDerWaalsContact C-N 3.31Å; L417-T419 PolarHBondContact O-N 2.88Å; L417-V420 PolarHBondContact O-N 2.75Å; L417-S421 WeakPolarHBondContact O-CB 3.42Å; L417-S421 PolarHBondContact O-N 3.08Å |
| 418 | A | 96.9 | Very high | 96.5 | Very high | 56 Ų | 56 | 55.8 Ų | 55.8 | 46% | 0.463 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -61.6 | -39.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | E416 N422 | E416-A418 PolarHBondContact O-N 3.08Å; A418-N422 WeakPolarHBondContact O-CB 3.44Å; A418-N422 PolarHBondContact O-N 3.34Å; A418-N422 PolarHBondContact O-ND2 3.32Å |
| 419 | T | 97 | Very high | 96.1 | Very high | 24 Ų | 24 | 59.1 Ų | 59.1 | 15% | 0.147 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -66.6 | -42.4 | 177.6 | -69.5 | 0 | 0 | 0 | 0 | 111.4 | L381 F383 L415 E416 L417 N422 F423 | L381-T419 HydrophobicContact CD2-CG2 4Å; F383-T419 HydrophobicContact CE1-CG2 3.49Å; F383-T419 VanDerWaalsContact CE1-CG2 3.49Å; F383-T419 HydrophobicContact CZ-CG2 3.62Å; L415-T419 HydrophobicContact CD2-CG2 4.22Å; E416-T419 WeakPolarHBondContact O-CA 3.5Å; E416-T419 WeakPolarHBondContact O-CB 3.29Å; E416-T419 PolarHBondContact O-N 3.46Å; L417-T419 VanDerWaalsContact C-N 3.31Å; L417-T419 PolarHBondContact O-N 2.88Å; T419-N422 PolarHBondContact O-N 3.13Å; T419-F423 PolarHBondContact O-N 3.4Å |
| 420 | V | 97.5 | Very high | 95.7 | Very high | 0 Ų | 0 | 66.5 Ų | 66.5 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -65.4 | -47 | 175.4 | 177.8 | 0 | 0 | 0 | 0 | 111.5 | L391 Q406 I409 A410 L415 E416 L417 N422 F423 F424 | L391-V420 HydrophobicContact CD2-CG1 4.25Å; Q406-V420 HydrophobicContact CB-CG1 4.19Å; Q406-V420 HydrophobicContact CG-CG1 4.28Å; I409-V420 HydrophobicContact CB-CG1 4.18Å; I409-V420 HydrophobicContact CG2-CG1 3.79Å; I409-V420 HydrophobicContact CG2-CG2 4.26Å; A410-V420 HydrophobicContact CB-CG2 3.88Å; L415-V420 HydrophobicContact CB-CG2 3.96Å; L415-V420 HydrophobicContact CD1-CG2 4.18Å; E416-V420 PolarHBondContact O-N 3Å; E416-V420 VanDerWaalsContact O-N 3.1Å; L417-V420 PolarHBondContact O-N 2.75Å; V420-N422 VanDerWaalsContact C-N 3.33Å; V420-N422 PolarHBondContact O-N 2.87Å; V420-F423 WeakPolarHBondContact O-CB 3.21Å; V420-F423 PolarHBondContact O-N 3.28Å; V420-F423 VanDerWaalsContact O-N 3.13Å; V420-F424 HydrophobicContact CG1-CD2 3.79Å; V420-F424 HydrophobicContact CG1-CE2 3.6Å; V420-F424 VanDerWaalsContact O-CD2 3.26Å; V420-F424 WeakPolarHBondContact O-CD2 3.3Å; V420-F424 PolarHBondContact O-N 3.44Å |
