| 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 | 38.4 | Very low | 44.3 | Very low | 246 Ų | 246 | 147.1 Ų | 147.1 | 100% | 1.212 | 79% | 0.791 | S | S | * | * | 0 | 121.6 | 0 | -83.8 | 159.6 | 118.2 | 0 | 0 | 107.8 | |||||
| 2 | S | 44 | Very low | 44 | Very low | 113 Ų | 113 | 147.2 Ų | 147.2 | 79% | 0.79 | 78% | 0.782 | S | S | * | * | trans | 54 | 95.3 | 178.5 | -91.3 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 3 | S | 42 | Very low | 43.7 | Very low | 105 Ų | 105 | 148 Ų | 148 | 73% | 0.734 | 79% | 0.786 | S | S | * | * | 53.7 | 125.1 | 73.3 | 73.7 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 4 | K | 46 | Very low | 43.2 | Very low | 178 Ų | 178 | 149.1 Ų | 149.1 | 77% | 0.774 | 79% | 0.792 | S | S | * | * | cis | -176.9 | 149.9 | 47 | -145.1 | -179 | -172.9 | -164 | 0 | 110.2 | ||||
| 5 | P | 49.7 | Very low | 42.8 | Very low | 121 Ų | 121 | 143.5 Ų | 143.5 | 79% | 0.786 | 78% | 0.783 | S | S | * | * | trans | -113.3 | 158.3 | 160.3 | 36.9 | -26 | 0 | 0 | 0 | 112.4 | ||||
| 6 | E | 47.9 | Very low | 42.6 | Very low | 148 Ų | 148 | 144.1 Ų | 144.1 | 69% | 0.692 | 79% | 0.793 | S | S | * | * | trans | -166.1 | 135.5 | 161.7 | -128.2 | 178.8 | 136.2 | 0 | 0 | 113 | ||||
| 7 | P | 50.8 | Low | 42.3 | Very low | 115 Ų | 115 | 140 Ų | 140 | 75% | 0.747 | 79% | 0.792 | S | S | * | * | trans | -115.2 | 167.2 | 164.7 | 38.7 | -27.3 | 0 | 0 | 0 | 112.8 | ||||
| 8 | K | 43.6 | Very low | 42.4 | Very low | 171 Ų | 171 | 139.6 Ų | 139.6 | 74% | 0.743 | 80% | 0.796 | S | S | * | * | trans | 172.8 | 115.7 | 161.3 | -98.7 | 154.8 | -174.8 | 179.4 | 0 | 108.9 | ||||
| 9 | D | 40.3 | Very low | 42.2 | Very low | 144 Ų | 144 | 138.4 Ų | 138.4 | 77% | 0.77 | 80% | 0.797 | S | S | * | * | 101.3 | 148.4 | 76.7 | -91.5 | -31.9 | 0 | 0 | 0 | 112.3 | |||||
| 10 | V | 42.2 | Very low | 42.2 | Very low | 116 Ų | 116 | 135.6 Ų | 135.6 | 70% | 0.703 | 79% | 0.791 | S | S | * | * | trans | 127.2 | 103.2 | 142.3 | -178.2 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 11 | H | 42.4 | Very low | 42.1 | Very low | 161 Ų | 161 | 134.9 Ų | 134.9 | 75% | 0.745 | 79% | 0.794 | S | S | * | * | trans | 62.7 | 149.6 | 136.4 | -69.3 | -34.9 | 0 | 0 | 0 | 120.9 | ||||
| 12 | Q | 40.8 | Very low | 42.2 | Very low | 148 Ų | 148 | 129 Ų | 129 | 69% | 0.692 | 77% | 0.774 | S | S | * | * | cis | -169.2 | 141.1 | 14.4 | -125.7 | 172.8 | 23.7 | 0 | 0 | 111.4 | ||||
| 13 | L | 40.5 | Very low | 41.8 | Very low | 158 Ų | 158 | 130 Ų | 130 | 83% | 0.827 | 78% | 0.779 | S | S | * | * | trans | 60.1 | 135.9 | 133.3 | -96.1 | 128.1 | 0 | 0 | 0 | 126.4 | ||||
| 14 | N | 35.8 | Very low | 41.4 | Very low | 164 Ų | 164 | 130.2 Ų | 130.2 | 88% | 0.877 | 78% | 0.781 | S | S | * | * | trans | -56.8 | 160.2 | 175.6 | -83.7 | -23.2 | 0 | 0 | 0 | 118.5 | ||||
| 15 | G | 38 | Very low | 41.1 | Very low | 64 Ų | 64 | 127.8 Ų | 127.8 | 66% | 0.66 | 79% | 0.786 | S | S | * | * | trans | 156.6 | 100.8 | 141.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 16 | T | 39.8 | Very low | 40.5 | Very low | 153 Ų | 153 | 130.4 Ų | 130.4 | 94% | 0.939 | 79% | 0.794 | S | S | * | * | trans | 57.2 | 125.1 | 135.9 | 54.5 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 17 | G | 36.4 | Very low | 40.1 | Very low | 75 Ų | 75 | 126.8 Ų | 126.8 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | trans | 114 | 125.8 | 131.4 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 18 | P | 44.2 | Very low | 39.5 | Very low | 133 Ų | 133 | 127.9 Ų | 127.9 | 86% | 0.864 | 80% | 0.803 | S | S | * | * | trans | -105.5 | 153.9 | -176.4 | 38.9 | -30.6 | 0 | 0 | 0 | 115.1 | ||||
| 19 | S | 38.8 | Very low | 39 | Very low | 116 Ų | 116 | 123.2 Ų | 123.2 | 81% | 0.811 | 80% | 0.803 | S | S | * | * | trans | 170.7 | 107.5 | 164.6 | 167.8 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 20 | A | 41.6 | Very low | 38.9 | Very low | 83 Ų | 83 | 127.5 Ų | 127.5 | 69% | 0.686 | 81% | 0.809 | S | S | * | * | 100 | 128 | 90.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 21 | S | 41.8 | Very low | 38.6 | Very low | 120 Ų | 120 | 130.1 Ų | 130.1 | 84% | 0.839 | 81% | 0.813 | S | S | * | * | trans | 111.9 | 133.6 | 141.9 | -53.3 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 22 | P | 40.1 | Very low | 38.2 | Very low | 122 Ų | 122 | 128.7 Ų | 128.7 | 79% | 0.792 | 82% | 0.819 | S | S | * | * | trans | -104.6 | 164.5 | -170.2 | 41.1 | -32.3 | 0 | 0 | 0 | 113.3 | ||||
| 23 | C | 34.8 | Very low | 38 | Very low | 134 Ų | 134 | 130 Ų | 130 | 91% | 0.905 | 83% | 0.829 | S | S | * | * | trans | -155.3 | 124.2 | 160.3 | -107.8 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 24 | S | 34.3 | Very low | 37.7 | Very low | 110 Ų | 110 | 127 Ų | 127 | 77% | 0.769 | 83% | 0.827 | S | S | * | * | trans | -78.9 | 148.7 | 168.5 | 47.1 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 25 | S | 40.1 | Very low | 37.6 | Very low | 127 Ų | 127 | 123 Ų | 123 | 89% | 0.888 | 83% | 0.825 | S | S | * | * | trans | -159.1 | 119.8 | 152.5 | -49.6 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 26 | D | 37.3 | Very low | 37.2 | Very low | 176 Ų | 176 | 125.9 Ų | 125.9 | 94% | 0.941 | 83% | 0.83 | S | S | * | * | trans | -68 | 160.3 | 174.3 | -79.3 | -52.3 | 0 | 0 | 0 | 115.1 | ||||
| 27 | G | 38.7 | Very low | 36.9 | Very low | 72 Ų | 72 | 124.4 Ų | 124.4 | 74% | 0.742 | 83% | 0.826 | S | S | * | * | trans | 165.7 | 139 | 150.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 28 | P | 38.8 | Very low | 36.6 | Very low | 138 Ų | 138 | 128 Ų | 128 | 90% | 0.896 | 82% | 0.823 | S | S | * | * | -124.7 | 164.8 | -129.2 | 36.3 | -20.9 | 0 | 0 | 0 | 117.3 | |||||
| 29 | G | 33.3 | Very low | 36 | Very low | 73 Ų | 73 | 131.8 Ų | 131.8 | 75% | 0.753 | 83% | 0.826 | S | S | * | * | trans | 109.6 | 105.9 | 137.2 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 30 | R | 37.2 | Very low | 35.6 | Very low | 234 Ų | 234 | 133.3 Ų | 133.3 | 88% | 0.883 | 82% | 0.824 | S | S | * | * | -176.4 | 107.6 | 124.8 | -109.9 | 176.7 | 169.8 | 153.9 | -0.4 | 113.9 | |||||
| 31 | E | 35.7 | Very low | 35.2 | Very low | 171 Ų | 171 | 132.5 Ų | 132.5 | 80% | 0.799 | 82% | 0.824 | S | S | * | * | trans | 53.9 | 124.5 | 142.2 | -62.7 | 179.6 | 117.1 | 0 | 0 | 123.5 | ||||
| 32 | P | 34.4 | Very low | 34.7 | Very low | 132 Ų | 132 | 132.4 Ų | 132.4 | 86% | 0.857 | 82% | 0.821 | S | S | * | * | trans | -129.2 | 139.9 | 142.9 | 33.5 | -18 | 0 | 0 | 0 | 114.1 | ||||
| 33 | L | 36.6 | Very low | 34.4 | Very low | 174 Ų | 174 | 134.3 Ų | 134.3 | 91% | 0.911 | 82% | 0.824 | S | S | * | * | trans | -103.2 | 147.5 | 165.8 | -79 | 153.7 | 0 | 0 | 0 | 107.8 | ||||
| 34 | A | 35.2 | Very low | 34.2 | Very low | 95 Ų | 95 | 132.3 Ų | 132.3 | 79% | 0.785 | 83% | 0.826 | S | S | * | * | cis | 176.3 | 141.1 | -17.9 | 0 | 0 | 0 | 0 | 0 | 104.1 | ||||
| 35 | G | 33.1 | Very low | 34 | Very low | 81 Ų | 81 | 131 Ų | 131 | 84% | 0.835 | 82% | 0.821 | S | S | * | * | trans | 154.6 | 46.6 | 169 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 36 | T | 28.7 | Very low | 33.3 | Very low | 125 Ų | 125 | 129.1 Ų | 129.1 | 77% | 0.767 | 82% | 0.822 | S | S | * | * | trans | -73.9 | 140.3 | 172.9 | -6.3 | 0 | 0 | 0 | 0 | 111.9 | E38 | T36-E38 HydrophobicContact CG2-CG 4.26Š| ||
| 37 | S | 33.4 | Very low | 32.9 | Very low | 122 Ų | 122 | 126.1 Ų | 126.1 | 85% | 0.853 | 81% | 0.81 | S | S | * | * | trans | -140.8 | 94.7 | 144.7 | -163.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 38 | E | 30.3 | Very low | 32.3 | Very low | 151 Ų | 151 | 131.5 Ų | 131.5 | 71% | 0.706 | 82% | 0.816 | S | S | * | * | trans | -78.4 | 134.4 | 164.6 | -74.4 | 178.2 | 109.8 | 0 | 0 | 108.9 | T36 | T36-E38 HydrophobicContact CG2-CG 4.26Š| ||
| 39 | F | 31.3 | Very low | 31.7 | Very low | 212 Ų | 212 | 129.4 Ų | 129.4 | 93% | 0.93 | 80% | 0.801 | S | S | * | * | trans | -125.3 | 105.1 | 151.9 | -141.4 | -89 | 0 | 0 | 0 | 107.8 | ||||
| 40 | L | 31.1 | Very low | 31.4 | Very low | 148 Ų | 148 | 132.2 Ų | 132.2 | 78% | 0.775 | 80% | 0.803 | S | S | * | * | trans | -71 | 129.6 | 175.4 | -134.1 | 89.9 | 0 | 0 | 0 | 109.4 | ||||
| 41 | G | 32.7 | Very low | 31.1 | Very low | 65 Ų | 65 | 127.9 Ų | 127.9 | 67% | 0.67 | 80% | 0.796 | S | S | * | * | trans | -144 | 125.8 | 162.8 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 42 | P | 32 | Very low | 30.6 | Very low | 119 Ų | 119 | 125.9 Ų | 125.9 | 77% | 0.773 | 79% | 0.786 | S | S | * | * | trans | -84.5 | 126.7 | -166.9 | 33.4 | -31.2 | 0 | 0 | 0 | 110.7 | ||||
| 43 | D | 34.4 | Very low | 30.3 | Very low | 161 Ų | 161 | 124.4 Ų | 124.4 | 86% | 0.861 | 78% | 0.779 | S | S | * | * | trans | 164.1 | 89.7 | 139.6 | -82.7 | -15.3 | 0 | 0 | 0 | 107.6 | A45 | D43-A45 PolarHBondContact O-N 3.4Š| ||
| 44 | G | 28.9 | Very low | 29.9 | Very low | 92 Ų | 92 | 125 Ų | 125 | 95% | 0.948 | 77% | 0.769 | S | S | * | * | trans | -76.1 | 100.9 | 179 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 45 | A | 30.3 | Very low | 29.8 | Very low | 82 Ų | 82 | 124.8 Ų | 124.8 | 68% | 0.678 | 77% | 0.768 | S | S | * | * | trans | -132.1 | 95.3 | 151 | 0 | 0 | 0 | 0 | 0 | 106.9 | D43 V47 | D43-A45 PolarHBondContact O-N 3.4Å; A45-V47 PolarHBondContact O-N 3.19Å | ||
| 46 | G | 27 | Very low | 29.8 | Very low | 88 Ų | 88 | 127.5 Ų | 127.5 | 91% | 0.907 | 76% | 0.763 | S | S | * | * | trans | -66.8 | 98.4 | 169.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 47 | V | 27.1 | Very low | 30.1 | Very low | 113 Ų | 113 | 124.2 Ų | 124.2 | 69% | 0.685 | 75% | 0.748 | S | S | * | * | trans | -92.3 | 105.2 | 168.5 | -174.3 | 0 | 0 | 0 | 0 | 107 | A45 V49 | A45-V47 PolarHBondContact O-N 3.19Å; V47-V49 HydrophobicContact CB-CG2 4.2Å; V47-V49 HydrophobicContact CG1-CG2 3.51Å; V47-V49 PolarHBondContact O-N 3.29Å; V47-V49 VanDerWaalsContact O-N 3.15Å | ||
| 48 | E | 26.8 | Very low | 30.1 | Very low | 186 Ų | 186 | 126.7 Ų | 126.7 | 87% | 0.869 | 74% | 0.744 | S | S | * | * | trans | -70.5 | 97.2 | 165.4 | -160.6 | 172.6 | -156.4 | 0 | 0 | 107.2 | V50 | E48-V50 PolarHBondContact O-N 3.24Š| ||
| 49 | V | 27 | Very low | 30.4 | Very low | 94 Ų | 94 | 122.1 Ų | 122.1 | 57% | 0.57 | 74% | 0.738 | S | S | * | * | trans | -89 | 92.2 | -178 | 177.7 | 0 | 0 | 0 | 0 | 108.9 | V47 I51 | V47-V49 HydrophobicContact CB-CG2 4.2Å; V47-V49 HydrophobicContact CG1-CG2 3.51Å; V47-V49 PolarHBondContact O-N 3.29Å; V47-V49 VanDerWaalsContact O-N 3.15Å; V49-I51 HydrophobicContact CG1-CD1 3.36Å; V49-I51 HydrophobicContact CG1-CG1 3.4Å; V49-I51 PolarHBondContact O-N 2.94Å | ||
| 50 | V | 26.8 | Very low | 30.7 | Very low | 132 Ų | 132 | 115.4 Ų | 115.4 | 80% | 0.8 | 71% | 0.714 | S | S | * | * | trans | -73.9 | 99.7 | 160.5 | 177.5 | 0 | 0 | 0 | 0 | 107.2 | E48 | E48-V50 PolarHBondContact O-N 3.24Š| ||
| 51 | I | 29.4 | Very low | 31 | Very low | 142 Ų | 142 | 117.8 Ų | 117.8 | 73% | 0.728 | 71% | 0.712 | S | S | * | * | trans | -92 | 104.5 | 171 | -76.9 | 157.4 | 0 | 0 | 0 | 109.2 | V49 S53 | V49-I51 HydrophobicContact CG1-CD1 3.36Å; V49-I51 HydrophobicContact CG1-CG1 3.4Å; V49-I51 PolarHBondContact O-N 2.94Å; I51-S53 PolarHBondContact O-N 3.07Å | ||
| 52 | E | 26.6 | Very low | 31.3 | Very low | 130 Ų | 130 | 122 Ų | 122 | 61% | 0.607 | 71% | 0.714 | S | S | * | * | trans | -62.4 | 109.1 | 167 | -160.2 | -175.7 | 177.1 | 0 | 0 | 109.2 | R54 | E52-R54 VanDerWaalsContact C-N 3.27Å; E52-R54 PolarHBondContact O-N 3.47Å; E52-R54 IonicContact OE1-CZ 3.13Å; E52-R54 IonicContact OE1-NE 3.31Å; E52-R54 PolarHBondContact OE1-NE 3.2Å; E52-R54 IonicContact OE1-NH2 3.13Å | ||
| 53 | S | 26.9 | Very low | 31.8 | Very low | 101 Ų | 101 | 123.1 Ų | 123.1 | 71% | 0.706 | 71% | 0.71 | S | S | * | * | trans | -73.7 | 81.2 | 176.1 | -162.7 | 0 | 0 | 0 | 0 | 110.2 | I51 | I51-S53 PolarHBondContact O-N 3.07Š| ||
| 54 | R | 29.3 | Very low | 32.1 | Very low | 185 Ų | 185 | 119.2 Ų | 119.2 | 70% | 0.698 | 69% | 0.688 | S | S | * | * | trans | -92.1 | 9.6 | -177 | -123.1 | 177.5 | -168.4 | -168.4 | 0.5 | 114.2 | E52 | E52-R54 VanDerWaalsContact C-N 3.27Å; E52-R54 PolarHBondContact O-N 3.47Å; E52-R54 IonicContact OE1-CZ 3.13Å; E52-R54 IonicContact OE1-NE 3.31Å; E52-R54 PolarHBondContact OE1-NE 3.2Å; E52-R54 IonicContact OE1-NH2 3.13Å | ||
| 55 | A | 32.2 | Very low | 32.9 | Very low | 91 Ų | 91 | 118 Ų | 118 | 75% | 0.752 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -95 | -19.1 | -166.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 56 | N | 34.8 | Very low | 33.6 | Very low | 139 Ų | 139 | 121.1 Ų | 121.1 | 74% | 0.743 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -99.3 | 5.3 | -178.4 | -149.2 | 23.5 | 0 | 0 | 0 | 114.6 | ||
| 57 | A | 33.7 | Very low | 34.6 | Very low | 55 Ų | 55 | 124 Ų | 124 | 46% | 0.455 | 67% | 0.668 | S | S | . | * | S | Bend | trans | -100.9 | -0.8 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 58 | K | 34.4 | Very low | 35.4 | Very low | 174 Ų | 174 | 126.9 Ų | 126.9 | 76% | 0.757 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.9 | -27.6 | 179.9 | -83.1 | -174.4 | 174.4 | -177.2 | 0 | 114.2 | ||
| 59 | G | 34.9 | Very low | 36 | Very low | 56 Ų | 56 | 125.9 Ų | 125.9 | 58% | 0.577 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | -25.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 60 | V | 39.5 | Very low | 36.4 | Very low | 70 Ų | 70 | 124.3 Ų | 124.3 | 42% | 0.424 | 68% | 0.678 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.9 | -24.6 | -179.2 | -176.4 | 0 | 0 | 0 | 0 | 111.8 | E62 L91 | V60-E62 VanDerWaalsContact C-N 3.34Å; V60-E62 PolarHBondContact O-N 2.95Å; V60-L91 HydrophobicContact CG1-CD1 3.99Å |
| 61 | R | 36.9 | Very low | 37.1 | Very low | 199 Ų | 199 | 123.1 Ų | 123.1 | 75% | 0.751 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -74.4 | -19.6 | -179.1 | -114.8 | 176 | 176.6 | 168.7 | -0.9 | 114.5 | A65 | R61-A65 WeakPolarHBondContact O-CB 3.32Å; R61-A65 PolarHBondContact O-N 2.74Å |
| 62 | E | 39.1 | Very low | 37.4 | Very low | 152 Ų | 152 | 124.9 Ų | 124.9 | 71% | 0.71 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -83.1 | -25.8 | 178.8 | -117.6 | 174 | 167.2 | 0 | 0 | 112.4 | V60 | V60-E62 VanDerWaalsContact C-N 3.34Å; V60-E62 PolarHBondContact O-N 2.95Å |
| 63 | E | 41.6 | Very low | 37.9 | Very low | 144 Ų | 144 | 123.5 Ų | 123.5 | 67% | 0.673 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -82 | -34.3 | 177.4 | -65.4 | -171.7 | 144.1 | 0 | 0 | 112.3 | ||
| 64 | D | 40.6 | Very low | 38.3 | Very low | 78 Ų | 78 | 125.4 Ų | 125.4 | 42% | 0.417 | 69% | 0.687 | S | S | . | * | H | α-helix | trans | -77.9 | -30.1 | 177.6 | -70.5 | -27.1 | 0 | 0 | 0 | 112.9 | L66 L67 | D64-L66 PolarHBondContact O-N 3.34Å; D64-L67 PolarHBondContact O-N 3.43Å |
| 65 | A | 45.1 | Very low | 38.8 | Very low | 67 Ų | 67 | 124.3 Ų | 124.3 | 55% | 0.554 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.2 | -16.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | R61 | R61-A65 WeakPolarHBondContact O-CB 3.32Å; R61-A65 PolarHBondContact O-N 2.74Å |
| 66 | L | 45.1 | Very low | 39.1 | Very low | 147 Ų | 147 | 124.7 Ų | 124.7 | 77% | 0.77 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.4 | -8.7 | 177.2 | -71.2 | 173.1 | 0 | 0 | 0 | 113.5 | D64 | D64-L66 PolarHBondContact O-N 3.34Š|
| 67 | L | 48.1 | Very low | 39.1 | Very low | 150 Ų | 150 | 125.3 Ų | 125.3 | 79% | 0.785 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.9 | -10.9 | -176.5 | -67.1 | 175.7 | 0 | 0 | 0 | 114.7 | D64 | D64-L67 PolarHBondContact O-N 3.43Š|
| 68 | E | 44.7 | Very low | 39.4 | Very low | 173 Ų | 173 | 130.2 Ų | 130.2 | 81% | 0.808 | 71% | 0.709 | S | S | * | * | trans | -108.7 | 4.9 | -172.9 | -127.9 | 179.4 | 174.6 | 0 | 0 | 115.4 | G70 | E68-G70 PolarHBondContact O-N 2.8Š| ||
| 69 | N | 38.9 | Very low | 39.7 | Very low | 165 Ų | 165 | 127.4 Ų | 127.4 | 88% | 0.882 | 71% | 0.706 | S | S | * | * | trans | -81.3 | 34.7 | -173.1 | -144 | 7.9 | 0 | 0 | 0 | 114.7 | ||||
| 70 | G | 36.4 | Very low | 39.7 | Very low | 61 Ų | 61 | 130 Ų | 130 | 63% | 0.629 | 72% | 0.715 | S | S | * | * | trans | -145.4 | 70.5 | -174.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | E68 | E68-G70 PolarHBondContact O-N 2.8Š| ||
| 71 | S | 41.5 | Very low | 39.7 | Very low | 107 Ų | 107 | 133 Ų | 133 | 75% | 0.748 | 73% | 0.734 | S | S | * | * | S | Bend | trans | 168.4 | 120.1 | 142.1 | -76.1 | 0 | 0 | 0 | 0 | 112.4 | ||
| 72 | Q | 35.7 | Very low | 39.5 | Very low | 179 Ų | 179 | 131.4 Ų | 131.4 | 84% | 0.836 | 74% | 0.74 | S | S | * | * | trans | 61.9 | 106.8 | 143.7 | -68.4 | 174.2 | -7.5 | 0 | 0 | 118.7 | ||||
| 73 | S | 35.8 | Very low | 39.4 | Very low | 101 Ų | 101 | 135.1 Ų | 135.1 | 71% | 0.706 | 75% | 0.748 | S | S | * | * | 82.8 | 110.9 | 69.2 | 72.1 | 0 | 0 | 0 | 0 | 115.9 | |||||
| 74 | N | 36.1 | Very low | 39.1 | Very low | 141 Ų | 141 | 130.8 Ų | 130.8 | 75% | 0.754 | 74% | 0.742 | S | S | * | * | trans | 68.2 | 123.4 | 143.7 | -76.7 | 23.1 | 0 | 0 | 0 | 123.9 | ||||
| 75 | E | 39.1 | Very low | 39.1 | Very low | 162 Ų | 162 | 133.3 Ų | 133.3 | 76% | 0.757 | 76% | 0.763 | S | S | * | * | 103.6 | 118.8 | 125 | -94.6 | 169.9 | 106.9 | 0 | 0 | 121.8 | |||||
| 76 | S | 38.6 | Very low | 38.5 | Very low | 99 Ų | 99 | 134 Ų | 134 | 69% | 0.692 | 77% | 0.769 | S | S | * | * | trans | 77.2 | 106.7 | 138.9 | 48 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 77 | D | 35.8 | Very low | 38 | Very low | 151 Ų | 151 | 132.2 Ų | 132.2 | 81% | 0.807 | 77% | 0.766 | S | S | * | * | 31.3 | 113.2 | 127.7 | -60 | -19.2 | 0 | 0 | 0 | 119.7 | |||||
| 78 | D | 38.8 | Very low | 37.5 | Very low | 158 Ų | 158 | 130.9 Ų | 130.9 | 85% | 0.845 | 77% | 0.766 | S | S | * | * | trans | -160.3 | 116.7 | 137.8 | -98.9 | -29.9 | 0 | 0 | 0 | 113.1 | ||||
| 79 | V | 42.2 | Very low | 37.2 | Very low | 116 Ų | 116 | 127.6 Ų | 127.6 | 70% | 0.703 | 76% | 0.762 | S | S | * | * | trans | 41.1 | 101.8 | 138.3 | -170.3 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 80 | S | 34.6 | Very low | 37.6 | Very low | 110 Ų | 110 | 122.9 Ų | 122.9 | 77% | 0.769 | 74% | 0.74 | S | S | * | * | trans | 15.3 | 103 | 139.6 | 52.7 | 0 | 0 | 0 | 0 | 119 | ||||
| 81 | T | 38.5 | Very low | 38.2 | Very low | 133 Ų | 133 | 125.6 Ų | 125.6 | 82% | 0.816 | 74% | 0.74 | S | S | * | * | trans | -134 | 107.7 | 135.1 | -2.1 | 0 | 0 | 0 | 0 | 107.7 | R83 | T81-R83 VanDerWaalsContact C-N 3.27Å; T81-R83 PolarHBondContact O-N 2.94Å | ||
| 82 | D | 32.5 | Very low | 39 | Very low | 165 Ų | 165 | 128.6 Ų | 128.6 | 88% | 0.882 | 74% | 0.739 | S | S | * | * | trans | -66.7 | 84.5 | 176.7 | -165.8 | 13.6 | 0 | 0 | 0 | 109.1 | ||||
| 83 | R | 38.1 | Very low | 40.5 | Very low | 230 Ų | 230 | 123.2 Ų | 123.2 | 87% | 0.868 | 71% | 0.714 | S | S | * | * | trans | -95.3 | 110.9 | 157.8 | -79 | -177.1 | 178.5 | 167.1 | 0.9 | 105.3 | T81 | T81-R83 VanDerWaalsContact C-N 3.27Å; T81-R83 PolarHBondContact O-N 2.94Å | ||
| 84 | G | 34.3 | Very low | 42.6 | Very low | 53 Ų | 53 | 122.2 Ų | 122.2 | 55% | 0.546 | 70% | 0.704 | S | S | . | * | P | Polyproline II helix | trans | -46.3 | 150.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | A86 | G84-A86 PolarHBondContact O-N 3.37Š|
| 85 | P | 40.6 | Very low | 44.8 | Very low | 132 Ų | 132 | 118 Ų | 118 | 86% | 0.857 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 119.5 | -171.2 | 23.9 | -31.1 | 0 | 0 | 0 | 108.8 | ||
| 86 | A | 32.9 | Very low | 46.9 | Very low | 82 Ų | 82 | 117.9 Ų | 117.9 | 68% | 0.678 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -51 | 141 | 168 | 0 | 0 | 0 | 0 | 0 | 108.2 | G84 | G84-A86 PolarHBondContact O-N 3.37Š|
| 87 | P | 35.4 | Very low | 48.9 | Very low | 109 Ų | 109 | 115 Ų | 115 | 71% | 0.708 | 66% | 0.663 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 136.7 | 178.2 | 21.7 | -31.4 | 0 | 0 | 0 | 108.6 | S89 | P87-S89 PolarHBondContact O-N 2.92Š|
| 88 | P | 37.4 | Very low | 51 | Low | 122 Ų | 122 | 107.9 Ų | 107.9 | 79% | 0.792 | 62% | 0.624 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 121.2 | -176.5 | 21.6 | -31.2 | 0 | 0 | 0 | 108.2 | ||
| 89 | S | 38.9 | Very low | 53 | Low | 103 Ų | 103 | 101.4 Ų | 101.4 | 72% | 0.72 | 60% | 0.595 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 126.1 | 173.5 | 52.8 | 0 | 0 | 0 | 0 | 107.5 | P87 L91 | P87-S89 PolarHBondContact O-N 2.92Å; S89-L91 PolarHBondContact O-N 3.33Å |
| 90 | P | 46.7 | Very low | 55 | Low | 66 Ų | 66 | 101.2 Ų | 101.2 | 43% | 0.429 | 59% | 0.59 | S | S | . | * | P | Polyproline II helix | trans | -53.6 | 122.6 | -179.6 | 19.4 | -29.6 | 0 | 0 | 0 | 107.6 | K92 F374 | P90-K92 PolarHBondContact O-N 3.45Å; P90-F374 HydrophobicContact CG-CE2 4.24Å |
| 91 | L | 48.3 | Very low | 57.1 | Low | 118 Ų | 118 | 100.6 Ų | 100.6 | 62% | 0.618 | 57% | 0.574 | S | S | * | * | trans | -42.2 | 119.8 | 177 | -80.2 | 160.4 | 0 | 0 | 0 | 107.4 | V60 S89 E93 | V60-L91 HydrophobicContact CG1-CD1 3.99Å; S89-L91 PolarHBondContact O-N 3.33Å; L91-E93 VanDerWaalsContact C-N 3.26Å; L91-E93 PolarHBondContact O-N 3.49Å | ||
| 92 | K | 58 | Low | 59.1 | Low | 171 Ų | 171 | 95 Ų | 95 | 74% | 0.743 | 54% | 0.54 | S | S | * | . | trans | -64.7 | 90.3 | -176.5 | -79.2 | 177.8 | 179.9 | 169.5 | 0 | 108.3 | P90 T94 | P90-K92 PolarHBondContact O-N 3.45Å; K92-T94 PolarHBondContact O-N 3.47Å | ||
| 93 | E | 67.8 | Low | 61.8 | Low | 65 Ų | 65 | 90.5 Ų | 90.5 | 30% | 0.304 | 52% | 0.516 | S | S | . | . | trans | -59.1 | 128.5 | 175.1 | -67.8 | -177.1 | 143.9 | 0 | 0 | 109.4 | L91 I98 R370 | L91-E93 VanDerWaalsContact C-N 3.26Å; L91-E93 PolarHBondContact O-N 3.49Å; E93-I98 HydrophobicContact CB-CD1 4.1Å; E93-I98 HydrophobicContact CB-CG1 4Å; E93-R370 IonicContact OE1-NH2 3.25Å; E93-R370 IonicContact OE2-CZ 3.94Å; E93-R370 IonicContact OE2-NH1 3.79Å; E93-R370 IonicContact OE2-NH2 3.86Å; E93-R370 PolarHBondContact OE2-NH2 3.35Å | ||
| 94 | T | 80.9 | Confident | 64.1 | Low | 80 Ų | 80 | 86.7 Ų | 86.7 | 49% | 0.491 | 51% | 0.506 | S | S | . | . | trans | -76.5 | 148.6 | 176.7 | 63.1 | 0 | 0 | 0 | 0 | 109.4 | K92 F96 S97 I98 | K92-T94 PolarHBondContact O-N 3.47Å; T94-F96 PolarHBondContact O-N 3.47Å; T94-F96 VanDerWaalsContact O-N 3.14Å; T94-S97 PolarHBondContact O-N 2.95Å; T94-S97 WeakPolarHBondContact OG1-CB 3.46Å; T94-S97 PolarHBondContact OG1-N 2.83Å; T94-I98 WeakPolarHBondContact O-CG1 3.36Å; T94-I98 PolarHBondContact O-N 2.96Å; T94-I98 VanDerWaalsContact O-N 3.07Å | ||
| 95 | S | 81.1 | Confident | 66.5 | Low | 53 Ų | 53 | 85.3 Ų | 85.3 | 37% | 0.371 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -56.3 | -31 | 175.9 | -63.9 | 0 | 0 | 0 | 0 | 112.5 | G99 | S95-G99 PolarHBondContact O-N 2.97Å |
| 96 | F | 82.9 | Confident | 68.9 | Low | 160 Ų | 160 | 79.6 Ų | 79.6 | 70% | 0.702 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -68.2 | -44.2 | 175.5 | -174.6 | -100.1 | 0 | 0 | 0 | 112.3 | T94 I98 G99 L100 | T94-F96 PolarHBondContact O-N 3.47Å; T94-F96 VanDerWaalsContact O-N 3.14Å; F96-I98 PolarHBondContact O-N 2.77Å; F96-G99 PolarHBondContact O-N 3Å; F96-L100 HydrophobicContact CE1-CD2 4.46Å; F96-L100 WeakPolarHBondContact O-CB 3.41Å; F96-L100 PolarHBondContact O-N 3.25Å |
| 97 | S | 81.8 | Confident | 71.7 | Confident | 39 Ų | 39 | 78 Ų | 78 | 27% | 0.273 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -60.3 | -46.7 | 175.7 | -173 | 0 | 0 | 0 | 0 | 111.3 | T94 G99 L100 Q101 | T94-S97 PolarHBondContact O-N 2.95Å; T94-S97 WeakPolarHBondContact OG1-CB 3.46Å; T94-S97 PolarHBondContact OG1-N 2.83Å; S97-G99 VanDerWaalsContact C-N 3.34Å; S97-G99 PolarHBondContact O-N 3.17Å; S97-L100 PolarHBondContact O-N 2.98Å; S97-Q101 WeakPolarHBondContact O-CB 3.29Å; S97-Q101 WeakPolarHBondContact O-CG 3.46Å; S97-Q101 PolarHBondContact O-N 2.77Å; S97-Q101 PolarHBondContact OG-NE2 2.86Å |
| 98 | I | 78.4 | Confident | 74.4 | Confident | 0 Ų | 0 | 75.7 Ų | 75.7 | 0% | 0 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -60.2 | -46.4 | 177.1 | -59.3 | 170.1 | 0 | 0 | 0 | 110.1 | E93 T94 F96 L100 Q101 V102 V411 | E93-I98 HydrophobicContact CB-CD1 4.1Å; E93-I98 HydrophobicContact CB-CG1 4Å; T94-I98 WeakPolarHBondContact O-CG1 3.36Å; T94-I98 PolarHBondContact O-N 2.96Å; T94-I98 VanDerWaalsContact O-N 3.07Å; F96-I98 PolarHBondContact O-N 2.77Å; I98-L100 PolarHBondContact O-N 3.16Å; I98-Q101 PolarHBondContact O-N 3.39Å; I98-V102 HydrophobicContact CG2-CG2 4.41Å; I98-V102 WeakPolarHBondContact O-CG2 3.49Å; I98-V102 PolarHBondContact O-N 3.09Å; I98-V411 HydrophobicContact CB-CG1 4.49Å; I98-V411 HydrophobicContact CG2-CB 4.34Å; I98-V411 HydrophobicContact CG2-CG1 4.08Å |
| 99 | G | 82.1 | Confident | 76.9 | Confident | 22 Ų | 22 | 70 Ų | 70 | 23% | 0.227 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -60.9 | -46.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | S95 F96 S97 V102 L103 | S95-G99 PolarHBondContact O-N 2.97Å; F96-G99 PolarHBondContact O-N 3Å; S97-G99 VanDerWaalsContact C-N 3.34Å; S97-G99 PolarHBondContact O-N 3.17Å; G99-V102 PolarHBondContact O-N 3.25Å; G99-L103 WeakPolarHBondContact O-CB 3.49Å; G99-L103 PolarHBondContact O-N 3.41Å |
| 100 | L | 83.6 | Confident | 79.6 | Confident | 113 Ų | 113 | 65.2 Ų | 65.2 | 59% | 0.592 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -66.3 | -39.9 | 179.8 | -173 | 63.8 | 0 | 0 | 0 | 112.1 | F96 S97 I98 | F96-L100 HydrophobicContact CE1-CD2 4.46Å; F96-L100 WeakPolarHBondContact O-CB 3.41Å; F96-L100 PolarHBondContact O-N 3.25Å; S97-L100 PolarHBondContact O-N 2.98Å; I98-L100 PolarHBondContact O-N 3.16Å |
| 101 | Q | 79 | Confident | 81.8 | Confident | 96 Ų | 96 | 66.4 Ų | 66.4 | 45% | 0.449 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -65 | -38.3 | 177.2 | -73.1 | 172 | 6.1 | 0 | 0 | 112.3 | S97 I98 P105 | S97-Q101 WeakPolarHBondContact O-CB 3.29Å; S97-Q101 WeakPolarHBondContact O-CG 3.46Å; S97-Q101 PolarHBondContact O-N 2.77Å; S97-Q101 PolarHBondContact OG-NE2 2.86Å; I98-Q101 PolarHBondContact O-N 3.39Å; Q101-P105 VanDerWaalsContact O-CD 3.26Å; Q101-P105 WeakPolarHBondContact O-CD 3.37Å; Q101-P105 VanDerWaalsContact O-CG 3.31Å; Q101-P105 WeakPolarHBondContact O-CG 3.4Å |
| 102 | V | 80.8 | Confident | 84 | Confident | 16 Ų | 16 | 61.2 Ų | 61.2 | 10% | 0.097 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -86.1 | -27 | -177.2 | 178.5 | 0 | 0 | 0 | 0 | 112.7 | I98 G99 F104 P105 F106 V366 L412 L415 | I98-V102 HydrophobicContact CG2-CG2 4.41Å; I98-V102 WeakPolarHBondContact O-CG2 3.49Å; I98-V102 PolarHBondContact O-N 3.09Å; G99-V102 PolarHBondContact O-N 3.25Å; V102-F104 PolarHBondContact O-N 2.73Å; V102-P105 WeakPolarHBondContact O-CB 3.49Å; V102-P105 WeakPolarHBondContact O-CD 2.89Å; V102-F106 HydrophobicContact CG1-CB 4.28Å; V102-F106 WeakPolarHBondContact O-CB 3.31Å; V102-F106 PolarHBondContact O-N 3.06Å; V102-V366 HydrophobicContact CG2-CG1 4.34Å; V102-L412 HydrophobicContact CG1-CD2 3.76Å; V102-L412 HydrophobicContact CG2-CD2 4.41Å; V102-L415 HydrophobicContact CG1-CD2 4.06Å |
| 103 | L | 87.9 | Confident | 85.7 | Confident | 70 Ų | 70 | 53.1 Ų | 53.1 | 37% | 0.366 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -57.6 | -51 | -172.2 | 176.9 | 63.8 | 0 | 0 | 0 | 113.8 | G99 F106 L107 L415 | G99-L103 WeakPolarHBondContact O-CB 3.49Å; G99-L103 PolarHBondContact O-N 3.41Å; L103-F106 PolarHBondContact O-N 3.47Å; L103-L107 HydrophobicContact CD1-CD1 4.06Å; L103-L107 HydrophobicContact CD1-CG 4.22Å; L103-L107 HydrophobicContact CG-CD1 4.28Å; L103-L107 WeakPolarHBondContact O-CG 3.28Å; L103-L107 PolarHBondContact O-N 3.17Å; L103-L415 HydrophobicContact CD1-CD1 3.61Å |
| 104 | F | 87.1 | Confident | 87 | Confident | 151 Ų | 151 | 50.1 Ų | 50.1 | 66% | 0.662 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -67 | -50.7 | -178.2 | 176.1 | -91.1 | 0 | 0 | 0 | 112.4 | V102 F106 L107 L108 | V102-F104 PolarHBondContact O-N 2.73Å; F104-F106 VanDerWaalsContact C-N 3.27Å; F104-F106 PolarHBondContact O-N 2.73Å; F104-L107 PolarHBondContact O-N 3.42Å; F104-L108 PolarHBondContact O-N 2.93Å |
| 105 | P | 85.6 | Confident | 87.7 | Confident | 23 Ų | 23 | 47.7 Ų | 47.7 | 15% | 0.149 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -42.9 | -51 | 165.3 | -40.6 | 44.9 | 0 | 0 | 0 | 114.6 | Q101 V102 L108 A109 P256 | Q101-P105 VanDerWaalsContact O-CD 3.26Å; Q101-P105 WeakPolarHBondContact O-CD 3.37Å; Q101-P105 VanDerWaalsContact O-CG 3.31Å; Q101-P105 WeakPolarHBondContact O-CG 3.4Å; V102-P105 WeakPolarHBondContact O-CB 3.49Å; V102-P105 WeakPolarHBondContact O-CD 2.89Å; P105-L108 PolarHBondContact O-N 2.95Å; P105-A109 WeakPolarHBondContact O-CB 3.25Å; P105-A109 PolarHBondContact O-N 2.81Å; P105-P256 HydrophobicContact CB-CB 3.9Å; P105-P256 HydrophobicContact CB-CG 3.33Å; P105-P256 HydrophobicContact CG-CG 3.88Å |
| 106 | F | 89.6 | Confident | 88.4 | Confident | 13 Ų | 13 | 45.2 Ų | 45.2 | 6% | 0.057 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -64.3 | -44.4 | -176.7 | 169.2 | -92.7 | 0 | 0 | 0 | 112.4 | V102 L103 F104 G110 V359 L363 L415 G419 F423 | V102-F106 HydrophobicContact CG1-CB 4.28Å; V102-F106 WeakPolarHBondContact O-CB 3.31Å; V102-F106 PolarHBondContact O-N 3.06Å; L103-F106 PolarHBondContact O-N 3.47Å; F104-F106 VanDerWaalsContact C-N 3.27Å; F104-F106 PolarHBondContact O-N 2.73Å; F106-G110 PolarHBondContact O-N 3.41Å; F106-V359 HydrophobicContact CE2-CG1 3.51Å; F106-V359 HydrophobicContact CZ-CG1 3.87Å; F106-L363 HydrophobicContact CD2-CD2 3.58Å; F106-L363 HydrophobicContact CD2-CG 4.09Å; F106-L363 HydrophobicContact CE2-CD1 3.94Å; F106-L363 HydrophobicContact CE2-CD2 3.71Å; F106-L363 HydrophobicContact CE2-CG 3.88Å; F106-L415 HydrophobicContact CB-CD2 3.71Å; F106-L415 HydrophobicContact CD1-CD1 4.05Å; F106-L415 HydrophobicContact CD1-CD2 3.58Å; F106-L415 HydrophobicContact CD1-CG 3.68Å; F106-L415 HydrophobicContact CD2-CD2 3.71Å; F106-L415 HydrophobicContact CD2-CG 4.21Å; F106-L415 HydrophobicContact CE1-CD1 4.13Å; F106-L415 HydrophobicContact CE1-CD2 4.07Å; F106-L415 HydrophobicContact CE1-CG 3.67Å; F106-L415 HydrophobicContact CE2-CD2 4.14Å; F106-L415 HydrophobicContact CE2-CG 4.16Å; F106-L415 HydrophobicContact CG-CD2 3.38Å; F106-L415 HydrophobicContact CG-CG 3.96Å; F106-L415 HydrophobicContact CZ-CD2 4.33Å; F106-L415 HydrophobicContact CZ-CG 3.92Å; F106-G419 VanDerWaalsContact CE1-CA 3.49Å; F106-F423 HydrophobicContact CD1-CZ 4.32Å; F106-F423 AromaticContact CE1-CE2 3.93Å; F106-F423 HydrophobicContact CE1-CE2 3.93Å; F106-F423 AromaticContact CE1-CZ 3.8Å; F106-F423 HydrophobicContact CE1-CZ 3.8Å; F106-F423 AromaticContact CZ-CE2 3.88Å; F106-F423 HydrophobicContact CZ-CE2 3.88Å; F106-F423 HydrophobicContact CZ-CZ 4.2Å |
| 107 | L | 92.9 | Very high | 88.9 | Confident | 47 Ų | 47 | 37.6 Ų | 37.6 | 25% | 0.246 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -64.9 | -43.7 | 177.2 | -72 | 175.2 | 0 | 0 | 0 | 111.6 | L103 F104 G110 F111 F423 | L103-L107 HydrophobicContact CD1-CD1 4.06Å; L103-L107 HydrophobicContact CD1-CG 4.22Å; L103-L107 HydrophobicContact CG-CD1 4.28Å; L103-L107 WeakPolarHBondContact O-CG 3.28Å; L103-L107 PolarHBondContact O-N 3.17Å; F104-L107 PolarHBondContact O-N 3.42Å; L107-G110 PolarHBondContact O-N 3.07Å; L107-F111 HydrophobicContact CB-CE2 4.35Å; L107-F111 WeakPolarHBondContact O-CD2 3.39Å; L107-F111 PolarHBondContact O-N 3.23Å; L107-F423 HydrophobicContact CD2-CE1 4.1Å; L107-F423 HydrophobicContact CD2-CZ 4.21Å |
| 108 | L | 91.5 | Very high | 89.6 | Confident | 61 Ų | 61 | 36.7 Ų | 36.7 | 32% | 0.319 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -60.8 | -47.9 | 177.7 | 178.8 | 62.2 | 0 | 0 | 0 | 111.4 | F104 P105 G110 F111 G112 P256 I257 S260 | F104-L108 PolarHBondContact O-N 2.93Å; P105-L108 PolarHBondContact O-N 2.95Å; L108-G110 VanDerWaalsContact C-N 3.34Å; L108-G110 PolarHBondContact O-N 3.49Å; L108-F111 PolarHBondContact O-N 3.41Å; L108-G112 PolarHBondContact O-N 3.41Å; L108-G112 VanDerWaalsContact O-N 3.14Å; L108-P256 HydrophobicContact CD2-CB 4.41Å; L108-I257 HydrophobicContact CD2-CG1 3.86Å; L108-S260 WeakPolarHBondContact O-CB 3.48Å |
| 109 | A | 90.8 | Very high | 90.4 | Very high | 4 Ų | 4 | 38.2 Ų | 38.2 | 3% | 0.033 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -57.7 | -48 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | P105 F111 G112 T113 A259 | P105-A109 WeakPolarHBondContact O-CB 3.25Å; P105-A109 PolarHBondContact O-N 2.81Å; A109-F111 PolarHBondContact O-N 3.42Å; A109-G112 PolarHBondContact O-N 2.98Å; A109-G112 VanDerWaalsContact O-N 3.16Å; A109-T113 WeakPolarHBondContact O-CG2 3.47Å; A109-T113 PolarHBondContact O-N 2.99Å; A109-A259 HydrophobicContact CB-CB 3.77Å |
| 110 | G | 93.8 | Very high | 91 | Very high | 1 Ų | 1 | 37.2 Ų | 37.2 | 1% | 0.01 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.6 | -43.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | F106 L107 L108 G112 T113 V114 F423 | F106-G110 PolarHBondContact O-N 3.41Å; L107-G110 PolarHBondContact O-N 3.07Å; L108-G110 VanDerWaalsContact C-N 3.34Å; L108-G110 PolarHBondContact O-N 3.49Å; G110-G112 VanDerWaalsContact C-N 3.29Å; G110-G112 PolarHBondContact O-N 2.87Å; G110-T113 WeakPolarHBondContact CA-OG1 3.44Å; G110-T113 PolarHBondContact O-N 2.99Å; G110-T113 VanDerWaalsContact O-N 3.11Å; G110-T113 PolarHBondContact O-OG1 3.27Å; G110-V114 WeakPolarHBondContact O-CG2 3.39Å; G110-V114 PolarHBondContact O-N 3.32Å; G110-F423 VanDerWaalsContact CA-CZ 3.47Å |
| 111 | F | 94.4 | Very high | 91.5 | Very high | 92 Ų | 92 | 32.3 Ų | 32.3 | 40% | 0.404 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -62.5 | -35.7 | 174.2 | -75.6 | -58.9 | 0 | 0 | 0 | 112.7 | L107 L108 A109 V114 A115 V422 T426 | L107-F111 HydrophobicContact CB-CE2 4.35Å; L107-F111 WeakPolarHBondContact O-CD2 3.39Å; L107-F111 PolarHBondContact O-N 3.23Å; L108-F111 PolarHBondContact O-N 3.41Å; A109-F111 PolarHBondContact O-N 3.42Å; F111-V114 PolarHBondContact O-N 2.88Å; F111-A115 PolarHBondContact O-N 2.92Å; F111-V422 HydrophobicContact CE1-CG1 4.34Å; F111-V422 HydrophobicContact CZ-CG1 3.94Å; F111-T426 HydrophobicContact CD1-CG2 4.38Å; F111-T426 HydrophobicContact CE1-CG2 4.18Å |
| 112 | G | 93.4 | Very high | 92.2 | Very high | 9 Ų | 9 | 32.4 Ų | 32.4 | 9% | 0.093 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -62.9 | -41 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | L108 A109 G110 A115 A116 S260 | L108-G112 PolarHBondContact O-N 3.41Å; L108-G112 VanDerWaalsContact O-N 3.14Å; A109-G112 PolarHBondContact O-N 2.98Å; A109-G112 VanDerWaalsContact O-N 3.16Å; G110-G112 VanDerWaalsContact C-N 3.29Å; G110-G112 PolarHBondContact O-N 2.87Å; G112-A115 PolarHBondContact O-N 3.42Å; G112-A116 PolarHBondContact O-N 2.9Å; G112-S260 WeakPolarHBondContact CA-O 3.38Å |
| 113 | T | 93.9 | Very high | 92.9 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -68.2 | -34.9 | 175.3 | 66.1 | 0 | 0 | 0 | 0 | 112.7 | A109 G110 A116 G117 D263 P354 | A109-T113 WeakPolarHBondContact O-CG2 3.47Å; A109-T113 PolarHBondContact O-N 2.99Å; G110-T113 WeakPolarHBondContact CA-OG1 3.44Å; G110-T113 PolarHBondContact O-N 2.99Å; G110-T113 VanDerWaalsContact O-N 3.11Å; G110-T113 PolarHBondContact O-OG1 3.27Å; T113-A116 PolarHBondContact O-N 2.92Å; T113-G117 PolarHBondContact O-N 3.1Å; T113-D263 WeakPolarHBondContact CG2-OD2 2.88Å; T113-P354 WeakPolarHBondContact CB-O 3.39Å |
| 114 | V | 95.5 | Very high | 93.2 | Very high | 2 Ų | 2 | 29 Ų | 29 | 1% | 0.012 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -64.2 | -46 | 172.7 | 170.9 | 0 | 0 | 0 | 0 | 110.1 | G110 F111 A116 G117 M118 V355 F423 T426 I427 | G110-V114 WeakPolarHBondContact O-CG2 3.39Å; G110-V114 PolarHBondContact O-N 3.32Å; F111-V114 PolarHBondContact O-N 2.88Å; V114-A116 VanDerWaalsContact C-N 3.3Å; V114-A116 PolarHBondContact O-N 3.02Å; V114-G117 WeakPolarHBondContact O-CA 3.48Å; V114-G117 PolarHBondContact O-N 3.44Å; V114-G117 VanDerWaalsContact O-N 3.11Å; V114-M118 WeakPolarHBondContact O-CG 3.17Å; V114-M118 PolarHBondContact O-N 3.01Å; V114-V355 HydrophobicContact CB-CG2 4.33Å; V114-V355 HydrophobicContact CG2-CG1 4.43Å; V114-V355 HydrophobicContact CG2-CG2 3.76Å; V114-F423 HydrophobicContact CG2-CB 3.64Å; V114-F423 HydrophobicContact CG2-CD1 4.15Å; V114-F423 HydrophobicContact CG2-CG 4.06Å; V114-T426 HydrophobicContact CG1-CG2 4.1Å; V114-I427 HydrophobicContact CG1-CG1 3.82Å |
| 115 | A | 95.5 | Very high | 93.5 | Very high | 30 Ų | 30 | 26 Ų | 26 | 25% | 0.248 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -60.5 | -40.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | F111 G112 M118 V119 L264 | F111-A115 PolarHBondContact O-N 2.92Å; G112-A115 PolarHBondContact O-N 3.42Å; A115-M118 PolarHBondContact O-N 2.9Å; A115-V119 WeakPolarHBondContact O-CG2 3.24Å; A115-V119 PolarHBondContact O-N 3.34Å; A115-L264 HydrophobicContact CB-CD1 4.01Å; A115-L264 HydrophobicContact CB-CD2 4.08Å |
| 116 | A | 95 | Very high | 93.9 | Very high | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -62.7 | -43.6 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | G112 T113 V114 M118 V119 L120 D263 L267 P354 | G112-A116 PolarHBondContact O-N 2.9Å; T113-A116 PolarHBondContact O-N 2.92Å; V114-A116 VanDerWaalsContact C-N 3.3Å; V114-A116 PolarHBondContact O-N 3.02Å; A116-M118 VanDerWaalsContact C-N 3.34Å; A116-M118 PolarHBondContact O-N 3.05Å; A116-V119 PolarHBondContact O-N 2.75Å; A116-V119 VanDerWaalsContact O-N 3.16Å; A116-L120 PolarHBondContact O-N 2.97Å; A116-D263 HydrophobicContact CB-CB 3.74Å; A116-L267 HydrophobicContact CB-CD2 4.42Å; A116-L267 WeakPolarHBondContact O-CD2 3.49Å; A116-P354 HydrophobicContact CB-CB 4.08Å |
| 117 | G | 95.3 | Very high | 94.1 | Very high | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -54.1 | -47.5 | 172 | 0 | 0 | 0 | 0 | 0 | 112.7 | T113 V114 V119 L120 D121 V351 | T113-G117 PolarHBondContact O-N 3.1Å; V114-G117 WeakPolarHBondContact O-CA 3.48Å; V114-G117 PolarHBondContact O-N 3.44Å; V114-G117 VanDerWaalsContact O-N 3.11Å; G117-V119 VanDerWaalsContact C-N 3.33Å; G117-V119 PolarHBondContact O-N 3.07Å; G117-L120 WeakPolarHBondContact O-CB 3.45Å; G117-L120 PolarHBondContact O-N 3.33Å; G117-L120 VanDerWaalsContact O-N 3.12Å; G117-D121 WeakPolarHBondContact O-CB 3.28Å; G117-D121 PolarHBondContact O-N 3.33Å; G117-V351 WeakPolarHBondContact CA-O 3.32Å; G117-V351 WeakPolarHBondContact O-CA 3.27Å |
| 118 | M | 94.8 | Very high | 94.2 | Very high | 21 Ų | 21 | 29.5 Ų | 29.5 | 10% | 0.103 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -63.2 | -38.3 | 177 | -65 | -59.3 | -55.5 | 0 | 0 | 112.3 | V114 A115 A116 L120 D121 I122 V351 M430 | V114-M118 WeakPolarHBondContact O-CG 3.17Å; V114-M118 PolarHBondContact O-N 3.01Å; A115-M118 PolarHBondContact O-N 2.9Å; A116-M118 VanDerWaalsContact C-N 3.34Å; A116-M118 PolarHBondContact O-N 3.05Å; M118-L120 VanDerWaalsContact C-N 3.35Å; M118-D121 PolarHBondContact O-N 3.47Å; M118-I122 VanDerWaalsContact O-CG1 3.32Å; M118-I122 WeakPolarHBondContact O-CG1 3.32Å; M118-I122 PolarHBondContact O-N 2.85Å; M118-I122 VanDerWaalsContact O-N 3.11Å; M118-V351 HydrophobicContact SD-CG2 3.69Å; M118-M430 HydrophobicContact CE-CB 3.89Å; M118-M430 HydrophobicContact CE-CE 4.36Å; M118-M430 HydrophobicContact CG-CE 3.87Å; M118-M430 HydrophobicContact CG-SD 4.25Å; M118-M430 HydrophobicContact SD-CB 4.11Å |
| 119 | V | 95.8 | Very high | 94.3 | Very high | 32 Ų | 32 | 26.6 Ų | 26.6 | 19% | 0.194 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -62.9 | -44.8 | 172.8 | 171.8 | 0 | 0 | 0 | 0 | 110.1 | A115 A116 G117 D121 I122 V123 L264 L267 | A115-V119 WeakPolarHBondContact O-CG2 3.24Å; A115-V119 PolarHBondContact O-N 3.34Å; A116-V119 PolarHBondContact O-N 2.75Å; A116-V119 VanDerWaalsContact O-N 3.16Å; G117-V119 VanDerWaalsContact C-N 3.33Å; G117-V119 PolarHBondContact O-N 3.07Å; V119-D121 VanDerWaalsContact C-N 3.29Å; V119-D121 PolarHBondContact O-N 3.15Å; V119-I122 PolarHBondContact O-N 2.75Å; V119-V123 HydrophobicContact CG1-CG1 4.08Å; V119-V123 VanDerWaalsContact O-CG1 3.25Å; V119-V123 WeakPolarHBondContact O-CG1 3.46Å; V119-V123 VanDerWaalsContact O-CG2 3.23Å; V119-V123 WeakPolarHBondContact O-CG2 3.41Å; V119-V123 PolarHBondContact O-N 3.31Å; V119-L264 HydrophobicContact CG2-CD1 3.73Å; V119-L267 HydrophobicContact CB-CD2 4.11Å; V119-L267 HydrophobicContact CG1-CD2 4.04Å; V119-L267 HydrophobicContact CG1-CG 4.02Å |
