| 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 | 45.6 | Very low | 44.2 | Very low | 240 Ų | 240 | 153.7 Ų | 153.7 | 100% | 1.182 | 81% | 0.808 | S | S | * | * | 0 | 105.3 | 0 | -76.8 | 179.8 | 177.1 | 0 | 0 | 107.1 | |||||
| 2 | D | 40.3 | Very low | 44.5 | Very low | 149 Ų | 149 | 153.5 Ų | 153.5 | 80% | 0.797 | 82% | 0.817 | S | S | * | * | trans | -54.3 | 167.6 | 154.9 | -44.3 | -103.8 | 0 | 0 | 0 | 109.4 | ||||
| 3 | V | 40.8 | Very low | 45.2 | Very low | 116 Ų | 116 | 156.7 Ų | 156.7 | 70% | 0.703 | 82% | 0.819 | S | S | * | * | cis | -148.5 | 176 | 19.7 | -143.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 4 | D | 45.1 | Very low | 45 | Very low | 125 Ų | 125 | 152.6 Ų | 152.6 | 67% | 0.668 | 82% | 0.82 | S | S | * | * | trans | 58.5 | 112.9 | 148.6 | -65.1 | -42.3 | 0 | 0 | 0 | 120.6 | ||||
| 5 | K | 58.9 | Low | 44.6 | Very low | 217 Ų | 217 | 147.7 Ų | 147.7 | 94% | 0.943 | 82% | 0.819 | S | S | * | * | -144.8 | 135.6 | 115 | -126.4 | 172.8 | -174.7 | 177.9 | 0 | 112.9 | |||||
| 6 | V | 42.1 | Very low | 44.9 | Very low | 113 Ų | 113 | 144.6 Ų | 144.6 | 69% | 0.685 | 82% | 0.819 | S | S | * | * | trans | -111.7 | 130.8 | -164.6 | 167.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 7 | L | 40.3 | Very low | 45.5 | Very low | 133 Ų | 133 | 143.9 Ų | 143.9 | 70% | 0.696 | 82% | 0.821 | S | S | * | * | trans | 36.1 | 111 | 145.4 | -160.5 | 90.4 | 0 | 0 | 0 | 120.2 | M9 | L7-M9 HydrophobicContact CD2-CG 3.88Å; L7-M9 HydrophobicContact CD2-SD 4.1Å; L7-M9 HydrophobicContact CG-CG 3.98Å | ||
| 8 | V | 47.8 | Very low | 45.2 | Very low | 139 Ų | 139 | 140.4 Ų | 140.4 | 84% | 0.842 | 82% | 0.822 | S | S | * | * | trans | -141.3 | 103 | 141.9 | -177.7 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 9 | M | 41 | Very low | 45.1 | Very low | 140 Ų | 140 | 143.9 Ų | 143.9 | 69% | 0.69 | 83% | 0.826 | S | S | * | * | 56.4 | 83.8 | 73.4 | -68.2 | -160.9 | 74.4 | 0 | 0 | 114.9 | L7 | L7-M9 HydrophobicContact CD2-CG 3.88Å; L7-M9 HydrophobicContact CD2-SD 4.1Å; L7-M9 HydrophobicContact CG-CG 3.98Å | |||
| 10 | E | 45 | Very low | 45.3 | Very low | 192 Ų | 192 | 142.1 Ų | 142.1 | 90% | 0.897 | 82% | 0.82 | S | S | * | * | trans | -131.8 | 140.2 | 148.8 | -114.4 | -172.3 | 118.6 | 0 | 0 | 110.4 | ||||
| 11 | T | 39.4 | Very low | 44.8 | Very low | 127 Ų | 127 | 142.6 Ų | 142.6 | 78% | 0.779 | 82% | 0.815 | S | S | * | * | trans | -126.9 | 106.2 | -171 | 44.4 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 12 | V | 47.5 | Very low | 44.2 | Very low | 151 Ų | 151 | 137.8 Ų | 137.8 | 92% | 0.915 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 140.3 | 173 | -174.4 | 0 | 0 | 0 | 0 | 109.7 | ||
| 13 | K | 54.2 | Low | 44 | Very low | 195 Ų | 195 | 140.9 Ų | 140.9 | 85% | 0.848 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -100.7 | 127.3 | -155.4 | -178.1 | 179.3 | 176.8 | -178 | 0 | 112.3 | ||
| 14 | A | 42.1 | Very low | 44.2 | Very low | 100 Ų | 100 | 143.6 Ų | 143.6 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 145.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112 | ||
| 15 | G | 38.7 | Very low | 43.8 | Very low | 79 Ų | 79 | 141.3 Ų | 141.3 | 81% | 0.814 | 81% | 0.808 | S | S | * | * | trans | -146.8 | 122.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 16 | A | 50.3 | Low | 43.1 | Very low | 98 Ų | 98 | 136.8 Ų | 136.8 | 81% | 0.81 | 80% | 0.803 | S | S | * | * | trans | -162.6 | 168.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 17 | P | 53.8 | Low | 42.9 | Very low | 132 Ų | 132 | 140.2 Ų | 140.2 | 86% | 0.857 | 81% | 0.812 | S | S | * | * | cis | -117.2 | 160.4 | -40.9 | 36 | -25.5 | 0 | 0 | 0 | 111.3 | ||||
| 18 | G | 40.4 | Very low | 43 | Very low | 82 Ų | 82 | 142.1 Ų | 142.1 | 85% | 0.845 | 82% | 0.817 | S | S | * | * | trans | -121.7 | 111.2 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 19 | K | 44.2 | Very low | 42.6 | Very low | 206 Ų | 206 | 143.3 Ų | 143.3 | 90% | 0.896 | 81% | 0.814 | S | S | * | * | trans | -151.9 | 146.6 | 158.6 | -122 | -177.9 | -179.5 | 178.6 | 0 | 106.6 | ||||
| 20 | P | 48.9 | Very low | 42.4 | Very low | 108 Ų | 108 | 141.4 Ų | 141.4 | 70% | 0.701 | 81% | 0.81 | S | S | * | * | -147.7 | -179.8 | 70.5 | 40.2 | -21.8 | 0 | 0 | 0 | 116.6 | |||||
| 21 | E | 34.1 | Very low | 42.1 | Very low | 153 Ų | 153 | 138.4 Ų | 138.4 | 72% | 0.715 | 80% | 0.8 | S | S | * | * | trans | 79 | 136.1 | 143.4 | -105.9 | 179.3 | 79.4 | 0 | 0 | 124.3 | ||||
| 22 | M | 33.8 | Very low | 41.9 | Very low | 138 Ų | 138 | 141.2 Ų | 141.2 | 68% | 0.68 | 80% | 0.804 | S | S | * | * | trans | 64.6 | 152.4 | 160.4 | -67 | -154.1 | -103.3 | 0 | 0 | 117.9 | ||||
| 23 | R | 36.3 | Very low | 41.3 | Very low | 214 Ų | 214 | 137.8 Ų | 137.8 | 81% | 0.808 | 80% | 0.799 | S | S | * | * | cis | -144.3 | 154.6 | 15.5 | -150.9 | 177.7 | -166.6 | 93.5 | -2.8 | 111.8 | ||||
| 24 | L | 43.6 | Very low | 40.5 | Very low | 173 Ų | 173 | 136.6 Ų | 136.6 | 91% | 0.906 | 80% | 0.802 | S | S | * | * | trans | -70.3 | 148.7 | 163.4 | -78.8 | 161.6 | 0 | 0 | 0 | 110.6 | ||||
| 25 | G | 36.8 | Very low | 40.4 | Very low | 78 Ų | 78 | 136.1 Ų | 136.1 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -157 | 95.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 26 | S | 45.1 | Very low | 40.7 | Very low | 122 Ų | 122 | 140 Ų | 140 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | trans | -82.9 | 140.1 | 164.3 | -55.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 27 | Q | 38.5 | Very low | 40.1 | Very low | 185 Ų | 185 | 143.7 Ų | 143.7 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | trans | -146.2 | 143.7 | 158.1 | -151.2 | 163.1 | -24.2 | 0 | 0 | 111.6 | ||||
| 28 | E | 41.3 | Very low | 39.7 | Very low | 173 Ų | 173 | 143.2 Ų | 143.2 | 81% | 0.808 | 80% | 0.801 | S | S | * | * | trans | -100.3 | -158.6 | -177.3 | -157 | 172.5 | 114.7 | 0 | 0 | 109.3 | ||||
| 29 | E | 40.6 | Very low | 39.7 | Very low | 164 Ų | 164 | 144 Ų | 144 | 77% | 0.766 | 79% | 0.793 | S | S | * | * | trans | 81.8 | 100.6 | -174.8 | -50.9 | -167.1 | 135.1 | 0 | 0 | 113.7 | ||||
| 30 | T | 36.6 | Very low | 39.5 | Very low | 100 Ų | 100 | 141.7 Ų | 141.7 | 61% | 0.613 | 79% | 0.79 | S | S | * | * | cis | 76.9 | 110.8 | 45.4 | 76.9 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 31 | N | 37.3 | Very low | 39.2 | Very low | 129 Ų | 129 | 144.9 Ų | 144.9 | 69% | 0.69 | 80% | 0.796 | S | S | * | * | 171.2 | 127.5 | 124.1 | -79.9 | -4.7 | 0 | 0 | 0 | 109.5 | |||||
| 32 | E | 36.8 | Very low | 39.5 | Very low | 185 Ų | 185 | 143.9 Ų | 143.9 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | 55.9 | 127.1 | 104.7 | -55.5 | -175.3 | 116.4 | 0 | 0 | 115 | |||||
| 33 | G | 34.8 | Very low | 39.7 | Very low | 79 Ų | 79 | 144.1 Ų | 144.1 | 81% | 0.814 | 80% | 0.803 | S | S | * | * | cis | -144 | -165.5 | -6.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 34 | D | 36.1 | Very low | 40.1 | Very low | 171 Ų | 171 | 139.4 Ų | 139.4 | 91% | 0.914 | 80% | 0.803 | S | S | * | * | cis | -149.5 | -172.3 | 19.7 | -152.8 | -67.1 | 0 | 0 | 0 | 109.7 | ||||
| 35 | A | 40.7 | Very low | 39.9 | Very low | 90 Ų | 90 | 136 Ų | 136 | 74% | 0.744 | 79% | 0.793 | S | S | * | * | trans | -88.5 | 149.7 | -160.9 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 36 | N | 44.5 | Very low | 40.3 | Very low | 161 Ų | 161 | 140.1 Ų | 140.1 | 86% | 0.861 | 80% | 0.797 | S | S | * | * | -137 | 157.3 | 129.3 | 71.9 | -8.8 | 0 | 0 | 0 | 111.5 | |||||
| 37 | E | 38.3 | Very low | 40 | Very low | 174 Ų | 174 | 140.5 Ų | 140.5 | 81% | 0.813 | 79% | 0.794 | S | S | * | * | trans | -100.8 | 134 | -168.9 | -173.8 | -158.2 | 143 | 0 | 0 | 111.8 | ||||
| 38 | S | 44.4 | Very low | 40.2 | Very low | 122 Ų | 122 | 137 Ų | 137 | 85% | 0.853 | 79% | 0.787 | S | S | * | * | trans | -154.6 | 138 | 140.7 | -165.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 39 | S | 40.8 | Very low | 40.1 | Very low | 99 Ų | 99 | 136.9 Ų | 136.9 | 69% | 0.692 | 79% | 0.791 | S | S | * | * | trans | -87.4 | 148 | -165 | -76.8 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 40 | L | 39.6 | Very low | 40 | Very low | 158 Ų | 158 | 137 Ų | 137 | 83% | 0.827 | 80% | 0.796 | S | S | * | * | trans | -48.7 | 144.6 | 169.3 | -56.2 | 166.3 | 0 | 0 | 0 | 112.6 | ||||
| 41 | Q | 44.2 | Very low | 40.1 | Very low | 175 Ų | 175 | 136.3 Ų | 136.3 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | -142.7 | 123.4 | 120.7 | -69 | -157.6 | 17.4 | 0 | 0 | 110.3 | |||||
| 42 | V | 39.3 | Very low | 40 | Very low | 131 Ų | 131 | 137.7 Ų | 137.7 | 79% | 0.794 | 81% | 0.807 | S | S | * | * | trans | -101.7 | 122.5 | 164.4 | 172.7 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 43 | L | 38.9 | Very low | 40.1 | Very low | 144 Ų | 144 | 137 Ų | 137 | 75% | 0.754 | 80% | 0.804 | S | S | * | * | trans | -127.7 | 120 | 168.1 | -74 | 177.6 | 0 | 0 | 0 | 109.9 | ||||
| 44 | S | 43.1 | Very low | 40.3 | Very low | 115 Ų | 115 | 142.5 Ų | 142.5 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -90.3 | 130.5 | 168 | 175.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 45 | S | 40.4 | Very low | 40.3 | Very low | 101 Ų | 101 | 141.7 Ų | 141.7 | 71% | 0.706 | 80% | 0.8 | S | S | * | * | trans | -156.1 | 117.9 | 169 | 57.3 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 46 | N | 45.5 | Very low | 39.9 | Very low | 164 Ų | 164 | 144.6 Ų | 144.6 | 88% | 0.877 | 80% | 0.804 | S | S | * | * | trans | -60.7 | 134.4 | 170.2 | -70 | -27 | 0 | 0 | 0 | 111.5 | ||||
| 47 | V | 37.6 | Very low | 39.7 | Very low | 131 Ų | 131 | 142.3 Ų | 142.3 | 79% | 0.794 | 80% | 0.796 | S | S | * | * | trans | -138 | 138.3 | 158.4 | 179 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 48 | P | 43.2 | Very low | 39.8 | Very low | 110 Ų | 110 | 140.9 Ų | 140.9 | 71% | 0.714 | 80% | 0.798 | S | S | * | * | trans | -96.5 | 165.8 | -146.2 | 37 | -38.2 | 0 | 0 | 0 | 116.1 | L50 | P48-L50 PolarHBondContact O-N 3.5Š| ||
| 49 | L | 40 | Very low | 39.6 | Very low | 171 Ų | 171 | 143.6 Ų | 143.6 | 90% | 0.895 | 80% | 0.798 | S | S | * | * | trans | -54.9 | 130.3 | 154.9 | -76.9 | 162.8 | 0 | 0 | 0 | 110.2 | ||||
| 50 | L | 38.8 | Very low | 39.7 | Very low | 167 Ų | 167 | 143.7 Ų | 143.7 | 87% | 0.874 | 80% | 0.804 | S | S | * | * | trans | -98.2 | 107.6 | 156.7 | -81.5 | 172.4 | 0 | 0 | 0 | 108.3 | P48 | P48-L50 PolarHBondContact O-N 3.5Š| ||
| 51 | A | 37.4 | Very low | 39.8 | Very low | 86 Ų | 86 | 145.3 Ų | 145.3 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | trans | -67.2 | 143.6 | 158.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 52 | L | 35.9 | Very low | 39.7 | Very low | 157 Ų | 157 | 145.3 Ų | 145.3 | 82% | 0.822 | 81% | 0.805 | S | S | * | * | trans | -122.9 | 77.5 | 173.5 | -147.4 | 171.2 | 0 | 0 | 0 | 107.9 | F54 | L52-F54 HydrophobicContact CD2-CD2 4.13Š| ||
| 53 | E | 39.1 | Very low | 39.7 | Very low | 172 Ų | 172 | 148.1 Ų | 148.1 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -72.9 | 128.4 | 171.5 | -64.7 | -171.1 | 151.5 | 0 | 0 | 109.8 | ||||
| 54 | F | 37.9 | Very low | 39.8 | Very low | 194 Ų | 194 | 145.4 Ų | 145.4 | 85% | 0.851 | 80% | 0.804 | S | S | * | * | trans | -142.6 | 97.8 | 150 | -99.6 | -74.4 | 0 | 0 | 0 | 109.2 | L52 | L52-F54 HydrophobicContact CD2-CD2 4.13Š| ||
| 55 | L | 36.5 | Very low | 39.5 | Very low | 153 Ų | 153 | 149.6 Ų | 149.6 | 80% | 0.801 | 81% | 0.808 | S | S | * | * | trans | -65.3 | 139 | 146.1 | -74.3 | 159.7 | 0 | 0 | 0 | 107.5 | ||||
| 56 | D | 33.1 | Very low | 39.5 | Very low | 151 Ų | 151 | 151.6 Ų | 151.6 | 81% | 0.807 | 81% | 0.811 | S | S | * | * | -156.6 | 165.6 | 103 | -137.9 | -27.6 | 0 | 0 | 0 | 113.2 | |||||
| 57 | T | 39.7 | Very low | 39.2 | Very low | 114 Ų | 114 | 149 Ų | 149 | 70% | 0.699 | 80% | 0.803 | S | S | * | * | trans | -93.4 | 135.9 | -174.9 | -54.8 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 58 | V | 40.4 | Very low | 39 | Very low | 143 Ų | 143 | 151.5 Ų | 151.5 | 87% | 0.867 | 81% | 0.808 | S | S | * | * | trans | -128.9 | 144.9 | 161.9 | -156.6 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 59 | Q | 40.5 | Very low | 39 | Very low | 179 Ų | 179 | 152.7 Ų | 152.7 | 84% | 0.836 | 81% | 0.813 | S | S | * | * | trans | -79.5 | 156.5 | -158 | -62.9 | 174.9 | -2.3 | 0 | 0 | 114.6 | ||||
| 60 | A | 43.4 | Very low | 38.9 | Very low | 101 Ų | 101 | 148.8 Ų | 148.8 | 84% | 0.835 | 80% | 0.8 | S | S | * | * | trans | -55.5 | 142.5 | 161.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 61 | K | 40.4 | Very low | 38.9 | Very low | 192 Ų | 192 | 149.7 Ų | 149.7 | 84% | 0.835 | 80% | 0.799 | S | S | * | * | trans | -136.7 | 92.2 | 156.6 | -166.7 | 154.9 | -168 | 162.3 | 0 | 111.3 | ||||
| 62 | E | 42.1 | Very low | 38.9 | Very low | 175 Ų | 175 | 152.1 Ų | 152.1 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | -48.8 | 135.6 | 164.1 | -173.7 | -168 | 125.1 | 0 | 0 | 110.8 | ||||
| 63 | K | 40.6 | Very low | 38.8 | Very low | 191 Ų | 191 | 154.3 Ų | 154.3 | 83% | 0.83 | 81% | 0.809 | S | S | * | * | trans | -147.1 | 106.4 | 163 | -125.7 | -174.1 | 179 | -170.9 | 0 | 109 | ||||
| 64 | A | 41 | Very low | 38.8 | Very low | 86 Ų | 86 | 154 Ų | 154 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | trans | -60.1 | 139.3 | 178 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 65 | F | 36.1 | Very low | 39.1 | Very low | 203 Ų | 203 | 152.3 Ų | 152.3 | 89% | 0.89 | 80% | 0.804 | S | S | * | * | trans | -118.1 | 116.8 | 165.1 | -154.3 | -88.2 | 0 | 0 | 0 | 107.7 | ||||
| 66 | L | 39.3 | Very low | 39.4 | Very low | 143 Ų | 143 | 150.5 Ų | 150.5 | 75% | 0.749 | 80% | 0.801 | S | S | * | * | trans | -80.1 | 147 | -175.7 | -72.3 | 170 | 0 | 0 | 0 | 111.3 | M68 | L66-M68 PolarHBondContact O-N 3.35Š| ||
| 67 | P | 41.1 | Very low | 39.5 | Very low | 111 Ų | 111 | 149.3 Ų | 149.3 | 72% | 0.721 | 80% | 0.799 | S | S | * | * | trans | -75.7 | 120.8 | 178.6 | 30.5 | -33.9 | 0 | 0 | 0 | 111.3 | V69 | P67-V69 HydrophobicContact CB-CG2 4.5Å; P67-V69 PolarHBondContact O-N 2.7Å | ||
| 68 | M | 32.8 | Very low | 39.4 | Very low | 182 Ų | 182 | 152.7 Ų | 152.7 | 90% | 0.897 | 81% | 0.807 | S | S | * | * | trans | -88 | 90.1 | 170.2 | -78.6 | -90.4 | -77 | 0 | 0 | 109.9 | L66 | L66-M68 PolarHBondContact O-N 3.35Š| ||
| 69 | V | 43.1 | Very low | 39 | Very low | 135 Ų | 135 | 154.5 Ų | 154.5 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | -98.2 | 101.2 | 173.1 | -179.4 | 0 | 0 | 0 | 0 | 109.8 | P67 | P67-V69 HydrophobicContact CB-CG2 4.5Å; P67-V69 PolarHBondContact O-N 2.7Å | ||
| 70 | S | 38.3 | Very low | 38.8 | Very low | 89 Ų | 89 | 151 Ų | 151 | 62% | 0.622 | 80% | 0.802 | S | S | * | * | trans | -171.3 | 109.2 | 157.9 | 54.4 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 71 | H | 37.3 | Very low | 38.2 | Very low | 187 Ų | 187 | 149.8 Ų | 149.8 | 87% | 0.866 | 80% | 0.799 | S | S | * | * | trans | -157.1 | 91.9 | 135.5 | -100.6 | -54.9 | 0 | 0 | 0 | 110.2 | F73 | H71-F73 PolarHBondContact O-N 3.46Š| ||
| 72 | T | 37.5 | Very low | 38.2 | Very low | 136 Ų | 136 | 145.4 Ų | 145.4 | 83% | 0.834 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 120.3 | 172 | -46.4 | 0 | 0 | 0 | 0 | 109.6 | H74 | T72-H74 PolarHBondContact O-N 2.97Š|
| 73 | F | 34.3 | Very low | 38.5 | Very low | 203 Ų | 203 | 142.7 Ų | 142.7 | 89% | 0.89 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 122.9 | 170.4 | -104.4 | -96.2 | 0 | 0 | 0 | 110 | H71 | H71-F73 PolarHBondContact O-N 3.46Š|
| 74 | H | 39.6 | Very low | 38.2 | Very low | 167 Ų | 167 | 141.6 Ų | 141.6 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -91 | 121 | -177.5 | -162.8 | -55.1 | 0 | 0 | 0 | 109.9 | T72 | T72-H74 PolarHBondContact O-N 2.97Š|
| 75 | M | 43.5 | Very low | 37.8 | Very low | 158 Ų | 158 | 145.9 Ų | 145.9 | 78% | 0.778 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 134.1 | 168.3 | -66.8 | -96.8 | 68.2 | 0 | 0 | 109.5 | ||
| 76 | P | 44.3 | Very low | 37.7 | Very low | 114 Ų | 114 | 139.7 Ų | 139.7 | 74% | 0.74 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -99.8 | 127.8 | 167.6 | 33.6 | -26.9 | 0 | 0 | 0 | 111 | ||
| 77 | T | 34.3 | Very low | 37.5 | Very low | 127 Ų | 127 | 140.5 Ų | 140.5 | 78% | 0.779 | 80% | 0.797 | S | S | * | * | trans | -116.7 | 120.3 | 166.3 | -58.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 78 | E | 36.5 | Very low | 37.2 | Very low | 184 Ų | 184 | 142.7 Ų | 142.7 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | 21.3 | 127.2 | 155 | -51.2 | -173.6 | 162.8 | 0 | 0 | 120.8 | ||||
| 79 | E | 32.1 | Very low | 37.4 | Very low | 181 Ų | 181 | 141.2 Ų | 141.2 | 85% | 0.846 | 80% | 0.798 | S | S | * | * | -156 | 145.1 | 118.5 | -133.6 | -153.8 | 96.7 | 0 | 0 | 114 | |||||
| 80 | S | 38.1 | Very low | 38.1 | Very low | 107 Ų | 107 | 139.1 Ų | 139.1 | 75% | 0.748 | 79% | 0.787 | S | S | * | * | trans | 33.4 | 130.8 | 140.7 | -162.4 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 81 | G | 30.5 | Very low | 37.9 | Very low | 75 Ų | 75 | 144.1 Ų | 144.1 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | trans | 169.8 | 109 | 159.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 82 | A | 39.5 | Very low | 37.7 | Very low | 99 Ų | 99 | 140.5 Ų | 140.5 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -156.2 | 173.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 83 | P | 49 | Very low | 37.6 | Very low | 118 Ų | 118 | 139.6 Ų | 139.6 | 77% | 0.766 | 79% | 0.793 | S | S | * | * | cis | -129.6 | 178 | -6.4 | 42.6 | -28.2 | 0 | 0 | 0 | 114.2 | ||||
| 84 | Q | 34.6 | Very low | 37.6 | Very low | 169 Ų | 169 | 133.4 Ų | 133.4 | 79% | 0.79 | 78% | 0.779 | S | S | * | * | trans | -178 | 126.6 | 140.4 | -100.4 | -176.7 | -50.1 | 0 | 0 | 107.9 | ||||
| 85 | E | 32.4 | Very low | 37.2 | Very low | 175 Ų | 175 | 133.5 Ų | 133.5 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | 94.1 | 121 | 62.6 | -169.5 | 172.8 | -143.3 | 0 | 0 | 111.8 | |||||
| 86 | G | 32.7 | Very low | 36.6 | Very low | 73 Ų | 73 | 131.5 Ų | 131.5 | 75% | 0.753 | 78% | 0.782 | S | S | * | * | trans | 149.4 | 121.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 87 | D | 35.3 | Very low | 36 | Very low | 160 Ų | 160 | 132 Ų | 132 | 86% | 0.856 | 79% | 0.788 | S | S | * | * | trans | -80.2 | 154.5 | -169.8 | -48.5 | -93.4 | 0 | 0 | 0 | 115.7 | ||||
| 88 | D | 35.5 | Very low | 36.1 | Very low | 157 Ų | 157 | 134.1 Ų | 134.1 | 84% | 0.84 | 79% | 0.789 | S | S | * | * | -173 | 167.8 | 102.4 | -130.3 | -42.3 | 0 | 0 | 0 | 114.1 | |||||
| 89 | L | 37.2 | Very low | 36.7 | Very low | 152 Ų | 152 | 130.5 Ų | 130.5 | 80% | 0.796 | 78% | 0.781 | S | S | * | * | trans | -129.8 | -170.4 | -170.7 | -116.1 | 73.7 | 0 | 0 | 0 | 111.4 | ||||
| 90 | P | 57.7 | Low | 36.7 | Very low | 91 Ų | 91 | 130.4 Ų | 130.4 | 59% | 0.591 | 78% | 0.778 | S | S | * | * | cis | -134.6 | -176.3 | -41 | 34.4 | -16.9 | 0 | 0 | 0 | 114.2 | ||||