| 421 | S | 97.3 | Very high | 95.1 | Very high | 40 Ų | 40 | 67.7 Ų | 67.7 | 28% | 0.28 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -58.1 | -44.7 | 175.4 | 180 | 0 | 0 | 0 | 0 | 112.1 | Q406 L417 F423 F424 M425 | Q406-S421 VanDerWaalsContact OE1-CA 3.25Å; Q406-S421 VanDerWaalsContact OE1-CB 3.24Å; L417-S421 WeakPolarHBondContact O-CB 3.42Å; L417-S421 PolarHBondContact O-N 3.08Å; S421-F423 VanDerWaalsContact C-N 3.35Å; S421-F423 PolarHBondContact O-N 2.91Å; S421-F424 PolarHBondContact O-N 3.18Å; S421-M425 WeakPolarHBondContact O-CB 3.35Å; S421-M425 PolarHBondContact O-N 3.1Å |
| 422 | N | 97 | Very high | 93.5 | Very high | 81 Ų | 81 | 64.7 Ų | 64.7 | 43% | 0.433 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -63.6 | -36.3 | 175.3 | -78.9 | -38 | 0 | 0 | 0 | 112.8 | A418 T419 V420 N426 | A418-N422 WeakPolarHBondContact O-CB 3.44Å; A418-N422 PolarHBondContact O-N 3.34Å; A418-N422 PolarHBondContact O-ND2 3.32Å; T419-N422 PolarHBondContact O-N 3.13Å; V420-N422 VanDerWaalsContact C-N 3.33Å; V420-N422 PolarHBondContact O-N 2.87Å; N422-N426 WeakPolarHBondContact O-CB 3.48Å; N422-N426 PolarHBondContact O-N 2.91Å; N422-N426 PolarHBondContact O-ND2 2.97Å |
| 423 | F | 97.3 | Very high | 91.7 | Very high | 24 Ų | 24 | 63.7 Ų | 63.7 | 11% | 0.105 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -59.3 | -56.6 | 171.7 | 173.5 | -88.3 | 0 | 0 | 0 | 110.4 | F383 L391 H392 F395 T419 V420 S421 M425 N426 A427 | F383-F423 HydrophobicContact CE2-CD2 4.12Å; F383-F423 HydrophobicContact CZ-CB 4.3Å; F383-F423 HydrophobicContact CZ-CD2 4.45Å; L391-F423 HydrophobicContact CB-CD1 3.9Å; L391-F423 HydrophobicContact CB-CD2 4.31Å; L391-F423 HydrophobicContact CB-CE1 3.61Å; L391-F423 HydrophobicContact CB-CE2 4.02Å; L391-F423 HydrophobicContact CB-CG 4.27Å; L391-F423 HydrophobicContact CB-CZ 3.68Å; L391-F423 HydrophobicContact CD1-CB 4.42Å; L391-F423 HydrophobicContact CD1-CD1 4.36Å; L391-F423 HydrophobicContact CD1-CD2 4.05Å; L391-F423 HydrophobicContact CD1-CE2 4.48Å; L391-F423 HydrophobicContact CD1-CG 4Å; L391-F423 HydrophobicContact CD2-CD1 4.04Å; L391-F423 HydrophobicContact CD2-CG 4.38Å; L391-F423 HydrophobicContact CG-CD1 4.33Å; L391-F423 HydrophobicContact CG-CG 4.46Å; L391-F423 WeakPolarHBondContact O-CE1 3.14Å; H392-F423 AromaticContact CE1-CE2 3.6Å; H392-F423 AromaticContact CE1-CZ 3.72Å; H392-F423 AromaticContact ND1-CE2 3.95Å; H392-F423 AromaticContact ND1-CZ 3.74Å; F395-F423 HydrophobicContact CB-CE1 4.24Å; T419-F423 PolarHBondContact O-N 3.4Å; V420-F423 WeakPolarHBondContact O-CB 3.21Å; V420-F423 PolarHBondContact O-N 3.28Å; V420-F423 VanDerWaalsContact O-N 3.13Å; S421-F423 VanDerWaalsContact C-N 3.35Å; S421-F423 PolarHBondContact O-N 2.91Å; F423-M425 VanDerWaalsContact C-N 3.3Å; F423-M425 PolarHBondContact O-N 2.93Å; F423-N426 PolarHBondContact O-N 3.46Å; F423-N426 VanDerWaalsContact O-N 3.08Å; F423-A427 HydrophobicContact CE1-CB 4.14Å; F423-A427 HydrophobicContact CZ-CB 4.37Å; F423-A427 WeakPolarHBondContact O-CB 3.44Å; F423-A427 PolarHBondContact O-N 2.91Å |