| 120 | L | 95.2 | Very high | 94.4 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -60.6 | -40.8 | 179.1 | -165.6 | 49.6 | 0 | 0 | 0 | 111.6 | A116 G117 M118 I122 V123 Q124 F129 F136 V139 L267 L337 A350 P354 | A116-L120 PolarHBondContact O-N 2.97Å; G117-L120 WeakPolarHBondContact O-CB 3.45Å; G117-L120 PolarHBondContact O-N 3.33Å; G117-L120 VanDerWaalsContact O-N 3.12Å; M118-L120 VanDerWaalsContact C-N 3.35Å; L120-I122 PolarHBondContact O-N 3.1Å; L120-V123 HydrophobicContact CD1-CG2 4.16Å; L120-V123 WeakPolarHBondContact O-CG2 3.2Å; L120-V123 PolarHBondContact O-N 3.32Å; L120-Q124 WeakPolarHBondContact O-CB 3.44Å; L120-Q124 WeakPolarHBondContact O-CG 3.42Å; L120-Q124 PolarHBondContact O-N 2.85Å; L120-F129 HydrophobicContact CD1-CE1 4.47Å; L120-F136 HydrophobicContact CD1-CD1 4.39Å; L120-F136 HydrophobicContact CD1-CE1 4.29Å; L120-V139 HydrophobicContact CD1-CG2 4.22Å; L120-V139 HydrophobicContact CD2-CG1 4.22Å; L120-L267 HydrophobicContact CB-CD2 3.67Å; L120-L267 HydrophobicContact CD1-CD1 4.08Å; L120-L267 HydrophobicContact CD1-CD2 4.34Å; L120-L267 HydrophobicContact CG-CD2 4.44Å; L120-L337 HydrophobicContact CD2-CD2 4.26Å; L120-A350 WeakPolarHBondContact CD2-O 3.43Å; L120-A350 HydrophobicContact CG-CB 4.08Å; L120-P354 HydrophobicContact CB-CG 4.48Å; L120-P354 HydrophobicContact CD2-CG 3.92Å |
| 121 | D | 94.1 | Very high | 94.3 | Very high | 10 Ų | 10 | 37.5 Ų | 37.5 | 5% | 0.053 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -64.9 | -35.8 | 178.4 | -170.8 | 44.4 | 0 | 0 | 0 | 113.1 | G117 M118 V119 Q124 H125 V351 G433 H434 | G117-D121 WeakPolarHBondContact O-CB 3.28Å; G117-D121 PolarHBondContact O-N 3.33Å; M118-D121 PolarHBondContact O-N 3.47Å; V119-D121 VanDerWaalsContact C-N 3.29Å; V119-D121 PolarHBondContact O-N 3.15Å; D121-Q124 WeakPolarHBondContact O-CG 3.18Å; D121-Q124 PolarHBondContact OD1-NE2 3.48Å; D121-H125 PolarHBondContact O-CE1 3.21Å; D121-H125 PolarHBondContact O-ND1 3.29Å; D121-V351 HydrophobicContact CB-CB 4.05Å; D121-V351 HydrophobicContact CB-CG2 4.36Å; D121-G433 PolarHBondContact OD2-N 3.16Å; D121-H434 IonicContact OD1-CD2 3.77Å |
| 122 | I | 93.7 | Very high | 94.3 | Very high | 99 Ų | 99 | 33.1 Ų | 33.1 | 51% | 0.508 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -74.1 | -46 | 175.6 | -67.1 | 164.6 | 0 | 0 | 0 | 110.6 | M118 V119 L120 H125 | M118-I122 VanDerWaalsContact O-CG1 3.32Å; M118-I122 WeakPolarHBondContact O-CG1 3.32Å; M118-I122 PolarHBondContact O-N 2.85Å; M118-I122 VanDerWaalsContact O-N 3.11Å; V119-I122 PolarHBondContact O-N 2.75Å; L120-I122 PolarHBondContact O-N 3.1Å; I122-H125 PolarHBondContact O-N 2.83Å |
| 123 | V | 95 | Very high | 94.3 | Very high | 4 Ų | 4 | 34.3 Ų | 34.3 | 2% | 0.024 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -79.7 | -21.2 | -170.5 | -56 | 0 | 0 | 0 | 0 | 112.9 | V119 L120 H125 W126 F129 S271 | V119-V123 HydrophobicContact CG1-CG1 4.08Å; V119-V123 VanDerWaalsContact O-CG1 3.25Å; V119-V123 WeakPolarHBondContact O-CG1 3.46Å; V119-V123 VanDerWaalsContact O-CG2 3.23Å; V119-V123 WeakPolarHBondContact O-CG2 3.41Å; V119-V123 PolarHBondContact O-N 3.31Å; L120-V123 HydrophobicContact CD1-CG2 4.16Å; L120-V123 WeakPolarHBondContact O-CG2 3.2Å; L120-V123 PolarHBondContact O-N 3.32Å; V123-H125 PolarHBondContact O-N 2.88Å; V123-H125 VanDerWaalsContact O-N 3.12Å; V123-W126 HydrophobicContact CB-CD2 4.18Å; V123-W126 HydrophobicContact CB-CE3 4.38Å; V123-W126 HydrophobicContact CB-CG 4.43Å; V123-W126 HydrophobicContact CG1-CD2 4.13Å; V123-W126 HydrophobicContact CG1-CE3 4.23Å; V123-W126 HydrophobicContact CG1-CH2 4.17Å; V123-W126 HydrophobicContact CG1-CZ2 4.03Å; V123-W126 HydrophobicContact CG1-CZ3 4.26Å; V123-W126 VanDerWaalsContact O-CB 3.28Å; V123-W126 WeakPolarHBondContact O-CB 3.41Å; V123-W126 PolarHBondContact O-N 3Å; V123-F129 HydrophobicContact CB-CD2 4.14Å; V123-F129 HydrophobicContact CB-CE2 3.79Å; V123-F129 HydrophobicContact CB-CZ 4.21Å; V123-F129 HydrophobicContact CG2-CD2 4.27Å; V123-F129 HydrophobicContact CG2-CE1 4.09Å; V123-F129 HydrophobicContact CG2-CE2 3.75Å; V123-F129 HydrophobicContact CG2-CZ 3.64Å; V123-F129 WeakPolarHBondContact O-CB 3.45Å; V123-F129 WeakPolarHBondContact O-CD2 3.39Å; V123-F129 WeakPolarHBondContact O-CG 3.16Å; V123-S271 WeakPolarHBondContact CG2-OG 3.29Å |
| 124 | Q | 93.9 | Very high | 94.3 | Very high | 11 Ų | 11 | 35.6 Ų | 35.6 | 5% | 0.051 | 17% | 0.174 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -56.9 | -26.7 | 173.3 | 59.2 | 165 | -33.7 | 0 | 0 | 112.5 | L120 D121 F136 V341 A347 A350 | L120-Q124 WeakPolarHBondContact O-CB 3.44Å; L120-Q124 WeakPolarHBondContact O-CG 3.42Å; L120-Q124 PolarHBondContact O-N 2.85Å; D121-Q124 WeakPolarHBondContact O-CG 3.18Å; D121-Q124 PolarHBondContact OD1-NE2 3.48Å; Q124-F136 HydrophobicContact CB-CE1 3.86Å; Q124-F136 HydrophobicContact CB-CZ 3.74Å; Q124-V341 HydrophobicContact CB-CG1 4.06Å; Q124-A347 PolarHBondContact NE2-O 2.89Å; Q124-A347 VanDerWaalsContact NE2-O 3.1Å; Q124-A347 PolarHBondContact OE1-O 3.24Å; Q124-A350 HydrophobicContact CG-CB 4.34Å; Q124-A350 VanDerWaalsContact NE2-CB 3.34Å |
| 125 | H | 92.9 | Very high | 94.4 | Very high | 88 Ų | 88 | 35.5 Ų | 35.5 | 41% | 0.407 | 17% | 0.173 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.3 | -3.9 | 177.8 | -59.1 | 100.6 | 0 | 0 | 0 | 113.7 | D121 I122 V123 H434 | D121-H125 PolarHBondContact O-CE1 3.21Å; D121-H125 PolarHBondContact O-ND1 3.29Å; I122-H125 PolarHBondContact O-N 2.83Å; V123-H125 PolarHBondContact O-N 2.88Å; V123-H125 VanDerWaalsContact O-N 3.12Å; H125-H434 AromaticContact CE1-CD2 3.78Å; H125-H434 AromaticContact CE1-NE2 3.21Å; H125-H434 PolarHBondContact CE1-NE2 3.42Å; H125-H434 AromaticContact NE2-NE2 3.72Å |
| 126 | W | 94.9 | Very high | 94.4 | Very high | 84 Ų | 84 | 34.3 Ų | 34.3 | 32% | 0.318 | 16% | 0.162 | S | C | . | . | S | Bend | trans | -76.1 | 146.3 | 177.9 | -68.3 | 9.4 | 0 | 0 | 0 | 110.9 | V123 V128 F129 Q130 W275 | V123-W126 HydrophobicContact CB-CD2 4.18Å; V123-W126 HydrophobicContact CB-CE3 4.38Å; V123-W126 HydrophobicContact CB-CG 4.43Å; V123-W126 HydrophobicContact CG1-CD2 4.13Å; V123-W126 HydrophobicContact CG1-CE3 4.23Å; V123-W126 HydrophobicContact CG1-CH2 4.17Å; V123-W126 HydrophobicContact CG1-CZ2 4.03Å; V123-W126 HydrophobicContact CG1-CZ3 4.26Å; V123-W126 VanDerWaalsContact O-CB 3.28Å; V123-W126 WeakPolarHBondContact O-CB 3.41Å; V123-W126 PolarHBondContact O-N 3Å; W126-V128 HydrophobicContact CB-CG1 4.42Å; W126-V128 PolarHBondContact O-N 3.32Å; W126-V128 VanDerWaalsContact O-N 3.07Å; W126-F129 HydrophobicContact CB-CD2 4.39Å; W126-F129 PolarHBondContact O-N 2.92Å; W126-Q130 PolarHBondContact O-N 2.92Å; W126-Q130 VanDerWaalsContact O-N 3.11Å; W126-W275 HydrophobicContact CB-CE3 4.16Å; W126-W275 HydrophobicContact CB-CZ3 4.31Å; W126-W275 HydrophobicContact CE3-CB 3.72Å; W126-W275 HydrophobicContact CE3-CD2 4.07Å; W126-W275 HydrophobicContact CE3-CE3 4.21Å; W126-W275 AromaticContact CE3-CG 3.87Å; W126-W275 HydrophobicContact CE3-CG 3.87Å; W126-W275 HydrophobicContact CZ3-CB 3.7Å; W126-W275 AromaticContact CZ3-CG 3.9Å; W126-W275 HydrophobicContact CZ3-CG 3.9Å |
| 127 | E | 93.8 | Very high | 94.4 | Very high | 72 Ų | 72 | 34.3 Ų | 34.3 | 34% | 0.336 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -53.9 | -36.4 | -175.4 | -160.9 | -166.1 | 148.5 | 0 | 0 | 113 | Q130 K131 W275 Y278 | E127-Q130 PolarHBondContact O-N 2.87Å; E127-K131 HydrophobicContact CG-CD 3.89Å; E127-K131 HydrophobicContact CG-CG 4.42Å; E127-K131 WeakPolarHBondContact O-CB 3.29Å; E127-K131 WeakPolarHBondContact O-CG 3.26Å; E127-K131 PolarHBondContact O-N 3.09Å; E127-K131 WeakPolarHBondContact OE1-CE 3.35Å; E127-K131 IonicContact OE1-NZ 3.6Å; E127-K131 PolarHBondContact OE1-NZ 3.5Å; E127-W275 HydrophobicContact CB-CH2 4.38Å; E127-W275 HydrophobicContact CB-CZ3 3.73Å; E127-Y278 HydrophobicContact CB-CE1 4.36Å; E127-Y278 HydrophobicContact CG-CE1 4.14Å; E127-Y278 WeakPolarHBondContact OE1-CE1 3.29Å; E127-Y278 PolarHBondContact OE1-OH 2.99Å |
| 128 | V | 94.4 | Very high | 94.4 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -66.2 | -40.5 | 179.1 | 67.5 | 0 | 0 | 0 | 0 | 112.3 | W126 V132 L216 W275 Y278 | W126-V128 HydrophobicContact CB-CG1 4.42Å; W126-V128 PolarHBondContact O-N 3.32Å; W126-V128 VanDerWaalsContact O-N 3.07Å; V128-V132 WeakPolarHBondContact O-CA 3.35Å; V128-V132 VanDerWaalsContact O-CB 3.28Å; V128-V132 WeakPolarHBondContact O-CB 3.24Å; V128-V132 PolarHBondContact O-N 3.15Å; V128-L216 HydrophobicContact CG2-CD2 4.08Å; V128-W275 HydrophobicContact CB-CE3 4.36Å; V128-W275 HydrophobicContact CG1-CB 4.27Å; V128-W275 HydrophobicContact CG1-CE3 4.07Å; V128-Y278 HydrophobicContact CB-CD1 4.24Å; V128-Y278 HydrophobicContact CB-CD2 4.49Å; V128-Y278 HydrophobicContact CB-CG 4Å; V128-Y278 HydrophobicContact CG2-CD2 4.13Å; V128-Y278 HydrophobicContact CG2-CG 3.93Å |
| 129 | F | 94.3 | Very high | 94.4 | Very high | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -73.2 | -33 | 178.4 | -81.1 | -96.3 | 0 | 0 | 0 | 111.8 | L120 V123 W126 T133 V135 F136 V139 | L120-F129 HydrophobicContact CD1-CE1 4.47Å; V123-F129 HydrophobicContact CB-CD2 4.14Å; V123-F129 HydrophobicContact CB-CE2 3.79Å; V123-F129 HydrophobicContact CB-CZ 4.21Å; V123-F129 HydrophobicContact CG2-CD2 4.27Å; V123-F129 HydrophobicContact CG2-CE1 4.09Å; V123-F129 HydrophobicContact CG2-CE2 3.75Å; V123-F129 HydrophobicContact CG2-CZ 3.64Å; V123-F129 WeakPolarHBondContact O-CB 3.45Å; V123-F129 WeakPolarHBondContact O-CD2 3.39Å; V123-F129 WeakPolarHBondContact O-CG 3.16Å; W126-F129 HydrophobicContact CB-CD2 4.39Å; W126-F129 PolarHBondContact O-N 2.92Å; F129-T133 WeakPolarHBondContact O-CA 3.02Å; F129-V135 HydrophobicContact CD1-CB 4.18Å; F129-V135 HydrophobicContact CD1-CG1 3.89Å; F129-V135 HydrophobicContact CE1-CB 4.16Å; F129-V135 HydrophobicContact CE1-CG1 3.39Å; F129-V135 HydrophobicContact CE2-CG1 4.25Å; F129-V135 HydrophobicContact CZ-CG1 3.59Å; F129-F136 HydrophobicContact CB-CE2 4.17Å; F129-F136 HydrophobicContact CB-CZ 3.85Å; F129-F136 AromaticContact CD1-CD1 3.89Å; F129-F136 HydrophobicContact CD1-CD1 3.89Å; F129-F136 AromaticContact CD1-CE1 3.5Å; F129-F136 HydrophobicContact CD1-CE1 3.5Å; F129-F136 VanDerWaalsContact CD1-CE1 3.5Å; F129-F136 HydrophobicContact CD1-CE2 4.21Å; F129-F136 HydrophobicContact CD1-CG 4.4Å; F129-F136 AromaticContact CD1-CZ 3.68Å; F129-F136 HydrophobicContact CD1-CZ 3.68Å; F129-F136 HydrophobicContact CE1-CD1 4.28Å; F129-F136 HydrophobicContact CE1-CE1 4.15Å; F129-F136 HydrophobicContact CG-CE1 4.41Å; F129-F136 HydrophobicContact CG-CZ 4.22Å; F129-F136 WeakPolarHBondContact O-CE2 3.44Å; F129-V139 HydrophobicContact CE1-CG2 4.45Å |
| 130 | Q | 93.1 | Very high | 94.4 | Very high | 117 Ų | 117 | 32 Ų | 32 | 55% | 0.547 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -74.1 | -36.3 | 177 | -67.3 | -178.4 | -19.9 | 0 | 0 | 113.1 | W126 E127 | W126-Q130 PolarHBondContact O-N 2.92Å; W126-Q130 VanDerWaalsContact O-N 3.11Å; E127-Q130 PolarHBondContact O-N 2.87Å |
| 131 | K | 92.1 | Very high | 94.3 | Very high | 117 Ų | 117 | 32 Ų | 32 | 51% | 0.509 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -91.9 | -25.8 | -178.1 | -71 | -176.7 | 176.2 | 179.9 | 0 | 114.1 | E127 H213 Y278 | E127-K131 HydrophobicContact CG-CD 3.89Å; E127-K131 HydrophobicContact CG-CG 4.42Å; E127-K131 WeakPolarHBondContact O-CB 3.29Å; E127-K131 WeakPolarHBondContact O-CG 3.26Å; E127-K131 PolarHBondContact O-N 3.09Å; E127-K131 WeakPolarHBondContact OE1-CE 3.35Å; E127-K131 IonicContact OE1-NZ 3.6Å; E127-K131 PolarHBondContact OE1-NZ 3.5Å; K131-H213 PolarHBondContact O-CE1 2.85Å; K131-H213 VanDerWaalsContact O-CE1 3.26Å; K131-Y278 WeakPolarHBondContact CD-OH 3.1Å; K131-Y278 PolarHBondContact NZ-OH 3.02Å |
| 132 | V | 93.6 | Very high | 94.3 | Very high | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 15% | 0.148 | C | C | . | . | trans | -124.2 | 71.5 | 179.9 | -168.3 | 0 | 0 | 0 | 0 | 107.3 | V128 E134 V135 H213 L216 L217 | V128-V132 WeakPolarHBondContact O-CA 3.35Å; V128-V132 VanDerWaalsContact O-CB 3.28Å; V128-V132 WeakPolarHBondContact O-CB 3.24Å; V128-V132 PolarHBondContact O-N 3.15Å; V132-E134 VanDerWaalsContact C-OE2 3.31Å; V132-E134 WeakPolarHBondContact CA-OE2 3.29Å; V132-E134 VanDerWaalsContact CG1-OE2 3.28Å; V132-E134 WeakPolarHBondContact CG1-OE2 3.32Å; V132-E134 PolarHBondContact O-N 2.9Å; V132-E134 VanDerWaalsContact O-N 3.14Å; V132-V135 HydrophobicContact CB-CG2 4.27Å; V132-V135 HydrophobicContact CG1-CG2 4.1Å; V132-V135 WeakPolarHBondContact O-CB 3.31Å; V132-V135 VanDerWaalsContact O-CG2 3.28Å; V132-V135 WeakPolarHBondContact O-CG2 3.2Å; V132-V135 PolarHBondContact O-N 3.35Å; V132-V135 VanDerWaalsContact O-N 3.09Å; V132-H213 HydrophobicContact CG1-CB 4.02Å; V132-L216 HydrophobicContact CG1-CD2 4.43Å; V132-L216 HydrophobicContact CG2-CD2 4.01Å; V132-L217 HydrophobicContact CG1-CD2 4.19Å; V132-L217 HydrophobicContact CG1-CG 4.31Å | ||
| 133 | T | 93.6 | Very high | 94.3 | Very high | 34 Ų | 34 | 27.8 Ų | 27.8 | 21% | 0.209 | 13% | 0.128 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -18.4 | -173.5 | 73.6 | 0 | 0 | 0 | 0 | 111.7 | F129 V135 F136 D338 | F129-T133 WeakPolarHBondContact O-CA 3.02Å; T133-V135 PolarHBondContact O-N 2.91Å; T133-F136 WeakPolarHBondContact O-CB 3.17Å; T133-F136 WeakPolarHBondContact O-CD2 3.28Å; T133-F136 PolarHBondContact O-N 3.41Å; T133-D338 WeakPolarHBondContact CB-OD1 3.34Å; T133-D338 PolarHBondContact OG1-OD1 2.92Å |
| 134 | E | 94.5 | Very high | 94 | Very high | 27 Ų | 27 | 27.8 Ų | 27.8 | 13% | 0.126 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -59.1 | -16.6 | 172.7 | -54.6 | 94.7 | 149.4 | 0 | 0 | 113.3 | V132 F136 I137 L138 H213 L217 | V132-E134 VanDerWaalsContact C-OE2 3.31Å; V132-E134 WeakPolarHBondContact CA-OE2 3.29Å; V132-E134 VanDerWaalsContact CG1-OE2 3.28Å; V132-E134 WeakPolarHBondContact CG1-OE2 3.32Å; V132-E134 PolarHBondContact O-N 2.9Å; V132-E134 VanDerWaalsContact O-N 3.14Å; E134-F136 VanDerWaalsContact C-N 3.27Å; E134-F136 PolarHBondContact O-N 2.94Å; E134-I137 HydrophobicContact CB-CD1 4.5Å; E134-I137 WeakPolarHBondContact O-CB 3.47Å; E134-I137 PolarHBondContact O-N 2.96Å; E134-L138 PolarHBondContact O-N 3.48Å; E134-H213 IonicContact OE1-ND1 3.63Å; E134-H213 IonicContact OE2-ND1 3.57Å; E134-L217 HydrophobicContact CB-CD1 3.56Å; E134-L217 HydrophobicContact CB-CD2 4.02Å; E134-L217 HydrophobicContact CB-CG 4.41Å; E134-L217 HydrophobicContact CG-CD1 4.25Å |
| 135 | V | 96.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -62.5 | -34 | 170 | -178.8 | 0 | 0 | 0 | 0 | 111.1 | F129 V132 T133 I137 L138 V139 L217 L270 | F129-V135 HydrophobicContact CD1-CB 4.18Å; F129-V135 HydrophobicContact CD1-CG1 3.89Å; F129-V135 HydrophobicContact CE1-CB 4.16Å; F129-V135 HydrophobicContact CE1-CG1 3.39Å; F129-V135 HydrophobicContact CE2-CG1 4.25Å; F129-V135 HydrophobicContact CZ-CG1 3.59Å; V132-V135 HydrophobicContact CB-CG2 4.27Å; V132-V135 HydrophobicContact CG1-CG2 4.1Å; V132-V135 WeakPolarHBondContact O-CB 3.31Å; V132-V135 VanDerWaalsContact O-CG2 3.28Å; V132-V135 WeakPolarHBondContact O-CG2 3.2Å; V132-V135 PolarHBondContact O-N 3.35Å; V132-V135 VanDerWaalsContact O-N 3.09Å; T133-V135 PolarHBondContact O-N 2.91Å; V135-I137 VanDerWaalsContact C-N 3.29Å; V135-I137 PolarHBondContact O-N 2.67Å; V135-L138 WeakPolarHBondContact O-CB 3.45Å; V135-L138 PolarHBondContact O-N 3.23Å; V135-L138 VanDerWaalsContact O-N 3.13Å; V135-V139 PolarHBondContact O-N 2.93Å; V135-L217 HydrophobicContact CB-CD2 4.48Å; V135-L217 HydrophobicContact CG2-CD2 3.75Å; V135-L270 HydrophobicContact CG1-CD2 4.23Å; V135-L270 HydrophobicContact CG1-CG 4.31Å |
| 136 | F | 95.6 | Very high | 93.2 | Very high | 5 Ų | 5 | 23.9 Ų | 23.9 | 2% | 0.022 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -64.6 | -34.2 | 173.8 | -66.5 | -64.8 | 0 | 0 | 0 | 112.2 | L120 Q124 F129 T133 E134 L138 V139 P140 D338 V341 | L120-F136 HydrophobicContact CD1-CD1 4.39Å; L120-F136 HydrophobicContact CD1-CE1 4.29Å; Q124-F136 HydrophobicContact CB-CE1 3.86Å; Q124-F136 HydrophobicContact CB-CZ 3.74Å; F129-F136 HydrophobicContact CB-CE2 4.17Å; F129-F136 HydrophobicContact CB-CZ 3.85Å; F129-F136 AromaticContact CD1-CD1 3.89Å; F129-F136 HydrophobicContact CD1-CD1 3.89Å; F129-F136 AromaticContact CD1-CE1 3.5Å; F129-F136 HydrophobicContact CD1-CE1 3.5Å; F129-F136 VanDerWaalsContact CD1-CE1 3.5Å; F129-F136 HydrophobicContact CD1-CE2 4.21Å; F129-F136 HydrophobicContact CD1-CG 4.4Å; F129-F136 AromaticContact CD1-CZ 3.68Å; F129-F136 HydrophobicContact CD1-CZ 3.68Å; F129-F136 HydrophobicContact CE1-CD1 4.28Å; F129-F136 HydrophobicContact CE1-CE1 4.15Å; F129-F136 HydrophobicContact CG-CE1 4.41Å; F129-F136 HydrophobicContact CG-CZ 4.22Å; F129-F136 WeakPolarHBondContact O-CE2 3.44Å; T133-F136 WeakPolarHBondContact O-CB 3.17Å; T133-F136 WeakPolarHBondContact O-CD2 3.28Å; T133-F136 PolarHBondContact O-N 3.41Å; E134-F136 VanDerWaalsContact C-N 3.27Å; E134-F136 PolarHBondContact O-N 2.94Å; F136-L138 PolarHBondContact O-N 2.84Å; F136-V139 PolarHBondContact O-N 3.45Å; F136-P140 WeakPolarHBondContact O-CD 3.34Å; F136-D338 HydrophobicContact CB-CB 3.92Å; F136-V341 HydrophobicContact CD1-CG1 4.28Å; F136-V341 HydrophobicContact CE1-CB 4.38Å; F136-V341 HydrophobicContact CE1-CG1 3.64Å; F136-V341 HydrophobicContact CE2-CG1 4.06Å; F136-V341 HydrophobicContact CZ-CB 4.43Å; F136-V341 HydrophobicContact CZ-CG1 3.51Å |
| 137 | I | 95.2 | Very high | 92.2 | Very high | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -63.6 | -34.6 | 174.8 | -52 | 179.3 | 0 | 0 | 0 | 110.9 | E134 V135 A198 F201 G334 L335 D338 | E134-I137 HydrophobicContact CB-CD1 4.5Å; E134-I137 WeakPolarHBondContact O-CB 3.47Å; E134-I137 PolarHBondContact O-N 2.96Å; V135-I137 VanDerWaalsContact C-N 3.29Å; V135-I137 PolarHBondContact O-N 2.67Å; I137-A198 HydrophobicContact CB-CB 4.15Å; I137-A198 HydrophobicContact CG2-CB 4.15Å; I137-F201 HydrophobicContact CD1-CB 4.18Å; I137-F201 HydrophobicContact CG2-CB 4.19Å; I137-F201 HydrophobicContact CG2-CD2 4.28Å; I137-G334 WeakPolarHBondContact CA-O 3.4Å; I137-L335 HydrophobicContact CD1-CD1 3.93Å; I137-D338 HydrophobicContact CD1-CB 4.37Å; I137-D338 HydrophobicContact CG1-CB 3.63Å |
| 138 | L | 95.5 | Very high | 91.6 | Very high | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -75 | -25.8 | -179.7 | -173 | 61.3 | 0 | 0 | 0 | 113.1 | E134 V135 F136 A141 L142 A194 A198 S221 L270 | E134-L138 PolarHBondContact O-N 3.48Å; V135-L138 WeakPolarHBondContact O-CB 3.45Å; V135-L138 PolarHBondContact O-N 3.23Å; V135-L138 VanDerWaalsContact O-N 3.13Å; F136-L138 PolarHBondContact O-N 2.84Å; L138-A141 PolarHBondContact O-N 3.14Å; L138-L142 HydrophobicContact CD1-CD1 4.05Å; L138-L142 HydrophobicContact CD1-CD2 4.26Å; L138-L142 HydrophobicContact CD1-CG 3.81Å; L138-L142 HydrophobicContact CD2-CD1 3.97Å; L138-L142 HydrophobicContact CG-CD1 3.67Å; L138-L142 HydrophobicContact CG-CG 3.86Å; L138-L142 PolarHBondContact O-N 3.05Å; L138-A194 HydrophobicContact CD1-CB 3.72Å; L138-A198 HydrophobicContact CB-CB 4.44Å; L138-S221 WeakPolarHBondContact CD1-OG 3.24Å; L138-L270 HydrophobicContact CD2-CD1 3.71Å; L138-L270 HydrophobicContact CG-CD1 4.43Å |
| 139 | V | 95.9 | Very high | 91.1 | Very high | 2 Ų | 2 | 17.1 Ų | 17.1 | 1% | 0.012 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -56.7 | -62.6 | -176.5 | 167 | 0 | 0 | 0 | 0 | 111.4 | L120 F129 V135 F136 A141 L142 L143 L267 L270 L337 | L120-V139 HydrophobicContact CD1-CG2 4.22Å; L120-V139 HydrophobicContact CD2-CG1 4.22Å; F129-V139 HydrophobicContact CE1-CG2 4.45Å; V135-V139 PolarHBondContact O-N 2.93Å; F136-V139 PolarHBondContact O-N 3.45Å; V139-A141 VanDerWaalsContact C-N 3.27Å; V139-A141 PolarHBondContact O-N 3.25Å; V139-L142 PolarHBondContact O-N 3.49Å; V139-L143 HydrophobicContact CG1-CD1 3.84Å; V139-L143 HydrophobicContact CG1-CG 4.31Å; V139-L143 VanDerWaalsContact O-CG 3.29Å; V139-L143 WeakPolarHBondContact O-CG 3.49Å; V139-L143 PolarHBondContact O-N 2.91Å; V139-L267 HydrophobicContact CG1-CD1 4.01Å; V139-L267 HydrophobicContact CG2-CD1 3.75Å; V139-L270 HydrophobicContact CG2-CD2 3.67Å; V139-L337 HydrophobicContact CB-CD2 4.26Å; V139-L337 HydrophobicContact CG1-CD2 4.2Å |
| 140 | P | 94 | Very high | 90.6 | Very high | 2 Ų | 2 | 17.2 Ų | 17.2 | 1% | 0.013 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -62.3 | -33.4 | -179.4 | -27.5 | 39.8 | 0 | 0 | 0 | 113.3 | F136 L142 L143 G144 L337 | F136-P140 WeakPolarHBondContact O-CD 3.34Å; P140-L142 PolarHBondContact O-N 3.13Å; P140-L143 PolarHBondContact O-N 3.39Å; P140-G144 PolarHBondContact O-N 3.4Å; P140-L337 HydrophobicContact CG-CD2 3.92Å |
| 141 | A | 94.5 | Very high | 89.8 | Confident | 0 Ų | 0 | 12.2 Ų | 12.2 | 0% | 0 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -62.3 | -42.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | L138 V139 L145 A194 M327 S331 | L138-A141 PolarHBondContact O-N 3.14Å; V139-A141 VanDerWaalsContact C-N 3.27Å; V139-A141 PolarHBondContact O-N 3.25Å; A141-L145 VanDerWaalsContact O-CB 3.32Å; A141-L145 WeakPolarHBondContact O-CB 3.42Å; A141-L145 PolarHBondContact O-N 3.47Å; A141-A194 HydrophobicContact CB-CB 4.16Å; A141-M327 HydrophobicContact CB-CG 4.41Å; A141-S331 WeakPolarHBondContact CB-OG 3.37Å |
| 142 | L | 94.5 | Very high | 89.2 | Confident | 3 Ų | 3 | 7.8 Ų | 7.8 | 2% | 0.016 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -76.9 | -36.5 | 177.8 | -69.2 | -176.6 | 0 | 0 | 0 | 112.9 | L138 V139 P140 L145 K146 T224 A225 T266 L270 | L138-L142 HydrophobicContact CD1-CD1 4.05Å; L138-L142 HydrophobicContact CD1-CD2 4.26Å; L138-L142 HydrophobicContact CD1-CG 3.81Å; L138-L142 HydrophobicContact CD2-CD1 3.97Å; L138-L142 HydrophobicContact CG-CD1 3.67Å; L138-L142 HydrophobicContact CG-CG 3.86Å; L138-L142 PolarHBondContact O-N 3.05Å; V139-L142 PolarHBondContact O-N 3.49Å; P140-L142 PolarHBondContact O-N 3.13Å; L142-L145 HydrophobicContact CD2-CD2 4.3Å; L142-L145 WeakPolarHBondContact O-CB 3.44Å; L142-L145 PolarHBondContact O-N 3.21Å; L142-K146 PolarHBondContact O-N 3.41Å; L142-T224 HydrophobicContact CD1-CG2 4.02Å; L142-A225 HydrophobicContact CD2-CB 4.09Å; L142-T266 HydrophobicContact CB-CG2 3.87Å; L142-L270 HydrophobicContact CD1-CD1 3.88Å; L142-L270 HydrophobicContact CD1-CD2 4.18Å; L142-L270 HydrophobicContact CD1-CG 4.46Å |
| 143 | L | 92.9 | Very high | 88.6 | Confident | 17 Ų | 17 | 8 Ų | 8 | 9% | 0.089 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -64.5 | -46.1 | 174.5 | -63 | -175.2 | 0 | 0 | 0 | 110.9 | V139 P140 L145 K146 G147 D263 T266 L267 | V139-L143 HydrophobicContact CG1-CD1 3.84Å; V139-L143 HydrophobicContact CG1-CG 4.31Å; V139-L143 VanDerWaalsContact O-CG 3.29Å; V139-L143 WeakPolarHBondContact O-CG 3.49Å; V139-L143 PolarHBondContact O-N 2.91Å; P140-L143 PolarHBondContact O-N 3.39Å; L143-L145 PolarHBondContact O-N 2.79Å; L143-K146 WeakPolarHBondContact O-CB 3.47Å; L143-K146 VanDerWaalsContact O-CG 3.3Å; L143-K146 WeakPolarHBondContact O-CG 3.1Å; L143-K146 PolarHBondContact O-N 3.47Å; L143-G147 PolarHBondContact O-N 2.88Å; L143-D263 HydrophobicContact CD2-CB 4.08Å; L143-T266 HydrophobicContact CD2-CG2 4.12Å; L143-L267 HydrophobicContact CD2-CB 4.4Å |
| 144 | G | 88.5 | Confident | 88 | Confident | 4 Ų | 4 | 6.3 Ų | 6.3 | 4% | 0.041 | 4% | 0.035 | C | C | . | . | H | α-helix | trans | -62.2 | -39.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | P140 K146 G147 N148 | P140-G144 PolarHBondContact O-N 3.4Å; G144-K146 VanDerWaalsContact C-N 3.31Å; G144-K146 PolarHBondContact O-N 2.87Å; G144-G147 PolarHBondContact O-N 3.33Å; G144-N148 VanDerWaalsContact O-CG 3.25Å; G144-N148 PolarHBondContact O-N 3.44Å; G144-N148 VanDerWaalsContact O-N 3.17Å; G144-N148 PolarHBondContact O-ND2 3.03Å; G144-N148 PolarHBondContact O-OD1 2.82Å |
| 145 | L | 86.4 | Confident | 87 | Confident | 5 Ų | 5 | 6.9 Ų | 6.9 | 3% | 0.026 | 4% | 0.041 | C | C | . | . | H | α-helix | trans | -56.9 | -43.6 | 175.1 | 179 | 59.3 | 0 | 0 | 0 | 112 | A141 L142 L143 G147 N148 L149 V190 A225 V323 | A141-L145 VanDerWaalsContact O-CB 3.32Å; A141-L145 WeakPolarHBondContact O-CB 3.42Å; A141-L145 PolarHBondContact O-N 3.47Å; L142-L145 HydrophobicContact CD2-CD2 4.3Å; L142-L145 WeakPolarHBondContact O-CB 3.44Å; L142-L145 PolarHBondContact O-N 3.21Å; L143-L145 PolarHBondContact O-N 2.79Å; L145-G147 PolarHBondContact O-N 3.5Å; L145-N148 PolarHBondContact O-N 2.92Å; L145-L149 HydrophobicContact CD1-CD1 3.7Å; L145-L149 HydrophobicContact CD1-CD2 4.3Å; L145-L149 HydrophobicContact CD1-CG 3.79Å; L145-L149 HydrophobicContact CG-CD1 3.93Å; L145-L149 HydrophobicContact CG-CG 4.26Å; L145-L149 WeakPolarHBondContact O-CG 2.98Å; L145-L149 PolarHBondContact O-N 3.19Å; L145-V190 HydrophobicContact CD1-CB 3.73Å; L145-V190 HydrophobicContact CD1-CG1 3.5Å; L145-V190 VanDerWaalsContact CD1-CG1 3.5Å; L145-V190 HydrophobicContact CD1-CG2 4.22Å; L145-V190 HydrophobicContact CD2-CB 3.98Å; L145-V190 HydrophobicContact CD2-CG1 3.96Å; L145-V190 HydrophobicContact CG-CG1 4.27Å; L145-A225 HydrophobicContact CD2-CB 4.2Å; L145-V323 HydrophobicContact CD1-CG1 3.84Å |
| 146 | K | 84.2 | Confident | 86.1 | Confident | 13 Ų | 13 | 9.8 Ų | 9.8 | 6% | 0.057 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -59.2 | -42 | 176.9 | 109.9 | -176.1 | 172 | 66.1 | 0 | 110.8 | L142 L143 G144 N148 L149 E150 A258 A259 G262 D263 | L142-K146 PolarHBondContact O-N 3.41Å; L143-K146 WeakPolarHBondContact O-CB 3.47Å; L143-K146 VanDerWaalsContact O-CG 3.3Å; L143-K146 WeakPolarHBondContact O-CG 3.1Å; L143-K146 PolarHBondContact O-N 3.47Å; G144-K146 VanDerWaalsContact C-N 3.31Å; G144-K146 PolarHBondContact O-N 2.87Å; K146-N148 PolarHBondContact O-N 3.11Å; K146-L149 PolarHBondContact O-N 3.35Å; K146-E150 HydrophobicContact CB-CG 4.45Å; K146-E150 VanDerWaalsContact O-CB 3.28Å; K146-E150 WeakPolarHBondContact O-CB 3.3Å; K146-E150 WeakPolarHBondContact O-CG 3.49Å; K146-E150 PolarHBondContact O-N 2.92Å; K146-A258 PolarHBondContact NZ-O 2.83Å; K146-A259 VanDerWaalsContact NZ-CA 3.26Å; K146-A259 PolarHBondContact NZ-O 3.23Å; K146-G262 WeakPolarHBondContact CD-O 3.25Å; K146-G262 VanDerWaalsContact CE-CA 3.49Å; K146-D263 WeakPolarHBondContact CD-OD1 3.19Å; K146-D263 WeakPolarHBondContact CE-OD1 3.42Å; K146-D263 IonicContact NZ-OD1 2.6Å |
| 147 | G | 72.7 | Confident | 85.4 | Confident | 5 Ų | 5 | 9.6 Ų | 9.6 | 5% | 0.052 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -60.5 | -39.6 | -176.2 | 0 | 0 | 0 | 0 | 0 | 109 | L143 G144 L145 M151 | L143-G147 PolarHBondContact O-N 2.88Å; G144-G147 PolarHBondContact O-N 3.33Å; L145-G147 PolarHBondContact O-N 3.5Å; G147-M151 WeakPolarHBondContact O-CB 3.29Å; G147-M151 WeakPolarHBondContact O-CE 3.47Å; G147-M151 WeakPolarHBondContact O-CG 3.5Å; G147-M151 PolarHBondContact O-N 2.98Å |
| 148 | N | 81 | Confident | 84.5 | Confident | 3 Ų | 3 | 9.6 Ų | 9.6 | 2% | 0.016 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -74.5 | -42.1 | -178.1 | -57.8 | -9.1 | 0 | 0 | 0 | 111.9 | G144 L145 K146 T152 A326 P480 T483 | G144-N148 VanDerWaalsContact O-CG 3.25Å; G144-N148 PolarHBondContact O-N 3.44Å; G144-N148 VanDerWaalsContact O-N 3.17Å; G144-N148 PolarHBondContact O-ND2 3.03Å; G144-N148 PolarHBondContact O-OD1 2.82Å; L145-N148 PolarHBondContact O-N 2.92Å; K146-N148 PolarHBondContact O-N 3.11Å; N148-T152 WeakPolarHBondContact O-CB 3.28Å; N148-T152 PolarHBondContact O-OG1 3.06Å; N148-A326 WeakPolarHBondContact ND2-CB 3.42Å; N148-P480 HydrophobicContact CB-CB 4.34Å; N148-P480 HydrophobicContact CB-CG 4.17Å; N148-P480 VanDerWaalsContact OD1-CA 3.28Å; N148-P480 WeakPolarHBondContact OD1-CA 3.18Å; N148-T483 PolarHBondContact OD1-OG1 3.48Å |
| 149 | L | 84.1 | Confident | 83.4 | Confident | 5 Ų | 5 | 12.7 Ų | 12.7 | 3% | 0.026 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -82 | -50.4 | -176.3 | -58.8 | -173.3 | 0 | 0 | 0 | 112.5 | L145 K146 T152 L153 I183 Q186 A187 V323 | L145-L149 HydrophobicContact CD1-CD1 3.7Å; L145-L149 HydrophobicContact CD1-CD2 4.3Å; L145-L149 HydrophobicContact CD1-CG 3.79Å; L145-L149 HydrophobicContact CG-CD1 3.93Å; L145-L149 HydrophobicContact CG-CG 4.26Å; L145-L149 WeakPolarHBondContact O-CG 2.98Å; L145-L149 PolarHBondContact O-N 3.19Å; K146-L149 PolarHBondContact O-N 3.35Å; L149-T152 PolarHBondContact O-N 3.1Å; L149-L153 WeakPolarHBondContact O-CB 3.16Å; L149-L153 PolarHBondContact O-N 3.26Å; L149-I183 HydrophobicContact CB-CG2 4.37Å; L149-I183 HydrophobicContact CD1-CG2 4.31Å; L149-Q186 HydrophobicContact CD1-CB 4Å; L149-Q186 HydrophobicContact CD2-CB 3.64Å; L149-Q186 HydrophobicContact CD2-CG 4.29Å; L149-A187 HydrophobicContact CD1-CB 3.91Å; L149-V323 HydrophobicContact CD2-CG1 4.39Å |
| 150 | E | 84.4 | Confident | 82.4 | Confident | 3 Ų | 3 | 13 Ų | 13 | 1% | 0.014 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -77.6 | -37.4 | -172.1 | -55.5 | -54.8 | 150.6 | 0 | 0 | 112.3 | K146 T152 L153 A154 S229 L232 G233 A258 | K146-E150 HydrophobicContact CB-CG 4.45Å; K146-E150 VanDerWaalsContact O-CB 3.28Å; K146-E150 WeakPolarHBondContact O-CB 3.3Å; K146-E150 WeakPolarHBondContact O-CG 3.49Å; K146-E150 PolarHBondContact O-N 2.92Å; E150-T152 VanDerWaalsContact C-N 3.32Å; E150-L153 WeakPolarHBondContact O-CB 3.28Å; E150-L153 PolarHBondContact O-N 2.87Å; E150-A154 WeakPolarHBondContact O-CB 3.4Å; E150-A154 PolarHBondContact O-N 3.22Å; E150-S229 VanDerWaalsContact OE1-CA 3.29Å; E150-S229 WeakPolarHBondContact OE1-CA 3.45Å; E150-S229 WeakPolarHBondContact OE1-CB 3.5Å; E150-L232 HydrophobicContact CG-CB 4.09Å; E150-L232 HydrophobicContact CG-CD1 4.26Å; E150-G233 PolarHBondContact OE2-N 3.37Å; E150-A258 HydrophobicContact CB-CB 4.44Å |
| 151 | M | 77.4 | Confident | 81.5 | Confident | 12 Ų | 12 | 13.1 Ų | 13.1 | 6% | 0.059 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -69.1 | -35.6 | 174.3 | -57 | -167.9 | -101.1 | 0 | 0 | 110.9 | G147 A154 S155 T255 A365 I479 T483 | G147-M151 WeakPolarHBondContact O-CB 3.29Å; G147-M151 WeakPolarHBondContact O-CE 3.47Å; G147-M151 WeakPolarHBondContact O-CG 3.5Å; G147-M151 PolarHBondContact O-N 2.98Å; M151-A154 PolarHBondContact O-N 3.03Å; M151-S155 WeakPolarHBondContact O-CB 3.37Å; M151-S155 PolarHBondContact O-N 3.14Å; M151-T255 HydrophobicContact SD-CG2 4.34Å; M151-A365 HydrophobicContact CE-CB 4.44Å; M151-A365 HydrophobicContact SD-CB 4.14Å; M151-I479 HydrophobicContact CE-CG2 4.45Å; M151-T483 HydrophobicContact CE-CG2 3.86Å |
| 152 | T | 78.2 | Confident | 80.5 | Confident | 24 Ų | 24 | 16.9 Ų | 16.9 | 15% | 0.147 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -66.6 | -40.6 | 173.3 | -60.2 | 0 | 0 | 0 | 0 | 111.5 | N148 L149 E150 R156 | N148-T152 WeakPolarHBondContact O-CB 3.28Å; N148-T152 PolarHBondContact O-OG1 3.06Å; L149-T152 PolarHBondContact O-N 3.1Å; E150-T152 VanDerWaalsContact C-N 3.32Å; T152-R156 HydrophobicContact CG2-CG 4.46Å; T152-R156 VanDerWaalsContact CG2-CZ 3.43Å; T152-R156 WeakPolarHBondContact O-CB 3.45Å; T152-R156 VanDerWaalsContact O-CG 3.29Å; T152-R156 WeakPolarHBondContact O-CG 3.4Å; T152-R156 PolarHBondContact O-N 3.29Å |
| 153 | L | 82 | Confident | 79.5 | Confident | 3 Ų | 3 | 21.3 Ų | 21.3 | 2% | 0.016 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -57.4 | -52.1 | 172.2 | 178.2 | 61.7 | 0 | 0 | 0 | 111.1 | L149 E150 S155 R156 L157 N179 I183 M236 | L149-L153 WeakPolarHBondContact O-CB 3.16Å; L149-L153 PolarHBondContact O-N 3.26Å; E150-L153 WeakPolarHBondContact O-CB 3.28Å; E150-L153 PolarHBondContact O-N 2.87Å; L153-S155 PolarHBondContact O-N 2.92Å; L153-R156 PolarHBondContact O-N 3.23Å; L153-L157 HydrophobicContact CD1-CD1 3.53Å; L153-L157 HydrophobicContact CD1-CG 3.81Å; L153-L157 HydrophobicContact CG-CD1 3.97Å; L153-L157 HydrophobicContact CG-CG 4.43Å; L153-L157 WeakPolarHBondContact O-CB 3.37Å; L153-L157 PolarHBondContact O-N 3.49Å; L153-N179 HydrophobicContact CD1-CB 3.51Å; L153-I183 HydrophobicContact CB-CD1 3.56Å; L153-I183 HydrophobicContact CD1-CD1 3.7Å; L153-I183 HydrophobicContact CD2-CD1 3.52Å; L153-I183 HydrophobicContact CG-CD1 3.74Å; L153-M236 HydrophobicContact CD2-CB 4.21Å |
| 154 | A | 80.6 | Confident | 78.4 | Confident | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -58.8 | -49.7 | -177.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | E150 M151 R156 L157 S158 M236 A254 | E150-A154 WeakPolarHBondContact O-CB 3.4Å; E150-A154 PolarHBondContact O-N 3.22Å; M151-A154 PolarHBondContact O-N 3.03Å; A154-R156 PolarHBondContact O-N 3.44Å; A154-L157 PolarHBondContact O-N 3.08Å; A154-S158 WeakPolarHBondContact O-CB 3.34Å; A154-S158 PolarHBondContact O-N 2.67Å; A154-S158 PolarHBondContact O-OG 3.28Å; A154-M236 HydrophobicContact CB-CE 4.3Å; A154-A254 HydrophobicContact CB-CB 4.15Å |
| 155 | S | 74.4 | Confident | 77.4 | Confident | 38 Ų | 38 | 26.4 Ų | 26.4 | 27% | 0.266 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -56.9 | -48.9 | 176.7 | 174.4 | 0 | 0 | 0 | 0 | 112.5 | M151 L153 T159 | M151-S155 WeakPolarHBondContact O-CB 3.37Å; M151-S155 PolarHBondContact O-N 3.14Å; L153-S155 PolarHBondContact O-N 2.92Å; S155-T159 VanDerWaalsContact O-CB 3.28Å; S155-T159 WeakPolarHBondContact O-CB 3.46Å; S155-T159 PolarHBondContact O-N 3.06Å; S155-T159 PolarHBondContact O-OG1 3.45Å |
| 156 | R | 76.5 | Confident | 76.4 | Confident | 61 Ų | 61 | 26.6 Ų | 26.6 | 23% | 0.23 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64.1 | -45.5 | -179.1 | -74.7 | 177.5 | -179.9 | 161.1 | 6 | 112.9 | T152 L153 A154 A160 V315 N476 | T152-R156 HydrophobicContact CG2-CG 4.46Å; T152-R156 VanDerWaalsContact CG2-CZ 3.43Å; T152-R156 WeakPolarHBondContact O-CB 3.45Å; T152-R156 VanDerWaalsContact O-CG 3.29Å; T152-R156 WeakPolarHBondContact O-CG 3.4Å; T152-R156 PolarHBondContact O-N 3.29Å; L153-R156 PolarHBondContact O-N 3.23Å; A154-R156 PolarHBondContact O-N 3.44Å; R156-A160 WeakPolarHBondContact O-CB 3.49Å; R156-A160 PolarHBondContact O-N 3.02Å; R156-V315 VanDerWaalsContact CZ-CG2 3.43Å; R156-V315 VanDerWaalsContact NH2-CG1 3.3Å; R156-N476 PolarHBondContact NH2-OD1 3.14Å |
| 157 | L | 80.8 | Confident | 75.7 | Confident | 1 Ų | 1 | 31.1 Ų | 31.1 | 1% | 0.005 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -72 | -38.8 | -179.5 | -73.7 | -174.7 | 0 | 0 | 0 | 111.7 | L153 A154 A160 A161 M175 I237 I240 | L153-L157 HydrophobicContact CD1-CD1 3.53Å; L153-L157 HydrophobicContact CD1-CG 3.81Å; L153-L157 HydrophobicContact CG-CD1 3.97Å; L153-L157 HydrophobicContact CG-CG 4.43Å; L153-L157 WeakPolarHBondContact O-CB 3.37Å; L153-L157 PolarHBondContact O-N 3.49Å; A154-L157 PolarHBondContact O-N 3.08Å; L157-A160 PolarHBondContact O-N 3.26Å; L157-A161 WeakPolarHBondContact O-CB 3.47Å; L157-A161 PolarHBondContact O-N 2.87Å; L157-M175 HydrophobicContact CD2-CG 3.63Å; L157-M175 HydrophobicContact CD2-SD 3.72Å; L157-I237 HydrophobicContact CD1-CG1 3.67Å; L157-I240 HydrophobicContact CB-CD1 3.53Å; L157-I240 HydrophobicContact CB-CG2 4.48Å; L157-I240 HydrophobicContact CD1-CD1 4.14Å; L157-I240 HydrophobicContact CG-CD1 4.49Å |
| 158 | S | 76 | Confident | 76.1 | Confident | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64 | -44.1 | 174.6 | -67.4 | 0 | 0 | 0 | 0 | 111.7 | A154 A160 A161 N162 D251 | A154-S158 WeakPolarHBondContact O-CB 3.34Å; A154-S158 PolarHBondContact O-N 2.67Å; A154-S158 PolarHBondContact O-OG 3.28Å; S158-A160 VanDerWaalsContact C-N 3.34Å; S158-A160 PolarHBondContact O-N 3.37Å; S158-A161 WeakPolarHBondContact O-CB 3.33Å; S158-A161 PolarHBondContact O-N 3.4Å; S158-A161 VanDerWaalsContact O-N 3.14Å; S158-N162 WeakPolarHBondContact O-CB 3.31Å; S158-N162 VanDerWaalsContact O-CG 3.29Å; S158-N162 PolarHBondContact O-N 3.28Å; S158-N162 PolarHBondContact O-ND2 2.89Å; S158-D251 WeakPolarHBondContact CB-OD1 3.25Å; S158-D251 PolarHBondContact OG-OD1 2.78Å |
| 159 | T | 72.5 | Confident | 76 | Confident | 66 Ų | 66 | 38.1 Ų | 38.1 | 41% | 0.405 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -58.2 | -47.1 | 174.8 | -61.2 | 0 | 0 | 0 | 0 | 110.8 | S155 A161 N162 I163 | S155-T159 VanDerWaalsContact O-CB 3.28Å; S155-T159 WeakPolarHBondContact O-CB 3.46Å; S155-T159 PolarHBondContact O-N 3.06Å; S155-T159 PolarHBondContact O-OG1 3.45Å; T159-A161 VanDerWaalsContact C-N 3.35Å; T159-A161 PolarHBondContact O-N 3.03Å; T159-N162 PolarHBondContact O-N 3.02Å; T159-I163 HydrophobicContact CG2-CD1 3.65Å; T159-I163 HydrophobicContact CG2-CG1 4.5Å; T159-I163 VanDerWaalsContact O-CG1 3.26Å; T159-I163 WeakPolarHBondContact O-CG1 3.4Å; T159-I163 PolarHBondContact O-N 3.18Å |
| 160 | A | 75.7 | Confident | 76 | Confident | 8 Ų | 8 | 46.3 Ų | 46.3 | 7% | 0.066 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.3 | -36 | 176 | 0 | 0 | 0 | 0 | 0 | 113.7 | R156 L157 S158 N162 G164 H165 M166 M175 | R156-A160 WeakPolarHBondContact O-CB 3.49Å; R156-A160 PolarHBondContact O-N 3.02Å; L157-A160 PolarHBondContact O-N 3.26Å; S158-A160 VanDerWaalsContact C-N 3.34Å; S158-A160 PolarHBondContact O-N 3.37Å; A160-N162 VanDerWaalsContact C-N 3.35Å; A160-G164 PolarHBondContact O-N 3.11Å; A160-H165 HydrophobicContact CB-CB 4.37Å; A160-H165 PolarHBondContact O-N 2.99Å; A160-M166 HydrophobicContact CB-CG 4.24Å; A160-M166 HydrophobicContact CB-SD 4.08Å; A160-M175 HydrophobicContact CB-CE 3.57Å; A160-M175 HydrophobicContact CB-SD 3.27Å; A160-M175 WeakPolarHBondContact CB-SD 3.5Å |
| 161 | A | 74.7 | Confident | 75.9 | Confident | 4 Ų | 4 | 49.7 Ų | 49.7 | 3% | 0.033 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -65.7 | -39.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | L157 S158 T159 M166 I240 R244 P250 | L157-A161 WeakPolarHBondContact O-CB 3.47Å; L157-A161 PolarHBondContact O-N 2.87Å; S158-A161 WeakPolarHBondContact O-CB 3.33Å; S158-A161 PolarHBondContact O-N 3.4Å; S158-A161 VanDerWaalsContact O-N 3.14Å; T159-A161 VanDerWaalsContact C-N 3.35Å; T159-A161 PolarHBondContact O-N 3.03Å; A161-M166 VanDerWaalsContact CA-SD 3.51Å; A161-M166 HydrophobicContact CB-SD 3.55Å; A161-M166 VanDerWaalsContact CB-SD 3.55Å; A161-M166 PolarHBondContact N-SD 3.19Å; A161-M166 VanDerWaalsContact N-SD 3.38Å; A161-I240 HydrophobicContact CB-CG2 4.17Å; A161-R244 PolarHBondContact O-NE 3.37Å; A161-R244 PolarHBondContact O-NH2 3.26Å; A161-P250 HydrophobicContact CB-CG 4.28Å |
| 162 | N | 72.7 | Confident | 76.2 | Confident | 79 Ų | 79 | 50.6 Ų | 50.6 | 42% | 0.422 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -74.5 | -33.5 | -179.2 | -73 | -19.2 | 0 | 0 | 0 | 112.3 | S158 T159 A160 G164 N249 D251 | S158-N162 WeakPolarHBondContact O-CB 3.31Å; S158-N162 VanDerWaalsContact O-CG 3.29Å; S158-N162 PolarHBondContact O-N 3.28Å; S158-N162 PolarHBondContact O-ND2 2.89Å; T159-N162 PolarHBondContact O-N 3.02Å; A160-N162 VanDerWaalsContact C-N 3.35Å; N162-G164 VanDerWaalsContact C-N 3.3Å; N162-G164 PolarHBondContact O-N 3.45Å; N162-N249 PolarHBondContact ND2-OD1 3.43Å; N162-D251 PolarHBondContact ND2-OD2 3.1Å; N162-D251 VanDerWaalsContact ND2-OD2 3.14Å |
| 163 | I | 73.6 | Confident | 76.5 | Confident | 96 Ų | 96 | 57.3 Ų | 57.3 | 49% | 0.492 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -77.2 | -14.8 | 176.5 | -64.5 | 168 | 0 | 0 | 0 | 112.4 | T159 | T159-I163 HydrophobicContact CG2-CD1 3.65Å; T159-I163 HydrophobicContact CG2-CG1 4.5Å; T159-I163 VanDerWaalsContact O-CG1 3.26Å; T159-I163 WeakPolarHBondContact O-CG1 3.4Å; T159-I163 PolarHBondContact O-N 3.18Å |
| 164 | G | 69.4 | Low | 76.7 | Confident | 17 Ų | 17 | 63.7 Ų | 63.7 | 18% | 0.175 | 32% | 0.316 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 90.3 | 3.9 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | A160 N162 M166 D167 | A160-G164 PolarHBondContact O-N 3.11Å; N162-G164 VanDerWaalsContact C-N 3.3Å; N162-G164 PolarHBondContact O-N 3.45Å; G164-M166 PolarHBondContact O-N 3.31Å; G164-D167 WeakPolarHBondContact O-CB 3.28Å; G164-D167 PolarHBondContact O-N 3.44Å; G164-D167 VanDerWaalsContact O-N 3.12Å; G164-D167 VanDerWaalsContact O-OD2 3.09Å |