| 91 | K | 34.3 | Very low | 36.4 | Very low | 194 Ų | 194 | 133.5 Ų | 133.5 | 84% | 0.843 | 78% | 0.781 | S | S | * | * | trans | 114.4 | 140.4 | 156.4 | -65.2 | 155.1 | -172.8 | 166.8 | 0 | 113.9 | ||||
| 92 | S | 33.3 | Very low | 36.5 | Very low | 110 Ų | 110 | 133 Ų | 133 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | cis | -161.9 | -179 | -11.9 | 58.6 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 93 | S | 33.9 | Very low | 36.4 | Very low | 117 Ų | 117 | 135.6 Ų | 135.6 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | cis | -152.7 | -167.3 | 13.4 | -157.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 94 | A | 34.6 | Very low | 35.8 | Very low | 73 Ų | 73 | 137.1 Ų | 137.1 | 60% | 0.603 | 78% | 0.776 | S | S | * | * | trans | -88.2 | 154.8 | -171.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 95 | N | 32.3 | Very low | 36.1 | Very low | 169 Ų | 169 | 135.2 Ų | 135.2 | 90% | 0.904 | 78% | 0.778 | S | S | * | * | -163.6 | 141.9 | 107 | -95.2 | -32.1 | 0 | 0 | 0 | 112.1 | |||||
| 96 | T | 30.4 | Very low | 36 | Very low | 117 Ų | 117 | 135.5 Ų | 135.5 | 72% | 0.718 | 78% | 0.777 | S | S | * | * | trans | -123.1 | 137.1 | -174.4 | -59.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 97 | S | 31.9 | Very low | 35.9 | Very low | 123 Ų | 123 | 137.2 Ų | 137.2 | 86% | 0.86 | 78% | 0.777 | S | S | * | * | trans | -142 | 114.3 | 166.5 | -76 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 98 | H | 35.4 | Very low | 36.5 | Very low | 172 Ų | 172 | 135.3 Ų | 135.3 | 80% | 0.796 | 77% | 0.774 | S | S | * | * | trans | -145.2 | 172.4 | 176 | -78.7 | -46.2 | 0 | 0 | 0 | 107.4 | ||||
| 99 | P | 49.5 | Very low | 36.7 | Very low | 108 Ų | 108 | 136.7 Ų | 136.7 | 70% | 0.701 | 78% | 0.775 | S | S | * | * | cis | -117.7 | -174 | 2.7 | 27.1 | -3 | 0 | 0 | 0 | 111.2 | ||||
| 100 | K | 32.8 | Very low | 36.4 | Very low | 180 Ų | 180 | 137.7 Ų | 137.7 | 78% | 0.783 | 78% | 0.776 | S | S | * | * | -172.3 | 168.2 | 51.7 | -74.5 | -178.7 | -177.9 | -178.2 | 0 | 107.8 | |||||
| 101 | Q | 32.5 | Very low | 35.1 | Very low | 171 Ų | 171 | 138.9 Ų | 138.9 | 80% | 0.799 | 78% | 0.781 | S | S | * | * | cis | -171 | 137.2 | -22.7 | 169.9 | 174.3 | -5.5 | 0 | 0 | 105.7 | ||||
| 102 | G | 30.8 | Very low | 35.1 | Very low | 66 Ų | 66 | 137.1 Ų | 137.1 | 68% | 0.68 | 78% | 0.78 | S | S | * | * | trans | 175 | 138.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 103 | D | 37.4 | Very low | 35.2 | Very low | 152 Ų | 152 | 140.4 Ų | 140.4 | 81% | 0.813 | 78% | 0.783 | S | S | * | * | trans | -95.8 | 161.9 | -155.2 | -64.6 | -88.6 | 0 | 0 | 0 | 116 | ||||
| 104 | I | 36.5 | Very low | 35.7 | Very low | 150 Ų | 150 | 139.5 Ų | 139.5 | 77% | 0.769 | 77% | 0.774 | S | S | * | * | trans | -98.1 | 137.7 | -173.6 | -75.2 | 166.1 | 0 | 0 | 0 | 109.7 | ||||
| 105 | P | 42.4 | Very low | 35.5 | Very low | 129 Ų | 129 | 141.6 Ų | 141.6 | 84% | 0.838 | 78% | 0.78 | S | S | * | * | -139 | 170.3 | 106.4 | 26.6 | -6.5 | 0 | 0 | 0 | 115.4 | |||||
| 106 | K | 29.7 | Very low | 35.5 | Very low | 182 Ų | 182 | 142.5 Ų | 142.5 | 79% | 0.791 | 78% | 0.779 | S | S | * | * | trans | -100.3 | 161.7 | -169.1 | -58.1 | 174.3 | 174.7 | -179.7 | 0 | 113.5 | ||||
| 107 | S | 31 | Very low | 35.5 | Very low | 108 Ų | 108 | 140.7 Ų | 140.7 | 76% | 0.755 | 78% | 0.783 | S | S | * | * | trans | 65.9 | 167.6 | 139.2 | 63.2 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 108 | P | 47 | Very low | 35.6 | Very low | 121 Ų | 121 | 142.7 Ų | 142.7 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | cis | -120.2 | -173.9 | -10.8 | 25.8 | -3.7 | 0 | 0 | 0 | 113.3 | ||||
| 109 | E | 39.5 | Very low | 35.4 | Very low | 186 Ų | 186 | 141.8 Ų | 141.8 | 87% | 0.869 | 78% | 0.784 | S | S | * | * | trans | -120.3 | 118.4 | 165.6 | -175.6 | 174 | 122.1 | 0 | 0 | 109.4 | ||||
| 110 | E | 31.9 | Very low | 34.3 | Very low | 173 Ų | 173 | 141.5 Ų | 141.5 | 81% | 0.808 | 78% | 0.783 | S | S | * | * | trans | -141.2 | 130.7 | 159.4 | -79.3 | -168.5 | 93 | 0 | 0 | 105.9 | ||||
| 111 | T | 29.4 | Very low | 34.1 | Very low | 115 Ų | 115 | 142 Ų | 142 | 71% | 0.706 | 79% | 0.785 | S | S | * | * | 89.3 | 139.3 | 52.3 | -53.7 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 112 | I | 34 | Very low | 34.3 | Very low | 157 Ų | 157 | 139 Ų | 139 | 81% | 0.805 | 78% | 0.783 | S | S | * | * | trans | 85.5 | 143.4 | 175.5 | -40.7 | -171.4 | 0 | 0 | 0 | 117.3 | ||||
| 113 | Q | 36.1 | Very low | 35 | Very low | 179 Ų | 179 | 141.4 Ų | 141.4 | 84% | 0.836 | 79% | 0.787 | S | S | * | * | trans | -89.5 | -153.2 | 177.2 | -40.2 | 177.4 | -15.8 | 0 | 0 | 109.9 | ||||
| 114 | P | 43.8 | Very low | 34.7 | Very low | 99 Ų | 99 | 142.8 Ų | 142.8 | 64% | 0.643 | 79% | 0.788 | S | S | * | * | cis | -142.9 | -157.4 | 16.7 | 43.1 | -19.7 | 0 | 0 | 0 | 115.8 | ||||
| 115 | T | 30.8 | Very low | 34.5 | Very low | 117 Ų | 117 | 142.2 Ų | 142.2 | 72% | 0.718 | 78% | 0.782 | S | S | * | * | trans | 69.4 | 153 | 159.7 | 45.5 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 116 | E | 32.7 | Very low | 33.8 | Very low | 187 Ų | 187 | 141.7 Ų | 141.7 | 87% | 0.874 | 78% | 0.777 | S | S | * | * | cis | -158.1 | 169.8 | 7.6 | -135.2 | 162.9 | -145.7 | 0 | 0 | 110.5 | ||||
| 117 | G | 31.3 | Very low | 33.7 | Very low | 79 Ų | 79 | 137.4 Ų | 137.4 | 81% | 0.814 | 76% | 0.763 | S | S | * | * | trans | 130.9 | 121.4 | 158.3 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 118 | D | 33.2 | Very low | 33.8 | Very low | 165 Ų | 165 | 139.7 Ų | 139.7 | 88% | 0.882 | 76% | 0.761 | S | S | * | * | trans | -95.3 | -178.6 | -175.9 | -96.7 | -70.1 | 0 | 0 | 0 | 115.6 | ||||
| 119 | I | 31.7 | Very low | 33.1 | Very low | 154 Ų | 154 | 138.5 Ų | 138.5 | 79% | 0.79 | 76% | 0.756 | S | S | * | * | trans | 103 | 87.7 | 153.8 | -48.4 | -172.1 | 0 | 0 | 0 | 118 | ||||
| 120 | C | 25.4 | Very low | 32.8 | Very low | 102 Ų | 102 | 137.8 Ų | 137.8 | 69% | 0.689 | 75% | 0.75 | S | S | * | * | 48.4 | 127.3 | 122.5 | -92.2 | 0 | 0 | 0 | 0 | 123.5 | |||||
| 121 | K | 29.2 | Very low | 32.8 | Very low | 190 Ų | 190 | 137 Ų | 137 | 83% | 0.826 | 74% | 0.744 | S | S | * | * | trans | 83.6 | 119.2 | 135.5 | -68.1 | 178.5 | -178.6 | -176.1 | 0 | 120.5 | ||||
| 122 | S | 35.8 | Very low | 32.9 | Very low | 107 Ų | 107 | 136.5 Ų | 136.5 | 75% | 0.748 | 74% | 0.737 | S | S | * | * | trans | -60.9 | 165.5 | 152.2 | -175.4 | 0 | 0 | 0 | 0 | 112 | ||||
| 123 | P | 45.8 | Very low | 32.8 | Very low | 117 Ų | 117 | 136.6 Ų | 136.6 | 76% | 0.76 | 74% | 0.739 | S | S | * | * | -131.5 | 153.1 | 129.6 | 40 | -32.5 | 0 | 0 | 0 | 115 | |||||
| 124 | E | 32 | Very low | 32.8 | Very low | 181 Ų | 181 | 135.6 Ų | 135.6 | 85% | 0.846 | 74% | 0.739 | S | S | * | * | trans | -58.1 | 171.1 | 151.6 | -66.5 | 157 | 72.9 | 0 | 0 | 110.5 | ||||
| 125 | E | 31.8 | Very low | 32.9 | Very low | 138 Ų | 138 | 136 Ų | 136 | 65% | 0.645 | 74% | 0.741 | S | S | * | * | cis | -140.8 | 177.4 | 18.4 | -120.8 | -152.2 | 102.6 | 0 | 0 | 108.1 | N127 | E125-N127 PolarHBondContact OE1-ND2 2.69Š| ||
| 126 | T | 27.6 | Very low | 33 | Very low | 118 Ų | 118 | 139.1 Ų | 139.1 | 72% | 0.724 | 75% | 0.745 | S | S | * | * | 173.8 | 132.3 | 84.3 | -61.5 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 127 | N | 28.3 | Very low | 32.9 | Very low | 92 Ų | 92 | 135.9 Ų | 135.9 | 49% | 0.492 | 74% | 0.743 | S | S | . | * | trans | 5.9 | 152.8 | 138.2 | -56.3 | -77 | 0 | 0 | 0 | 120.2 | E125 | E125-N127 PolarHBondContact OE1-ND2 2.69Š| ||
| 128 | Q | 32.3 | Very low | 33.2 | Very low | 156 Ų | 156 | 137.3 Ų | 137.3 | 73% | 0.729 | 74% | 0.74 | S | S | * | * | cis | -176.4 | 161.3 | -0.6 | -113.3 | 172.5 | 44.6 | 0 | 0 | 109.7 | ||||
| 129 | S | 32.3 | Very low | 33.3 | Very low | 97 Ų | 97 | 137.8 Ų | 137.8 | 68% | 0.678 | 74% | 0.737 | S | S | * | * | trans | 65.4 | 163.2 | 152.8 | -77 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 130 | K | 33.1 | Very low | 33.5 | Very low | 170 Ų | 170 | 138.9 Ų | 138.9 | 74% | 0.739 | 74% | 0.739 | S | S | * | * | cis | -164.4 | 146.6 | -3.2 | -123.4 | 175 | 179.2 | 174.9 | 0 | 108.8 | ||||
| 131 | K | 31.7 | Very low | 33.8 | Very low | 157 Ų | 157 | 139.7 Ų | 139.7 | 68% | 0.683 | 74% | 0.74 | S | S | * | * | trans | 58.9 | 160.9 | 142 | -72.5 | -175.1 | 147.3 | -68.2 | 0 | 118.6 | ||||
| 132 | D | 31.7 | Very low | 34.2 | Very low | 105 Ų | 105 | 137.9 Ų | 137.9 | 56% | 0.561 | 74% | 0.738 | S | S | * | * | cis | -154.6 | -179.4 | -11.8 | -100.9 | -24.4 | 0 | 0 | 0 | 107.1 | ||||
| 133 | D | 32.8 | Very low | 34.2 | Very low | 159 Ų | 159 | 141.9 Ų | 141.9 | 85% | 0.85 | 74% | 0.742 | S | S | * | * | trans | 70 | 119.2 | 154.4 | -62.9 | -43.5 | 0 | 0 | 0 | 122.4 | ||||
| 134 | L | 35.9 | Very low | 34 | Very low | 158 Ų | 158 | 141.5 Ų | 141.5 | 83% | 0.827 | 74% | 0.74 | S | S | * | * | trans | -111.9 | 138 | 156.2 | 177.2 | 65.4 | 0 | 0 | 0 | 104.6 | ||||
| 135 | P | 46.5 | Very low | 34 | Very low | 106 Ų | 106 | 142.6 Ų | 142.6 | 69% | 0.688 | 74% | 0.742 | S | S | * | * | -163.8 | 176.3 | 73.8 | 44.7 | -22.9 | 0 | 0 | 0 | 121.4 | |||||
| 136 | K | 32.1 | Very low | 34.2 | Very low | 184 Ų | 184 | 145.4 Ų | 145.4 | 80% | 0.8 | 76% | 0.755 | S | S | * | * | trans | 90.1 | 144.5 | 144.3 | -90 | 173.9 | 178.9 | 179.3 | 0 | 122 | ||||
| 137 | S | 30.8 | Very low | 34.3 | Very low | 118 Ų | 118 | 142.7 Ų | 142.7 | 83% | 0.825 | 75% | 0.751 | S | S | * | * | trans | 67.7 | 148.3 | 165.2 | 26.3 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 138 | S | 37.4 | Very low | 34.5 | Very low | 109 Ų | 109 | 146.2 Ų | 146.2 | 76% | 0.762 | 77% | 0.77 | S | S | * | * | cis | -152.9 | 148.8 | -1.4 | 45.7 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 139 | E | 35.9 | Very low | 34.8 | Very low | 175 Ų | 175 | 145.8 Ų | 145.8 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | trans | 3.9 | 128.4 | 141.4 | -176.6 | 176.5 | -179 | 0 | 0 | 120.3 | ||||
| 140 | E | 34.4 | Very low | 34.9 | Very low | 177 Ų | 177 | 147 Ų | 147 | 83% | 0.827 | 78% | 0.776 | S | S | * | * | -154.5 | 167.6 | 125.9 | -138.4 | -170.6 | 103.7 | 0 | 0 | 111.3 | |||||
| 141 | V | 33.2 | Very low | 35 | Very low | 119 Ų | 119 | 148.5 Ų | 148.5 | 72% | 0.721 | 78% | 0.783 | S | S | * | * | trans | -138.1 | 120 | -167.1 | 174.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 142 | I | 36.9 | Very low | 35 | Very low | 152 Ų | 152 | 146.6 Ų | 146.6 | 78% | 0.779 | 79% | 0.789 | S | S | * | * | trans | -137.3 | 125.2 | 164.8 | -56.5 | -177.6 | 0 | 0 | 0 | 112.1 | ||||
| 143 | K | 34.8 | Very low | 35.1 | Very low | 191 Ų | 191 | 147 Ų | 147 | 83% | 0.83 | 80% | 0.8 | S | S | * | * | trans | -110.8 | 159 | 155.5 | -93.1 | -171.6 | 178.9 | -174.3 | 0 | 106.2 | ||||
| 144 | P | 43.2 | Very low | 35.1 | Very low | 110 Ų | 110 | 143.9 Ų | 143.9 | 71% | 0.714 | 80% | 0.797 | S | S | * | * | cis | -160.7 | -177.8 | 49.6 | 43.6 | -21.4 | 0 | 0 | 0 | 120.2 | ||||
| 145 | K | 31.7 | Very low | 35.2 | Very low | 204 Ų | 204 | 146.1 Ų | 146.1 | 89% | 0.887 | 80% | 0.8 | S | S | * | * | trans | 89.5 | 171.5 | 140.3 | -94.6 | 174.8 | 180 | -174.5 | 0 | 121.1 | ||||
| 146 | E | 35.3 | Very low | 35 | Very low | 196 Ų | 196 | 146.7 Ų | 146.7 | 92% | 0.916 | 80% | 0.804 | S | S | * | * | trans | -157.3 | 154.2 | -141.6 | 178.1 | -175.1 | 163.6 | 0 | 0 | 108.7 | ||||
| 147 | G | 29.6 | Very low | 34.9 | Very low | 62 Ų | 62 | 146.1 Ų | 146.1 | 64% | 0.639 | 81% | 0.808 | S | S | * | * | trans | 113.8 | 142.8 | -171 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 148 | D | 32 | Very low | 35.2 | Very low | 166 Ų | 166 | 148.7 Ų | 148.7 | 89% | 0.888 | 81% | 0.807 | S | S | * | * | cis | -145.4 | 164 | 9.7 | -98.3 | -67 | 0 | 0 | 0 | 112.6 | ||||
| 149 | I | 38.7 | Very low | 34.9 | Very low | 146 Ų | 146 | 149.3 Ų | 149.3 | 75% | 0.749 | 81% | 0.812 | S | S | * | * | trans | -104.2 | 136 | 175.4 | -60.6 | 167.5 | 0 | 0 | 0 | 110.5 | K151 | I149-K151 HydrophobicContact CG2-CG 4.31Š| ||
| 150 | P | 35 | Very low | 34.7 | Very low | 122 Ų | 122 | 150 Ų | 150 | 79% | 0.792 | 81% | 0.812 | S | S | * | * | trans | -113.8 | 130.2 | 153.2 | 33.9 | -24.9 | 0 | 0 | 0 | 112.6 | ||||
| 151 | K | 35.3 | Very low | 34.5 | Very low | 202 Ų | 202 | 149.3 Ų | 149.3 | 88% | 0.878 | 81% | 0.813 | S | S | * | * | trans | -97.7 | 130.5 | 170.5 | -70.2 | 177.4 | 177 | 176.2 | 0 | 110.9 | I149 | I149-K151 HydrophobicContact CG2-CG 4.31Š| ||
| 152 | S | 32.6 | Very low | 34.3 | Very low | 117 Ų | 117 | 147.2 Ų | 147.2 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | trans | -163.9 | 120.4 | 161.6 | -170.6 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 153 | S | 32.2 | Very low | 34.1 | Very low | 113 Ų | 113 | 146.7 Ų | 146.7 | 79% | 0.79 | 82% | 0.815 | S | S | * | * | cis | 104.1 | 149.5 | 40.6 | -166.8 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 154 | A | 32.9 | Very low | 34.1 | Very low | 94 Ų | 94 | 145.8 Ų | 145.8 | 78% | 0.777 | 82% | 0.817 | S | S | * | * | trans | 70.1 | 101.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 155 | K | 38.1 | Very low | 33.8 | Very low | 205 Ų | 205 | 146.3 Ų | 146.3 | 89% | 0.891 | 82% | 0.82 | S | S | * | * | trans | -79.6 | 175.4 | 132.3 | -80.9 | -178 | 177.2 | 177.9 | 0 | 108.3 | ||||
| 156 | P | 41.8 | Very low | 34 | Very low | 119 Ų | 119 | 146.2 Ų | 146.2 | 77% | 0.773 | 82% | 0.82 | S | S | * | * | cis | -133.9 | 179.5 | 6.4 | 43.2 | -27.6 | 0 | 0 | 0 | 115.4 | ||||
| 157 | L | 31.8 | Very low | 33.9 | Very low | 171 Ų | 171 | 142.2 Ų | 142.2 | 90% | 0.895 | 81% | 0.814 | S | S | * | * | trans | -154 | 155.8 | 148.2 | -115.2 | 170.9 | 0 | 0 | 0 | 110.5 | ||||
| 158 | Q | 35.4 | Very low | 34 | Very low | 172 Ų | 172 | 144.7 Ų | 144.7 | 80% | 0.804 | 82% | 0.821 | S | S | * | * | trans | -121.9 | 150.4 | 177 | -71.2 | -170.9 | -6.4 | 0 | 0 | 111.2 | ||||
| 159 | S | 31.5 | Very low | 34.1 | Very low | 123 Ų | 123 | 145.8 Ų | 145.8 | 86% | 0.86 | 82% | 0.823 | S | S | * | * | trans | -152.5 | 170.9 | 150.1 | 58.6 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 160 | K | 32.5 | Very low | 34 | Very low | 188 Ų | 188 | 147.9 Ų | 147.9 | 82% | 0.817 | 83% | 0.827 | S | S | * | * | trans | -126.1 | 167.7 | -162.6 | -63 | 178.3 | 177.3 | 178.5 | 0 | 112.8 | ||||
| 161 | L | 30.1 | Very low | 34 | Very low | 163 Ų | 163 | 147.9 Ų | 147.9 | 85% | 0.853 | 83% | 0.827 | S | S | * | * | trans | 100.9 | 124.1 | 135.2 | -149.3 | 76.6 | 0 | 0 | 0 | 117.6 | ||||
| 162 | G | 28.5 | Very low | 33.9 | Very low | 75 Ų | 75 | 146.4 Ų | 146.4 | 77% | 0.773 | 83% | 0.827 | S | S | * | * | trans | 174.7 | 106.8 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 163 | N | 33.2 | Very low | 33.9 | Very low | 142 Ų | 142 | 149.7 Ų | 149.7 | 76% | 0.759 | 83% | 0.829 | S | S | * | * | trans | -107.4 | 146.6 | 177.3 | -47 | -73.7 | 0 | 0 | 0 | 109.9 | ||||
| 164 | I | 35.2 | Very low | 34 | Very low | 172 Ų | 172 | 149.7 Ų | 149.7 | 88% | 0.882 | 83% | 0.829 | S | S | * | * | trans | -170.4 | 155.8 | 158.5 | -105 | 149.8 | 0 | 0 | 0 | 108.2 | ||||
| 165 | P | 37.1 | Very low | 33.8 | Very low | 120 Ų | 120 | 155.1 Ų | 155.1 | 78% | 0.779 | 84% | 0.835 | S | S | * | * | -115.1 | -171.3 | -112.3 | 42.3 | -38.5 | 0 | 0 | 0 | 116.7 | |||||
| 166 | K | 34.3 | Very low | 33.5 | Very low | 203 Ų | 203 | 154.1 Ų | 154.1 | 88% | 0.883 | 83% | 0.834 | S | S | * | * | trans | -94.7 | 140.8 | -179.5 | -57.7 | 177.5 | 178.9 | -177.5 | 0 | 113.2 | ||||
| 167 | S | 33.2 | Very low | 33 | Very low | 112 Ų | 112 | 156.1 Ų | 156.1 | 78% | 0.783 | 84% | 0.838 | S | S | * | * | trans | -149.4 | 115.1 | 154.5 | 53.9 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 168 | S | 33.3 | Very low | 32.8 | Very low | 113 Ų | 113 | 154.8 Ų | 154.8 | 79% | 0.79 | 83% | 0.832 | S | S | * | * | 71.5 | 92.3 | 61.5 | -64.6 | 0 | 0 | 0 | 0 | 114 | |||||
| 169 | M | 33 | Very low | 32.5 | Very low | 189 Ų | 189 | 151.9 Ų | 151.9 | 93% | 0.931 | 83% | 0.83 | S | S | * | * | trans | -152.5 | 159 | 134.7 | -108.3 | 171.8 | 76.6 | 0 | 0 | 109.9 | ||||
| 170 | K | 37.6 | Very low | 33.3 | Very low | 191 Ų | 191 | 151 Ų | 151 | 83% | 0.83 | 82% | 0.822 | S | S | * | * | trans | -121.7 | 156.4 | 179.3 | -98 | -170.1 | 173.6 | -173.2 | 0 | 110 | ||||
| 171 | P | 35.2 | Very low | 33.1 | Very low | 122 Ų | 122 | 151.9 Ų | 151.9 | 79% | 0.792 | 83% | 0.825 | S | S | * | * | trans | -75.8 | 161.1 | -177.4 | 32.5 | -36.6 | 0 | 0 | 0 | 112.9 | ||||
| 172 | I | 32.5 | Very low | 33 | Very low | 171 Ų | 171 | 149.2 Ų | 149.2 | 88% | 0.877 | 82% | 0.821 | S | S | * | * | trans | -111.5 | 148 | 168.6 | -65.4 | 178.4 | 0 | 0 | 0 | 108.4 | ||||
| 173 | Q | 32.8 | Very low | 34.1 | Very low | 185 Ų | 185 | 150.1 Ų | 150.1 | 86% | 0.864 | 81% | 0.813 | S | S | * | * | trans | -96.1 | 159.7 | -165.9 | -64.5 | 174.2 | -53.1 | 0 | 0 | 113.7 | ||||
| 174 | S | 33.3 | Very low | 34 | Very low | 114 Ų | 114 | 150.9 Ų | 150.9 | 80% | 0.797 | 81% | 0.812 | S | S | * | * | trans | -71.5 | 159.6 | 169.8 | 46.7 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 175 | K | 30.4 | Very low | 33.9 | Very low | 208 Ų | 208 | 151.6 Ų | 151.6 | 90% | 0.904 | 81% | 0.811 | S | S | * | * | trans | -152.6 | 127.7 | 153.7 | -77.3 | -150.4 | 172.5 | -158.4 | 0 | 111.9 | ||||
| 176 | E | 31.8 | Very low | 33.4 | Very low | 184 Ų | 184 | 149.4 Ų | 149.4 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -87.9 | 162 | 142.6 | -66.8 | 166.7 | 96.8 | 0 | 0 | 108.1 | ||||
| 177 | D | 30 | Very low | 33.5 | Very low | 161 Ų | 161 | 148 Ų | 148 | 86% | 0.861 | 80% | 0.803 | S | S | * | * | -174.7 | 160.2 | 115 | -132.1 | -37.3 | 0 | 0 | 0 | 114.1 | |||||
| 178 | D | 28.7 | Very low | 33.4 | Very low | 143 Ų | 143 | 151.3 Ų | 151.3 | 77% | 0.765 | 81% | 0.806 | S | S | * | * | trans | 65.1 | 155.8 | 157.2 | -130.5 | -29 | 0 | 0 | 0 | 122.5 | ||||
| 179 | S | 28.7 | Very low | 34.4 | Very low | 111 Ų | 111 | 151.4 Ų | 151.4 | 78% | 0.776 | 81% | 0.805 | S | S | * | * | trans | -120.8 | -134.1 | 178.6 | -145.7 | 0 | 0 | 0 | 0 | 107 | ||||
| 180 | P | 47.6 | Very low | 34.4 | Very low | 104 Ų | 104 | 151.3 Ų | 151.3 | 68% | 0.675 | 80% | 0.799 | S | S | * | * | cis | -121.2 | -178.8 | -25.3 | 41.1 | -27.8 | 0 | 0 | 0 | 113.2 | ||||
| 181 | K | 27.8 | Very low | 34.3 | Very low | 206 Ų | 206 | 149.8 Ų | 149.8 | 90% | 0.896 | 80% | 0.795 | S | S | * | * | 162.1 | 145.6 | 112.5 | -158.4 | 155.6 | -172.5 | 168.2 | 0 | 114.4 | |||||
| 182 | S | 28.8 | Very low | 34.2 | Very low | 108 Ų | 108 | 147.2 Ų | 147.2 | 76% | 0.755 | 79% | 0.79 | S | S | * | * | trans | -83.6 | -177.2 | 175.1 | -128.1 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 183 | P | 51.8 | Low | 34.3 | Very low | 93 Ų | 93 | 145.8 Ų | 145.8 | 60% | 0.604 | 79% | 0.785 | S | S | * | * | cis | -132.5 | -147.6 | 9.7 | 34.7 | -8.7 | 0 | 0 | 0 | 112.8 | ||||