| 424 | F | 96.7 | Very high | 89.9 | Confident | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -63.5 | -35.2 | -177.3 | -76 | -71.4 | 0 | 0 | 0 | 112.7 | L391 I394 F395 P401 Q406 I409 V420 S421 R428 | L391-F424 HydrophobicContact CD2-CE2 4.01Å; L391-F424 HydrophobicContact CD2-CZ 4.25Å; I394-F424 HydrophobicContact CB-CZ 4.28Å; I394-F424 HydrophobicContact CG2-CE1 4.25Å; I394-F424 HydrophobicContact CG2-CZ 3.85Å; F395-F424 HydrophobicContact CB-CD1 4.28Å; F395-F424 HydrophobicContact CB-CE1 3.87Å; F395-F424 AromaticContact CD2-CD1 3.88Å; F395-F424 HydrophobicContact CD2-CD1 3.88Å; F395-F424 HydrophobicContact CD2-CE1 4.24Å; P401-F424 HydrophobicContact CG-CD1 3.77Å; P401-F424 HydrophobicContact CG-CD2 3.73Å; P401-F424 HydrophobicContact CG-CE1 3.81Å; P401-F424 HydrophobicContact CG-CE2 3.78Å; P401-F424 HydrophobicContact CG-CG 3.75Å; P401-F424 HydrophobicContact CG-CZ 3.83Å; Q406-F424 HydrophobicContact CG-CD2 4.33Å; I409-F424 HydrophobicContact CD1-CE2 4Å; I409-F424 HydrophobicContact CD1-CZ 4.06Å; V420-F424 HydrophobicContact CG1-CD2 3.79Å; V420-F424 HydrophobicContact CG1-CE2 3.6Å; V420-F424 VanDerWaalsContact O-CD2 3.26Å; V420-F424 WeakPolarHBondContact O-CD2 3.3Å; V420-F424 PolarHBondContact O-N 3.44Å; S421-F424 PolarHBondContact O-N 3.18Å; F424-R428 WeakPolarHBondContact O-CB 3.19Å; F424-R428 WeakPolarHBondContact O-CG 3.48Å; F424-R428 PolarHBondContact O-N 3.39Å; F424-R428 VanDerWaalsContact O-N 3.08Å; F424-R428 PolarHBondContact O-NH1 2.9Å |
| 425 | M | 94.6 | Very high | 88 | Confident | 98 Ų | 98 | 68.3 Ų | 68.3 | 48% | 0.483 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -61.4 | -46.6 | 171.9 | -169.6 | -167.2 | -58.5 | 0 | 0 | 111.8 | S421 F423 R429 | S421-M425 WeakPolarHBondContact O-CB 3.35Å; S421-M425 PolarHBondContact O-N 3.1Å; F423-M425 VanDerWaalsContact C-N 3.3Å; F423-M425 PolarHBondContact O-N 2.93Å; M425-R429 WeakPolarHBondContact O-CB 3.23Å; M425-R429 PolarHBondContact O-N 3.43Å |
| 426 | N | 94.3 | Very high | 86.1 | Confident | 48 Ų | 48 | 71.7 Ų | 71.7 | 26% | 0.257 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -72.6 | -35.2 | 179.4 | -80.5 | -73.9 | 0 | 0 | 0 | 113 | N422 F423 R429 R430 | N422-N426 WeakPolarHBondContact O-CB 3.48Å; N422-N426 PolarHBondContact O-N 2.91Å; N422-N426 PolarHBondContact O-ND2 2.97Å; F423-N426 PolarHBondContact O-N 3.46Å; F423-N426 VanDerWaalsContact O-N 3.08Å; N426-R429 WeakPolarHBondContact O-CB 3.42Å; N426-R429 PolarHBondContact O-N 2.86Å; N426-R429 VanDerWaalsContact O-N 3.14Å; N426-R429 PolarHBondContact OD1-NE 3.49Å; N426-R429 VanDerWaalsContact OD1-NE 3.16Å; N426-R429 PolarHBondContact OD1-NH2 3.38Å; N426-R430 WeakPolarHBondContact O-CB 3.36Å; N426-R430 WeakPolarHBondContact O-CG 3.43Å; N426-R430 PolarHBondContact O-N 3.44Å |