| 165 | H | 67.5 | Low | 76.8 | Confident | 112 Ų | 112 | 65.4 Ų | 65.4 | 52% | 0.519 | 33% | 0.325 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.3 | 1.2 | 176 | -72.3 | -172.2 | 0 | 0 | 0 | 114 | A160 M175 | A160-H165 HydrophobicContact CB-CB 4.37Å; A160-H165 PolarHBondContact O-N 2.99Å; H165-M175 HydrophobicContact CB-CE 4.24Å |
| 166 | M | 66.9 | Low | 77.5 | Confident | 9 Ų | 9 | 64.1 Ų | 64.1 | 4% | 0.044 | 31% | 0.314 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -112 | 14.1 | 176.7 | -69.5 | 173.7 | 77.6 | 0 | 0 | 112.7 | A160 A161 G164 L172 M175 I240 R244 | A160-M166 HydrophobicContact CB-CG 4.24Å; A160-M166 HydrophobicContact CB-SD 4.08Å; A161-M166 VanDerWaalsContact CA-SD 3.51Å; A161-M166 HydrophobicContact CB-SD 3.55Å; A161-M166 VanDerWaalsContact CB-SD 3.55Å; A161-M166 PolarHBondContact N-SD 3.19Å; A161-M166 VanDerWaalsContact N-SD 3.38Å; G164-M166 PolarHBondContact O-N 3.31Å; M166-L172 HydrophobicContact CB-CD1 4.14Å; M166-L172 HydrophobicContact CE-CD1 3.12Å; M166-L172 HydrophobicContact CG-CD1 4.09Å; M166-L172 HydrophobicContact SD-CD1 4.38Å; M166-M175 HydrophobicContact CG-SD 4.15Å; M166-M175 HydrophobicContact SD-SD 4.36Å; M166-I240 HydrophobicContact CE-CG2 4.31Å; M166-R244 PolarHBondContact O-NH1 2.94Å |
| 167 | D | 69.8 | Low | 78.1 | Confident | 107 Ų | 107 | 63.6 Ų | 63.6 | 57% | 0.572 | 32% | 0.318 | S | S | * | . | S | Bend | trans | -74.4 | -32.1 | -177.1 | -71.3 | -20 | 0 | 0 | 0 | 113.5 | G164 R244 | G164-D167 WeakPolarHBondContact O-CB 3.28Å; G164-D167 PolarHBondContact O-N 3.44Å; G164-D167 VanDerWaalsContact O-N 3.12Å; G164-D167 VanDerWaalsContact O-OD2 3.09Å; D167-R244 IonicContact OD1-CZ 2.91Å; D167-R244 IonicContact OD1-NH1 2.76Å; D167-R244 PolarHBondContact OD1-NH1 3.14Å; D167-R244 IonicContact OD1-NH2 3.97Å; D167-R244 PolarHBondContact OD1-NH2 2.94Å |
| 168 | T | 79.5 | Confident | 78.6 | Confident | 60 Ų | 60 | 63.6 Ų | 63.6 | 37% | 0.368 | 32% | 0.319 | S | S | . | . | S | Bend | trans | -92.3 | 135.4 | 174.3 | 75.2 | 0 | 0 | 0 | 0 | 111.1 | K170 E171 L172 | T168-K170 PolarHBondContact O-N 3.09Å; T168-K170 VanDerWaalsContact O-N 3.12Å; T168-E171 PolarHBondContact O-N 2.89Å; T168-E171 VanDerWaalsContact O-N 3.13Å; T168-E171 VanDerWaalsContact OG1-CB 3.26Å; T168-E171 WeakPolarHBondContact OG1-CB 3.4Å; T168-E171 WeakPolarHBondContact OG1-CG 3.28Å; T168-E171 PolarHBondContact OG1-N 2.99Å; T168-E171 PolarHBondContact OG1-OE2 2.94Å; T168-L172 WeakPolarHBondContact O-CB 3.47Å; T168-L172 PolarHBondContact O-N 2.66Å |
| 169 | P | 80.5 | Confident | 79.2 | Confident | 95 Ų | 95 | 64.1 Ų | 64.1 | 62% | 0.617 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -55.7 | -33.3 | 177.1 | -27 | 33.9 | 0 | 0 | 0 | 113 | W173 | P169-W173 WeakPolarHBondContact O-CB 3.28Å; P169-W173 PolarHBondContact O-N 2.89Å |
| 170 | K | 83.5 | Confident | 80.1 | Confident | 178 Ų | 178 | 61.5 Ų | 61.5 | 77% | 0.774 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -67.6 | -43.3 | 179.6 | -172.8 | 179.9 | 179.2 | -176.8 | 0 | 111.9 | T168 R174 | T168-K170 PolarHBondContact O-N 3.09Å; T168-K170 VanDerWaalsContact O-N 3.12Å; K170-R174 VanDerWaalsContact O-CB 3.28Å; K170-R174 WeakPolarHBondContact O-CB 3.4Å; K170-R174 PolarHBondContact O-N 3.36Å |
| 171 | E | 81.3 | Confident | 81 | Confident | 74 Ų | 74 | 61.1 Ų | 61.1 | 35% | 0.346 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -70.9 | -41.5 | 178 | -71.4 | 164.7 | 158.5 | 0 | 0 | 111.3 | T168 R174 M175 | T168-E171 PolarHBondContact O-N 2.89Å; T168-E171 VanDerWaalsContact O-N 3.13Å; T168-E171 VanDerWaalsContact OG1-CB 3.26Å; T168-E171 WeakPolarHBondContact OG1-CB 3.4Å; T168-E171 WeakPolarHBondContact OG1-CG 3.28Å; T168-E171 PolarHBondContact OG1-N 2.99Å; T168-E171 PolarHBondContact OG1-OE2 2.94Å; E171-R174 PolarHBondContact O-N 3.26Å; E171-M175 VanDerWaalsContact O-CB 3.3Å; E171-M175 WeakPolarHBondContact O-CB 3.14Å; E171-M175 PolarHBondContact O-N 2.9Å |
| 172 | L | 83.5 | Confident | 81.8 | Confident | 30 Ų | 30 | 61 Ų | 61 | 16% | 0.157 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -53.3 | -56 | 173.2 | 176.1 | 61.1 | 0 | 0 | 0 | 111.4 | M166 T168 R174 M175 I176 I241 | M166-L172 HydrophobicContact CB-CD1 4.14Å; M166-L172 HydrophobicContact CE-CD1 3.12Å; M166-L172 HydrophobicContact CG-CD1 4.09Å; M166-L172 HydrophobicContact SD-CD1 4.38Å; T168-L172 WeakPolarHBondContact O-CB 3.47Å; T168-L172 PolarHBondContact O-N 2.66Å; L172-R174 PolarHBondContact O-N 3.49Å; L172-M175 PolarHBondContact O-N 3.49Å; L172-I176 HydrophobicContact CD1-CD1 3.56Å; L172-I176 HydrophobicContact CD1-CG1 4.19Å; L172-I176 HydrophobicContact CG-CD1 3.71Å; L172-I176 WeakPolarHBondContact O-CB 3.47Å; L172-I176 VanDerWaalsContact O-CG1 3.27Å; L172-I176 WeakPolarHBondContact O-CG1 3.33Å; L172-I176 PolarHBondContact O-N 3.42Å; L172-I241 HydrophobicContact CD1-CD1 4.32Å; L172-I241 HydrophobicContact CD1-CG1 4.38Å; L172-I241 HydrophobicContact CD2-CD1 4.36Å |
| 173 | W | 85.2 | Confident | 82.7 | Confident | 166 Ų | 166 | 57.5 Ų | 57.5 | 63% | 0.629 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -64 | -40.8 | 179.7 | -81 | 112.9 | 0 | 0 | 0 | 112.4 | P169 M175 I176 T177 | P169-W173 WeakPolarHBondContact O-CB 3.28Å; P169-W173 PolarHBondContact O-N 2.89Å; W173-M175 VanDerWaalsContact C-N 3.3Å; W173-M175 PolarHBondContact O-N 3.28Å; W173-I176 HydrophobicContact CE3-CG2 4.46Å; W173-I176 PolarHBondContact O-N 2.86Å; W173-T177 VanDerWaalsContact O-CB 3.25Å; W173-T177 WeakPolarHBondContact O-CB 3.33Å; W173-T177 PolarHBondContact O-N 3.04Å; W173-T177 PolarHBondContact O-OG1 3.43Å |
| 174 | R | 85.7 | Confident | 83.7 | Confident | 136 Ų | 136 | 53 Ų | 53 | 51% | 0.513 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -60.2 | -42.2 | 176.5 | -178.7 | 176.9 | 64.3 | 179.9 | -2.4 | 111.6 | K170 E171 L172 G178 | K170-R174 VanDerWaalsContact O-CB 3.28Å; K170-R174 WeakPolarHBondContact O-CB 3.4Å; K170-R174 PolarHBondContact O-N 3.36Å; E171-R174 PolarHBondContact O-N 3.26Å; L172-R174 PolarHBondContact O-N 3.49Å; R174-G178 PolarHBondContact O-N 3.32Å |
| 175 | M | 83.9 | Confident | 84.9 | Confident | 37 Ų | 37 | 52.3 Ų | 52.3 | 18% | 0.182 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -71.1 | -44.6 | -179.7 | -172.2 | 178.4 | -68.9 | 0 | 0 | 111.8 | L157 A160 H165 M166 E171 L172 W173 G178 N179 | L157-M175 HydrophobicContact CD2-CG 3.63Å; L157-M175 HydrophobicContact CD2-SD 3.72Å; A160-M175 HydrophobicContact CB-CE 3.57Å; A160-M175 HydrophobicContact CB-SD 3.27Å; A160-M175 WeakPolarHBondContact CB-SD 3.5Å; H165-M175 HydrophobicContact CB-CE 4.24Å; M166-M175 HydrophobicContact CG-SD 4.15Å; M166-M175 HydrophobicContact SD-SD 4.36Å; E171-M175 VanDerWaalsContact O-CB 3.3Å; E171-M175 WeakPolarHBondContact O-CB 3.14Å; E171-M175 PolarHBondContact O-N 2.9Å; L172-M175 PolarHBondContact O-N 3.49Å; W173-M175 VanDerWaalsContact C-N 3.3Å; W173-M175 PolarHBondContact O-N 3.28Å; M175-G178 PolarHBondContact O-N 2.99Å; M175-N179 WeakPolarHBondContact CG-ND2 3.27Å; M175-N179 WeakPolarHBondContact O-CB 3.48Å; M175-N179 PolarHBondContact O-N 3.45Å; M175-N179 PolarHBondContact O-ND2 3.3Å |
| 176 | I | 87.7 | Confident | 86.2 | Confident | 10 Ų | 10 | 47.5 Ų | 47.5 | 5% | 0.051 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -57.4 | -54.2 | 174.5 | -75.6 | 165.6 | 0 | 0 | 0 | 110.1 | L172 W173 G178 N179 M180 I237 I241 | L172-I176 HydrophobicContact CD1-CD1 3.56Å; L172-I176 HydrophobicContact CD1-CG1 4.19Å; L172-I176 HydrophobicContact CG-CD1 3.71Å; L172-I176 WeakPolarHBondContact O-CB 3.47Å; L172-I176 VanDerWaalsContact O-CG1 3.27Å; L172-I176 WeakPolarHBondContact O-CG1 3.33Å; L172-I176 PolarHBondContact O-N 3.42Å; W173-I176 HydrophobicContact CE3-CG2 4.46Å; W173-I176 PolarHBondContact O-N 2.86Å; I176-G178 VanDerWaalsContact C-N 3.33Å; I176-G178 PolarHBondContact O-N 3.23Å; I176-N179 PolarHBondContact O-N 3.29Å; I176-M180 WeakPolarHBondContact O-CB 3.3Å; I176-M180 PolarHBondContact O-N 3.06Å; I176-I237 HydrophobicContact CB-CD1 4.41Å; I176-I237 HydrophobicContact CD1-CG2 3.62Å; I176-I237 HydrophobicContact CG1-CD1 4.38Å; I176-I237 HydrophobicContact CG1-CG1 4.31Å; I176-I237 HydrophobicContact CG1-CG2 3.81Å; I176-I237 HydrophobicContact CG2-CD1 3.61Å; I176-I237 HydrophobicContact CG2-CG1 4.42Å; I176-I237 HydrophobicContact CG2-CG2 4.34Å; I176-I241 HydrophobicContact CD1-CD1 3.95Å |
| 177 | T | 90.5 | Very high | 87.5 | Confident | 50 Ų | 50 | 47.1 Ų | 47.1 | 31% | 0.307 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -65.1 | -38.4 | -176.4 | -59.7 | 0 | 0 | 0 | 0 | 111.7 | W173 A181 L305 | W173-T177 VanDerWaalsContact O-CB 3.25Å; W173-T177 WeakPolarHBondContact O-CB 3.33Å; W173-T177 PolarHBondContact O-N 3.04Å; W173-T177 PolarHBondContact O-OG1 3.43Å; T177-A181 WeakPolarHBondContact O-CB 3.48Å; T177-A181 PolarHBondContact O-N 3.41Å; T177-L305 HydrophobicContact CG2-CD1 3.57Å; T177-L305 HydrophobicContact CG2-CD2 3.54Å; T177-L305 HydrophobicContact CG2-CG 3.64Å |
| 178 | G | 90.4 | Very high | 88.7 | Confident | 2 Ų | 2 | 42.1 Ų | 42.1 | 2% | 0.021 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -65.2 | -48.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113 | R174 M175 I176 A181 L182 T312 | R174-G178 PolarHBondContact O-N 3.32Å; M175-G178 PolarHBondContact O-N 2.99Å; I176-G178 VanDerWaalsContact C-N 3.33Å; I176-G178 PolarHBondContact O-N 3.23Å; G178-A181 PolarHBondContact O-N 2.86Å; G178-L182 WeakPolarHBondContact O-CB 3.26Å; G178-L182 PolarHBondContact O-N 3.31Å; G178-T312 WeakPolarHBondContact O-CG2 3.32Å |
| 179 | N | 88.9 | Confident | 89.4 | Confident | 10 Ų | 10 | 41.1 Ų | 41.1 | 5% | 0.053 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -70.2 | -40.5 | 179.9 | -77.4 | -77.8 | 0 | 0 | 0 | 112.2 | L153 M175 I176 A181 L182 I183 T312 | L153-N179 HydrophobicContact CD1-CB 3.51Å; M175-N179 WeakPolarHBondContact CG-ND2 3.27Å; M175-N179 WeakPolarHBondContact O-CB 3.48Å; M175-N179 PolarHBondContact O-N 3.45Å; M175-N179 PolarHBondContact O-ND2 3.3Å; I176-N179 PolarHBondContact O-N 3.29Å; N179-A181 VanDerWaalsContact C-N 3.32Å; N179-A181 PolarHBondContact O-N 3.1Å; N179-L182 PolarHBondContact O-N 3.09Å; N179-I183 WeakPolarHBondContact O-CG1 3.27Å; N179-I183 PolarHBondContact O-N 3.48Å; N179-T312 HydrophobicContact CB-CG2 4.35Å |
| 180 | M | 91.9 | Very high | 90.1 | Very high | 12 Ų | 12 | 36.6 Ų | 36.6 | 6% | 0.059 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -58.6 | -46.7 | 173.1 | -178.6 | 59.1 | 70.5 | 0 | 0 | 110.6 | I176 L182 I183 Q184 L230 M234 I237 | I176-M180 WeakPolarHBondContact O-CB 3.3Å; I176-M180 PolarHBondContact O-N 3.06Å; M180-L182 PolarHBondContact O-N 3.23Å; M180-I183 PolarHBondContact O-N 3.46Å; M180-Q184 WeakPolarHBondContact O-CG 3.48Å; M180-Q184 PolarHBondContact O-N 3.36Å; M180-Q184 HydrophobicContact SD-CG 4.48Å; M180-L230 HydrophobicContact CG-CD1 4.38Å; M180-L230 HydrophobicContact SD-CD1 3.8Å; M180-M234 HydrophobicContact CE-CG 3.84Å; M180-M234 HydrophobicContact CE-SD 3.78Å; M180-I237 HydrophobicContact CE-CD1 3.64Å |
| 181 | A | 93.8 | Very high | 90.6 | Very high | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -62.2 | -42.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | T177 G178 N179 I183 Q184 V185 W302 L305 A306 | T177-A181 WeakPolarHBondContact O-CB 3.48Å; T177-A181 PolarHBondContact O-N 3.41Å; G178-A181 PolarHBondContact O-N 2.86Å; N179-A181 VanDerWaalsContact C-N 3.32Å; N179-A181 PolarHBondContact O-N 3.1Å; A181-I183 VanDerWaalsContact C-N 3.33Å; A181-I183 PolarHBondContact O-N 3.36Å; A181-Q184 PolarHBondContact O-N 3.05Å; A181-V185 WeakPolarHBondContact O-CG2 3.35Å; A181-V185 PolarHBondContact O-N 3.38Å; A181-W302 HydrophobicContact CB-CE3 3.74Å; A181-W302 HydrophobicContact CB-CZ3 4.36Å; A181-L305 HydrophobicContact CB-CB 3.75Å; A181-L305 HydrophobicContact CB-CD2 3.97Å; A181-L305 HydrophobicContact CB-CG 3.76Å; A181-A306 HydrophobicContact CB-CB 3.99Å |
| 182 | L | 92 | Very high | 91.3 | Very high | 1 Ų | 1 | 28.8 Ų | 28.8 | 1% | 0.005 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -58.4 | -46.6 | 176.5 | 175.4 | 64.7 | 0 | 0 | 0 | 111.3 | G178 N179 M180 V185 Q186 A306 T312 V315 L316 | G178-L182 WeakPolarHBondContact O-CB 3.26Å; G178-L182 PolarHBondContact O-N 3.31Å; N179-L182 PolarHBondContact O-N 3.09Å; M180-L182 PolarHBondContact O-N 3.23Å; L182-V185 WeakPolarHBondContact O-CB 3.4Å; L182-V185 PolarHBondContact O-N 2.67Å; L182-Q186 HydrophobicContact CD1-CG 4.4Å; L182-Q186 WeakPolarHBondContact O-CG 2.93Å; L182-Q186 PolarHBondContact O-N 2.93Å; L182-A306 HydrophobicContact CB-CB 4.27Å; L182-T312 HydrophobicContact CB-CG2 4.24Å; L182-T312 HydrophobicContact CD2-CG2 4.09Å; L182-V315 HydrophobicContact CD2-CB 3.82Å; L182-V315 HydrophobicContact CD2-CG1 3.77Å; L182-L316 HydrophobicContact CD1-CB 3.91Å; L182-L316 HydrophobicContact CD1-CD1 3.99Å |
| 183 | I | 92 | Very high | 91.9 | Very high | 6 Ų | 6 | 29.9 Ų | 29.9 | 3% | 0.031 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -63.6 | -42.9 | 178.5 | -71.6 | 166.4 | 0 | 0 | 0 | 111.1 | L149 L153 N179 M180 A181 V185 Q186 A187 | L149-I183 HydrophobicContact CB-CG2 4.37Å; L149-I183 HydrophobicContact CD1-CG2 4.31Å; L153-I183 HydrophobicContact CB-CD1 3.56Å; L153-I183 HydrophobicContact CD1-CD1 3.7Å; L153-I183 HydrophobicContact CD2-CD1 3.52Å; L153-I183 HydrophobicContact CG-CD1 3.74Å; N179-I183 WeakPolarHBondContact O-CG1 3.27Å; N179-I183 PolarHBondContact O-N 3.48Å; M180-I183 PolarHBondContact O-N 3.46Å; A181-I183 VanDerWaalsContact C-N 3.33Å; A181-I183 PolarHBondContact O-N 3.36Å; I183-V185 VanDerWaalsContact C-N 3.27Å; I183-V185 PolarHBondContact O-N 3.03Å; I183-Q186 PolarHBondContact O-N 2.82Å; I183-A187 WeakPolarHBondContact O-CB 3.35Å; I183-A187 PolarHBondContact O-N 3.41Å |
| 184 | Q | 94.7 | Very high | 92.4 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60 | -39.1 | 176.5 | -68.8 | -51.5 | -48.9 | 0 | 0 | 112 | M180 A181 T188 F226 S229 W302 | M180-Q184 WeakPolarHBondContact O-CG 3.48Å; M180-Q184 PolarHBondContact O-N 3.36Å; M180-Q184 HydrophobicContact SD-CG 4.48Å; A181-Q184 PolarHBondContact O-N 3.05Å; Q184-T188 WeakPolarHBondContact O-CB 3.36Å; Q184-T188 PolarHBondContact O-N 3.42Å; Q184-T188 PolarHBondContact O-OG1 2.89Å; Q184-F226 HydrophobicContact CB-CE2 4.39Å; Q184-F226 VanDerWaalsContact OE1-CG 3.3Å; Q184-F226 PolarHBondContact OE1-O 3.12Å; Q184-S229 PolarHBondContact NE2-OG 2.79Å; Q184-S229 VanDerWaalsContact NE2-OG 3.1Å; Q184-W302 HydrophobicContact CB-CB 4.29Å; Q184-W302 HydrophobicContact CB-CD2 3.69Å; Q184-W302 HydrophobicContact CB-CE3 4.16Å; Q184-W302 HydrophobicContact CB-CG 3.75Å; Q184-W302 HydrophobicContact CB-CZ2 4.49Å; Q184-W302 HydrophobicContact CG-CD2 4.02Å; Q184-W302 HydrophobicContact CG-CE3 4.21Å; Q184-W302 HydrophobicContact CG-CH2 4.18Å; Q184-W302 HydrophobicContact CG-CZ2 4.01Å; Q184-W302 HydrophobicContact CG-CZ3 4.28Å |
| 185 | V | 94.5 | Very high | 92.9 | Very high | 3 Ų | 3 | 15.7 Ų | 15.7 | 2% | 0.018 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -63.3 | -51.1 | 173.7 | 175.5 | 0 | 0 | 0 | 0 | 110.8 | A181 L182 I183 T188 V189 W302 V303 L316 W320 | A181-V185 WeakPolarHBondContact O-CG2 3.35Å; A181-V185 PolarHBondContact O-N 3.38Å; L182-V185 WeakPolarHBondContact O-CB 3.4Å; L182-V185 PolarHBondContact O-N 2.67Å; I183-V185 VanDerWaalsContact C-N 3.27Å; I183-V185 PolarHBondContact O-N 3.03Å; V185-T188 PolarHBondContact O-N 3.07Å; V185-V189 WeakPolarHBondContact O-CG2 2.99Å; V185-V189 PolarHBondContact O-N 3.48Å; V185-V189 VanDerWaalsContact O-N 3.08Å; V185-W302 HydrophobicContact CG2-CB 3.48Å; V185-W302 VanDerWaalsContact CG2-CB 3.48Å; V185-V303 HydrophobicContact CG1-CG2 3.95Å; V185-V303 HydrophobicContact CG2-CB 4.42Å; V185-V303 HydrophobicContact CG2-CG2 3.68Å; V185-L316 HydrophobicContact CB-CD1 4.48Å; V185-L316 HydrophobicContact CG1-CD1 3.92Å; V185-W320 HydrophobicContact CG1-CH2 3.87Å; V185-W320 HydrophobicContact CG1-CZ2 4.06Å |
| 186 | Q | 93.6 | Very high | 93.4 | Very high | 11 Ų | 11 | 17.6 Ų | 17.6 | 5% | 0.051 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -64 | -44.2 | -178.2 | -69.7 | 179.8 | -59 | 0 | 0 | 111.7 | L149 L182 I183 T188 V189 V190 W320 | L149-Q186 HydrophobicContact CD1-CB 4Å; L149-Q186 HydrophobicContact CD2-CB 3.64Å; L149-Q186 HydrophobicContact CD2-CG 4.29Å; L182-Q186 HydrophobicContact CD1-CG 4.4Å; L182-Q186 WeakPolarHBondContact O-CG 2.93Å; L182-Q186 PolarHBondContact O-N 2.93Å; I183-Q186 PolarHBondContact O-N 2.82Å; Q186-T188 PolarHBondContact O-N 3.28Å; Q186-V189 PolarHBondContact O-N 3.06Å; Q186-V190 WeakPolarHBondContact O-CB 3.3Å; Q186-V190 WeakPolarHBondContact O-CG2 3.34Å; Q186-V190 PolarHBondContact O-N 2.74Å; Q186-W320 HydrophobicContact CG-CH2 4.22Å; Q186-W320 HydrophobicContact CG-CZ3 4.28Å |
| 187 | A | 94.3 | Very high | 93.8 | Very high | 1 Ų | 1 | 17.9 Ų | 17.9 | 1% | 0.008 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -62.5 | -43.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L149 I183 G191 A225 S229 | L149-A187 HydrophobicContact CD1-CB 3.91Å; I183-A187 WeakPolarHBondContact O-CB 3.35Å; I183-A187 PolarHBondContact O-N 3.41Å; A187-G191 WeakPolarHBondContact O-CA 3.26Å; A187-G191 PolarHBondContact O-N 3.38Å; A187-A225 HydrophobicContact CB-CB 4.23Å; A187-A225 WeakPolarHBondContact CB-O 3.5Å; A187-A225 VanDerWaalsContact O-CB 3.27Å; A187-A225 WeakPolarHBondContact O-CB 3.43Å; A187-S229 VanDerWaalsContact CB-OG 3.26Å; A187-S229 WeakPolarHBondContact CB-OG 3.32Å |
| 188 | T | 94.9 | Very high | 94 | Very high | 2 Ų | 2 | 15.5 Ų | 15.5 | 1% | 0.012 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -63.9 | -49.4 | 177.7 | -53.9 | 0 | 0 | 0 | 0 | 111.4 | Q184 V185 Q186 F192 V222 F226 L299 | Q184-T188 WeakPolarHBondContact O-CB 3.36Å; Q184-T188 PolarHBondContact O-N 3.42Å; Q184-T188 PolarHBondContact O-OG1 2.89Å; V185-T188 PolarHBondContact O-N 3.07Å; Q186-T188 PolarHBondContact O-N 3.28Å; T188-F192 WeakPolarHBondContact O-CB 3.39Å; T188-F192 PolarHBondContact O-N 3.16Å; T188-V222 HydrophobicContact CG2-CG1 3.93Å; T188-F226 WeakPolarHBondContact OG1-CD2 3.49Å; T188-L299 HydrophobicContact CG2-CD1 4.23Å |
| 189 | V | 94.8 | Very high | 94.2 | Very high | 39 Ų | 39 | 16.6 Ų | 16.6 | 24% | 0.236 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -67.5 | -47.2 | -177.6 | 173.1 | 0 | 0 | 0 | 0 | 110.8 | V185 Q186 F192 L193 L299 W320 | V185-V189 WeakPolarHBondContact O-CG2 2.99Å; V185-V189 PolarHBondContact O-N 3.48Å; V185-V189 VanDerWaalsContact O-N 3.08Å; Q186-V189 PolarHBondContact O-N 3.06Å; V189-F192 WeakPolarHBondContact O-CB 3.35Å; V189-F192 PolarHBondContact O-N 3.5Å; V189-L193 HydrophobicContact CG1-CD1 4.14Å; V189-L193 WeakPolarHBondContact O-CG 3.32Å; V189-L193 PolarHBondContact O-N 3.33Å; V189-L299 HydrophobicContact CG2-CD1 3.61Å; V189-W320 HydrophobicContact CB-CH2 3.96Å; V189-W320 HydrophobicContact CB-CZ3 3.81Å; V189-W320 HydrophobicContact CG1-CH2 4.11Å; V189-W320 HydrophobicContact CG1-CZ3 3.67Å; V189-W320 HydrophobicContact CG2-CH2 3.96Å; V189-W320 HydrophobicContact CG2-CZ3 4.32Å |
| 190 | V | 94.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 19.1 Ų | 19.1 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -74 | -33.9 | -176.4 | -176.1 | 0 | 0 | 0 | 0 | 110.8 | L145 Q186 F192 L193 A194 W320 V323 M327 | L145-V190 HydrophobicContact CD1-CB 3.73Å; L145-V190 HydrophobicContact CD1-CG1 3.5Å; L145-V190 VanDerWaalsContact CD1-CG1 3.5Å; L145-V190 HydrophobicContact CD1-CG2 4.22Å; L145-V190 HydrophobicContact CD2-CB 3.98Å; L145-V190 HydrophobicContact CD2-CG1 3.96Å; L145-V190 HydrophobicContact CG-CG1 4.27Å; Q186-V190 WeakPolarHBondContact O-CB 3.3Å; Q186-V190 WeakPolarHBondContact O-CG2 3.34Å; Q186-V190 PolarHBondContact O-N 2.74Å; V190-F192 VanDerWaalsContact C-N 3.33Å; V190-F192 PolarHBondContact O-N 2.82Å; V190-L193 PolarHBondContact O-N 2.97Å; V190-A194 VanDerWaalsContact O-CB 3.27Å; V190-A194 WeakPolarHBondContact O-CB 3.41Å; V190-A194 PolarHBondContact O-N 3.29Å; V190-W320 HydrophobicContact CG2-CZ3 4.42Å; V190-V323 HydrophobicContact CB-CG1 4.48Å; V190-V323 HydrophobicContact CG1-CG1 4.29Å; V190-V323 HydrophobicContact CG2-CG1 3.62Å; V190-M327 HydrophobicContact CG1-CB 3.75Å; V190-M327 HydrophobicContact CG1-CG 3.68Å |
| 191 | G | 95.6 | Very high | 94.6 | Very high | 0 Ų | 0 | 20.8 Ų | 20.8 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -59.8 | -42.6 | 169 | 0 | 0 | 0 | 0 | 0 | 112.1 | A187 A194 S195 S221 | A187-G191 WeakPolarHBondContact O-CA 3.26Å; A187-G191 PolarHBondContact O-N 3.38Å; G191-A194 PolarHBondContact O-N 3.04Å; G191-S195 PolarHBondContact O-N 3.41Å; G191-S221 VanDerWaalsContact C-OG 3.27Å; G191-S221 WeakPolarHBondContact CA-OG 3.5Å; G191-S221 WeakPolarHBondContact O-CB 3.42Å; G191-S221 PolarHBondContact O-OG 2.84Å |
| 192 | F | 95.5 | Very high | 94.4 | Very high | 88 Ų | 88 | 20.9 Ų | 20.9 | 39% | 0.386 | 11% | 0.112 | S | C | . | . | H | α-helix | trans | -61.2 | -48.4 | 173.3 | 177.1 | -104.5 | 0 | 0 | 0 | 111.7 | T188 V189 V190 A194 S195 I196 C218 V222 | T188-F192 WeakPolarHBondContact O-CB 3.39Å; T188-F192 PolarHBondContact O-N 3.16Å; V189-F192 WeakPolarHBondContact O-CB 3.35Å; V189-F192 PolarHBondContact O-N 3.5Å; V190-F192 VanDerWaalsContact C-N 3.33Å; V190-F192 PolarHBondContact O-N 2.82Å; F192-A194 VanDerWaalsContact C-N 3.33Å; F192-A194 PolarHBondContact O-N 3.2Å; F192-S195 PolarHBondContact O-N 2.98Å; F192-S195 PolarHBondContact O-OG 3.24Å; F192-I196 HydrophobicContact CD1-CD1 3.97Å; F192-I196 HydrophobicContact CE1-CD1 3.39Å; F192-I196 HydrophobicContact CE1-CG1 4.41Å; F192-I196 HydrophobicContact CE2-CD1 4.45Å; F192-I196 HydrophobicContact CZ-CD1 3.67Å; F192-I196 HydrophobicContact CZ-CG1 4.39Å; F192-I196 PolarHBondContact O-N 3.26Å; F192-I196 VanDerWaalsContact O-N 3.16Å; F192-C218 VanDerWaalsContact CD2-SG 3.57Å; F192-V222 HydrophobicContact CB-CG2 3.83Å; F192-V222 HydrophobicContact CD2-CG2 4.49Å |
| 193 | L | 95.7 | Very high | 94.4 | Very high | 53 Ų | 53 | 27.1 Ų | 27.1 | 28% | 0.277 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -63.3 | -37.7 | 178.1 | -67.3 | 175.3 | 0 | 0 | 0 | 112.6 | V189 V190 S195 I196 A197 I324 M327 | V189-L193 HydrophobicContact CG1-CD1 4.14Å; V189-L193 WeakPolarHBondContact O-CG 3.32Å; V189-L193 PolarHBondContact O-N 3.33Å; V190-L193 PolarHBondContact O-N 2.97Å; L193-S195 VanDerWaalsContact C-N 3.3Å; L193-S195 PolarHBondContact O-N 3.04Å; L193-I196 PolarHBondContact O-N 3.47Å; L193-A197 PolarHBondContact O-N 3.42Å; L193-I324 HydrophobicContact CD1-CD1 4.15Å; L193-I324 HydrophobicContact CD1-CG1 4.04Å; L193-M327 HydrophobicContact CB-CE 3.5Å; L193-M327 VanDerWaalsContact CB-CE 3.5Å |
| 194 | A | 96.1 | Very high | 94.3 | Very high | 1 Ų | 1 | 32.1 Ų | 32.1 | 1% | 0.008 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63 | -36.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | L138 A141 V190 G191 F192 A197 A198 M327 | L138-A194 HydrophobicContact CD1-CB 3.72Å; A141-A194 HydrophobicContact CB-CB 4.16Å; V190-A194 VanDerWaalsContact O-CB 3.27Å; V190-A194 WeakPolarHBondContact O-CB 3.41Å; V190-A194 PolarHBondContact O-N 3.29Å; G191-A194 PolarHBondContact O-N 3.04Å; F192-A194 VanDerWaalsContact C-N 3.33Å; F192-A194 PolarHBondContact O-N 3.2Å; A194-A197 PolarHBondContact O-N 2.82Å; A194-A198 WeakPolarHBondContact O-CB 3.35Å; A194-A198 PolarHBondContact O-N 3.35Å; A194-M327 VanDerWaalsContact CA-SD 3.57Å; A194-M327 HydrophobicContact CB-CG 3.93Å; A194-M327 HydrophobicContact CB-SD 3.9Å |
| 195 | S | 95.9 | Very high | 93.9 | Very high | 4 Ų | 4 | 35.2 Ų | 35.2 | 3% | 0.028 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -66.9 | -38.3 | 174.1 | 76.1 | 0 | 0 | 0 | 0 | 112.5 | G191 F192 L193 A198 V199 C218 | G191-S195 PolarHBondContact O-N 3.41Å; F192-S195 PolarHBondContact O-N 2.98Å; F192-S195 PolarHBondContact O-OG 3.24Å; L193-S195 VanDerWaalsContact C-N 3.3Å; L193-S195 PolarHBondContact O-N 3.04Å; S195-A198 PolarHBondContact O-N 2.92Å; S195-V199 VanDerWaalsContact O-CG2 3.27Å; S195-V199 WeakPolarHBondContact O-CG2 3.37Å; S195-V199 PolarHBondContact O-N 3.39Å; S195-C218 WeakPolarHBondContact OG-CA 3.22Å |
| 196 | I | 95.4 | Very high | 93.2 | Very high | 76 Ų | 76 | 38.8 Ų | 38.8 | 39% | 0.39 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -64.1 | -46 | 173.7 | -66.2 | 171.4 | 0 | 0 | 0 | 109.7 | F192 L193 A198 V199 V200 | F192-I196 HydrophobicContact CD1-CD1 3.97Å; F192-I196 HydrophobicContact CE1-CD1 3.39Å; F192-I196 HydrophobicContact CE1-CG1 4.41Å; F192-I196 HydrophobicContact CE2-CD1 4.45Å; F192-I196 HydrophobicContact CZ-CD1 3.67Å; F192-I196 HydrophobicContact CZ-CG1 4.39Å; F192-I196 PolarHBondContact O-N 3.26Å; F192-I196 VanDerWaalsContact O-N 3.16Å; L193-I196 PolarHBondContact O-N 3.47Å; I196-A198 VanDerWaalsContact C-N 3.33Å; I196-A198 PolarHBondContact O-N 3.43Å; I196-V199 PolarHBondContact O-N 2.91Å; I196-V200 HydrophobicContact CG2-CG2 4.25Å; I196-V200 WeakPolarHBondContact O-CB 3.4Å; I196-V200 VanDerWaalsContact O-CG2 3.3Å; I196-V200 WeakPolarHBondContact O-CG2 3.32Å; I196-V200 PolarHBondContact O-N 3.2Å |
| 197 | A | 95.2 | Very high | 92.7 | Very high | 17 Ų | 17 | 40.6 Ų | 40.6 | 14% | 0.14 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -59 | -44.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | L193 A194 V199 V200 F201 M327 | L193-A197 PolarHBondContact O-N 3.42Å; A194-A197 PolarHBondContact O-N 2.82Å; A197-V199 PolarHBondContact O-N 3.21Å; A197-V200 PolarHBondContact O-N 3.2Å; A197-F201 VanDerWaalsContact O-CB 3.29Å; A197-F201 WeakPolarHBondContact O-CB 3.24Å; A197-F201 VanDerWaalsContact O-CG 3.31Å; A197-F201 WeakPolarHBondContact O-CG 3.4Å; A197-F201 PolarHBondContact O-N 2.76Å; A197-M327 HydrophobicContact CB-SD 4.19Å |
| 198 | A | 95.4 | Very high | 92.1 | Very high | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.4 | -45 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | I137 L138 A194 S195 I196 F201 G202 | I137-A198 HydrophobicContact CB-CB 4.15Å; I137-A198 HydrophobicContact CG2-CB 4.15Å; L138-A198 HydrophobicContact CB-CB 4.44Å; A194-A198 WeakPolarHBondContact O-CB 3.35Å; A194-A198 PolarHBondContact O-N 3.35Å; S195-A198 PolarHBondContact O-N 2.92Å; I196-A198 VanDerWaalsContact C-N 3.33Å; I196-A198 PolarHBondContact O-N 3.43Å; A198-F201 PolarHBondContact O-N 3.45Å; A198-G202 PolarHBondContact O-N 3.29Å |
| 199 | V | 94.7 | Very high | 91.7 | Very high | 24 Ų | 24 | 53.9 Ų | 53.9 | 15% | 0.145 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.4 | -43.9 | 176.7 | 171.3 | 0 | 0 | 0 | 0 | 111.7 | S195 I196 A197 W203 F209 A214 L217 | S195-V199 VanDerWaalsContact O-CG2 3.27Å; S195-V199 WeakPolarHBondContact O-CG2 3.37Å; S195-V199 PolarHBondContact O-N 3.39Å; I196-V199 PolarHBondContact O-N 2.91Å; A197-V199 PolarHBondContact O-N 3.21Å; V199-W203 VanDerWaalsContact O-CB 3.26Å; V199-W203 WeakPolarHBondContact O-CB 3.26Å; V199-W203 PolarHBondContact O-N 2.92Å; V199-F209 HydrophobicContact CG1-CD2 4.06Å; V199-F209 HydrophobicContact CG1-CE2 3.45Å; V199-F209 VanDerWaalsContact CG1-CE2 3.45Å; V199-F209 HydrophobicContact CG1-CZ 4.38Å; V199-A214 HydrophobicContact CG1-CB 4.24Å; V199-A214 HydrophobicContact CG2-CB 3.78Å; V199-L217 HydrophobicContact CG2-CD1 3.65Å |
| 200 | V | 94.6 | Very high | 91.3 | Very high | 64 Ų | 64 | 54 Ų | 54 | 39% | 0.388 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -66.3 | -45.2 | 179.3 | 170.9 | 0 | 0 | 0 | 0 | 110.7 | I196 A197 W203 I204 | I196-V200 HydrophobicContact CG2-CG2 4.25Å; I196-V200 WeakPolarHBondContact O-CB 3.4Å; I196-V200 VanDerWaalsContact O-CG2 3.3Å; I196-V200 WeakPolarHBondContact O-CG2 3.32Å; I196-V200 PolarHBondContact O-N 3.2Å; A197-V200 PolarHBondContact O-N 3.2Å; V200-W203 PolarHBondContact O-N 2.85Å; V200-I204 HydrophobicContact CG1-CD1 3.97Å; V200-I204 VanDerWaalsContact O-CG1 3.31Å; V200-I204 WeakPolarHBondContact O-CG1 3.38Å; V200-I204 PolarHBondContact O-N 3.18Å; V200-I204 VanDerWaalsContact O-N 3.1Å |
| 201 | F | 93.4 | Very high | 91.1 | Very high | 47 Ų | 47 | 58.8 Ų | 58.8 | 21% | 0.206 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -72.4 | -30 | -179.6 | -68.9 | -20.4 | 0 | 0 | 0 | 113.4 | I137 A197 A198 I204 P205 S331 V332 L335 | I137-F201 HydrophobicContact CD1-CB 4.18Å; I137-F201 HydrophobicContact CG2-CB 4.19Å; I137-F201 HydrophobicContact CG2-CD2 4.28Å; A197-F201 VanDerWaalsContact O-CB 3.29Å; A197-F201 WeakPolarHBondContact O-CB 3.24Å; A197-F201 VanDerWaalsContact O-CG 3.31Å; A197-F201 WeakPolarHBondContact O-CG 3.4Å; A197-F201 PolarHBondContact O-N 2.76Å; A198-F201 PolarHBondContact O-N 3.45Å; F201-I204 HydrophobicContact CD1-CD1 4.17Å; F201-P205 WeakPolarHBondContact O-CD 3.46Å; F201-S331 VanDerWaalsContact CE2-CB 3.48Å; F201-V332 HydrophobicContact CE2-CG2 4.02Å; F201-V332 HydrophobicContact CZ-CG2 4.04Å; F201-L335 HydrophobicContact CB-CD1 4.29Å; F201-L335 HydrophobicContact CB-CD2 4.38Å; F201-L335 WeakPolarHBondContact O-CD1 3.45Å |
| 202 | G | 90.7 | Very high | 90.8 | Very high | 2 Ų | 2 | 61.9 Ų | 61.9 | 2% | 0.021 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -70.7 | -36.2 | 169 | 0 | 0 | 0 | 0 | 0 | 112.4 | A198 P205 | A198-G202 PolarHBondContact O-N 3.29Å; G202-P205 WeakPolarHBondContact O-CD 3.33Å |
| 203 | W | 91.8 | Very high | 90.6 | Very high | 132 Ų | 132 | 60 Ų | 60 | 50% | 0.5 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -69.3 | -35.4 | 179.1 | 176.1 | 60.3 | 0 | 0 | 0 | 113.7 | V199 V200 G207 | V199-W203 VanDerWaalsContact O-CB 3.26Å; V199-W203 WeakPolarHBondContact O-CB 3.26Å; V199-W203 PolarHBondContact O-N 2.92Å; V200-W203 PolarHBondContact O-N 2.85Å; W203-G207 PolarHBondContact NE1-O 2.88Å; W203-G207 VanDerWaalsContact O-CA 3.28Å; W203-G207 WeakPolarHBondContact O-CA 3.38Å; W203-G207 PolarHBondContact O-N 2.76Å |
| 204 | I | 89.8 | Confident | 90.5 | Very high | 111 Ų | 111 | 58.5 Ų | 58.5 | 57% | 0.569 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -60.4 | -48.8 | -175.1 | -73.7 | 162.8 | 0 | 0 | 0 | 113 | V200 F201 | V200-I204 HydrophobicContact CG1-CD1 3.97Å; V200-I204 VanDerWaalsContact O-CG1 3.31Å; V200-I204 WeakPolarHBondContact O-CG1 3.38Å; V200-I204 PolarHBondContact O-N 3.18Å; V200-I204 VanDerWaalsContact O-N 3.1Å; F201-I204 HydrophobicContact CD1-CD1 4.17Å |
| 205 | P | 85.2 | Confident | 90.4 | Very high | 65 Ų | 65 | 63 Ų | 63 | 42% | 0.422 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -77.5 | -40.7 | 179 | -15.9 | 30 | 0 | 0 | 0 | 113.7 | F201 G202 L335 | F201-P205 WeakPolarHBondContact O-CD 3.46Å; G202-P205 WeakPolarHBondContact O-CD 3.33Å; P205-L335 HydrophobicContact CG-CD1 4.06Å |
| 206 | D | 81.1 | Confident | 90.3 | Very high | 78 Ų | 78 | 62.9 Ų | 62.9 | 42% | 0.417 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -97.5 | -17.1 | -167.4 | -57.7 | -50.5 | 0 | 0 | 0 | 113.1 | H208 K339 | D206-H208 PolarHBondContact O-CD2 3.03Å; D206-H208 PolarHBondContact O-N 2.92Å; D206-K339 IonicContact OD1-NZ 2.83Å; D206-K339 PolarHBondContact OD1-NZ 3.26Å; D206-K339 IonicContact OD2-NZ 2.77Å; D206-K339 PolarHBondContact OD2-NZ 3.28Å |
| 207 | G | 83.3 | Confident | 90.3 | Very high | 49 Ų | 49 | 59.3 Ų | 59.3 | 51% | 0.505 | 32% | 0.316 | S | S | . | . | trans | 69.8 | -6.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | W203 | W203-G207 PolarHBondContact NE1-O 2.88Å; W203-G207 VanDerWaalsContact O-CA 3.28Å; W203-G207 WeakPolarHBondContact O-CA 3.38Å; W203-G207 PolarHBondContact O-N 2.76Å | ||
| 208 | H | 81.1 | Confident | 90.4 | Very high | 158 Ų | 158 | 59.1 Ų | 59.1 | 73% | 0.731 | 31% | 0.314 | S | S | * | . | trans | -93 | 117.1 | -179.3 | -73 | -74.3 | 0 | 0 | 0 | 111.5 | D206 | D206-H208 PolarHBondContact O-CD2 3.03Å; D206-H208 PolarHBondContact O-N 2.92Å | ||
| 209 | F | 85.8 | Confident | 90.4 | Very high | 124 Ų | 124 | 59.1 Ų | 59.1 | 54% | 0.544 | 31% | 0.314 | S | S | . | . | trans | -102.7 | 106.7 | 175.7 | -174 | -96.1 | 0 | 0 | 0 | 110.7 | V199 I211 | V199-F209 HydrophobicContact CG1-CD2 4.06Å; V199-F209 HydrophobicContact CG1-CE2 3.45Å; V199-F209 VanDerWaalsContact CG1-CE2 3.45Å; V199-F209 HydrophobicContact CG1-CZ 4.38Å; F209-I211 HydrophobicContact CD1-CG1 4.21Å; F209-I211 HydrophobicContact CE1-CG1 3.78Å | ||
| 210 | S | 87.8 | Confident | 90.5 | Very high | 40 Ų | 40 | 58 Ų | 58 | 28% | 0.28 | 31% | 0.307 | S | S | . | . | trans | -101.1 | 109.2 | 177.5 | -178.5 | 0 | 0 | 0 | 0 | 110.7 | P212 H213 A214 | S210-P212 VanDerWaalsContact C-N 3.35Å; S210-P212 WeakPolarHBondContact OG-CD 3.39Å; S210-H213 PolarHBondContact O-N 2.88Å; S210-H213 VanDerWaalsContact O-N 3.1Å; S210-H213 PolarHBondContact OG-CD2 3.23Å; S210-H213 VanDerWaalsContact OG-CD2 3.23Å; S210-A214 PolarHBondContact O-N 2.72Å | ||
| 211 | I | 88.8 | Confident | 90.6 | Very high | 102 Ų | 102 | 54.9 Ų | 54.9 | 52% | 0.523 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -55.7 | -43.3 | 177 | -64.5 | 171.3 | 0 | 0 | 0 | 112 | F209 H213 A214 F215 | F209-I211 HydrophobicContact CD1-CG1 4.21Å; F209-I211 HydrophobicContact CE1-CG1 3.78Å; I211-H213 VanDerWaalsContact C-N 3.34Å; I211-H213 PolarHBondContact O-N 3.45Å; I211-A214 PolarHBondContact O-N 2.95Å; I211-F215 HydrophobicContact CG2-CD2 3.65Å; I211-F215 HydrophobicContact CG2-CE2 3.54Å; I211-F215 WeakPolarHBondContact O-CD2 3.41Å; I211-F215 PolarHBondContact O-N 3.32Å; I211-F215 VanDerWaalsContact O-N 3.09Å |
| 212 | P | 89.5 | Confident | 90.8 | Very high | 64 Ų | 64 | 52.7 Ų | 52.7 | 42% | 0.416 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -58.6 | -40.4 | 174.4 | -26.4 | 35.5 | 0 | 0 | 0 | 113.8 | S210 F215 L216 | S210-P212 VanDerWaalsContact C-N 3.35Å; S210-P212 WeakPolarHBondContact OG-CD 3.39Å; P212-F215 PolarHBondContact O-N 3.42Å; P212-L216 WeakPolarHBondContact O-CB 3.41Å; P212-L216 PolarHBondContact O-N 3.49Å |
| 213 | H | 90.9 | Very high | 91.1 | Very high | 48 Ų | 48 | 52.8 Ų | 52.8 | 22% | 0.222 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -65.1 | -44.2 | 177.4 | -66.4 | -165.8 | 0 | 0 | 0 | 110.2 | K131 V132 E134 S210 I211 F215 L216 L217 | K131-H213 PolarHBondContact O-CE1 2.85Å; K131-H213 VanDerWaalsContact O-CE1 3.26Å; V132-H213 HydrophobicContact CG1-CB 4.02Å; E134-H213 IonicContact OE1-ND1 3.63Å; E134-H213 IonicContact OE2-ND1 3.57Å; S210-H213 PolarHBondContact O-N 2.88Å; S210-H213 VanDerWaalsContact O-N 3.1Å; S210-H213 PolarHBondContact OG-CD2 3.23Å; S210-H213 VanDerWaalsContact OG-CD2 3.23Å; I211-H213 VanDerWaalsContact C-N 3.34Å; I211-H213 PolarHBondContact O-N 3.45Å; H213-F215 VanDerWaalsContact C-N 3.33Å; H213-F215 PolarHBondContact O-N 2.96Å; H213-L216 PolarHBondContact O-N 3.44Å; H213-L216 VanDerWaalsContact O-N 3.15Å; H213-L217 WeakPolarHBondContact O-CB 3.32Å; H213-L217 WeakPolarHBondContact O-CD1 3.4Å; H213-L217 WeakPolarHBondContact O-CG 3.48Å; H213-L217 PolarHBondContact O-N 3.21Å |
| 214 | A | 93.2 | Very high | 91.3 | Very high | 22 Ų | 22 | 46.5 Ų | 46.5 | 18% | 0.182 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -58.3 | -43.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.6 | V199 S210 I211 C218 | V199-A214 HydrophobicContact CG1-CB 4.24Å; V199-A214 HydrophobicContact CG2-CB 3.78Å; S210-A214 PolarHBondContact O-N 2.72Å; I211-A214 PolarHBondContact O-N 2.95Å; A214-C218 VanDerWaalsContact O-CB 3.29Å; A214-C218 WeakPolarHBondContact O-CB 3.32Å; A214-C218 PolarHBondContact O-N 3.39Å |
| 215 | F | 93.9 | Very high | 91.6 | Very high | 95 Ų | 95 | 41.5 Ų | 41.5 | 42% | 0.417 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -69.1 | -38.2 | 175.6 | -81.3 | -65.7 | 0 | 0 | 0 | 113 | I211 P212 H213 C218 A219 Y288 P289 | I211-F215 HydrophobicContact CG2-CD2 3.65Å; I211-F215 HydrophobicContact CG2-CE2 3.54Å; I211-F215 WeakPolarHBondContact O-CD2 3.41Å; I211-F215 PolarHBondContact O-N 3.32Å; I211-F215 VanDerWaalsContact O-N 3.09Å; P212-F215 PolarHBondContact O-N 3.42Å; H213-F215 VanDerWaalsContact C-N 3.33Å; H213-F215 PolarHBondContact O-N 2.96Å; F215-C218 PolarHBondContact O-N 3.33Å; F215-A219 VanDerWaalsContact O-CB 3.29Å; F215-A219 WeakPolarHBondContact O-CB 3.22Å; F215-A219 PolarHBondContact O-N 3.35Å; F215-Y288 HydrophobicContact CB-CD2 3.84Å; F215-Y288 HydrophobicContact CB-CG 4.23Å; F215-P289 HydrophobicContact CD1-CB 4.45Å; F215-P289 HydrophobicContact CE1-CB 4.37Å |
| 216 | L | 95 | Very high | 92.1 | Very high | 2 Ų | 2 | 39.1 Ų | 39.1 | 1% | 0.01 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -62.6 | -47.6 | 174.9 | 174.6 | 63.2 | 0 | 0 | 0 | 111.4 | V128 V132 P212 H213 C218 A219 S220 L277 Y278 Y288 | V128-L216 HydrophobicContact CG2-CD2 4.08Å; V132-L216 HydrophobicContact CG1-CD2 4.43Å; V132-L216 HydrophobicContact CG2-CD2 4.01Å; P212-L216 WeakPolarHBondContact O-CB 3.41Å; P212-L216 PolarHBondContact O-N 3.49Å; H213-L216 PolarHBondContact O-N 3.44Å; H213-L216 VanDerWaalsContact O-N 3.15Å; L216-C218 VanDerWaalsContact C-N 3.34Å; L216-C218 PolarHBondContact O-N 2.9Å; L216-A219 PolarHBondContact O-N 3.12Å; L216-S220 VanDerWaalsContact O-CB 3.28Å; L216-S220 WeakPolarHBondContact O-CB 3.26Å; L216-S220 PolarHBondContact O-N 3.19Å; L216-S220 PolarHBondContact O-OG 2.86Å; L216-L277 HydrophobicContact CD1-CB 3.6Å; L216-L277 HydrophobicContact CD1-CD1 4.37Å; L216-Y278 HydrophobicContact CD2-CD2 4.09Å; L216-Y288 HydrophobicContact CB-CD2 4.19Å; L216-Y288 HydrophobicContact CB-CE1 4.41Å; L216-Y288 HydrophobicContact CB-CE2 3.81Å; L216-Y288 HydrophobicContact CD1-CD1 4.35Å; L216-Y288 HydrophobicContact CD1-CE1 3.75Å |
| 217 | L | 95.7 | Very high | 92.8 | Very high | 1 Ų | 1 | 38.1 Ų | 38.1 | 1% | 0.005 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -62 | -42.1 | 177.9 | -68 | 164.4 | 0 | 0 | 0 | 111 | V132 E134 V135 V199 H213 S220 S221 | V132-L217 HydrophobicContact CG1-CD2 4.19Å; V132-L217 HydrophobicContact CG1-CG 4.31Å; E134-L217 HydrophobicContact CB-CD1 3.56Å; E134-L217 HydrophobicContact CB-CD2 4.02Å; E134-L217 HydrophobicContact CB-CG 4.41Å; E134-L217 HydrophobicContact CG-CD1 4.25Å; V135-L217 HydrophobicContact CB-CD2 4.48Å; V135-L217 HydrophobicContact CG2-CD2 3.75Å; V199-L217 HydrophobicContact CG2-CD1 3.65Å; H213-L217 WeakPolarHBondContact O-CB 3.32Å; H213-L217 WeakPolarHBondContact O-CD1 3.4Å; H213-L217 WeakPolarHBondContact O-CG 3.48Å; H213-L217 PolarHBondContact O-N 3.21Å; L217-S220 WeakPolarHBondContact CA-OG 3.17Å; L217-S220 PolarHBondContact O-OG 3.42Å; L217-S221 WeakPolarHBondContact O-CB 3.04Å; L217-S221 PolarHBondContact O-N 3.25Å |
| 218 | C | 96.3 | Very high | 93.3 | Very high | 13 Ų | 13 | 35.9 Ų | 35.9 | 9% | 0.088 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -62.8 | -49.1 | 175.2 | -177.5 | 0 | 0 | 0 | 0 | 111.8 | F192 S195 A214 F215 L216 V222 C292 | F192-C218 VanDerWaalsContact CD2-SG 3.57Å; S195-C218 WeakPolarHBondContact OG-CA 3.22Å; A214-C218 VanDerWaalsContact O-CB 3.29Å; A214-C218 WeakPolarHBondContact O-CB 3.32Å; A214-C218 PolarHBondContact O-N 3.39Å; F215-C218 PolarHBondContact O-N 3.33Å; L216-C218 VanDerWaalsContact C-N 3.34Å; L216-C218 PolarHBondContact O-N 2.9Å; C218-V222 WeakPolarHBondContact O-CB 3.1Å; C218-V222 VanDerWaalsContact O-CG2 3.27Å; C218-V222 WeakPolarHBondContact O-CG2 3.47Å; C218-V222 PolarHBondContact O-N 3.45Å; C218-C292 PolarHBondContact SG-SG 3.33Å |
| 219 | A | 96.3 | Very high | 93.9 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -64.9 | -47 | -178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | F215 L216 A223 L277 V291 C292 | F215-A219 VanDerWaalsContact O-CB 3.29Å; F215-A219 WeakPolarHBondContact O-CB 3.22Å; F215-A219 PolarHBondContact O-N 3.35Å; L216-A219 PolarHBondContact O-N 3.12Å; A219-A223 WeakPolarHBondContact O-CB 3.33Å; A219-A223 PolarHBondContact O-N 3.46Å; A219-L277 HydrophobicContact CB-CD1 3.74Å; A219-V291 HydrophobicContact CB-CB 4.18Å; A219-V291 HydrophobicContact CB-CG1 4.1Å; A219-C292 WeakPolarHBondContact CA-SG 3.33Å; A219-C292 PolarHBondContact N-SG 3Å; A219-C292 VanDerWaalsContact N-SG 3.37Å |