| 184 | E | 30.1 | Very low | 34.4 | Very low | 159 Ų | 159 | 143.8 Ų | 143.8 | 74% | 0.743 | 78% | 0.778 | S | S | * | * | cis | -163.7 | 155.4 | 6.4 | -152.9 | 99.4 | 74.9 | 0 | 0 | 111.3 | ||||
| 185 | E | 33.1 | Very low | 34.9 | Very low | 187 Ų | 187 | 142.9 Ų | 142.9 | 87% | 0.874 | 77% | 0.77 | S | S | * | * | trans | 52.1 | 159 | 157.1 | -74.7 | -152 | 129.2 | 0 | 0 | 122.6 | ||||
| 186 | A | 28 | Very low | 35 | Very low | 73 Ų | 73 | 142.5 Ų | 142.5 | 60% | 0.603 | 77% | 0.768 | S | S | * | * | cis | -171.6 | -169.2 | -22.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 187 | I | 35.8 | Very low | 35 | Very low | 173 Ų | 173 | 138.7 Ų | 138.7 | 89% | 0.887 | 76% | 0.762 | S | S | * | * | trans | 97.8 | 147.2 | 167 | -54.1 | 173 | 0 | 0 | 0 | 116.8 | ||||
| 188 | Q | 31.5 | Very low | 36.1 | Very low | 182 Ų | 182 | 136.6 Ų | 136.6 | 85% | 0.85 | 76% | 0.757 | S | S | * | * | trans | -118.6 | 162.6 | -161.4 | -64.6 | -177.7 | 3.3 | 0 | 0 | 114.9 | ||||
| 189 | P | 53.4 | Low | 36.5 | Very low | 116 Ų | 116 | 137.2 Ų | 137.2 | 75% | 0.753 | 76% | 0.755 | S | S | * | * | trans | -105.4 | 172.2 | -176.7 | 41.2 | -36.4 | 0 | 0 | 0 | 115.4 | ||||
| 190 | K | 34.3 | Very low | 36.9 | Very low | 187 Ų | 187 | 140.2 Ų | 140.2 | 81% | 0.813 | 76% | 0.757 | S | S | * | * | trans | 173.6 | 160.1 | 162 | -102.5 | 159.2 | 174.9 | -162.4 | 0 | 111.4 | ||||
| 191 | E | 35.2 | Very low | 36.2 | Very low | 158 Ų | 158 | 138.9 Ų | 138.9 | 74% | 0.738 | 76% | 0.755 | S | S | * | * | cis | -158.6 | 145.8 | 1.7 | -146.8 | 157 | 94.1 | 0 | 0 | 111.5 | ||||
| 192 | G | 32 | Very low | 36.7 | Very low | 68 Ų | 68 | 136.6 Ų | 136.6 | 70% | 0.701 | 75% | 0.75 | S | S | * | * | trans | 57.3 | 162.2 | 147.3 | 0 | 0 | 0 | 0 | 0 | 124 | ||||
| 193 | D | 35.5 | Very low | 37.7 | Very low | 141 Ų | 141 | 137.1 Ų | 137.1 | 75% | 0.754 | 75% | 0.751 | S | S | * | * | cis | -171.5 | 151.1 | -20.3 | -130.9 | -44.5 | 0 | 0 | 0 | 113 | ||||
| 194 | I | 34.9 | Very low | 38.1 | Very low | 143 Ų | 143 | 137.9 Ų | 137.9 | 73% | 0.733 | 76% | 0.757 | S | S | * | * | trans | 62.5 | 144.9 | 147.8 | -85.5 | 158.9 | 0 | 0 | 0 | 121.6 | ||||
| 195 | P | 44.1 | Very low | 38.2 | Very low | 95 Ų | 95 | 140.8 Ų | 140.8 | 62% | 0.617 | 77% | 0.766 | S | S | * | * | cis | -151 | -173 | -25.8 | 47.7 | -29.5 | 0 | 0 | 0 | 118 | ||||
| 196 | K | 31.2 | Very low | 38.3 | Very low | 201 Ų | 201 | 136.9 Ų | 136.9 | 87% | 0.874 | 77% | 0.767 | S | S | * | * | trans | 89.7 | 123.4 | 145.4 | -80.9 | 172.2 | -177 | 177.1 | 0 | 124.2 | ||||
| 197 | S | 32 | Very low | 38.4 | Very low | 103 Ų | 103 | 136.6 Ų | 136.6 | 72% | 0.72 | 77% | 0.77 | S | S | * | * | trans | -66.8 | -175.9 | 156.1 | -121.4 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 198 | P | 52.8 | Low | 38.3 | Very low | 118 Ų | 118 | 135.1 Ų | 135.1 | 77% | 0.766 | 76% | 0.764 | S | S | * | * | cis | -135.5 | -163.4 | 14.5 | 23.9 | 4.1 | 0 | 0 | 0 | 114.6 | ||||
| 199 | E | 37.5 | Very low | 38.2 | Very low | 156 Ų | 156 | 133.1 Ų | 133.1 | 73% | 0.729 | 76% | 0.758 | S | S | * | * | cis | -174.8 | 150 | -40.2 | -172.8 | 165.3 | 128.7 | 0 | 0 | 110.8 | ||||
| 200 | E | 38.3 | Very low | 37.1 | Very low | 174 Ų | 174 | 134.2 Ų | 134.2 | 81% | 0.813 | 76% | 0.757 | S | S | * | * | trans | 56.1 | 144.6 | 161.9 | -82.1 | -151.6 | 131.1 | 0 | 0 | 128.9 | ||||
| 201 | A | 31.6 | Very low | 37 | Very low | 75 Ų | 75 | 134.5 Ų | 134.5 | 62% | 0.62 | 76% | 0.758 | S | S | * | * | trans | 66.8 | 114.8 | 143.8 | 0 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 202 | I | 38 | Very low | 37.1 | Very low | 158 Ų | 158 | 131.8 Ų | 131.8 | 81% | 0.81 | 76% | 0.757 | S | S | * | * | 74.9 | 141.4 | 65.3 | -67 | 172 | 0 | 0 | 0 | 113.4 | |||||
| 203 | P | 50.3 | Low | 37.9 | Very low | 119 Ų | 119 | 134.5 Ų | 134.5 | 77% | 0.773 | 76% | 0.762 | S | S | * | * | cis | -129.5 | -127.8 | 1.1 | 32.8 | -5.5 | 0 | 0 | 0 | 115.7 | ||||
| 204 | P | 60 | Low | 37.7 | Very low | 110 Ų | 110 | 135.4 Ų | 135.4 | 71% | 0.714 | 76% | 0.762 | S | S | * | * | -135.1 | 177.9 | -121.3 | 43.7 | -22.3 | 0 | 0 | 0 | 118.7 | |||||
| 205 | K | 32.5 | Very low | 37.8 | Very low | 219 Ų | 219 | 136.8 Ų | 136.8 | 95% | 0.952 | 77% | 0.765 | S | S | * | * | trans | -167.2 | 173.5 | 148.7 | -115.1 | 160.6 | -172.9 | 170.7 | 0 | 115 | ||||
| 206 | A | 35.6 | Very low | 37.1 | Very low | 106 Ų | 106 | 135.6 Ų | 135.6 | 88% | 0.876 | 76% | 0.763 | S | S | * | * | trans | -117.7 | 172.8 | -168.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 207 | G | 29.8 | Very low | 37.4 | Very low | 66 Ų | 66 | 133.8 Ų | 133.8 | 68% | 0.68 | 76% | 0.761 | S | S | * | * | trans | 152.3 | 101.2 | 160.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 208 | D | 32.9 | Very low | 37.5 | Very low | 143 Ų | 143 | 137.3 Ų | 137.3 | 77% | 0.765 | 77% | 0.767 | S | S | * | * | trans | 51.4 | 123.1 | 138.7 | -60 | -46.7 | 0 | 0 | 0 | 125.6 | ||||
| 209 | I | 31.2 | Very low | 37.3 | Very low | 139 Ų | 139 | 136.6 Ų | 136.6 | 71% | 0.713 | 76% | 0.762 | S | S | * | * | 50.6 | 122.3 | 124.7 | -47.5 | 163.5 | 0 | 0 | 0 | 119.7 | |||||
| 210 | L | 29.8 | Very low | 37 | Very low | 140 Ų | 140 | 136.6 Ų | 136.6 | 73% | 0.733 | 76% | 0.759 | S | S | * | * | 177.7 | 121.4 | 118.5 | -94 | 172.5 | 0 | 0 | 0 | 115.6 | |||||
| 211 | K | 32.7 | Very low | 36.7 | Very low | 192 Ų | 192 | 135.4 Ų | 135.4 | 84% | 0.835 | 75% | 0.754 | S | S | * | * | trans | 58.2 | 128.7 | 144 | -70.3 | 176.6 | -175.3 | 175.2 | 0 | 123.5 | ||||
| 212 | S | 35.4 | Very low | 36.7 | Very low | 102 Ų | 102 | 138.8 Ų | 138.8 | 71% | 0.713 | 76% | 0.761 | S | S | * | * | trans | -69.3 | -179 | 153.7 | -40.9 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 213 | P | 48.7 | Very low | 36.3 | Very low | 125 Ų | 125 | 138 Ų | 138 | 81% | 0.812 | 76% | 0.759 | S | S | * | * | -135.1 | 147.1 | 116 | 38.2 | -30.6 | 0 | 0 | 0 | 116.7 | |||||
| 214 | E | 33.1 | Very low | 35.4 | Very low | 160 Ų | 160 | 137 Ų | 137 | 75% | 0.748 | 75% | 0.754 | S | S | * | * | trans | -42.9 | 166 | 149.6 | -98.3 | 104.6 | 131 | 0 | 0 | 115.4 | ||||
| 215 | E | 35.3 | Very low | 34.2 | Very low | 172 Ų | 172 | 138.1 Ų | 138.1 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | cis | -158.3 | 169 | 3.4 | -141.7 | -170.7 | 146.1 | 0 | 0 | 113.5 | ||||
| 216 | A | 31.3 | Very low | 34.2 | Very low | 70 Ų | 70 | 136.8 Ų | 136.8 | 58% | 0.579 | 76% | 0.756 | S | S | * | * | trans | 49.9 | 128.7 | 140.7 | 0 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 217 | I | 35.9 | Very low | 34.1 | Very low | 163 Ų | 163 | 136 Ų | 136 | 84% | 0.836 | 74% | 0.744 | S | S | * | * | -173 | 146.9 | 104.2 | -90.5 | 156 | 0 | 0 | 0 | 110.1 | |||||
| 218 | Q | 35.1 | Very low | 34.7 | Very low | 177 Ų | 177 | 138.7 Ų | 138.7 | 83% | 0.827 | 75% | 0.749 | S | S | * | * | trans | -140.7 | -172.1 | 167.3 | -45.1 | -173.4 | 2.5 | 0 | 0 | 108.6 | ||||
| 219 | P | 47.9 | Very low | 34.6 | Very low | 102 Ų | 102 | 139.9 Ų | 139.9 | 66% | 0.662 | 75% | 0.751 | S | S | * | * | cis | -133.8 | -168.8 | -13.6 | 27 | -2.3 | 0 | 0 | 0 | 113.9 | ||||
| 220 | K | 30.8 | Very low | 34.7 | Very low | 156 Ų | 156 | 141.4 Ų | 141.4 | 68% | 0.678 | 76% | 0.755 | S | S | * | * | trans | 116.5 | 130.9 | 140.9 | -80.6 | 167 | 152.1 | -88.7 | 0 | 121.4 | ||||
| 221 | E | 32.1 | Very low | 34.7 | Very low | 150 Ų | 150 | 139.6 Ų | 139.6 | 70% | 0.701 | 75% | 0.753 | S | S | * | * | trans | 83.4 | 122.8 | 130.8 | -74.1 | 162.2 | 165.9 | 0 | 0 | 124.5 | ||||
| 222 | D | 31.4 | Very low | 34.7 | Very low | 145 Ų | 145 | 138.4 Ų | 138.4 | 78% | 0.775 | 75% | 0.754 | S | S | * | * | trans | 101.7 | 167.4 | 136.6 | -119.9 | -36.9 | 0 | 0 | 0 | 122.6 | ||||
| 223 | N | 29.8 | Very low | 34.6 | Very low | 142 Ų | 142 | 142 Ų | 142 | 76% | 0.759 | 76% | 0.76 | S | S | * | * | trans | -92 | 151.5 | -146 | -87 | -90.1 | 0 | 0 | 0 | 118 | ||||
| 224 | S | 31.6 | Very low | 34.7 | Very low | 97 Ų | 97 | 141 Ų | 141 | 68% | 0.678 | 75% | 0.754 | S | S | * | * | trans | 24 | 136.1 | 136.9 | -166.2 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 225 | P | 35.8 | Very low | 34.6 | Very low | 134 Ų | 134 | 141.8 Ų | 141.8 | 87% | 0.87 | 76% | 0.755 | S | S | * | * | trans | -125.5 | 167.2 | 138.7 | 37.7 | -29.1 | 0 | 0 | 0 | 114.7 | ||||
| 226 | K | 31.3 | Very low | 34.4 | Very low | 192 Ų | 192 | 141.1 Ų | 141.1 | 84% | 0.835 | 75% | 0.752 | S | S | * | * | trans | -140.7 | 133.9 | -162.4 | 166.1 | -172.3 | 172.9 | -173 | 0 | 113.1 | ||||
| 227 | S | 33.8 | Very low | 34.3 | Very low | 89 Ų | 89 | 141.4 Ų | 141.4 | 62% | 0.622 | 76% | 0.761 | S | S | * | * | trans | 62.4 | 166.5 | 164.5 | -141.8 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 228 | P | 43.4 | Very low | 34.1 | Very low | 122 Ų | 122 | 141.5 Ų | 141.5 | 79% | 0.792 | 76% | 0.763 | S | S | * | * | -138.9 | 168.5 | 86.7 | 40.1 | -26.9 | 0 | 0 | 0 | 117.2 | |||||
| 229 | E | 31.5 | Very low | 34.1 | Very low | 169 Ų | 169 | 140 Ų | 140 | 79% | 0.79 | 76% | 0.76 | S | S | * | * | trans | -75.9 | -174.1 | 167.5 | -74 | 146.4 | 80.2 | 0 | 0 | 112.2 | ||||
| 230 | E | 32.4 | Very low | 33.7 | Very low | 171 Ų | 171 | 140.4 Ų | 140.4 | 80% | 0.799 | 76% | 0.762 | S | S | * | * | cis | -149 | 144.2 | 18.8 | -111.3 | -172 | 107.7 | 0 | 0 | 108.8 | ||||
| 231 | S | 28.8 | Very low | 33.6 | Very low | 101 Ų | 101 | 142 Ų | 142 | 71% | 0.706 | 77% | 0.769 | S | S | * | * | 69.6 | 102 | 79.3 | -164 | 0 | 0 | 0 | 0 | 118.3 | |||||
| 232 | I | 33.7 | Very low | 33.7 | Very low | 167 Ų | 167 | 139.8 Ų | 139.8 | 86% | 0.856 | 77% | 0.77 | S | S | * | * | trans | -151.9 | 141.6 | 153.3 | -58 | -172.9 | 0 | 0 | 0 | 111.1 | ||||
| 233 | Q | 33.6 | Very low | 34.3 | Very low | 178 Ų | 178 | 139 Ų | 139 | 83% | 0.832 | 77% | 0.773 | S | S | * | * | trans | -146.8 | -172.3 | 159.2 | -51.2 | -172.4 | -0.3 | 0 | 0 | 108.9 | ||||
| 234 | P | 50.3 | Low | 34.5 | Very low | 105 Ų | 105 | 140.8 Ų | 140.8 | 68% | 0.682 | 78% | 0.777 | S | S | * | * | cis | -132.6 | -156.3 | -15.3 | 37.9 | -17 | 0 | 0 | 0 | 113 | ||||
| 235 | K | 31.3 | Very low | 34.4 | Very low | 176 Ų | 176 | 145.1 Ų | 145.1 | 77% | 0.765 | 79% | 0.786 | S | S | * | * | trans | 105.6 | 154 | 161.4 | -67.1 | -176.9 | 168 | -103.8 | 0 | 118.4 | ||||
| 236 | E | 31.6 | Very low | 34.1 | Very low | 158 Ų | 158 | 142.8 Ų | 142.8 | 74% | 0.738 | 78% | 0.778 | S | S | * | * | cis | -176.5 | 146.9 | -23.7 | -177.5 | 171.5 | 168.5 | 0 | 0 | 109.7 | ||||
| 237 | G | 29.1 | Very low | 34.4 | Very low | 75 Ų | 75 | 141 Ų | 141 | 77% | 0.773 | 78% | 0.776 | S | S | * | * | trans | 84.3 | 145.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 238 | D | 31.6 | Very low | 34.9 | Very low | 165 Ų | 165 | 141.6 Ų | 141.6 | 88% | 0.882 | 78% | 0.778 | S | S | * | * | cis | -150.7 | 169.3 | 17.9 | -140.3 | -36 | 0 | 0 | 0 | 112.4 | ||||
| 239 | I | 34.4 | Very low | 34.8 | Very low | 147 Ų | 147 | 141.4 Ų | 141.4 | 75% | 0.754 | 78% | 0.777 | S | S | * | * | trans | -131.6 | 143.7 | 179.4 | -34.3 | 175.7 | 0 | 0 | 0 | 110 | ||||
| 240 | P | 39 | Very low | 34.9 | Very low | 109 Ų | 109 | 142.7 Ų | 142.7 | 71% | 0.708 | 78% | 0.779 | S | S | * | * | -148.3 | 132.9 | 119.6 | 30.6 | -11.6 | 0 | 0 | 0 | 117.5 | |||||
| 241 | K | 30.2 | Very low | 35 | Very low | 189 Ų | 189 | 143.2 Ų | 143.2 | 82% | 0.822 | 78% | 0.779 | S | S | * | * | trans | 73.9 | 110.2 | 133.8 | -65.1 | 174.1 | -176.3 | 175.6 | 0 | 121.1 | ||||
| 242 | S | 32.6 | Very low | 35.3 | Very low | 104 Ų | 104 | 144.5 Ų | 144.5 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | trans | -61 | 163.7 | 135.7 | -177.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 243 | P | 44.6 | Very low | 35.2 | Very low | 128 Ų | 128 | 143.9 Ų | 143.9 | 83% | 0.831 | 78% | 0.777 | S | S | * | * | -122 | 140 | 123.8 | 35.4 | -32.5 | 0 | 0 | 0 | 113.5 | |||||
| 244 | E | 33.5 | Very low | 35.2 | Very low | 181 Ų | 181 | 141.7 Ų | 141.7 | 85% | 0.846 | 77% | 0.769 | S | S | * | * | trans | -99.9 | 136.1 | 172.4 | 172 | -170.7 | 147.2 | 0 | 0 | 109 | ||||
| 245 | E | 30.7 | Very low | 34.2 | Very low | 188 Ų | 188 | 144 Ų | 144 | 88% | 0.879 | 78% | 0.775 | S | S | * | * | trans | -153.2 | 125.6 | 154.2 | -134.9 | -173.7 | 151.3 | 0 | 0 | 114.6 | ||||
| 246 | A | 28.7 | Very low | 34.1 | Very low | 85 Ų | 85 | 144.2 Ų | 144.2 | 70% | 0.702 | 78% | 0.776 | S | S | * | * | trans | 44.5 | 133.1 | 144.7 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 247 | I | 37.5 | Very low | 34.3 | Very low | 154 Ų | 154 | 142 Ų | 142 | 79% | 0.79 | 78% | 0.778 | S | S | * | * | trans | -79.7 | 153.3 | 166.2 | -23.1 | 177.7 | 0 | 0 | 0 | 109.9 | ||||
| 248 | P | 45.1 | Very low | 35.1 | Very low | 102 Ų | 102 | 144.6 Ų | 144.6 | 66% | 0.662 | 78% | 0.781 | S | S | * | * | -144.6 | 154.1 | 98.7 | 38.4 | -25.3 | 0 | 0 | 0 | 114.7 | |||||
| 249 | P | 41.2 | Very low | 35.1 | Very low | 118 Ų | 118 | 145.2 Ų | 145.2 | 77% | 0.766 | 78% | 0.779 | S | S | * | * | trans | -71.7 | 148.3 | 169.3 | 32.2 | -34.8 | 0 | 0 | 0 | 111 | ||||
| 250 | K | 32.3 | Very low | 35.1 | Very low | 195 Ų | 195 | 147.3 Ų | 147.3 | 85% | 0.848 | 79% | 0.785 | S | S | * | * | trans | -125.4 | 136.4 | 168.2 | -75.6 | -173.2 | 175.3 | -179.7 | 0 | 111.3 | ||||
| 251 | K | 35.3 | Very low | 34.7 | Very low | 182 Ų | 182 | 145.9 Ų | 145.9 | 79% | 0.791 | 78% | 0.783 | S | S | * | * | trans | -90.6 | -170.1 | 163.7 | -68.2 | -179 | 171.9 | -178.1 | 0 | 109.1 | ||||
| 252 | D | 34.3 | Very low | 34.9 | Very low | 128 Ų | 128 | 143.6 Ų | 143.6 | 68% | 0.684 | 78% | 0.784 | S | S | * | * | trans | 80.7 | 84.4 | 154.4 | -46.7 | -40.3 | 0 | 0 | 0 | 116.3 | ||||
| 253 | D | 33.3 | Very low | 35 | Very low | 154 Ų | 154 | 147 Ų | 147 | 82% | 0.824 | 79% | 0.789 | S | S | * | * | -157 | 112.1 | 113.9 | -91.6 | -35.9 | 0 | 0 | 0 | 106.8 | |||||
| 254 | I | 31.7 | Very low | 34.8 | Very low | 132 Ų | 132 | 147 Ų | 147 | 68% | 0.677 | 79% | 0.789 | S | S | * | * | 61.2 | 99.3 | 66.1 | -55.4 | 175.8 | 0 | 0 | 0 | 112.3 | |||||
| 255 | L | 29.4 | Very low | 34.9 | Very low | 154 Ų | 154 | 148.5 Ų | 148.5 | 81% | 0.806 | 79% | 0.792 | S | S | * | * | trans | -164.2 | 95.8 | 133.2 | -108.1 | 169.5 | 0 | 0 | 0 | 113.5 | ||||
| 256 | K | 30.9 | Very low | 35.2 | Very low | 181 Ų | 181 | 149 Ų | 149 | 79% | 0.787 | 80% | 0.795 | S | S | * | * | trans | 41.9 | 110.1 | 145.1 | -66.6 | 176.7 | -178.9 | 176.6 | 0 | 120.6 | ||||
| 257 | S | 34 | Very low | 35.4 | Very low | 111 Ų | 111 | 148.3 Ų | 148.3 | 78% | 0.776 | 80% | 0.796 | S | S | * | * | trans | -61.4 | 162.8 | 135.2 | -35.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 258 | P | 45.9 | Very low | 35.1 | Very low | 130 Ų | 130 | 148.5 Ų | 148.5 | 84% | 0.844 | 80% | 0.799 | S | S | * | * | trans | -111 | 113.1 | 141.4 | 32.9 | -24.9 | 0 | 0 | 0 | 110.2 | ||||
| 259 | E | 32.6 | Very low | 34.9 | Very low | 178 Ų | 178 | 150.4 Ų | 150.4 | 83% | 0.832 | 80% | 0.802 | S | S | * | * | trans | -97.4 | 128.9 | 157.4 | -179 | -175.2 | 145.9 | 0 | 0 | 106.6 | ||||
| 260 | E | 33.4 | Very low | 34.7 | Very low | 191 Ų | 191 | 150.5 Ų | 150.5 | 89% | 0.893 | 80% | 0.802 | S | S | * | * | trans | -130.9 | 125.2 | 165.4 | -166 | 172.9 | -159.7 | 0 | 0 | 108.8 | ||||
| 261 | A | 31.7 | Very low | 34.6 | Very low | 79 Ų | 79 | 150.5 Ų | 150.5 | 65% | 0.653 | 80% | 0.802 | S | S | * | * | trans | -115.8 | 133.9 | -171.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 262 | V | 34 | Very low | 34.6 | Very low | 141 Ų | 141 | 146.5 Ų | 146.5 | 86% | 0.855 | 80% | 0.797 | S | S | * | * | trans | -131.9 | 136.8 | 167 | -176.4 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 263 | Q | 34.4 | Very low | 35.3 | Very low | 175 Ų | 175 | 146.7 Ų | 146.7 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | -85 | 161.2 | -171.8 | -75.1 | -178.9 | 0.1 | 0 | 0 | 113.4 | ||||
| 264 | P | 40 | Very low | 35.4 | Very low | 129 Ų | 129 | 147.9 Ų | 147.9 | 84% | 0.838 | 81% | 0.806 | S | S | * | * | trans | -67.3 | 165.4 | -179.1 | 29 | -37.8 | 0 | 0 | 0 | 113.6 | ||||
| 265 | K | 35.9 | Very low | 35.5 | Very low | 211 Ų | 211 | 150.8 Ų | 150.8 | 92% | 0.917 | 82% | 0.817 | S | S | * | * | trans | -137.4 | 171.5 | 173.6 | -74.5 | -167.9 | 175.6 | -178.5 | 0 | 112.1 | ||||
| 266 | E | 38 | Very low | 35.7 | Very low | 200 Ų | 200 | 146.8 Ų | 146.8 | 94% | 0.935 | 81% | 0.806 | S | S | * | * | trans | -125.4 | 156.3 | -151.6 | -172.9 | -177.4 | 142.1 | 0 | 0 | 111.4 | ||||
| 267 | G | 31.3 | Very low | 35.9 | Very low | 70 Ų | 70 | 146 Ų | 146 | 72% | 0.722 | 81% | 0.808 | S | S | * | * | trans | 93.8 | 151.8 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 268 | D | 33 | Very low | 35.9 | Very low | 158 Ų | 158 | 148.9 Ų | 148.9 | 85% | 0.845 | 81% | 0.81 | S | S | * | * | cis | -151.8 | 175.4 | 6.7 | -144.3 | -43.5 | 0 | 0 | 0 | 112 | ||||
| 269 | I | 39.7 | Very low | 36.4 | Very low | 142 Ų | 142 | 147.8 Ų | 147.8 | 73% | 0.728 | 80% | 0.802 | S | S | * | * | trans | -113.8 | 138 | -170.5 | -58.4 | 167.8 | 0 | 0 | 0 | 112.2 | ||||
| 270 | P | 37.8 | Very low | 36.4 | Very low | 120 Ų | 120 | 148.9 Ų | 148.9 | 78% | 0.779 | 80% | 0.804 | S | S | * | * | trans | -132.3 | 112.4 | 135.1 | 30.2 | -15.5 | 0 | 0 | 0 | 111.1 | ||||
| 271 | K | 30.2 | Very low | 36.6 | Very low | 195 Ų | 195 | 148.5 Ų | 148.5 | 85% | 0.848 | 80% | 0.803 | S | S | * | * | 68.4 | 120 | 82.1 | -89.2 | -174.9 | 173.1 | 174.9 | 0 | 115.5 | |||||
| 272 | S | 35.3 | Very low | 36.7 | Very low | 98 Ų | 98 | 152.4 Ų | 152.4 | 69% | 0.685 | 81% | 0.813 | S | S | * | * | trans | -62.9 | 169.6 | 164.8 | -166.1 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 273 | P | 48.7 | Very low | 36.4 | Very low | 131 Ų | 131 | 152.2 Ų | 152.2 | 85% | 0.851 | 81% | 0.807 | S | S | * | * | -126.6 | 147.3 | 113.1 | 36.9 | -32.7 | 0 | 0 | 0 | 114.7 | |||||
| 274 | E | 36.1 | Very low | 36.2 | Very low | 180 Ų | 180 | 147.9 Ų | 147.9 | 84% | 0.841 | 80% | 0.796 | S | S | * | * | trans | -119.7 | 127.9 | 173.3 | 175.1 | -169.3 | 142.7 | 0 | 0 | 108.7 | ||||
| 275 | E | 33.9 | Very low | 35.8 | Very low | 193 Ų | 193 | 147.8 Ų | 147.8 | 90% | 0.902 | 79% | 0.793 | S | S | * | * | trans | -160 | 151.9 | 159.7 | -86.1 | -152.4 | 98.4 | 0 | 0 | 108.3 | ||||
| 276 | A | 32.6 | Very low | 35.7 | Very low | 69 Ų | 69 | 146.9 Ų | 146.9 | 57% | 0.57 | 79% | 0.789 | S | S | * | * | cis | -172.6 | -173.8 | -20.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 277 | I | 35.9 | Very low | 35.5 | Very low | 164 Ų | 164 | 142 Ų | 142 | 84% | 0.841 | 78% | 0.778 | S | S | * | * | trans | 88.8 | 128.4 | 160.6 | -53.4 | 170.8 | 0 | 0 | 0 | 116.9 | ||||