| 427 | A | 94.5 | Very high | 83.6 | Confident | 14 Ų | 14 | 71.9 Ų | 71.9 | 12% | 0.116 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -61 | -50.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | F395 F423 R429 R430 S431 | F395-A427 HydrophobicContact CD1-CB 3.84Å; F395-A427 HydrophobicContact CD2-CB 3.89Å; F395-A427 HydrophobicContact CE1-CB 3.74Å; F395-A427 HydrophobicContact CE2-CB 3.79Å; F395-A427 HydrophobicContact CG-CB 3.91Å; F395-A427 HydrophobicContact CZ-CB 3.71Å; F423-A427 HydrophobicContact CE1-CB 4.14Å; F423-A427 HydrophobicContact CZ-CB 4.37Å; F423-A427 WeakPolarHBondContact O-CB 3.44Å; F423-A427 PolarHBondContact O-N 2.91Å; A427-R429 PolarHBondContact O-N 3.08Å; A427-R430 PolarHBondContact O-N 3.32Å; A427-R430 VanDerWaalsContact O-N 3.12Å; A427-S431 PolarHBondContact O-N 3.21Å |
| 428 | R | 92.9 | Very high | 81.1 | Confident | 61 Ų | 61 | 76 Ų | 76 | 23% | 0.23 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -61 | -22.7 | 172.1 | -74.3 | -168.1 | -63 | -85.4 | -0.6 | 114.8 | F395 K399 F424 S431 K434 | F395-R428 HydrophobicContact CE2-CG 3.77Å; F395-R428 HydrophobicContact CZ-CG 4.28Å; K399-R428 VanDerWaalsContact O-CD 3.23Å; K399-R428 WeakPolarHBondContact O-CD 3.45Å; K399-R428 WeakPolarHBondContact O-CG 3.3Å; K399-R428 PolarHBondContact O-NH1 2.84Å; F424-R428 WeakPolarHBondContact O-CB 3.19Å; F424-R428 WeakPolarHBondContact O-CG 3.48Å; F424-R428 PolarHBondContact O-N 3.39Å; F424-R428 VanDerWaalsContact O-N 3.08Å; F424-R428 PolarHBondContact O-NH1 2.9Å; R428-S431 PolarHBondContact O-OG 3.18Å; R428-K434 PolarHBondContact O-NZ 2.94Å |
| 429 | R | 89.5 | Confident | 78.5 | Confident | 149 Ų | 149 | 76.9 Ų | 76.9 | 56% | 0.562 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -85.5 | -26.9 | 177.9 | -173.5 | -178 | 63 | 77.9 | -6.9 | 112 | M425 N426 A427 | M425-R429 WeakPolarHBondContact O-CB 3.23Å; M425-R429 PolarHBondContact O-N 3.43Å; N426-R429 WeakPolarHBondContact O-CB 3.42Å; N426-R429 PolarHBondContact O-N 2.86Å; N426-R429 VanDerWaalsContact O-N 3.14Å; N426-R429 PolarHBondContact OD1-NE 3.49Å; N426-R429 VanDerWaalsContact OD1-NE 3.16Å; N426-R429 PolarHBondContact OD1-NH2 3.38Å; A427-R429 PolarHBondContact O-N 3.08Å |