| 220 | S | 96.9 | Very high | 94.3 | Very high | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -64.6 | -46.9 | 177.8 | 56.1 | 0 | 0 | 0 | 0 | 111.8 | L216 L217 T224 S274 | L216-S220 VanDerWaalsContact O-CB 3.28Å; L216-S220 WeakPolarHBondContact O-CB 3.26Å; L216-S220 PolarHBondContact O-N 3.19Å; L216-S220 PolarHBondContact O-OG 2.86Å; L217-S220 WeakPolarHBondContact CA-OG 3.17Å; L217-S220 PolarHBondContact O-OG 3.42Å; S220-T224 WeakPolarHBondContact O-CB 3.41Å; S220-T224 PolarHBondContact O-N 3.25Å; S220-T224 PolarHBondContact O-OG1 3.13Å; S220-S274 VanDerWaalsContact CB-OG 3.24Å; S220-S274 WeakPolarHBondContact CB-OG 3.39Å |
| 221 | S | 96.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -61 | -53 | 179.3 | -176.4 | 0 | 0 | 0 | 0 | 112.5 | L138 G191 L217 A223 T224 A225 | L138-S221 WeakPolarHBondContact CD1-OG 3.24Å; G191-S221 VanDerWaalsContact C-OG 3.27Å; G191-S221 WeakPolarHBondContact CA-OG 3.5Å; G191-S221 WeakPolarHBondContact O-CB 3.42Å; G191-S221 PolarHBondContact O-OG 2.84Å; L217-S221 WeakPolarHBondContact O-CB 3.04Å; L217-S221 PolarHBondContact O-N 3.25Å; S221-A223 PolarHBondContact O-N 3.34Å; S221-T224 PolarHBondContact O-N 3.2Å; S221-A225 VanDerWaalsContact O-CB 3.29Å; S221-A225 WeakPolarHBondContact O-CB 3.43Å; S221-A225 PolarHBondContact O-N 2.99Å |
| 222 | V | 96.7 | Very high | 94.8 | Very high | 1 Ų | 1 | 21.9 Ų | 21.9 | 1% | 0.006 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -64.5 | -44.9 | -177 | 174.3 | 0 | 0 | 0 | 0 | 110.6 | T188 F192 C218 F226 F295 | T188-V222 HydrophobicContact CG2-CG1 3.93Å; F192-V222 HydrophobicContact CB-CG2 3.83Å; F192-V222 HydrophobicContact CD2-CG2 4.49Å; C218-V222 WeakPolarHBondContact O-CB 3.1Å; C218-V222 VanDerWaalsContact O-CG2 3.27Å; C218-V222 WeakPolarHBondContact O-CG2 3.47Å; C218-V222 PolarHBondContact O-N 3.45Å; V222-F226 WeakPolarHBondContact O-CB 3.49Å; V222-F226 PolarHBondContact O-N 2.96Å; V222-F295 HydrophobicContact CG1-CB 3.48Å; V222-F295 VanDerWaalsContact CG1-CB 3.48Å; V222-F295 HydrophobicContact CG1-CD2 4.36Å; V222-F295 HydrophobicContact CG1-CG 4.06Å |
| 223 | A | 96.9 | Very high | 94.9 | Very high | 3 Ų | 3 | 18.8 Ų | 18.8 | 3% | 0.025 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -63.3 | -43.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A219 S221 I227 I273 V291 F295 | A219-A223 WeakPolarHBondContact O-CB 3.33Å; A219-A223 PolarHBondContact O-N 3.46Å; S221-A223 PolarHBondContact O-N 3.34Å; A223-I227 WeakPolarHBondContact O-CB 3.04Å; A223-I227 WeakPolarHBondContact O-CD1 3.28Å; A223-I227 WeakPolarHBondContact O-CG1 3.2Å; A223-I227 PolarHBondContact O-N 3.21Å; A223-I273 HydrophobicContact CB-CD1 4.2Å; A223-I273 HydrophobicContact CB-CG2 4.08Å; A223-V291 HydrophobicContact CB-CG1 4.17Å; A223-F295 HydrophobicContact CB-CD2 4.01Å; A223-F295 HydrophobicContact CB-CE2 3.35Å; A223-F295 HydrophobicContact CB-CZ 3.89Å |
| 224 | T | 96.7 | Very high | 94.9 | Very high | 0 Ų | 0 | 21.6 Ų | 21.6 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -63.5 | -53.2 | 178.3 | -60.3 | 0 | 0 | 0 | 0 | 110.9 | L142 S220 S221 F226 I227 A228 T266 L269 L270 | L142-T224 HydrophobicContact CD1-CG2 4.02Å; S220-T224 WeakPolarHBondContact O-CB 3.41Å; S220-T224 PolarHBondContact O-N 3.25Å; S220-T224 PolarHBondContact O-OG1 3.13Å; S221-T224 PolarHBondContact O-N 3.2Å; T224-F226 VanDerWaalsContact C-N 3.28Å; T224-F226 PolarHBondContact O-N 3.36Å; T224-I227 PolarHBondContact O-N 3.45Å; T224-A228 WeakPolarHBondContact O-CA 3.37Å; T224-A228 WeakPolarHBondContact O-CB 3.19Å; T224-A228 PolarHBondContact O-N 2.85Å; T224-T266 HydrophobicContact CG2-CG2 4.24Å; T224-T266 WeakPolarHBondContact CG2-O 3.46Å; T224-L269 HydrophobicContact CG2-CB 4.03Å; T224-L270 HydrophobicContact CG2-CB 3.87Å; T224-L270 WeakPolarHBondContact OG1-CA 3.2Å |
| 225 | A | 95.5 | Very high | 94.9 | Very high | 7 Ų | 7 | 23.1 Ų | 23.1 | 6% | 0.058 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -57.8 | -43.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | L142 L145 A187 S221 S229 | L142-A225 HydrophobicContact CD2-CB 4.09Å; L145-A225 HydrophobicContact CD2-CB 4.2Å; A187-A225 HydrophobicContact CB-CB 4.23Å; A187-A225 WeakPolarHBondContact CB-O 3.5Å; A187-A225 VanDerWaalsContact O-CB 3.27Å; A187-A225 WeakPolarHBondContact O-CB 3.43Å; S221-A225 VanDerWaalsContact O-CB 3.29Å; S221-A225 WeakPolarHBondContact O-CB 3.43Å; S221-A225 PolarHBondContact O-N 2.99Å; A225-S229 WeakPolarHBondContact O-CB 3.39Å; A225-S229 PolarHBondContact O-N 2.92Å; A225-S229 PolarHBondContact O-OG 3.07Å |
| 226 | F | 95.2 | Very high | 94.7 | Very high | 15 Ų | 15 | 18.7 Ų | 18.7 | 7% | 0.066 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -62.6 | -55.7 | 176.6 | -172.5 | -78.6 | 0 | 0 | 0 | 112.2 | Q184 T188 V222 T224 S229 L230 F295 L298 W302 | Q184-F226 HydrophobicContact CB-CE2 4.39Å; Q184-F226 VanDerWaalsContact OE1-CG 3.3Å; Q184-F226 PolarHBondContact OE1-O 3.12Å; T188-F226 WeakPolarHBondContact OG1-CD2 3.49Å; V222-F226 WeakPolarHBondContact O-CB 3.49Å; V222-F226 PolarHBondContact O-N 2.96Å; T224-F226 VanDerWaalsContact C-N 3.28Å; T224-F226 PolarHBondContact O-N 3.36Å; F226-S229 PolarHBondContact O-N 3Å; F226-S229 PolarHBondContact O-OG 2.77Å; F226-L230 HydrophobicContact CE1-CD2 4.19Å; F226-L230 VanDerWaalsContact O-CB 3.31Å; F226-L230 WeakPolarHBondContact O-CB 3.45Å; F226-L230 PolarHBondContact O-N 3.42Å; F226-F295 HydrophobicContact CB-CD1 3.79Å; F226-F295 HydrophobicContact CB-CE1 3.86Å; F226-F295 AromaticContact CD1-CD1 3.75Å; F226-F295 HydrophobicContact CD1-CD1 3.75Å; F226-F295 AromaticContact CD1-CE1 3.39Å; F226-F295 HydrophobicContact CD1-CE1 3.39Å; F226-F295 AromaticContact CD2-CD1 3.67Å; F226-F295 HydrophobicContact CD2-CD1 3.67Å; F226-F295 HydrophobicContact CD2-CE1 4.21Å; F226-F295 HydrophobicContact CE1-CD1 4.23Å; F226-F295 AromaticContact CE1-CE1 3.95Å; F226-F295 HydrophobicContact CE1-CE1 3.95Å; F226-F295 HydrophobicContact CE2-CD1 4.16Å; F226-F295 AromaticContact CG-CD1 3.45Å; F226-F295 HydrophobicContact CG-CD1 3.45Å; F226-F295 VanDerWaalsContact CG-CD1 3.45Å; F226-F295 AromaticContact CG-CE1 3.55Å; F226-F295 HydrophobicContact CG-CE1 3.55Å; F226-F295 HydrophobicContact CZ-CD1 4.42Å; F226-L298 HydrophobicContact CE2-CD1 4.06Å; F226-L298 HydrophobicContact CZ-CD1 3.77Å; F226-W302 AromaticContact CE2-NE1 3.35Å; F226-W302 HydrophobicContact CZ-CZ2 4.01Å; F226-W302 AromaticContact CZ-NE1 3.54Å |
| 227 | I | 95.7 | Very high | 94.4 | Very high | 57 Ų | 57 | 19.1 Ų | 19.1 | 29% | 0.292 | 10% | 0.103 | S | C | . | . | H | α-helix | trans | -67.4 | -43.7 | -174.8 | -64.1 | 167.1 | 0 | 0 | 0 | 110.5 | A223 T224 L230 V231 L269 I273 F295 | A223-I227 WeakPolarHBondContact O-CB 3.04Å; A223-I227 WeakPolarHBondContact O-CD1 3.28Å; A223-I227 WeakPolarHBondContact O-CG1 3.2Å; A223-I227 PolarHBondContact O-N 3.21Å; T224-I227 PolarHBondContact O-N 3.45Å; I227-L230 PolarHBondContact O-N 3.4Å; I227-V231 HydrophobicContact CG2-CG2 4.22Å; I227-V231 WeakPolarHBondContact O-CB 3.21Å; I227-V231 VanDerWaalsContact O-CG2 3.27Å; I227-V231 WeakPolarHBondContact O-CG2 3.41Å; I227-V231 PolarHBondContact O-N 3Å; I227-L269 HydrophobicContact CB-CD1 4.24Å; I227-L269 HydrophobicContact CG2-CD1 3.77Å; I227-L269 HydrophobicContact CG2-CD2 4.02Å; I227-I273 HydrophobicContact CD1-CD1 3.97Å; I227-F295 HydrophobicContact CD1-CZ 4.23Å; I227-F295 HydrophobicContact CG1-CZ 4.33Å |
| 228 | A | 94.7 | Very high | 94.1 | Very high | 2 Ų | 2 | 21 Ų | 21 | 2% | 0.017 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -60.1 | -49.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | T224 L230 V231 L232 T266 L269 | T224-A228 WeakPolarHBondContact O-CA 3.37Å; T224-A228 WeakPolarHBondContact O-CB 3.19Å; T224-A228 PolarHBondContact O-N 2.85Å; A228-L230 VanDerWaalsContact C-N 3.32Å; A228-L230 PolarHBondContact O-N 3.1Å; A228-V231 PolarHBondContact O-N 3.48Å; A228-L232 HydrophobicContact CB-CD1 4.48Å; A228-L232 WeakPolarHBondContact O-CB 3.37Å; A228-L232 WeakPolarHBondContact O-CD1 3.36Å; A228-L232 WeakPolarHBondContact O-CG 3.16Å; A228-L232 PolarHBondContact O-N 3.4Å; A228-T266 HydrophobicContact CB-CG2 4.49Å; A228-L269 HydrophobicContact CB-CD1 3.79Å |
| 229 | S | 93.6 | Very high | 93.8 | Very high | 6 Ų | 6 | 21.7 Ų | 21.7 | 4% | 0.042 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -67.5 | -31 | 179.5 | 67 | 0 | 0 | 0 | 0 | 113.4 | E150 Q184 A187 A225 F226 G233 | E150-S229 VanDerWaalsContact OE1-CA 3.29Å; E150-S229 WeakPolarHBondContact OE1-CA 3.45Å; E150-S229 WeakPolarHBondContact OE1-CB 3.5Å; Q184-S229 PolarHBondContact NE2-OG 2.79Å; Q184-S229 VanDerWaalsContact NE2-OG 3.1Å; A187-S229 VanDerWaalsContact CB-OG 3.26Å; A187-S229 WeakPolarHBondContact CB-OG 3.32Å; A225-S229 WeakPolarHBondContact O-CB 3.39Å; A225-S229 PolarHBondContact O-N 2.92Å; A225-S229 PolarHBondContact O-OG 3.07Å; F226-S229 PolarHBondContact O-N 3Å; F226-S229 PolarHBondContact O-OG 2.77Å; S229-G233 WeakPolarHBondContact O-CA 3.43Å; S229-G233 PolarHBondContact O-N 3.2Å |
| 230 | L | 94 | Very high | 93.3 | Very high | 60 Ų | 60 | 21.7 Ų | 21.7 | 31% | 0.314 | 13% | 0.127 | S | C | . | . | H | α-helix | trans | -68.1 | -49.2 | 174.2 | -176 | 63.3 | 0 | 0 | 0 | 110.8 | M180 F226 I227 A228 M234 | M180-L230 HydrophobicContact CG-CD1 4.38Å; M180-L230 HydrophobicContact SD-CD1 3.8Å; F226-L230 HydrophobicContact CE1-CD2 4.19Å; F226-L230 VanDerWaalsContact O-CB 3.31Å; F226-L230 WeakPolarHBondContact O-CB 3.45Å; F226-L230 PolarHBondContact O-N 3.42Å; I227-L230 PolarHBondContact O-N 3.4Å; A228-L230 VanDerWaalsContact C-N 3.32Å; A228-L230 PolarHBondContact O-N 3.1Å; L230-M234 WeakPolarHBondContact O-CB 3.39Å; L230-M234 WeakPolarHBondContact O-CG 3.39Å; L230-M234 PolarHBondContact O-N 3.16Å |
| 231 | V | 94.2 | Very high | 92.8 | Very high | 61 Ų | 61 | 23.9 Ų | 23.9 | 37% | 0.37 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -64.6 | -50 | -179.6 | 170.7 | 0 | 0 | 0 | 0 | 110.4 | I227 A228 M234 I235 I265 | I227-V231 HydrophobicContact CG2-CG2 4.22Å; I227-V231 WeakPolarHBondContact O-CB 3.21Å; I227-V231 VanDerWaalsContact O-CG2 3.27Å; I227-V231 WeakPolarHBondContact O-CG2 3.41Å; I227-V231 PolarHBondContact O-N 3Å; A228-V231 PolarHBondContact O-N 3.48Å; V231-M234 PolarHBondContact O-N 2.63Å; V231-I235 HydrophobicContact CG1-CD1 3.84Å; V231-I235 VanDerWaalsContact O-CG1 3.3Å; V231-I235 WeakPolarHBondContact O-CG1 3.27Å; V231-I235 PolarHBondContact O-N 3.17Å; V231-I265 HydrophobicContact CG1-CD1 4.2Å; V231-I265 HydrophobicContact CG1-CG2 4.42Å |
| 232 | L | 92.4 | Very high | 92.3 | Very high | 2 Ų | 2 | 25.2 Ų | 25.2 | 1% | 0.01 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -64 | -47.3 | 179.5 | -70.2 | 167.6 | 0 | 0 | 0 | 111.1 | E150 A228 M234 I235 M236 L261 I265 | E150-L232 HydrophobicContact CG-CB 4.09Å; E150-L232 HydrophobicContact CG-CD1 4.26Å; A228-L232 HydrophobicContact CB-CD1 4.48Å; A228-L232 WeakPolarHBondContact O-CB 3.37Å; A228-L232 WeakPolarHBondContact O-CD1 3.36Å; A228-L232 WeakPolarHBondContact O-CG 3.16Å; A228-L232 PolarHBondContact O-N 3.4Å; L232-M234 VanDerWaalsContact C-N 3.25Å; L232-M234 PolarHBondContact O-N 3.05Å; L232-I235 CarbonylContact O-C 3.28Å; L232-I235 WeakPolarHBondContact O-CB 3.36Å; L232-I235 PolarHBondContact O-N 3.49Å; L232-I235 VanDerWaalsContact O-N 3.1Å; L232-M236 WeakPolarHBondContact O-CB 3.4Å; L232-M236 VanDerWaalsContact O-CG 3.25Å; L232-M236 WeakPolarHBondContact O-CG 3.46Å; L232-M236 PolarHBondContact O-N 2.81Å; L232-L261 HydrophobicContact CD2-CB 4.08Å; L232-I265 HydrophobicContact CD2-CB 4.33Å; L232-I265 HydrophobicContact CD2-CD1 3.79Å; L232-I265 HydrophobicContact CG-CG2 4.41Å |
| 233 | G | 91.7 | Very high | 91.8 | Very high | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -56.2 | -41.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | E150 S229 M236 I237 | E150-G233 PolarHBondContact OE2-N 3.37Å; S229-G233 WeakPolarHBondContact O-CA 3.43Å; S229-G233 PolarHBondContact O-N 3.2Å; G233-M236 PolarHBondContact O-N 3.35Å; G233-I237 WeakPolarHBondContact O-CB 3.28Å; G233-I237 VanDerWaalsContact O-CD1 3.27Å; G233-I237 WeakPolarHBondContact O-CD1 3.41Å; G233-I237 WeakPolarHBondContact O-CG1 3.31Å; G233-I237 PolarHBondContact O-N 3.45Å |
| 234 | M | 92.2 | Very high | 90.9 | Very high | 107 Ų | 107 | 29.7 Ų | 29.7 | 53% | 0.527 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -67.6 | -41.5 | 177.5 | -73.3 | -59.5 | -61.6 | 0 | 0 | 112.2 | M180 L230 V231 L232 M236 G238 | M180-M234 HydrophobicContact CE-CG 3.84Å; M180-M234 HydrophobicContact CE-SD 3.78Å; L230-M234 WeakPolarHBondContact O-CB 3.39Å; L230-M234 WeakPolarHBondContact O-CG 3.39Å; L230-M234 PolarHBondContact O-N 3.16Å; V231-M234 PolarHBondContact O-N 2.63Å; L232-M234 VanDerWaalsContact C-N 3.25Å; L232-M234 PolarHBondContact O-N 3.05Å; M234-M236 VanDerWaalsContact C-N 3.34Å; M234-G238 PolarHBondContact O-N 3.43Å |
| 235 | I | 92.1 | Very high | 90.3 | Very high | 54 Ų | 54 | 38 Ų | 38 | 28% | 0.277 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -60.6 | -46.8 | 173.2 | -68.6 | 166 | 0 | 0 | 0 | 109.6 | V231 L232 I237 G238 V239 I257 L261 I265 | V231-I235 HydrophobicContact CG1-CD1 3.84Å; V231-I235 VanDerWaalsContact O-CG1 3.3Å; V231-I235 WeakPolarHBondContact O-CG1 3.27Å; V231-I235 PolarHBondContact O-N 3.17Å; L232-I235 CarbonylContact O-C 3.28Å; L232-I235 WeakPolarHBondContact O-CB 3.36Å; L232-I235 PolarHBondContact O-N 3.49Å; L232-I235 VanDerWaalsContact O-N 3.1Å; I235-I237 PolarHBondContact O-N 3.49Å; I235-G238 CarbonylContact O-C 3.56Å; I235-G238 WeakPolarHBondContact O-CA 3.44Å; I235-G238 PolarHBondContact O-N 2.99Å; I235-G238 VanDerWaalsContact O-N 3.09Å; I235-V239 HydrophobicContact CG2-CG2 4.22Å; I235-V239 WeakPolarHBondContact O-CG2 3.46Å; I235-V239 PolarHBondContact O-N 3.41Å; I235-I257 HydrophobicContact CG2-CG2 4.37Å; I235-L261 HydrophobicContact CD1-CD1 4.36Å; I235-L261 HydrophobicContact CG2-CD1 3.96Å; I235-I265 HydrophobicContact CD1-CD1 3.94Å |
| 236 | M | 90 | Very high | 89.8 | Confident | 1 Ų | 1 | 43.9 Ų | 43.9 | 1% | 0.005 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.4 | -45.2 | -178.2 | -69.5 | -34.3 | -57.2 | 0 | 0 | 112.5 | L153 A154 L232 G233 M234 G238 V239 I240 A254 I257 A258 | L153-M236 HydrophobicContact CD2-CB 4.21Å; A154-M236 HydrophobicContact CB-CE 4.3Å; L232-M236 WeakPolarHBondContact O-CB 3.4Å; L232-M236 VanDerWaalsContact O-CG 3.25Å; L232-M236 WeakPolarHBondContact O-CG 3.46Å; L232-M236 PolarHBondContact O-N 2.81Å; G233-M236 PolarHBondContact O-N 3.35Å; M234-M236 VanDerWaalsContact C-N 3.34Å; M236-G238 VanDerWaalsContact C-N 3.29Å; M236-G238 PolarHBondContact O-N 3.15Å; M236-V239 PolarHBondContact O-N 3.49Å; M236-I240 VanDerWaalsContact O-CG1 3.24Å; M236-I240 WeakPolarHBondContact O-CG1 3.19Å; M236-I240 PolarHBondContact O-N 2.91Å; M236-A254 HydrophobicContact CE-CB 3.46Å; M236-A254 VanDerWaalsContact CE-CB 3.46Å; M236-A254 WeakPolarHBondContact CE-O 3.49Å; M236-I257 HydrophobicContact SD-CG2 4.38Å; M236-A258 HydrophobicContact CE-CB 3.84Å; M236-A258 HydrophobicContact CG-CB 4.19Å; M236-A258 VanDerWaalsContact SD-CA 3.57Å; M236-A258 HydrophobicContact SD-CB 3.54Å; M236-A258 VanDerWaalsContact SD-CB 3.54Å |
| 237 | I | 88.8 | Confident | 88.9 | Confident | 11 Ų | 11 | 46.5 Ų | 46.5 | 6% | 0.056 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58.2 | -44.7 | 172.9 | -69.9 | 157.8 | 0 | 0 | 0 | 110.6 | L157 I176 M180 G233 I235 I240 I241 | L157-I237 HydrophobicContact CD1-CG1 3.67Å; I176-I237 HydrophobicContact CB-CD1 4.41Å; I176-I237 HydrophobicContact CD1-CG2 3.62Å; I176-I237 HydrophobicContact CG1-CD1 4.38Å; I176-I237 HydrophobicContact CG1-CG1 4.31Å; I176-I237 HydrophobicContact CG1-CG2 3.81Å; I176-I237 HydrophobicContact CG2-CD1 3.61Å; I176-I237 HydrophobicContact CG2-CG1 4.42Å; I176-I237 HydrophobicContact CG2-CG2 4.34Å; M180-I237 HydrophobicContact CE-CD1 3.64Å; G233-I237 WeakPolarHBondContact O-CB 3.28Å; G233-I237 VanDerWaalsContact O-CD1 3.27Å; G233-I237 WeakPolarHBondContact O-CD1 3.41Å; G233-I237 WeakPolarHBondContact O-CG1 3.31Å; G233-I237 PolarHBondContact O-N 3.45Å; I235-I237 PolarHBondContact O-N 3.49Å; I237-I240 PolarHBondContact O-N 3.48Å; I237-I241 HydrophobicContact CG2-CD1 3.65Å; I237-I241 HydrophobicContact CG2-CG1 4.42Å; I237-I241 WeakPolarHBondContact O-CB 3.39Å; I237-I241 VanDerWaalsContact O-CG1 3.28Å; I237-I241 WeakPolarHBondContact O-CG1 3.43Å; I237-I241 PolarHBondContact O-N 3.05Å |
| 238 | G | 90.2 | Very high | 87.8 | Confident | 42 Ų | 42 | 47.6 Ų | 47.6 | 43% | 0.433 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -59.8 | -45 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | M234 I235 M236 G242 | M234-G238 PolarHBondContact O-N 3.43Å; I235-G238 CarbonylContact O-C 3.56Å; I235-G238 WeakPolarHBondContact O-CA 3.44Å; I235-G238 PolarHBondContact O-N 2.99Å; I235-G238 VanDerWaalsContact O-N 3.09Å; M236-G238 VanDerWaalsContact C-N 3.29Å; M236-G238 PolarHBondContact O-N 3.15Å; G238-G242 PolarHBondContact O-N 2.95Å |
| 239 | V | 89.1 | Confident | 86.7 | Confident | 26 Ų | 26 | 50.1 Ų | 50.1 | 16% | 0.158 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -62.5 | -44.3 | 176.9 | 169.8 | 0 | 0 | 0 | 0 | 111.1 | I235 M236 G242 S243 V253 A254 I257 | I235-V239 HydrophobicContact CG2-CG2 4.22Å; I235-V239 WeakPolarHBondContact O-CG2 3.46Å; I235-V239 PolarHBondContact O-N 3.41Å; M236-V239 PolarHBondContact O-N 3.49Å; V239-G242 PolarHBondContact O-N 2.77Å; V239-S243 VanDerWaalsContact O-CB 3.27Å; V239-S243 WeakPolarHBondContact O-CB 3.4Å; V239-S243 PolarHBondContact O-N 3.36Å; V239-S243 PolarHBondContact O-OG 3.03Å; V239-V253 HydrophobicContact CG1-CB 4.36Å; V239-V253 HydrophobicContact CG1-CG1 3.83Å; V239-A254 HydrophobicContact CG1-CB 4.22Å; V239-I257 HydrophobicContact CG1-CD1 4.02Å; V239-I257 HydrophobicContact CG2-CD1 3.95Å; V239-I257 HydrophobicContact CG2-CG2 4.17Å |
| 240 | I | 85.8 | Confident | 85.7 | Confident | 1 Ų | 1 | 50 Ų | 50 | 1% | 0.005 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -66.9 | -47.8 | -178.4 | -67.9 | 168.1 | 0 | 0 | 0 | 110.8 | L157 A161 M166 M236 I237 G242 S243 R244 P250 A254 | L157-I240 HydrophobicContact CB-CD1 3.53Å; L157-I240 HydrophobicContact CB-CG2 4.48Å; L157-I240 HydrophobicContact CD1-CD1 4.14Å; L157-I240 HydrophobicContact CG-CD1 4.49Å; A161-I240 HydrophobicContact CB-CG2 4.17Å; M166-I240 HydrophobicContact CE-CG2 4.31Å; M236-I240 VanDerWaalsContact O-CG1 3.24Å; M236-I240 WeakPolarHBondContact O-CG1 3.19Å; M236-I240 PolarHBondContact O-N 2.91Å; I237-I240 PolarHBondContact O-N 3.48Å; I240-G242 VanDerWaalsContact C-N 3.33Å; I240-G242 PolarHBondContact O-N 3.34Å; I240-S243 PolarHBondContact O-N 3.39Å; I240-R244 WeakPolarHBondContact O-CB 3.36Å; I240-R244 PolarHBondContact O-N 3.11Å; I240-R244 VanDerWaalsContact O-N 3.08Å; I240-P250 HydrophobicContact CB-CB 4.28Å; I240-P250 HydrophobicContact CG1-CB 4.16Å; I240-P250 HydrophobicContact CG2-CB 3.98Å; I240-P250 HydrophobicContact CG2-CG 4.45Å; I240-A254 HydrophobicContact CD1-CB 4.33Å; I240-A254 HydrophobicContact CG1-CB 3.81Å |
| 241 | I | 86.8 | Confident | 84.5 | Confident | 46 Ų | 46 | 49.7 Ų | 49.7 | 24% | 0.236 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -64.1 | -40.7 | 177 | -63.9 | 169.2 | 0 | 0 | 0 | 110.7 | L172 I176 I237 K245 | L172-I241 HydrophobicContact CD1-CD1 4.32Å; L172-I241 HydrophobicContact CD1-CG1 4.38Å; L172-I241 HydrophobicContact CD2-CD1 4.36Å; I176-I241 HydrophobicContact CD1-CD1 3.95Å; I237-I241 HydrophobicContact CG2-CD1 3.65Å; I237-I241 HydrophobicContact CG2-CG1 4.42Å; I237-I241 WeakPolarHBondContact O-CB 3.39Å; I237-I241 VanDerWaalsContact O-CG1 3.28Å; I237-I241 WeakPolarHBondContact O-CG1 3.43Å; I237-I241 PolarHBondContact O-N 3.05Å; I241-K245 WeakPolarHBondContact O-CG 3.39Å; I241-K245 PolarHBondContact O-N 3.36Å; I241-K245 VanDerWaalsContact O-N 3.15Å |
| 242 | G | 87 | Confident | 83.3 | Confident | 27 Ų | 27 | 51 Ų | 51 | 28% | 0.278 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -64 | -47.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | G238 V239 I240 R244 K245 I246 | G238-G242 PolarHBondContact O-N 2.95Å; V239-G242 PolarHBondContact O-N 2.77Å; I240-G242 VanDerWaalsContact C-N 3.33Å; I240-G242 PolarHBondContact O-N 3.34Å; G242-R244 VanDerWaalsContact C-N 3.31Å; G242-R244 PolarHBondContact O-N 3.48Å; G242-K245 PolarHBondContact O-N 3.46Å; G242-K245 VanDerWaalsContact O-N 3.14Å; G242-I246 WeakPolarHBondContact O-CG1 3.32Å; G242-I246 PolarHBondContact O-N 2.68Å; G242-I246 VanDerWaalsContact O-N 3.17Å |
| 243 | S | 84.2 | Confident | 82.7 | Confident | 10 Ų | 10 | 53 Ų | 53 | 7% | 0.07 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -58.9 | -44.6 | 178.3 | -57.9 | 0 | 0 | 0 | 0 | 110.7 | V239 I240 K245 I246 G247 I248 | V239-S243 VanDerWaalsContact O-CB 3.27Å; V239-S243 WeakPolarHBondContact O-CB 3.4Å; V239-S243 PolarHBondContact O-N 3.36Å; V239-S243 PolarHBondContact O-OG 3.03Å; I240-S243 PolarHBondContact O-N 3.39Å; S243-K245 VanDerWaalsContact C-N 3.35Å; S243-K245 PolarHBondContact O-N 2.55Å; S243-I246 CarbonylContact O-C 3.57Å; S243-I246 PolarHBondContact O-N 3.47Å; S243-I246 VanDerWaalsContact O-N 3.12Å; S243-G247 PolarHBondContact O-N 3.02Å; S243-I248 CarbonylContact C-O 3.5Å; S243-I248 VanDerWaalsContact C-O 3.28Å; S243-I248 WeakPolarHBondContact CB-O 3.29Å; S243-I248 PolarHBondContact O-N 3.38Å; S243-I248 VanDerWaalsContact O-O 3.12Å |
| 244 | R | 79.8 | Confident | 82.2 | Confident | 88 Ų | 88 | 53 Ų | 53 | 33% | 0.332 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -58.5 | -42.7 | 175.7 | -165.3 | -178.3 | -153 | -132.5 | -5.9 | 112.9 | A161 M166 D167 I240 G242 I246 G247 | A161-R244 PolarHBondContact O-NE 3.37Å; A161-R244 PolarHBondContact O-NH2 3.26Å; M166-R244 PolarHBondContact O-NH1 2.94Å; D167-R244 IonicContact OD1-CZ 2.91Å; D167-R244 IonicContact OD1-NH1 2.76Å; D167-R244 PolarHBondContact OD1-NH1 3.14Å; D167-R244 IonicContact OD1-NH2 3.97Å; D167-R244 PolarHBondContact OD1-NH2 2.94Å; I240-R244 WeakPolarHBondContact O-CB 3.36Å; I240-R244 PolarHBondContact O-N 3.11Å; I240-R244 VanDerWaalsContact O-N 3.08Å; G242-R244 VanDerWaalsContact C-N 3.31Å; G242-R244 PolarHBondContact O-N 3.48Å; R244-I246 VanDerWaalsContact C-N 3.26Å; R244-I246 PolarHBondContact O-N 3.1Å; R244-G247 PolarHBondContact O-N 3.35Å |
| 245 | K | 83.7 | Confident | 81.4 | Confident | 176 Ų | 176 | 49.7 Ų | 49.7 | 77% | 0.765 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -66.2 | -28.3 | 178.4 | -75 | 179 | 178.6 | -177.5 | 0 | 113.2 | I241 G242 S243 | I241-K245 WeakPolarHBondContact O-CG 3.39Å; I241-K245 PolarHBondContact O-N 3.36Å; I241-K245 VanDerWaalsContact O-N 3.15Å; G242-K245 PolarHBondContact O-N 3.46Å; G242-K245 VanDerWaalsContact O-N 3.14Å; S243-K245 VanDerWaalsContact C-N 3.35Å; S243-K245 PolarHBondContact O-N 2.55Å |
| 246 | I | 85.4 | Confident | 80.8 | Confident | 129 Ų | 129 | 47.7 Ų | 47.7 | 66% | 0.662 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -91.6 | -7.7 | 179.5 | -56.9 | 166.1 | 0 | 0 | 0 | 110.9 | G242 S243 R244 I248 | G242-I246 WeakPolarHBondContact O-CG1 3.32Å; G242-I246 PolarHBondContact O-N 2.68Å; G242-I246 VanDerWaalsContact O-N 3.17Å; S243-I246 CarbonylContact O-C 3.57Å; S243-I246 PolarHBondContact O-N 3.47Å; S243-I246 VanDerWaalsContact O-N 3.12Å; R244-I246 VanDerWaalsContact C-N 3.26Å; R244-I246 PolarHBondContact O-N 3.1Å; I246-I248 VanDerWaalsContact C-N 3.3Å; I246-I248 HydrophobicContact CB-CD1 4.44Å; I246-I248 HydrophobicContact CB-CG1 4.42Å; I246-I248 HydrophobicContact CG2-CD1 3.87Å; I246-I248 HydrophobicContact CG2-CG1 4.03Å |
| 247 | G | 75.7 | Confident | 80.6 | Confident | 71 Ų | 71 | 49.2 Ų | 49.2 | 73% | 0.732 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.1 | 15.1 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | S243 R244 | S243-G247 PolarHBondContact O-N 3.02Å; R244-G247 PolarHBondContact O-N 3.35Å |
| 248 | I | 73.1 | Confident | 80.5 | Confident | 80 Ų | 80 | 48.7 Ų | 48.7 | 41% | 0.41 | 28% | 0.281 | S | S | . | . | trans | -87.6 | 134.1 | 173.6 | -58.7 | 172.9 | 0 | 0 | 0 | 107.9 | S243 I246 P250 V253 | S243-I248 CarbonylContact C-O 3.5Å; S243-I248 VanDerWaalsContact C-O 3.28Å; S243-I248 WeakPolarHBondContact CB-O 3.29Å; S243-I248 PolarHBondContact O-N 3.38Å; S243-I248 VanDerWaalsContact O-O 3.12Å; I246-I248 VanDerWaalsContact C-N 3.3Å; I246-I248 HydrophobicContact CB-CD1 4.44Å; I246-I248 HydrophobicContact CB-CG1 4.42Å; I246-I248 HydrophobicContact CG2-CD1 3.87Å; I246-I248 HydrophobicContact CG2-CG1 4.03Å; I248-P250 WeakPolarHBondContact O-CD 3.38Å; I248-P250 VanDerWaalsContact O-N 3.14Å; I248-V253 HydrophobicContact CG2-CG2 3.59Å | ||
| 249 | N | 71.6 | Confident | 80.2 | Confident | 55 Ų | 55 | 46.8 Ų | 46.8 | 29% | 0.294 | 26% | 0.261 | S | S | . | . | trans | -59.3 | 118.9 | 174.9 | -175.2 | -16.2 | 0 | 0 | 0 | 109.4 | N162 D251 N252 | N162-N249 PolarHBondContact ND2-OD1 3.43Å; N249-D251 PolarHBondContact O-N 3.15Å; N249-D251 VanDerWaalsContact O-N 3.16Å; N249-D251 WeakPolarHBondContact OD1-CB 3.13Å; N249-D251 PolarHBondContact OD1-N 3.04Å; N249-D251 PolarHBondContact OD1-OD2 3.07Å; N249-N252 PolarHBondContact O-N 2.93Å; N249-N252 VanDerWaalsContact O-N 3.14Å | ||
| 250 | P | 71.6 | Confident | 80 | Confident | 3 Ų | 3 | 46 Ų | 46 | 2% | 0.019 | 26% | 0.256 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.5 | -27.6 | -178.5 | 24.2 | -35.1 | 0 | 0 | 0 | 113.1 | A161 I240 I248 N252 V253 A254 | A161-P250 HydrophobicContact CB-CG 4.28Å; I240-P250 HydrophobicContact CB-CB 4.28Å; I240-P250 HydrophobicContact CG1-CB 4.16Å; I240-P250 HydrophobicContact CG2-CB 3.98Å; I240-P250 HydrophobicContact CG2-CG 4.45Å; I248-P250 WeakPolarHBondContact O-CD 3.38Å; I248-P250 VanDerWaalsContact O-N 3.14Å; P250-N252 VanDerWaalsContact C-N 3.26Å; P250-N252 PolarHBondContact O-N 3.44Å; P250-V253 PolarHBondContact O-N 3.31Å; P250-A254 WeakPolarHBondContact O-CB 3.11Å; P250-A254 PolarHBondContact O-N 3.39Å |
| 251 | D | 69 | Low | 80.3 | Confident | 53 Ų | 53 | 48.7 Ų | 48.7 | 28% | 0.283 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.4 | -33.2 | 178.1 | -69.6 | -42.9 | 0 | 0 | 0 | 113.4 | S158 N162 N249 V253 | S158-D251 WeakPolarHBondContact CB-OD1 3.25Å; S158-D251 PolarHBondContact OG-OD1 2.78Å; N162-D251 PolarHBondContact ND2-OD2 3.1Å; N162-D251 VanDerWaalsContact ND2-OD2 3.14Å; N249-D251 PolarHBondContact O-N 3.15Å; N249-D251 VanDerWaalsContact O-N 3.16Å; N249-D251 WeakPolarHBondContact OD1-CB 3.13Å; N249-D251 PolarHBondContact OD1-N 3.04Å; N249-D251 PolarHBondContact OD1-OD2 3.07Å; D251-V253 VanDerWaalsContact C-N 3.28Å; D251-V253 PolarHBondContact O-N 3.45Å |
| 252 | N | 69.7 | Low | 80.5 | Confident | 90 Ų | 90 | 46.5 Ų | 46.5 | 48% | 0.481 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -76.8 | -17.1 | -177.1 | -66.8 | -14.2 | 0 | 0 | 0 | 113 | N249 P250 | N249-N252 PolarHBondContact O-N 2.93Å; N249-N252 VanDerWaalsContact O-N 3.14Å; P250-N252 VanDerWaalsContact C-N 3.26Å; P250-N252 PolarHBondContact O-N 3.44Å |
| 253 | V | 78.3 | Confident | 80.7 | Confident | 43 Ų | 43 | 45.7 Ų | 45.7 | 26% | 0.261 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -119.2 | -37.1 | -171.9 | -175.3 | 0 | 0 | 0 | 0 | 111.4 | V239 I248 P250 D251 P256 I257 | V239-V253 HydrophobicContact CG1-CB 4.36Å; V239-V253 HydrophobicContact CG1-CG1 3.83Å; I248-V253 HydrophobicContact CG2-CG2 3.59Å; P250-V253 PolarHBondContact O-N 3.31Å; D251-V253 VanDerWaalsContact C-N 3.28Å; D251-V253 PolarHBondContact O-N 3.45Å; V253-P256 WeakPolarHBondContact O-CD 3.45Å; V253-I257 HydrophobicContact CG1-CD1 3.55Å; V253-I257 HydrophobicContact CG1-CG1 4.41Å; V253-I257 WeakPolarHBondContact O-CB 3.4Å; V253-I257 WeakPolarHBondContact O-CD1 3.41Å; V253-I257 WeakPolarHBondContact O-CG1 3.14Å; V253-I257 PolarHBondContact O-N 3.1Å |
| 254 | A | 81.8 | Confident | 81.2 | Confident | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -68.5 | -55.9 | -175.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | A154 M236 V239 I240 P250 I257 A258 | A154-A254 HydrophobicContact CB-CB 4.15Å; M236-A254 HydrophobicContact CE-CB 3.46Å; M236-A254 VanDerWaalsContact CE-CB 3.46Å; M236-A254 WeakPolarHBondContact CE-O 3.49Å; V239-A254 HydrophobicContact CG1-CB 4.22Å; I240-A254 HydrophobicContact CD1-CB 4.33Å; I240-A254 HydrophobicContact CG1-CB 3.81Å; P250-A254 WeakPolarHBondContact O-CB 3.11Å; P250-A254 PolarHBondContact O-N 3.39Å; A254-I257 PolarHBondContact O-N 3.34Å; A254-A258 WeakPolarHBondContact O-CB 3.48Å; A254-A258 PolarHBondContact O-N 2.91Å |
| 255 | T | 76.3 | Confident | 81.9 | Confident | 38 Ų | 38 | 45.2 Ų | 45.2 | 23% | 0.233 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -56.1 | -43.8 | -177.1 | -49.9 | 0 | 0 | 0 | 0 | 113 | M151 A258 A259 | M151-T255 HydrophobicContact SD-CG2 4.34Å; T255-A258 WeakPolarHBondContact O-CB 3.35Å; T255-A258 PolarHBondContact O-N 3.48Å; T255-A259 WeakPolarHBondContact O-CB 3.49Å; T255-A259 PolarHBondContact O-N 2.89Å |
| 256 | P | 79.7 | Confident | 82.4 | Confident | 12 Ų | 12 | 37 Ų | 37 | 8% | 0.078 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -71 | -35.2 | 179.4 | -23.5 | 39.2 | 0 | 0 | 0 | 113.8 | P105 L108 V253 A259 S260 | P105-P256 HydrophobicContact CB-CB 3.9Å; P105-P256 HydrophobicContact CB-CG 3.33Å; P105-P256 HydrophobicContact CG-CG 3.88Å; L108-P256 HydrophobicContact CD2-CB 4.41Å; V253-P256 WeakPolarHBondContact O-CD 3.45Å; P256-A259 WeakPolarHBondContact O-CB 3.34Å; P256-A259 PolarHBondContact O-N 2.94Å; P256-S260 WeakPolarHBondContact O-CB 3.26Å; P256-S260 PolarHBondContact O-N 3.28Å; P256-S260 PolarHBondContact O-OG 3.29Å |
| 257 | I | 85.4 | Confident | 82.9 | Confident | 32 Ų | 32 | 31 Ų | 31 | 16% | 0.164 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -69 | -41.5 | 174.5 | -69.2 | 177.6 | 0 | 0 | 0 | 110.4 | L108 I235 M236 V239 V253 A254 A259 S260 L261 | L108-I257 HydrophobicContact CD2-CG1 3.86Å; I235-I257 HydrophobicContact CG2-CG2 4.37Å; M236-I257 HydrophobicContact SD-CG2 4.38Å; V239-I257 HydrophobicContact CG1-CD1 4.02Å; V239-I257 HydrophobicContact CG2-CD1 3.95Å; V239-I257 HydrophobicContact CG2-CG2 4.17Å; V253-I257 HydrophobicContact CG1-CD1 3.55Å; V253-I257 HydrophobicContact CG1-CG1 4.41Å; V253-I257 WeakPolarHBondContact O-CB 3.4Å; V253-I257 WeakPolarHBondContact O-CD1 3.41Å; V253-I257 WeakPolarHBondContact O-CG1 3.14Å; V253-I257 PolarHBondContact O-N 3.1Å; A254-I257 PolarHBondContact O-N 3.34Å; I257-A259 VanDerWaalsContact C-N 3.28Å; I257-A259 PolarHBondContact O-N 2.87Å; I257-S260 PolarHBondContact O-N 2.74Å; I257-S260 PolarHBondContact O-OG 2.97Å; I257-L261 HydrophobicContact CG2-CD1 3.62Å; I257-L261 HydrophobicContact CG2-CG 4.15Å; I257-L261 WeakPolarHBondContact O-CB 3.28Å; I257-L261 PolarHBondContact O-N 2.8Å |
| 258 | A | 86.3 | Confident | 83.9 | Confident | 1 Ų | 1 | 29.8 Ų | 29.8 | 1% | 0.008 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58.1 | -45.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | K146 E150 M236 A254 T255 G262 | K146-A258 PolarHBondContact NZ-O 2.83Å; E150-A258 HydrophobicContact CB-CB 4.44Å; M236-A258 HydrophobicContact CE-CB 3.84Å; M236-A258 HydrophobicContact CG-CB 4.19Å; M236-A258 VanDerWaalsContact SD-CA 3.57Å; M236-A258 HydrophobicContact SD-CB 3.54Å; M236-A258 VanDerWaalsContact SD-CB 3.54Å; A254-A258 WeakPolarHBondContact O-CB 3.48Å; A254-A258 PolarHBondContact O-N 2.91Å; T255-A258 WeakPolarHBondContact O-CB 3.35Å; T255-A258 PolarHBondContact O-N 3.48Å; A258-G262 VanDerWaalsContact O-CA 3.28Å; A258-G262 WeakPolarHBondContact O-CA 3.15Å; A258-G262 PolarHBondContact O-N 2.97Å |
| 259 | A | 84.1 | Confident | 85 | Confident | 2 Ų | 2 | 28 Ų | 28 | 2% | 0.017 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -57.8 | -57.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | A109 K146 T255 P256 I257 N362 | A109-A259 HydrophobicContact CB-CB 3.77Å; K146-A259 VanDerWaalsContact NZ-CA 3.26Å; K146-A259 PolarHBondContact NZ-O 3.23Å; T255-A259 WeakPolarHBondContact O-CB 3.49Å; T255-A259 PolarHBondContact O-N 2.89Å; P256-A259 WeakPolarHBondContact O-CB 3.34Å; P256-A259 PolarHBondContact O-N 2.94Å; I257-A259 VanDerWaalsContact C-N 3.28Å; I257-A259 PolarHBondContact O-N 2.87Å; A259-N362 WeakPolarHBondContact CB-OD1 3.36Å |
| 260 | S | 85.7 | Confident | 86.3 | Confident | 8 Ų | 8 | 25.5 Ų | 25.5 | 6% | 0.056 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -66.1 | -53.9 | -172.1 | 71.7 | 0 | 0 | 0 | 0 | 113.5 | L108 G112 P256 I257 G262 | L108-S260 WeakPolarHBondContact O-CB 3.48Å; G112-S260 WeakPolarHBondContact CA-O 3.38Å; P256-S260 WeakPolarHBondContact O-CB 3.26Å; P256-S260 PolarHBondContact O-N 3.28Å; P256-S260 PolarHBondContact O-OG 3.29Å; I257-S260 PolarHBondContact O-N 2.74Å; I257-S260 PolarHBondContact O-OG 2.97Å; S260-G262 VanDerWaalsContact C-N 3.28Å |
| 261 | L | 90.8 | Very high | 87.5 | Confident | 59 Ų | 59 | 25.4 Ų | 25.4 | 31% | 0.309 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -74 | -29.7 | -176.9 | -68.4 | -179 | 0 | 0 | 0 | 111.1 | L232 I235 I257 D263 I265 | L232-L261 HydrophobicContact CD2-CB 4.08Å; I235-L261 HydrophobicContact CD1-CD1 4.36Å; I235-L261 HydrophobicContact CG2-CD1 3.96Å; I257-L261 HydrophobicContact CG2-CD1 3.62Å; I257-L261 HydrophobicContact CG2-CG 4.15Å; I257-L261 WeakPolarHBondContact O-CB 3.28Å; I257-L261 PolarHBondContact O-N 2.8Å; L261-D263 PolarHBondContact O-N 2.93Å; L261-I265 HydrophobicContact CB-CD1 4.09Å; L261-I265 VanDerWaalsContact O-CB 3.23Å; L261-I265 WeakPolarHBondContact O-CB 3.49Å; L261-I265 VanDerWaalsContact O-CG1 3.24Å; L261-I265 WeakPolarHBondContact O-CG1 3.44Å; L261-I265 PolarHBondContact O-N 3.26Å |
| 262 | G | 91 | Very high | 88.8 | Confident | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -61 | -46.8 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | K146 A258 S260 T266 | K146-G262 WeakPolarHBondContact CD-O 3.25Å; K146-G262 VanDerWaalsContact CE-CA 3.49Å; A258-G262 VanDerWaalsContact O-CA 3.28Å; A258-G262 WeakPolarHBondContact O-CA 3.15Å; A258-G262 PolarHBondContact O-N 2.97Å; S260-G262 VanDerWaalsContact C-N 3.28Å; G262-T266 WeakPolarHBondContact O-CB 3.11Å; G262-T266 PolarHBondContact O-N 2.95Å; G262-T266 PolarHBondContact O-OG1 3.42Å |
| 263 | D | 91.3 | Very high | 90.1 | Very high | 10 Ų | 10 | 21.8 Ų | 21.8 | 5% | 0.053 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -71.4 | -43.4 | -174.4 | -74.4 | -30.1 | 0 | 0 | 0 | 109.4 | T113 A116 L143 K146 L261 L267 | T113-D263 WeakPolarHBondContact CG2-OD2 2.88Å; A116-D263 HydrophobicContact CB-CB 3.74Å; L143-D263 HydrophobicContact CD2-CB 4.08Å; K146-D263 WeakPolarHBondContact CD-OD1 3.19Å; K146-D263 WeakPolarHBondContact CE-OD1 3.42Å; K146-D263 IonicContact NZ-OD1 2.6Å; L261-D263 PolarHBondContact O-N 2.93Å; D263-L267 VanDerWaalsContact O-CB 3.24Å; D263-L267 WeakPolarHBondContact O-CB 3.34Å; D263-L267 PolarHBondContact O-N 3.17Å |
| 264 | L | 94.2 | Very high | 91 | Very high | 52 Ų | 52 | 19.8 Ų | 19.8 | 27% | 0.272 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -59.2 | -51.7 | 177.1 | 178.1 | 59.6 | 0 | 0 | 0 | 112 | A115 V119 A268 | A115-L264 HydrophobicContact CB-CD1 4.01Å; A115-L264 HydrophobicContact CB-CD2 4.08Å; V119-L264 HydrophobicContact CG2-CD1 3.73Å; L264-A268 WeakPolarHBondContact O-CB 3.38Å; L264-A268 PolarHBondContact O-N 3.02Å |
| 265 | I | 95 | Very high | 91.6 | Very high | 36 Ų | 36 | 23.5 Ų | 23.5 | 19% | 0.185 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -66.4 | -45.1 | -178.1 | -71 | 175.7 | 0 | 0 | 0 | 110.5 | V231 L232 I235 L261 L267 A268 L269 | V231-I265 HydrophobicContact CG1-CD1 4.2Å; V231-I265 HydrophobicContact CG1-CG2 4.42Å; L232-I265 HydrophobicContact CD2-CB 4.33Å; L232-I265 HydrophobicContact CD2-CD1 3.79Å; L232-I265 HydrophobicContact CG-CG2 4.41Å; I235-I265 HydrophobicContact CD1-CD1 3.94Å; L261-I265 HydrophobicContact CB-CD1 4.09Å; L261-I265 VanDerWaalsContact O-CB 3.23Å; L261-I265 WeakPolarHBondContact O-CB 3.49Å; L261-I265 VanDerWaalsContact O-CG1 3.24Å; L261-I265 WeakPolarHBondContact O-CG1 3.44Å; L261-I265 PolarHBondContact O-N 3.26Å; I265-L267 PolarHBondContact O-N 3.32Å; I265-A268 PolarHBondContact O-N 3.48Å; I265-L269 HydrophobicContact CG2-CD1 3.63Å; I265-L269 HydrophobicContact CG2-CG 4.26Å; I265-L269 VanDerWaalsContact O-CB 3.27Å; I265-L269 WeakPolarHBondContact O-CB 3.32Å; I265-L269 VanDerWaalsContact O-CG 3.25Å; I265-L269 WeakPolarHBondContact O-CG 3.39Å; I265-L269 PolarHBondContact O-N 3.1Å |
| 266 | T | 94.6 | Very high | 92.5 | Very high | 4 Ų | 4 | 23.2 Ų | 23.2 | 3% | 0.025 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -62.1 | -46.1 | -178.7 | -56.8 | 0 | 0 | 0 | 0 | 110.6 | L142 L143 T224 A228 G262 L270 | L142-T266 HydrophobicContact CB-CG2 3.87Å; L143-T266 HydrophobicContact CD2-CG2 4.12Å; T224-T266 HydrophobicContact CG2-CG2 4.24Å; T224-T266 WeakPolarHBondContact CG2-O 3.46Å; A228-T266 HydrophobicContact CB-CG2 4.49Å; G262-T266 WeakPolarHBondContact O-CB 3.11Å; G262-T266 PolarHBondContact O-N 2.95Å; G262-T266 PolarHBondContact O-OG1 3.42Å; T266-L270 WeakPolarHBondContact O-CB 3.41Å; T266-L270 PolarHBondContact O-N 2.99Å |
| 267 | L | 95.1 | Very high | 93.2 | Very high | 1 Ų | 1 | 23.3 Ų | 23.3 | 1% | 0.005 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -71.5 | -40.1 | -179.5 | -174.6 | 64.5 | 0 | 0 | 0 | 112.8 | A116 V119 L120 V139 L143 D263 I265 L269 L270 S271 | A116-L267 HydrophobicContact CB-CD2 4.42Å; A116-L267 WeakPolarHBondContact O-CD2 3.49Å; V119-L267 HydrophobicContact CB-CD2 4.11Å; V119-L267 HydrophobicContact CG1-CD2 4.04Å; V119-L267 HydrophobicContact CG1-CG 4.02Å; L120-L267 HydrophobicContact CB-CD2 3.67Å; L120-L267 HydrophobicContact CD1-CD1 4.08Å; L120-L267 HydrophobicContact CD1-CD2 4.34Å; L120-L267 HydrophobicContact CG-CD2 4.44Å; V139-L267 HydrophobicContact CG1-CD1 4.01Å; V139-L267 HydrophobicContact CG2-CD1 3.75Å; L143-L267 HydrophobicContact CD2-CB 4.4Å; D263-L267 VanDerWaalsContact O-CB 3.24Å; D263-L267 WeakPolarHBondContact O-CB 3.34Å; D263-L267 PolarHBondContact O-N 3.17Å; I265-L267 PolarHBondContact O-N 3.32Å; L267-L269 VanDerWaalsContact C-N 3.33Å; L267-L269 PolarHBondContact O-N 3.17Å; L267-L270 HydrophobicContact CD1-CD2 4.49Å; L267-L270 PolarHBondContact O-N 3.11Å; L267-S271 WeakPolarHBondContact O-CB 3.48Å; L267-S271 PolarHBondContact O-N 3.41Å; L267-S271 PolarHBondContact O-OG 3.19Å |
| 268 | A | 96.8 | Very high | 93.6 | Very high | 46 Ų | 46 | 23.7 Ų | 23.7 | 38% | 0.38 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -62.3 | -42.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | L264 I265 G272 | L264-A268 WeakPolarHBondContact O-CB 3.38Å; L264-A268 PolarHBondContact O-N 3.02Å; I265-A268 PolarHBondContact O-N 3.48Å; A268-G272 PolarHBondContact O-N 3.02Å |
| 269 | L | 97.2 | Very high | 93.8 | Very high | 44 Ų | 44 | 27 Ų | 27 | 23% | 0.23 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -66.3 | -45.5 | 174.6 | -74.1 | 172.6 | 0 | 0 | 0 | 111.5 | T224 I227 A228 I265 L267 S271 G272 I273 | T224-L269 HydrophobicContact CG2-CB 4.03Å; I227-L269 HydrophobicContact CB-CD1 4.24Å; I227-L269 HydrophobicContact CG2-CD1 3.77Å; I227-L269 HydrophobicContact CG2-CD2 4.02Å; A228-L269 HydrophobicContact CB-CD1 3.79Å; I265-L269 HydrophobicContact CG2-CD1 3.63Å; I265-L269 HydrophobicContact CG2-CG 4.26Å; I265-L269 VanDerWaalsContact O-CB 3.27Å; I265-L269 WeakPolarHBondContact O-CB 3.32Å; I265-L269 VanDerWaalsContact O-CG 3.25Å; I265-L269 WeakPolarHBondContact O-CG 3.39Å; I265-L269 PolarHBondContact O-N 3.1Å; L267-L269 VanDerWaalsContact C-N 3.33Å; L267-L269 PolarHBondContact O-N 3.17Å; L269-S271 VanDerWaalsContact C-N 3.27Å; L269-S271 PolarHBondContact O-N 2.74Å; L269-G272 PolarHBondContact O-N 3.08Å; L269-I273 HydrophobicContact CB-CD1 4.22Å; L269-I273 HydrophobicContact CD2-CD1 4.5Å; L269-I273 WeakPolarHBondContact O-CB 3.37Å; L269-I273 WeakPolarHBondContact O-CD1 3.3Å; L269-I273 WeakPolarHBondContact O-CG1 3.14Å; L269-I273 PolarHBondContact O-N 3.08Å |