| 278 | Q | 33.1 | Very low | 36 | Very low | 173 Ų | 173 | 145.3 Ų | 145.3 | 81% | 0.808 | 78% | 0.783 | S | S | * | * | trans | -115.5 | -158.8 | 176.1 | -60.3 | 177.3 | -2.5 | 0 | 0 | 109.4 | ||||
| 279 | P | 57.5 | Low | 36.1 | Very low | 106 Ų | 106 | 146.5 Ų | 146.5 | 69% | 0.688 | 78% | 0.784 | S | S | * | * | -119.8 | -172.8 | -78.1 | 36.9 | -21.6 | 0 | 0 | 0 | 111.3 | |||||
| 280 | K | 31.7 | Very low | 36.4 | Very low | 201 Ų | 201 | 148.4 Ų | 148.4 | 87% | 0.874 | 79% | 0.789 | S | S | * | * | trans | -165.5 | 153.4 | 142.2 | -110.4 | 150.8 | -170.5 | 172.3 | 0 | 114.3 | ||||
| 281 | E | 38.2 | Very low | 36.1 | Very low | 183 Ų | 183 | 148.4 Ų | 148.4 | 86% | 0.855 | 79% | 0.788 | S | S | * | * | trans | -87.9 | 153.3 | 171 | -56.4 | 144.2 | 116 | 0 | 0 | 109.9 | ||||
| 282 | D | 33 | Very low | 37 | Very low | 162 Ų | 162 | 146.1 Ų | 146.1 | 87% | 0.866 | 78% | 0.783 | S | S | * | * | -164.2 | 151 | 127.6 | -133 | -28.5 | 0 | 0 | 0 | 115.2 | |||||
| 283 | D | 28.3 | Very low | 37.4 | Very low | 136 Ų | 136 | 147 Ų | 147 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | trans | 40.3 | -171.2 | 159.4 | -145.5 | 12.4 | 0 | 0 | 0 | 123.7 | ||||
| 284 | S | 30.7 | Very low | 37.1 | Very low | 85 Ų | 85 | 146.6 Ų | 146.6 | 59% | 0.594 | 78% | 0.784 | S | S | * | * | trans | -137.9 | -178.9 | -139.3 | -49.6 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 285 | T | 30.6 | Very low | 37.4 | Very low | 127 Ų | 127 | 147.6 Ų | 147.6 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | trans | 83.7 | 99.4 | 158.8 | 68.4 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 286 | K | 33.7 | Very low | 38.1 | Very low | 191 Ų | 191 | 146.8 Ų | 146.8 | 83% | 0.83 | 78% | 0.781 | S | S | * | * | 48.2 | 107.3 | 110.6 | -173.8 | -132.7 | 176.2 | -174 | 0 | 118.2 | |||||
| 287 | S | 34.8 | Very low | 38.4 | Very low | 99 Ų | 99 | 148.6 Ų | 148.6 | 69% | 0.692 | 79% | 0.79 | S | S | * | * | -175.2 | 150.9 | 106 | -75.9 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 288 | V | 40.7 | Very low | 39 | Very low | 138 Ų | 138 | 147.5 Ų | 147.5 | 84% | 0.836 | 79% | 0.786 | S | S | * | * | trans | -21.8 | 132 | 158.3 | -178 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 289 | E | 36.4 | Very low | 39.5 | Very low | 184 Ų | 184 | 146.5 Ų | 146.5 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | -152.5 | 155.1 | 126.1 | -164.9 | 133.5 | 100.8 | 0 | 0 | 110.5 | |||||
| 290 | E | 44.4 | Very low | 38.8 | Very low | 181 Ų | 181 | 149.2 Ų | 149.2 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | trans | -103.7 | 117.2 | -178.8 | 177.1 | -171.9 | 128 | 0 | 0 | 110 | ||||
| 291 | T | 32.9 | Very low | 39.1 | Very low | 121 Ų | 121 | 148.5 Ų | 148.5 | 74% | 0.742 | 79% | 0.789 | S | S | * | * | trans | -156.6 | 121.8 | 166.1 | -74.2 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 292 | I | 49.4 | Very low | 39.4 | Very low | 147 Ų | 147 | 144.9 Ų | 144.9 | 75% | 0.754 | 78% | 0.782 | S | S | * | * | trans | 14.9 | 113.6 | 148.8 | -46.6 | 174.6 | 0 | 0 | 0 | 117.4 | ||||
| 293 | P | 42.6 | Very low | 40.2 | Very low | 116 Ų | 116 | 146.4 Ų | 146.4 | 75% | 0.753 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 139.8 | 160.9 | 32.6 | -32.5 | 0 | 0 | 0 | 111.5 | ||
| 294 | P | 42.6 | Very low | 41.2 | Very low | 122 Ų | 122 | 147.7 Ų | 147.7 | 79% | 0.792 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 164.2 | 168.8 | 33 | -35 | 0 | 0 | 0 | 111.6 | ||
| 295 | K | 42.9 | Very low | 41.9 | Very low | 202 Ų | 202 | 151.7 Ų | 151.7 | 88% | 0.878 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 143.4 | 162.9 | -57.4 | 176.8 | -178.5 | 178.8 | 0 | 109.1 | ||
| 296 | E | 47.9 | Very low | 42.3 | Very low | 176 Ų | 176 | 151.2 Ų | 151.2 | 82% | 0.822 | 79% | 0.792 | S | S | * | * | 173.1 | 126.4 | 117.7 | -166.6 | 159.5 | 107.8 | 0 | 0 | 110.1 | |||||
| 297 | S | 39.6 | Very low | 43.1 | Very low | 107 Ų | 107 | 146.2 Ų | 146.2 | 75% | 0.748 | 78% | 0.777 | S | S | * | * | trans | -166.9 | 104.6 | 167.1 | 61.5 | 0 | 0 | 0 | 0 | 109 | I299 | S297-I299 PolarHBondContact O-N 2.64Š| ||
| 298 | D | 47.1 | Very low | 43.7 | Very low | 141 Ų | 141 | 150.3 Ų | 150.3 | 75% | 0.754 | 79% | 0.785 | S | S | * | * | trans | -61.9 | 130.3 | 179.7 | -71.1 | -72.8 | 0 | 0 | 0 | 112.5 | ||||
| 299 | I | 43.8 | Very low | 44 | Very low | 152 Ų | 152 | 150.6 Ų | 150.6 | 78% | 0.779 | 78% | 0.776 | S | S | * | * | trans | -128.2 | 101.5 | 157.1 | -60.5 | -178.5 | 0 | 0 | 0 | 106.2 | S297 K301 | S297-I299 PolarHBondContact O-N 2.64Å; I299-K301 PolarHBondContact O-N 3.19Å | ||
| 300 | L | 42.6 | Very low | 44.8 | Very low | 163 Ų | 163 | 146 Ų | 146 | 85% | 0.853 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 117.9 | 171.5 | -68 | 167.5 | 0 | 0 | 0 | 108.8 | ||
| 301 | K | 38.3 | Very low | 45.4 | Very low | 185 Ų | 185 | 147.1 Ų | 147.1 | 80% | 0.804 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 152.5 | 166.8 | -103.9 | -174.5 | 170.5 | -170.2 | 0 | 109.4 | I299 | I299-K301 PolarHBondContact O-N 3.19Š|
| 302 | P | 44.8 | Very low | 47.4 | Very low | 108 Ų | 108 | 143.5 Ų | 143.5 | 70% | 0.701 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 144.5 | 165.8 | -20.2 | 32.9 | 0 | 0 | 0 | 110.6 | E304 | P302-E304 VanDerWaalsContact C-N 3.32Å; P302-E304 PolarHBondContact O-N 2.61Å |
| 303 | E | 49.5 | Very low | 49.2 | Very low | 194 Ų | 194 | 138.3 Ų | 138.3 | 91% | 0.907 | 72% | 0.722 | S | S | * | * | trans | -75.2 | 87.5 | 172.4 | -68.2 | 168.2 | -166.8 | 0 | 0 | 108.2 | E305 | E303-E305 PolarHBondContact O-N 3.07Å; E303-E305 VanDerWaalsContact O-N 3.16Å | ||
| 304 | E | 49 | Very low | 51.7 | Low | 162 Ų | 162 | 137.2 Ų | 137.2 | 76% | 0.757 | 71% | 0.71 | S | S | * | * | trans | -57.3 | 115 | 163.4 | -66.9 | -88.3 | 122.6 | 0 | 0 | 107.2 | P302 T306 | P302-E304 VanDerWaalsContact C-N 3.32Å; P302-E304 PolarHBondContact O-N 2.61Å; E304-T306 PolarHBondContact O-N 2.89Å; E304-T306 PolarHBondContact O-OG1 2.61Å | ||
| 305 | E | 46.9 | Very low | 54.3 | Low | 170 Ų | 170 | 132.2 Ų | 132.2 | 79% | 0.794 | 68% | 0.677 | S | S | * | * | trans | -60.9 | 88.3 | 178.4 | -173.1 | -178.9 | 147.3 | 0 | 0 | 108.7 | E303 T307 | E303-E305 PolarHBondContact O-N 3.07Å; E303-E305 VanDerWaalsContact O-N 3.16Å; E305-T307 VanDerWaalsContact C-N 3.34Å; E305-T307 PolarHBondContact O-N 3.21Å | ||
| 306 | T | 38.5 | Very low | 57 | Low | 117 Ų | 117 | 125.9 Ų | 125.9 | 72% | 0.718 | 65% | 0.649 | S | S | * | * | trans | -77.9 | 90.3 | -170.7 | -56.6 | 0 | 0 | 0 | 0 | 106.9 | E304 E308 | E304-T306 PolarHBondContact O-N 2.89Å; E304-T306 PolarHBondContact O-OG1 2.61Å; T306-E308 PolarHBondContact O-N 2.9Å | ||
| 307 | T | 50.8 | Low | 59.3 | Low | 86 Ų | 86 | 121.2 Ų | 121.2 | 53% | 0.528 | 63% | 0.632 | S | S | . | * | trans | -53 | 116.8 | 168.2 | 42.8 | 0 | 0 | 0 | 0 | 107.5 | E305 F309 | E305-T307 VanDerWaalsContact C-N 3.34Å; E305-T307 PolarHBondContact O-N 3.21Å; T307-F309 WeakPolarHBondContact O-CD2 3.45Å; T307-F309 PolarHBondContact O-N 3.33Å | ||
| 308 | E | 46.7 | Very low | 62.1 | Low | 185 Ų | 185 | 116.2 Ų | 116.2 | 86% | 0.864 | 60% | 0.598 | S | S | * | * | trans | -66.6 | 88.3 | 174.7 | -67.6 | -168.1 | -174.8 | 0 | 0 | 108 | T306 L310 | T306-E308 PolarHBondContact O-N 2.9Å; E308-L310 PolarHBondContact O-N 2.57Å | ||
| 309 | F | 48 | Very low | 64.5 | Low | 144 Ų | 144 | 116.1 Ų | 116.1 | 63% | 0.632 | 60% | 0.596 | S | S | * | * | trans | -55.5 | 122.2 | 171.2 | -91.2 | -94.1 | 0 | 0 | 0 | 107.6 | T307 E311 | T307-F309 WeakPolarHBondContact O-CD2 3.45Å; T307-F309 PolarHBondContact O-N 3.33Å; F309-E311 PolarHBondContact O-N 3.47Å | ||
| 310 | L | 52.8 | Low | 67.1 | Low | 86 Ų | 86 | 110.9 Ų | 110.9 | 45% | 0.45 | 57% | 0.573 | S | S | . | * | trans | -68.7 | 100.6 | 170.4 | -60.6 | 176.6 | 0 | 0 | 0 | 106.7 | E308 G312 D313 | E308-L310 PolarHBondContact O-N 2.57Å; L310-G312 PolarHBondContact O-N 2.95Å; L310-D313 PolarHBondContact O-N 3.15Å | ||
| 311 | E | 55.7 | Low | 69.7 | Low | 206 Ų | 206 | 105.6 Ų | 105.6 | 96% | 0.963 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.6 | 75 | -176.6 | -65.1 | -173.4 | 127.6 | 0 | 0 | 111.5 | F309 | F309-E311 PolarHBondContact O-N 3.47Š|
| 312 | G | 75.4 | Confident | 72.6 | Confident | 44 Ų | 44 | 103.1 Ų | 103.1 | 45% | 0.454 | 54% | 0.535 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 148.6 | 22.8 | -178.9 | 0 | 0 | 0 | 0 | 0 | 116.8 | L310 M360 | L310-G312 PolarHBondContact O-N 2.95Å; G312-M360 WeakPolarHBondContact O-CE 3.28Å |
| 313 | D | 88.6 | Confident | 75.1 | Confident | 38 Ų | 38 | 100 Ų | 100 | 20% | 0.203 | 51% | 0.512 | C | S | . | . | trans | -72.7 | 164.1 | 167.4 | 76.1 | 73.7 | 0 | 0 | 0 | 112.8 | L310 V315 H356 M360 | L310-D313 PolarHBondContact O-N 3.15Å; D313-V315 WeakPolarHBondContact OD1-CB 3.29Å; D313-V315 PolarHBondContact OD1-N 3.08Å; D313-H356 HydrophobicContact CB-CB 3.97Å; D313-H356 WeakPolarHBondContact CB-CE1 3.46Å; D313-H356 IonicContact OD1-CE1 2.7Å; D313-H356 PolarHBondContact OD1-CE1 2.89Å; D313-H356 IonicContact OD1-ND1 3.85Å; D313-H356 PolarHBondContact OD1-ND1 2.87Å; D313-H356 IonicContact OD1-NE2 2.68Å; D313-H356 CovalentContact OD2-CE1 1.77Å; D313-H356 IonicContact OD2-CE1 3.92Å; D313-H356 PolarHBondContact OD2-CE1 2.81Å; D313-H356 IonicContact OD2-CG 2.76Å; D313-H356 IonicContact OD2-ND1 2.87Å; D313-H356 PolarHBondContact OD2-ND1 2.89Å; D313-H356 IonicContact OD2-NE2 2.7Å; D313-H356 PolarHBondContact OD2-NE2 2.62Å; D313-M360 HydrophobicContact CB-CG 4.5Å | ||
| 314 | N | 94.6 | Very high | 77.4 | Confident | 94 Ų | 94 | 91.3 Ų | 91.3 | 50% | 0.503 | 47% | 0.471 | S | S | . | . | trans | -110.7 | 27.9 | -179.7 | -63.8 | -52.1 | 0 | 0 | 0 | 112.1 | S359 | N314-S359 PolarHBondContact N-OG 3.4Å; N314-S359 PolarHBondContact ND2-O 3.46Å | ||
| 315 | V | 97.9 | Very high | 79.8 | Confident | 17 Ų | 17 | 87.4 Ų | 87.4 | 10% | 0.103 | 45% | 0.453 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.5 | 119 | -178.7 | -174.8 | 0 | 0 | 0 | 0 | 110.4 | D313 V317 F355 H356 F367 E369 | D313-V315 WeakPolarHBondContact OD1-CB 3.29Å; D313-V315 PolarHBondContact OD1-N 3.08Å; V315-V317 PolarHBondContact O-N 3.39Å; V315-F355 HydrophobicContact CG1-CD1 4.36Å; V315-F355 HydrophobicContact CG1-CE1 3.91Å; V315-F355 HydrophobicContact CG2-CD1 4.12Å; V315-F355 HydrophobicContact CG2-CE1 4.22Å; V315-H356 HydrophobicContact CG2-CB 4.35Å; V315-F367 HydrophobicContact CG2-CB 4.09Å; V315-E369 HydrophobicContact CG1-CB 3.8Å |
| 316 | K | 97.8 | Very high | 82.2 | Confident | 69 Ų | 69 | 81.5 Ų | 81.5 | 30% | 0.3 | 43% | 0.433 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.2 | 113 | 172.5 | -178.4 | -177.7 | 175 | -174.4 | 0 | 110.1 | I318 D323 S327 F367 L368 E369 | K316-I318 HydrophobicContact CD-CD1 4.22Å; K316-I318 HydrophobicContact CG-CD1 4.35Å; K316-I318 PolarHBondContact O-N 3.33Å; K316-D323 VanDerWaalsContact CE-OD1 3.25Å; K316-D323 WeakPolarHBondContact CE-OD1 3.11Å; K316-D323 WeakPolarHBondContact CE-OD2 3.43Å; K316-D323 IonicContact NZ-OD1 1.77Å; K316-D323 PolarHBondContact NZ-OD1 2.87Å; K316-D323 IonicContact NZ-OD2 2.67Å; K316-S327 WeakPolarHBondContact CE-OG 3.31Å; K316-S327 PolarHBondContact NZ-OG 2.78Å; K316-F367 PolarHBondContact N-O 2.81Å; K316-L368 HydrophobicContact CB-CD2 3.84Å; K316-L368 HydrophobicContact CD-CD2 4.25Å; K316-L368 HydrophobicContact CG-CD2 4.41Å; K316-L368 VanDerWaalsContact O-CA 3.3Å; K316-L368 WeakPolarHBondContact O-CA 3.35Å; K316-E369 PolarHBondContact O-N 2.93Å |
| 317 | V | 97.9 | Very high | 85.1 | Confident | 77 Ų | 77 | 76.1 Ų | 76.1 | 47% | 0.467 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.2 | 127.5 | 167.6 | -177.5 | 0 | 0 | 0 | 0 | 109.4 | V315 L319 | V315-V317 PolarHBondContact O-N 3.39Å; V317-L319 HydrophobicContact CG1-CD2 4Å |
| 318 | I | 98.4 | Very high | 87.3 | Confident | 3 Ų | 3 | 72.8 Ų | 72.8 | 2% | 0.015 | 38% | 0.379 | C | S | . | . | trans | -92.5 | 131.7 | 178.1 | -63.6 | -57.8 | 0 | 0 | 0 | 109.7 | K316 S320 F324 S327 L368 E369 V370 | K316-I318 HydrophobicContact CD-CD1 4.22Å; K316-I318 HydrophobicContact CG-CD1 4.35Å; K316-I318 PolarHBondContact O-N 3.33Å; I318-S320 WeakPolarHBondContact CG2-O 3.36Å; I318-F324 HydrophobicContact CG1-CD2 4.3Å; I318-F324 HydrophobicContact CG2-CB 3.85Å; I318-F324 HydrophobicContact CG2-CD2 4.33Å; I318-S327 WeakPolarHBondContact CD1-OG 3.5Å; I318-L368 HydrophobicContact CD1-CD1 4.21Å; I318-L368 HydrophobicContact CD1-CD2 4.15Å; I318-L368 HydrophobicContact CG1-CB 4.09Å; I318-L368 HydrophobicContact CG1-CD1 4.37Å; I318-E369 WeakPolarHBondContact CB-O 3.03Å; I318-E369 PolarHBondContact N-O 3.4Å; I318-V370 HydrophobicContact CB-CG2 3.96Å; I318-V370 HydrophobicContact CG1-CG2 4.09Å; I318-V370 HydrophobicContact CG2-CG2 4.25Å | ||
| 319 | L | 96.8 | Very high | 89.8 | Confident | 138 Ų | 138 | 68.8 Ų | 68.8 | 72% | 0.723 | 36% | 0.359 | S | S | * | . | trans | -117.5 | -7.1 | -176.1 | -58.6 | 178.3 | 0 | 0 | 0 | 114.3 | V317 | V317-L319 HydrophobicContact CG1-CD2 4Š| ||
| 320 | S | 97.9 | Very high | 92.1 | Very high | 42 Ų | 42 | 68.7 Ų | 68.7 | 29% | 0.294 | 36% | 0.361 | S | S | . | . | S | Bend | trans | -160 | 171 | 172 | 87.5 | 0 | 0 | 0 | 0 | 111.8 | I318 E322 D323 F324 | I318-S320 WeakPolarHBondContact CG2-O 3.36Å; S320-E322 VanDerWaalsContact CB-OE2 3.24Å; S320-E322 WeakPolarHBondContact CB-OE2 3.28Å; S320-E322 PolarHBondContact OG-N 3Å; S320-E322 PolarHBondContact OG-OE2 3.28Å; S320-D323 PolarHBondContact O-N 2.94Å; S320-D323 PolarHBondContact OG-N 3.07Å; S320-F324 PolarHBondContact O-N 3.21Å |
| 321 | K | 97.6 | Very high | 94.2 | Very high | 52 Ų | 52 | 65 Ų | 65 | 23% | 0.226 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -64.2 | -38.5 | 174.5 | 176 | 170.2 | 170.6 | 171.7 | 0 | 113 | D323 F324 E325 E377 V378 D381 | K321-D323 VanDerWaalsContact C-N 3.28Å; K321-D323 PolarHBondContact O-N 3Å; K321-F324 WeakPolarHBondContact O-CB 3.32Å; K321-F324 PolarHBondContact O-N 3.21Å; K321-E325 WeakPolarHBondContact O-CB 3.31Å; K321-E325 PolarHBondContact O-N 3.28Å; K321-E377 HydrophobicContact CD-CG 3.94Å; K321-E377 WeakPolarHBondContact CD-OE1 3.37Å; K321-E377 IonicContact NZ-OE1 3.32Å; K321-E377 PolarHBondContact NZ-OE1 2.85Å; K321-V378 HydrophobicContact CB-CG2 3.97Å; K321-D381 WeakPolarHBondContact CE-OD2 3.28Å; K321-D381 IonicContact NZ-OD2 2.72Å; K321-D381 PolarHBondContact NZ-OD2 3.44Å |
| 322 | E | 98.2 | Very high | 96.2 | Very high | 134 Ų | 134 | 56.8 Ų | 56.8 | 63% | 0.626 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -63.6 | -37.3 | 175.6 | -57.1 | 80.3 | -178.6 | 0 | 0 | 111.3 | S320 A326 | S320-E322 VanDerWaalsContact CB-OE2 3.24Å; S320-E322 WeakPolarHBondContact CB-OE2 3.28Å; S320-E322 PolarHBondContact OG-N 3Å; S320-E322 PolarHBondContact OG-OE2 3.28Å; E322-A326 WeakPolarHBondContact O-CB 3.26Å; E322-A326 PolarHBondContact O-N 3.29Å |
| 323 | D | 98.1 | Very high | 97.1 | Very high | 42 Ų | 42 | 61.5 Ų | 61.5 | 23% | 0.225 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -71.7 | -36.8 | 175.8 | -170 | 46.6 | 0 | 0 | 0 | 112.3 | K316 S320 K321 S327 | K316-D323 VanDerWaalsContact CE-OD1 3.25Å; K316-D323 WeakPolarHBondContact CE-OD1 3.11Å; K316-D323 WeakPolarHBondContact CE-OD2 3.43Å; K316-D323 IonicContact NZ-OD1 1.77Å; K316-D323 PolarHBondContact NZ-OD1 2.87Å; K316-D323 IonicContact NZ-OD2 2.67Å; S320-D323 PolarHBondContact O-N 2.94Å; S320-D323 PolarHBondContact OG-N 3.07Å; K321-D323 VanDerWaalsContact C-N 3.28Å; K321-D323 PolarHBondContact O-N 3Å; D323-S327 WeakPolarHBondContact O-CB 3.4Å; D323-S327 PolarHBondContact O-N 3.34Å; D323-S327 PolarHBondContact O-OG 3.1Å |
| 324 | F | 98.5 | Very high | 97.6 | Very high | 12 Ų | 12 | 64.9 Ų | 64.9 | 5% | 0.053 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -60 | -54.9 | 170.8 | -172.8 | -112 | 0 | 0 | 0 | 111.6 | I318 S320 K321 A326 S327 L328 V338 F340 L368 V370 V378 Y393 | I318-F324 HydrophobicContact CG1-CD2 4.3Å; I318-F324 HydrophobicContact CG2-CB 3.85Å; I318-F324 HydrophobicContact CG2-CD2 4.33Å; S320-F324 PolarHBondContact O-N 3.21Å; K321-F324 WeakPolarHBondContact O-CB 3.32Å; K321-F324 PolarHBondContact O-N 3.21Å; F324-A326 VanDerWaalsContact C-N 3.34Å; F324-A326 PolarHBondContact O-N 2.93Å; F324-S327 WeakPolarHBondContact O-CB 3.2Å; F324-S327 PolarHBondContact O-N 3.48Å; F324-S327 VanDerWaalsContact O-N 3.13Å; F324-L328 HydrophobicContact CD1-CD1 4.17Å; F324-L328 HydrophobicContact CE1-CD1 3.71Å; F324-L328 HydrophobicContact CE1-CG 4.45Å; F324-L328 HydrophobicContact CZ-CD1 4.07Å; F324-L328 PolarHBondContact O-N 2.89Å; F324-L328 VanDerWaalsContact O-N 3.07Å; F324-V338 HydrophobicContact CE2-CG1 3.95Å; F324-V338 HydrophobicContact CE2-CG2 4.03Å; F324-V338 HydrophobicContact CZ-CG2 4.45Å; F324-F340 HydrophobicContact CE2-CZ 4.4Å; F324-F340 HydrophobicContact CZ-CZ 4.25Å; F324-L368 HydrophobicContact CD2-CD1 4.25Å; F324-L368 HydrophobicContact CE2-CD1 4.21Å; F324-V370 HydrophobicContact CD2-CG2 4.27Å; F324-V370 HydrophobicContact CE2-CG2 4.35Å; F324-V378 HydrophobicContact CB-CG1 4.17Å; F324-V378 HydrophobicContact CB-CG2 4.31Å; F324-V378 HydrophobicContact CD1-CG1 3.6Å; F324-V378 HydrophobicContact CD2-CG1 3.96Å; F324-V378 HydrophobicContact CE1-CG1 3.89Å; F324-V378 HydrophobicContact CE2-CG1 4.24Å; F324-V378 HydrophobicContact CG-CG1 3.63Å; F324-V378 HydrophobicContact CZ-CG1 4.2Å; F324-Y393 HydrophobicContact CZ-CE2 4.09Å; F324-Y393 AromaticContact CZ-CZ 3.89Å |
| 325 | E | 98.1 | Very high | 97.8 | Very high | 79 Ų | 79 | 60.4 Ų | 60.4 | 37% | 0.369 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -59.1 | -42.7 | 177.8 | -78.9 | -168.2 | -139.7 | 0 | 0 | 112.3 | K321 S327 L328 K329 | K321-E325 WeakPolarHBondContact O-CB 3.31Å; K321-E325 PolarHBondContact O-N 3.28Å; E325-S327 VanDerWaalsContact C-N 3.3Å; E325-S327 PolarHBondContact O-N 2.95Å; E325-L328 PolarHBondContact O-N 2.96Å; E325-K329 WeakPolarHBondContact O-CB 3.46Å; E325-K329 VanDerWaalsContact O-CD 3.27Å; E325-K329 WeakPolarHBondContact O-CD 3.4Å; E325-K329 VanDerWaalsContact O-CG 3.28Å; E325-K329 WeakPolarHBondContact O-CG 3.47Å; E325-K329 PolarHBondContact O-N 3.09Å; E325-K329 VanDerWaalsContact O-N 3.09Å; E325-K329 IonicContact OE2-NZ 3.45Å; E325-K329 PolarHBondContact OE2-NZ 3.16Å |
| 326 | A | 98.4 | Very high | 97.8 | Very high | 46 Ų | 46 | 59.8 Ų | 59.8 | 38% | 0.38 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -62.1 | -39.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | E322 F324 K329 E330 | E322-A326 WeakPolarHBondContact O-CB 3.26Å; E322-A326 PolarHBondContact O-N 3.29Å; F324-A326 VanDerWaalsContact C-N 3.34Å; F324-A326 PolarHBondContact O-N 2.93Å; A326-K329 PolarHBondContact O-N 2.95Å; A326-E330 VanDerWaalsContact O-CB 3.31Å; A326-E330 WeakPolarHBondContact O-CB 3.37Å; A326-E330 PolarHBondContact O-N 3.37Å |