| 430 | R | 88.8 | Confident | 75.6 | Confident | 164 Ų | 164 | 79.2 Ų | 79.2 | 62% | 0.619 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -101.5 | -15.5 | -176.5 | -70.8 | 174.1 | 170.6 | 166.9 | -3 | 114.1 | N426 A427 L432 | N426-R430 WeakPolarHBondContact O-CB 3.36Å; N426-R430 WeakPolarHBondContact O-CG 3.43Å; N426-R430 PolarHBondContact O-N 3.44Å; A427-R430 PolarHBondContact O-N 3.32Å; A427-R430 VanDerWaalsContact O-N 3.12Å; R430-L432 PolarHBondContact O-N 2.94Å; R430-L432 VanDerWaalsContact O-N 3.07Å |
| 431 | S | 84.8 | Confident | 72.7 | Confident | 31 Ų | 31 | 83.1 Ų | 83.1 | 22% | 0.217 | 46% | 0.455 | C | S | . | . | trans | -56.4 | 110.2 | 176.3 | 56.7 | 0 | 0 | 0 | 0 | 111.1 | A427 R428 D433 | A427-S431 PolarHBondContact O-N 3.21Å; R428-S431 PolarHBondContact O-OG 3.18Å; S431-D433 VanDerWaalsContact C-N 3.32Å; S431-D433 PolarHBondContact O-N 3.38Å | ||
| 432 | L | 62.8 | Low | 69.8 | Low | 105 Ų | 105 | 89.5 Ų | 89.5 | 55% | 0.55 | 48% | 0.48 | S | S | . | . | G | 310 helix | trans | -66.2 | -34.4 | -171.2 | -159.5 | 74.3 | 0 | 0 | 0 | 113.2 | N323 R430 K434 W435 | N323-L432 WeakPolarHBondContact OD1-CD1 3.29Å; R430-L432 PolarHBondContact O-N 2.94Å; R430-L432 VanDerWaalsContact O-N 3.07Å; L432-K434 PolarHBondContact O-N 3.4Å; L432-W435 PolarHBondContact O-N 2.96Å; L432-W435 VanDerWaalsContact O-N 3.13Å |
| 433 | D | 60.3 | Low | 66.8 | Low | 139 Ų | 139 | 90.1 Ų | 90.1 | 74% | 0.743 | 50% | 0.496 | S | S | * | . | G | 310 helix | trans | -32.1 | -41.1 | 172.4 | -168.7 | -112.7 | 0 | 0 | 0 | 114.8 | S431 W435 | S431-D433 VanDerWaalsContact C-N 3.32Å; S431-D433 PolarHBondContact O-N 3.38Å; D433-W435 PolarHBondContact O-N 2.95Å |
| 434 | K | 58.3 | Low | 64.3 | Low | 111 Ų | 111 | 94.2 Ų | 94.2 | 48% | 0.483 | 53% | 0.525 | S | S | . | . | G | 310 helix | trans | -59.9 | -15.8 | -177.4 | -75.2 | -176.1 | 168.6 | 179.1 | 0 | 116.9 | R428 L432 | R428-K434 PolarHBondContact O-NZ 2.94Å; L432-K434 PolarHBondContact O-N 3.4Å |
| 435 | W | 57.4 | Low | 61.3 | Low | 78 Ų | 78 | 101.8 Ų | 101.8 | 30% | 0.295 | 57% | 0.566 | S | S | . | * | G | 310 helix | trans | -131.2 | 12.7 | -170.1 | -44.2 | 119.2 | 0 | 0 | 0 | 114.2 | P326 K329 L432 D433 | P326-W435 HydrophobicContact CG-CB 4.14Å; P326-W435 HydrophobicContact CG-CD2 3.97Å; P326-W435 HydrophobicContact CG-CE3 3.93Å; P326-W435 HydrophobicContact CG-CG 4.1Å; K329-W435 HydrophobicContact CB-CE3 4.35Å; K329-W435 HydrophobicContact CB-CH2 3.81Å; K329-W435 HydrophobicContact CB-CZ2 4.46Å; K329-W435 HydrophobicContact CB-CZ3 3.78Å; K329-W435 HydrophobicContact CD-CE3 4.31Å; K329-W435 HydrophobicContact CD-CH2 4.09Å; K329-W435 HydrophobicContact CD-CZ3 3.48Å; K329-W435 VanDerWaalsContact CD-CZ3 3.48Å; K329-W435 HydrophobicContact CG-CE3 3.81Å; K329-W435 HydrophobicContact CG-CH2 3.9Å; K329-W435 HydrophobicContact CG-CZ3 3.33Å; L432-W435 PolarHBondContact O-N 2.96Å; L432-W435 VanDerWaalsContact O-N 3.13Å; D433-W435 PolarHBondContact O-N 2.95Å |