| 270 | L | 97.3 | Very high | 94.1 | Very high | 1 Ų | 1 | 30.9 Ų | 30.9 | 1% | 0.005 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -54 | -50.3 | 176.2 | -179.4 | 58.8 | 0 | 0 | 0 | 110.4 | V135 L138 V139 L142 T224 T266 L267 S274 | V135-L270 HydrophobicContact CG1-CD2 4.23Å; V135-L270 HydrophobicContact CG1-CG 4.31Å; L138-L270 HydrophobicContact CD2-CD1 3.71Å; L138-L270 HydrophobicContact CG-CD1 4.43Å; V139-L270 HydrophobicContact CG2-CD2 3.67Å; L142-L270 HydrophobicContact CD1-CD1 3.88Å; L142-L270 HydrophobicContact CD1-CD2 4.18Å; L142-L270 HydrophobicContact CD1-CG 4.46Å; T224-L270 HydrophobicContact CG2-CB 3.87Å; T224-L270 WeakPolarHBondContact OG1-CA 3.2Å; T266-L270 WeakPolarHBondContact O-CB 3.41Å; T266-L270 PolarHBondContact O-N 2.99Å; L267-L270 HydrophobicContact CD1-CD2 4.49Å; L267-L270 PolarHBondContact O-N 3.11Å; L270-S274 WeakPolarHBondContact O-CB 3.31Å; L270-S274 PolarHBondContact O-N 3.36Å; L270-S274 PolarHBondContact O-OG 2.65Å |
| 271 | S | 97.1 | Very high | 93.9 | Very high | 1 Ų | 1 | 33 Ų | 33 | 1% | 0.007 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -65.9 | -48.1 | -175.9 | -52.5 | 0 | 0 | 0 | 0 | 111.3 | V123 L267 L269 W275 | V123-S271 WeakPolarHBondContact CG2-OG 3.29Å; L267-S271 WeakPolarHBondContact O-CB 3.48Å; L267-S271 PolarHBondContact O-N 3.41Å; L267-S271 PolarHBondContact O-OG 3.19Å; L269-S271 VanDerWaalsContact C-N 3.27Å; L269-S271 PolarHBondContact O-N 2.74Å; S271-W275 WeakPolarHBondContact O-CB 3.44Å; S271-W275 PolarHBondContact O-N 3.41Å |
| 272 | G | 97.2 | Very high | 93.3 | Very high | 37 Ų | 37 | 37.2 Ų | 37.2 | 38% | 0.381 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -65.2 | -42.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | A268 L269 G276 | A268-G272 PolarHBondContact O-N 3.02Å; L269-G272 PolarHBondContact O-N 3.08Å; G272-G276 PolarHBondContact O-N 3.02Å |
| 273 | I | 96.8 | Very high | 92.9 | Very high | 31 Ų | 31 | 44.3 Ų | 44.3 | 16% | 0.159 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -69.5 | -45.5 | 179 | -66.2 | 167.1 | 0 | 0 | 0 | 110.2 | A223 I227 L269 W275 G276 L277 | A223-I273 HydrophobicContact CB-CD1 4.2Å; A223-I273 HydrophobicContact CB-CG2 4.08Å; I227-I273 HydrophobicContact CD1-CD1 3.97Å; L269-I273 HydrophobicContact CB-CD1 4.22Å; L269-I273 HydrophobicContact CD2-CD1 4.5Å; L269-I273 WeakPolarHBondContact O-CB 3.37Å; L269-I273 WeakPolarHBondContact O-CD1 3.3Å; L269-I273 WeakPolarHBondContact O-CG1 3.14Å; L269-I273 PolarHBondContact O-N 3.08Å; I273-W275 PolarHBondContact O-N 3.13Å; I273-G276 PolarHBondContact O-N 3.43Å; I273-L277 HydrophobicContact CG2-CD1 3.71Å; I273-L277 HydrophobicContact CG2-CG 4.18Å; I273-L277 VanDerWaalsContact O-CB 3.31Å; I273-L277 WeakPolarHBondContact O-CB 3.37Å; I273-L277 VanDerWaalsContact O-CG 3.22Å; I273-L277 WeakPolarHBondContact O-CG 3.21Å; I273-L277 PolarHBondContact O-N 2.96Å |
| 274 | S | 96.5 | Very high | 92.5 | Very high | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61.2 | -46.4 | 178.8 | -55.8 | 0 | 0 | 0 | 0 | 111 | S220 L270 Y278 | S220-S274 VanDerWaalsContact CB-OG 3.24Å; S220-S274 WeakPolarHBondContact CB-OG 3.39Å; L270-S274 WeakPolarHBondContact O-CB 3.31Å; L270-S274 PolarHBondContact O-N 3.36Å; L270-S274 PolarHBondContact O-OG 2.65Å; S274-Y278 WeakPolarHBondContact O-CB 3.32Å; S274-Y278 PolarHBondContact O-N 2.88Å |
| 275 | W | 96 | Very high | 91.9 | Very high | 79 Ų | 79 | 59.4 Ų | 59.4 | 30% | 0.299 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -61 | -50.5 | 175.5 | 175.3 | -104.7 | 0 | 0 | 0 | 112.7 | W126 E127 V128 S271 I273 L277 Y278 L279 | W126-W275 HydrophobicContact CB-CE3 4.16Å; W126-W275 HydrophobicContact CB-CZ3 4.31Å; W126-W275 HydrophobicContact CE3-CB 3.72Å; W126-W275 HydrophobicContact CE3-CD2 4.07Å; W126-W275 HydrophobicContact CE3-CE3 4.21Å; W126-W275 AromaticContact CE3-CG 3.87Å; W126-W275 HydrophobicContact CE3-CG 3.87Å; W126-W275 HydrophobicContact CZ3-CB 3.7Å; W126-W275 AromaticContact CZ3-CG 3.9Å; W126-W275 HydrophobicContact CZ3-CG 3.9Å; E127-W275 HydrophobicContact CB-CH2 4.38Å; E127-W275 HydrophobicContact CB-CZ3 3.73Å; V128-W275 HydrophobicContact CB-CE3 4.36Å; V128-W275 HydrophobicContact CG1-CB 4.27Å; V128-W275 HydrophobicContact CG1-CE3 4.07Å; S271-W275 WeakPolarHBondContact O-CB 3.44Å; S271-W275 PolarHBondContact O-N 3.41Å; I273-W275 PolarHBondContact O-N 3.13Å; W275-L277 PolarHBondContact O-N 3.31Å; W275-Y278 PolarHBondContact O-N 3.01Å; W275-L279 HydrophobicContact CD2-CD1 4.34Å; W275-L279 HydrophobicContact CD2-CG 4.35Å; W275-L279 HydrophobicContact CH2-CD2 4.16Å; W275-L279 HydrophobicContact CZ2-CD1 3.75Å; W275-L279 HydrophobicContact CZ2-CD2 3.93Å; W275-L279 HydrophobicContact CZ2-CG 4.06Å; W275-L279 VanDerWaalsContact NE1-CD1 3.3Å; W275-L279 PolarHBondContact O-N 3.4Å |
| 276 | G | 94.6 | Very high | 91.5 | Very high | 31 Ų | 31 | 66.2 Ų | 66.2 | 32% | 0.32 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60.7 | -45 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | G272 I273 L279 E280 | G272-G276 PolarHBondContact O-N 3.02Å; I273-G276 PolarHBondContact O-N 3.43Å; G276-L279 PolarHBondContact O-N 3.05Å; G276-E280 WeakPolarHBondContact O-CG 3.38Å; G276-E280 PolarHBondContact O-N 2.92Å |
| 277 | L | 94.9 | Very high | 91.4 | Very high | 15 Ų | 15 | 67.5 Ų | 67.5 | 8% | 0.079 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.9 | -41.7 | 175.3 | -70.3 | 177.4 | 0 | 0 | 0 | 111.6 | L216 A219 I273 W275 L279 E280 L281 I287 Y288 V291 | L216-L277 HydrophobicContact CD1-CB 3.6Å; L216-L277 HydrophobicContact CD1-CD1 4.37Å; A219-L277 HydrophobicContact CB-CD1 3.74Å; I273-L277 HydrophobicContact CG2-CD1 3.71Å; I273-L277 HydrophobicContact CG2-CG 4.18Å; I273-L277 VanDerWaalsContact O-CB 3.31Å; I273-L277 WeakPolarHBondContact O-CB 3.37Å; I273-L277 VanDerWaalsContact O-CG 3.22Å; I273-L277 WeakPolarHBondContact O-CG 3.21Å; I273-L277 PolarHBondContact O-N 2.96Å; W275-L277 PolarHBondContact O-N 3.31Å; L277-L279 PolarHBondContact O-N 3.44Å; L277-E280 PolarHBondContact O-N 2.84Å; L277-L281 PolarHBondContact O-N 3.3Å; L277-I287 HydrophobicContact CD2-CD1 4.1Å; L277-I287 HydrophobicContact CD2-CG1 4.1Å; L277-Y288 HydrophobicContact CB-CD1 4.25Å; L277-Y288 HydrophobicContact CB-CE1 3.86Å; L277-Y288 VanDerWaalsContact O-CE1 3.28Å; L277-Y288 WeakPolarHBondContact O-CE1 3.34Å; L277-Y288 PolarHBondContact O-OH 3.11Å; L277-V291 HydrophobicContact CD2-CG2 4Å |
| 278 | Y | 93.4 | Very high | 91.2 | Very high | 40 Ų | 40 | 67.9 Ų | 67.9 | 16% | 0.157 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.8 | -43.8 | 178.8 | -179.3 | -96.8 | 0 | 0 | 0 | 112.2 | E127 V128 K131 L216 S274 W275 L281 | E127-Y278 HydrophobicContact CB-CE1 4.36Å; E127-Y278 HydrophobicContact CG-CE1 4.14Å; E127-Y278 WeakPolarHBondContact OE1-CE1 3.29Å; E127-Y278 PolarHBondContact OE1-OH 2.99Å; V128-Y278 HydrophobicContact CB-CD1 4.24Å; V128-Y278 HydrophobicContact CB-CD2 4.49Å; V128-Y278 HydrophobicContact CB-CG 4Å; V128-Y278 HydrophobicContact CG2-CD2 4.13Å; V128-Y278 HydrophobicContact CG2-CG 3.93Å; K131-Y278 WeakPolarHBondContact CD-OH 3.1Å; K131-Y278 PolarHBondContact NZ-OH 3.02Å; L216-Y278 HydrophobicContact CD2-CD2 4.09Å; S274-Y278 WeakPolarHBondContact O-CB 3.32Å; S274-Y278 PolarHBondContact O-N 2.88Å; W275-Y278 PolarHBondContact O-N 3.01Å; Y278-L281 WeakPolarHBondContact O-CB 3.28Å; Y278-L281 PolarHBondContact O-N 3.49Å |
| 279 | L | 91.2 | Very high | 91 | Very high | 71 Ų | 71 | 68 Ų | 68 | 37% | 0.372 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -64.9 | -39.9 | 176.5 | -70.9 | -178.2 | 0 | 0 | 0 | 113.3 | W275 G276 L277 L281 | W275-L279 HydrophobicContact CD2-CD1 4.34Å; W275-L279 HydrophobicContact CD2-CG 4.35Å; W275-L279 HydrophobicContact CH2-CD2 4.16Å; W275-L279 HydrophobicContact CZ2-CD1 3.75Å; W275-L279 HydrophobicContact CZ2-CD2 3.93Å; W275-L279 HydrophobicContact CZ2-CG 4.06Å; W275-L279 VanDerWaalsContact NE1-CD1 3.3Å; W275-L279 PolarHBondContact O-N 3.4Å; G276-L279 PolarHBondContact O-N 3.05Å; L277-L279 PolarHBondContact O-N 3.44Å; L279-L281 VanDerWaalsContact C-N 3.26Å; L279-L281 PolarHBondContact O-N 3.48Å |
| 280 | E | 88.9 | Confident | 90.8 | Very high | 82 Ų | 82 | 71.2 Ų | 71.2 | 38% | 0.383 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -74.8 | -13.5 | -177.5 | -71.5 | -60.2 | 153.5 | 0 | 0 | 113.7 | G276 L277 N282 H283 W284 I287 | G276-E280 WeakPolarHBondContact O-CG 3.38Å; G276-E280 PolarHBondContact O-N 2.92Å; L277-E280 PolarHBondContact O-N 2.84Å; E280-N282 PolarHBondContact O-N 3.48Å; E280-H283 PolarHBondContact O-N 2.84Å; E280-W284 PolarHBondContact O-N 2.86Å; E280-I287 HydrophobicContact CB-CD1 3.53Å; E280-I287 HydrophobicContact CG-CD1 4.11Å |
| 281 | L | 82.6 | Confident | 90.6 | Very high | 53 Ų | 53 | 72.6 Ų | 72.6 | 28% | 0.277 | 35% | 0.349 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.4 | -37.4 | 178.6 | -177.7 | 58.3 | 0 | 0 | 0 | 112.7 | L277 Y278 L279 H283 Y288 | L277-L281 PolarHBondContact O-N 3.3Å; Y278-L281 WeakPolarHBondContact O-CB 3.28Å; Y278-L281 PolarHBondContact O-N 3.49Å; L279-L281 VanDerWaalsContact C-N 3.26Å; L279-L281 PolarHBondContact O-N 3.48Å; L281-H283 PolarHBondContact O-N 3.44Å; L281-Y288 HydrophobicContact CB-CE1 4.43Å; L281-Y288 WeakPolarHBondContact CB-OH 3.07Å; L281-Y288 HydrophobicContact CD1-CD2 4.23Å; L281-Y288 HydrophobicContact CD1-CE1 4.38Å; L281-Y288 HydrophobicContact CD1-CE2 3.56Å; L281-Y288 HydrophobicContact CD2-CE2 4.03Å; L281-Y288 WeakPolarHBondContact CD2-OH 3.32Å; L281-Y288 HydrophobicContact CG-CE2 4.24Å |
| 282 | N | 77.1 | Confident | 90.4 | Very high | 148 Ų | 148 | 73.3 Ų | 73.3 | 79% | 0.791 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.1 | -26.8 | -179.7 | -70.3 | -36.5 | 0 | 0 | 0 | 112.6 | E280 | E280-N282 PolarHBondContact O-N 3.48Š|
| 283 | H | 82.5 | Confident | 90.2 | Very high | 149 Ų | 149 | 74.3 Ų | 74.3 | 69% | 0.69 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96 | -41.2 | -178.2 | -64.5 | 95.9 | 0 | 0 | 0 | 111.8 | E280 L281 | E280-H283 PolarHBondContact O-N 2.84Å; L281-H283 PolarHBondContact O-N 3.44Å |
| 284 | W | 84.6 | Confident | 90.1 | Very high | 167 Ų | 167 | 78.6 Ų | 78.6 | 63% | 0.633 | 38% | 0.376 | S | S | * | . | trans | -127.2 | 90.4 | -171.9 | -67.6 | 72.4 | 0 | 0 | 0 | 111.7 | E280 Y286 I287 | E280-W284 PolarHBondContact O-N 2.86Å; W284-Y286 PolarHBondContact O-N 2.85Å; W284-I287 HydrophobicContact CB-CB 3.96Å; W284-I287 WeakPolarHBondContact O-CB 3.46Å; W284-I287 VanDerWaalsContact O-CG2 3.25Å; W284-I287 WeakPolarHBondContact O-CG2 3.45Å; W284-I287 PolarHBondContact O-N 2.83Å | ||
| 285 | R | 80.3 | Confident | 90 | Very high | 212 Ų | 212 | 79.4 Ų | 79.4 | 80% | 0.8 | 38% | 0.379 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.9 | -23.2 | -177.2 | -171 | 168.6 | -178 | 159.9 | 1.5 | 115.2 | ||
| 286 | Y | 87.8 | Confident | 89.8 | Confident | 179 Ų | 179 | 79.1 Ų | 79.1 | 70% | 0.702 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.4 | 11.7 | -178.2 | -59.1 | -70.6 | 0 | 0 | 0 | 113.9 | W284 Y288 P289 L290 | W284-Y286 PolarHBondContact O-N 2.85Å; Y286-Y288 PolarHBondContact O-N 2.87Å; Y286-P289 VanDerWaalsContact O-CD 3.31Å; Y286-P289 WeakPolarHBondContact O-CD 3.35Å; Y286-P289 WeakPolarHBondContact O-CG 3.3Å; Y286-L290 VanDerWaalsContact O-CB 3.28Å; Y286-L290 WeakPolarHBondContact O-CB 3.48Å; Y286-L290 PolarHBondContact O-N 3.34Å |
| 287 | I | 91.1 | Very high | 89.8 | Confident | 31 Ų | 31 | 81 Ų | 81 | 16% | 0.159 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62.4 | -42.7 | -176.1 | -165.9 | 170.9 | 0 | 0 | 0 | 112.5 | L277 E280 W284 L290 V291 | L277-I287 HydrophobicContact CD2-CD1 4.1Å; L277-I287 HydrophobicContact CD2-CG1 4.1Å; E280-I287 HydrophobicContact CB-CD1 3.53Å; E280-I287 HydrophobicContact CG-CD1 4.11Å; W284-I287 HydrophobicContact CB-CB 3.96Å; W284-I287 WeakPolarHBondContact O-CB 3.46Å; W284-I287 VanDerWaalsContact O-CG2 3.25Å; W284-I287 WeakPolarHBondContact O-CG2 3.45Å; W284-I287 PolarHBondContact O-N 2.83Å; I287-L290 PolarHBondContact O-N 3.42Å; I287-V291 HydrophobicContact CG1-CG2 4.36Å; I287-V291 VanDerWaalsContact O-CG2 3.31Å; I287-V291 WeakPolarHBondContact O-CG2 3.44Å; I287-V291 PolarHBondContact O-N 2.88Å |
| 288 | Y | 92.2 | Very high | 89.7 | Confident | 8 Ų | 8 | 82.6 Ų | 82.6 | 3% | 0.031 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -61.1 | -54.8 | -179.4 | -51.7 | -24.5 | 0 | 0 | 0 | 113.9 | F215 L216 L277 L281 Y286 L290 V291 C292 | F215-Y288 HydrophobicContact CB-CD2 3.84Å; F215-Y288 HydrophobicContact CB-CG 4.23Å; L216-Y288 HydrophobicContact CB-CD2 4.19Å; L216-Y288 HydrophobicContact CB-CE1 4.41Å; L216-Y288 HydrophobicContact CB-CE2 3.81Å; L216-Y288 HydrophobicContact CD1-CD1 4.35Å; L216-Y288 HydrophobicContact CD1-CE1 3.75Å; L277-Y288 HydrophobicContact CB-CD1 4.25Å; L277-Y288 HydrophobicContact CB-CE1 3.86Å; L277-Y288 VanDerWaalsContact O-CE1 3.28Å; L277-Y288 WeakPolarHBondContact O-CE1 3.34Å; L277-Y288 PolarHBondContact O-OH 3.11Å; L281-Y288 HydrophobicContact CB-CE1 4.43Å; L281-Y288 WeakPolarHBondContact CB-OH 3.07Å; L281-Y288 HydrophobicContact CD1-CD2 4.23Å; L281-Y288 HydrophobicContact CD1-CE1 4.38Å; L281-Y288 HydrophobicContact CD1-CE2 3.56Å; L281-Y288 HydrophobicContact CD2-CE2 4.03Å; L281-Y288 WeakPolarHBondContact CD2-OH 3.32Å; L281-Y288 HydrophobicContact CG-CE2 4.24Å; Y286-Y288 PolarHBondContact O-N 2.87Å; Y288-L290 VanDerWaalsContact C-N 3.26Å; Y288-L290 PolarHBondContact O-N 3.35Å; Y288-V291 PolarHBondContact O-N 3.12Å; Y288-C292 PolarHBondContact O-N 3.44Å; Y288-C292 VanDerWaalsContact O-N 3.1Å; Y288-C292 PolarHBondContact O-SG 2.98Å |
| 289 | P | 91.2 | Very high | 89.7 | Confident | 49 Ų | 49 | 82.9 Ų | 82.9 | 32% | 0.318 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -65.3 | -30.7 | 178.2 | 25.2 | -34.9 | 0 | 0 | 0 | 112.4 | F215 Y286 C292 A293 | F215-P289 HydrophobicContact CD1-CB 4.45Å; F215-P289 HydrophobicContact CE1-CB 4.37Å; Y286-P289 VanDerWaalsContact O-CD 3.31Å; Y286-P289 WeakPolarHBondContact O-CD 3.35Å; Y286-P289 WeakPolarHBondContact O-CG 3.3Å; P289-C292 PolarHBondContact O-N 3.23Å; P289-A293 VanDerWaalsContact O-CB 3.23Å; P289-A293 WeakPolarHBondContact O-CB 3.43Å; P289-A293 PolarHBondContact O-N 2.92Å |
| 290 | L | 93.3 | Very high | 89.9 | Confident | 111 Ų | 111 | 83.1 Ų | 83.1 | 58% | 0.581 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -64.6 | -45.1 | 176.8 | -177.6 | 67 | 0 | 0 | 0 | 111.7 | Y286 I287 Y288 A293 F294 | Y286-L290 VanDerWaalsContact O-CB 3.28Å; Y286-L290 WeakPolarHBondContact O-CB 3.48Å; Y286-L290 PolarHBondContact O-N 3.34Å; I287-L290 PolarHBondContact O-N 3.42Å; Y288-L290 VanDerWaalsContact C-N 3.26Å; Y288-L290 PolarHBondContact O-N 3.35Å; L290-A293 PolarHBondContact O-N 3.18Å; L290-F294 WeakPolarHBondContact O-CB 3.23Å; L290-F294 PolarHBondContact O-N 2.93Å |
| 291 | V | 94.1 | Very high | 90.2 | Very high | 31 Ų | 31 | 83.5 Ų | 83.5 | 19% | 0.188 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -62.7 | -45.5 | 176.5 | 171.6 | 0 | 0 | 0 | 0 | 110.6 | A219 A223 L277 I287 Y288 A293 F294 F295 | A219-V291 HydrophobicContact CB-CB 4.18Å; A219-V291 HydrophobicContact CB-CG1 4.1Å; A223-V291 HydrophobicContact CB-CG1 4.17Å; L277-V291 HydrophobicContact CD2-CG2 4Å; I287-V291 HydrophobicContact CG1-CG2 4.36Å; I287-V291 VanDerWaalsContact O-CG2 3.31Å; I287-V291 WeakPolarHBondContact O-CG2 3.44Å; I287-V291 PolarHBondContact O-N 2.88Å; Y288-V291 PolarHBondContact O-N 3.12Å; V291-A293 PolarHBondContact O-N 3.16Å; V291-F294 PolarHBondContact O-N 3.4Å; V291-F295 HydrophobicContact CG1-CD2 4.01Å; V291-F295 HydrophobicContact CG1-CE2 3.84Å; V291-F295 VanDerWaalsContact O-CD2 3.25Å; V291-F295 WeakPolarHBondContact O-CD2 3.24Å; V291-F295 PolarHBondContact O-N 3.11Å |
| 292 | C | 91.8 | Very high | 90.7 | Very high | 15 Ų | 15 | 83.2 Ų | 83.2 | 10% | 0.101 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -58.6 | -49 | 175 | -63.3 | 0 | 0 | 0 | 0 | 111.7 | C218 A219 Y288 P289 F294 F295 V296 | C218-C292 PolarHBondContact SG-SG 3.33Å; A219-C292 WeakPolarHBondContact CA-SG 3.33Å; A219-C292 PolarHBondContact N-SG 3Å; A219-C292 VanDerWaalsContact N-SG 3.37Å; Y288-C292 PolarHBondContact O-N 3.44Å; Y288-C292 VanDerWaalsContact O-N 3.1Å; Y288-C292 PolarHBondContact O-SG 2.98Å; P289-C292 PolarHBondContact O-N 3.23Å; C292-F294 VanDerWaalsContact C-N 3.29Å; C292-F294 PolarHBondContact O-N 3.5Å; C292-F295 PolarHBondContact O-N 3.41Å; C292-V296 WeakPolarHBondContact O-CB 3.23Å; C292-V296 VanDerWaalsContact O-CG2 3.26Å; C292-V296 WeakPolarHBondContact O-CG2 3.47Å; C292-V296 PolarHBondContact O-N 2.95Å |
| 293 | A | 93.3 | Very high | 91.5 | Very high | 58 Ų | 58 | 77.3 Ų | 77.3 | 48% | 0.479 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -61 | -38.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112 | P289 L290 V291 A297 | P289-A293 VanDerWaalsContact O-CB 3.23Å; P289-A293 WeakPolarHBondContact O-CB 3.43Å; P289-A293 PolarHBondContact O-N 2.92Å; L290-A293 PolarHBondContact O-N 3.18Å; V291-A293 PolarHBondContact O-N 3.16Å; A293-A297 WeakPolarHBondContact O-CB 3.29Å; A293-A297 PolarHBondContact O-N 2.94Å |
| 294 | F | 95.5 | Very high | 92.1 | Very high | 121 Ų | 121 | 74 Ų | 74 | 53% | 0.531 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -59.5 | -53.1 | 176.3 | 173.6 | -99.5 | 0 | 0 | 0 | 111.9 | L290 V291 C292 A297 L298 | L290-F294 WeakPolarHBondContact O-CB 3.23Å; L290-F294 PolarHBondContact O-N 2.93Å; V291-F294 PolarHBondContact O-N 3.4Å; C292-F294 VanDerWaalsContact C-N 3.29Å; C292-F294 PolarHBondContact O-N 3.5Å; F294-A297 PolarHBondContact O-N 3.28Å; F294-L298 HydrophobicContact CE1-CD1 3.96Å; F294-L298 HydrophobicContact CZ-CD1 4.08Å; F294-L298 PolarHBondContact O-N 2.99Å |
| 295 | F | 94.1 | Very high | 92.5 | Very high | 17 Ų | 17 | 68 Ų | 68 | 8% | 0.075 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -69.1 | -38.3 | -179 | -72.3 | -70.5 | 0 | 0 | 0 | 112.6 | V222 A223 F226 I227 V291 C292 A297 L298 | V222-F295 HydrophobicContact CG1-CB 3.48Å; V222-F295 VanDerWaalsContact CG1-CB 3.48Å; V222-F295 HydrophobicContact CG1-CD2 4.36Å; V222-F295 HydrophobicContact CG1-CG 4.06Å; A223-F295 HydrophobicContact CB-CD2 4.01Å; A223-F295 HydrophobicContact CB-CE2 3.35Å; A223-F295 HydrophobicContact CB-CZ 3.89Å; F226-F295 HydrophobicContact CB-CD1 3.79Å; F226-F295 HydrophobicContact CB-CE1 3.86Å; F226-F295 AromaticContact CD1-CD1 3.75Å; F226-F295 HydrophobicContact CD1-CD1 3.75Å; F226-F295 AromaticContact CD1-CE1 3.39Å; F226-F295 HydrophobicContact CD1-CE1 3.39Å; F226-F295 AromaticContact CD2-CD1 3.67Å; F226-F295 HydrophobicContact CD2-CD1 3.67Å; F226-F295 HydrophobicContact CD2-CE1 4.21Å; F226-F295 HydrophobicContact CE1-CD1 4.23Å; F226-F295 AromaticContact CE1-CE1 3.95Å; F226-F295 HydrophobicContact CE1-CE1 3.95Å; F226-F295 HydrophobicContact CE2-CD1 4.16Å; F226-F295 AromaticContact CG-CD1 3.45Å; F226-F295 HydrophobicContact CG-CD1 3.45Å; F226-F295 VanDerWaalsContact CG-CD1 3.45Å; F226-F295 AromaticContact CG-CE1 3.55Å; F226-F295 HydrophobicContact CG-CE1 3.55Å; F226-F295 HydrophobicContact CZ-CD1 4.42Å; I227-F295 HydrophobicContact CD1-CZ 4.23Å; I227-F295 HydrophobicContact CG1-CZ 4.33Å; V291-F295 HydrophobicContact CG1-CD2 4.01Å; V291-F295 HydrophobicContact CG1-CE2 3.84Å; V291-F295 VanDerWaalsContact O-CD2 3.25Å; V291-F295 WeakPolarHBondContact O-CD2 3.24Å; V291-F295 PolarHBondContact O-N 3.11Å; C292-F295 PolarHBondContact O-N 3.41Å; F295-A297 VanDerWaalsContact C-N 3.29Å; F295-A297 PolarHBondContact O-N 2.89Å; F295-L298 HydrophobicContact CD1-CD1 4.45Å; F295-L298 WeakPolarHBondContact O-CB 3.25Å; F295-L298 PolarHBondContact O-N 3.36Å; F295-L298 VanDerWaalsContact O-N 3.16Å |
| 296 | V | 90.4 | Very high | 93 | Very high | 74 Ų | 74 | 57.9 Ų | 57.9 | 45% | 0.448 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -63.3 | -36.7 | 174.6 | 172.6 | 0 | 0 | 0 | 0 | 111.2 | C292 L298 L299 | C292-V296 WeakPolarHBondContact O-CB 3.23Å; C292-V296 VanDerWaalsContact O-CG2 3.26Å; C292-V296 WeakPolarHBondContact O-CG2 3.47Å; C292-V296 PolarHBondContact O-N 2.95Å; V296-L298 PolarHBondContact O-N 2.96Å; V296-L299 VanDerWaalsContact O-CB 3.23Å; V296-L299 WeakPolarHBondContact O-CB 3.47Å; V296-L299 PolarHBondContact O-N 2.97Å; V296-L299 VanDerWaalsContact O-N 3.13Å |
| 297 | A | 94.3 | Very high | 93.2 | Very high | 69 Ų | 69 | 55.3 Ų | 55.3 | 57% | 0.57 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -66.2 | -22.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | A293 F294 F295 P300 | A293-A297 WeakPolarHBondContact O-CB 3.29Å; A293-A297 PolarHBondContact O-N 2.94Å; F294-A297 PolarHBondContact O-N 3.28Å; F295-A297 VanDerWaalsContact C-N 3.29Å; F295-A297 PolarHBondContact O-N 2.89Å; A297-P300 WeakPolarHBondContact O-CD 3.15Å |
| 298 | L | 94.2 | Very high | 93.1 | Very high | 50 Ų | 50 | 62.7 Ų | 62.7 | 26% | 0.262 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -78.8 | -21.5 | 174.3 | -63.4 | 176.5 | 0 | 0 | 0 | 112.8 | F226 F294 F295 V296 V301 W302 | F226-L298 HydrophobicContact CE2-CD1 4.06Å; F226-L298 HydrophobicContact CZ-CD1 3.77Å; F294-L298 HydrophobicContact CE1-CD1 3.96Å; F294-L298 HydrophobicContact CZ-CD1 4.08Å; F294-L298 PolarHBondContact O-N 2.99Å; F295-L298 HydrophobicContact CD1-CD1 4.45Å; F295-L298 WeakPolarHBondContact O-CB 3.25Å; F295-L298 PolarHBondContact O-N 3.36Å; F295-L298 VanDerWaalsContact O-N 3.16Å; V296-L298 PolarHBondContact O-N 2.96Å; L298-V301 WeakPolarHBondContact O-CB 3.45Å; L298-V301 PolarHBondContact O-N 3.14Å; L298-W302 PolarHBondContact O-N 3.27Å |
| 299 | L | 93.7 | Very high | 92.5 | Very high | 46 Ų | 46 | 62.8 Ų | 62.8 | 24% | 0.241 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -55.3 | -46.3 | -175 | -172.4 | 155.7 | 0 | 0 | 0 | 113.5 | T188 V189 V296 V301 W302 V303 | T188-L299 HydrophobicContact CG2-CD1 4.23Å; V189-L299 HydrophobicContact CG2-CD1 3.61Å; V296-L299 VanDerWaalsContact O-CB 3.23Å; V296-L299 WeakPolarHBondContact O-CB 3.47Å; V296-L299 PolarHBondContact O-N 2.97Å; V296-L299 VanDerWaalsContact O-N 3.13Å; L299-V301 PolarHBondContact O-N 3.1Å; L299-W302 PolarHBondContact O-N 3.26Å; L299-V303 HydrophobicContact CD2-CG2 3.71Å; L299-V303 HydrophobicContact CG-CG2 4.44Å; L299-V303 WeakPolarHBondContact O-CG2 3.03Å; L299-V303 PolarHBondContact O-N 3.36Å |
| 300 | P | 94.6 | Very high | 92.1 | Very high | 76 Ų | 76 | 65 Ų | 65 | 49% | 0.494 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -58.7 | -36.1 | 177.5 | -24.2 | 34.7 | 0 | 0 | 0 | 113.2 | A297 V303 V304 | A297-P300 WeakPolarHBondContact O-CD 3.15Å; P300-V303 PolarHBondContact O-N 3.07Å; P300-V304 VanDerWaalsContact O-CG2 3.3Å; P300-V304 WeakPolarHBondContact O-CG2 3.25Å; P300-V304 PolarHBondContact O-N 3.03Å |
| 301 | V | 94.5 | Very high | 91.3 | Very high | 90 Ų | 90 | 62.8 Ų | 62.8 | 55% | 0.545 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -64.7 | -47.7 | 179 | -178.9 | 0 | 0 | 0 | 0 | 110 | L298 L299 V304 L305 | L298-V301 WeakPolarHBondContact O-CB 3.45Å; L298-V301 PolarHBondContact O-N 3.14Å; L299-V301 PolarHBondContact O-N 3.1Å; V301-V304 PolarHBondContact O-N 2.81Å; V301-L305 WeakPolarHBondContact O-CB 3.3Å; V301-L305 PolarHBondContact O-N 3.29Å |
| 302 | W | 94.2 | Very high | 90.8 | Very high | 47 Ų | 47 | 61.3 Ų | 61.3 | 18% | 0.178 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -67.1 | -37.7 | 178.9 | -62.4 | 119.2 | 0 | 0 | 0 | 112.5 | A181 Q184 V185 F226 L298 L299 V304 L305 A306 | A181-W302 HydrophobicContact CB-CE3 3.74Å; A181-W302 HydrophobicContact CB-CZ3 4.36Å; Q184-W302 HydrophobicContact CB-CB 4.29Å; Q184-W302 HydrophobicContact CB-CD2 3.69Å; Q184-W302 HydrophobicContact CB-CE3 4.16Å; Q184-W302 HydrophobicContact CB-CG 3.75Å; Q184-W302 HydrophobicContact CB-CZ2 4.49Å; Q184-W302 HydrophobicContact CG-CD2 4.02Å; Q184-W302 HydrophobicContact CG-CE3 4.21Å; Q184-W302 HydrophobicContact CG-CH2 4.18Å; Q184-W302 HydrophobicContact CG-CZ2 4.01Å; Q184-W302 HydrophobicContact CG-CZ3 4.28Å; V185-W302 HydrophobicContact CG2-CB 3.48Å; V185-W302 VanDerWaalsContact CG2-CB 3.48Å; F226-W302 AromaticContact CE2-NE1 3.35Å; F226-W302 HydrophobicContact CZ-CZ2 4.01Å; F226-W302 AromaticContact CZ-NE1 3.54Å; L298-W302 PolarHBondContact O-N 3.27Å; L299-W302 PolarHBondContact O-N 3.26Å; W302-V304 PolarHBondContact O-N 2.97Å; W302-L305 HydrophobicContact CE3-CD2 4Å; W302-L305 HydrophobicContact CZ3-CD2 3.95Å; W302-L305 PolarHBondContact O-N 3.49Å; W302-A306 VanDerWaalsContact O-CB 3.29Å; W302-A306 WeakPolarHBondContact O-CB 3.5Å; W302-A306 PolarHBondContact O-N 3.05Å |
| 303 | V | 94.1 | Very high | 90.6 | Very high | 23 Ų | 23 | 67.5 Ų | 67.5 | 14% | 0.139 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -60.7 | -46.2 | 174.1 | 168.9 | 0 | 0 | 0 | 0 | 111.1 | V185 L299 P300 L305 A306 R307 L316 | V185-V303 HydrophobicContact CG1-CG2 3.95Å; V185-V303 HydrophobicContact CG2-CB 4.42Å; V185-V303 HydrophobicContact CG2-CG2 3.68Å; L299-V303 HydrophobicContact CD2-CG2 3.71Å; L299-V303 HydrophobicContact CG-CG2 4.44Å; L299-V303 WeakPolarHBondContact O-CG2 3.03Å; L299-V303 PolarHBondContact O-N 3.36Å; P300-V303 PolarHBondContact O-N 3.07Å; V303-L305 VanDerWaalsContact C-N 3.29Å; V303-L305 PolarHBondContact O-N 3.17Å; V303-A306 PolarHBondContact O-N 3.36Å; V303-R307 VanDerWaalsContact O-CG 3.27Å; V303-R307 WeakPolarHBondContact O-CG 3.28Å; V303-R307 PolarHBondContact O-N 3.41Å; V303-L316 HydrophobicContact CG1-CD2 4.39Å |
| 304 | V | 94.5 | Very high | 90.1 | Very high | 80 Ų | 80 | 71.4 Ų | 71.4 | 49% | 0.485 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.3 | -40.9 | 177.5 | 170.4 | 0 | 0 | 0 | 0 | 110.7 | P300 V301 W302 | P300-V304 VanDerWaalsContact O-CG2 3.3Å; P300-V304 WeakPolarHBondContact O-CG2 3.25Å; P300-V304 PolarHBondContact O-N 3.03Å; V301-V304 PolarHBondContact O-N 2.81Å; W302-V304 PolarHBondContact O-N 2.97Å |
| 305 | L | 92.2 | Very high | 89.5 | Confident | 41 Ų | 41 | 66.4 Ų | 66.4 | 22% | 0.215 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -69.8 | -42.1 | -179.1 | -168.6 | 55 | 0 | 0 | 0 | 112.5 | T177 A181 V301 W302 V303 R307 R308 | T177-L305 HydrophobicContact CG2-CD1 3.57Å; T177-L305 HydrophobicContact CG2-CD2 3.54Å; T177-L305 HydrophobicContact CG2-CG 3.64Å; A181-L305 HydrophobicContact CB-CB 3.75Å; A181-L305 HydrophobicContact CB-CD2 3.97Å; A181-L305 HydrophobicContact CB-CG 3.76Å; V301-L305 WeakPolarHBondContact O-CB 3.3Å; V301-L305 PolarHBondContact O-N 3.29Å; W302-L305 HydrophobicContact CE3-CD2 4Å; W302-L305 HydrophobicContact CZ3-CD2 3.95Å; W302-L305 PolarHBondContact O-N 3.49Å; V303-L305 VanDerWaalsContact C-N 3.29Å; V303-L305 PolarHBondContact O-N 3.17Å; L305-R307 VanDerWaalsContact C-N 3.32Å; L305-R307 PolarHBondContact O-N 3.03Å; L305-R308 WeakPolarHBondContact O-CB 3.49Å; L305-R308 PolarHBondContact O-N 3.25Å |
| 306 | A | 91.2 | Very high | 89.2 | Confident | 0 Ų | 0 | 66.1 Ų | 66.1 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -65.2 | -33.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A181 L182 W302 V303 R308 T312 L316 | A181-A306 HydrophobicContact CB-CB 3.99Å; L182-A306 HydrophobicContact CB-CB 4.27Å; W302-A306 VanDerWaalsContact O-CB 3.29Å; W302-A306 WeakPolarHBondContact O-CB 3.5Å; W302-A306 PolarHBondContact O-N 3.05Å; V303-A306 PolarHBondContact O-N 3.36Å; A306-R308 VanDerWaalsContact C-N 3.25Å; A306-R308 PolarHBondContact O-N 3.45Å; A306-T312 WeakPolarHBondContact O-CB 3.18Å; A306-T312 PolarHBondContact O-OG1 3.23Å; A306-L316 HydrophobicContact CB-CD2 4.23Å |
| 307 | R | 92.2 | Very high | 89.1 | Confident | 124 Ų | 124 | 69 Ų | 69 | 47% | 0.468 | 35% | 0.353 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.8 | -17.7 | 177.1 | -74.9 | 178.7 | -171.1 | 178.9 | 5.2 | 114.3 | V303 L305 L316 Y317 | V303-R307 VanDerWaalsContact O-CG 3.27Å; V303-R307 WeakPolarHBondContact O-CG 3.28Å; V303-R307 PolarHBondContact O-N 3.41Å; L305-R307 VanDerWaalsContact C-N 3.32Å; L305-R307 PolarHBondContact O-N 3.03Å; R307-L316 HydrophobicContact CG-CD2 3.61Å; R307-Y317 PolarHBondContact NE-OH 3.3Å |
| 308 | R | 88.3 | Confident | 88.6 | Confident | 186 Ų | 186 | 69 Ų | 69 | 70% | 0.702 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.1 | -25.6 | -177.3 | -73 | -179.1 | 178.4 | -179.9 | -0.4 | 113.5 | L305 A306 | L305-R308 WeakPolarHBondContact O-CB 3.49Å; L305-R308 PolarHBondContact O-N 3.25Å; A306-R308 VanDerWaalsContact C-N 3.25Å; A306-R308 PolarHBondContact O-N 3.45Å |
| 309 | S | 81.5 | Confident | 88 | Confident | 11 Ų | 11 | 67.2 Ų | 67.2 | 8% | 0.077 | 34% | 0.342 | C | S | . | . | S | Bend | trans | -98.3 | 126.3 | 176 | 172.9 | 0 | 0 | 0 | 0 | 109.7 | A311 T312 R313 | S309-A311 VanDerWaalsContact C-N 3.3Å; S309-A311 PolarHBondContact O-N 3.01Å; S309-T312 VanDerWaalsContact CB-OG1 3.26Å; S309-T312 WeakPolarHBondContact CB-OG1 3.34Å; S309-T312 PolarHBondContact O-N 3.18Å; S309-T312 PolarHBondContact O-OG1 3.35Å; S309-R313 WeakPolarHBondContact O-CB 3.36Å; S309-R313 PolarHBondContact O-N 3.35Å |
| 310 | P | 82.5 | Confident | 87.8 | Confident | 96 Ų | 96 | 67.8 Ų | 67.8 | 62% | 0.623 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -55.4 | -43 | -178.9 | -27.7 | 35 | 0 | 0 | 0 | 113.4 | T312 R313 E314 | P310-T312 PolarHBondContact O-N 2.99Å; P310-R313 WeakPolarHBondContact O-CB 3.34Å; P310-R313 PolarHBondContact O-N 3.49Å; P310-E314 PolarHBondContact O-N 2.71Å |
| 311 | A | 76.5 | Confident | 87.6 | Confident | 63 Ų | 63 | 69.8 Ų | 69.8 | 52% | 0.521 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -61.8 | -40.7 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | S309 V315 | S309-A311 VanDerWaalsContact C-N 3.3Å; S309-A311 PolarHBondContact O-N 3.01Å; A311-V315 WeakPolarHBondContact O-CG2 3.24Å |
| 312 | T | 83.9 | Confident | 87.3 | Confident | 1 Ų | 1 | 65.6 Ų | 65.6 | 1% | 0.006 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -81.3 | -25.3 | 179.4 | 50.8 | 0 | 0 | 0 | 0 | 112.5 | G178 N179 L182 A306 S309 P310 L316 | G178-T312 WeakPolarHBondContact O-CG2 3.32Å; N179-T312 HydrophobicContact CB-CG2 4.35Å; L182-T312 HydrophobicContact CB-CG2 4.24Å; L182-T312 HydrophobicContact CD2-CG2 4.09Å; A306-T312 WeakPolarHBondContact O-CB 3.18Å; A306-T312 PolarHBondContact O-OG1 3.23Å; S309-T312 VanDerWaalsContact CB-OG1 3.26Å; S309-T312 WeakPolarHBondContact CB-OG1 3.34Å; S309-T312 PolarHBondContact O-N 3.18Å; S309-T312 PolarHBondContact O-OG1 3.35Å; P310-T312 PolarHBondContact O-N 2.99Å; T312-L316 VanDerWaalsContact O-CB 3.26Å; T312-L316 WeakPolarHBondContact O-CB 3.45Å; T312-L316 PolarHBondContact O-N 3.45Å |
| 313 | R | 87 | Confident | 87.1 | Confident | 144 Ų | 144 | 63.8 Ų | 63.8 | 54% | 0.543 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -62 | -45.3 | 174.9 | 179.7 | -176.4 | 167.4 | 179.1 | -2.9 | 111.2 | S309 P310 L316 Y317 | S309-R313 WeakPolarHBondContact O-CB 3.36Å; S309-R313 PolarHBondContact O-N 3.35Å; P310-R313 WeakPolarHBondContact O-CB 3.34Å; P310-R313 PolarHBondContact O-N 3.49Å; R313-L316 PolarHBondContact O-N 2.92Å; R313-Y317 HydrophobicContact CG-CD2 4.07Å; R313-Y317 HydrophobicContact CG-CE2 3.73Å; R313-Y317 WeakPolarHBondContact O-CD2 3.18Å; R313-Y317 PolarHBondContact O-N 3.39Å |
| 314 | E | 83.3 | Confident | 87.1 | Confident | 141 Ų | 141 | 65.7 Ų | 65.7 | 66% | 0.659 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -60.5 | -47.6 | 179 | -178.3 | 173.4 | -176.4 | 0 | 0 | 111.6 | P310 L316 Y317 S318 | P310-E314 PolarHBondContact O-N 2.71Å; E314-L316 VanDerWaalsContact C-N 3.33Å; E314-L316 PolarHBondContact O-N 2.92Å; E314-Y317 PolarHBondContact O-N 2.97Å; E314-Y317 VanDerWaalsContact O-N 3.15Å; E314-S318 PolarHBondContact O-N 3.48Å; E314-S318 PolarHBondContact O-OG 2.89Å |
| 315 | V | 82.3 | Confident | 87 | Confident | 16 Ų | 16 | 65.1 Ų | 65.1 | 10% | 0.097 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -66.9 | -35.8 | 179.8 | -175.7 | 0 | 0 | 0 | 0 | 111.5 | R156 L182 A311 Y317 S318 G319 | R156-V315 VanDerWaalsContact CZ-CG2 3.43Å; R156-V315 VanDerWaalsContact NH2-CG1 3.3Å; L182-V315 HydrophobicContact CD2-CB 3.82Å; L182-V315 HydrophobicContact CD2-CG1 3.77Å; A311-V315 WeakPolarHBondContact O-CG2 3.24Å; V315-Y317 PolarHBondContact O-N 3.35Å; V315-S318 PolarHBondContact O-N 2.64Å; V315-G319 WeakPolarHBondContact O-CA 3.17Å; V315-G319 PolarHBondContact O-N 2.91Å |
| 316 | L | 88.4 | Confident | 87.1 | Confident | 10 Ų | 10 | 63.2 Ų | 63.2 | 5% | 0.052 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.3 | -25 | 176.2 | -176.9 | 64.1 | 0 | 0 | 0 | 112.8 | L182 V185 V303 A306 R307 T312 R313 E314 W320 | L182-L316 HydrophobicContact CD1-CB 3.91Å; L182-L316 HydrophobicContact CD1-CD1 3.99Å; V185-L316 HydrophobicContact CB-CD1 4.48Å; V185-L316 HydrophobicContact CG1-CD1 3.92Å; V303-L316 HydrophobicContact CG1-CD2 4.39Å; A306-L316 HydrophobicContact CB-CD2 4.23Å; R307-L316 HydrophobicContact CG-CD2 3.61Å; T312-L316 VanDerWaalsContact O-CB 3.26Å; T312-L316 WeakPolarHBondContact O-CB 3.45Å; T312-L316 PolarHBondContact O-N 3.45Å; R313-L316 PolarHBondContact O-N 2.92Å; E314-L316 VanDerWaalsContact C-N 3.33Å; E314-L316 PolarHBondContact O-N 2.92Å; L316-W320 HydrophobicContact CD1-CZ2 4.09Å; L316-W320 PolarHBondContact O-NE1 3.4Å |
| 317 | Y | 86.8 | Confident | 87.2 | Confident | 134 Ų | 134 | 63.6 Ų | 63.6 | 53% | 0.525 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -96.7 | -32.1 | 178.2 | -71.1 | -65.1 | 0 | 0 | 0 | 113.4 | R307 R313 E314 V315 | R307-Y317 PolarHBondContact NE-OH 3.3Å; R313-Y317 HydrophobicContact CG-CD2 4.07Å; R313-Y317 HydrophobicContact CG-CE2 3.73Å; R313-Y317 WeakPolarHBondContact O-CD2 3.18Å; R313-Y317 PolarHBondContact O-N 3.39Å; E314-Y317 PolarHBondContact O-N 2.97Å; E314-Y317 VanDerWaalsContact O-N 3.15Å; V315-Y317 PolarHBondContact O-N 3.35Å |
| 318 | S | 84.7 | Confident | 87.4 | Confident | 70 Ų | 70 | 59.7 Ų | 59.7 | 49% | 0.49 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -105.3 | -27.2 | -172.8 | 57.8 | 0 | 0 | 0 | 0 | 114.8 | E314 V315 W320 | E314-S318 PolarHBondContact O-N 3.48Å; E314-S318 PolarHBondContact O-OG 2.89Å; V315-S318 PolarHBondContact O-N 2.64Å; S318-W320 VanDerWaalsContact C-N 3.29Å; S318-W320 PolarHBondContact O-N 2.92Å; S318-W320 VanDerWaalsContact O-N 3.13Å |
| 319 | G | 81.8 | Confident | 87.7 | Confident | 12 Ų | 12 | 53.1 Ų | 53.1 | 12% | 0.124 | 28% | 0.28 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -82.1 | 15.7 | -166.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | V315 V323 | V315-G319 WeakPolarHBondContact O-CA 3.17Å; V315-G319 PolarHBondContact O-N 2.91Å; G319-V323 WeakPolarHBondContact O-CG2 3.31Å |
| 320 | W | 89.3 | Confident | 88.4 | Confident | 58 Ų | 58 | 52.7 Ų | 52.7 | 22% | 0.22 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -84.5 | -38.2 | -175.6 | -67.7 | 101.2 | 0 | 0 | 0 | 113.7 | V185 Q186 V189 V190 L316 S318 V323 I324 | V185-W320 HydrophobicContact CG1-CH2 3.87Å; V185-W320 HydrophobicContact CG1-CZ2 4.06Å; Q186-W320 HydrophobicContact CG-CH2 4.22Å; Q186-W320 HydrophobicContact CG-CZ3 4.28Å; V189-W320 HydrophobicContact CB-CH2 3.96Å; V189-W320 HydrophobicContact CB-CZ3 3.81Å; V189-W320 HydrophobicContact CG1-CH2 4.11Å; V189-W320 HydrophobicContact CG1-CZ3 3.67Å; V189-W320 HydrophobicContact CG2-CH2 3.96Å; V189-W320 HydrophobicContact CG2-CZ3 4.32Å; V190-W320 HydrophobicContact CG2-CZ3 4.42Å; L316-W320 HydrophobicContact CD1-CZ2 4.09Å; L316-W320 PolarHBondContact O-NE1 3.4Å; S318-W320 VanDerWaalsContact C-N 3.29Å; S318-W320 PolarHBondContact O-N 2.92Å; S318-W320 VanDerWaalsContact O-N 3.13Å; W320-V323 PolarHBondContact O-N 2.9Å; W320-I324 HydrophobicContact CB-CD1 4.07Å; W320-I324 HydrophobicContact CE3-CD1 4.36Å; W320-I324 WeakPolarHBondContact O-CB 3.11Å; W320-I324 VanDerWaalsContact O-CG1 3.31Å; W320-I324 WeakPolarHBondContact O-CG1 3.22Å; W320-I324 PolarHBondContact O-N 3.19Å |
| 321 | E | 90.2 | Very high | 89 | Confident | 119 Ų | 119 | 48.1 Ų | 48.1 | 56% | 0.556 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -54.6 | -54.1 | -176.3 | -179 | 179.5 | 170.8 | 0 | 0 | 113.1 | V323 I325 | E321-V323 VanDerWaalsContact C-N 3.33Å; E321-V323 PolarHBondContact O-N 2.99Å; E321-I325 HydrophobicContact CG-CD1 3.67Å; E321-I325 WeakPolarHBondContact O-CB 3.2Å; E321-I325 VanDerWaalsContact O-CG1 3.31Å; E321-I325 WeakPolarHBondContact O-CG1 3.42Å; E321-I325 PolarHBondContact O-N 3.45Å; E321-I325 VanDerWaalsContact O-N 3.12Å |
| 322 | P | 88.6 | Confident | 89.9 | Confident | 2 Ų | 2 | 48 Ų | 48 | 1% | 0.013 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -65.2 | -37.4 | -178.9 | 24.7 | -33.9 | 0 | 0 | 0 | 112.2 | A326 N476 F477 P480 Y481 | P322-A326 WeakPolarHBondContact O-CB 3.35Å; P322-A326 PolarHBondContact O-N 3.28Å; P322-N476 WeakPolarHBondContact CG-O 3.31Å; P322-F477 HydrophobicContact CB-CD1 4.09Å; P322-F477 HydrophobicContact CG-CD1 3.88Å; P322-F477 HydrophobicContact CG-CE1 4.28Å; P322-P480 HydrophobicContact CB-CB 3.97Å; P322-P480 HydrophobicContact CB-CG 4.08Å; P322-Y481 HydrophobicContact CB-CE1 4.34Å; P322-Y481 HydrophobicContact CB-CE2 4.41Å |
| 323 | V | 90.3 | Very high | 90.4 | Very high | 9 Ų | 9 | 47.9 Ų | 47.9 | 6% | 0.055 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -70.6 | -42.8 | -177.2 | -176.3 | 0 | 0 | 0 | 0 | 111.8 | L145 L149 V190 G319 W320 E321 M327 | L145-V323 HydrophobicContact CD1-CG1 3.84Å; L149-V323 HydrophobicContact CD2-CG1 4.39Å; V190-V323 HydrophobicContact CB-CG1 4.48Å; V190-V323 HydrophobicContact CG1-CG1 4.29Å; V190-V323 HydrophobicContact CG2-CG1 3.62Å; G319-V323 WeakPolarHBondContact O-CG2 3.31Å; W320-V323 PolarHBondContact O-N 2.9Å; E321-V323 VanDerWaalsContact C-N 3.33Å; E321-V323 PolarHBondContact O-N 2.99Å; V323-M327 WeakPolarHBondContact O-CB 3.42Å; V323-M327 PolarHBondContact O-N 3.28Å |
| 324 | I | 93.1 | Very high | 90.9 | Very high | 63 Ų | 63 | 41 Ų | 41 | 32% | 0.323 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -69.9 | -44.9 | -179.3 | -67.5 | 171.8 | 0 | 0 | 0 | 110.8 | L193 W320 M327 A328 | L193-I324 HydrophobicContact CD1-CD1 4.15Å; L193-I324 HydrophobicContact CD1-CG1 4.04Å; W320-I324 HydrophobicContact CB-CD1 4.07Å; W320-I324 HydrophobicContact CE3-CD1 4.36Å; W320-I324 WeakPolarHBondContact O-CB 3.11Å; W320-I324 VanDerWaalsContact O-CG1 3.31Å; W320-I324 WeakPolarHBondContact O-CG1 3.22Å; W320-I324 PolarHBondContact O-N 3.19Å; I324-M327 PolarHBondContact O-N 3.05Å; I324-A328 PolarHBondContact O-N 3Å |
| 325 | I | 93.4 | Very high | 91.4 | Very high | 68 Ų | 68 | 36.2 Ų | 36.2 | 35% | 0.349 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -65.9 | -42.9 | 178.9 | -67.4 | 171.1 | 0 | 0 | 0 | 110.3 | E321 M327 A328 I329 Y481 | E321-I325 HydrophobicContact CG-CD1 3.67Å; E321-I325 WeakPolarHBondContact O-CB 3.2Å; E321-I325 VanDerWaalsContact O-CG1 3.31Å; E321-I325 WeakPolarHBondContact O-CG1 3.42Å; E321-I325 PolarHBondContact O-N 3.45Å; E321-I325 VanDerWaalsContact O-N 3.12Å; I325-M327 PolarHBondContact O-N 2.84Å; I325-A328 PolarHBondContact O-N 2.62Å; I325-I329 HydrophobicContact CG2-CD1 3.92Å; I325-I329 HydrophobicContact CG2-CG1 4.48Å; I325-I329 WeakPolarHBondContact O-CG1 3.01Å; I325-I329 PolarHBondContact O-N 2.88Å; I325-Y481 HydrophobicContact CB-CE1 3.8Å; I325-Y481 HydrophobicContact CD1-CE1 4.26Å; I325-Y481 HydrophobicContact CG2-CD1 4.04Å; I325-Y481 HydrophobicContact CG2-CE1 3.58Å |
| 326 | A | 93.7 | Very high | 92.1 | Very high | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -58.2 | -47.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | N148 P322 A328 I329 S330 P480 A484 | N148-A326 WeakPolarHBondContact ND2-CB 3.42Å; P322-A326 WeakPolarHBondContact O-CB 3.35Å; P322-A326 PolarHBondContact O-N 3.28Å; A326-A328 VanDerWaalsContact C-N 3.31Å; A326-A328 PolarHBondContact O-N 2.94Å; A326-I329 PolarHBondContact O-N 3.48Å; A326-S330 PolarHBondContact O-N 3.49Å; A326-S330 PolarHBondContact O-OG 3.44Å; A326-P480 HydrophobicContact CB-CB 3.86Å; A326-P480 WeakPolarHBondContact CB-O 3.33Å; A326-A484 HydrophobicContact CB-CB 3.78Å; A326-A484 WeakPolarHBondContact O-CB 3.27Å |