| 327 | S | 98.1 | Very high | 97.8 | Very high | 5 Ų | 5 | 56.5 Ų | 56.5 | 4% | 0.035 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -66.2 | -41.3 | 178.4 | -55.1 | 0 | 0 | 0 | 0 | 112.5 | K316 I318 D323 F324 E325 K329 E330 A331 | K316-S327 WeakPolarHBondContact CE-OG 3.31Å; K316-S327 PolarHBondContact NZ-OG 2.78Å; I318-S327 WeakPolarHBondContact CD1-OG 3.5Å; D323-S327 WeakPolarHBondContact O-CB 3.4Å; D323-S327 PolarHBondContact O-N 3.34Å; D323-S327 PolarHBondContact O-OG 3.1Å; F324-S327 WeakPolarHBondContact O-CB 3.2Å; F324-S327 PolarHBondContact O-N 3.48Å; F324-S327 VanDerWaalsContact O-N 3.13Å; E325-S327 VanDerWaalsContact C-N 3.3Å; E325-S327 PolarHBondContact O-N 2.95Å; S327-K329 VanDerWaalsContact C-N 3.33Å; S327-E330 PolarHBondContact O-N 3.21Å; S327-A331 PolarHBondContact O-N 3.32Å |
| 328 | L | 98.1 | Very high | 97.9 | Very high | 15 Ų | 15 | 52.8 Ų | 52.8 | 8% | 0.079 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63 | -40.2 | 174 | -65 | -179.5 | 0 | 0 | 0 | 111.6 | F324 E325 A331 V336 Y393 E396 | F324-L328 HydrophobicContact CD1-CD1 4.17Å; F324-L328 HydrophobicContact CE1-CD1 3.71Å; F324-L328 HydrophobicContact CE1-CG 4.45Å; F324-L328 HydrophobicContact CZ-CD1 4.07Å; F324-L328 PolarHBondContact O-N 2.89Å; F324-L328 VanDerWaalsContact O-N 3.07Å; E325-L328 PolarHBondContact O-N 2.96Å; L328-A331 PolarHBondContact O-N 2.85Å; L328-V336 HydrophobicContact CD2-CB 4.14Å; L328-V336 HydrophobicContact CD2-CG1 4.07Å; L328-V336 HydrophobicContact CD2-CG2 4.05Å; L328-Y393 HydrophobicContact CD1-CD1 4.17Å; L328-Y393 HydrophobicContact CD1-CE1 4.19Å; L328-Y393 HydrophobicContact CD2-CD1 4.18Å; L328-Y393 HydrophobicContact CD2-CD2 3.99Å; L328-Y393 HydrophobicContact CD2-CG 3.79Å; L328-E396 HydrophobicContact CB-CG 4.19Å |
| 329 | K | 98 | Very high | 97.9 | Very high | 101 Ų | 101 | 52.7 Ų | 52.7 | 44% | 0.439 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -69.7 | -36.9 | 177.9 | -70.8 | 158.7 | -166.9 | 168.5 | 0 | 112.5 | E325 A326 S327 E396 | E325-K329 WeakPolarHBondContact O-CB 3.46Å; E325-K329 VanDerWaalsContact O-CD 3.27Å; E325-K329 WeakPolarHBondContact O-CD 3.4Å; E325-K329 VanDerWaalsContact O-CG 3.28Å; E325-K329 WeakPolarHBondContact O-CG 3.47Å; E325-K329 PolarHBondContact O-N 3.09Å; E325-K329 VanDerWaalsContact O-N 3.09Å; E325-K329 IonicContact OE2-NZ 3.45Å; E325-K329 PolarHBondContact OE2-NZ 3.16Å; A326-K329 PolarHBondContact O-N 2.95Å; S327-K329 VanDerWaalsContact C-N 3.33Å; K329-E396 WeakPolarHBondContact CE-OE2 3.43Å; K329-E396 HydrophobicContact CG-CG 4.12Å; K329-E396 VanDerWaalsContact CG-OE2 3.28Å; K329-E396 WeakPolarHBondContact CG-OE2 3.4Å |
| 330 | E | 97.9 | Very high | 98 | Very high | 143 Ų | 143 | 46.1 Ų | 46.1 | 67% | 0.668 | 23% | 0.234 | S | C | * | . | H | α-helix | trans | -75.1 | -24.6 | 176.7 | -175.1 | 173.4 | -169.3 | 0 | 0 | 113.3 | A326 S327 R334 | A326-E330 VanDerWaalsContact O-CB 3.31Å; A326-E330 WeakPolarHBondContact O-CB 3.37Å; A326-E330 PolarHBondContact O-N 3.37Å; S327-E330 PolarHBondContact O-N 3.21Å; E330-R334 PolarHBondContact O-NH2 2.63Å; E330-R334 VanDerWaalsContact O-NH2 3.07Å |
| 331 | A | 96.9 | Very high | 98 | Very high | 7 Ų | 7 | 44.3 Ų | 44.3 | 6% | 0.058 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -65.1 | -39.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | S327 L328 E333 R334 V336 V366 | S327-A331 PolarHBondContact O-N 3.32Å; L328-A331 PolarHBondContact O-N 2.85Å; A331-E333 PolarHBondContact O-N 2.86Å; A331-R334 WeakPolarHBondContact O-CB 3.31Å; A331-R334 PolarHBondContact O-N 3.34Å; A331-R334 PolarHBondContact O-NE 3.43Å; A331-V336 HydrophobicContact CB-CG2 3.26Å; A331-V366 HydrophobicContact CB-CB 4.43Å; A331-V366 HydrophobicContact CB-CG2 3.91Å |
| 332 | G | 96 | Very high | 98 | Very high | 35 Ų | 35 | 41.9 Ų | 41.9 | 36% | 0.361 | 21% | 0.211 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 68.4 | -110.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | K395 | G332-K395 PolarHBondContact O-N 3.19Š|
| 333 | E | 96.1 | Very high | 97.9 | Very high | 142 Ų | 142 | 40.4 Ų | 40.4 | 66% | 0.664 | 21% | 0.211 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -91.3 | -8.8 | 176.7 | -54.6 | -156.1 | 116.4 | 0 | 0 | 113.7 | A331 K395 | A331-E333 PolarHBondContact O-N 2.86Å; E333-K395 WeakPolarHBondContact OE1-CE 3.44Å; E333-K395 IonicContact OE1-NZ 2.61Å; E333-K395 PolarHBondContact OE1-NZ 3Å |
| 334 | R | 97.7 | Very high | 97.8 | Very high | 109 Ų | 109 | 46.2 Ų | 46.2 | 41% | 0.411 | 23% | 0.23 | S | C | . | . | S | Bend | trans | -65.3 | 150.6 | 175.8 | -67.6 | -179.9 | -72.3 | 171.7 | -2.1 | 110.8 | E330 A331 V366 | E330-R334 PolarHBondContact O-NH2 2.63Å; E330-R334 VanDerWaalsContact O-NH2 3.07Å; A331-R334 WeakPolarHBondContact O-CB 3.31Å; A331-R334 PolarHBondContact O-N 3.34Å; A331-R334 PolarHBondContact O-NE 3.43Å; R334-V366 HydrophobicContact CB-CG2 4.41Å |
| 335 | L | 98.5 | Very high | 97.8 | Very high | 1 Ų | 1 | 46 Ų | 46 | 1% | 0.005 | 23% | 0.23 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -65.1 | 138 | 165.1 | -175.4 | 67.1 | 0 | 0 | 0 | 109 | V365 V366 F392 K394 V399 L417 K418 | L335-V365 HydrophobicContact CB-CG1 4.11Å; L335-V365 HydrophobicContact CB-CG2 4.15Å; L335-V365 HydrophobicContact CD2-CG1 4.09Å; L335-V365 HydrophobicContact CD2-CG2 4.15Å; L335-V365 HydrophobicContact CG-CG1 4.11Å; L335-V365 WeakPolarHBondContact O-CA 3.48Å; L335-V365 WeakPolarHBondContact O-CG1 3.4Å; L335-V366 PolarHBondContact O-N 3.12Å; L335-F392 HydrophobicContact CD1-CB 4.28Å; L335-K394 HydrophobicContact CB-CG 4.48Å; L335-K394 HydrophobicContact CD1-CD 4.46Å; L335-K394 HydrophobicContact CD1-CG 4.07Å; L335-V399 HydrophobicContact CD1-CG2 4.38Å; L335-L417 HydrophobicContact CD1-CB 3.82Å; L335-L417 HydrophobicContact CD1-CD1 4.42Å; L335-L417 HydrophobicContact CD2-CB 3.95Å; L335-K418 HydrophobicContact CD2-CB 4.06Å |
| 336 | V | 98.8 | Very high | 97.8 | Very high | 3 Ų | 3 | 43.5 Ų | 43.5 | 2% | 0.018 | 23% | 0.226 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -111.2 | 129.1 | 166.1 | -167.8 | 0 | 0 | 0 | 0 | 108.3 | L328 A331 V338 V366 L368 F392 Y393 | L328-V336 HydrophobicContact CD2-CB 4.14Å; L328-V336 HydrophobicContact CD2-CG1 4.07Å; L328-V336 HydrophobicContact CD2-CG2 4.05Å; A331-V336 HydrophobicContact CB-CG2 3.26Å; V336-V338 HydrophobicContact CG1-CG2 4.04Å; V336-V366 CarbonylContact C-O 3.52Å; V336-V366 VanDerWaalsContact CA-O 3.31Å; V336-V366 WeakPolarHBondContact CA-O 3.37Å; V336-V366 HydrophobicContact CG1-CB 4.24Å; V336-V366 HydrophobicContact CG1-CG1 4.28Å; V336-V366 HydrophobicContact CG2-CB 4.27Å; V336-L368 HydrophobicContact CG1-CD1 3.61Å; V336-L368 HydrophobicContact CG1-CG 3.7Å; V336-F392 CarbonylContact O-C 3.54Å; V336-F392 VanDerWaalsContact O-CA 3.28Å; V336-F392 WeakPolarHBondContact O-CA 3.38Å; V336-Y393 PolarHBondContact N-O 3.1Å; V336-Y393 PolarHBondContact O-N 3.38Å |
| 337 | A | 98.7 | Very high | 97.8 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 23% | 0.229 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -109.9 | 129 | 169.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | F355 V365 V366 F367 L368 F392 I414 | A337-F355 HydrophobicContact CB-CE2 4.18Å; A337-V365 HydrophobicContact CB-CG1 4.3Å; A337-V366 PolarHBondContact N-O 2.04Å; A337-F367 HydrophobicContact CB-CD1 4.26Å; A337-F367 HydrophobicContact CB-CE1 4.31Å; A337-F367 WeakPolarHBondContact O-CA 3.34Å; A337-L368 PolarHBondContact O-N 2.63Å; A337-F392 HydrophobicContact CB-CD1 3.87Å; A337-F392 HydrophobicContact CB-CE1 3.72Å; A337-I414 HydrophobicContact CB-CD1 4.43Å |
| 338 | V | 98.8 | Very high | 97.8 | Very high | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 23% | 0.228 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -120.9 | 119 | -175.7 | -171.2 | 0 | 0 | 0 | 0 | 109.7 | F324 V336 F340 L368 V370 F390 Q391 Y393 | F324-V338 HydrophobicContact CE2-CG1 3.95Å; F324-V338 HydrophobicContact CE2-CG2 4.03Å; F324-V338 HydrophobicContact CZ-CG2 4.45Å; V336-V338 HydrophobicContact CG1-CG2 4.04Å; V338-F340 HydrophobicContact CB-CD2 4.38Å; V338-F340 HydrophobicContact CB-CE2 3.95Å; V338-F340 HydrophobicContact CG1-CD2 3.85Å; V338-F340 HydrophobicContact CG1-CE1 4.42Å; V338-F340 HydrophobicContact CG1-CE2 3.46Å; V338-F340 VanDerWaalsContact CG1-CE2 3.46Å; V338-F340 HydrophobicContact CG1-CG 4.49Å; V338-F340 HydrophobicContact CG1-CZ 3.79Å; V338-L368 WeakPolarHBondContact CA-O 3.39Å; V338-L368 HydrophobicContact CG1-CB 4.24Å; V338-L368 HydrophobicContact CG2-CB 4.21Å; V338-L368 HydrophobicContact CG2-CD1 4.12Å; V338-L368 HydrophobicContact CG2-CG 4.44Å; V338-V370 HydrophobicContact CG1-CG2 3.7Å; V338-F390 VanDerWaalsContact O-CA 3.28Å; V338-F390 WeakPolarHBondContact O-CA 3.43Å; V338-Q391 PolarHBondContact N-O 3.23Å; V338-Q391 PolarHBondContact O-N 3.28Å; V338-Q391 VanDerWaalsContact O-N 3.12Å; V338-Y393 HydrophobicContact CB-CE2 4.49Å; V338-Y393 HydrophobicContact CG2-CD2 3.9Å; V338-Y393 HydrophobicContact CG2-CE2 3.7Å |
| 339 | D | 98.8 | Very high | 97.8 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 25% | 0.248 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -90 | 108.5 | 168.6 | -170 | -8.8 | 0 | 0 | 0 | 109.4 | S341 F355 L368 V370 F390 | D339-S341 PolarHBondContact O-N 3.32Å; D339-F355 HydrophobicContact CB-CD1 4.03Å; D339-F355 HydrophobicContact CB-CD2 4.22Å; D339-F355 HydrophobicContact CB-CE1 3.77Å; D339-F355 HydrophobicContact CB-CE2 3.98Å; D339-F355 HydrophobicContact CB-CG 4.25Å; D339-F355 HydrophobicContact CB-CZ 3.75Å; D339-L368 PolarHBondContact N-O 3.03Å; D339-V370 PolarHBondContact O-N 3.24Å; D339-F390 HydrophobicContact CB-CD1 4.07Å; D339-F390 HydrophobicContact CB-CE1 3.66Å |
| 340 | F | 98.8 | Very high | 97.7 | Very high | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.2 | 101.1 | 167.1 | -68.8 | -88.1 | 0 | 0 | 0 | 108.7 | F324 V338 V370 V378 C382 I384 V387 P388 T389 Q391 | F324-F340 HydrophobicContact CE2-CZ 4.4Å; F324-F340 HydrophobicContact CZ-CZ 4.25Å; V338-F340 HydrophobicContact CB-CD2 4.38Å; V338-F340 HydrophobicContact CB-CE2 3.95Å; V338-F340 HydrophobicContact CG1-CD2 3.85Å; V338-F340 HydrophobicContact CG1-CE1 4.42Å; V338-F340 HydrophobicContact CG1-CE2 3.46Å; V338-F340 VanDerWaalsContact CG1-CE2 3.46Å; V338-F340 HydrophobicContact CG1-CG 4.49Å; V338-F340 HydrophobicContact CG1-CZ 3.79Å; F340-V370 WeakPolarHBondContact CA-O 3.46Å; F340-V370 HydrophobicContact CD1-CB 3.69Å; F340-V370 HydrophobicContact CD1-CG1 3.8Å; F340-V370 HydrophobicContact CD1-CG2 4.17Å; F340-V370 HydrophobicContact CE1-CB 3.91Å; F340-V370 HydrophobicContact CE1-CG1 3.86Å; F340-V370 HydrophobicContact CE1-CG2 3.93Å; F340-V370 HydrophobicContact CG-CB 4.43Å; F340-V370 HydrophobicContact CZ-CG2 4.43Å; F340-V378 HydrophobicContact CE1-CG1 4.03Å; F340-V378 HydrophobicContact CZ-CG1 4.41Å; F340-C382 HydrophobicContact CE1-CB 4.27Å; F340-C382 HydrophobicContact CE2-CB 4.44Å; F340-C382 HydrophobicContact CZ-CB 3.77Å; F340-I384 HydrophobicContact CB-CD1 4.23Å; F340-I384 HydrophobicContact CB-CG1 4.27Å; F340-I384 HydrophobicContact CB-CG2 4.03Å; F340-I384 HydrophobicContact CD1-CD1 4.06Å; F340-I384 HydrophobicContact CD1-CG1 3.68Å; F340-I384 HydrophobicContact CD2-CD1 3.43Å; F340-I384 VanDerWaalsContact CD2-CD1 3.43Å; F340-I384 HydrophobicContact CD2-CG1 4.02Å; F340-I384 HydrophobicContact CE1-CD1 4.24Å; F340-I384 HydrophobicContact CE1-CG1 3.9Å; F340-I384 HydrophobicContact CE2-CD1 3.64Å; F340-I384 HydrophobicContact CE2-CG1 4.23Å; F340-I384 HydrophobicContact CG-CD1 3.64Å; F340-I384 HydrophobicContact CG-CG1 3.73Å; F340-I384 HydrophobicContact CG-CG2 4.42Å; F340-I384 HydrophobicContact CZ-CD1 4.04Å; F340-I384 HydrophobicContact CZ-CG1 4.17Å; F340-V387 WeakPolarHBondContact O-CG1 3.31Å; F340-P388 VanDerWaalsContact O-CA 3.28Å; F340-P388 WeakPolarHBondContact O-CA 3.3Å; F340-T389 WeakPolarHBondContact CB-O 3.28Å; F340-T389 PolarHBondContact N-O 3.32Å; F340-T389 PolarHBondContact O-N 3.44Å; F340-Q391 HydrophobicContact CD2-CG 4.32Å; F340-Q391 HydrophobicContact CE2-CB 4.08Å; F340-Q391 HydrophobicContact CE2-CG 4Å |
| 341 | S | 98.4 | Very high | 97.8 | Very high | 5 Ų | 5 | 42.6 Ų | 42.6 | 4% | 0.035 | 22% | 0.221 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -114.9 | 175.8 | -165.2 | 139.2 | 0 | 0 | 0 | 0 | 110.6 | D339 E369 V370 A372 | D339-S341 PolarHBondContact O-N 3.32Å; S341-E369 PolarHBondContact OG-OE1 3.31Å; S341-V370 PolarHBondContact N-O 2.92Å; S341-A372 VanDerWaalsContact O-CB 3.31Å; S341-A372 WeakPolarHBondContact O-CB 3.47Å; S341-A372 PolarHBondContact O-N 3.09Å |
| 342 | A | 97.8 | Very high | 97.8 | Very high | 1 Ų | 1 | 45.1 Ų | 45.1 | 1% | 0.008 | 23% | 0.231 | C | C | . | . | trans | -155.1 | 136.5 | 169 | 0 | 0 | 0 | 0 | 0 | 110.5 | W344 C345 D371 V387 | A342-W344 VanDerWaalsContact C-N 3.31Å; A342-W344 HydrophobicContact CB-CD2 4.23Å; A342-W344 HydrophobicContact CB-CZ2 3.85Å; A342-W344 PolarHBondContact O-N 2.92Å; A342-C345 HydrophobicContact CB-CB 4.05Å; A342-C345 VanDerWaalsContact O-CB 3.28Å; A342-C345 WeakPolarHBondContact O-CB 3.39Å; A342-C345 PolarHBondContact O-N 3.5Å; A342-D371 WeakPolarHBondContact CA-OD2 3.18Å; A342-V387 HydrophobicContact CB-CG2 4.06Å | ||
| 343 | T | 96 | Very high | 97.8 | Very high | 102 Ų | 102 | 47 Ų | 47 | 63% | 0.626 | 24% | 0.237 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -51.1 | -43.1 | -178.7 | 56.9 | 0 | 0 | 0 | 0 | 114.6 | C345 R349 D371 | T343-C345 VanDerWaalsContact C-N 3.32Å; T343-C345 PolarHBondContact O-N 3.3Å; T343-R349 PolarHBondContact O-NH1 2.93Å; T343-D371 PolarHBondContact N-OD2 3.01Å |
| 344 | W | 96.1 | Very high | 97.9 | Very high | 164 Ų | 164 | 42.5 Ų | 42.5 | 62% | 0.621 | 22% | 0.215 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -72.8 | -20.7 | -179.5 | 50 | -94.8 | 0 | 0 | 0 | 113.7 | A342 G346 R349 D373 V387 | A342-W344 VanDerWaalsContact C-N 3.31Å; A342-W344 HydrophobicContact CB-CD2 4.23Å; A342-W344 HydrophobicContact CB-CZ2 3.85Å; A342-W344 PolarHBondContact O-N 2.92Å; W344-G346 PolarHBondContact O-N 3.09Å; W344-R349 PolarHBondContact O-NH1 2.76Å; W344-D373 PolarHBondContact NE1-OD1 3.43Å; W344-D373 PolarHBondContact NE1-OD2 2.85Å; W344-V387 HydrophobicContact CH2-CG2 3.9Å; W344-V387 HydrophobicContact CZ2-CG2 4.41Å; W344-V387 HydrophobicContact CZ3-CG2 4.43Å |
| 345 | C | 97.9 | Very high | 98 | Very high | 7 Ų | 7 | 37.4 Ų | 37.4 | 5% | 0.047 | 20% | 0.196 | C | C | . | . | trans | -72.8 | 106.8 | -175.3 | 165.8 | 0 | 0 | 0 | 0 | 112.8 | A342 T343 C348 R349 V387 | A342-C345 HydrophobicContact CB-CB 4.05Å; A342-C345 VanDerWaalsContact O-CB 3.28Å; A342-C345 WeakPolarHBondContact O-CB 3.39Å; A342-C345 PolarHBondContact O-N 3.5Å; T343-C345 VanDerWaalsContact C-N 3.32Å; T343-C345 PolarHBondContact O-N 3.3Å; C345-C348 HydrophobicContact CB-CB 3.66Å; C345-C348 WeakPolarHBondContact CB-SG 3.5Å; C345-C348 WeakPolarHBondContact O-CB 3.28Å; C345-C348 PolarHBondContact O-N 3.07Å; C345-C348 WeakPolarHBondContact SG-CB 3.49Å; C345-C348 PolarHBondContact SG-N 3.42Å; C345-C348 CovalentContact SG-SG 2.04Å; C345-C348 PolarHBondContact SG-SG 3.4Å; C345-R349 PolarHBondContact O-N 2.83Å; C345-R349 VanDerWaalsContact O-N 3.1Å; C345-V387 HydrophobicContact CB-CG2 3.97Å | ||
| 346 | G | 98.1 | Very high | 97.9 | Very high | 28 Ų | 28 | 38.1 Ų | 38.1 | 29% | 0.289 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -56.9 | -45.6 | 177 | 0 | 0 | 0 | 0 | 0 | 114.9 | W344 C348 R349 T350 | W344-G346 PolarHBondContact O-N 3.09Å; G346-C348 VanDerWaalsContact C-N 3.3Å; G346-C348 PolarHBondContact O-N 3.35Å; G346-R349 PolarHBondContact O-N 2.82Å; G346-T350 PolarHBondContact O-N 2.72Å; G346-T350 VanDerWaalsContact O-N 3.12Å; G346-T350 PolarHBondContact O-OG1 3.12Å |
| 347 | P | 98.3 | Very high | 97.8 | Very high | 70 Ų | 70 | 40 Ų | 40 | 46% | 0.455 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -59.8 | -37.7 | 173.9 | -26.6 | 36.1 | 0 | 0 | 0 | 113.4 | T350 I351 A405 | P347-T350 WeakPolarHBondContact O-CB 2.88Å; P347-T350 PolarHBondContact O-N 2.91Å; P347-T350 VanDerWaalsContact O-N 3.13Å; P347-I351 PolarHBondContact O-N 2.93Å; P347-I351 VanDerWaalsContact O-N 3.13Å; P347-A405 HydrophobicContact CB-CB 3.96Å |
| 348 | C | 98.4 | Very high | 97.7 | Very high | 2 Ų | 2 | 40.2 Ų | 40.2 | 1% | 0.014 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -61.7 | -51.7 | 176.9 | -52 | 0 | 0 | 0 | 0 | 110.4 | C345 G346 T350 I351 K352 P388 | C345-C348 HydrophobicContact CB-CB 3.66Å; C345-C348 WeakPolarHBondContact CB-SG 3.5Å; C345-C348 WeakPolarHBondContact O-CB 3.28Å; C345-C348 PolarHBondContact O-N 3.07Å; C345-C348 WeakPolarHBondContact SG-CB 3.49Å; C345-C348 PolarHBondContact SG-N 3.42Å; C345-C348 CovalentContact SG-SG 2.04Å; C345-C348 PolarHBondContact SG-SG 3.4Å; G346-C348 VanDerWaalsContact C-N 3.3Å; G346-C348 PolarHBondContact O-N 3.35Å; C348-T350 PolarHBondContact O-N 3.24Å; C348-T350 VanDerWaalsContact O-N 3.09Å; C348-I351 WeakPolarHBondContact O-CG2 3.28Å; C348-I351 PolarHBondContact O-N 2.92Å; C348-I351 VanDerWaalsContact O-N 3.11Å; C348-K352 WeakPolarHBondContact O-CB 3.36Å; C348-K352 PolarHBondContact O-N 2.7Å; C348-P388 HydrophobicContact CB-CB 4.37Å; C348-P388 WeakPolarHBondContact SG-CD 3.48Å |
| 349 | R | 97.6 | Very high | 97.7 | Very high | 128 Ų | 128 | 40.2 Ų | 40.2 | 48% | 0.483 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -57.6 | -26.1 | 173.9 | -61.5 | -164 | -58.1 | -79.5 | 1.3 | 113.5 | T343 W344 C345 G346 P353 | T343-R349 PolarHBondContact O-NH1 2.93Å; W344-R349 PolarHBondContact O-NH1 2.76Å; C345-R349 PolarHBondContact O-N 2.83Å; C345-R349 VanDerWaalsContact O-N 3.1Å; G346-R349 PolarHBondContact O-N 2.82Å; R349-P353 WeakPolarHBondContact O-CD 3.31Å |
| 350 | T | 97.3 | Very high | 97.6 | Very high | 90 Ų | 90 | 45 Ų | 45 | 55% | 0.552 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -81.2 | -26.8 | 179.9 | -53.5 | 0 | 0 | 0 | 0 | 113.6 | G346 P347 C348 K407 | G346-T350 PolarHBondContact O-N 2.72Å; G346-T350 VanDerWaalsContact O-N 3.12Å; G346-T350 PolarHBondContact O-OG1 3.12Å; P347-T350 WeakPolarHBondContact O-CB 2.88Å; P347-T350 PolarHBondContact O-N 2.91Å; P347-T350 VanDerWaalsContact O-N 3.13Å; C348-T350 PolarHBondContact O-N 3.24Å; C348-T350 VanDerWaalsContact O-N 3.09Å; T350-K407 WeakPolarHBondContact O-CE 3.25Å; T350-K407 PolarHBondContact O-NZ 2.59Å |
| 351 | I | 98.3 | Very high | 97.4 | Very high | 1 Ų | 1 | 50.9 Ų | 50.9 | 1% | 0.005 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -100.2 | -27.6 | 177.8 | -168.5 | 155.6 | 0 | 0 | 0 | 113.7 | P347 C348 F354 F355 P388 F390 A405 K407 L410 | P347-I351 PolarHBondContact O-N 2.93Å; P347-I351 VanDerWaalsContact O-N 3.13Å; C348-I351 WeakPolarHBondContact O-CG2 3.28Å; C348-I351 PolarHBondContact O-N 2.92Å; C348-I351 VanDerWaalsContact O-N 3.11Å; I351-F354 HydrophobicContact CG1-CD1 4.42Å; I351-F354 WeakPolarHBondContact O-CA 3.42Å; I351-F354 WeakPolarHBondContact O-CB 3.49Å; I351-F354 PolarHBondContact O-N 3.13Å; I351-F355 PolarHBondContact O-N 2.83Å; I351-P388 HydrophobicContact CG2-CB 4.29Å; I351-P388 HydrophobicContact CG2-CG 3.99Å; I351-F390 HydrophobicContact CD1-CE2 3.88Å; I351-F390 HydrophobicContact CD1-CZ 3.77Å; I351-F390 HydrophobicContact CG1-CZ 4.07Å; I351-F390 HydrophobicContact CG2-CE2 4.45Å; I351-F390 HydrophobicContact CG2-CZ 3.87Å; I351-A405 HydrophobicContact CB-CB 4.07Å; I351-A405 HydrophobicContact CD1-CB 4.39Å; I351-A405 HydrophobicContact CG2-CB 4.1Å; I351-K407 HydrophobicContact CD1-CG 4.02Å; I351-K407 HydrophobicContact CG1-CG 4.19Å; I351-L410 HydrophobicContact CD1-CD2 3.94Å; I351-L410 HydrophobicContact CG1-CD2 4.22Å |