| 436 | V | 55.8 | Low | 58.7 | Low | 91 Ų | 91 | 102.1 Ų | 102.1 | 55% | 0.552 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.1 | -36.3 | 177.9 | -179 | 0 | 0 | 0 | 0 | 111.2 | D438 | V436-D438 PolarHBondContact O-N 2.98Š|
| 437 | D | 45 | Very low | 55.9 | Low | 143 Ų | 143 | 102.2 Ų | 102.2 | 77% | 0.765 | 59% | 0.59 | S | S | * | * | G | 310 helix | trans | -57.5 | -37.7 | -173.5 | -164.4 | -125.5 | 0 | 0 | 0 | 115.1 | G439 | D437-G439 PolarHBondContact O-N 2.96Š|
| 438 | D | 44 | Very low | 53.7 | Low | 140 Ų | 140 | 107.6 Ų | 107.6 | 75% | 0.749 | 62% | 0.624 | S | S | * | * | G | 310 helix | trans | -72.1 | 2.3 | -170.6 | -149.6 | -132.4 | 0 | 0 | 0 | 114.6 | V436 | V436-D438 PolarHBondContact O-N 2.98Š|
| 439 | G | 42.2 | Very low | 51.1 | Low | 73 Ų | 73 | 112.6 Ų | 112.6 | 75% | 0.753 | 66% | 0.655 | S | S | * | * | G | 310 helix | trans | -138.3 | 6.1 | -169.6 | 0 | 0 | 0 | 0 | 0 | 116.5 | D437 | D437-G439 PolarHBondContact O-N 2.96Š|
| 440 | S | 35.9 | Very low | 48.8 | Very low | 73 Ų | 73 | 111.1 Ų | 111.1 | 51% | 0.51 | 66% | 0.662 | S | S | . | * | trans | -136.9 | 88.1 | -178.6 | 50.1 | 0 | 0 | 0 | 0 | 111.4 | H442 | S440-H442 PolarHBondContact O-N 3.45Š| ||
| 441 | G | 37.2 | Very low | 46.3 | Very low | 83 Ų | 83 | 109.2 Ų | 109.2 | 86% | 0.856 | 67% | 0.673 | S | S | * | * | trans | -68.3 | 70.2 | 167 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 442 | H | 36.1 | Very low | 44.4 | Very low | 174 Ų | 174 | 113.8 Ų | 113.8 | 81% | 0.806 | 70% | 0.699 | S | S | * | * | trans | -141.5 | 100.8 | 165.8 | -112.6 | 54.8 | 0 | 0 | 0 | 108.6 | S440 P444 | S440-H442 PolarHBondContact O-N 3.45Å; H442-P444 WeakPolarHBondContact O-CD 3.49Å | ||
| 443 | A | 34.3 | Very low | 43.4 | Very low | 93 Ų | 93 | 118.2 Ų | 118.2 | 77% | 0.769 | 71% | 0.714 | S | S | * | * | trans | -63.6 | 125 | 170 | 0 | 0 | 0 | 0 | 0 | 108.9 | N445 | A443-N445 PolarHBondContact O-N 2.92Š| ||
| 444 | P | 44.8 | Very low | 42.3 | Very low | 110 Ų | 110 | 119.5 Ų | 119.5 | 71% | 0.714 | 74% | 0.744 | S | S | * | * | trans | -69.7 | 105.5 | 166.9 | 28.5 | -30.9 | 0 | 0 | 0 | 107.8 | H442 S446 | H442-P444 WeakPolarHBondContact O-CD 3.49Å; P444-S446 PolarHBondContact O-N 3.29Å; P444-S446 PolarHBondContact O-OG 2.88Å; P444-S446 VanDerWaalsContact O-OG 3.1Å | ||
| 445 | N | 34.8 | Very low | 41.5 | Very low | 159 Ų | 159 | 119.9 Ų | 119.9 | 85% | 0.85 | 76% | 0.757 | S | S | * | * | trans | -55.8 | 98.5 | 175.5 | -175 | 14.7 | 0 | 0 | 0 | 109.6 | A443 G447 | A443-N445 PolarHBondContact O-N 2.92Å; N445-G447 PolarHBondContact O-N 3.29Å | ||