| 327 | M | 94.5 | Very high | 92.4 | Very high | 9 Ų | 9 | 37.4 Ų | 37.4 | 4% | 0.044 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -57.1 | -44.3 | 175.6 | 177.7 | -81.8 | -63.3 | 0 | 0 | 111.7 | A141 V190 L193 A194 A197 V323 I324 I325 I329 S330 S331 | A141-M327 HydrophobicContact CB-CG 4.41Å; V190-M327 HydrophobicContact CG1-CB 3.75Å; V190-M327 HydrophobicContact CG1-CG 3.68Å; L193-M327 HydrophobicContact CB-CE 3.5Å; L193-M327 VanDerWaalsContact CB-CE 3.5Å; A194-M327 VanDerWaalsContact CA-SD 3.57Å; A194-M327 HydrophobicContact CB-CG 3.93Å; A194-M327 HydrophobicContact CB-SD 3.9Å; A197-M327 HydrophobicContact CB-SD 4.19Å; V323-M327 WeakPolarHBondContact O-CB 3.42Å; V323-M327 PolarHBondContact O-N 3.28Å; I324-M327 PolarHBondContact O-N 3.05Å; I325-M327 PolarHBondContact O-N 2.84Å; M327-I329 PolarHBondContact O-N 3.14Å; M327-S330 PolarHBondContact O-N 3.47Å; M327-S331 WeakPolarHBondContact O-CB 3.28Å; M327-S331 PolarHBondContact O-N 3.22Å; M327-S331 PolarHBondContact O-OG 2.82Å; M327-S331 VanDerWaalsContact O-OG 3.1Å |
| 328 | A | 94.6 | Very high | 92.8 | Very high | 42 Ų | 42 | 31 Ų | 31 | 35% | 0.347 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -62 | -41.2 | 178 | 0 | 0 | 0 | 0 | 0 | 112.7 | I324 I325 A326 S331 V332 | I324-A328 PolarHBondContact O-N 3Å; I325-A328 PolarHBondContact O-N 2.62Å; A326-A328 VanDerWaalsContact C-N 3.31Å; A326-A328 PolarHBondContact O-N 2.94Å; A328-S331 PolarHBondContact O-N 3.35Å; A328-V332 PolarHBondContact O-N 3.37Å |
| 329 | I | 95.6 | Very high | 93.2 | Very high | 48 Ų | 48 | 31.7 Ų | 31.7 | 25% | 0.246 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -65.2 | -47.4 | 176 | -65.8 | 167.6 | 0 | 0 | 0 | 110.4 | I325 A326 M327 S331 V332 G333 A484 L488 | I325-I329 HydrophobicContact CG2-CD1 3.92Å; I325-I329 HydrophobicContact CG2-CG1 4.48Å; I325-I329 WeakPolarHBondContact O-CG1 3.01Å; I325-I329 PolarHBondContact O-N 2.88Å; A326-I329 PolarHBondContact O-N 3.48Å; M327-I329 PolarHBondContact O-N 3.14Å; I329-S331 VanDerWaalsContact C-N 3.28Å; I329-S331 PolarHBondContact O-N 2.71Å; I329-V332 WeakPolarHBondContact O-CB 3.41Å; I329-V332 PolarHBondContact O-N 2.83Å; I329-G333 PolarHBondContact O-N 3.33Å; I329-A484 HydrophobicContact CB-CB 3.93Å; I329-A484 HydrophobicContact CG2-CB 3.97Å; I329-A484 WeakPolarHBondContact CG2-O 3.44Å; I329-L488 HydrophobicContact CG2-CB 4.11Å; I329-L488 HydrophobicContact CG2-CD2 4.04Å |
| 330 | S | 95.2 | Very high | 93.7 | Very high | 1 Ų | 1 | 32 Ų | 32 | 1% | 0.007 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -61.5 | -36.1 | 176.9 | -64.2 | 0 | 0 | 0 | 0 | 111.9 | A326 M327 V332 G333 G334 A484 D487 | A326-S330 PolarHBondContact O-N 3.49Å; A326-S330 PolarHBondContact O-OG 3.44Å; M327-S330 PolarHBondContact O-N 3.47Å; S330-V332 VanDerWaalsContact C-N 3.28Å; S330-V332 PolarHBondContact O-N 3.43Å; S330-G333 CarbonylContact O-C 3.51Å; S330-G333 WeakPolarHBondContact O-CA 3.27Å; S330-G333 PolarHBondContact O-N 3.25Å; S330-G334 PolarHBondContact O-N 3.34Å; S330-A484 WeakPolarHBondContact OG-CA 3.41Å; S330-A484 WeakPolarHBondContact OG-CB 3.26Å; S330-D487 PolarHBondContact OG-OD2 3.41Å |
| 331 | S | 95.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -62.8 | -30.8 | 173.9 | -68.8 | 0 | 0 | 0 | 0 | 113.2 | A141 F201 M327 A328 I329 G334 L335 | A141-S331 WeakPolarHBondContact CB-OG 3.37Å; F201-S331 VanDerWaalsContact CE2-CB 3.48Å; M327-S331 WeakPolarHBondContact O-CB 3.28Å; M327-S331 PolarHBondContact O-N 3.22Å; M327-S331 PolarHBondContact O-OG 2.82Å; M327-S331 VanDerWaalsContact O-OG 3.1Å; A328-S331 PolarHBondContact O-N 3.35Å; I329-S331 VanDerWaalsContact C-N 3.28Å; I329-S331 PolarHBondContact O-N 2.71Å; S331-G334 PolarHBondContact O-N 3.36Å; S331-L335 PolarHBondContact O-N 3.18Å |
| 332 | V | 95.8 | Very high | 93.7 | Very high | 60 Ų | 60 | 26.9 Ų | 26.9 | 36% | 0.364 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -66.8 | -39.9 | 170.7 | -179.7 | 0 | 0 | 0 | 0 | 110.4 | F201 A328 I329 S330 G334 L335 I336 L488 | F201-V332 HydrophobicContact CE2-CG2 4.02Å; F201-V332 HydrophobicContact CZ-CG2 4.04Å; A328-V332 PolarHBondContact O-N 3.37Å; I329-V332 WeakPolarHBondContact O-CB 3.41Å; I329-V332 PolarHBondContact O-N 2.83Å; S330-V332 VanDerWaalsContact C-N 3.28Å; S330-V332 PolarHBondContact O-N 3.43Å; V332-G334 VanDerWaalsContact C-N 3.28Å; V332-G334 PolarHBondContact O-N 3.1Å; V332-L335 WeakPolarHBondContact O-CB 3.28Å; V332-L335 PolarHBondContact O-N 3.37Å; V332-I336 PolarHBondContact O-N 2.87Å; V332-L488 HydrophobicContact CB-CD1 4.14Å; V332-L488 HydrophobicContact CG1-CD1 3.76Å |
| 333 | G | 95.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -59.1 | -41 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112 | I329 S330 L335 I336 L337 T491 | I329-G333 PolarHBondContact O-N 3.33Å; S330-G333 CarbonylContact O-C 3.51Å; S330-G333 WeakPolarHBondContact O-CA 3.27Å; S330-G333 PolarHBondContact O-N 3.25Å; G333-L335 VanDerWaalsContact C-N 3.32Å; G333-L335 PolarHBondContact O-N 2.91Å; G333-I336 WeakPolarHBondContact O-CB 3.41Å; G333-I336 PolarHBondContact O-N 3.37Å; G333-I336 VanDerWaalsContact O-N 3.15Å; G333-L337 PolarHBondContact O-N 3.02Å; G333-T491 WeakPolarHBondContact O-CG2 3.27Å |
| 334 | G | 95.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -58.3 | -38.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | I137 S330 S331 V332 I336 L337 D338 | I137-G334 WeakPolarHBondContact CA-O 3.4Å; S330-G334 PolarHBondContact O-N 3.34Å; S331-G334 PolarHBondContact O-N 3.36Å; V332-G334 VanDerWaalsContact C-N 3.28Å; V332-G334 PolarHBondContact O-N 3.1Å; G334-I336 VanDerWaalsContact C-N 3.32Å; G334-I336 PolarHBondContact O-N 2.99Å; G334-L337 WeakPolarHBondContact O-CB 3.25Å; G334-L337 PolarHBondContact O-N 2.96Å; G334-D338 PolarHBondContact O-N 2.88Å |
| 335 | L | 95.5 | Very high | 93 | Very high | 39 Ų | 39 | 34.4 Ų | 34.4 | 20% | 0.204 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64.4 | -37 | 175.6 | -177.5 | 61.8 | 0 | 0 | 0 | 112.2 | I137 F201 P205 S331 V332 G333 K339 | I137-L335 HydrophobicContact CD1-CD1 3.93Å; F201-L335 HydrophobicContact CB-CD1 4.29Å; F201-L335 HydrophobicContact CB-CD2 4.38Å; F201-L335 WeakPolarHBondContact O-CD1 3.45Å; P205-L335 HydrophobicContact CG-CD1 4.06Å; S331-L335 PolarHBondContact O-N 3.18Å; V332-L335 WeakPolarHBondContact O-CB 3.28Å; V332-L335 PolarHBondContact O-N 3.37Å; G333-L335 VanDerWaalsContact C-N 3.32Å; G333-L335 PolarHBondContact O-N 2.91Å; L335-K339 WeakPolarHBondContact O-CG 3.28Å; L335-K339 PolarHBondContact O-N 3.43Å |
| 336 | I | 95.7 | Very high | 92.7 | Very high | 51 Ų | 51 | 32.1 Ų | 32.1 | 26% | 0.262 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -66.1 | -43 | 173.9 | -59.1 | 172.8 | 0 | 0 | 0 | 110 | V332 G333 G334 K339 T340 L488 T491 A495 | V332-I336 PolarHBondContact O-N 2.87Å; G333-I336 WeakPolarHBondContact O-CB 3.41Å; G333-I336 PolarHBondContact O-N 3.37Å; G333-I336 VanDerWaalsContact O-N 3.15Å; G334-I336 VanDerWaalsContact C-N 3.32Å; G334-I336 PolarHBondContact O-N 2.99Å; I336-K339 PolarHBondContact O-N 3.19Å; I336-T340 HydrophobicContact CG2-CG2 4.35Å; I336-T340 WeakPolarHBondContact O-CB 3.29Å; I336-T340 VanDerWaalsContact O-CG2 3.29Å; I336-T340 WeakPolarHBondContact O-CG2 3.29Å; I336-T340 PolarHBondContact O-N 3.17Å; I336-T340 VanDerWaalsContact O-N 3.07Å; I336-T340 PolarHBondContact O-OG1 2.87Å; I336-L488 HydrophobicContact CD1-CD1 3.86Å; I336-T491 HydrophobicContact CB-CG2 4.06Å; I336-T491 HydrophobicContact CG2-CG2 3.99Å; I336-A495 HydrophobicContact CG2-CB 3.73Å |
| 337 | L | 95.4 | Very high | 92.2 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -61.4 | -46.4 | 178.1 | -177.4 | 62.6 | 0 | 0 | 0 | 112 | L120 V139 P140 G333 G334 K339 T340 V341 T353 T491 | L120-L337 HydrophobicContact CD2-CD2 4.26Å; V139-L337 HydrophobicContact CB-CD2 4.26Å; V139-L337 HydrophobicContact CG1-CD2 4.2Å; P140-L337 HydrophobicContact CG-CD2 3.92Å; G333-L337 PolarHBondContact O-N 3.02Å; G334-L337 WeakPolarHBondContact O-CB 3.25Å; G334-L337 PolarHBondContact O-N 2.96Å; L337-K339 PolarHBondContact O-N 3.26Å; L337-T340 WeakPolarHBondContact CA-OG1 3.35Å; L337-T340 PolarHBondContact O-N 2.97Å; L337-T340 PolarHBondContact O-OG1 3.49Å; L337-V341 HydrophobicContact CD1-CG2 3.56Å; L337-V341 HydrophobicContact CG-CG2 4.23Å; L337-V341 WeakPolarHBondContact O-CB 3.5Å; L337-V341 WeakPolarHBondContact O-CG2 3.47Å; L337-V341 PolarHBondContact O-N 2.87Å; L337-T353 HydrophobicContact CD1-CG2 3.99Å; L337-T353 WeakPolarHBondContact CD1-OG1 3.42Å; L337-T353 HydrophobicContact CD2-CG2 4.32Å; L337-T491 HydrophobicContact CB-CG2 4.01Å |
| 338 | D | 94.6 | Very high | 91.9 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -54.6 | -52.6 | 175.7 | 167.2 | 57.9 | 0 | 0 | 0 | 111.9 | T133 F136 I137 G334 T340 S342 | T133-D338 WeakPolarHBondContact CB-OD1 3.34Å; T133-D338 PolarHBondContact OG1-OD1 2.92Å; F136-D338 HydrophobicContact CB-CB 3.92Å; I137-D338 HydrophobicContact CD1-CB 4.37Å; I137-D338 HydrophobicContact CG1-CB 3.63Å; G334-D338 PolarHBondContact O-N 2.88Å; D338-T340 VanDerWaalsContact C-N 3.28Å; D338-T340 PolarHBondContact O-N 2.9Å; D338-S342 WeakPolarHBondContact O-CB 3.31Å; D338-S342 PolarHBondContact O-N 3.36Å; D338-S342 PolarHBondContact O-OG 2.95Å |
| 339 | K | 92.9 | Very high | 91.8 | Very high | 85 Ų | 85 | 30.9 Ų | 30.9 | 37% | 0.37 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -68.1 | -26.4 | -177 | -66.6 | -64.9 | 169.6 | -165.1 | 0 | 113.9 | D206 L335 I336 L337 | D206-K339 IonicContact OD1-NZ 2.83Å; D206-K339 PolarHBondContact OD1-NZ 3.26Å; D206-K339 IonicContact OD2-NZ 2.77Å; D206-K339 PolarHBondContact OD2-NZ 3.28Å; L335-K339 WeakPolarHBondContact O-CG 3.28Å; L335-K339 PolarHBondContact O-N 3.43Å; I336-K339 PolarHBondContact O-N 3.19Å; L337-K339 PolarHBondContact O-N 3.26Å |
| 340 | T | 92.6 | Very high | 91.6 | Very high | 17 Ų | 17 | 28.6 Ų | 28.6 | 10% | 0.104 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -85.1 | -49.6 | 179.2 | 48.7 | 0 | 0 | 0 | 0 | 111.5 | I336 L337 D338 S342 D343 F346 M349 A495 | I336-T340 HydrophobicContact CG2-CG2 4.35Å; I336-T340 WeakPolarHBondContact O-CB 3.29Å; I336-T340 VanDerWaalsContact O-CG2 3.29Å; I336-T340 WeakPolarHBondContact O-CG2 3.29Å; I336-T340 PolarHBondContact O-N 3.17Å; I336-T340 VanDerWaalsContact O-N 3.07Å; I336-T340 PolarHBondContact O-OG1 2.87Å; L337-T340 WeakPolarHBondContact CA-OG1 3.35Å; L337-T340 PolarHBondContact O-N 2.97Å; L337-T340 PolarHBondContact O-OG1 3.49Å; D338-T340 VanDerWaalsContact C-N 3.28Å; D338-T340 PolarHBondContact O-N 2.9Å; T340-S342 VanDerWaalsContact C-N 3.26Å; T340-S342 PolarHBondContact O-N 3.14Å; T340-D343 WeakPolarHBondContact O-CB 3.44Å; T340-D343 PolarHBondContact O-N 3.29Å; T340-F346 WeakPolarHBondContact O-CB 3.39Å; T340-M349 VanDerWaalsContact CB-CE 3.4Å; T340-M349 VanDerWaalsContact CB-SD 3.55Å; T340-M349 HydrophobicContact CG2-CE 3.53Å; T340-M349 HydrophobicContact CG2-SD 3.87Å; T340-M349 PolarHBondContact OG1-SD 3.25Å; T340-A495 HydrophobicContact CG2-CB 3.71Å |
| 341 | V | 91 | Very high | 91.6 | Very high | 10 Ų | 10 | 28.5 Ų | 28.5 | 6% | 0.061 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -66.3 | -29.9 | 179.4 | 173.9 | 0 | 0 | 0 | 0 | 112.1 | Q124 F136 L337 D343 A350 | Q124-V341 HydrophobicContact CB-CG1 4.06Å; F136-V341 HydrophobicContact CD1-CG1 4.28Å; F136-V341 HydrophobicContact CE1-CB 4.38Å; F136-V341 HydrophobicContact CE1-CG1 3.64Å; F136-V341 HydrophobicContact CE2-CG1 4.06Å; F136-V341 HydrophobicContact CZ-CB 4.43Å; F136-V341 HydrophobicContact CZ-CG1 3.51Å; L337-V341 HydrophobicContact CD1-CG2 3.56Å; L337-V341 HydrophobicContact CG-CG2 4.23Å; L337-V341 WeakPolarHBondContact O-CB 3.5Å; L337-V341 WeakPolarHBondContact O-CG2 3.47Å; L337-V341 PolarHBondContact O-N 2.87Å; V341-D343 PolarHBondContact O-N 3.16Å; V341-A350 HydrophobicContact CG2-CB 4.14Å |
| 342 | S | 88.5 | Confident | 91.5 | Very high | 60 Ų | 60 | 28.5 Ų | 28.5 | 42% | 0.42 | 17% | 0.165 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -68.9 | -16.7 | 173.9 | -61.9 | 0 | 0 | 0 | 0 | 113.8 | D338 T340 | D338-S342 WeakPolarHBondContact O-CB 3.31Å; D338-S342 PolarHBondContact O-N 3.36Å; D338-S342 PolarHBondContact O-OG 2.95Å; T340-S342 VanDerWaalsContact C-N 3.26Å; T340-S342 PolarHBondContact O-N 3.14Å |
| 343 | D | 88.4 | Confident | 91.5 | Very high | 53 Ų | 53 | 25.8 Ų | 25.8 | 28% | 0.283 | 15% | 0.148 | S | C | . | . | S | Bend | trans | -89.4 | 119.3 | 172.9 | -173.2 | -24.2 | 0 | 0 | 0 | 109.3 | T340 V341 N345 F346 A347 | T340-D343 WeakPolarHBondContact O-CB 3.44Å; T340-D343 PolarHBondContact O-N 3.29Å; V341-D343 PolarHBondContact O-N 3.16Å; D343-N345 PolarHBondContact O-N 3.43Å; D343-N345 WeakPolarHBondContact OD1-CB 3.09Å; D343-N345 PolarHBondContact OD1-N 2.93Å; D343-N345 PolarHBondContact OD1-ND2 3.49Å; D343-F346 HydrophobicContact CB-CD2 3.78Å; D343-F346 HydrophobicContact CB-CE2 4.42Å; D343-F346 PolarHBondContact O-N 3.11Å; D343-F346 WeakPolarHBondContact OD2-CE2 3.36Å; D343-A347 PolarHBondContact O-N 3.46Å |
| 344 | P | 84.6 | Confident | 91.5 | Very high | 110 Ų | 110 | 25.9 Ų | 25.9 | 71% | 0.714 | 15% | 0.149 | S | C | * | . | G | 310 helix | trans | -53.8 | -27.8 | 179 | -26.7 | 34.8 | 0 | 0 | 0 | 114.1 | F346 | P344-F346 PolarHBondContact O-N 3.41Š|
| 345 | N | 83.7 | Confident | 91.5 | Very high | 70 Ų | 70 | 25.9 Ų | 25.9 | 37% | 0.374 | 15% | 0.149 | S | C | . | . | G | 310 helix | trans | -69.7 | -18.1 | 178.2 | -60.2 | -74.1 | 0 | 0 | 0 | 113.1 | D343 W502 | D343-N345 PolarHBondContact O-N 3.43Å; D343-N345 WeakPolarHBondContact OD1-CB 3.09Å; D343-N345 PolarHBondContact OD1-N 2.93Å; D343-N345 PolarHBondContact OD1-ND2 3.49Å; N345-W502 PolarHBondContact OD1-NE1 3.15Å |
| 346 | F | 87.4 | Confident | 91.5 | Very high | 19 Ų | 19 | 24 Ų | 24 | 8% | 0.083 | 14% | 0.139 | C | C | . | . | G | 310 helix | trans | -125 | 14.6 | -175.6 | -49.2 | -55.3 | 0 | 0 | 0 | 113 | T340 D343 P344 G348 M349 F498 H499 W502 | T340-F346 WeakPolarHBondContact O-CB 3.39Å; D343-F346 HydrophobicContact CB-CD2 3.78Å; D343-F346 HydrophobicContact CB-CE2 4.42Å; D343-F346 PolarHBondContact O-N 3.11Å; D343-F346 WeakPolarHBondContact OD2-CE2 3.36Å; P344-F346 PolarHBondContact O-N 3.41Å; F346-G348 PolarHBondContact O-N 3.07Å; F346-G348 VanDerWaalsContact O-N 3.1Å; F346-M349 HydrophobicContact CB-CE 4.19Å; F346-M349 WeakPolarHBondContact O-CB 3.2Å; F346-M349 PolarHBondContact O-N 2.97Å; F346-F498 HydrophobicContact CD1-CB 3.71Å; F346-F498 HydrophobicContact CD1-CD1 4.14Å; F346-F498 HydrophobicContact CD1-CG 4.38Å; F346-F498 HydrophobicContact CE1-CB 4.18Å; F346-F498 WeakPolarHBondContact CE1-O 3.46Å; F346-F498 HydrophobicContact CG-CB 4.49Å; F346-H499 AromaticContact CZ-ND1 3.94Å; F346-W502 HydrophobicContact CE1-CB 3.78Å; F346-W502 HydrophobicContact CE1-CG 4.18Å; F346-W502 HydrophobicContact CZ-CB 4.22Å; F346-W502 HydrophobicContact CZ-CG 4.28Å |
| 347 | A | 84.5 | Confident | 91.4 | Very high | 20 Ų | 20 | 22 Ų | 22 | 17% | 0.165 | 13% | 0.129 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55 | -30.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q124 D343 M349 A350 | Q124-A347 PolarHBondContact NE2-O 2.89Å; Q124-A347 VanDerWaalsContact NE2-O 3.1Å; Q124-A347 PolarHBondContact OE1-O 3.24Å; D343-A347 PolarHBondContact O-N 3.46Å; A347-M349 PolarHBondContact O-N 2.98Å; A347-M349 VanDerWaalsContact O-N 3.14Å; A347-A350 PolarHBondContact O-N 3.07Å |
| 348 | G | 87.3 | Confident | 91.3 | Very high | 5 Ų | 5 | 22.5 Ų | 22.5 | 5% | 0.052 | 13% | 0.134 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64 | -15.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | F346 A350 V351 F352 G433 | F346-G348 PolarHBondContact O-N 3.07Å; F346-G348 VanDerWaalsContact O-N 3.1Å; G348-A350 PolarHBondContact O-N 3.49Å; G348-V351 WeakPolarHBondContact O-CG1 3.35Å; G348-V351 PolarHBondContact O-N 3.4Å; G348-F352 WeakPolarHBondContact O-CD2 3.36Å; G348-F352 WeakPolarHBondContact O-CE2 3.48Å; G348-G433 WeakPolarHBondContact CA-O 3.3Å |
| 349 | M | 91.8 | Very high | 91.2 | Very high | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -62.6 | -26 | 177.8 | -166.8 | 178.7 | -51.2 | 0 | 0 | 113.3 | T340 F346 A347 V351 F352 T353 L494 A495 F498 | T340-M349 VanDerWaalsContact CB-CE 3.4Å; T340-M349 VanDerWaalsContact CB-SD 3.55Å; T340-M349 HydrophobicContact CG2-CE 3.53Å; T340-M349 HydrophobicContact CG2-SD 3.87Å; T340-M349 PolarHBondContact OG1-SD 3.25Å; F346-M349 HydrophobicContact CB-CE 4.19Å; F346-M349 WeakPolarHBondContact O-CB 3.2Å; F346-M349 PolarHBondContact O-N 2.97Å; A347-M349 PolarHBondContact O-N 2.98Å; A347-M349 VanDerWaalsContact O-N 3.14Å; M349-V351 VanDerWaalsContact C-N 3.35Å; M349-V351 PolarHBondContact O-N 2.97Å; M349-F352 PolarHBondContact O-N 3.47Å; M349-T353 PolarHBondContact O-N 3.48Å; M349-T353 PolarHBondContact O-OG1 3.49Å; M349-L494 HydrophobicContact CG-CD2 3.61Å; M349-L494 HydrophobicContact CG-CG 3.93Å; M349-L494 HydrophobicContact SD-CD2 4.48Å; M349-L494 HydrophobicContact SD-CG 4.44Å; M349-A495 VanDerWaalsContact CE-CA 3.42Å; M349-A495 HydrophobicContact CE-CB 3.86Å; M349-A495 HydrophobicContact SD-CB 4.03Å; M349-F498 HydrophobicContact CB-CD2 4.44Å; M349-F498 HydrophobicContact CB-CE2 4.22Å; M349-F498 HydrophobicContact CB-CZ 4.4Å; M349-F498 HydrophobicContact CE-CB 3.89Å; M349-F498 HydrophobicContact CE-CD2 3.97Å; M349-F498 HydrophobicContact CE-CG 3.99Å; M349-F498 HydrophobicContact CG-CD2 4.39Å; M349-F498 HydrophobicContact CG-CE2 4.34Å |
| 350 | A | 93 | Very high | 91.2 | Very high | 0 Ų | 0 | 18.6 Ų | 18.6 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -54.8 | -46.2 | 180 | 0 | 0 | 0 | 0 | 0 | 112.4 | L120 Q124 V341 A347 G348 F352 P354 | L120-A350 WeakPolarHBondContact CD2-O 3.43Å; L120-A350 HydrophobicContact CG-CB 4.08Å; Q124-A350 HydrophobicContact CG-CB 4.34Å; Q124-A350 VanDerWaalsContact NE2-CB 3.34Å; V341-A350 HydrophobicContact CG2-CB 4.14Å; A347-A350 PolarHBondContact O-N 3.07Å; G348-A350 PolarHBondContact O-N 3.49Å; A350-F352 VanDerWaalsContact C-N 3.33Å; A350-F352 PolarHBondContact O-N 3.46Å; A350-P354 WeakPolarHBondContact O-CD 3.28Å |
| 351 | V | 94 | Very high | 91.1 | Very high | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -69.7 | -32.1 | -177.9 | 76.8 | 0 | 0 | 0 | 0 | 112.7 | G117 M118 D121 G348 M349 I427 | G117-V351 WeakPolarHBondContact CA-O 3.32Å; G117-V351 WeakPolarHBondContact O-CA 3.27Å; M118-V351 HydrophobicContact SD-CG2 3.69Å; D121-V351 HydrophobicContact CB-CB 4.05Å; D121-V351 HydrophobicContact CB-CG2 4.36Å; G348-V351 WeakPolarHBondContact O-CG1 3.35Å; G348-V351 PolarHBondContact O-N 3.4Å; M349-V351 VanDerWaalsContact C-N 3.35Å; M349-V351 PolarHBondContact O-N 2.97Å; V351-I427 HydrophobicContact CG1-CG2 4.01Å; V351-I427 HydrophobicContact CG2-CD1 4.23Å; V351-I427 HydrophobicContact CG2-CG1 4.21Å; V351-I427 HydrophobicContact CG2-CG2 3.89Å |
| 352 | F | 94.7 | Very high | 90.9 | Very high | 0 Ų | 0 | 18.6 Ų | 18.6 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -88.1 | -23.4 | -172.7 | -62.6 | -64.6 | 0 | 0 | 0 | 113.5 | G348 M349 A350 V355 I356 L424 I427 T435 L437 F441 Y445 L494 F498 | G348-F352 WeakPolarHBondContact O-CD2 3.36Å; G348-F352 WeakPolarHBondContact O-CE2 3.48Å; M349-F352 PolarHBondContact O-N 3.47Å; A350-F352 VanDerWaalsContact C-N 3.33Å; A350-F352 PolarHBondContact O-N 3.46Å; F352-V355 PolarHBondContact O-N 2.98Å; F352-I356 PolarHBondContact O-N 2.88Å; F352-L424 HydrophobicContact CD1-CD2 3.76Å; F352-L424 HydrophobicContact CE1-CD2 3.47Å; F352-L424 VanDerWaalsContact CE1-CD2 3.47Å; F352-I427 HydrophobicContact CD1-CD1 3.8Å; F352-I427 HydrophobicContact CE1-CD1 3.79Å; F352-I427 HydrophobicContact CE1-CG2 4.13Å; F352-I427 HydrophobicContact CZ-CG2 4.36Å; F352-T435 WeakPolarHBondContact CE2-OG1 3.41Å; F352-L437 HydrophobicContact CE1-CD2 4.27Å; F352-L437 HydrophobicContact CZ-CD2 4.03Å; F352-F441 HydrophobicContact CD1-CZ 4.3Å; F352-F441 AromaticContact CD2-CZ 3.82Å; F352-F441 HydrophobicContact CD2-CZ 3.82Å; F352-F441 AromaticContact CE1-CE1 4Å; F352-F441 HydrophobicContact CE1-CE1 4Å; F352-F441 HydrophobicContact CE1-CZ 4.03Å; F352-F441 HydrophobicContact CE2-CE1 4.12Å; F352-F441 HydrophobicContact CE2-CE2 4.29Å; F352-F441 AromaticContact CE2-CZ 3.51Å; F352-F441 HydrophobicContact CE2-CZ 3.51Å; F352-F441 HydrophobicContact CG-CZ 4.22Å; F352-F441 AromaticContact CZ-CE1 3.75Å; F352-F441 HydrophobicContact CZ-CE1 3.75Å; F352-F441 AromaticContact CZ-CZ 3.63Å; F352-F441 HydrophobicContact CZ-CZ 3.63Å; F352-Y445 HydrophobicContact CB-CE2 4.01Å; F352-Y445 HydrophobicContact CD1-CE2 4.09Å; F352-Y445 HydrophobicContact CG-CE2 4.28Å; F352-L494 HydrophobicContact CB-CD1 4.29Å; F352-L494 HydrophobicContact CB-CD2 3.74Å; F352-F498 HydrophobicContact CD2-CE2 4.11Å; F352-F498 AromaticContact CD2-CZ 3.82Å; F352-F498 HydrophobicContact CD2-CZ 3.82Å; F352-F498 HydrophobicContact CE2-CZ 4.09Å |
| 353 | T | 95.2 | Very high | 91.1 | Very high | 3 Ų | 3 | 15.9 Ų | 15.9 | 2% | 0.018 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -63.5 | -50.4 | -174.9 | -61.3 | 0 | 0 | 0 | 0 | 112.7 | L337 M349 V355 I356 N357 T491 | L337-T353 HydrophobicContact CD1-CG2 3.99Å; L337-T353 WeakPolarHBondContact CD1-OG1 3.42Å; L337-T353 HydrophobicContact CD2-CG2 4.32Å; M349-T353 PolarHBondContact O-N 3.48Å; M349-T353 PolarHBondContact O-OG1 3.49Å; T353-V355 PolarHBondContact O-N 3.39Å; T353-I356 WeakPolarHBondContact O-CG2 3.38Å; T353-I356 PolarHBondContact O-N 3.03Å; T353-N357 WeakPolarHBondContact CG2-ND2 3.44Å; T353-N357 VanDerWaalsContact O-CB 3.32Å; T353-N357 WeakPolarHBondContact O-CB 3.35Å; T353-N357 VanDerWaalsContact O-CG 3.28Å; T353-N357 PolarHBondContact O-N 3.35Å; T353-T491 HydrophobicContact CG2-CG2 4.19Å |
| 354 | P | 94.9 | Very high | 91.2 | Very high | 2 Ų | 2 | 13.4 Ų | 13.4 | 1% | 0.013 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -60.7 | -32.3 | 176.5 | -27.6 | 39.6 | 0 | 0 | 0 | 112.8 | T113 A116 L120 A350 G358 | T113-P354 WeakPolarHBondContact CB-O 3.39Å; A116-P354 HydrophobicContact CB-CB 4.08Å; L120-P354 HydrophobicContact CB-CG 4.48Å; L120-P354 HydrophobicContact CD2-CG 3.92Å; A350-P354 WeakPolarHBondContact O-CD 3.28Å; P354-G358 WeakPolarHBondContact O-CA 3.36Å; P354-G358 PolarHBondContact O-N 2.56Å |
| 355 | V | 95.3 | Very high | 91.3 | Very high | 0 Ų | 0 | 8.5 Ų | 8.5 | 0% | 0 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -69.7 | -51.2 | 179.2 | -177.1 | 0 | 0 | 0 | 0 | 111.6 | V114 F352 T353 V359 F423 I427 | V114-V355 HydrophobicContact CB-CG2 4.33Å; V114-V355 HydrophobicContact CG2-CG1 4.43Å; V114-V355 HydrophobicContact CG2-CG2 3.76Å; F352-V355 PolarHBondContact O-N 2.98Å; T353-V355 PolarHBondContact O-N 3.39Å; V355-V359 HydrophobicContact CG1-CG2 4.22Å; V355-V359 WeakPolarHBondContact O-CB 3.45Å; V355-V359 WeakPolarHBondContact O-CG2 3.34Å; V355-V359 PolarHBondContact O-N 3.07Å; V355-F423 HydrophobicContact CG1-CB 3.97Å; V355-F423 HydrophobicContact CG1-CD2 4.11Å; V355-F423 HydrophobicContact CG1-CG 4.36Å; V355-I427 HydrophobicContact CG2-CD1 4.18Å |
| 356 | I | 95.4 | Very high | 91.3 | Very high | 0 Ų | 0 | 7.3 Ų | 7.3 | 0% | 0 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -66 | -41.7 | -178.7 | -164.6 | 162.6 | 0 | 0 | 0 | 111.5 | F352 T353 G360 Y445 A448 A449 Q452 L494 | F352-I356 PolarHBondContact O-N 2.88Å; T353-I356 WeakPolarHBondContact O-CG2 3.38Å; T353-I356 PolarHBondContact O-N 3.03Å; I356-G360 PolarHBondContact O-N 2.94Å; I356-Y445 HydrophobicContact CD1-CE2 4.47Å; I356-A448 HydrophobicContact CD1-CB 4.1Å; I356-A449 HydrophobicContact CD1-CB 4.26Å; I356-A449 HydrophobicContact CG1-CB 4.42Å; I356-Q452 PolarHBondContact O-NE2 3.1Å; I356-Q452 PolarHBondContact O-OE1 2.98Å; I356-Q452 VanDerWaalsContact O-OE1 3.07Å; I356-L494 HydrophobicContact CD1-CB 4.32Å; I356-L494 HydrophobicContact CG2-CB 4.43Å; I356-L494 HydrophobicContact CG2-CD2 3.98Å |
| 357 | N | 94.8 | Very high | 91.4 | Very high | 8 Ų | 8 | 6.5 Ų | 6.5 | 4% | 0.043 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -69.4 | -51.1 | 179.2 | -67.4 | -5.5 | 0 | 0 | 0 | 111.2 | T353 G360 G361 D487 G490 T491 | T353-N357 WeakPolarHBondContact CG2-ND2 3.44Å; T353-N357 VanDerWaalsContact O-CB 3.32Å; T353-N357 WeakPolarHBondContact O-CB 3.35Å; T353-N357 VanDerWaalsContact O-CG 3.28Å; T353-N357 PolarHBondContact O-N 3.35Å; N357-G360 PolarHBondContact O-N 2.95Å; N357-G361 PolarHBondContact O-N 3.46Å; N357-D487 PolarHBondContact OD1-O 3.3Å; N357-G490 VanDerWaalsContact OD1-CA 3.28Å; N357-G490 WeakPolarHBondContact OD1-CA 3.27Å; N357-T491 PolarHBondContact ND2-OG1 3.44Å; N357-T491 PolarHBondContact OD1-N 3.25Å; N357-T491 VanDerWaalsContact OD1-N 3.11Å; N357-T491 PolarHBondContact OD1-OG1 3.42Å |
| 358 | G | 92.2 | Very high | 91.5 | Very high | 10 Ų | 10 | 5.6 Ų | 5.6 | 10% | 0.103 | 4% | 0.037 | C | C | . | . | H | α-helix | trans | -64 | -45.2 | -177.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | P354 G361 N362 | P354-G358 WeakPolarHBondContact O-CA 3.36Å; P354-G358 PolarHBondContact O-N 2.56Å; G358-G361 PolarHBondContact O-N 2.69Å; G358-N362 VanDerWaalsContact O-CB 3.29Å; G358-N362 WeakPolarHBondContact O-CB 3.43Å; G358-N362 PolarHBondContact O-N 2.98Å; G358-N362 PolarHBondContact O-ND2 3.4Å |
| 359 | V | 93 | Very high | 91.2 | Very high | 3 Ų | 3 | 7.4 Ų | 7.4 | 2% | 0.018 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -63 | -47.6 | 178.2 | 175.1 | 0 | 0 | 0 | 0 | 111.3 | F106 V355 N362 L363 H420 F423 | F106-V359 HydrophobicContact CE2-CG1 3.51Å; F106-V359 HydrophobicContact CZ-CG1 3.87Å; V355-V359 HydrophobicContact CG1-CG2 4.22Å; V355-V359 WeakPolarHBondContact O-CB 3.45Å; V355-V359 WeakPolarHBondContact O-CG2 3.34Å; V355-V359 PolarHBondContact O-N 3.07Å; V359-N362 PolarHBondContact O-N 2.92Å; V359-L363 HydrophobicContact CG1-CD1 4.17Å; V359-L363 WeakPolarHBondContact O-CG 3.24Å; V359-L363 PolarHBondContact O-N 2.72Å; V359-L363 VanDerWaalsContact O-N 3.08Å; V359-H420 WeakPolarHBondContact CG1-NE2 3.49Å; V359-F423 HydrophobicContact CG2-CD2 3.86Å; V359-F423 HydrophobicContact CG2-CE2 3.59Å |
| 360 | G | 93.2 | Very high | 90.8 | Very high | 0 Ų | 0 | 9.6 Ų | 9.6 | 0% | 0 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -62.4 | -45.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | I356 N357 N362 L363 V364 | I356-G360 PolarHBondContact O-N 2.94Å; N357-G360 PolarHBondContact O-N 2.95Å; G360-N362 PolarHBondContact O-N 2.83Å; G360-L363 PolarHBondContact O-N 2.91Å; G360-V364 WeakPolarHBondContact O-CG1 3.45Å; G360-V364 PolarHBondContact O-N 3.29Å |
| 361 | G | 90.8 | Very high | 90.4 | Very high | 5 Ų | 5 | 9.6 Ų | 9.6 | 5% | 0.052 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -60.2 | -42 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | N357 G358 V364 A365 | N357-G361 PolarHBondContact O-N 3.46Å; G358-G361 PolarHBondContact O-N 2.69Å; G361-V364 VanDerWaalsContact O-CG1 3.32Å; G361-V364 WeakPolarHBondContact O-CG1 3.22Å; G361-A365 VanDerWaalsContact O-CB 3.28Å; G361-A365 WeakPolarHBondContact O-CB 3.43Å; G361-A365 PolarHBondContact O-N 3.1Å |
| 362 | N | 87.2 | Confident | 89.8 | Confident | 22 Ų | 22 | 9.6 Ų | 9.6 | 12% | 0.118 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -68.7 | -44.8 | 178.7 | -67.8 | -32.1 | 0 | 0 | 0 | 112.1 | A259 G358 V359 G360 V364 A365 V366 | A259-N362 WeakPolarHBondContact CB-OD1 3.36Å; G358-N362 VanDerWaalsContact O-CB 3.29Å; G358-N362 WeakPolarHBondContact O-CB 3.43Å; G358-N362 PolarHBondContact O-N 2.98Å; G358-N362 PolarHBondContact O-ND2 3.4Å; V359-N362 PolarHBondContact O-N 2.92Å; G360-N362 PolarHBondContact O-N 2.83Å; N362-V364 PolarHBondContact O-N 3.3Å; N362-A365 PolarHBondContact O-N 3.13Å; N362-V366 WeakPolarHBondContact O-CG2 3.48Å; N362-V366 PolarHBondContact O-N 3.15Å; N362-V366 VanDerWaalsContact O-N 3.07Å |
| 363 | L | 90.9 | Very high | 89 | Confident | 3 Ų | 3 | 12.4 Ų | 12.4 | 2% | 0.016 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -61.9 | -44.5 | 178.3 | -72.6 | 175.5 | 0 | 0 | 0 | 111.7 | F106 V359 G360 V366 Q367 L412 L415 V416 V453 | F106-L363 HydrophobicContact CD2-CD2 3.58Å; F106-L363 HydrophobicContact CD2-CG 4.09Å; F106-L363 HydrophobicContact CE2-CD1 3.94Å; F106-L363 HydrophobicContact CE2-CD2 3.71Å; F106-L363 HydrophobicContact CE2-CG 3.88Å; V359-L363 HydrophobicContact CG1-CD1 4.17Å; V359-L363 WeakPolarHBondContact O-CG 3.24Å; V359-L363 PolarHBondContact O-N 2.72Å; V359-L363 VanDerWaalsContact O-N 3.08Å; G360-L363 PolarHBondContact O-N 2.91Å; L363-V366 PolarHBondContact O-N 3.29Å; L363-Q367 PolarHBondContact O-N 3.09Å; L363-L412 HydrophobicContact CD2-CB 4.18Å; L363-L412 HydrophobicContact CD2-CD2 3.68Å; L363-L412 HydrophobicContact CD2-CG 4.48Å; L363-L415 HydrophobicContact CD2-CD2 4.42Å; L363-V416 HydrophobicContact CD1-CG2 3.73Å; L363-V453 HydrophobicContact CD1-CG1 4.09Å; L363-V453 HydrophobicContact CD1-CG2 4.12Å |
| 364 | V | 91.6 | Very high | 88.3 | Confident | 1 Ų | 1 | 15.3 Ų | 15.3 | 1% | 0.006 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -70.8 | -34 | -179.3 | 75.9 | 0 | 0 | 0 | 0 | 112.1 | G360 G361 N362 Q367 A368 L456 A460 L482 | G360-V364 WeakPolarHBondContact O-CG1 3.45Å; G360-V364 PolarHBondContact O-N 3.29Å; G361-V364 VanDerWaalsContact O-CG1 3.32Å; G361-V364 WeakPolarHBondContact O-CG1 3.22Å; N362-V364 PolarHBondContact O-N 3.3Å; V364-Q367 PolarHBondContact O-N 3.08Å; V364-A368 WeakPolarHBondContact O-CB 3.42Å; V364-A368 PolarHBondContact O-N 2.91Å; V364-L456 HydrophobicContact CB-CB 4Å; V364-L456 HydrophobicContact CB-CD1 4.4Å; V364-L456 HydrophobicContact CG1-CD1 4.28Å; V364-L456 HydrophobicContact CG2-CB 3.83Å; V364-L456 WeakPolarHBondContact CG2-O 3.41Å; V364-A460 HydrophobicContact CG2-CB 3.67Å; V364-L482 HydrophobicContact CG1-CB 3.79Å; V364-L482 HydrophobicContact CG2-CB 3.88Å; V364-L482 HydrophobicContact CG2-CD1 4.02Å; V364-L482 HydrophobicContact CG2-CD2 3.9Å; V364-L482 HydrophobicContact CG2-CG 4.11Å |
| 365 | A | 86.4 | Confident | 87.7 | Confident | 7 Ų | 7 | 16.1 Ų | 16.1 | 6% | 0.058 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -63.3 | -43.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | M151 G361 N362 Q367 A368 S369 I479 | M151-A365 HydrophobicContact CE-CB 4.44Å; M151-A365 HydrophobicContact SD-CB 4.14Å; G361-A365 VanDerWaalsContact O-CB 3.28Å; G361-A365 WeakPolarHBondContact O-CB 3.43Å; G361-A365 PolarHBondContact O-N 3.1Å; N362-A365 PolarHBondContact O-N 3.13Å; A365-Q367 VanDerWaalsContact C-N 3.35Å; A365-Q367 PolarHBondContact O-N 2.6Å; A365-A368 PolarHBondContact O-N 2.96Å; A365-S369 WeakPolarHBondContact O-CB 3.33Å; A365-S369 PolarHBondContact O-N 3.28Å; A365-I479 HydrophobicContact CB-CG2 4.11Å |
| 366 | V | 83 | Confident | 86.8 | Confident | 46 Ų | 46 | 19.7 Ų | 19.7 | 28% | 0.279 | 11% | 0.108 | S | C | . | . | H | α-helix | trans | -59.9 | -45.3 | 173.4 | 170.7 | 0 | 0 | 0 | 0 | 110.7 | V102 N362 L363 R370 L412 | V102-V366 HydrophobicContact CG2-CG1 4.34Å; N362-V366 WeakPolarHBondContact O-CG2 3.48Å; N362-V366 PolarHBondContact O-N 3.15Å; N362-V366 VanDerWaalsContact O-N 3.07Å; L363-V366 PolarHBondContact O-N 3.29Å; V366-R370 VanDerWaalsContact O-CG 3.27Å; V366-R370 WeakPolarHBondContact O-CG 3.21Å; V366-R370 PolarHBondContact O-N 3.34Å; V366-L412 HydrophobicContact CG1-CD1 4.47Å; V366-L412 HydrophobicContact CG1-CD2 4.26Å |
| 367 | Q | 89.3 | Confident | 85.8 | Confident | 2 Ų | 2 | 26.4 Ų | 26.4 | 1% | 0.009 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -63.2 | -46.9 | 177.9 | -175.4 | 64.1 | 6.5 | 0 | 0 | 112.1 | L363 V364 A365 S369 R370 I371 N405 S408 L412 L457 A460 | L363-Q367 PolarHBondContact O-N 3.09Å; V364-Q367 PolarHBondContact O-N 3.08Å; A365-Q367 VanDerWaalsContact C-N 3.35Å; A365-Q367 PolarHBondContact O-N 2.6Å; Q367-S369 PolarHBondContact O-N 3.18Å; Q367-R370 PolarHBondContact O-N 3.35Å; Q367-I371 HydrophobicContact CG-CD1 3.9Å; Q367-I371 HydrophobicContact CG-CG1 4.43Å; Q367-I371 VanDerWaalsContact O-CG1 3.31Å; Q367-I371 WeakPolarHBondContact O-CG1 2.74Å; Q367-I371 PolarHBondContact O-N 3.47Å; Q367-N405 PolarHBondContact NE2-O 3.03Å; Q367-S408 PolarHBondContact OE1-OG 3.32Å; Q367-L412 HydrophobicContact CB-CD1 3.68Å; Q367-L412 HydrophobicContact CG-CD1 4.39Å; Q367-L457 HydrophobicContact CB-CD2 3.68Å; Q367-L457 HydrophobicContact CG-CD2 3.77Å; Q367-A460 HydrophobicContact CG-CB 4.5Å |
| 368 | A | 87.6 | Confident | 85 | Confident | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -61.4 | -44.1 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | V364 A365 R370 I371 S372 V464 I479 L482 | V364-A368 WeakPolarHBondContact O-CB 3.42Å; V364-A368 PolarHBondContact O-N 2.91Å; A365-A368 PolarHBondContact O-N 2.96Å; A368-R370 PolarHBondContact O-N 2.81Å; A368-I371 PolarHBondContact O-N 3.48Å; A368-S372 VanDerWaalsContact O-CB 3.28Å; A368-S372 WeakPolarHBondContact O-CB 3.12Å; A368-S372 PolarHBondContact O-N 3.04Å; A368-V464 HydrophobicContact CB-CG2 4.16Å; A368-I479 HydrophobicContact CB-CG1 4.36Å; A368-L482 HydrophobicContact CB-CD1 3.62Å |
| 369 | S | 81.4 | Confident | 84.2 | Confident | 43 Ų | 43 | 31 Ų | 31 | 30% | 0.301 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -62.2 | -40.8 | 176.1 | 175.3 | 0 | 0 | 0 | 0 | 112.2 | A365 Q367 S372 T373 | A365-S369 WeakPolarHBondContact O-CB 3.33Å; A365-S369 PolarHBondContact O-N 3.28Å; Q367-S369 PolarHBondContact O-N 3.18Å; S369-S372 PolarHBondContact O-N 2.72Å; S369-T373 WeakPolarHBondContact O-CB 3.33Å; S369-T373 PolarHBondContact O-N 2.83Å; S369-T373 PolarHBondContact O-OG1 2.85Å |
| 370 | R | 81.9 | Confident | 83.4 | Confident | 46 Ų | 46 | 36.9 Ų | 36.9 | 17% | 0.174 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.6 | -44.5 | 176.8 | -72.9 | 177.5 | 121.1 | -114.5 | -15 | 112.6 | E93 V366 Q367 A368 T373 F374 S408 | E93-R370 IonicContact OE1-NH2 3.25Å; E93-R370 IonicContact OE2-CZ 3.94Å; E93-R370 IonicContact OE2-NH1 3.79Å; E93-R370 IonicContact OE2-NH2 3.86Å; E93-R370 PolarHBondContact OE2-NH2 3.35Å; V366-R370 VanDerWaalsContact O-CG 3.27Å; V366-R370 WeakPolarHBondContact O-CG 3.21Å; V366-R370 PolarHBondContact O-N 3.34Å; Q367-R370 PolarHBondContact O-N 3.35Å; A368-R370 PolarHBondContact O-N 2.81Å; R370-T373 PolarHBondContact O-N 2.86Å; R370-F374 WeakPolarHBondContact O-CB 3.15Å; R370-F374 PolarHBondContact O-N 2.91Å; R370-S408 WeakPolarHBondContact CD-OG 3.09Å; R370-S408 PolarHBondContact NH1-OG 3.48Å |
| 371 | I | 84.9 | Confident | 82.6 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.6 | -45.9 | 176.6 | -61.2 | 169.8 | 0 | 0 | 0 | 109.8 | Q367 A368 T373 F374 L375 N405 D461 V464 | Q367-I371 HydrophobicContact CG-CD1 3.9Å; Q367-I371 HydrophobicContact CG-CG1 4.43Å; Q367-I371 VanDerWaalsContact O-CG1 3.31Å; Q367-I371 WeakPolarHBondContact O-CG1 2.74Å; Q367-I371 PolarHBondContact O-N 3.47Å; A368-I371 PolarHBondContact O-N 3.48Å; I371-T373 PolarHBondContact O-N 2.92Å; I371-F374 WeakPolarHBondContact O-CB 3.5Å; I371-F374 PolarHBondContact O-N 3.39Å; I371-L375 HydrophobicContact CG2-CD1 4.1Å; I371-L375 HydrophobicContact CG2-CG 4.48Å; I371-L375 WeakPolarHBondContact O-CG 3.28Å; I371-L375 PolarHBondContact O-N 2.84Å; I371-N405 HydrophobicContact CG1-CB 4.11Å; I371-D461 HydrophobicContact CD1-CB 4.32Å; I371-V464 HydrophobicContact CB-CB 4.49Å; I371-V464 HydrophobicContact CB-CG1 4Å; I371-V464 HydrophobicContact CG2-CB 4Å; I371-V464 HydrophobicContact CG2-CG1 3.45Å; I371-V464 VanDerWaalsContact CG2-CG1 3.45Å |
| 372 | S | 82.6 | Confident | 81.7 | Confident | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -57.4 | -49.3 | 177.1 | 177.4 | 0 | 0 | 0 | 0 | 112 | A368 S369 F374 L375 H376 P474 D475 | A368-S372 VanDerWaalsContact O-CB 3.28Å; A368-S372 WeakPolarHBondContact O-CB 3.12Å; A368-S372 PolarHBondContact O-N 3.04Å; S369-S372 PolarHBondContact O-N 2.72Å; S372-F374 VanDerWaalsContact C-N 3.31Å; S372-F374 PolarHBondContact O-N 3.33Å; S372-L375 PolarHBondContact O-N 2.82Å; S372-H376 PolarHBondContact O-CD2 2.78Å; S372-H376 PolarHBondContact O-N 2.83Å; S372-P474 WeakPolarHBondContact OG-CG 3.46Å; S372-D475 WeakPolarHBondContact CB-OD1 3.45Å; S372-D475 PolarHBondContact OG-OD1 3.33Å; S372-D475 PolarHBondContact OG-OD2 3.33Å |
| 373 | T | 77 | Confident | 80.7 | Confident | 59 Ų | 59 | 44.9 Ų | 44.9 | 36% | 0.362 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -58.4 | -44.2 | 176.9 | -58.4 | 0 | 0 | 0 | 0 | 111.2 | S369 R370 I371 L375 H376 M377 | S369-T373 WeakPolarHBondContact O-CB 3.33Å; S369-T373 PolarHBondContact O-N 2.83Å; S369-T373 PolarHBondContact O-OG1 2.85Å; R370-T373 PolarHBondContact O-N 2.86Å; I371-T373 PolarHBondContact O-N 2.92Å; T373-L375 VanDerWaalsContact C-N 3.31Å; T373-L375 PolarHBondContact O-N 3.13Å; T373-H376 PolarHBondContact O-N 2.63Å; T373-M377 HydrophobicContact CG2-CE 3.81Å; T373-M377 HydrophobicContact CG2-SD 4.34Å; T373-M377 VanDerWaalsContact O-CG 3.32Å; T373-M377 WeakPolarHBondContact O-CG 3.2Å; T373-M377 PolarHBondContact O-N 3.42Å |
| 374 | F | 80.3 | Confident | 78.9 | Confident | 65 Ų | 65 | 49.2 Ų | 49.2 | 29% | 0.285 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.1 | -39 | 176.6 | 176.5 | -95.3 | 0 | 0 | 0 | 112.2 | P90 R370 I371 S372 N378 | P90-F374 HydrophobicContact CG-CE2 4.24Å; R370-F374 WeakPolarHBondContact O-CB 3.15Å; R370-F374 PolarHBondContact O-N 2.91Å; I371-F374 WeakPolarHBondContact O-CB 3.5Å; I371-F374 PolarHBondContact O-N 3.39Å; S372-F374 VanDerWaalsContact C-N 3.31Å; S372-F374 PolarHBondContact O-N 3.33Å; F374-N378 VanDerWaalsContact CE1-ND2 3.35Å; F374-N378 WeakPolarHBondContact CE1-ND2 3.16Å; F374-N378 WeakPolarHBondContact CE2-ND2 3.31Å; F374-N378 WeakPolarHBondContact CZ-ND2 3.12Å; F374-N378 PolarHBondContact O-N 3.2Å; F374-N378 PolarHBondContact O-ND2 2.95Å |
| 375 | L | 82.3 | Confident | 76.9 | Confident | 18 Ų | 18 | 51.3 Ų | 51.3 | 9% | 0.094 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -69.3 | -45.1 | 177.5 | -68.3 | 171.1 | 0 | 0 | 0 | 111.8 | I371 S372 T373 M377 N378 G379 V464 W468 | I371-L375 HydrophobicContact CG2-CD1 4.1Å; I371-L375 HydrophobicContact CG2-CG 4.48Å; I371-L375 WeakPolarHBondContact O-CG 3.28Å; I371-L375 PolarHBondContact O-N 2.84Å; S372-L375 PolarHBondContact O-N 2.82Å; T373-L375 VanDerWaalsContact C-N 3.31Å; T373-L375 PolarHBondContact O-N 3.13Å; L375-M377 VanDerWaalsContact C-N 3.27Å; L375-M377 PolarHBondContact O-N 3.07Å; L375-N378 PolarHBondContact O-N 3.45Å; L375-G379 PolarHBondContact O-N 3.18Å; L375-G379 VanDerWaalsContact O-N 3.07Å; L375-V464 HydrophobicContact CD1-CG1 3.72Å; L375-W468 HydrophobicContact CB-CD2 3.66Å; L375-W468 HydrophobicContact CB-CE3 3.59Å; L375-W468 HydrophobicContact CB-CG 4.37Å; L375-W468 HydrophobicContact CB-CH2 3.86Å; L375-W468 HydrophobicContact CB-CZ2 3.9Å; L375-W468 HydrophobicContact CB-CZ3 3.68Å; L375-W468 HydrophobicContact CD1-CB 3.86Å; L375-W468 HydrophobicContact CD1-CD2 3.88Å; L375-W468 HydrophobicContact CD1-CE3 4.02Å; L375-W468 HydrophobicContact CD1-CG 3.8Å; L375-W468 HydrophobicContact CD2-CD2 4.48Å; L375-W468 HydrophobicContact CD2-CG 4.41Å; L375-W468 HydrophobicContact CG-CD2 4.22Å; L375-W468 HydrophobicContact CG-CE3 4.41Å; L375-W468 HydrophobicContact CG-CG 4.43Å; L375-W468 WeakPolarHBondContact O-CH2 3.45Å; L375-W468 WeakPolarHBondContact O-CZ2 3.21Å |
| 376 | H | 76.8 | Confident | 75 | Confident | 75 Ų | 75 | 60.2 Ų | 60.2 | 35% | 0.347 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -61 | -31.8 | 175 | -82.3 | -66.3 | 0 | 0 | 0 | 113.5 | S372 T373 N378 W468 D473 D475 | S372-H376 PolarHBondContact O-CD2 2.78Å; S372-H376 PolarHBondContact O-N 2.83Å; T373-H376 PolarHBondContact O-N 2.63Å; H376-N378 VanDerWaalsContact C-N 3.29Å; H376-N378 PolarHBondContact O-N 3.49Å; H376-W468 HydrophobicContact CB-CH2 4.4Å; H376-W468 AromaticContact CD2-CZ3 3.9Å; H376-W468 AromaticContact CE1-CZ3 3.77Å; H376-W468 AromaticContact CG-CH2 3.95Å; H376-W468 AromaticContact CG-CZ3 3.79Å; H376-W468 AromaticContact ND1-CH2 3.73Å; H376-W468 AromaticContact ND1-CZ3 3.71Å; H376-W468 AromaticContact NE2-CZ3 3.88Å; H376-D473 IonicContact CE1-OD1 3.74Å; H376-D473 IonicContact NE2-OD1 3.95Å; H376-D473 PolarHBondContact NE2-OD1 2.69Å; H376-D475 IonicContact CD2-OD2 3.67Å; H376-D475 IonicContact NE2-OD2 2.63Å |