| 352 | K | 97.4 | Very high | 97.3 | Very high | 59 Ų | 59 | 51.6 Ų | 51.6 | 26% | 0.257 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -47.4 | -48.3 | -178.7 | 179.5 | 168.6 | -175.5 | 159.8 | 0 | 114.2 | C348 F354 F355 H356 E369 | C348-K352 WeakPolarHBondContact O-CB 3.36Å; C348-K352 PolarHBondContact O-N 2.7Å; K352-F354 PolarHBondContact O-N 3.05Å; K352-F354 VanDerWaalsContact O-N 3.13Å; K352-F355 PolarHBondContact O-N 3.08Å; K352-F355 VanDerWaalsContact O-N 3.13Å; K352-H356 PolarHBondContact O-CD2 3.45Å; K352-H356 PolarHBondContact O-N 3.49Å; K352-E369 WeakPolarHBondContact CE-OE1 3.35Å; K352-E369 WeakPolarHBondContact CE-OE2 3.3Å; K352-E369 IonicContact NZ-OE1 3.73Å; K352-E369 PolarHBondContact NZ-OE1 3.46Å; K352-E369 IonicContact NZ-OE2 3.66Å; K352-E369 PolarHBondContact NZ-OE2 3.12Å |
| 353 | P | 97.1 | Very high | 97.2 | Very high | 75 Ų | 75 | 59.5 Ų | 59.5 | 49% | 0.487 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.3 | -26.1 | 177.1 | -24.1 | 34.9 | 0 | 0 | 0 | 114.4 | R349 A357 | R349-P353 WeakPolarHBondContact O-CD 3.31Å; P353-A357 WeakPolarHBondContact O-CB 3.41Å; P353-A357 PolarHBondContact O-N 2.92Å; P353-A357 VanDerWaalsContact O-N 3.08Å |
| 354 | F | 97.9 | Very high | 97.2 | Very high | 48 Ų | 48 | 58 Ų | 58 | 21% | 0.211 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -81.4 | -37.9 | 176.1 | 179.4 | -103.1 | 0 | 0 | 0 | 111.9 | I351 K352 A357 L358 K407 L410 E411 | I351-F354 HydrophobicContact CG1-CD1 4.42Å; I351-F354 WeakPolarHBondContact O-CA 3.42Å; I351-F354 WeakPolarHBondContact O-CB 3.49Å; I351-F354 PolarHBondContact O-N 3.13Å; K352-F354 PolarHBondContact O-N 3.05Å; K352-F354 VanDerWaalsContact O-N 3.13Å; F354-A357 PolarHBondContact O-N 3.13Å; F354-L358 HydrophobicContact CD1-CD1 3.94Å; F354-L358 HydrophobicContact CE1-CD1 3.56Å; F354-L358 HydrophobicContact CE1-CG 4.28Å; F354-L358 HydrophobicContact CZ-CD1 4.05Å; F354-L358 HydrophobicContact CZ-CD2 4.46Å; F354-L358 HydrophobicContact CZ-CG 4.36Å; F354-L358 WeakPolarHBondContact O-CG 3.45Å; F354-L358 PolarHBondContact O-N 3.41Å; F354-K407 HydrophobicContact CB-CD 4.11Å; F354-K407 HydrophobicContact CB-CG 4.5Å; F354-K407 HydrophobicContact CD1-CB 3.83Å; F354-K407 HydrophobicContact CD1-CD 4.06Å; F354-K407 HydrophobicContact CD1-CG 3.7Å; F354-K407 HydrophobicContact CD2-CD 4.29Å; F354-K407 HydrophobicContact CE1-CB 3.62Å; F354-K407 HydrophobicContact CE1-CG 4.05Å; F354-K407 WeakPolarHBondContact CE1-O 3.47Å; F354-K407 HydrophobicContact CG-CB 4.44Å; F354-K407 HydrophobicContact CG-CD 3.9Å; F354-K407 HydrophobicContact CG-CG 4.08Å; F354-K407 HydrophobicContact CZ-CB 4.06Å; F354-L410 HydrophobicContact CD1-CD2 3.99Å; F354-L410 HydrophobicContact CE1-CB 4.47Å; F354-L410 HydrophobicContact CE1-CD2 4.14Å; F354-E411 HydrophobicContact CZ-CB 4.21Å |
| 355 | F | 98.3 | Very high | 97.3 | Very high | 1 Ų | 1 | 50.6 Ų | 50.6 | 0% | 0.004 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -61.3 | -44.2 | 170.5 | -174.7 | -100.7 | 0 | 0 | 0 | 111.2 | V315 A337 D339 I351 K352 A357 L358 S359 F367 L368 F390 L410 | V315-F355 HydrophobicContact CG1-CD1 4.36Å; V315-F355 HydrophobicContact CG1-CE1 3.91Å; V315-F355 HydrophobicContact CG2-CD1 4.12Å; V315-F355 HydrophobicContact CG2-CE1 4.22Å; A337-F355 HydrophobicContact CB-CE2 4.18Å; D339-F355 HydrophobicContact CB-CD1 4.03Å; D339-F355 HydrophobicContact CB-CD2 4.22Å; D339-F355 HydrophobicContact CB-CE1 3.77Å; D339-F355 HydrophobicContact CB-CE2 3.98Å; D339-F355 HydrophobicContact CB-CG 4.25Å; D339-F355 HydrophobicContact CB-CZ 3.75Å; I351-F355 PolarHBondContact O-N 2.83Å; K352-F355 PolarHBondContact O-N 3.08Å; K352-F355 VanDerWaalsContact O-N 3.13Å; F355-A357 PolarHBondContact O-N 3.08Å; F355-L358 WeakPolarHBondContact O-CB 3.24Å; F355-L358 PolarHBondContact O-N 3.13Å; F355-S359 PolarHBondContact O-N 3.13Å; F355-S359 VanDerWaalsContact O-N 3.13Å; F355-F367 HydrophobicContact CD1-CD1 4.36Å; F355-F367 HydrophobicContact CD2-CD1 4.1Å; F355-F367 HydrophobicContact CD2-CE1 4.44Å; F355-F367 HydrophobicContact CE1-CB 4.1Å; F355-F367 HydrophobicContact CE1-CD1 4Å; F355-F367 AromaticContact CE2-CD1 3.72Å; F355-F367 HydrophobicContact CE2-CD1 3.72Å; F355-F367 HydrophobicContact CE2-CE1 4.27Å; F355-F367 HydrophobicContact CG-CD1 4.41Å; F355-F367 HydrophobicContact CZ-CB 4.15Å; F355-F367 AromaticContact CZ-CD1 3.67Å; F355-F367 HydrophobicContact CZ-CD1 3.67Å; F355-F367 HydrophobicContact CZ-CG 4.39Å; F355-L368 WeakPolarHBondContact CE1-O 3.41Å; F355-L368 WeakPolarHBondContact CZ-O 3.45Å; F355-F390 AromaticContact CD2-CD1 4Å; F355-F390 HydrophobicContact CD2-CD1 4Å; F355-F390 AromaticContact CD2-CE1 3.62Å; F355-F390 HydrophobicContact CD2-CE1 3.62Å; F355-F390 AromaticContact CE2-CD1 3.96Å; F355-F390 HydrophobicContact CE2-CD1 3.96Å; F355-F390 HydrophobicContact CE2-CE1 4.01Å; F355-F390 HydrophobicContact CG-CE1 4.31Å; F355-L410 HydrophobicContact CB-CD2 4.45Å; F355-L410 HydrophobicContact CD2-CD1 4.35Å; F355-L410 HydrophobicContact CD2-CD2 4.08Å |
| 356 | H | 97.6 | Very high | 97.3 | Very high | 16 Ų | 16 | 51.5 Ų | 51.5 | 7% | 0.074 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.5 | -44.1 | 173.8 | -75 | -122.7 | 0 | 0 | 0 | 111.7 | D313 V315 K352 L358 S359 M360 | D313-H356 HydrophobicContact CB-CB 3.97Å; D313-H356 WeakPolarHBondContact CB-CE1 3.46Å; D313-H356 IonicContact OD1-CE1 2.7Å; D313-H356 PolarHBondContact OD1-CE1 2.89Å; D313-H356 IonicContact OD1-ND1 3.85Å; D313-H356 PolarHBondContact OD1-ND1 2.87Å; D313-H356 IonicContact OD1-NE2 2.68Å; D313-H356 CovalentContact OD2-CE1 1.77Å; D313-H356 IonicContact OD2-CE1 3.92Å; D313-H356 PolarHBondContact OD2-CE1 2.81Å; D313-H356 IonicContact OD2-CG 2.76Å; D313-H356 IonicContact OD2-ND1 2.87Å; D313-H356 PolarHBondContact OD2-ND1 2.89Å; D313-H356 IonicContact OD2-NE2 2.7Å; D313-H356 PolarHBondContact OD2-NE2 2.62Å; V315-H356 HydrophobicContact CG2-CB 4.35Å; K352-H356 PolarHBondContact O-CD2 3.45Å; K352-H356 PolarHBondContact O-N 3.49Å; H356-L358 VanDerWaalsContact C-N 3.31Å; H356-L358 PolarHBondContact O-N 2.97Å; H356-S359 WeakPolarHBondContact O-CB 3.43Å; H356-S359 PolarHBondContact O-N 2.92Å; H356-S359 VanDerWaalsContact O-N 3.12Å; H356-S359 PolarHBondContact O-OG 2.87Å; H356-M360 PolarHBondContact O-N 1.77Å |
| 357 | A | 97 | Very high | 97.3 | Very high | 43 Ų | 43 | 50.3 Ų | 50.3 | 36% | 0.355 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63.4 | -33 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | P353 F354 F355 S359 M360 K361 | P353-A357 WeakPolarHBondContact O-CB 3.41Å; P353-A357 PolarHBondContact O-N 2.92Å; P353-A357 VanDerWaalsContact O-N 3.08Å; F354-A357 PolarHBondContact O-N 3.13Å; F355-A357 PolarHBondContact O-N 3.08Å; A357-S359 VanDerWaalsContact C-N 3.34Å; A357-M360 PolarHBondContact O-N 3.07Å; A357-K361 PolarHBondContact O-N 3.42Å |
| 358 | L | 97.1 | Very high | 97.4 | Very high | 4 Ų | 4 | 47 Ų | 47 | 2% | 0.021 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -67.1 | -34.1 | 173.2 | -72.8 | 168.3 | 0 | 0 | 0 | 112.1 | F354 F355 H356 M360 K361 H362 F367 L410 E411 I414 | F354-L358 HydrophobicContact CD1-CD1 3.94Å; F354-L358 HydrophobicContact CE1-CD1 3.56Å; F354-L358 HydrophobicContact CE1-CG 4.28Å; F354-L358 HydrophobicContact CZ-CD1 4.05Å; F354-L358 HydrophobicContact CZ-CD2 4.46Å; F354-L358 HydrophobicContact CZ-CG 4.36Å; F354-L358 WeakPolarHBondContact O-CG 3.45Å; F354-L358 PolarHBondContact O-N 3.41Å; F355-L358 WeakPolarHBondContact O-CB 3.24Å; F355-L358 PolarHBondContact O-N 3.13Å; H356-L358 VanDerWaalsContact C-N 3.31Å; H356-L358 PolarHBondContact O-N 2.97Å; L358-M360 PolarHBondContact O-N 2.89Å; L358-K361 HydrophobicContact CD2-CD 4.22Å; L358-K361 WeakPolarHBondContact O-CB 3.33Å; L358-K361 PolarHBondContact O-N 2.99Å; L358-H362 PolarHBondContact O-N 2.72Å; L358-F367 HydrophobicContact CB-CE1 3.73Å; L358-F367 HydrophobicContact CB-CZ 3.9Å; L358-L410 HydrophobicContact CD1-CD2 3.81Å; L358-L410 HydrophobicContact CD1-CG 3.77Å; L358-E411 HydrophobicContact CD2-CB 4.47Å; L358-E411 HydrophobicContact CD2-CG 4.29Å; L358-I414 HydrophobicContact CD1-CD1 4.06Å |
| 359 | S | 97.4 | Very high | 97.4 | Very high | 1 Ų | 1 | 47.3 Ų | 47.3 | 1% | 0.007 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.4 | -27.4 | 174.4 | 83 | 0 | 0 | 0 | 0 | 113.9 | N314 F355 H356 A357 F367 | N314-S359 PolarHBondContact N-OG 3.4Å; N314-S359 PolarHBondContact ND2-O 3.46Å; F355-S359 PolarHBondContact O-N 3.13Å; F355-S359 VanDerWaalsContact O-N 3.13Å; H356-S359 WeakPolarHBondContact O-CB 3.43Å; H356-S359 PolarHBondContact O-N 2.92Å; H356-S359 VanDerWaalsContact O-N 3.12Å; H356-S359 PolarHBondContact O-OG 2.87Å; A357-S359 VanDerWaalsContact C-N 3.34Å; S359-F367 VanDerWaalsContact CA-CD2 3.48Å |
| 360 | M | 96.1 | Very high | 97.4 | Very high | 100 Ų | 100 | 41.2 Ų | 41.2 | 49% | 0.493 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -81.9 | -21 | 172.3 | -58.3 | -178.2 | 75.4 | 0 | 0 | 112.7 | G312 D313 H356 A357 L358 | G312-M360 WeakPolarHBondContact O-CE 3.28Å; D313-M360 HydrophobicContact CB-CG 4.5Å; H356-M360 PolarHBondContact O-N 1.77Å; A357-M360 PolarHBondContact O-N 3.07Å; L358-M360 PolarHBondContact O-N 2.89Å |
| 361 | K | 96.2 | Very high | 97.5 | Very high | 123 Ų | 123 | 38 Ų | 38 | 54% | 0.535 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -88.7 | -22.4 | -178.9 | -169.7 | -178.7 | 176.4 | 175.4 | 0 | 112.9 | A357 L358 E411 | A357-K361 PolarHBondContact O-N 3.42Å; L358-K361 HydrophobicContact CD2-CD 4.22Å; L358-K361 WeakPolarHBondContact O-CB 3.33Å; L358-K361 PolarHBondContact O-N 2.99Å; K361-E411 IonicContact NZ-OE1 2.75Å; K361-E411 PolarHBondContact NZ-OE1 3.36Å |
| 362 | H | 95.8 | Very high | 97.4 | Very high | 20 Ų | 20 | 38.7 Ų | 38.7 | 9% | 0.093 | 20% | 0.201 | C | C | . | . | trans | -133 | 68.4 | -169.3 | -63.4 | -43 | 0 | 0 | 0 | 111.8 | L358 D364 V365 F367 | L358-H362 PolarHBondContact O-N 2.72Å; H362-D364 WeakPolarHBondContact CA-OD1 3.39Å; H362-D364 IonicContact ND1-OD1 2.57Å; H362-D364 PolarHBondContact O-N 2.68Å; H362-D364 VanDerWaalsContact O-N 3.07Å; H362-V365 HydrophobicContact CB-CB 4.13Å; H362-V365 HydrophobicContact CB-CG2 4.07Å; H362-V365 PolarHBondContact O-N 3.43Å; H362-V365 VanDerWaalsContact O-O 3.1Å; H362-F367 HydrophobicContact CB-CE2 3.97Å; H362-F367 HydrophobicContact CB-CZ 4.14Å | ||
| 363 | E | 95.1 | Very high | 97.4 | Very high | 167 Ų | 167 | 39.9 Ų | 39.9 | 78% | 0.78 | 21% | 0.21 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -56.6 | -18.5 | 171.6 | -60.9 | 177.3 | -165.7 | 0 | 0 | 113.2 | V365 | E363-V365 VanDerWaalsContact C-N 3.3Š|
| 364 | D | 96.1 | Very high | 97.4 | Very high | 72 Ų | 72 | 43 Ų | 43 | 39% | 0.385 | 22% | 0.222 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -78 | -10.5 | 174.9 | 59.4 | -45 | 0 | 0 | 0 | 114.3 | H362 K418 | H362-D364 WeakPolarHBondContact CA-OD1 3.39Å; H362-D364 IonicContact ND1-OD1 2.57Å; H362-D364 PolarHBondContact O-N 2.68Å; H362-D364 VanDerWaalsContact O-N 3.07Å; D364-K418 VanDerWaalsContact CG-NZ 3.3Å; D364-K418 IonicContact OD1-NZ 3.19Å; D364-K418 PolarHBondContact OD1-NZ 3.18Å; D364-K418 IonicContact OD2-NZ 2.61Å; D364-K418 PolarHBondContact OD2-NZ 3.41Å |
| 365 | V | 98.1 | Very high | 97.3 | Very high | 8 Ų | 8 | 41.1 Ų | 41.1 | 5% | 0.048 | 22% | 0.215 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -119.3 | 138.7 | -177.4 | 179.8 | 0 | 0 | 0 | 0 | 109.6 | L335 A337 H362 E363 F367 I414 K418 | L335-V365 HydrophobicContact CB-CG1 4.11Å; L335-V365 HydrophobicContact CB-CG2 4.15Å; L335-V365 HydrophobicContact CD2-CG1 4.09Å; L335-V365 HydrophobicContact CD2-CG2 4.15Å; L335-V365 HydrophobicContact CG-CG1 4.11Å; L335-V365 WeakPolarHBondContact O-CA 3.48Å; L335-V365 WeakPolarHBondContact O-CG1 3.4Å; A337-V365 HydrophobicContact CB-CG1 4.3Å; H362-V365 HydrophobicContact CB-CB 4.13Å; H362-V365 HydrophobicContact CB-CG2 4.07Å; H362-V365 PolarHBondContact O-N 3.43Å; H362-V365 VanDerWaalsContact O-O 3.1Å; E363-V365 VanDerWaalsContact C-N 3.3Å; V365-F367 HydrophobicContact CB-CD2 4.36Å; V365-F367 HydrophobicContact CB-CE2 3.66Å; V365-F367 HydrophobicContact CB-CZ 4.26Å; V365-F367 HydrophobicContact CG1-CD2 4.16Å; V365-F367 HydrophobicContact CG1-CE2 3.65Å; V365-F367 HydrophobicContact CG1-CZ 3.99Å; V365-F367 WeakPolarHBondContact O-CD2 3.43Å; V365-I414 HydrophobicContact CG2-CG2 4.33Å; V365-K418 HydrophobicContact CG2-CB 4.04Å; V365-K418 HydrophobicContact CG2-CD 4.34Å |
| 366 | V | 98.4 | Very high | 97.3 | Very high | 25 Ų | 25 | 47 Ų | 47 | 15% | 0.152 | 24% | 0.242 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -90.2 | 124.7 | 175.2 | 179.8 | 0 | 0 | 0 | 0 | 109 | A331 R334 L335 V336 A337 L368 | A331-V366 HydrophobicContact CB-CB 4.43Å; A331-V366 HydrophobicContact CB-CG2 3.91Å; R334-V366 HydrophobicContact CB-CG2 4.41Å; L335-V366 PolarHBondContact O-N 3.12Å; V336-V366 CarbonylContact C-O 3.52Å; V336-V366 VanDerWaalsContact CA-O 3.31Å; V336-V366 WeakPolarHBondContact CA-O 3.37Å; V336-V366 HydrophobicContact CG1-CB 4.24Å; V336-V366 HydrophobicContact CG1-CG1 4.28Å; V336-V366 HydrophobicContact CG2-CB 4.27Å; A337-V366 PolarHBondContact N-O 2.04Å; V366-L368 HydrophobicContact CG1-CD2 3.77Å; V366-L368 HydrophobicContact CG1-CG 4.36Å |
| 367 | F | 98.7 | Very high | 97.3 | Very high | 3 Ų | 3 | 50.7 Ų | 50.7 | 1% | 0.013 | 26% | 0.26 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.2 | 123.7 | 178.6 | -70 | -104.2 | 0 | 0 | 0 | 110.1 | V315 K316 A337 F355 L358 S359 H362 V365 I414 | V315-F367 HydrophobicContact CG2-CB 4.09Å; K316-F367 PolarHBondContact N-O 2.81Å; A337-F367 HydrophobicContact CB-CD1 4.26Å; A337-F367 HydrophobicContact CB-CE1 4.31Å; A337-F367 WeakPolarHBondContact O-CA 3.34Å; F355-F367 HydrophobicContact CD1-CD1 4.36Å; F355-F367 HydrophobicContact CD2-CD1 4.1Å; F355-F367 HydrophobicContact CD2-CE1 4.44Å; F355-F367 HydrophobicContact CE1-CB 4.1Å; F355-F367 HydrophobicContact CE1-CD1 4Å; F355-F367 AromaticContact CE2-CD1 3.72Å; F355-F367 HydrophobicContact CE2-CD1 3.72Å; F355-F367 HydrophobicContact CE2-CE1 4.27Å; F355-F367 HydrophobicContact CG-CD1 4.41Å; F355-F367 HydrophobicContact CZ-CB 4.15Å; F355-F367 AromaticContact CZ-CD1 3.67Å; F355-F367 HydrophobicContact CZ-CD1 3.67Å; F355-F367 HydrophobicContact CZ-CG 4.39Å; L358-F367 HydrophobicContact CB-CE1 3.73Å; L358-F367 HydrophobicContact CB-CZ 3.9Å; S359-F367 VanDerWaalsContact CA-CD2 3.48Å; H362-F367 HydrophobicContact CB-CE2 3.97Å; H362-F367 HydrophobicContact CB-CZ 4.14Å; V365-F367 HydrophobicContact CB-CD2 4.36Å; V365-F367 HydrophobicContact CB-CE2 3.66Å; V365-F367 HydrophobicContact CB-CZ 4.26Å; V365-F367 HydrophobicContact CG1-CD2 4.16Å; V365-F367 HydrophobicContact CG1-CE2 3.65Å; V365-F367 HydrophobicContact CG1-CZ 3.99Å; V365-F367 WeakPolarHBondContact O-CD2 3.43Å; F367-I414 HydrophobicContact CE1-CD1 3.88Å; F367-I414 HydrophobicContact CZ-CD1 4.13Å |
| 368 | L | 98.8 | Very high | 97.3 | Very high | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 24% | 0.243 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.7 | 144.1 | 177.1 | -51.2 | -176.1 | 0 | 0 | 0 | 110 | K316 I318 F324 V336 A337 V338 D339 F355 V366 | K316-L368 HydrophobicContact CB-CD2 3.84Å; K316-L368 HydrophobicContact CD-CD2 4.25Å; K316-L368 HydrophobicContact CG-CD2 4.41Å; K316-L368 VanDerWaalsContact O-CA 3.3Å; K316-L368 WeakPolarHBondContact O-CA 3.35Å; I318-L368 HydrophobicContact CD1-CD1 4.21Å; I318-L368 HydrophobicContact CD1-CD2 4.15Å; I318-L368 HydrophobicContact CG1-CB 4.09Å; I318-L368 HydrophobicContact CG1-CD1 4.37Å; F324-L368 HydrophobicContact CD2-CD1 4.25Å; F324-L368 HydrophobicContact CE2-CD1 4.21Å; V336-L368 HydrophobicContact CG1-CD1 3.61Å; V336-L368 HydrophobicContact CG1-CG 3.7Å; A337-L368 PolarHBondContact O-N 2.63Å; V338-L368 WeakPolarHBondContact CA-O 3.39Å; V338-L368 HydrophobicContact CG1-CB 4.24Å; V338-L368 HydrophobicContact CG2-CB 4.21Å; V338-L368 HydrophobicContact CG2-CD1 4.12Å; V338-L368 HydrophobicContact CG2-CG 4.44Å; D339-L368 PolarHBondContact N-O 3.03Å; F355-L368 WeakPolarHBondContact CE1-O 3.41Å; F355-L368 WeakPolarHBondContact CZ-O 3.45Å; V366-L368 HydrophobicContact CG1-CD2 3.77Å; V366-L368 HydrophobicContact CG1-CG 4.36Å |
| 369 | E | 98.4 | Very high | 97.4 | Very high | 10 Ų | 10 | 49.7 Ų | 49.7 | 5% | 0.047 | 25% | 0.249 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -118.2 | 134.9 | 166.8 | -173.6 | -177.2 | -171.8 | 0 | 0 | 110 | V315 K316 I318 S341 K352 | V315-E369 HydrophobicContact CG1-CB 3.8Å; K316-E369 PolarHBondContact O-N 2.93Å; I318-E369 WeakPolarHBondContact CB-O 3.03Å; I318-E369 PolarHBondContact N-O 3.4Å; S341-E369 PolarHBondContact OG-OE1 3.31Å; K352-E369 WeakPolarHBondContact CE-OE1 3.35Å; K352-E369 WeakPolarHBondContact CE-OE2 3.3Å; K352-E369 IonicContact NZ-OE1 3.73Å; K352-E369 PolarHBondContact NZ-OE1 3.46Å; K352-E369 IonicContact NZ-OE2 3.66Å; K352-E369 PolarHBondContact NZ-OE2 3.12Å |
| 370 | V | 98.7 | Very high | 97.4 | Very high | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 28% | 0.275 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.3 | 113 | 176.8 | -175.8 | 0 | 0 | 0 | 0 | 107.7 | I318 F324 V338 D339 F340 S341 C375 V378 | I318-V370 HydrophobicContact CB-CG2 3.96Å; I318-V370 HydrophobicContact CG1-CG2 4.09Å; I318-V370 HydrophobicContact CG2-CG2 4.25Å; F324-V370 HydrophobicContact CD2-CG2 4.27Å; F324-V370 HydrophobicContact CE2-CG2 4.35Å; V338-V370 HydrophobicContact CG1-CG2 3.7Å; D339-V370 PolarHBondContact O-N 3.24Å; F340-V370 WeakPolarHBondContact CA-O 3.46Å; F340-V370 HydrophobicContact CD1-CB 3.69Å; F340-V370 HydrophobicContact CD1-CG1 3.8Å; F340-V370 HydrophobicContact CD1-CG2 4.17Å; F340-V370 HydrophobicContact CE1-CB 3.91Å; F340-V370 HydrophobicContact CE1-CG1 3.86Å; F340-V370 HydrophobicContact CE1-CG2 3.93Å; F340-V370 HydrophobicContact CG-CB 4.43Å; F340-V370 HydrophobicContact CZ-CG2 4.43Å; S341-V370 PolarHBondContact N-O 2.92Å; V370-C375 HydrophobicContact CG1-CB 3.51Å; V370-V378 HydrophobicContact CG1-CB 4.46Å |
| 371 | D | 98.4 | Very high | 97.5 | Very high | 22 Ų | 22 | 56.5 Ų | 56.5 | 12% | 0.118 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.3 | 129.6 | 168.9 | -172.8 | -69.2 | 0 | 0 | 0 | 109.6 | A342 T343 D373 D374 C375 | A342-D371 WeakPolarHBondContact CA-OD2 3.18Å; T343-D371 PolarHBondContact N-OD2 3.01Å; D371-D373 VanDerWaalsContact C-N 3.35Å; D371-D373 PolarHBondContact O-N 3.13Å; D371-D373 WeakPolarHBondContact OD1-CB 3.43Å; D371-D373 PolarHBondContact OD1-N 3.12Å; D371-D374 HydrophobicContact CB-CB 4.41Å; D371-D374 PolarHBondContact O-N 2.79Å; D371-D374 PolarHBondContact OD1-N 3.13Å; D371-C375 WeakPolarHBondContact O-CB 3.38Å; D371-C375 PolarHBondContact O-N 3.11Å |