| 446 | S | 38.9 | Very low | 40.7 | Very low | 105 Ų | 105 | 122.1 Ų | 122.1 | 73% | 0.734 | 78% | 0.781 | S | S | * | * | trans | -90.4 | 99.6 | -178.5 | -61.5 | 0 | 0 | 0 | 0 | 107.5 | P444 | P444-S446 PolarHBondContact O-N 3.29Å; P444-S446 PolarHBondContact O-OG 2.88Å; P444-S446 VanDerWaalsContact O-OG 3.1Å | ||
| 447 | G | 35.6 | Very low | 39.8 | Very low | 50 Ų | 50 | 123.8 Ų | 123.8 | 52% | 0.515 | 79% | 0.794 | S | S | . | * | trans | -58.7 | 154.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | N445 N449 | N445-G447 PolarHBondContact O-N 3.29Å; G447-N449 PolarHBondContact O-N 3.1Å | ||
| 448 | P | 47.8 | Very low | 39.5 | Very low | 127 Ų | 127 | 122.7 Ų | 122.7 | 83% | 0.825 | 80% | 0.796 | S | S | * | * | trans | -69.7 | 115.6 | -175.8 | 28.1 | -34 | 0 | 0 | 0 | 111.2 | V450 | P448-V450 PolarHBondContact O-N 3.15Å; P448-V450 VanDerWaalsContact O-N 3.08Å | ||
| 449 | N | 38.2 | Very low | 39.3 | Very low | 166 Ų | 166 | 121.6 Ų | 121.6 | 89% | 0.888 | 80% | 0.799 | S | S | * | * | trans | -68.9 | 102.7 | 166.3 | -80 | -37 | 0 | 0 | 0 | 109.4 | G447 C451 | G447-N449 PolarHBondContact O-N 3.1Å; N449-C451 PolarHBondContact O-N 2.81Å | ||
| 450 | V | 42.9 | Very low | 39.1 | Very low | 119 Ų | 119 | 124.9 Ų | 124.9 | 72% | 0.721 | 80% | 0.802 | S | S | * | * | trans | -63.9 | 120.3 | 164.6 | 154.3 | 0 | 0 | 0 | 0 | 108.9 | P448 T452 | P448-V450 PolarHBondContact O-N 3.15Å; P448-V450 VanDerWaalsContact O-N 3.08Å; V450-T452 HydrophobicContact CG1-CG2 3.93Å; V450-T452 PolarHBondContact O-N 3.33Å | ||
| 451 | C | 36.3 | Very low | 39.3 | Very low | 124 Ų | 124 | 128.6 Ų | 128.6 | 84% | 0.838 | 82% | 0.823 | S | S | * | * | trans | -88.1 | 90.9 | 171.4 | -173.8 | 0 | 0 | 0 | 0 | 109.1 | N449 K453 | N449-C451 PolarHBondContact O-N 2.81Å; C451-K453 PolarHBondContact O-N 3.36Å | ||
| 452 | T | 44 | Very low | 39.4 | Very low | 126 Ų | 126 | 132.1 Ų | 132.1 | 77% | 0.773 | 82% | 0.82 | S | S | * | * | trans | -77.5 | 104.8 | 167.3 | 37.2 | 0 | 0 | 0 | 0 | 109.9 | V450 | V450-T452 HydrophobicContact CG1-CG2 3.93Å; V450-T452 PolarHBondContact O-N 3.33Å | ||
| 453 | K | 40.9 | Very low | 39.7 | Very low | 199 Ų | 199 | 128.6 Ų | 128.6 | 87% | 0.865 | 82% | 0.821 | S | S | * | * | trans | -74.8 | 129 | 161.6 | 178.3 | 178.7 | 177.7 | 176.2 | 0 | 109.1 | C451 | C451-K453 PolarHBondContact O-N 3.36Š| ||
| 454 | A | 38.2 | Very low | 40.2 | Very low | 165 Ų | 165 | 131.8 Ų | 131.8 | 100% | 1.364 | 83% | 0.826 | S | S | * | * | trans | -130.9 | 0 | 161.1 | 0 | 0 | 0 | 0 | 0 | 107 |
Retrieved 454 of 454 residues in 93.2 ms
(Link to these results)