| 377 | M | 74.2 | Confident | 73.2 | Confident | 141 Ų | 141 | 66.3 Ų | 66.3 | 70% | 0.695 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -70.8 | -23.2 | 172.9 | -74.3 | -178.1 | 175.3 | 0 | 0 | 113.4 | T373 L375 | T373-M377 HydrophobicContact CG2-CE 3.81Å; T373-M377 HydrophobicContact CG2-SD 4.34Å; T373-M377 VanDerWaalsContact O-CG 3.32Å; T373-M377 WeakPolarHBondContact O-CG 3.2Å; T373-M377 PolarHBondContact O-N 3.42Å; L375-M377 VanDerWaalsContact C-N 3.27Å; L375-M377 PolarHBondContact O-N 3.07Å |
| 378 | N | 77.4 | Confident | 71.4 | Confident | 90 Ų | 90 | 67.4 Ų | 67.4 | 48% | 0.481 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -106.1 | -6 | -173.4 | -71 | -51.7 | 0 | 0 | 0 | 114.1 | F374 L375 H376 | F374-N378 VanDerWaalsContact CE1-ND2 3.35Å; F374-N378 WeakPolarHBondContact CE1-ND2 3.16Å; F374-N378 WeakPolarHBondContact CE2-ND2 3.31Å; F374-N378 WeakPolarHBondContact CZ-ND2 3.12Å; F374-N378 PolarHBondContact O-N 3.2Å; F374-N378 PolarHBondContact O-ND2 2.95Å; L375-N378 PolarHBondContact O-N 3.45Å; H376-N378 VanDerWaalsContact C-N 3.29Å; H376-N378 PolarHBondContact O-N 3.49Å |
| 379 | G | 77 | Confident | 69.6 | Low | 26 Ų | 26 | 71.2 Ų | 71.2 | 27% | 0.268 | 38% | 0.382 | S | S | . | . | trans | 168.4 | -174.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L375 W468 | L375-G379 PolarHBondContact O-N 3.18Å; L375-G379 VanDerWaalsContact O-N 3.07Å; G379-W468 WeakPolarHBondContact O-CH2 3.48Å; G379-W468 VanDerWaalsContact O-CZ2 3.24Å; G379-W468 WeakPolarHBondContact O-CZ2 3.27Å | ||
| 380 | M | 76 | Confident | 68.2 | Low | 125 Ų | 125 | 79.3 Ų | 79.3 | 62% | 0.616 | 41% | 0.406 | S | S | * | . | trans | -95.3 | 152.6 | 171.7 | -56.3 | -170.5 | -179.7 | 0 | 0 | 111.4 | G382 E383 W468 | M380-G382 PolarHBondContact O-N 3.08Å; M380-E383 HydrophobicContact CB-CB 4.16Å; M380-E383 VanDerWaalsContact CB-OE2 3.29Å; M380-E383 WeakPolarHBondContact CB-OE2 3.41Å; M380-E383 VanDerWaalsContact CG-OE2 3.3Å; M380-E383 WeakPolarHBondContact CG-OE2 3.27Å; M380-E383 WeakPolarHBondContact O-CB 3.48Å; M380-E383 PolarHBondContact O-N 3.46Å; M380-E383 VanDerWaalsContact O-N 3.09Å; M380-W468 WeakPolarHBondContact O-CZ2 3.43Å | ||
| 381 | P | 75.9 | Confident | 66.9 | Low | 40 Ų | 40 | 87.6 Ų | 87.6 | 26% | 0.26 | 44% | 0.438 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.2 | 130.3 | 173.2 | -24.4 | 31.6 | 0 | 0 | 0 | 111.3 | E383 W468 | P381-E383 VanDerWaalsContact C-N 3.27Å; P381-E383 PolarHBondContact O-N 3.06Å; P381-W468 HydrophobicContact CB-CD2 4.48Å; P381-W468 HydrophobicContact CB-CE3 4.28Å; P381-W468 HydrophobicContact CB-CZ3 4.31Å; P381-W468 VanDerWaalsContact CD-CH2 3.5Å; P381-W468 HydrophobicContact CG-CE3 4Å; P381-W468 HydrophobicContact CG-CH2 3.82Å; P381-W468 HydrophobicContact CG-CZ2 4.46Å; P381-W468 HydrophobicContact CG-CZ3 3.59Å |
| 382 | G | 72.5 | Confident | 65.9 | Low | 28 Ų | 28 | 91.2 Ų | 91.2 | 29% | 0.289 | 46% | 0.462 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 79.5 | -14.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | M380 N384 W468 | M380-G382 PolarHBondContact O-N 3.08Å; G382-N384 VanDerWaalsContact C-N 3.34Å; G382-N384 PolarHBondContact O-N 2.74Å; G382-W468 PolarHBondContact N-O 3.35Å |
| 383 | E | 64.8 | Low | 65.2 | Low | 128 Ų | 128 | 92.3 Ų | 92.3 | 60% | 0.598 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.7 | -8.4 | -168.1 | -153.4 | 174.1 | -175.8 | 0 | 0 | 114.9 | M380 P381 | M380-E383 HydrophobicContact CB-CB 4.16Å; M380-E383 VanDerWaalsContact CB-OE2 3.29Å; M380-E383 WeakPolarHBondContact CB-OE2 3.41Å; M380-E383 VanDerWaalsContact CG-OE2 3.3Å; M380-E383 WeakPolarHBondContact CG-OE2 3.27Å; M380-E383 WeakPolarHBondContact O-CB 3.48Å; M380-E383 PolarHBondContact O-N 3.46Å; M380-E383 VanDerWaalsContact O-N 3.09Å; P381-E383 VanDerWaalsContact C-N 3.27Å; P381-E383 PolarHBondContact O-N 3.06Å |
| 384 | N | 53.1 | Low | 65 | Low | 94 Ų | 94 | 92 Ų | 92 | 50% | 0.503 | 47% | 0.47 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -135.3 | 46.2 | 176.9 | -75.5 | -43.3 | 0 | 0 | 0 | 112.6 | G382 E386 Q387 A388 | G382-N384 VanDerWaalsContact C-N 3.34Å; G382-N384 PolarHBondContact O-N 2.74Å; N384-E386 PolarHBondContact O-N 2.73Å; N384-Q387 PolarHBondContact O-N 3.46Å; N384-A388 PolarHBondContact O-N 2.99Å |
| 385 | S | 49.5 | Very low | 64.8 | Low | 45 Ų | 45 | 92.3 Ų | 92.3 | 32% | 0.315 | 48% | 0.478 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.8 | 1.1 | -176.1 | 62.2 | 0 | 0 | 0 | 0 | 115.8 | R390 | S385-R390 PolarHBondContact O-NE 3.49Å; S385-R390 PolarHBondContact O-NH2 3.06Å |
| 386 | E | 46.8 | Very low | 64.5 | Low | 193 Ų | 193 | 95.5 Ų | 95.5 | 90% | 0.902 | 50% | 0.501 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.2 | -20.7 | 169.4 | -66.3 | -163.9 | 142.2 | 0 | 0 | 114.1 | N384 | N384-E386 PolarHBondContact O-N 2.73Š|
| 387 | Q | 46.3 | Very low | 64.6 | Low | 175 Ų | 175 | 95 Ų | 95 | 82% | 0.818 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.8 | -16.1 | 177.6 | -69.1 | -175.6 | 8.2 | 0 | 0 | 114 | N384 P389 | N384-Q387 PolarHBondContact O-N 3.46Å; Q387-P389 WeakPolarHBondContact O-CD 3.39Å |
| 388 | A | 50.8 | Low | 64.8 | Low | 24 Ų | 24 | 88.4 Ų | 88.4 | 20% | 0.198 | 47% | 0.471 | C | S | . | . | S | Bend | trans | -63.1 | 123.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | N384 R390 | N384-A388 PolarHBondContact O-N 2.99Å; A388-R390 PolarHBondContact O-N 3.25Å |
| 389 | P | 51.1 | Low | 65 | Low | 81 Ų | 81 | 84.9 Ų | 84.9 | 53% | 0.526 | 45% | 0.451 | S | S | . | . | trans | -62.7 | 97.9 | -179.5 | 22.8 | -29.9 | 0 | 0 | 0 | 109.2 | Q387 R391 | Q387-P389 WeakPolarHBondContact O-CD 3.39Å; P389-R391 PolarHBondContact O-N 3.32Å | ||
| 390 | R | 50.6 | Low | 65.2 | Low | 213 Ų | 213 | 91.4 Ų | 91.4 | 80% | 0.804 | 47% | 0.472 | S | S | * | . | trans | -65.3 | -5.5 | 173.2 | -66.9 | -170.7 | -175.9 | -167.9 | 0.1 | 112.6 | S385 A388 | S385-R390 PolarHBondContact O-NE 3.49Å; S385-R390 PolarHBondContact O-NH2 3.06Å; A388-R390 PolarHBondContact O-N 3.25Å | ||
| 391 | R | 55.6 | Low | 65.4 | Low | 220 Ų | 220 | 87.1 Ų | 87.1 | 83% | 0.83 | 46% | 0.455 | S | S | * | . | S | Bend | trans | -99.6 | 135 | 179.2 | -124.7 | 172.7 | -167.2 | 157.7 | 4.2 | 108.5 | P389 | P389-R391 PolarHBondContact O-N 3.32Š|
| 392 | C | 63.5 | Low | 65.5 | Low | 76 Ų | 76 | 90 Ų | 90 | 51% | 0.514 | 47% | 0.473 | S | S | . | . | P | Polyproline II helix | trans | -47 | 120.1 | 169.6 | -58.9 | 0 | 0 | 0 | 0 | 108.5 | S394 W462 | C392-S394 PolarHBondContact O-N 3.34Å; C392-W462 PolarHBondContact SG-NE1 3.47Å |
| 393 | P | 68.5 | Low | 66 | Low | 22 Ų | 22 | 91.4 Ų | 91.4 | 14% | 0.143 | 47% | 0.474 | C | S | . | . | P | Polyproline II helix | trans | -56.4 | 140 | 175.1 | 23.5 | -29.8 | 0 | 0 | 0 | 107.1 | Y458 D461 W462 | P393-Y458 VanDerWaalsContact O-CE2 3.32Å; P393-Y458 WeakPolarHBondContact O-CE2 3.25Å; P393-Y458 PolarHBondContact O-OH 3.01Å; P393-D461 VanDerWaalsContact CG-OD2 3.24Å; P393-D461 WeakPolarHBondContact CG-OD2 3.07Å; P393-W462 HydrophobicContact CG-CB 4.35Å |
| 394 | S | 72.4 | Confident | 66.8 | Low | 54 Ų | 54 | 86.9 Ų | 86.9 | 38% | 0.378 | 46% | 0.455 | S | S | . | . | P | Polyproline II helix | trans | -64.1 | 146 | 171.3 | 67.2 | 0 | 0 | 0 | 0 | 108.5 | C392 C396 T397 T398 | C392-S394 PolarHBondContact O-N 3.34Å; S394-C396 PolarHBondContact O-N 3.35Å; S394-T397 PolarHBondContact N-OG1 2.9Å; S394-T397 PolarHBondContact O-N 3.25Å; S394-T397 PolarHBondContact O-OG1 3.49Å; S394-T397 WeakPolarHBondContact OG-CG2 3.16Å; S394-T397 PolarHBondContact OG-N 3.23Å; S394-T397 VanDerWaalsContact OG-N 3.09Å; S394-T397 PolarHBondContact OG-OG1 3.4Å; S394-T398 PolarHBondContact O-N 2.96Å; S394-T398 VanDerWaalsContact O-N 3.13Å; S394-T398 PolarHBondContact O-OG1 2.9Å |
| 395 | P | 76.6 | Confident | 68.4 | Low | 71 Ų | 71 | 82.9 Ų | 82.9 | 46% | 0.461 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -52.8 | -32 | 173.6 | -26.9 | 33.3 | 0 | 0 | 0 | 112.2 | T397 T398 F399 Y458 | P395-T397 PolarHBondContact O-N 3.05Å; P395-T398 PolarHBondContact O-N 3.37Å; P395-F399 WeakPolarHBondContact O-CD2 3.37Å; P395-F399 PolarHBondContact O-N 2.93Å; P395-F399 VanDerWaalsContact O-N 3.15Å; P395-Y458 HydrophobicContact CB-CD2 4.19Å; P395-Y458 HydrophobicContact CB-CE2 4.24Å; P395-Y458 HydrophobicContact CG-CD2 4.06Å; P395-Y458 HydrophobicContact CG-CE2 3.68Å |
| 396 | C | 76.3 | Confident | 70.2 | Confident | 84 Ų | 84 | 80.9 Ų | 80.9 | 57% | 0.568 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -63.3 | -40 | 174.9 | -68.4 | 0 | 0 | 0 | 0 | 112.8 | S394 F400 | S394-C396 PolarHBondContact O-N 3.35Å; C396-F400 WeakPolarHBondContact O-CA 3.27Å; C396-F400 VanDerWaalsContact O-CB 3.26Å; C396-F400 WeakPolarHBondContact O-CB 3.49Å; C396-F400 PolarHBondContact O-N 2.85Å |
| 397 | T | 78 | Confident | 72.1 | Confident | 65 Ų | 65 | 75 Ų | 75 | 40% | 0.399 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -68.7 | -39.7 | 175.9 | 43.7 | 0 | 0 | 0 | 0 | 111.4 | S394 P395 F399 S401 S406 | S394-T397 PolarHBondContact N-OG1 2.9Å; S394-T397 PolarHBondContact O-N 3.25Å; S394-T397 PolarHBondContact O-OG1 3.49Å; S394-T397 WeakPolarHBondContact OG-CG2 3.16Å; S394-T397 PolarHBondContact OG-N 3.23Å; S394-T397 VanDerWaalsContact OG-N 3.09Å; S394-T397 PolarHBondContact OG-OG1 3.4Å; P395-T397 PolarHBondContact O-N 3.05Å; T397-F399 PolarHBondContact O-N 3.14Å; T397-S401 WeakPolarHBondContact O-CB 3.47Å; T397-S401 PolarHBondContact O-N 3.45Å; T397-S406 PolarHBondContact O-OG 3.07Å; T397-S406 VanDerWaalsContact O-OG 3.06Å |
| 398 | T | 77.5 | Confident | 74.1 | Confident | 2 Ų | 2 | 66.6 Ų | 66.6 | 1% | 0.012 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -65.2 | -35.4 | -179.7 | -53.9 | 0 | 0 | 0 | 0 | 113.3 | S394 P395 S406 D461 | S394-T398 PolarHBondContact O-N 2.96Å; S394-T398 VanDerWaalsContact O-N 3.13Å; S394-T398 PolarHBondContact O-OG1 2.9Å; P395-T398 PolarHBondContact O-N 3.37Å; T398-S406 VanDerWaalsContact O-CA 3.32Å; T398-S406 WeakPolarHBondContact O-CA 3.48Å; T398-S406 WeakPolarHBondContact O-CB 3.29Å; T398-S406 PolarHBondContact O-OG 3.28Å; T398-S406 VanDerWaalsContact O-OG 3.05Å; T398-D461 WeakPolarHBondContact CB-OD2 3.28Å; T398-D461 HydrophobicContact CG2-CB 3.48Å; T398-D461 VanDerWaalsContact CG2-CB 3.48Å; T398-D461 WeakPolarHBondContact CG2-OD2 2.8Å; T398-D461 PolarHBondContact OG1-OD2 2.96Å |
| 399 | F | 81.7 | Confident | 76 | Confident | 16 Ų | 16 | 65.5 Ų | 65.5 | 7% | 0.07 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -103.5 | -28.3 | -176.5 | -70 | -76 | 0 | 0 | 0 | 114.2 | P395 T397 A409 R410 L454 L457 | P395-F399 WeakPolarHBondContact O-CD2 3.37Å; P395-F399 PolarHBondContact O-N 2.93Å; P395-F399 VanDerWaalsContact O-N 3.15Å; T397-F399 PolarHBondContact O-N 3.14Å; F399-A409 HydrophobicContact CD1-CB 4.18Å; F399-A409 HydrophobicContact CE1-CB 4.14Å; F399-R410 WeakPolarHBondContact O-CD 3.41Å; F399-R410 WeakPolarHBondContact O-CG 3.25Å; F399-R410 PolarHBondContact O-NH1 2.87Å; F399-L454 HydrophobicContact CD2-CD1 4.26Å; F399-L454 HydrophobicContact CE1-CD1 4.21Å; F399-L454 HydrophobicContact CE2-CD1 3.62Å; F399-L454 HydrophobicContact CZ-CD1 3.6Å; F399-L454 HydrophobicContact CZ-CG 4.48Å; F399-L457 HydrophobicContact CE1-CB 4.01Å; F399-L457 HydrophobicContact CE1-CD1 3.99Å; F399-L457 HydrophobicContact CZ-CB 3.78Å; F399-L457 HydrophobicContact CZ-CD1 4.47Å |
| 400 | F | 81.6 | Confident | 78 | Confident | 163 Ų | 163 | 65.1 Ų | 65.1 | 72% | 0.715 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -113.7 | 2.2 | -170.9 | -58.8 | -86.2 | 0 | 0 | 0 | 114.3 | C396 | C396-F400 WeakPolarHBondContact O-CA 3.27Å; C396-F400 VanDerWaalsContact O-CB 3.26Å; C396-F400 WeakPolarHBondContact O-CB 3.49Å; C396-F400 PolarHBondContact O-N 2.85Å |
| 401 | S | 80.7 | Confident | 79.9 | Confident | 35 Ų | 35 | 55.8 Ų | 55.8 | 25% | 0.245 | 30% | 0.296 | C | S | . | . | S | Bend | trans | -74.4 | 150.9 | 174.3 | 174.3 | 0 | 0 | 0 | 0 | 111.4 | T397 D403 S406 R410 | T397-S401 WeakPolarHBondContact O-CB 3.47Å; T397-S401 PolarHBondContact O-N 3.45Å; S401-D403 WeakPolarHBondContact CB-OD1 3.17Å; S401-D403 PolarHBondContact O-N 3.49Å; S401-D403 PolarHBondContact OG-OD1 2.6Å; S401-S406 WeakPolarHBondContact O-CB 3.21Å; S401-R410 PolarHBondContact O-NH1 2.89Å |
| 402 | P | 78.6 | Confident | 81.6 | Confident | 100 Ų | 100 | 45.3 Ų | 45.3 | 65% | 0.649 | 26% | 0.256 | S | S | * | . | S | Bend | trans | -75.5 | -3.9 | -178.3 | 29.1 | -36.7 | 0 | 0 | 0 | 114.6 | R407 | P402-R407 PolarHBondContact O-NE 3.02Å; P402-R407 PolarHBondContact O-NH2 3.31Å |
| 403 | D | 83 | Confident | 83.1 | Confident | 58 Ų | 58 | 44.5 Ų | 44.5 | 31% | 0.31 | 24% | 0.244 | S | C | . | . | S | Bend | trans | -66.7 | 164.1 | -179 | 66.6 | -80.7 | 0 | 0 | 0 | 113.4 | S401 N405 S406 R407 | S401-D403 WeakPolarHBondContact CB-OD1 3.17Å; S401-D403 PolarHBondContact O-N 3.49Å; S401-D403 PolarHBondContact OG-OD1 2.6Å; D403-N405 VanDerWaalsContact C-N 3.33Å; D403-N405 PolarHBondContact O-N 3.04Å; D403-N405 WeakPolarHBondContact OD2-CA 3.41Å; D403-N405 WeakPolarHBondContact OD2-CB 3.47Å; D403-N405 PolarHBondContact OD2-N 3.4Å; D403-N405 VanDerWaalsContact OD2-N 3.08Å; D403-S406 VanDerWaalsContact CG-OG 3.26Å; D403-S406 VanDerWaalsContact OD1-CB 3.28Å; D403-S406 WeakPolarHBondContact OD1-CB 3.12Å; D403-S406 PolarHBondContact OD1-OG 3Å; D403-S406 PolarHBondContact OD2-N 3.39Å; D403-S406 PolarHBondContact OD2-OG 3.36Å; D403-R407 VanDerWaalsContact O-CG 3.29Å; D403-R407 WeakPolarHBondContact O-CG 3.49Å; D403-R407 PolarHBondContact O-N 2.74Å |
| 404 | V | 81.8 | Confident | 84.3 | Confident | 33 Ų | 33 | 49.4 Ų | 49.4 | 20% | 0.2 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -65.8 | -35.8 | -175.6 | 179.8 | 0 | 0 | 0 | 0 | 111.7 | R407 S408 | V404-R407 WeakPolarHBondContact O-CB 3.21Å; V404-R407 PolarHBondContact O-N 2.87Å; V404-S408 WeakPolarHBondContact O-CB 3.34Å; V404-S408 PolarHBondContact O-N 2.94Å |
| 405 | N | 85.1 | Confident | 85.3 | Confident | 10 Ų | 10 | 47.8 Ų | 47.8 | 5% | 0.053 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -70.8 | -41.8 | -178.7 | -64.8 | -28 | 0 | 0 | 0 | 111.2 | Q367 I371 D403 S408 A409 | Q367-N405 PolarHBondContact NE2-O 3.03Å; I371-N405 HydrophobicContact CG1-CB 4.11Å; D403-N405 VanDerWaalsContact C-N 3.33Å; D403-N405 PolarHBondContact O-N 3.04Å; D403-N405 WeakPolarHBondContact OD2-CA 3.41Å; D403-N405 WeakPolarHBondContact OD2-CB 3.47Å; D403-N405 PolarHBondContact OD2-N 3.4Å; D403-N405 VanDerWaalsContact OD2-N 3.08Å; N405-S408 VanDerWaalsContact O-CB 3.32Å; N405-S408 WeakPolarHBondContact O-CB 3.19Å; N405-S408 PolarHBondContact O-N 3.41Å; N405-A409 PolarHBondContact O-N 2.97Å |
| 406 | S | 88 | Confident | 86.2 | Confident | 4 Ų | 4 | 44.4 Ų | 44.4 | 3% | 0.028 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -65.5 | -38 | 173.1 | -63.1 | 0 | 0 | 0 | 0 | 112.2 | T397 T398 S401 D403 A409 R410 | T397-S406 PolarHBondContact O-OG 3.07Å; T397-S406 VanDerWaalsContact O-OG 3.06Å; T398-S406 VanDerWaalsContact O-CA 3.32Å; T398-S406 WeakPolarHBondContact O-CA 3.48Å; T398-S406 WeakPolarHBondContact O-CB 3.29Å; T398-S406 PolarHBondContact O-OG 3.28Å; T398-S406 VanDerWaalsContact O-OG 3.05Å; S401-S406 WeakPolarHBondContact O-CB 3.21Å; D403-S406 VanDerWaalsContact CG-OG 3.26Å; D403-S406 VanDerWaalsContact OD1-CB 3.28Å; D403-S406 WeakPolarHBondContact OD1-CB 3.12Å; D403-S406 PolarHBondContact OD1-OG 3Å; D403-S406 PolarHBondContact OD2-N 3.39Å; D403-S406 PolarHBondContact OD2-OG 3.36Å; S406-A409 PolarHBondContact O-N 2.91Å; S406-R410 WeakPolarHBondContact O-CG 3.31Å; S406-R410 PolarHBondContact O-N 3.42Å; S406-R410 PolarHBondContact O-NH1 3.42Å |
| 407 | R | 87.4 | Confident | 87.2 | Confident | 68 Ų | 68 | 43.1 Ų | 43.1 | 26% | 0.257 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -60.5 | -45.7 | 171.4 | -74 | 169.7 | -167.1 | -149 | -3.3 | 111.3 | P402 D403 V404 R410 V411 | P402-R407 PolarHBondContact O-NE 3.02Å; P402-R407 PolarHBondContact O-NH2 3.31Å; D403-R407 VanDerWaalsContact O-CG 3.29Å; D403-R407 WeakPolarHBondContact O-CG 3.49Å; D403-R407 PolarHBondContact O-N 2.74Å; V404-R407 WeakPolarHBondContact O-CB 3.21Å; V404-R407 PolarHBondContact O-N 2.87Å; R407-R410 PolarHBondContact O-N 3.34Å; R407-V411 WeakPolarHBondContact O-CG2 3.26Å; R407-V411 PolarHBondContact O-N 3.36Å |
| 408 | S | 86.6 | Confident | 88.1 | Confident | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -58.7 | -50.5 | 176.5 | -171.2 | 0 | 0 | 0 | 0 | 111.3 | Q367 R370 V404 N405 R410 V411 L412 | Q367-S408 PolarHBondContact OE1-OG 3.32Å; R370-S408 WeakPolarHBondContact CD-OG 3.09Å; R370-S408 PolarHBondContact NH1-OG 3.48Å; V404-S408 WeakPolarHBondContact O-CB 3.34Å; V404-S408 PolarHBondContact O-N 2.94Å; N405-S408 VanDerWaalsContact O-CB 3.32Å; N405-S408 WeakPolarHBondContact O-CB 3.19Å; N405-S408 PolarHBondContact O-N 3.41Å; S408-R410 VanDerWaalsContact C-N 3.31Å; S408-R410 PolarHBondContact O-N 3.38Å; S408-V411 PolarHBondContact O-N 2.85Å; S408-V411 VanDerWaalsContact O-N 3.1Å; S408-L412 WeakPolarHBondContact O-CG 3.19Å; S408-L412 PolarHBondContact O-N 2.76Å |
| 409 | A | 91.3 | Very high | 88.9 | Confident | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -57.2 | -42.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112 | F399 N405 S406 L412 F413 L457 | F399-A409 HydrophobicContact CD1-CB 4.18Å; F399-A409 HydrophobicContact CE1-CB 4.14Å; N405-A409 PolarHBondContact O-N 2.97Å; S406-A409 PolarHBondContact O-N 2.91Å; A409-L412 PolarHBondContact O-N 3.41Å; A409-F413 VanDerWaalsContact O-CB 3.26Å; A409-F413 WeakPolarHBondContact O-CB 3.19Å; A409-F413 PolarHBondContact O-N 2.95Å; A409-L457 WeakPolarHBondContact O-CD1 3.38Å |
| 410 | R | 93.3 | Very high | 89.6 | Confident | 73 Ų | 73 | 42.5 Ų | 42.5 | 28% | 0.275 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -62.5 | -44.1 | 175.3 | -72.4 | -170.3 | -62 | -88.7 | 8 | 112.8 | F399 S401 S406 R407 S408 F413 L414 | F399-R410 WeakPolarHBondContact O-CD 3.41Å; F399-R410 WeakPolarHBondContact O-CG 3.25Å; F399-R410 PolarHBondContact O-NH1 2.87Å; S401-R410 PolarHBondContact O-NH1 2.89Å; S406-R410 WeakPolarHBondContact O-CG 3.31Å; S406-R410 PolarHBondContact O-N 3.42Å; S406-R410 PolarHBondContact O-NH1 3.42Å; R407-R410 PolarHBondContact O-N 3.34Å; S408-R410 VanDerWaalsContact C-N 3.31Å; S408-R410 PolarHBondContact O-N 3.38Å; R410-F413 PolarHBondContact O-N 3.36Å; R410-L414 WeakPolarHBondContact O-CB 3.42Å; R410-L414 VanDerWaalsContact O-CG 3.25Å; R410-L414 WeakPolarHBondContact O-CG 3.45Å; R410-L414 PolarHBondContact O-N 2.78Å |
| 411 | V | 90.8 | Very high | 90.3 | Very high | 17 Ų | 17 | 38.6 Ų | 38.6 | 10% | 0.103 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -63.2 | -46.2 | 179.2 | 171 | 0 | 0 | 0 | 0 | 110.5 | I98 R407 S408 L414 L415 | I98-V411 HydrophobicContact CB-CG1 4.49Å; I98-V411 HydrophobicContact CG2-CB 4.34Å; I98-V411 HydrophobicContact CG2-CG1 4.08Å; R407-V411 WeakPolarHBondContact O-CG2 3.26Å; R407-V411 PolarHBondContact O-N 3.36Å; S408-V411 PolarHBondContact O-N 2.85Å; S408-V411 VanDerWaalsContact O-N 3.1Å; V411-L414 PolarHBondContact O-N 3.23Å; V411-L415 PolarHBondContact O-N 3.29Å; V411-L415 VanDerWaalsContact O-N 3.1Å |
| 412 | L | 91.8 | Very high | 91 | Very high | 1 Ų | 1 | 39.8 Ų | 39.8 | 1% | 0.005 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63.4 | -42.4 | 178.1 | -64.8 | 173.6 | 0 | 0 | 0 | 111.7 | V102 L363 V366 Q367 S408 A409 L415 L457 | V102-L412 HydrophobicContact CG1-CD2 3.76Å; V102-L412 HydrophobicContact CG2-CD2 4.41Å; L363-L412 HydrophobicContact CD2-CB 4.18Å; L363-L412 HydrophobicContact CD2-CD2 3.68Å; L363-L412 HydrophobicContact CD2-CG 4.48Å; V366-L412 HydrophobicContact CG1-CD1 4.47Å; V366-L412 HydrophobicContact CG1-CD2 4.26Å; Q367-L412 HydrophobicContact CB-CD1 3.68Å; Q367-L412 HydrophobicContact CG-CD1 4.39Å; S408-L412 WeakPolarHBondContact O-CG 3.19Å; S408-L412 PolarHBondContact O-N 2.76Å; A409-L412 PolarHBondContact O-N 3.41Å; L412-L415 WeakPolarHBondContact O-CB 3.42Å; L412-L415 PolarHBondContact O-N 3.4Å; L412-L457 HydrophobicContact CB-CD1 4.42Å; L412-L457 HydrophobicContact CB-CD2 4.47Å; L412-L457 HydrophobicContact CD1-CD2 4.18Å |
| 413 | F | 94.5 | Very high | 91.8 | Very high | 58 Ų | 58 | 35 Ų | 35 | 25% | 0.254 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -64.1 | -41.3 | 176.2 | -175.5 | -103 | 0 | 0 | 0 | 112.5 | A409 R410 L415 V416 L450 V453 L454 L457 | A409-F413 VanDerWaalsContact O-CB 3.26Å; A409-F413 WeakPolarHBondContact O-CB 3.19Å; A409-F413 PolarHBondContact O-N 2.95Å; R410-F413 PolarHBondContact O-N 3.36Å; F413-L415 VanDerWaalsContact C-N 3.26Å; F413-L415 PolarHBondContact O-N 3.45Å; F413-V416 WeakPolarHBondContact O-CB 3.23Å; F413-V416 VanDerWaalsContact O-CG2 3.3Å; F413-V416 WeakPolarHBondContact O-CG2 3.46Å; F413-V416 PolarHBondContact O-N 2.92Å; F413-L450 HydrophobicContact CE1-CD2 4.26Å; F413-L450 HydrophobicContact CE2-CB 4.41Å; F413-L450 HydrophobicContact CE2-CD2 3.83Å; F413-L450 HydrophobicContact CZ-CB 4.46Å; F413-L450 HydrophobicContact CZ-CD2 3.69Å; F413-V453 HydrophobicContact CD2-CG1 4.36Å; F413-L454 HydrophobicContact CE2-CB 3.93Å; F413-L454 HydrophobicContact CE2-CD1 4.14Å; F413-L454 HydrophobicContact CZ-CD1 4.49Å; F413-L457 HydrophobicContact CB-CD1 3.98Å |
| 414 | L | 94 | Very high | 92.4 | Very high | 125 Ų | 125 | 32.4 Ų | 32.4 | 65% | 0.654 | 17% | 0.169 | S | C | * | . | H | α-helix | trans | -67 | -26.8 | 177.1 | -74.5 | 171.6 | 0 | 0 | 0 | 113 | R410 V411 V416 P418 | R410-L414 WeakPolarHBondContact O-CB 3.42Å; R410-L414 VanDerWaalsContact O-CG 3.25Å; R410-L414 WeakPolarHBondContact O-CG 3.45Å; R410-L414 PolarHBondContact O-N 2.78Å; V411-L414 PolarHBondContact O-N 3.23Å; L414-V416 VanDerWaalsContact C-N 3.28Å; L414-V416 PolarHBondContact O-N 3.21Å; L414-P418 WeakPolarHBondContact O-CD 3.33Å |
| 415 | L | 93.1 | Very high | 92.9 | Very high | 21 Ų | 21 | 38.6 Ų | 38.6 | 11% | 0.11 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -72.8 | -21.1 | 178.9 | -171.1 | 60.5 | 0 | 0 | 0 | 113 | V102 L103 F106 L363 V411 L412 F413 V417 P418 G419 | V102-L415 HydrophobicContact CG1-CD2 4.06Å; L103-L415 HydrophobicContact CD1-CD1 3.61Å; F106-L415 HydrophobicContact CB-CD2 3.71Å; F106-L415 HydrophobicContact CD1-CD1 4.05Å; F106-L415 HydrophobicContact CD1-CD2 3.58Å; F106-L415 HydrophobicContact CD1-CG 3.68Å; F106-L415 HydrophobicContact CD2-CD2 3.71Å; F106-L415 HydrophobicContact CD2-CG 4.21Å; F106-L415 HydrophobicContact CE1-CD1 4.13Å; F106-L415 HydrophobicContact CE1-CD2 4.07Å; F106-L415 HydrophobicContact CE1-CG 3.67Å; F106-L415 HydrophobicContact CE2-CD2 4.14Å; F106-L415 HydrophobicContact CE2-CG 4.16Å; F106-L415 HydrophobicContact CG-CD2 3.38Å; F106-L415 HydrophobicContact CG-CG 3.96Å; F106-L415 HydrophobicContact CZ-CD2 4.33Å; F106-L415 HydrophobicContact CZ-CG 3.92Å; L363-L415 HydrophobicContact CD2-CD2 4.42Å; V411-L415 PolarHBondContact O-N 3.29Å; V411-L415 VanDerWaalsContact O-N 3.1Å; L412-L415 WeakPolarHBondContact O-CB 3.42Å; L412-L415 PolarHBondContact O-N 3.4Å; F413-L415 VanDerWaalsContact C-N 3.26Å; F413-L415 PolarHBondContact O-N 3.45Å; L415-V417 PolarHBondContact O-N 3.07Å; L415-P418 WeakPolarHBondContact O-CD 3.26Å; L415-P418 WeakPolarHBondContact O-CG 3.4Å; L415-G419 PolarHBondContact O-N 3.4Å |
| 416 | V | 96 | Very high | 93.3 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -56.2 | -53.2 | -179.7 | 179.1 | 0 | 0 | 0 | 0 | 111 | L363 F413 L414 G419 H420 A449 L450 V453 | L363-V416 HydrophobicContact CD1-CG2 3.73Å; F413-V416 WeakPolarHBondContact O-CB 3.23Å; F413-V416 VanDerWaalsContact O-CG2 3.3Å; F413-V416 WeakPolarHBondContact O-CG2 3.46Å; F413-V416 PolarHBondContact O-N 2.92Å; L414-V416 VanDerWaalsContact C-N 3.28Å; L414-V416 PolarHBondContact O-N 3.21Å; V416-G419 PolarHBondContact O-N 3.05Å; V416-H420 VanDerWaalsContact CG1-CD2 3.5Å; V416-H420 WeakPolarHBondContact CG1-CD2 3.45Å; V416-H420 WeakPolarHBondContact O-CB 3.21Å; V416-H420 PolarHBondContact O-CD2 2.88Å; V416-H420 VanDerWaalsContact O-CD2 3.23Å; V416-H420 PolarHBondContact O-N 3.32Å; V416-A449 HydrophobicContact CG1-CB 4.2Å; V416-L450 HydrophobicContact CB-CD2 4.06Å; V416-L450 HydrophobicContact CG1-CD2 3.89Å; V416-L450 HydrophobicContact CG1-CG 4.31Å; V416-V453 HydrophobicContact CG1-CG2 4.49Å; V416-V453 HydrophobicContact CG2-CB 3.92Å; V416-V453 HydrophobicContact CG2-CG1 3.7Å; V416-V453 HydrophobicContact CG2-CG2 3.84Å |
| 417 | V | 96.4 | Very high | 93.5 | Very high | 56 Ų | 56 | 39.4 Ų | 39.4 | 34% | 0.339 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -60.2 | -59 | -175.5 | -178.3 | 0 | 0 | 0 | 0 | 113 | L415 G419 L421 M446 L450 | L415-V417 PolarHBondContact O-N 3.07Å; V417-G419 VanDerWaalsContact C-N 3.27Å; V417-G419 PolarHBondContact O-N 3.23Å; V417-L421 HydrophobicContact CG1-CD1 4.02Å; V417-L421 WeakPolarHBondContact O-CB 3.43Å; V417-L421 VanDerWaalsContact O-CG 3.27Å; V417-L421 WeakPolarHBondContact O-CG 3.18Å; V417-L421 PolarHBondContact O-N 2.89Å; V417-M446 HydrophobicContact CB-SD 4.24Å; V417-M446 HydrophobicContact CG1-CE 4.34Å; V417-M446 HydrophobicContact CG1-SD 4.25Å; V417-M446 HydrophobicContact CG2-SD 4.08Å; V417-L450 HydrophobicContact CG2-CD1 4.19Å; V417-L450 HydrophobicContact CG2-CD2 3.88Å; V417-L450 HydrophobicContact CG2-CG 4.4Å |
| 418 | P | 96 | Very high | 93.6 | Very high | 68 Ų | 68 | 39.1 Ų | 39.1 | 44% | 0.442 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -63.1 | -35.8 | 179.9 | 25.7 | -34.1 | 0 | 0 | 0 | 112 | L414 L415 V422 | L414-P418 WeakPolarHBondContact O-CD 3.33Å; L415-P418 WeakPolarHBondContact O-CD 3.26Å; L415-P418 WeakPolarHBondContact O-CG 3.4Å; P418-V422 WeakPolarHBondContact O-CG2 3.21Å; P418-V422 PolarHBondContact O-N 2.91Å; P418-V422 VanDerWaalsContact O-N 3.11Å |
| 419 | G | 95.6 | Very high | 93.8 | Very high | 2 Ų | 2 | 42.9 Ų | 42.9 | 2% | 0.021 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.9 | -58.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | F106 L415 V416 V417 L421 V422 F423 | F106-G419 VanDerWaalsContact CE1-CA 3.49Å; L415-G419 PolarHBondContact O-N 3.4Å; V416-G419 PolarHBondContact O-N 3.05Å; V417-G419 VanDerWaalsContact C-N 3.27Å; V417-G419 PolarHBondContact O-N 3.23Å; G419-L421 VanDerWaalsContact C-N 3.28Å; G419-L421 PolarHBondContact O-N 3.41Å; G419-V422 WeakPolarHBondContact O-CB 3.32Å; G419-V422 PolarHBondContact O-N 3.35Å; G419-V422 VanDerWaalsContact O-N 3.1Å; G419-F423 WeakPolarHBondContact O-CD2 3.4Å; G419-F423 WeakPolarHBondContact O-CE2 3.37Å; G419-F423 WeakPolarHBondContact O-CG 3.31Å; G419-F423 PolarHBondContact O-N 3.37Å |
| 420 | H | 96.3 | Very high | 93.7 | Very high | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -61.5 | -35.5 | 179.4 | -82.2 | -80.2 | 0 | 0 | 0 | 112.3 | V359 V416 V422 F423 L424 Y445 M446 | V359-H420 WeakPolarHBondContact CG1-NE2 3.49Å; V416-H420 VanDerWaalsContact CG1-CD2 3.5Å; V416-H420 WeakPolarHBondContact CG1-CD2 3.45Å; V416-H420 WeakPolarHBondContact O-CB 3.21Å; V416-H420 PolarHBondContact O-CD2 2.88Å; V416-H420 VanDerWaalsContact O-CD2 3.23Å; V416-H420 PolarHBondContact O-N 3.32Å; H420-V422 PolarHBondContact O-N 3.41Å; H420-F423 PolarHBondContact O-N 3.03Å; H420-L424 VanDerWaalsContact O-CB 3.32Å; H420-L424 WeakPolarHBondContact O-CB 3.35Å; H420-L424 WeakPolarHBondContact O-CG 3.09Å; H420-L424 PolarHBondContact O-N 3.48Å; H420-Y445 HydrophobicContact CB-CE1 4.04Å; H420-Y445 PolarHBondContact CE1-OH 3.5Å; H420-Y445 AromaticContact CG-CE1 3.96Å; H420-Y445 AromaticContact ND1-CE1 3.41Å; H420-Y445 WeakPolarHBondContact ND1-CE1 3.37Å; H420-Y445 AromaticContact ND1-CZ 3.56Å; H420-Y445 PolarHBondContact ND1-OH 2.99Å; H420-M446 HydrophobicContact CB-CE 3.84Å; H420-M446 HydrophobicContact CB-SD 4.18Å |
| 421 | L | 96.1 | Very high | 93.2 | Very high | 81 Ų | 81 | 53 Ų | 53 | 42% | 0.424 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.8 | -42.1 | 173.9 | -72.3 | 174.7 | 0 | 0 | 0 | 112.3 | V417 G419 Y425 I442 M446 | V417-L421 HydrophobicContact CG1-CD1 4.02Å; V417-L421 WeakPolarHBondContact O-CB 3.43Å; V417-L421 VanDerWaalsContact O-CG 3.27Å; V417-L421 WeakPolarHBondContact O-CG 3.18Å; V417-L421 PolarHBondContact O-N 2.89Å; G419-L421 VanDerWaalsContact C-N 3.28Å; G419-L421 PolarHBondContact O-N 3.41Å; L421-Y425 VanDerWaalsContact O-CB 3.26Å; L421-Y425 WeakPolarHBondContact O-CB 3.06Å; L421-Y425 PolarHBondContact O-N 2.81Å; L421-I442 HydrophobicContact CD2-CG2 4.12Å; L421-M446 HydrophobicContact CD2-CE 3.83Å; L421-M446 HydrophobicContact CG-CE 3.76Å |
| 422 | V | 95.8 | Very high | 92.5 | Very high | 60 Ų | 60 | 52.5 Ų | 52.5 | 36% | 0.364 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -64 | -43.2 | 174.9 | 170.8 | 0 | 0 | 0 | 0 | 110.9 | F111 P418 G419 H420 Y425 T426 | F111-V422 HydrophobicContact CE1-CG1 4.34Å; F111-V422 HydrophobicContact CZ-CG1 3.94Å; P418-V422 WeakPolarHBondContact O-CG2 3.21Å; P418-V422 PolarHBondContact O-N 2.91Å; P418-V422 VanDerWaalsContact O-N 3.11Å; G419-V422 WeakPolarHBondContact O-CB 3.32Å; G419-V422 PolarHBondContact O-N 3.35Å; G419-V422 VanDerWaalsContact O-N 3.1Å; H420-V422 PolarHBondContact O-N 3.41Å; V422-Y425 PolarHBondContact O-N 2.91Å; V422-T426 WeakPolarHBondContact O-CB 3.35Å; V422-T426 PolarHBondContact O-N 3.31Å; V422-T426 PolarHBondContact O-OG1 3.1Å |
| 423 | F | 95.3 | Very high | 91.4 | Very high | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -66.9 | -44.1 | 180 | -55.4 | -32.8 | 0 | 0 | 0 | 112.1 | F106 L107 G110 V114 V355 V359 G419 H420 T426 I427 | F106-F423 HydrophobicContact CD1-CZ 4.32Å; F106-F423 AromaticContact CE1-CE2 3.93Å; F106-F423 HydrophobicContact CE1-CE2 3.93Å; F106-F423 AromaticContact CE1-CZ 3.8Å; F106-F423 HydrophobicContact CE1-CZ 3.8Å; F106-F423 AromaticContact CZ-CE2 3.88Å; F106-F423 HydrophobicContact CZ-CE2 3.88Å; F106-F423 HydrophobicContact CZ-CZ 4.2Å; L107-F423 HydrophobicContact CD2-CE1 4.1Å; L107-F423 HydrophobicContact CD2-CZ 4.21Å; G110-F423 VanDerWaalsContact CA-CZ 3.47Å; V114-F423 HydrophobicContact CG2-CB 3.64Å; V114-F423 HydrophobicContact CG2-CD1 4.15Å; V114-F423 HydrophobicContact CG2-CG 4.06Å; V355-F423 HydrophobicContact CG1-CB 3.97Å; V355-F423 HydrophobicContact CG1-CD2 4.11Å; V355-F423 HydrophobicContact CG1-CG 4.36Å; V359-F423 HydrophobicContact CG2-CD2 3.86Å; V359-F423 HydrophobicContact CG2-CE2 3.59Å; G419-F423 WeakPolarHBondContact O-CD2 3.4Å; G419-F423 WeakPolarHBondContact O-CE2 3.37Å; G419-F423 WeakPolarHBondContact O-CG 3.31Å; G419-F423 PolarHBondContact O-N 3.37Å; H420-F423 PolarHBondContact O-N 3.03Å; F423-T426 WeakPolarHBondContact O-CB 3.42Å; F423-T426 PolarHBondContact O-N 3.31Å; F423-I427 WeakPolarHBondContact O-CG1 3.5Å; F423-I427 PolarHBondContact O-N 2.93Å |
| 424 | L | 94.2 | Very high | 90.1 | Very high | 3 Ų | 3 | 54.1 Ų | 54.1 | 2% | 0.016 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -61 | -47.1 | 174 | -72.5 | 178.6 | 0 | 0 | 0 | 111.4 | F352 H420 T426 I427 S428 L437 F441 I442 Y445 | F352-L424 HydrophobicContact CD1-CD2 3.76Å; F352-L424 HydrophobicContact CE1-CD2 3.47Å; F352-L424 VanDerWaalsContact CE1-CD2 3.47Å; H420-L424 VanDerWaalsContact O-CB 3.32Å; H420-L424 WeakPolarHBondContact O-CB 3.35Å; H420-L424 WeakPolarHBondContact O-CG 3.09Å; H420-L424 PolarHBondContact O-N 3.48Å; L424-T426 PolarHBondContact O-N 3.43Å; L424-I427 PolarHBondContact O-N 3.37Å; L424-I427 VanDerWaalsContact O-N 3.17Å; L424-S428 PolarHBondContact O-N 3.3Å; L424-L437 HydrophobicContact CB-CD1 4.17Å; L424-L437 HydrophobicContact CD2-CD2 4.36Å; L424-L437 WeakPolarHBondContact O-CD1 3.29Å; L424-F441 HydrophobicContact CD2-CE1 4.31Å; L424-I442 HydrophobicContact CD1-CG1 4.37Å; L424-I442 HydrophobicContact CD1-CG2 4.46Å; L424-Y445 HydrophobicContact CD1-CD1 3.62Å; L424-Y445 HydrophobicContact CD1-CE1 3.83Å; L424-Y445 HydrophobicContact CD1-CG 4.4Å; L424-Y445 HydrophobicContact CD2-CD1 4Å; L424-Y445 HydrophobicContact CD2-CD2 4.5Å; L424-Y445 HydrophobicContact CD2-CE1 3.78Å; L424-Y445 HydrophobicContact CD2-CE2 4.34Å; L424-Y445 HydrophobicContact CD2-CG 4.34Å; L424-Y445 HydrophobicContact CG-CD1 4.12Å; L424-Y445 HydrophobicContact CG-CE1 3.86Å |
| 425 | Y | 93 | Very high | 88.8 | Confident | 163 Ų | 163 | 49.7 Ų | 49.7 | 64% | 0.639 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -58 | -40.9 | 176 | -180 | -98.7 | 0 | 0 | 0 | 111.6 | L421 V422 S428 C429 | L421-Y425 VanDerWaalsContact O-CB 3.26Å; L421-Y425 WeakPolarHBondContact O-CB 3.06Å; L421-Y425 PolarHBondContact O-N 2.81Å; V422-Y425 PolarHBondContact O-N 2.91Å; Y425-S428 WeakPolarHBondContact O-CB 3.24Å; Y425-S428 PolarHBondContact O-N 2.89Å; Y425-C429 WeakPolarHBondContact CE1-SG 3.28Å; Y425-C429 VanDerWaalsContact CZ-SG 3.52Å; Y425-C429 PolarHBondContact O-N 3.35Å; Y425-C429 PolarHBondContact O-SG 3.15Å; Y425-C429 VanDerWaalsContact O-SG 3.36Å |
| 426 | T | 93.2 | Very high | 87.9 | Confident | 29 Ų | 29 | 52 Ų | 52 | 18% | 0.178 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -62.5 | -45.3 | 176.4 | -54.8 | 0 | 0 | 0 | 0 | 111.6 | F111 V114 V422 F423 L424 S428 C429 M430 | F111-T426 HydrophobicContact CD1-CG2 4.38Å; F111-T426 HydrophobicContact CE1-CG2 4.18Å; V114-T426 HydrophobicContact CG1-CG2 4.1Å; V422-T426 WeakPolarHBondContact O-CB 3.35Å; V422-T426 PolarHBondContact O-N 3.31Å; V422-T426 PolarHBondContact O-OG1 3.1Å; F423-T426 WeakPolarHBondContact O-CB 3.42Å; F423-T426 PolarHBondContact O-N 3.31Å; L424-T426 PolarHBondContact O-N 3.43Å; T426-S428 VanDerWaalsContact C-N 3.3Å; T426-S428 PolarHBondContact O-N 3.23Å; T426-C429 PolarHBondContact O-N 3.28Å; T426-M430 HydrophobicContact CG2-SD 4.08Å; T426-M430 WeakPolarHBondContact O-CG 3.23Å; T426-M430 PolarHBondContact O-N 2.91Å |
| 427 | I | 92.3 | Very high | 87.2 | Confident | 2 Ų | 2 | 54.1 Ų | 54.1 | 1% | 0.01 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -58.4 | -44 | 174.8 | -67.7 | 166.8 | 0 | 0 | 0 | 110.6 | V114 V351 F352 V355 F423 L424 C429 M430 Q431 G432 | V114-I427 HydrophobicContact CG1-CG1 3.82Å; V351-I427 HydrophobicContact CG1-CG2 4.01Å; V351-I427 HydrophobicContact CG2-CD1 4.23Å; V351-I427 HydrophobicContact CG2-CG1 4.21Å; V351-I427 HydrophobicContact CG2-CG2 3.89Å; F352-I427 HydrophobicContact CD1-CD1 3.8Å; F352-I427 HydrophobicContact CE1-CD1 3.79Å; F352-I427 HydrophobicContact CE1-CG2 4.13Å; F352-I427 HydrophobicContact CZ-CG2 4.36Å; V355-I427 HydrophobicContact CG2-CD1 4.18Å; F423-I427 WeakPolarHBondContact O-CG1 3.5Å; F423-I427 PolarHBondContact O-N 2.93Å; L424-I427 PolarHBondContact O-N 3.37Å; L424-I427 VanDerWaalsContact O-N 3.17Å; I427-C429 PolarHBondContact O-N 3.04Å; I427-M430 CarbonylContact O-C 3.43Å; I427-M430 PolarHBondContact O-N 3.31Å; I427-Q431 PolarHBondContact O-N 2.69Å; I427-Q431 VanDerWaalsContact O-N 3.11Å; I427-G432 PolarHBondContact O-N 3.47Å; I427-G432 VanDerWaalsContact O-N 3.1Å |
| 428 | S | 89.8 | Confident | 86.7 | Confident | 62 Ų | 62 | 52.8 Ų | 52.8 | 43% | 0.434 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -60.4 | -45 | 177 | -163.2 | 0 | 0 | 0 | 0 | 112.6 | L424 Y425 T426 M430 Q431 | L424-S428 PolarHBondContact O-N 3.3Å; Y425-S428 WeakPolarHBondContact O-CB 3.24Å; Y425-S428 PolarHBondContact O-N 2.89Å; T426-S428 VanDerWaalsContact C-N 3.3Å; T426-S428 PolarHBondContact O-N 3.23Å; S428-M430 PolarHBondContact O-N 3.34Å; S428-Q431 PolarHBondContact O-N 2.97Å |
| 429 | C | 90.6 | Very high | 86.4 | Confident | 80 Ų | 80 | 55.7 Ų | 55.7 | 54% | 0.541 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -65.1 | -31.4 | 177.8 | -70.6 | 0 | 0 | 0 | 0 | 112.3 | Y425 T426 I427 Q431 | Y425-C429 WeakPolarHBondContact CE1-SG 3.28Å; Y425-C429 VanDerWaalsContact CZ-SG 3.52Å; Y425-C429 PolarHBondContact O-N 3.35Å; Y425-C429 PolarHBondContact O-SG 3.15Å; Y425-C429 VanDerWaalsContact O-SG 3.36Å; T426-C429 PolarHBondContact O-N 3.28Å; I427-C429 PolarHBondContact O-N 3.04Å; C429-Q431 VanDerWaalsContact C-N 3.29Å |
| 430 | M | 89.2 | Confident | 86.1 | Confident | 104 Ų | 104 | 59 Ų | 59 | 51% | 0.512 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.2 | 1.5 | 177.2 | -65.9 | -177.9 | 69.5 | 0 | 0 | 113.5 | M118 T426 I427 S428 G432 | M118-M430 HydrophobicContact CE-CB 3.89Å; M118-M430 HydrophobicContact CE-CE 4.36Å; M118-M430 HydrophobicContact CG-CE 3.87Å; M118-M430 HydrophobicContact CG-SD 4.25Å; M118-M430 HydrophobicContact SD-CB 4.11Å; T426-M430 HydrophobicContact CG2-SD 4.08Å; T426-M430 WeakPolarHBondContact O-CG 3.23Å; T426-M430 PolarHBondContact O-N 2.91Å; I427-M430 CarbonylContact O-C 3.43Å; I427-M430 PolarHBondContact O-N 3.31Å; S428-M430 PolarHBondContact O-N 3.34Å; M430-G432 PolarHBondContact O-N 3.39Å |
| 431 | Q | 83.8 | Confident | 85.8 | Confident | 181 Ų | 181 | 59.5 Ų | 59.5 | 85% | 0.846 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.3 | 31.4 | -177.6 | -58.1 | -178.8 | -32.1 | 0 | 0 | 113.8 | I427 S428 C429 | I427-Q431 PolarHBondContact O-N 2.69Å; I427-Q431 VanDerWaalsContact O-N 3.11Å; S428-Q431 PolarHBondContact O-N 2.97Å; C429-Q431 VanDerWaalsContact C-N 3.29Å |
| 432 | G | 75.6 | Confident | 85.7 | Confident | 6 Ų | 6 | 57.7 Ų | 57.7 | 6% | 0.062 | 30% | 0.304 | C | S | . | . | trans | -81 | 152.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | I427 M430 | I427-G432 PolarHBondContact O-N 3.47Å; I427-G432 VanDerWaalsContact O-N 3.1Å; M430-G432 PolarHBondContact O-N 3.39Å | ||
| 433 | G | 67.8 | Low | 85.6 | Confident | 0 Ų | 0 | 59.3 Ų | 59.3 | 0% | 0 | 31% | 0.309 | C | S | . | . | S | Bend | trans | 89 | -0.1 | 165.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | D121 G348 T435 | D121-G433 PolarHBondContact OD2-N 3.16Å; G348-G433 WeakPolarHBondContact CA-O 3.3Å; G433-T435 WeakPolarHBondContact O-CG2 3.29Å; G433-T435 PolarHBondContact O-N 3.34Å; G433-T435 PolarHBondContact O-OG1 3.39Å |
| 434 | H | 68.6 | Low | 85.5 | Confident | 93 Ų | 93 | 62.1 Ų | 62.1 | 43% | 0.431 | 32% | 0.321 | S | S | . | . | S | Bend | trans | 54.1 | 8.6 | -179 | -59.1 | -76.3 | 0 | 0 | 0 | 115.5 | D121 H125 V511 | D121-H434 IonicContact OD1-CD2 3.77Å; H125-H434 AromaticContact CE1-CD2 3.78Å; H125-H434 AromaticContact CE1-NE2 3.21Å; H125-H434 PolarHBondContact CE1-NE2 3.42Å; H125-H434 AromaticContact NE2-NE2 3.72Å; H434-V511 HydrophobicContact CB-CG1 3.95Å; H434-V511 HydrophobicContact CB-CG2 4.24Å |
| 435 | T | 66.4 | Low | 85.5 | Confident | 33 Ų | 33 | 62.1 Ų | 62.1 | 20% | 0.202 | 32% | 0.321 | C | S | . | . | trans | -112.2 | 132.5 | -177 | 51 | 0 | 0 | 0 | 0 | 109.5 | F352 G433 F498 | F352-T435 WeakPolarHBondContact CE2-OG1 3.41Å; G433-T435 WeakPolarHBondContact O-CG2 3.29Å; G433-T435 PolarHBondContact O-N 3.34Å; G433-T435 PolarHBondContact O-OG1 3.39Å; T435-F498 HydrophobicContact CG2-CE1 4.13Å | ||
| 436 | T | 73.2 | Confident | 85.7 | Confident | 70 Ų | 70 | 55.2 Ų | 55.2 | 43% | 0.429 | 30% | 0.295 | S | S | . | . | trans | -72.9 | 137.4 | 168.5 | 79.2 | 0 | 0 | 0 | 0 | 109 | T438 D508 | T436-T438 PolarHBondContact O-N 3.06Å; T436-T438 WeakPolarHBondContact OG1-CG2 3.44Å; T436-D508 PolarHBondContact OG1-OD1 3.26Å; T436-D508 PolarHBondContact OG1-OD2 3.13Å | ||
| 437 | L | 82.7 | Confident | 85.8 | Confident | 43 Ų | 43 | 57.7 Ų | 57.7 | 23% | 0.225 | 31% | 0.31 | C | S | . | . | trans | -78.2 | 77.2 | 176.4 | -68.5 | -173.6 | 0 | 0 | 0 | 109.8 | F352 L424 F441 I442 | F352-L437 HydrophobicContact CE1-CD2 4.27Å; F352-L437 HydrophobicContact CZ-CD2 4.03Å; L424-L437 HydrophobicContact CB-CD1 4.17Å; L424-L437 HydrophobicContact CD2-CD2 4.36Å; L424-L437 WeakPolarHBondContact O-CD1 3.29Å; L437-F441 HydrophobicContact CD2-CD1 3.69Å; L437-F441 HydrophobicContact CD2-CE1 3.61Å; L437-I442 HydrophobicContact CB-CD1 4.35Å | ||
| 438 | T | 86 | Confident | 86.1 | Confident | 28 Ų | 28 | 57.8 Ų | 57.8 | 17% | 0.172 | 31% | 0.311 | C | S | . | . | trans | -66.3 | 154.1 | 171.6 | 70.6 | 0 | 0 | 0 | 0 | 110.5 | T436 I440 F441 I442 D506 D508 | T436-T438 PolarHBondContact O-N 3.06Å; T436-T438 WeakPolarHBondContact OG1-CG2 3.44Å; T438-I440 PolarHBondContact O-N 3.3Å; T438-F441 PolarHBondContact O-N 3.04Å; T438-F441 WeakPolarHBondContact OG1-CB 3.2Å; T438-F441 PolarHBondContact OG1-N 3.14Å; T438-I442 WeakPolarHBondContact O-CG1 3.49Å; T438-I442 PolarHBondContact O-N 3.34Å; T438-D506 PolarHBondContact OG1-OD2 3.27Å; T438-D508 WeakPolarHBondContact CG2-OD2 3.45Å | ||