| 372 | A | 97.2 | Very high | 97.6 | Very high | 16 Ų | 16 | 51.4 Ų | 51.4 | 13% | 0.132 | 26% | 0.256 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.7 | -18.5 | -172.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | S341 V379 V387 | S341-A372 VanDerWaalsContact O-CB 3.31Å; S341-A372 WeakPolarHBondContact O-CB 3.47Å; S341-A372 PolarHBondContact O-N 3.09Å; A372-V379 HydrophobicContact CB-CG2 3.84Å; A372-V387 HydrophobicContact CB-CG1 3.96Å |
| 373 | D | 96.8 | Very high | 97.7 | Very high | 84 Ų | 84 | 53.4 Ų | 53.4 | 45% | 0.449 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.8 | -37.6 | 173.6 | -61.4 | -35.2 | 0 | 0 | 0 | 110.7 | W344 D371 | W344-D373 PolarHBondContact NE1-OD1 3.43Å; W344-D373 PolarHBondContact NE1-OD2 2.85Å; D371-D373 VanDerWaalsContact C-N 3.35Å; D371-D373 PolarHBondContact O-N 3.13Å; D371-D373 WeakPolarHBondContact OD1-CB 3.43Å; D371-D373 PolarHBondContact OD1-N 3.12Å |
| 374 | D | 97.3 | Very high | 97.8 | Very high | 141 Ų | 141 | 46.1 Ų | 46.1 | 75% | 0.754 | 24% | 0.243 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -78.9 | -32.4 | -179.9 | -79.4 | -31.5 | 0 | 0 | 0 | 113.4 | D371 | D371-D374 HydrophobicContact CB-CB 4.41Å; D371-D374 PolarHBondContact O-N 2.79Å; D371-D374 PolarHBondContact OD1-N 3.13Å |
| 375 | C | 96.5 | Very high | 97.9 | Very high | 8 Ų | 8 | 50.8 Ų | 50.8 | 5% | 0.054 | 26% | 0.264 | C | S | . | . | trans | -112.9 | 41.5 | -172.5 | -76.4 | 0 | 0 | 0 | 0 | 114.8 | V370 D371 E377 V378 V379 | V370-C375 HydrophobicContact CG1-CB 3.51Å; D371-C375 WeakPolarHBondContact O-CB 3.38Å; D371-C375 PolarHBondContact O-N 3.11Å; C375-E377 PolarHBondContact O-N 2.89Å; C375-V378 HydrophobicContact CB-CB 4.4Å; C375-V378 HydrophobicContact CB-CG2 4.3Å; C375-V378 PolarHBondContact O-N 3.19Å; C375-V379 WeakPolarHBondContact O-CG2 3.31Å; C375-V379 PolarHBondContact O-N 2.9Å | ||
| 376 | E | 97.1 | Very high | 97.8 | Very high | 124 Ų | 124 | 53.3 Ų | 53.3 | 58% | 0.579 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -42.3 | -38.3 | -176.8 | -78.1 | -165.2 | -157.6 | 0 | 0 | 116.1 | R380 | E376-R380 VanDerWaalsContact O-CB 3.29Å; E376-R380 WeakPolarHBondContact O-CB 3.17Å; E376-R380 PolarHBondContact O-N 3Å; E376-R380 IonicContact OE2-NH2 2.67Å; E376-R380 PolarHBondContact OE2-NH2 2.97Å |
| 377 | E | 97.8 | Very high | 97.8 | Very high | 93 Ų | 93 | 53.7 Ų | 53.7 | 44% | 0.435 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -70.3 | -40.7 | -178.9 | -167.3 | 177 | 162.3 | 0 | 0 | 112 | K321 C375 R380 D381 | K321-E377 HydrophobicContact CD-CG 3.94Å; K321-E377 WeakPolarHBondContact CD-OE1 3.37Å; K321-E377 IonicContact NZ-OE1 3.32Å; K321-E377 PolarHBondContact NZ-OE1 2.85Å; C375-E377 PolarHBondContact O-N 2.89Å; E377-R380 PolarHBondContact O-N 2.7Å; E377-D381 WeakPolarHBondContact O-CB 3.27Å; E377-D381 PolarHBondContact O-N 2.67Å |
| 378 | V | 98.3 | Very high | 97.7 | Very high | 3 Ų | 3 | 53.6 Ų | 53.6 | 2% | 0.018 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -67.6 | -42.7 | 177.7 | -169.3 | 0 | 0 | 0 | 0 | 110.1 | K321 F324 F340 V370 C375 R380 D381 C382 | K321-V378 HydrophobicContact CB-CG2 3.97Å; F324-V378 HydrophobicContact CB-CG1 4.17Å; F324-V378 HydrophobicContact CB-CG2 4.31Å; F324-V378 HydrophobicContact CD1-CG1 3.6Å; F324-V378 HydrophobicContact CD2-CG1 3.96Å; F324-V378 HydrophobicContact CE1-CG1 3.89Å; F324-V378 HydrophobicContact CE2-CG1 4.24Å; F324-V378 HydrophobicContact CG-CG1 3.63Å; F324-V378 HydrophobicContact CZ-CG1 4.2Å; F340-V378 HydrophobicContact CE1-CG1 4.03Å; F340-V378 HydrophobicContact CZ-CG1 4.41Å; V370-V378 HydrophobicContact CG1-CB 4.46Å; C375-V378 HydrophobicContact CB-CB 4.4Å; C375-V378 HydrophobicContact CB-CG2 4.3Å; C375-V378 PolarHBondContact O-N 3.19Å; V378-R380 VanDerWaalsContact C-N 3.29Å; V378-R380 PolarHBondContact O-N 2.88Å; V378-D381 PolarHBondContact O-N 2.75Å; V378-C382 WeakPolarHBondContact O-CB 3.09Å; V378-C382 PolarHBondContact O-N 2.61Å; V378-C382 PolarHBondContact O-SG 3.45Å |
| 379 | V | 98.2 | Very high | 97.7 | Very high | 24 Ų | 24 | 54 Ų | 54 | 15% | 0.145 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -55 | -45.2 | 173.9 | 175.2 | 0 | 0 | 0 | 0 | 111.2 | A372 C375 A383 I384 | A372-V379 HydrophobicContact CB-CG2 3.84Å; C375-V379 WeakPolarHBondContact O-CG2 3.31Å; C375-V379 PolarHBondContact O-N 2.9Å; V379-A383 PolarHBondContact O-N 2.86Å; V379-I384 HydrophobicContact CG1-CB 3.91Å; V379-I384 HydrophobicContact CG1-CG2 4.45Å; V379-I384 PolarHBondContact O-N 3.29Å |
| 380 | R | 98.2 | Very high | 97.8 | Very high | 147 Ų | 147 | 53.5 Ų | 53.5 | 56% | 0.555 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -68.7 | -48.3 | -179.4 | -170.7 | -172.9 | -52.7 | 119.7 | 6.4 | 112.2 | E376 E377 V378 C382 A383 | E376-R380 VanDerWaalsContact O-CB 3.29Å; E376-R380 WeakPolarHBondContact O-CB 3.17Å; E376-R380 PolarHBondContact O-N 3Å; E376-R380 IonicContact OE2-NH2 2.67Å; E376-R380 PolarHBondContact OE2-NH2 2.97Å; E377-R380 PolarHBondContact O-N 2.7Å; V378-R380 VanDerWaalsContact C-N 3.29Å; V378-R380 PolarHBondContact O-N 2.88Å; R380-C382 VanDerWaalsContact C-N 3.35Å; R380-A383 PolarHBondContact O-N 3.47Å; R380-A383 VanDerWaalsContact O-N 3.12Å |
| 381 | D | 97.9 | Very high | 97.8 | Very high | 96 Ų | 96 | 53.5 Ų | 53.5 | 51% | 0.513 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -71 | -31.6 | -177 | -72.5 | 2.9 | 0 | 0 | 0 | 112.1 | K321 E377 V378 A383 | K321-D381 WeakPolarHBondContact CE-OD2 3.28Å; K321-D381 IonicContact NZ-OD2 2.72Å; K321-D381 PolarHBondContact NZ-OD2 3.44Å; E377-D381 WeakPolarHBondContact O-CB 3.27Å; E377-D381 PolarHBondContact O-N 2.67Å; V378-D381 PolarHBondContact O-N 2.75Å; D381-A383 PolarHBondContact O-N 3.49Å |
| 382 | C | 97.9 | Very high | 97.8 | Very high | 17 Ų | 17 | 52.4 Ų | 52.4 | 12% | 0.115 | 28% | 0.278 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82.7 | 1.9 | 172.6 | -58.6 | 0 | 0 | 0 | 0 | 113.5 | F340 V378 R380 I384 Q391 Y393 | F340-C382 HydrophobicContact CE1-CB 4.27Å; F340-C382 HydrophobicContact CE2-CB 4.44Å; F340-C382 HydrophobicContact CZ-CB 3.77Å; V378-C382 WeakPolarHBondContact O-CB 3.09Å; V378-C382 PolarHBondContact O-N 2.61Å; V378-C382 PolarHBondContact O-SG 3.45Å; R380-C382 VanDerWaalsContact C-N 3.35Å; C382-I384 HydrophobicContact CB-CD1 4.12Å; C382-I384 HydrophobicContact CB-CG1 4Å; C382-I384 PolarHBondContact O-N 2.97Å; C382-Q391 PolarHBondContact O-NE2 2.76Å; C382-Y393 PolarHBondContact SG-OH 3.41Å |
| 383 | A | 98 | Very high | 97.9 | Very high | 62 Ų | 62 | 52.4 Ų | 52.4 | 51% | 0.512 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 56.4 | 37.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | V379 R380 D381 M385 | V379-A383 PolarHBondContact O-N 2.86Å; R380-A383 PolarHBondContact O-N 3.47Å; R380-A383 VanDerWaalsContact O-N 3.12Å; D381-A383 PolarHBondContact O-N 3.49Å; A383-M385 PolarHBondContact O-N 2.89Å |
| 384 | I | 98.3 | Very high | 97.9 | Very high | 14 Ų | 14 | 51.1 Ų | 51.1 | 7% | 0.072 | 27% | 0.265 | C | S | . | . | trans | -73.4 | 115.1 | -177 | -53.3 | -62.4 | 0 | 0 | 0 | 110.9 | F340 V379 C382 C386 T389 Q391 | F340-I384 HydrophobicContact CB-CD1 4.23Å; F340-I384 HydrophobicContact CB-CG1 4.27Å; F340-I384 HydrophobicContact CB-CG2 4.03Å; F340-I384 HydrophobicContact CD1-CD1 4.06Å; F340-I384 HydrophobicContact CD1-CG1 3.68Å; F340-I384 HydrophobicContact CD2-CD1 3.43Å; F340-I384 VanDerWaalsContact CD2-CD1 3.43Å; F340-I384 HydrophobicContact CD2-CG1 4.02Å; F340-I384 HydrophobicContact CE1-CD1 4.24Å; F340-I384 HydrophobicContact CE1-CG1 3.9Å; F340-I384 HydrophobicContact CE2-CD1 3.64Å; F340-I384 HydrophobicContact CE2-CG1 4.23Å; F340-I384 HydrophobicContact CG-CD1 3.64Å; F340-I384 HydrophobicContact CG-CG1 3.73Å; F340-I384 HydrophobicContact CG-CG2 4.42Å; F340-I384 HydrophobicContact CZ-CD1 4.04Å; F340-I384 HydrophobicContact CZ-CG1 4.17Å; V379-I384 HydrophobicContact CG1-CB 3.91Å; V379-I384 HydrophobicContact CG1-CG2 4.45Å; V379-I384 PolarHBondContact O-N 3.29Å; C382-I384 HydrophobicContact CB-CD1 4.12Å; C382-I384 HydrophobicContact CB-CG1 4Å; C382-I384 PolarHBondContact O-N 2.97Å; I384-C386 WeakPolarHBondContact CG2-O 3.01Å; I384-T389 HydrophobicContact CD1-CG2 3.79Å; I384-Q391 HydrophobicContact CD1-CG 4.11Å; I384-Q391 VanDerWaalsContact CD1-NE2 3.33Å | ||
| 385 | M | 96.2 | Very high | 97.9 | Very high | 169 Ų | 169 | 50.8 Ų | 50.8 | 83% | 0.833 | 26% | 0.257 | S | S | * | . | trans | -101.6 | -14.1 | -176.8 | -61.4 | -70.5 | 92.9 | 0 | 0 | 114.4 | A383 | A383-M385 PolarHBondContact O-N 2.89Š| ||
| 386 | C | 96.3 | Very high | 97.9 | Very high | 62 Ų | 62 | 55.6 Ų | 55.6 | 42% | 0.419 | 28% | 0.278 | S | S | . | . | S | Bend | trans | -156.6 | 162.2 | 179 | 50.8 | 0 | 0 | 0 | 0 | 111.4 | I384 T389 C403 | I384-C386 WeakPolarHBondContact CG2-O 3.01Å; C386-T389 WeakPolarHBondContact O-CB 3.5Å; C386-T389 PolarHBondContact O-OG1 3.3Å; C386-C403 WeakPolarHBondContact CB-SG 3.39Å; C386-C403 WeakPolarHBondContact SG-CB 3.48Å; C386-C403 CovalentContact SG-SG 2.04Å; C386-C403 PolarHBondContact SG-SG 2.94Å |
| 387 | V | 98.2 | Very high | 97.9 | Very high | 33 Ų | 33 | 56.5 Ų | 56.5 | 20% | 0.2 | 28% | 0.283 | C | S | . | . | S | Bend | trans | -127.8 | 143.9 | 179.6 | -65.2 | 0 | 0 | 0 | 0 | 111.1 | F340 A342 W344 C345 A372 | F340-V387 WeakPolarHBondContact O-CG1 3.31Å; A342-V387 HydrophobicContact CB-CG2 4.06Å; W344-V387 HydrophobicContact CH2-CG2 3.9Å; W344-V387 HydrophobicContact CZ2-CG2 4.41Å; W344-V387 HydrophobicContact CZ3-CG2 4.43Å; C345-V387 HydrophobicContact CB-CG2 3.97Å; A372-V387 HydrophobicContact CB-CG1 3.96Å |
| 388 | P | 98.4 | Very high | 97.9 | Very high | 1 Ų | 1 | 55.8 Ų | 55.8 | 1% | 0.006 | 28% | 0.278 | C | S | . | . | S | Bend | cis | -72.9 | 142.8 | -4.8 | 31.4 | -32.7 | 0 | 0 | 0 | 110.5 | F340 C348 I351 F390 C403 G404 A405 | F340-P388 VanDerWaalsContact O-CA 3.28Å; F340-P388 WeakPolarHBondContact O-CA 3.3Å; C348-P388 HydrophobicContact CB-CB 4.37Å; C348-P388 WeakPolarHBondContact SG-CD 3.48Å; I351-P388 HydrophobicContact CG2-CB 4.29Å; I351-P388 HydrophobicContact CG2-CG 3.99Å; P388-F390 HydrophobicContact CB-CE2 4.02Å; P388-F390 HydrophobicContact CB-CZ 4.14Å; P388-F390 HydrophobicContact CG-CE2 4.24Å; P388-C403 WeakPolarHBondContact O-CA 3.15Å; P388-G404 PolarHBondContact O-N 3.02Å; P388-A405 HydrophobicContact CG-CB 4.11Å |
| 389 | T | 98.8 | Very high | 97.9 | Very high | 7 Ų | 7 | 58.8 Ų | 58.8 | 4% | 0.043 | 30% | 0.296 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.7 | 130 | 169 | -73.9 | 0 | 0 | 0 | 0 | 109.5 | F340 I384 C386 Q391 F402 C403 | F340-T389 WeakPolarHBondContact CB-O 3.28Å; F340-T389 PolarHBondContact N-O 3.32Å; F340-T389 PolarHBondContact O-N 3.44Å; I384-T389 HydrophobicContact CD1-CG2 3.79Å; C386-T389 WeakPolarHBondContact O-CB 3.5Å; C386-T389 PolarHBondContact O-OG1 3.3Å; T389-Q391 HydrophobicContact CG2-CG 4.1Å; T389-F402 WeakPolarHBondContact CA-O 3.45Å; T389-C403 VanDerWaalsContact OG1-CB 3.3Å; T389-C403 WeakPolarHBondContact OG1-CB 3.35Å; T389-C403 PolarHBondContact OG1-SG 2.67Å |
| 390 | F | 98.8 | Very high | 97.9 | Very high | 0 Ų | 0 | 60.1 Ų | 60.1 | 0% | 0 | 30% | 0.303 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.4 | 121.6 | 175.6 | -59 | -82 | 0 | 0 | 0 | 109.3 | V338 D339 I351 F355 P388 F392 E401 F402 L410 | V338-F390 VanDerWaalsContact O-CA 3.28Å; V338-F390 WeakPolarHBondContact O-CA 3.43Å; D339-F390 HydrophobicContact CB-CD1 4.07Å; D339-F390 HydrophobicContact CB-CE1 3.66Å; I351-F390 HydrophobicContact CD1-CE2 3.88Å; I351-F390 HydrophobicContact CD1-CZ 3.77Å; I351-F390 HydrophobicContact CG1-CZ 4.07Å; I351-F390 HydrophobicContact CG2-CE2 4.45Å; I351-F390 HydrophobicContact CG2-CZ 3.87Å; F355-F390 AromaticContact CD2-CD1 4Å; F355-F390 HydrophobicContact CD2-CD1 4Å; F355-F390 AromaticContact CD2-CE1 3.62Å; F355-F390 HydrophobicContact CD2-CE1 3.62Å; F355-F390 AromaticContact CE2-CD1 3.96Å; F355-F390 HydrophobicContact CE2-CD1 3.96Å; F355-F390 HydrophobicContact CE2-CE1 4.01Å; F355-F390 HydrophobicContact CG-CE1 4.31Å; P388-F390 HydrophobicContact CB-CE2 4.02Å; P388-F390 HydrophobicContact CB-CZ 4.14Å; P388-F390 HydrophobicContact CG-CE2 4.24Å; F390-F392 HydrophobicContact CB-CE2 3.85Å; F390-F392 HydrophobicContact CB-CZ 3.84Å; F390-E401 CarbonylContact O-C 3.55Å; F390-E401 VanDerWaalsContact O-CA 3.24Å; F390-E401 WeakPolarHBondContact O-CA 3.41Å; F390-F402 HydrophobicContact CB-CD1 4.41Å; F390-F402 HydrophobicContact CB-CE1 3.99Å; F390-F402 HydrophobicContact CB-CE2 4.37Å; F390-F402 HydrophobicContact CB-CZ 3.95Å; F390-F402 HydrophobicContact CD2-CD2 4.17Å; F390-F402 HydrophobicContact CD2-CE1 4.49Å; F390-F402 AromaticContact CD2-CE2 3.46Å; F390-F402 HydrophobicContact CD2-CE2 3.46Å; F390-F402 VanDerWaalsContact CD2-CE2 3.46Å; F390-F402 AromaticContact CD2-CZ 3.64Å; F390-F402 HydrophobicContact CD2-CZ 3.64Å; F390-F402 HydrophobicContact CE2-CE2 4.18Å; F390-F402 HydrophobicContact CG-CE2 4.24Å; F390-F402 AromaticContact CG-CZ 4Å; F390-F402 HydrophobicContact CG-CZ 4Å; F390-F402 PolarHBondContact N-O 3.05Å; F390-F402 PolarHBondContact O-N 3.33Å; F390-L410 HydrophobicContact CB-CD1 4.43Å; F390-L410 HydrophobicContact CD1-CD1 3.76Å; F390-L410 HydrophobicContact CD1-CD2 4.43Å; F390-L410 HydrophobicContact CE1-CD1 4.19Å; F390-L410 HydrophobicContact CE1-CD2 4.02Å; F390-L410 HydrophobicContact CG-CD1 3.98Å; F390-L410 HydrophobicContact CZ-CD2 4.18Å |
| 391 | Q | 98.8 | Very high | 97.9 | Very high | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 30% | 0.295 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.7 | 143 | 170.4 | -64.1 | -166.9 | -16.9 | 0 | 0 | 110.1 | V338 F340 C382 I384 T389 Y393 K398 E401 | V338-Q391 PolarHBondContact N-O 3.23Å; V338-Q391 PolarHBondContact O-N 3.28Å; V338-Q391 VanDerWaalsContact O-N 3.12Å; F340-Q391 HydrophobicContact CD2-CG 4.32Å; F340-Q391 HydrophobicContact CE2-CB 4.08Å; F340-Q391 HydrophobicContact CE2-CG 4Å; C382-Q391 PolarHBondContact O-NE2 2.76Å; I384-Q391 HydrophobicContact CD1-CG 4.11Å; I384-Q391 VanDerWaalsContact CD1-NE2 3.33Å; T389-Q391 HydrophobicContact CG2-CG 4.1Å; Q391-Y393 HydrophobicContact CB-CE2 3.8Å; Q391-Y393 PolarHBondContact OE1-OH 3.38Å; Q391-K398 HydrophobicContact CB-CD 3.97Å; Q391-K398 HydrophobicContact CB-CG 4.45Å; Q391-K398 VanDerWaalsContact CD-CD 3.44Å; Q391-K398 HydrophobicContact CG-CD 3.91Å; Q391-E401 HydrophobicContact CG-CB 3.86Å; Q391-E401 PolarHBondContact NE2-OE2 2.95Å |
| 392 | F | 98.8 | Very high | 98 | Very high | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 27% | 0.274 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119 | 133.9 | -175.7 | -58.7 | -84.3 | 0 | 0 | 0 | 110 | L335 V336 A337 F390 K398 V399 D400 F402 L410 V413 I414 L417 | L335-F392 HydrophobicContact CD1-CB 4.28Å; V336-F392 CarbonylContact O-C 3.54Å; V336-F392 VanDerWaalsContact O-CA 3.28Å; V336-F392 WeakPolarHBondContact O-CA 3.38Å; A337-F392 HydrophobicContact CB-CD1 3.87Å; A337-F392 HydrophobicContact CB-CE1 3.72Å; F390-F392 HydrophobicContact CB-CE2 3.85Å; F390-F392 HydrophobicContact CB-CZ 3.84Å; F392-K398 CarbonylContact O-C 3.56Å; F392-K398 WeakPolarHBondContact O-CA 3.5Å; F392-V399 HydrophobicContact CB-CG2 4Å; F392-V399 VanDerWaalsContact O-CG2 3.31Å; F392-V399 WeakPolarHBondContact O-CG2 3.45Å; F392-V399 PolarHBondContact O-N 3.44Å; F392-D400 HydrophobicContact CB-CB 4.49Å; F392-D400 HydrophobicContact CD2-CB 4.13Å; F392-D400 PolarHBondContact N-O 3.18Å; F392-F402 HydrophobicContact CE2-CD1 4Å; F392-F402 AromaticContact CE2-CE1 3.67Å; F392-F402 HydrophobicContact CE2-CE1 3.67Å; F392-F402 AromaticContact CZ-CE1 3.92Å; F392-F402 HydrophobicContact CZ-CE1 3.92Å; F392-L410 HydrophobicContact CE1-CD1 4.3Å; F392-L410 HydrophobicContact CZ-CD1 3.87Å; F392-V413 HydrophobicContact CD1-CG1 4.18Å; F392-V413 HydrophobicContact CD2-CG1 3.59Å; F392-V413 HydrophobicContact CE1-CG1 4.11Å; F392-V413 HydrophobicContact CE2-CB 4.31Å; F392-V413 HydrophobicContact CE2-CG1 3.53Å; F392-V413 HydrophobicContact CG-CG1 3.94Å; F392-V413 HydrophobicContact CZ-CB 4.3Å; F392-V413 HydrophobicContact CZ-CG1 3.79Å; F392-I414 HydrophobicContact CD1-CG1 4.42Å; F392-I414 HydrophobicContact CE1-CD1 4.29Å; F392-I414 HydrophobicContact CE1-CG1 3.67Å; F392-I414 HydrophobicContact CZ-CG1 4.49Å; F392-L417 HydrophobicContact CB-CD1 3.75Å; F392-L417 HydrophobicContact CG-CD1 4.02Å |
| 393 | Y | 98.7 | Very high | 98 | Very high | 16 Ų | 16 | 55.1 Ų | 55.1 | 6% | 0.063 | 29% | 0.286 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.9 | 147.3 | -177.6 | -58.1 | -106.5 | 0 | 0 | 0 | 112.2 | F324 L328 V336 V338 C382 Q391 E397 K398 | F324-Y393 HydrophobicContact CZ-CE2 4.09Å; F324-Y393 AromaticContact CZ-CZ 3.89Å; L328-Y393 HydrophobicContact CD1-CD1 4.17Å; L328-Y393 HydrophobicContact CD1-CE1 4.19Å; L328-Y393 HydrophobicContact CD2-CD1 4.18Å; L328-Y393 HydrophobicContact CD2-CD2 3.99Å; L328-Y393 HydrophobicContact CD2-CG 3.79Å; V336-Y393 PolarHBondContact N-O 3.1Å; V336-Y393 PolarHBondContact O-N 3.38Å; V338-Y393 HydrophobicContact CB-CE2 4.49Å; V338-Y393 HydrophobicContact CG2-CD2 3.9Å; V338-Y393 HydrophobicContact CG2-CE2 3.7Å; C382-Y393 PolarHBondContact SG-OH 3.41Å; Q391-Y393 HydrophobicContact CB-CE2 3.8Å; Q391-Y393 PolarHBondContact OE1-OH 3.38Å; Y393-E397 CarbonylContact C-O 3.55Å; Y393-E397 WeakPolarHBondContact CA-O 3.4Å; Y393-E397 WeakPolarHBondContact CB-O 3.21Å; Y393-K398 HydrophobicContact CD1-CB 3.96Å; Y393-K398 HydrophobicContact CE1-CB 3.84Å; Y393-K398 HydrophobicContact CE1-CG 4.31Å |
| 394 | K | 97.5 | Very high | 98 | Very high | 57 Ų | 57 | 53.1 Ų | 53.1 | 25% | 0.248 | 27% | 0.272 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.8 | 134.8 | 163.1 | -86.9 | -174.9 | 158.7 | 175.1 | 0 | 108.6 | L335 E396 E397 V399 L417 K418 | L335-K394 HydrophobicContact CB-CG 4.48Å; L335-K394 HydrophobicContact CD1-CD 4.46Å; L335-K394 HydrophobicContact CD1-CG 4.07Å; K394-E396 VanDerWaalsContact C-N 3.29Å; K394-E396 PolarHBondContact O-N 3.17Å; K394-E397 PolarHBondContact N-O 2.88Å; K394-E397 PolarHBondContact O-N 3.16Å; K394-E397 VanDerWaalsContact O-N 3.08Å; K394-V399 HydrophobicContact CB-CG1 4.3Å; K394-L417 WeakPolarHBondContact CE-O 3.44Å; K394-L417 PolarHBondContact NZ-O 3.21Å; K394-K418 PolarHBondContact NZ-OXT 2.04Å |
| 395 | K | 96.4 | Very high | 98 | Very high | 133 Ų | 133 | 54.2 Ų | 54.2 | 58% | 0.578 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.3 | 44.8 | 179.1 | -51.7 | -174.6 | 179.3 | -163.6 | 0 | 113.1 | G332 E333 E397 | G332-K395 PolarHBondContact O-N 3.19Å; E333-K395 WeakPolarHBondContact OE1-CE 3.44Å; E333-K395 IonicContact OE1-NZ 2.61Å; E333-K395 PolarHBondContact OE1-NZ 3Å; K395-E397 PolarHBondContact O-N 2.84Å; K395-E397 VanDerWaalsContact O-N 3.09Å |
| 396 | E | 96.8 | Very high | 98.1 | Very high | 109 Ų | 109 | 50.6 Ų | 50.6 | 51% | 0.509 | 27% | 0.266 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 65.4 | -3.6 | -176.8 | -55.9 | 171.6 | -115.9 | 0 | 0 | 115.8 | L328 K329 K394 | L328-E396 HydrophobicContact CB-CG 4.19Å; K329-E396 WeakPolarHBondContact CE-OE2 3.43Å; K329-E396 HydrophobicContact CG-CG 4.12Å; K329-E396 VanDerWaalsContact CG-OE2 3.28Å; K329-E396 WeakPolarHBondContact CG-OE2 3.4Å; K394-E396 VanDerWaalsContact C-N 3.29Å; K394-E396 PolarHBondContact O-N 3.17Å |
| 397 | E | 97.4 | Very high | 98.1 | Very high | 144 Ų | 144 | 51.9 Ų | 51.9 | 67% | 0.673 | 26% | 0.264 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -95.2 | 139.4 | 176.1 | -174.4 | 170.8 | -159.7 | 0 | 0 | 111.8 | Y393 K394 K395 | Y393-E397 CarbonylContact C-O 3.55Å; Y393-E397 WeakPolarHBondContact CA-O 3.4Å; Y393-E397 WeakPolarHBondContact CB-O 3.21Å; K394-E397 PolarHBondContact N-O 2.88Å; K394-E397 PolarHBondContact O-N 3.16Å; K394-E397 VanDerWaalsContact O-N 3.08Å; K395-E397 PolarHBondContact O-N 2.84Å; K395-E397 VanDerWaalsContact O-N 3.09Å |
| 398 | K | 98.3 | Very high | 98.1 | Very high | 77 Ų | 77 | 58.8 Ų | 58.8 | 34% | 0.335 | 30% | 0.295 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.7 | 120.7 | 176.2 | -169.6 | 176.1 | 76.2 | 177.2 | 0 | 110.2 | Q391 F392 Y393 E401 | Q391-K398 HydrophobicContact CB-CD 3.97Å; Q391-K398 HydrophobicContact CB-CG 4.45Å; Q391-K398 VanDerWaalsContact CD-CD 3.44Å; Q391-K398 HydrophobicContact CG-CD 3.91Å; F392-K398 CarbonylContact O-C 3.56Å; F392-K398 WeakPolarHBondContact O-CA 3.5Å; Y393-K398 HydrophobicContact CD1-CB 3.96Å; Y393-K398 HydrophobicContact CE1-CB 3.84Å; Y393-K398 HydrophobicContact CE1-CG 4.31Å; K398-E401 WeakPolarHBondContact CE-OE1 3.37Å; K398-E401 IonicContact NZ-OE1 3.44Å; K398-E401 PolarHBondContact NZ-OE1 3.41Å; K398-E401 IonicContact NZ-OE2 2.61Å; K398-E401 PolarHBondContact NZ-OE2 3.39Å |
| 399 | V | 98.4 | Very high | 98.1 | Very high | 67 Ų | 67 | 62.5 Ų | 62.5 | 41% | 0.406 | 31% | 0.311 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | -27.7 | -173.2 | -69 | 0 | 0 | 0 | 0 | 114.7 | L335 F392 K394 L417 | L335-V399 HydrophobicContact CD1-CG2 4.38Å; F392-V399 HydrophobicContact CB-CG2 4Å; F392-V399 VanDerWaalsContact O-CG2 3.31Å; F392-V399 WeakPolarHBondContact O-CG2 3.45Å; F392-V399 PolarHBondContact O-N 3.44Å; K394-V399 HydrophobicContact CB-CG1 4.3Å; V399-L417 HydrophobicContact CG2-CD1 3.98Å |
| 400 | D | 98.5 | Very high | 98.1 | Very high | 52 Ų | 52 | 62.2 Ų | 62.2 | 28% | 0.278 | 31% | 0.309 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.5 | 164.6 | 170 | -171.2 | 28.3 | 0 | 0 | 0 | 110.7 | F392 K409 V413 L417 | F392-D400 HydrophobicContact CB-CB 4.49Å; F392-D400 HydrophobicContact CD2-CB 4.13Å; F392-D400 PolarHBondContact N-O 3.18Å; D400-K409 IonicContact OD2-NZ 3.95Å; D400-V413 HydrophobicContact CB-CG1 4.32Å; D400-V413 WeakPolarHBondContact OD2-CG1 3.35Å; D400-V413 WeakPolarHBondContact OD2-CG2 2.96Å; D400-L417 HydrophobicContact CB-CD1 3.79Å |
| 401 | E | 98.6 | Very high | 98.1 | Very high | 85 Ų | 85 | 65.4 Ų | 65.4 | 40% | 0.397 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.4 | 157.1 | 167.8 | 71.3 | -171.5 | 135.6 | 0 | 0 | 114.4 | F390 Q391 K398 | F390-E401 CarbonylContact O-C 3.55Å; F390-E401 VanDerWaalsContact O-CA 3.24Å; F390-E401 WeakPolarHBondContact O-CA 3.41Å; Q391-E401 HydrophobicContact CG-CB 3.86Å; Q391-E401 PolarHBondContact NE2-OE2 2.95Å; K398-E401 WeakPolarHBondContact CE-OE1 3.37Å; K398-E401 IonicContact NZ-OE1 3.44Å; K398-E401 PolarHBondContact NZ-OE1 3.41Å; K398-E401 IonicContact NZ-OE2 2.61Å; K398-E401 PolarHBondContact NZ-OE2 3.39Å |
| 402 | F | 98.6 | Very high | 98.1 | Very high | 17 Ų | 17 | 68 Ų | 68 | 8% | 0.075 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -156.8 | 152.3 | 160.5 | 64.4 | -86.1 | 0 | 0 | 0 | 113.2 | T389 F390 F392 L406 K409 L410 V413 | T389-F402 WeakPolarHBondContact CA-O 3.45Å; F390-F402 HydrophobicContact CB-CD1 4.41Å; F390-F402 HydrophobicContact CB-CE1 3.99Å; F390-F402 HydrophobicContact CB-CE2 4.37Å; F390-F402 HydrophobicContact CB-CZ 3.95Å; F390-F402 HydrophobicContact CD2-CD2 4.17Å; F390-F402 HydrophobicContact CD2-CE1 4.49Å; F390-F402 AromaticContact CD2-CE2 3.46Å; F390-F402 HydrophobicContact CD2-CE2 3.46Å; F390-F402 VanDerWaalsContact CD2-CE2 3.46Å; F390-F402 AromaticContact CD2-CZ 3.64Å; F390-F402 HydrophobicContact CD2-CZ 3.64Å; F390-F402 HydrophobicContact CE2-CE2 4.18Å; F390-F402 HydrophobicContact CG-CE2 4.24Å; F390-F402 AromaticContact CG-CZ 4Å; F390-F402 HydrophobicContact CG-CZ 4Å; F390-F402 PolarHBondContact N-O 3.05Å; F390-F402 PolarHBondContact O-N 3.33Å; F392-F402 HydrophobicContact CE2-CD1 4Å; F392-F402 AromaticContact CE2-CE1 3.67Å; F392-F402 HydrophobicContact CE2-CE1 3.67Å; F392-F402 AromaticContact CZ-CE1 3.92Å; F392-F402 HydrophobicContact CZ-CE1 3.92Å; F402-L406 HydrophobicContact CD2-CD1 4.36Å; F402-L406 HydrophobicContact CE2-CB 4.05Å; F402-K409 HydrophobicContact CB-CD 4.08Å; F402-K409 HydrophobicContact CD1-CD 3.65Å; F402-K409 VanDerWaalsContact CD1-CE 3.4Å; F402-K409 HydrophobicContact CD1-CG 3.97Å; F402-K409 HydrophobicContact CD2-CD 4.12Å; F402-K409 HydrophobicContact CE1-CB 4.47Å; F402-K409 HydrophobicContact CE1-CD 4.08Å; F402-K409 HydrophobicContact CE1-CG 3.85Å; F402-K409 HydrophobicContact CE2-CB 4.4Å; F402-K409 HydrophobicContact CE2-CG 4.46Å; F402-K409 HydrophobicContact CG-CD 3.68Å; F402-K409 HydrophobicContact CG-CG 4.32Å; F402-K409 HydrophobicContact CZ-CB 4.25Å; F402-K409 HydrophobicContact CZ-CG 4.13Å; F402-L410 HydrophobicContact CZ-CB 3.89Å; F402-L410 HydrophobicContact CZ-CD1 4.29Å; F402-V413 HydrophobicContact CE1-CG2 4.34Å |
| 403 | C | 98.1 | Very high | 98 | Very high | 52 Ų | 52 | 68.4 Ų | 68.4 | 35% | 0.351 | 35% | 0.348 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.3 | 146.2 | 171.3 | -176.8 | 0 | 0 | 0 | 0 | 111 | C386 P388 T389 | C386-C403 WeakPolarHBondContact CB-SG 3.39Å; C386-C403 WeakPolarHBondContact SG-CB 3.48Å; C386-C403 CovalentContact SG-SG 2.04Å; C386-C403 PolarHBondContact SG-SG 2.94Å; P388-C403 WeakPolarHBondContact O-CA 3.15Å; T389-C403 VanDerWaalsContact OG1-CB 3.3Å; T389-C403 WeakPolarHBondContact OG1-CB 3.35Å; T389-C403 PolarHBondContact OG1-SG 2.67Å |
| 404 | G | 97.8 | Very high | 98 | Very high | 21 Ų | 21 | 67.6 Ų | 67.6 | 22% | 0.216 | 35% | 0.345 | C | S | . | . | S | Bend | trans | 110.1 | 151.4 | 177 | 0 | 0 | 0 | 0 | 0 | 114.2 | P388 L406 | P388-G404 PolarHBondContact O-N 3.02Å; G404-L406 PolarHBondContact O-N 3.5Å |
| 405 | A | 98.3 | Very high | 98 | Very high | 37 Ų | 37 | 68 Ų | 68 | 31% | 0.306 | 36% | 0.358 | S | S | . | . | trans | -76.1 | 54.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | P347 I351 P388 K407 | P347-A405 HydrophobicContact CB-CB 3.96Å; I351-A405 HydrophobicContact CB-CB 4.07Å; I351-A405 HydrophobicContact CD1-CB 4.39Å; I351-A405 HydrophobicContact CG2-CB 4.1Å; P388-A405 HydrophobicContact CG-CB 4.11Å; A405-K407 PolarHBondContact O-N 3.03Å | ||
| 406 | L | 98.1 | Very high | 98.1 | Very high | 93 Ų | 93 | 69.5 Ų | 69.5 | 49% | 0.487 | 37% | 0.367 | S | S | . | . | trans | -95 | 84.6 | -171 | -58.1 | 178.3 | 0 | 0 | 0 | 111.9 | F402 G404 E408 K409 L410 | F402-L406 HydrophobicContact CD2-CD1 4.36Å; F402-L406 HydrophobicContact CE2-CB 4.05Å; G404-L406 PolarHBondContact O-N 3.5Å; L406-E408 VanDerWaalsContact C-N 3.33Å; L406-E408 PolarHBondContact O-N 3.43Å; L406-K409 HydrophobicContact CB-CB 4Å; L406-K409 PolarHBondContact O-N 2.83Å; L406-K409 VanDerWaalsContact O-N 3.16Å; L406-L410 PolarHBondContact O-N 2.72Å | ||
| 407 | K | 98.1 | Very high | 98.1 | Very high | 88 Ų | 88 | 66.3 Ų | 66.3 | 38% | 0.383 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -53.4 | -45.2 | -176.6 | -63.8 | -171.1 | 179 | -174.9 | 0 | 113.6 | T350 I351 F354 A405 L410 E411 | T350-K407 WeakPolarHBondContact O-CE 3.25Å; T350-K407 PolarHBondContact O-NZ 2.59Å; I351-K407 HydrophobicContact CD1-CG 4.02Å; I351-K407 HydrophobicContact CG1-CG 4.19Å; F354-K407 HydrophobicContact CB-CD 4.11Å; F354-K407 HydrophobicContact CB-CG 4.5Å; F354-K407 HydrophobicContact CD1-CB 3.83Å; F354-K407 HydrophobicContact CD1-CD 4.06Å; F354-K407 HydrophobicContact CD1-CG 3.7Å; F354-K407 HydrophobicContact CD2-CD 4.29Å; F354-K407 HydrophobicContact CE1-CB 3.62Å; F354-K407 HydrophobicContact CE1-CG 4.05Å; F354-K407 WeakPolarHBondContact CE1-O 3.47Å; F354-K407 HydrophobicContact CG-CB 4.44Å; F354-K407 HydrophobicContact CG-CD 3.9Å; F354-K407 HydrophobicContact CG-CG 4.08Å; F354-K407 HydrophobicContact CZ-CB 4.06Å; A405-K407 PolarHBondContact O-N 3.03Å; K407-L410 PolarHBondContact O-N 2.74Å; K407-E411 PolarHBondContact O-N 2.9Å; K407-E411 VanDerWaalsContact O-N 3.1Å |
| 408 | E | 98.2 | Very high | 97.5 | Very high | 178 Ų | 178 | 64.8 Ų | 64.8 | 83% | 0.832 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -64.9 | -41.7 | 179.9 | -66.4 | 164.9 | -169.6 | 0 | 0 | 112.1 | L406 A412 | L406-E408 VanDerWaalsContact C-N 3.33Å; L406-E408 PolarHBondContact O-N 3.43Å; E408-A412 VanDerWaalsContact O-CB 3.28Å; E408-A412 WeakPolarHBondContact O-CB 3.44Å; E408-A412 PolarHBondContact O-N 2.94Å |
| 409 | K | 98.4 | Very high | 97.4 | Very high | 80 Ų | 80 | 64.2 Ų | 64.2 | 35% | 0.348 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -67.6 | -40.9 | 175.1 | -174.7 | 174 | 175.8 | -177.2 | 0 | 111.2 | D400 F402 L406 E411 A412 V413 | D400-K409 IonicContact OD2-NZ 3.95Å; F402-K409 HydrophobicContact CB-CD 4.08Å; F402-K409 HydrophobicContact CD1-CD 3.65Å; F402-K409 VanDerWaalsContact CD1-CE 3.4Å; F402-K409 HydrophobicContact CD1-CG 3.97Å; F402-K409 HydrophobicContact CD2-CD 4.12Å; F402-K409 HydrophobicContact CE1-CB 4.47Å; F402-K409 HydrophobicContact CE1-CD 4.08Å; F402-K409 HydrophobicContact CE1-CG 3.85Å; F402-K409 HydrophobicContact CE2-CB 4.4Å; F402-K409 HydrophobicContact CE2-CG 4.46Å; F402-K409 HydrophobicContact CG-CD 3.68Å; F402-K409 HydrophobicContact CG-CG 4.32Å; F402-K409 HydrophobicContact CZ-CB 4.25Å; F402-K409 HydrophobicContact CZ-CG 4.13Å; L406-K409 HydrophobicContact CB-CB 4Å; L406-K409 PolarHBondContact O-N 2.83Å; L406-K409 VanDerWaalsContact O-N 3.16Å; K409-E411 PolarHBondContact O-N 3.44Å; K409-A412 PolarHBondContact O-N 2.85Å; K409-V413 HydrophobicContact CD-CG2 4.44Å; K409-V413 HydrophobicContact CG-CG2 3.84Å; K409-V413 WeakPolarHBondContact O-CB 3.29Å; K409-V413 VanDerWaalsContact O-CG2 3.31Å; K409-V413 WeakPolarHBondContact O-CG2 3.1Å; K409-V413 PolarHBondContact O-N 2.95Å |
| 410 | L | 98.4 | Very high | 97.4 | Very high | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -57.4 | -49.7 | 178.8 | 179.4 | 57.4 | 0 | 0 | 0 | 111.8 | I351 F354 F355 L358 F390 F392 F402 L406 K407 I414 | I351-L410 HydrophobicContact CD1-CD2 3.94Å; I351-L410 HydrophobicContact CG1-CD2 4.22Å; F354-L410 HydrophobicContact CD1-CD2 3.99Å; F354-L410 HydrophobicContact CE1-CB 4.47Å; F354-L410 HydrophobicContact CE1-CD2 4.14Å; F355-L410 HydrophobicContact CB-CD2 4.45Å; F355-L410 HydrophobicContact CD2-CD1 4.35Å; F355-L410 HydrophobicContact CD2-CD2 4.08Å; L358-L410 HydrophobicContact CD1-CD2 3.81Å; L358-L410 HydrophobicContact CD1-CG 3.77Å; F390-L410 HydrophobicContact CB-CD1 4.43Å; F390-L410 HydrophobicContact CD1-CD1 3.76Å; F390-L410 HydrophobicContact CD1-CD2 4.43Å; F390-L410 HydrophobicContact CE1-CD1 4.19Å; F390-L410 HydrophobicContact CE1-CD2 4.02Å; F390-L410 HydrophobicContact CG-CD1 3.98Å; F390-L410 HydrophobicContact CZ-CD2 4.18Å; F392-L410 HydrophobicContact CE1-CD1 4.3Å; F392-L410 HydrophobicContact CZ-CD1 3.87Å; F402-L410 HydrophobicContact CZ-CB 3.89Å; F402-L410 HydrophobicContact CZ-CD1 4.29Å; L406-L410 PolarHBondContact O-N 2.72Å; K407-L410 PolarHBondContact O-N 2.74Å; L410-I414 HydrophobicContact CD1-CD1 3.75Å; L410-I414 HydrophobicContact CD1-CG1 4.49Å; L410-I414 HydrophobicContact CG-CD1 4.13Å; L410-I414 WeakPolarHBondContact O-CD1 3.45Å; L410-I414 VanDerWaalsContact O-CG1 3.31Å; L410-I414 WeakPolarHBondContact O-CG1 3.44Å; L410-I414 PolarHBondContact O-N 3.03Å; L410-I414 VanDerWaalsContact O-N 3.15Å |
| 411 | E | 97.9 | Very high | 97.3 | Very high | 67 Ų | 67 | 64.7 Ų | 64.7 | 31% | 0.313 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -68.7 | -39.1 | 178.4 | -176.4 | 166.5 | -166 | 0 | 0 | 112.3 | F354 L358 K361 K407 K409 A415 | F354-E411 HydrophobicContact CZ-CB 4.21Å; L358-E411 HydrophobicContact CD2-CB 4.47Å; L358-E411 HydrophobicContact CD2-CG 4.29Å; K361-E411 IonicContact NZ-OE1 2.75Å; K361-E411 PolarHBondContact NZ-OE1 3.36Å; K407-E411 PolarHBondContact O-N 2.9Å; K407-E411 VanDerWaalsContact O-N 3.1Å; K409-E411 PolarHBondContact O-N 3.44Å; E411-A415 VanDerWaalsContact O-CB 3.29Å; E411-A415 WeakPolarHBondContact O-CB 3.43Å; E411-A415 PolarHBondContact O-N 3.42Å |
| 412 | A | 98.4 | Very high | 97.3 | Very high | 55 Ų | 55 | 63.5 Ų | 63.5 | 46% | 0.455 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.4 | -47.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | E408 K409 A415 E416 | E408-A412 VanDerWaalsContact O-CB 3.28Å; E408-A412 WeakPolarHBondContact O-CB 3.44Å; E408-A412 PolarHBondContact O-N 2.94Å; K409-A412 PolarHBondContact O-N 2.85Å; A412-A415 PolarHBondContact O-N 3.48Å; A412-E416 WeakPolarHBondContact O-CB 3.17Å; A412-E416 PolarHBondContact O-N 3.32Å |
| 413 | V | 98.4 | Very high | 97.2 | Very high | 8 Ų | 8 | 66.4 Ų | 66.4 | 5% | 0.048 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -65.5 | -40.7 | 179.7 | 171.9 | 0 | 0 | 0 | 0 | 111.3 | F392 D400 F402 K409 A415 E416 L417 | F392-V413 HydrophobicContact CD1-CG1 4.18Å; F392-V413 HydrophobicContact CD2-CG1 3.59Å; F392-V413 HydrophobicContact CE1-CG1 4.11Å; F392-V413 HydrophobicContact CE2-CB 4.31Å; F392-V413 HydrophobicContact CE2-CG1 3.53Å; F392-V413 HydrophobicContact CG-CG1 3.94Å; F392-V413 HydrophobicContact CZ-CB 4.3Å; F392-V413 HydrophobicContact CZ-CG1 3.79Å; D400-V413 HydrophobicContact CB-CG1 4.32Å; D400-V413 WeakPolarHBondContact OD2-CG1 3.35Å; D400-V413 WeakPolarHBondContact OD2-CG2 2.96Å; F402-V413 HydrophobicContact CE1-CG2 4.34Å; K409-V413 HydrophobicContact CD-CG2 4.44Å; K409-V413 HydrophobicContact CG-CG2 3.84Å; K409-V413 WeakPolarHBondContact O-CB 3.29Å; K409-V413 VanDerWaalsContact O-CG2 3.31Å; K409-V413 WeakPolarHBondContact O-CG2 3.1Å; K409-V413 PolarHBondContact O-N 2.95Å; V413-A415 VanDerWaalsContact C-N 3.33Å; V413-A415 PolarHBondContact O-N 2.72Å; V413-E416 PolarHBondContact O-N 3.16Å; V413-L417 HydrophobicContact CG1-CD1 3.46Å; V413-L417 VanDerWaalsContact CG1-CD1 3.46Å; V413-L417 HydrophobicContact CG1-CG 4.09Å; V413-L417 WeakPolarHBondContact O-CB 3.24Å; V413-L417 VanDerWaalsContact O-CG 3.31Å; V413-L417 WeakPolarHBondContact O-CG 3.47Å; V413-L417 PolarHBondContact O-N 2.89Å |
| 414 | I | 97.9 | Very high | 97.1 | Very high | 0 Ų | 0 | 67.4 Ų | 67.4 | 0% | 0 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -62.5 | -41.8 | 173.8 | -70.4 | 166.8 | 0 | 0 | 0 | 110.8 | A337 L358 V365 F367 F392 L410 K418 | A337-I414 HydrophobicContact CB-CD1 4.43Å; L358-I414 HydrophobicContact CD1-CD1 4.06Å; V365-I414 HydrophobicContact CG2-CG2 4.33Å; F367-I414 HydrophobicContact CE1-CD1 3.88Å; F367-I414 HydrophobicContact CZ-CD1 4.13Å; F392-I414 HydrophobicContact CD1-CG1 4.42Å; F392-I414 HydrophobicContact CE1-CD1 4.29Å; F392-I414 HydrophobicContact CE1-CG1 3.67Å; F392-I414 HydrophobicContact CZ-CG1 4.49Å; L410-I414 HydrophobicContact CD1-CD1 3.75Å; L410-I414 HydrophobicContact CD1-CG1 4.49Å; L410-I414 HydrophobicContact CG-CD1 4.13Å; L410-I414 WeakPolarHBondContact O-CD1 3.45Å; L410-I414 VanDerWaalsContact O-CG1 3.31Å; L410-I414 WeakPolarHBondContact O-CG1 3.44Å; L410-I414 PolarHBondContact O-N 3.03Å; L410-I414 VanDerWaalsContact O-N 3.15Å; I414-K418 HydrophobicContact CG2-CD 4.37Å; I414-K418 WeakPolarHBondContact O-CB 3.28Å; I414-K418 VanDerWaalsContact O-CD 3.26Å; I414-K418 WeakPolarHBondContact O-CD 3.31Å; I414-K418 WeakPolarHBondContact O-CG 3.32Å; I414-K418 PolarHBondContact O-N 3Å |
| 415 | A | 97.4 | Very high | 97.1 | Very high | 65 Ų | 65 | 70.7 Ų | 70.7 | 54% | 0.537 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -69.6 | -29.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | E411 A412 V413 | E411-A415 VanDerWaalsContact O-CB 3.29Å; E411-A415 WeakPolarHBondContact O-CB 3.43Å; E411-A415 PolarHBondContact O-N 3.42Å; A412-A415 PolarHBondContact O-N 3.48Å; V413-A415 VanDerWaalsContact C-N 3.33Å; V413-A415 PolarHBondContact O-N 2.72Å |
| 416 | E | 97.9 | Very high | 97 | Very high | 164 Ų | 164 | 73.3 Ų | 73.3 | 77% | 0.766 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -80 | -39.7 | 176.7 | -177.6 | 172.6 | 172.4 | 0 | 0 | 112.6 | A412 V413 | A412-E416 WeakPolarHBondContact O-CB 3.17Å; A412-E416 PolarHBondContact O-N 3.32Å; V413-E416 PolarHBondContact O-N 3.16Å |
| 417 | L | 96.3 | Very high | 96.9 | Very high | 42 Ų | 42 | 71.7 Ų | 71.7 | 22% | 0.22 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -90.5 | -8 | -169.1 | -66.4 | -178.5 | 0 | 0 | 0 | 115.7 | L335 F392 K394 V399 D400 V413 | L335-L417 HydrophobicContact CD1-CB 3.82Å; L335-L417 HydrophobicContact CD1-CD1 4.42Å; L335-L417 HydrophobicContact CD2-CB 3.95Å; F392-L417 HydrophobicContact CB-CD1 3.75Å; F392-L417 HydrophobicContact CG-CD1 4.02Å; K394-L417 WeakPolarHBondContact CE-O 3.44Å; K394-L417 PolarHBondContact NZ-O 3.21Å; V399-L417 HydrophobicContact CG2-CD1 3.98Å; D400-L417 HydrophobicContact CB-CD1 3.79Å; V413-L417 HydrophobicContact CG1-CD1 3.46Å; V413-L417 VanDerWaalsContact CG1-CD1 3.46Å; V413-L417 HydrophobicContact CG1-CG 4.09Å; V413-L417 WeakPolarHBondContact O-CB 3.24Å; V413-L417 VanDerWaalsContact O-CG 3.31Å; V413-L417 WeakPolarHBondContact O-CG 3.47Å; V413-L417 PolarHBondContact O-N 2.89Å |
| 418 | K | 85.5 | Confident | 96.8 | Very high | 113 Ų | 113 | 70.2 Ų | 70.2 | 49% | 0.491 | 37% | 0.365 | S | S | . | . | trans | -84.6 | 0 | -170.2 | 72.3 | -165.3 | -153.6 | 105.1 | 0 | 114.9 | L335 D364 V365 K394 I414 | L335-K418 HydrophobicContact CD2-CB 4.06Å; D364-K418 VanDerWaalsContact CG-NZ 3.3Å; D364-K418 IonicContact OD1-NZ 3.19Å; D364-K418 PolarHBondContact OD1-NZ 3.18Å; D364-K418 IonicContact OD2-NZ 2.61Å; D364-K418 PolarHBondContact OD2-NZ 3.41Å; V365-K418 HydrophobicContact CG2-CB 4.04Å; V365-K418 HydrophobicContact CG2-CD 4.34Å; K394-K418 PolarHBondContact NZ-OXT 2.04Å; I414-K418 HydrophobicContact CG2-CD 4.37Å; I414-K418 WeakPolarHBondContact O-CB 3.28Å; I414-K418 VanDerWaalsContact O-CD 3.26Å; I414-K418 WeakPolarHBondContact O-CD 3.31Å; I414-K418 WeakPolarHBondContact O-CG 3.32Å; I414-K418 PolarHBondContact O-N 3Å |
Retrieved 418 of 418 residues in 158.2 ms
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