| 439 | L | 88.3 | Confident | 86.5 | Confident | 129 Ų | 129 | 54.8 Ų | 54.8 | 68% | 0.675 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -58.5 | -33.9 | 173.4 | -177.9 | 63.3 | 0 | 0 | 0 | 111.4 | I442 I443 | L439-I442 PolarHBondContact O-N 3.3Å; L439-I443 HydrophobicContact CG-CD1 4.13Å; L439-I443 WeakPolarHBondContact O-CD1 3.05Å; L439-I443 VanDerWaalsContact O-CG1 3.25Å; L439-I443 WeakPolarHBondContact O-CG1 3.21Å; L439-I443 PolarHBondContact O-N 3.38Å |
| 440 | I | 89.7 | Confident | 86.8 | Confident | 73 Ų | 73 | 53 Ų | 53 | 37% | 0.374 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -67.3 | -49 | 179.1 | -54.1 | 177.6 | 0 | 0 | 0 | 109.4 | T438 I442 I443 F444 L501 | T438-I440 PolarHBondContact O-N 3.3Å; I440-I442 VanDerWaalsContact C-N 3.33Å; I440-I442 PolarHBondContact O-N 3.27Å; I440-I443 PolarHBondContact O-N 3.04Å; I440-I443 VanDerWaalsContact O-N 3.16Å; I440-F444 HydrophobicContact CG2-CD2 3.92Å; I440-F444 HydrophobicContact CG2-CE2 3.87Å; I440-F444 WeakPolarHBondContact O-CD2 3.41Å; I440-F444 PolarHBondContact O-N 3.04Å; I440-F444 VanDerWaalsContact O-N 3.09Å; I440-L501 HydrophobicContact CB-CD2 4.37Å; I440-L501 HydrophobicContact CG2-CD2 3.58Å |
| 441 | F | 90.7 | Very high | 87.2 | Confident | 10 Ų | 10 | 51.5 Ų | 51.5 | 4% | 0.044 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -54.3 | -48.8 | 173.8 | 175.7 | -95 | 0 | 0 | 0 | 111.8 | F352 L424 L437 T438 I443 F444 Y445 F498 L501 | F352-F441 HydrophobicContact CD1-CZ 4.3Å; F352-F441 AromaticContact CD2-CZ 3.82Å; F352-F441 HydrophobicContact CD2-CZ 3.82Å; F352-F441 AromaticContact CE1-CE1 4Å; F352-F441 HydrophobicContact CE1-CE1 4Å; F352-F441 HydrophobicContact CE1-CZ 4.03Å; F352-F441 HydrophobicContact CE2-CE1 4.12Å; F352-F441 HydrophobicContact CE2-CE2 4.29Å; F352-F441 AromaticContact CE2-CZ 3.51Å; F352-F441 HydrophobicContact CE2-CZ 3.51Å; F352-F441 HydrophobicContact CG-CZ 4.22Å; F352-F441 AromaticContact CZ-CE1 3.75Å; F352-F441 HydrophobicContact CZ-CE1 3.75Å; F352-F441 AromaticContact CZ-CZ 3.63Å; F352-F441 HydrophobicContact CZ-CZ 3.63Å; L424-F441 HydrophobicContact CD2-CE1 4.31Å; L437-F441 HydrophobicContact CD2-CD1 3.69Å; L437-F441 HydrophobicContact CD2-CE1 3.61Å; T438-F441 PolarHBondContact O-N 3.04Å; T438-F441 WeakPolarHBondContact OG1-CB 3.2Å; T438-F441 PolarHBondContact OG1-N 3.14Å; F441-I443 VanDerWaalsContact C-N 3.29Å; F441-I443 PolarHBondContact O-N 3.29Å; F441-F444 PolarHBondContact O-N 3.02Å; F441-Y445 HydrophobicContact CE1-CG 4.42Å; F441-Y445 HydrophobicContact CZ-CD2 4.2Å; F441-Y445 HydrophobicContact CZ-CG 4.49Å; F441-Y445 VanDerWaalsContact O-CB 3.29Å; F441-Y445 WeakPolarHBondContact O-CB 3.43Å; F441-Y445 PolarHBondContact O-N 3.22Å; F441-F498 HydrophobicContact CE2-CD2 4.42Å; F441-F498 HydrophobicContact CE2-CE1 4.19Å; F441-F498 AromaticContact CE2-CE2 3.67Å; F441-F498 HydrophobicContact CE2-CE2 3.67Å; F441-F498 AromaticContact CE2-CZ 3.54Å; F441-F498 HydrophobicContact CE2-CZ 3.54Å; F441-F498 HydrophobicContact CZ-CE2 4.2Å; F441-F498 HydrophobicContact CZ-CZ 4.11Å; F441-L501 HydrophobicContact CB-CD1 4.32Å; F441-L501 HydrophobicContact CD2-CD1 3.57Å; F441-L501 HydrophobicContact CE2-CD1 4.34Å; F441-L501 HydrophobicContact CG-CD1 4.39Å |
| 442 | I | 92.9 | Very high | 87.9 | Confident | 43 Ų | 43 | 42.9 Ų | 42.9 | 22% | 0.221 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -58.6 | -41.4 | 179.7 | -66.4 | 168.8 | 0 | 0 | 0 | 111 | L421 L424 L437 T438 L439 I440 M446 | L421-I442 HydrophobicContact CD2-CG2 4.12Å; L424-I442 HydrophobicContact CD1-CG1 4.37Å; L424-I442 HydrophobicContact CD1-CG2 4.46Å; L437-I442 HydrophobicContact CB-CD1 4.35Å; T438-I442 WeakPolarHBondContact O-CG1 3.49Å; T438-I442 PolarHBondContact O-N 3.34Å; L439-I442 PolarHBondContact O-N 3.3Å; I440-I442 VanDerWaalsContact C-N 3.33Å; I440-I442 PolarHBondContact O-N 3.27Å; I442-M446 WeakPolarHBondContact O-CB 3.29Å; I442-M446 PolarHBondContact O-N 3.14Å |
| 443 | I | 94.2 | Very high | 88.9 | Confident | 94 Ų | 94 | 42.7 Ų | 42.7 | 48% | 0.482 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -64.1 | -47.1 | 178.7 | -70.3 | 164.5 | 0 | 0 | 0 | 111.3 | L439 I440 F441 T447 | L439-I443 HydrophobicContact CG-CD1 4.13Å; L439-I443 WeakPolarHBondContact O-CD1 3.05Å; L439-I443 VanDerWaalsContact O-CG1 3.25Å; L439-I443 WeakPolarHBondContact O-CG1 3.21Å; L439-I443 PolarHBondContact O-N 3.38Å; I440-I443 PolarHBondContact O-N 3.04Å; I440-I443 VanDerWaalsContact O-N 3.16Å; F441-I443 VanDerWaalsContact C-N 3.29Å; F441-I443 PolarHBondContact O-N 3.29Å; I443-T447 WeakPolarHBondContact O-CB 3.26Å; I443-T447 PolarHBondContact O-N 3.41Å; I443-T447 PolarHBondContact O-OG1 3.49Å |
| 444 | F | 93.5 | Very high | 90.2 | Very high | 59 Ų | 59 | 45.9 Ų | 45.9 | 26% | 0.259 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -67.4 | -46.5 | 179.6 | -83.9 | -81.6 | 0 | 0 | 0 | 112 | I440 F441 M446 T447 A448 V500 L501 I504 | I440-F444 HydrophobicContact CG2-CD2 3.92Å; I440-F444 HydrophobicContact CG2-CE2 3.87Å; I440-F444 WeakPolarHBondContact O-CD2 3.41Å; I440-F444 PolarHBondContact O-N 3.04Å; I440-F444 VanDerWaalsContact O-N 3.09Å; F441-F444 PolarHBondContact O-N 3.02Å; F444-M446 VanDerWaalsContact C-N 3.34Å; F444-M446 PolarHBondContact O-N 3.16Å; F444-T447 WeakPolarHBondContact O-CB 3.27Å; F444-T447 PolarHBondContact O-N 2.83Å; F444-T447 VanDerWaalsContact O-N 3.17Å; F444-A448 PolarHBondContact O-N 2.78Å; F444-V500 HydrophobicContact CD1-CG1 4.32Å; F444-V500 HydrophobicContact CE1-CB 4.26Å; F444-V500 HydrophobicContact CE1-CG1 3.5Å; F444-V500 VanDerWaalsContact CE1-CG1 3.5Å; F444-V500 HydrophobicContact CZ-CG1 3.7Å; F444-L501 HydrophobicContact CB-CD1 4.29Å; F444-L501 HydrophobicContact CB-CD2 4.43Å; F444-L501 HydrophobicContact CB-CG 4.33Å; F444-L501 HydrophobicContact CD2-CD2 3.55Å; F444-L501 HydrophobicContact CD2-CG 4.09Å; F444-L501 HydrophobicContact CE2-CD2 4.09Å; F444-L501 HydrophobicContact CG-CD2 4.19Å; F444-L501 HydrophobicContact CG-CG 4.26Å; F444-I504 HydrophobicContact CE2-CD1 3.83Å; F444-I504 HydrophobicContact CZ-CD1 3.6Å |
| 445 | Y | 94.6 | Very high | 91.5 | Very high | 2 Ų | 2 | 44 Ų | 44 | 1% | 0.008 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -57.2 | -46.9 | 174.9 | 176.4 | -87.6 | 0 | 0 | 0 | 111.6 | F352 I356 H420 L424 F441 T447 A448 A449 L494 | F352-Y445 HydrophobicContact CB-CE2 4.01Å; F352-Y445 HydrophobicContact CD1-CE2 4.09Å; F352-Y445 HydrophobicContact CG-CE2 4.28Å; I356-Y445 HydrophobicContact CD1-CE2 4.47Å; H420-Y445 HydrophobicContact CB-CE1 4.04Å; H420-Y445 PolarHBondContact CE1-OH 3.5Å; H420-Y445 AromaticContact CG-CE1 3.96Å; H420-Y445 AromaticContact ND1-CE1 3.41Å; H420-Y445 WeakPolarHBondContact ND1-CE1 3.37Å; H420-Y445 AromaticContact ND1-CZ 3.56Å; H420-Y445 PolarHBondContact ND1-OH 2.99Å; L424-Y445 HydrophobicContact CD1-CD1 3.62Å; L424-Y445 HydrophobicContact CD1-CE1 3.83Å; L424-Y445 HydrophobicContact CD1-CG 4.4Å; L424-Y445 HydrophobicContact CD2-CD1 4Å; L424-Y445 HydrophobicContact CD2-CD2 4.5Å; L424-Y445 HydrophobicContact CD2-CE1 3.78Å; L424-Y445 HydrophobicContact CD2-CE2 4.34Å; L424-Y445 HydrophobicContact CD2-CG 4.34Å; L424-Y445 HydrophobicContact CG-CD1 4.12Å; L424-Y445 HydrophobicContact CG-CE1 3.86Å; F441-Y445 HydrophobicContact CE1-CG 4.42Å; F441-Y445 HydrophobicContact CZ-CD2 4.2Å; F441-Y445 HydrophobicContact CZ-CG 4.49Å; F441-Y445 VanDerWaalsContact O-CB 3.29Å; F441-Y445 WeakPolarHBondContact O-CB 3.43Å; F441-Y445 PolarHBondContact O-N 3.22Å; Y445-T447 VanDerWaalsContact C-N 3.29Å; Y445-T447 PolarHBondContact O-N 3.18Å; Y445-A448 PolarHBondContact O-N 2.82Å; Y445-A449 PolarHBondContact O-N 2.8Å; Y445-L494 HydrophobicContact CD2-CD1 3.66Å; Y445-L494 HydrophobicContact CE2-CD1 4.02Å |
| 446 | M | 96.1 | Very high | 92.9 | Very high | 19 Ų | 19 | 42.4 Ų | 42.4 | 9% | 0.094 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -64.6 | -36.6 | 179 | -167.4 | 62.2 | 65.2 | 0 | 0 | 111.6 | V417 H420 L421 I442 F444 A449 L450 | V417-M446 HydrophobicContact CB-SD 4.24Å; V417-M446 HydrophobicContact CG1-CE 4.34Å; V417-M446 HydrophobicContact CG1-SD 4.25Å; V417-M446 HydrophobicContact CG2-SD 4.08Å; H420-M446 HydrophobicContact CB-CE 3.84Å; H420-M446 HydrophobicContact CB-SD 4.18Å; L421-M446 HydrophobicContact CD2-CE 3.83Å; L421-M446 HydrophobicContact CG-CE 3.76Å; I442-M446 WeakPolarHBondContact O-CB 3.29Å; I442-M446 PolarHBondContact O-N 3.14Å; F444-M446 VanDerWaalsContact C-N 3.34Å; F444-M446 PolarHBondContact O-N 3.16Å; M446-A449 PolarHBondContact O-N 2.91Å; M446-L450 HydrophobicContact CG-CD1 4.01Å; M446-L450 HydrophobicContact CG-CG 4.43Å; M446-L450 VanDerWaalsContact O-CB 3.31Å; M446-L450 WeakPolarHBondContact O-CB 3.33Å; M446-L450 VanDerWaalsContact O-CG 3.24Å; M446-L450 WeakPolarHBondContact O-CG 3.26Å; M446-L450 PolarHBondContact O-N 3.43Å |
| 447 | T | 96.7 | Very high | 94 | Very high | 81 Ų | 81 | 39.1 Ų | 39.1 | 50% | 0.497 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -64.3 | -43.4 | 175 | -58 | 0 | 0 | 0 | 0 | 111.2 | I443 F444 Y445 L451 | I443-T447 WeakPolarHBondContact O-CB 3.26Å; I443-T447 PolarHBondContact O-N 3.41Å; I443-T447 PolarHBondContact O-OG1 3.49Å; F444-T447 WeakPolarHBondContact O-CB 3.27Å; F444-T447 PolarHBondContact O-N 2.83Å; F444-T447 VanDerWaalsContact O-N 3.17Å; Y445-T447 VanDerWaalsContact C-N 3.29Å; Y445-T447 PolarHBondContact O-N 3.18Å; T447-L451 WeakPolarHBondContact O-CB 3.31Å; T447-L451 PolarHBondContact O-N 2.93Å |
| 448 | A | 97.3 | Very high | 94.5 | Very high | 3 Ų | 3 | 40.1 Ų | 40.1 | 3% | 0.025 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -61.8 | -47.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | I356 F444 Y445 L451 Q452 L493 S497 | I356-A448 HydrophobicContact CD1-CB 4.1Å; F444-A448 PolarHBondContact O-N 2.78Å; Y445-A448 PolarHBondContact O-N 2.82Å; A448-L451 PolarHBondContact O-N 3.04Å; A448-Q452 WeakPolarHBondContact O-CB 3.39Å; A448-Q452 PolarHBondContact O-N 3.31Å; A448-L493 HydrophobicContact CB-CB 3.89Å; A448-S497 WeakPolarHBondContact CB-OG 3.4Å |
| 449 | A | 97.5 | Very high | 94.9 | Very high | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -62.2 | -44.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | I356 V416 Y445 M446 V453 | I356-A449 HydrophobicContact CD1-CB 4.26Å; I356-A449 HydrophobicContact CG1-CB 4.42Å; V416-A449 HydrophobicContact CG1-CB 4.2Å; Y445-A449 PolarHBondContact O-N 2.8Å; M446-A449 PolarHBondContact O-N 2.91Å; A449-V453 WeakPolarHBondContact O-CG2 3.1Å; A449-V453 PolarHBondContact O-N 3.25Å |
| 450 | L | 97.5 | Very high | 95.1 | Very high | 43 Ų | 43 | 34.3 Ų | 34.3 | 23% | 0.225 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -63.5 | -43.7 | 176 | -74.2 | 169.3 | 0 | 0 | 0 | 111.8 | F413 V416 V417 M446 L454 | F413-L450 HydrophobicContact CE1-CD2 4.26Å; F413-L450 HydrophobicContact CE2-CB 4.41Å; F413-L450 HydrophobicContact CE2-CD2 3.83Å; F413-L450 HydrophobicContact CZ-CB 4.46Å; F413-L450 HydrophobicContact CZ-CD2 3.69Å; V416-L450 HydrophobicContact CB-CD2 4.06Å; V416-L450 HydrophobicContact CG1-CD2 3.89Å; V416-L450 HydrophobicContact CG1-CG 4.31Å; V417-L450 HydrophobicContact CG2-CD1 4.19Å; V417-L450 HydrophobicContact CG2-CD2 3.88Å; V417-L450 HydrophobicContact CG2-CG 4.4Å; M446-L450 HydrophobicContact CG-CD1 4.01Å; M446-L450 HydrophobicContact CG-CG 4.43Å; M446-L450 VanDerWaalsContact O-CB 3.31Å; M446-L450 WeakPolarHBondContact O-CB 3.33Å; M446-L450 VanDerWaalsContact O-CG 3.24Å; M446-L450 WeakPolarHBondContact O-CG 3.26Å; M446-L450 PolarHBondContact O-N 3.43Å; L450-L454 WeakPolarHBondContact O-CB 3.49Å; L450-L454 PolarHBondContact O-N 3.44Å |
| 451 | L | 97.4 | Very high | 95.2 | Very high | 72 Ų | 72 | 31.5 Ų | 31.5 | 38% | 0.377 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -65.6 | -43.3 | 179.5 | -177.8 | 59.9 | 0 | 0 | 0 | 111.6 | T447 A448 L454 I455 L493 | T447-L451 WeakPolarHBondContact O-CB 3.31Å; T447-L451 PolarHBondContact O-N 2.93Å; A448-L451 PolarHBondContact O-N 3.04Å; L451-L454 PolarHBondContact O-N 2.91Å; L451-I455 HydrophobicContact CD1-CD1 3.92Å; L451-I455 HydrophobicContact CD1-CG1 4.28Å; L451-I455 HydrophobicContact CG-CD1 3.94Å; L451-I455 WeakPolarHBondContact O-CD1 3.48Å; L451-I455 VanDerWaalsContact O-CG1 3.24Å; L451-I455 WeakPolarHBondContact O-CG1 3.47Å; L451-I455 PolarHBondContact O-N 2.88Å; L451-L493 HydrophobicContact CB-CD1 4.18Å; L451-L493 HydrophobicContact CD2-CD1 4.17Å; L451-L493 HydrophobicContact CD2-CD2 3.77Å; L451-L493 HydrophobicContact CG-CD1 4.05Å |
| 452 | Q | 98 | Very high | 95.2 | Very high | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -56.8 | -55.8 | 174.6 | -177.2 | -154.1 | 0.7 | 0 | 0 | 110.5 | I356 A448 L454 I455 L456 G486 L489 L493 | I356-Q452 PolarHBondContact O-NE2 3.1Å; I356-Q452 PolarHBondContact O-OE1 2.98Å; I356-Q452 VanDerWaalsContact O-OE1 3.07Å; A448-Q452 WeakPolarHBondContact O-CB 3.39Å; A448-Q452 PolarHBondContact O-N 3.31Å; Q452-L454 VanDerWaalsContact C-N 3.34Å; Q452-L454 PolarHBondContact O-N 3.35Å; Q452-I455 PolarHBondContact O-N 2.89Å; Q452-L456 HydrophobicContact CG-CD1 3.94Å; Q452-L456 HydrophobicContact CG-CG 4.47Å; Q452-L456 WeakPolarHBondContact O-CB 3.36Å; Q452-L456 VanDerWaalsContact O-CG 3.28Å; Q452-L456 WeakPolarHBondContact O-CG 3.49Å; Q452-L456 PolarHBondContact O-N 2.78Å; Q452-G486 PolarHBondContact NE2-O 2.87Å; Q452-L489 HydrophobicContact CG-CB 4.05Å; Q452-L493 HydrophobicContact CB-CD1 3.94Å |
| 453 | V | 96.8 | Very high | 95.1 | Very high | 1 Ų | 1 | 34.1 Ų | 34.1 | 1% | 0.006 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -65.1 | -37.3 | -177.1 | 176.3 | 0 | 0 | 0 | 0 | 111.6 | L363 F413 V416 A449 I455 L456 L457 | L363-V453 HydrophobicContact CD1-CG1 4.09Å; L363-V453 HydrophobicContact CD1-CG2 4.12Å; F413-V453 HydrophobicContact CD2-CG1 4.36Å; V416-V453 HydrophobicContact CG1-CG2 4.49Å; V416-V453 HydrophobicContact CG2-CB 3.92Å; V416-V453 HydrophobicContact CG2-CG1 3.7Å; V416-V453 HydrophobicContact CG2-CG2 3.84Å; A449-V453 WeakPolarHBondContact O-CG2 3.1Å; A449-V453 PolarHBondContact O-N 3.25Å; V453-I455 PolarHBondContact O-N 2.84Å; V453-L456 PolarHBondContact O-N 3.07Å; V453-L457 HydrophobicContact CG1-CD1 3.69Å; V453-L457 HydrophobicContact CG1-CG 3.96Å; V453-L457 WeakPolarHBondContact O-CB 3.48Å; V453-L457 VanDerWaalsContact O-CG 3.26Å; V453-L457 WeakPolarHBondContact O-CG 2.93Å; V453-L457 PolarHBondContact O-N 3.32Å |
| 454 | L | 96 | Very high | 94.9 | Very high | 68 Ų | 68 | 29.6 Ų | 29.6 | 36% | 0.356 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -57.7 | -49.6 | 174.6 | -177.7 | 72.9 | 0 | 0 | 0 | 111.4 | F399 F413 L450 L451 Q452 Y458 | F399-L454 HydrophobicContact CD2-CD1 4.26Å; F399-L454 HydrophobicContact CE1-CD1 4.21Å; F399-L454 HydrophobicContact CE2-CD1 3.62Å; F399-L454 HydrophobicContact CZ-CD1 3.6Å; F399-L454 HydrophobicContact CZ-CG 4.48Å; F413-L454 HydrophobicContact CE2-CB 3.93Å; F413-L454 HydrophobicContact CE2-CD1 4.14Å; F413-L454 HydrophobicContact CZ-CD1 4.49Å; L450-L454 WeakPolarHBondContact O-CB 3.49Å; L450-L454 PolarHBondContact O-N 3.44Å; L451-L454 PolarHBondContact O-N 2.91Å; Q452-L454 VanDerWaalsContact C-N 3.34Å; Q452-L454 PolarHBondContact O-N 3.35Å; L454-Y458 WeakPolarHBondContact O-CB 3.41Å; L454-Y458 PolarHBondContact O-N 2.93Å; L454-Y458 VanDerWaalsContact O-N 3.14Å |
| 455 | I | 96.3 | Very high | 94.6 | Very high | 52 Ų | 52 | 28.4 Ų | 28.4 | 27% | 0.267 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -64 | -45.3 | 179.3 | -67.1 | 166.1 | 0 | 0 | 0 | 110.1 | L451 Q452 V453 Y458 I459 L489 | L451-I455 HydrophobicContact CD1-CD1 3.92Å; L451-I455 HydrophobicContact CD1-CG1 4.28Å; L451-I455 HydrophobicContact CG-CD1 3.94Å; L451-I455 WeakPolarHBondContact O-CD1 3.48Å; L451-I455 VanDerWaalsContact O-CG1 3.24Å; L451-I455 WeakPolarHBondContact O-CG1 3.47Å; L451-I455 PolarHBondContact O-N 2.88Å; Q452-I455 PolarHBondContact O-N 2.89Å; V453-I455 PolarHBondContact O-N 2.84Å; I455-Y458 PolarHBondContact O-N 3.45Å; I455-I459 HydrophobicContact CG2-CD1 3.57Å; I455-I459 HydrophobicContact CG2-CG1 4.33Å; I455-I459 WeakPolarHBondContact O-CB 3.35Å; I455-I459 VanDerWaalsContact O-CG1 3.3Å; I455-I459 WeakPolarHBondContact O-CG1 3.5Å; I455-I459 PolarHBondContact O-N 3.27Å; I455-L489 HydrophobicContact CB-CD1 4.11Å; I455-L489 HydrophobicContact CG2-CD1 3.55Å |
| 456 | L | 96.3 | Very high | 94.3 | Very high | 1 Ų | 1 | 33.3 Ų | 33.3 | 1% | 0.005 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61.7 | -46.8 | -179.7 | -74.7 | 177.3 | 0 | 0 | 0 | 112.8 | V364 Q452 V453 Y458 I459 A460 L482 L485 L489 | V364-L456 HydrophobicContact CB-CB 4Å; V364-L456 HydrophobicContact CB-CD1 4.4Å; V364-L456 HydrophobicContact CG1-CD1 4.28Å; V364-L456 HydrophobicContact CG2-CB 3.83Å; V364-L456 WeakPolarHBondContact CG2-O 3.41Å; Q452-L456 HydrophobicContact CG-CD1 3.94Å; Q452-L456 HydrophobicContact CG-CG 4.47Å; Q452-L456 WeakPolarHBondContact O-CB 3.36Å; Q452-L456 VanDerWaalsContact O-CG 3.28Å; Q452-L456 WeakPolarHBondContact O-CG 3.49Å; Q452-L456 PolarHBondContact O-N 2.78Å; V453-L456 PolarHBondContact O-N 3.07Å; L456-Y458 VanDerWaalsContact C-N 3.33Å; L456-Y458 PolarHBondContact O-N 2.99Å; L456-I459 PolarHBondContact O-N 2.94Å; L456-A460 WeakPolarHBondContact O-CB 3.23Å; L456-A460 PolarHBondContact O-N 3.41Å; L456-L482 WeakPolarHBondContact CD2-O 3.36Å; L456-L485 HydrophobicContact CD2-CB 4.24Å; L456-L485 HydrophobicContact CD2-CD2 4.32Å; L456-L485 HydrophobicContact CD2-CG 4.16Å; L456-L489 HydrophobicContact CD2-CD1 4.34Å |
| 457 | L | 95.1 | Very high | 93.9 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -65 | -37.7 | 178.9 | -69.4 | 175.9 | 0 | 0 | 0 | 111.8 | Q367 F399 A409 L412 F413 V453 D461 | Q367-L457 HydrophobicContact CB-CD2 3.68Å; Q367-L457 HydrophobicContact CG-CD2 3.77Å; F399-L457 HydrophobicContact CE1-CB 4.01Å; F399-L457 HydrophobicContact CE1-CD1 3.99Å; F399-L457 HydrophobicContact CZ-CB 3.78Å; F399-L457 HydrophobicContact CZ-CD1 4.47Å; A409-L457 WeakPolarHBondContact O-CD1 3.38Å; L412-L457 HydrophobicContact CB-CD1 4.42Å; L412-L457 HydrophobicContact CB-CD2 4.47Å; L412-L457 HydrophobicContact CD1-CD2 4.18Å; F413-L457 HydrophobicContact CB-CD1 3.98Å; V453-L457 HydrophobicContact CG1-CD1 3.69Å; V453-L457 HydrophobicContact CG1-CG 3.96Å; V453-L457 WeakPolarHBondContact O-CB 3.48Å; V453-L457 VanDerWaalsContact O-CG 3.26Å; V453-L457 WeakPolarHBondContact O-CG 2.93Å; V453-L457 PolarHBondContact O-N 3.32Å; L457-D461 PolarHBondContact O-N 3.33Å; L457-D461 VanDerWaalsContact O-N 3.16Å |
| 458 | Y | 94.3 | Very high | 93.5 | Very high | 65 Ų | 65 | 29.6 Ų | 29.6 | 26% | 0.255 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -64.1 | -46.8 | 173.9 | 172.7 | -107.2 | 0 | 0 | 0 | 112.2 | P393 P395 L454 I455 L456 A460 D461 W462 | P393-Y458 VanDerWaalsContact O-CE2 3.32Å; P393-Y458 WeakPolarHBondContact O-CE2 3.25Å; P393-Y458 PolarHBondContact O-OH 3.01Å; P395-Y458 HydrophobicContact CB-CD2 4.19Å; P395-Y458 HydrophobicContact CB-CE2 4.24Å; P395-Y458 HydrophobicContact CG-CD2 4.06Å; P395-Y458 HydrophobicContact CG-CE2 3.68Å; L454-Y458 WeakPolarHBondContact O-CB 3.41Å; L454-Y458 PolarHBondContact O-N 2.93Å; L454-Y458 VanDerWaalsContact O-N 3.14Å; I455-Y458 PolarHBondContact O-N 3.45Å; L456-Y458 VanDerWaalsContact C-N 3.33Å; L456-Y458 PolarHBondContact O-N 2.99Å; Y458-A460 VanDerWaalsContact C-N 3.33Å; Y458-A460 PolarHBondContact O-N 3.25Å; Y458-D461 PolarHBondContact O-N 3.02Å; Y458-W462 PolarHBondContact O-N 3.42Å |
| 459 | I | 94.2 | Very high | 92.8 | Very high | 35 Ų | 35 | 31 Ų | 31 | 18% | 0.179 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -67.6 | -35.8 | 179.1 | -67.6 | 173.2 | 0 | 0 | 0 | 110.7 | I455 L456 W462 M463 L482 L485 | I455-I459 HydrophobicContact CG2-CD1 3.57Å; I455-I459 HydrophobicContact CG2-CG1 4.33Å; I455-I459 WeakPolarHBondContact O-CB 3.35Å; I455-I459 VanDerWaalsContact O-CG1 3.3Å; I455-I459 WeakPolarHBondContact O-CG1 3.5Å; I455-I459 PolarHBondContact O-N 3.27Å; L456-I459 PolarHBondContact O-N 2.94Å; I459-W462 HydrophobicContact CG2-CE3 4.36Å; I459-W462 PolarHBondContact O-N 2.99Å; I459-M463 HydrophobicContact CG2-CB 4.43Å; I459-M463 WeakPolarHBondContact O-CA 3.18Å; I459-M463 WeakPolarHBondContact O-CB 3.34Å; I459-M463 PolarHBondContact O-N 3.44Å; I459-L482 HydrophobicContact CB-CD2 4.28Å; I459-L482 HydrophobicContact CG2-CD2 3.83Å; I459-L485 HydrophobicContact CD1-CD2 3.39Å; I459-L485 HydrophobicContact CG2-CD2 4.13Å |
| 460 | A | 92.7 | Very high | 92.3 | Very high | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -59.3 | -48.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | V364 Q367 L456 Y458 V464 L482 | V364-A460 HydrophobicContact CG2-CB 3.67Å; Q367-A460 HydrophobicContact CG-CB 4.5Å; L456-A460 WeakPolarHBondContact O-CB 3.23Å; L456-A460 PolarHBondContact O-N 3.41Å; Y458-A460 VanDerWaalsContact C-N 3.33Å; Y458-A460 PolarHBondContact O-N 3.25Å; A460-V464 VanDerWaalsContact O-CB 3.3Å; A460-V464 WeakPolarHBondContact O-CB 3.21Å; A460-V464 WeakPolarHBondContact O-CG2 3.41Å; A460-V464 PolarHBondContact O-N 3.25Å; A460-L482 HydrophobicContact CB-CD1 3.75Å; A460-L482 HydrophobicContact CB-CD2 3.96Å |
| 461 | D | 91.2 | Very high | 91.5 | Very high | 14 Ų | 14 | 39 Ų | 39 | 8% | 0.075 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.8 | -50.3 | 176.8 | -174.8 | 47.5 | 0 | 0 | 0 | 111.7 | I371 P393 T398 L457 Y458 H465 | I371-D461 HydrophobicContact CD1-CB 4.32Å; P393-D461 VanDerWaalsContact CG-OD2 3.24Å; P393-D461 WeakPolarHBondContact CG-OD2 3.07Å; T398-D461 WeakPolarHBondContact CB-OD2 3.28Å; T398-D461 HydrophobicContact CG2-CB 3.48Å; T398-D461 VanDerWaalsContact CG2-CB 3.48Å; T398-D461 WeakPolarHBondContact CG2-OD2 2.8Å; T398-D461 PolarHBondContact OG1-OD2 2.96Å; L457-D461 PolarHBondContact O-N 3.33Å; L457-D461 VanDerWaalsContact O-N 3.16Å; Y458-D461 PolarHBondContact O-N 3.02Å; D461-H465 PolarHBondContact O-N 2.62Å; D461-H465 PolarHBondContact O-ND1 3.45Å; D461-H465 IonicContact OD1-CE1 2.66Å; D461-H465 PolarHBondContact OD1-CE1 3.24Å; D461-H465 IonicContact OD1-ND1 3.65Å; D461-H465 PolarHBondContact OD1-ND1 3.43Å |
| 462 | W | 91 | Very high | 90.8 | Very high | 90 Ų | 90 | 38.7 Ų | 38.7 | 34% | 0.341 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -62.1 | -49.5 | 178.2 | 169.3 | 63.7 | 0 | 0 | 0 | 112.9 | C392 P393 Y458 I459 W466 | C392-W462 PolarHBondContact SG-NE1 3.47Å; P393-W462 HydrophobicContact CG-CB 4.35Å; Y458-W462 PolarHBondContact O-N 3.42Å; I459-W462 HydrophobicContact CG2-CE3 4.36Å; I459-W462 PolarHBondContact O-N 2.99Å; W462-W466 VanDerWaalsContact O-CB 3.22Å; W462-W466 WeakPolarHBondContact O-CB 3.41Å; W462-W466 PolarHBondContact O-N 3.02Å |
| 463 | M | 91.2 | Very high | 90 | Very high | 17 Ų | 17 | 41 Ų | 41 | 8% | 0.084 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -71.8 | -40.3 | -170 | -170.7 | -178.9 | 66.8 | 0 | 0 | 111.9 | I459 W466 M467 S478 Y481 L482 | I459-M463 HydrophobicContact CG2-CB 4.43Å; I459-M463 WeakPolarHBondContact O-CA 3.18Å; I459-M463 WeakPolarHBondContact O-CB 3.34Å; I459-M463 PolarHBondContact O-N 3.44Å; M463-W466 PolarHBondContact O-N 3.47Å; M463-M467 HydrophobicContact CE-CE 4.11Å; M463-M467 HydrophobicContact CG-CE 3.76Å; M463-M467 HydrophobicContact CG-CG 4.41Å; M463-M467 HydrophobicContact CG-SD 4.14Å; M463-M467 WeakPolarHBondContact O-CB 3.25Å; M463-M467 VanDerWaalsContact O-CG 3.26Å; M463-M467 WeakPolarHBondContact O-CG 3.3Å; M463-M467 PolarHBondContact O-N 3.07Å; M463-M467 HydrophobicContact SD-CE 3.78Å; M463-S478 VanDerWaalsContact CE-CA 3.43Å; M463-S478 WeakPolarHBondContact CE-O 3.5Å; M463-Y481 HydrophobicContact SD-CD2 4.07Å; M463-Y481 HydrophobicContact SD-CG 4.5Å; M463-L482 HydrophobicContact CE-CD1 3.64Å; M463-L482 HydrophobicContact CE-CD2 3.84Å; M463-L482 HydrophobicContact CE-CG 3.41Å; M463-L482 VanDerWaalsContact CE-CG 3.41Å |
| 464 | V | 89.3 | Confident | 89.3 | Confident | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63.1 | -46.5 | 177.4 | 172.1 | 0 | 0 | 0 | 0 | 110.5 | A368 I371 L375 A460 W466 M467 W468 P474 | A368-V464 HydrophobicContact CB-CG2 4.16Å; I371-V464 HydrophobicContact CB-CB 4.49Å; I371-V464 HydrophobicContact CB-CG1 4Å; I371-V464 HydrophobicContact CG2-CB 4Å; I371-V464 HydrophobicContact CG2-CG1 3.45Å; I371-V464 VanDerWaalsContact CG2-CG1 3.45Å; L375-V464 HydrophobicContact CD1-CG1 3.72Å; A460-V464 VanDerWaalsContact O-CB 3.3Å; A460-V464 WeakPolarHBondContact O-CB 3.21Å; A460-V464 WeakPolarHBondContact O-CG2 3.41Å; A460-V464 PolarHBondContact O-N 3.25Å; V464-W466 VanDerWaalsContact C-N 3.33Å; V464-W466 PolarHBondContact O-N 2.92Å; V464-M467 PolarHBondContact O-N 3.33Å; V464-W468 VanDerWaalsContact O-CB 3.3Å; V464-W468 WeakPolarHBondContact O-CB 3.4Å; V464-W468 PolarHBondContact O-N 3.48Å; V464-P474 HydrophobicContact CB-CB 4.39Å; V464-P474 HydrophobicContact CG1-CB 3.81Å; V464-P474 HydrophobicContact CG1-CG 3.99Å; V464-P474 HydrophobicContact CG2-CB 4.34Å |
| 465 | H | 87.6 | Confident | 88.2 | Confident | 33 Ų | 33 | 40 Ų | 40 | 15% | 0.153 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.5 | -36.1 | 175.7 | -70.8 | 98.5 | 0 | 0 | 0 | 112.6 | D461 G469 | D461-H465 PolarHBondContact O-N 2.62Å; D461-H465 PolarHBondContact O-ND1 3.45Å; D461-H465 IonicContact OD1-CE1 2.66Å; D461-H465 PolarHBondContact OD1-CE1 3.24Å; D461-H465 IonicContact OD1-ND1 3.65Å; D461-H465 PolarHBondContact OD1-ND1 3.43Å; H465-G469 PolarHBondContact O-N 2.82Å |
| 466 | W | 87.6 | Confident | 87.3 | Confident | 106 Ų | 106 | 40.3 Ų | 40.3 | 40% | 0.402 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -65.7 | -44.8 | 176.5 | 177.4 | 84.7 | 0 | 0 | 0 | 112.1 | W462 M463 V464 G469 R470 | W462-W466 VanDerWaalsContact O-CB 3.22Å; W462-W466 WeakPolarHBondContact O-CB 3.41Å; W462-W466 PolarHBondContact O-N 3.02Å; M463-W466 PolarHBondContact O-N 3.47Å; V464-W466 VanDerWaalsContact C-N 3.33Å; V464-W466 PolarHBondContact O-N 2.92Å; W466-G469 PolarHBondContact O-N 3.49Å; W466-R470 HydrophobicContact CZ2-CG 4.43Å; W466-R470 WeakPolarHBondContact O-CG 3.42Å; W466-R470 PolarHBondContact O-N 3.22Å |
| 467 | M | 88.5 | Confident | 86.7 | Confident | 4 Ų | 4 | 42 Ų | 42 | 2% | 0.02 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.9 | -46.6 | 174.6 | -73.6 | 175.2 | 169.8 | 0 | 0 | 111.1 | M463 V464 G469 R470 G471 L472 P474 F477 Y481 | M463-M467 HydrophobicContact CE-CE 4.11Å; M463-M467 HydrophobicContact CG-CE 3.76Å; M463-M467 HydrophobicContact CG-CG 4.41Å; M463-M467 HydrophobicContact CG-SD 4.14Å; M463-M467 WeakPolarHBondContact O-CB 3.25Å; M463-M467 VanDerWaalsContact O-CG 3.26Å; M463-M467 WeakPolarHBondContact O-CG 3.3Å; M463-M467 PolarHBondContact O-N 3.07Å; M463-M467 HydrophobicContact SD-CE 3.78Å; V464-M467 PolarHBondContact O-N 3.33Å; M467-G469 VanDerWaalsContact C-N 3.32Å; M467-G469 PolarHBondContact O-N 3.02Å; M467-R470 CarbonylContact O-C 3.55Å; M467-R470 WeakPolarHBondContact O-CA 3.41Å; M467-R470 WeakPolarHBondContact O-CB 3.46Å; M467-R470 PolarHBondContact O-N 2.9Å; M467-G471 PolarHBondContact O-N 3.27Å; M467-L472 CarbonylContact C-O 3.6Å; M467-L472 HydrophobicContact CB-CB 4.19Å; M467-L472 PolarHBondContact O-N 3.22Å; M467-P474 HydrophobicContact CB-CB 4.42Å; M467-P474 HydrophobicContact SD-CB 4.46Å; M467-F477 HydrophobicContact CE-CB 3.53Å; M467-F477 HydrophobicContact SD-CB 3.77Å; M467-Y481 HydrophobicContact CE-CD2 3.56Å; M467-Y481 HydrophobicContact CE-CE2 3.65Å |
| 468 | W | 86.7 | Confident | 86.3 | Confident | 18 Ų | 18 | 42 Ų | 42 | 7% | 0.068 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -56.5 | -45.1 | 176.3 | -172.9 | -93.7 | 0 | 0 | 0 | 112.5 | L375 H376 G379 M380 P381 G382 V464 R470 G471 P474 | L375-W468 HydrophobicContact CB-CD2 3.66Å; L375-W468 HydrophobicContact CB-CE3 3.59Å; L375-W468 HydrophobicContact CB-CG 4.37Å; L375-W468 HydrophobicContact CB-CH2 3.86Å; L375-W468 HydrophobicContact CB-CZ2 3.9Å; L375-W468 HydrophobicContact CB-CZ3 3.68Å; L375-W468 HydrophobicContact CD1-CB 3.86Å; L375-W468 HydrophobicContact CD1-CD2 3.88Å; L375-W468 HydrophobicContact CD1-CE3 4.02Å; L375-W468 HydrophobicContact CD1-CG 3.8Å; L375-W468 HydrophobicContact CD2-CD2 4.48Å; L375-W468 HydrophobicContact CD2-CG 4.41Å; L375-W468 HydrophobicContact CG-CD2 4.22Å; L375-W468 HydrophobicContact CG-CE3 4.41Å; L375-W468 HydrophobicContact CG-CG 4.43Å; L375-W468 WeakPolarHBondContact O-CH2 3.45Å; L375-W468 WeakPolarHBondContact O-CZ2 3.21Å; H376-W468 HydrophobicContact CB-CH2 4.4Å; H376-W468 AromaticContact CD2-CZ3 3.9Å; H376-W468 AromaticContact CE1-CZ3 3.77Å; H376-W468 AromaticContact CG-CH2 3.95Å; H376-W468 AromaticContact CG-CZ3 3.79Å; H376-W468 AromaticContact ND1-CH2 3.73Å; H376-W468 AromaticContact ND1-CZ3 3.71Å; H376-W468 AromaticContact NE2-CZ3 3.88Å; G379-W468 WeakPolarHBondContact O-CH2 3.48Å; G379-W468 VanDerWaalsContact O-CZ2 3.24Å; G379-W468 WeakPolarHBondContact O-CZ2 3.27Å; M380-W468 WeakPolarHBondContact O-CZ2 3.43Å; P381-W468 HydrophobicContact CB-CD2 4.48Å; P381-W468 HydrophobicContact CB-CE3 4.28Å; P381-W468 HydrophobicContact CB-CZ3 4.31Å; P381-W468 VanDerWaalsContact CD-CH2 3.5Å; P381-W468 HydrophobicContact CG-CE3 4Å; P381-W468 HydrophobicContact CG-CH2 3.82Å; P381-W468 HydrophobicContact CG-CZ2 4.46Å; P381-W468 HydrophobicContact CG-CZ3 3.59Å; G382-W468 PolarHBondContact N-O 3.35Å; V464-W468 VanDerWaalsContact O-CB 3.3Å; V464-W468 WeakPolarHBondContact O-CB 3.4Å; V464-W468 PolarHBondContact O-N 3.48Å; W468-R470 PolarHBondContact O-N 3.25Å; W468-G471 PolarHBondContact O-N 2.85Å; W468-G471 VanDerWaalsContact O-N 3.1Å; W468-P474 HydrophobicContact CE3-CG 4.11Å |
| 469 | G | 83.9 | Confident | 86 | Confident | 32 Ų | 32 | 39.6 Ų | 39.6 | 33% | 0.33 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -66.4 | -18.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | H465 W466 M467 | H465-G469 PolarHBondContact O-N 2.82Å; W466-G469 PolarHBondContact O-N 3.49Å; M467-G469 VanDerWaalsContact C-N 3.32Å; M467-G469 PolarHBondContact O-N 3.02Å |
| 470 | R | 85.7 | Confident | 85.8 | Confident | 170 Ų | 170 | 38.1 Ų | 38.1 | 64% | 0.642 | 19% | 0.189 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -93.2 | -0.5 | 174.7 | -71 | -73.9 | -175.9 | 100.4 | -2 | 113.3 | W466 M467 W468 L472 | W466-R470 HydrophobicContact CZ2-CG 4.43Å; W466-R470 WeakPolarHBondContact O-CG 3.42Å; W466-R470 PolarHBondContact O-N 3.22Å; M467-R470 CarbonylContact O-C 3.55Å; M467-R470 WeakPolarHBondContact O-CA 3.41Å; M467-R470 WeakPolarHBondContact O-CB 3.46Å; M467-R470 PolarHBondContact O-N 2.9Å; W468-R470 PolarHBondContact O-N 3.25Å; R470-L472 HydrophobicContact CB-CD1 4.39Å; R470-L472 HydrophobicContact CB-CG 4.23Å; R470-L472 PolarHBondContact O-N 3.42Å |
| 471 | G | 82 | Confident | 85.8 | Confident | 41 Ų | 41 | 40.1 Ų | 40.1 | 42% | 0.423 | 20% | 0.197 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 71.6 | 17 | -174 | 0 | 0 | 0 | 0 | 0 | 113.4 | M467 W468 | M467-G471 PolarHBondContact O-N 3.27Å; W468-G471 PolarHBondContact O-N 2.85Å; W468-G471 VanDerWaalsContact O-N 3.1Å |
| 472 | L | 82.4 | Confident | 85.9 | Confident | 66 Ų | 66 | 39.4 Ų | 39.4 | 35% | 0.346 | 19% | 0.193 | S | C | . | . | trans | -88.4 | 133.4 | 170.7 | -61.7 | 175.6 | 0 | 0 | 0 | 108.2 | M467 R470 P474 F477 | M467-L472 CarbonylContact C-O 3.6Å; M467-L472 HydrophobicContact CB-CB 4.19Å; M467-L472 PolarHBondContact O-N 3.22Å; R470-L472 HydrophobicContact CB-CD1 4.39Å; R470-L472 HydrophobicContact CB-CG 4.23Å; R470-L472 PolarHBondContact O-N 3.42Å; L472-P474 WeakPolarHBondContact O-CD 3.16Å; L472-F477 HydrophobicContact CB-CD2 4.38Å; L472-F477 HydrophobicContact CB-CE2 4.41Å; L472-F477 HydrophobicContact CD2-CE2 4.38Å; L472-F477 HydrophobicContact CD2-CZ 4.48Å | ||
| 473 | D | 80.4 | Confident | 86 | Confident | 47 Ų | 47 | 35.4 Ų | 35.4 | 25% | 0.251 | 18% | 0.178 | S | C | . | . | trans | -73.3 | 107.6 | 175.2 | -179.2 | 7.5 | 0 | 0 | 0 | 110 | H376 D475 N476 F477 | H376-D473 IonicContact CE1-OD1 3.74Å; H376-D473 IonicContact NE2-OD1 3.95Å; H376-D473 PolarHBondContact NE2-OD1 2.69Å; D473-D475 PolarHBondContact O-N 3.3Å; D473-D475 VanDerWaalsContact O-N 3.08Å; D473-D475 PolarHBondContact OD1-N 2.9Å; D473-N476 PolarHBondContact O-N 3.29Å; D473-N476 VanDerWaalsContact O-N 3.1Å; D473-N476 PolarHBondContact OD2-ND2 2.99Å; D473-F477 VanDerWaalsContact O-CD2 3.31Å; D473-F477 WeakPolarHBondContact O-CD2 3.19Å | ||
| 474 | P | 82.1 | Confident | 86.1 | Confident | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -57.5 | -27.1 | -174.9 | 22.5 | -32.2 | 0 | 0 | 0 | 113.1 | S372 V464 M467 W468 L472 N476 F477 S478 | S372-P474 WeakPolarHBondContact OG-CG 3.46Å; V464-P474 HydrophobicContact CB-CB 4.39Å; V464-P474 HydrophobicContact CG1-CB 3.81Å; V464-P474 HydrophobicContact CG1-CG 3.99Å; V464-P474 HydrophobicContact CG2-CB 4.34Å; M467-P474 HydrophobicContact CB-CB 4.42Å; M467-P474 HydrophobicContact SD-CB 4.46Å; W468-P474 HydrophobicContact CE3-CG 4.11Å; L472-P474 WeakPolarHBondContact O-CD 3.16Å; P474-N476 PolarHBondContact O-N 3.43Å; P474-N476 VanDerWaalsContact O-N 3.15Å; P474-F477 PolarHBondContact O-N 3.38Å; P474-F477 VanDerWaalsContact O-N 3.13Å; P474-S478 WeakPolarHBondContact O-CB 3.26Å; P474-S478 PolarHBondContact O-N 2.84Å; P474-S478 PolarHBondContact O-OG 2.92Å |
| 475 | D | 74.2 | Confident | 86.4 | Confident | 48 Ų | 48 | 36.5 Ų | 36.5 | 26% | 0.257 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -59.8 | -28.7 | 179 | -74 | -19.4 | 0 | 0 | 0 | 113.5 | S372 H376 D473 | S372-D475 WeakPolarHBondContact CB-OD1 3.45Å; S372-D475 PolarHBondContact OG-OD1 3.33Å; S372-D475 PolarHBondContact OG-OD2 3.33Å; H376-D475 IonicContact CD2-OD2 3.67Å; H376-D475 IonicContact NE2-OD2 2.63Å; D473-D475 PolarHBondContact O-N 3.3Å; D473-D475 VanDerWaalsContact O-N 3.08Å; D473-D475 PolarHBondContact OD1-N 2.9Å |
| 476 | N | 76 | Confident | 86.8 | Confident | 60 Ų | 60 | 35 Ų | 35 | 32% | 0.321 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -87.9 | -20.9 | -179.6 | -69.2 | -55.6 | 0 | 0 | 0 | 113.6 | R156 P322 D473 P474 | R156-N476 PolarHBondContact NH2-OD1 3.14Å; P322-N476 WeakPolarHBondContact CG-O 3.31Å; D473-N476 PolarHBondContact O-N 3.29Å; D473-N476 VanDerWaalsContact O-N 3.1Å; D473-N476 PolarHBondContact OD2-ND2 2.99Å; P474-N476 PolarHBondContact O-N 3.43Å; P474-N476 VanDerWaalsContact O-N 3.15Å |
| 477 | F | 84.2 | Confident | 87.1 | Confident | 35 Ų | 35 | 30.4 Ų | 30.4 | 15% | 0.154 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -121.3 | -35.8 | -168.7 | -61.5 | -89.2 | 0 | 0 | 0 | 113.8 | P322 M467 L472 D473 P474 P480 Y481 | P322-F477 HydrophobicContact CB-CD1 4.09Å; P322-F477 HydrophobicContact CG-CD1 3.88Å; P322-F477 HydrophobicContact CG-CE1 4.28Å; M467-F477 HydrophobicContact CE-CB 3.53Å; M467-F477 HydrophobicContact SD-CB 3.77Å; L472-F477 HydrophobicContact CB-CD2 4.38Å; L472-F477 HydrophobicContact CB-CE2 4.41Å; L472-F477 HydrophobicContact CD2-CE2 4.38Å; L472-F477 HydrophobicContact CD2-CZ 4.48Å; D473-F477 VanDerWaalsContact O-CD2 3.31Å; D473-F477 WeakPolarHBondContact O-CD2 3.19Å; P474-F477 PolarHBondContact O-N 3.38Å; P474-F477 VanDerWaalsContact O-N 3.13Å; F477-P480 WeakPolarHBondContact O-CD 3.43Å; F477-Y481 HydrophobicContact CB-CE2 4.11Å; F477-Y481 WeakPolarHBondContact O-CD2 3.29Å; F477-Y481 WeakPolarHBondContact O-CE2 3.27Å |
| 478 | S | 87.8 | Confident | 87.5 | Confident | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -72.1 | -44.4 | -166.7 | 68.5 | 0 | 0 | 0 | 0 | 112.8 | M463 P474 Y481 L482 | M463-S478 VanDerWaalsContact CE-CA 3.43Å; M463-S478 WeakPolarHBondContact CE-O 3.5Å; P474-S478 WeakPolarHBondContact O-CB 3.26Å; P474-S478 PolarHBondContact O-N 2.84Å; P474-S478 PolarHBondContact O-OG 2.92Å; S478-Y481 PolarHBondContact O-N 3.43Å; S478-L482 WeakPolarHBondContact O-CB 3.39Å; S478-L482 WeakPolarHBondContact O-CD1 3.36Å; S478-L482 VanDerWaalsContact O-CG 3.23Å; S478-L482 WeakPolarHBondContact O-CG 3.3Å; S478-L482 PolarHBondContact O-N 3.26Å |
| 479 | I | 87.4 | Confident | 88.1 | Confident | 16 Ų | 16 | 33.3 Ų | 33.3 | 8% | 0.082 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -59.9 | -50.5 | -176.7 | -63.7 | 171.5 | 0 | 0 | 0 | 110.5 | M151 A365 A368 Y481 L482 T483 | M151-I479 HydrophobicContact CE-CG2 4.45Å; A365-I479 HydrophobicContact CB-CG2 4.11Å; A368-I479 HydrophobicContact CB-CG1 4.36Å; I479-Y481 VanDerWaalsContact C-N 3.34Å; I479-Y481 PolarHBondContact O-N 3.37Å; I479-L482 PolarHBondContact O-N 2.82Å; I479-T483 HydrophobicContact CG2-CG2 4.01Å; I479-T483 WeakPolarHBondContact O-CG2 3.5Å; I479-T483 PolarHBondContact O-N 3.09Å; I479-T483 PolarHBondContact O-OG1 3.42Å |
| 480 | P | 90.2 | Very high | 88.7 | Confident | 4 Ų | 4 | 31.8 Ų | 31.8 | 3% | 0.026 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -54.8 | -42.1 | 178.1 | -30.1 | 37.4 | 0 | 0 | 0 | 115.7 | N148 P322 A326 F477 T483 A484 | N148-P480 HydrophobicContact CB-CB 4.34Å; N148-P480 HydrophobicContact CB-CG 4.17Å; N148-P480 VanDerWaalsContact OD1-CA 3.28Å; N148-P480 WeakPolarHBondContact OD1-CA 3.18Å; P322-P480 HydrophobicContact CB-CB 3.97Å; P322-P480 HydrophobicContact CB-CG 4.08Å; A326-P480 HydrophobicContact CB-CB 3.86Å; A326-P480 WeakPolarHBondContact CB-O 3.33Å; F477-P480 WeakPolarHBondContact O-CD 3.43Å; P480-T483 PolarHBondContact O-OG1 3.38Å; P480-T483 VanDerWaalsContact O-OG1 3.14Å; P480-A484 WeakPolarHBondContact O-CB 3.39Å; P480-A484 PolarHBondContact O-N 3.02Å |
| 481 | Y | 92.5 | Very high | 89.2 | Confident | 41 Ų | 41 | 23.7 Ų | 23.7 | 16% | 0.161 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -72 | -38.9 | 178.9 | -61.2 | -46.7 | 0 | 0 | 0 | 112.4 | P322 I325 M463 M467 F477 S478 I479 L485 | P322-Y481 HydrophobicContact CB-CE1 4.34Å; P322-Y481 HydrophobicContact CB-CE2 4.41Å; I325-Y481 HydrophobicContact CB-CE1 3.8Å; I325-Y481 HydrophobicContact CD1-CE1 4.26Å; I325-Y481 HydrophobicContact CG2-CD1 4.04Å; I325-Y481 HydrophobicContact CG2-CE1 3.58Å; M463-Y481 HydrophobicContact SD-CD2 4.07Å; M463-Y481 HydrophobicContact SD-CG 4.5Å; M467-Y481 HydrophobicContact CE-CD2 3.56Å; M467-Y481 HydrophobicContact CE-CE2 3.65Å; F477-Y481 HydrophobicContact CB-CE2 4.11Å; F477-Y481 WeakPolarHBondContact O-CD2 3.29Å; F477-Y481 WeakPolarHBondContact O-CE2 3.27Å; S478-Y481 PolarHBondContact O-N 3.43Å; I479-Y481 VanDerWaalsContact C-N 3.34Å; I479-Y481 PolarHBondContact O-N 3.37Å; Y481-L485 WeakPolarHBondContact O-CB 3.32Å; Y481-L485 PolarHBondContact O-N 3.41Å |
| 482 | L | 93.3 | Very high | 89.9 | Confident | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -70.5 | -40.6 | -177.7 | -69.4 | 162.6 | 0 | 0 | 0 | 111.8 | V364 A368 L456 I459 A460 M463 S478 I479 G486 | V364-L482 HydrophobicContact CG1-CB 3.79Å; V364-L482 HydrophobicContact CG2-CB 3.88Å; V364-L482 HydrophobicContact CG2-CD1 4.02Å; V364-L482 HydrophobicContact CG2-CD2 3.9Å; V364-L482 HydrophobicContact CG2-CG 4.11Å; A368-L482 HydrophobicContact CB-CD1 3.62Å; L456-L482 WeakPolarHBondContact CD2-O 3.36Å; I459-L482 HydrophobicContact CB-CD2 4.28Å; I459-L482 HydrophobicContact CG2-CD2 3.83Å; A460-L482 HydrophobicContact CB-CD1 3.75Å; A460-L482 HydrophobicContact CB-CD2 3.96Å; M463-L482 HydrophobicContact CE-CD1 3.64Å; M463-L482 HydrophobicContact CE-CD2 3.84Å; M463-L482 HydrophobicContact CE-CG 3.41Å; M463-L482 VanDerWaalsContact CE-CG 3.41Å; S478-L482 WeakPolarHBondContact O-CB 3.39Å; S478-L482 WeakPolarHBondContact O-CD1 3.36Å; S478-L482 VanDerWaalsContact O-CG 3.23Å; S478-L482 WeakPolarHBondContact O-CG 3.3Å; S478-L482 PolarHBondContact O-N 3.26Å; I479-L482 PolarHBondContact O-N 2.82Å; L482-G486 PolarHBondContact O-N 2.85Å |
| 483 | T | 92.3 | Very high | 90.6 | Very high | 5 Ų | 5 | 21.1 Ų | 21.1 | 3% | 0.031 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -65.9 | -46.2 | 176.3 | 52.8 | 0 | 0 | 0 | 0 | 110.9 | N148 M151 I479 P480 L485 G486 D487 | N148-T483 PolarHBondContact OD1-OG1 3.48Å; M151-T483 HydrophobicContact CE-CG2 3.86Å; I479-T483 HydrophobicContact CG2-CG2 4.01Å; I479-T483 WeakPolarHBondContact O-CG2 3.5Å; I479-T483 PolarHBondContact O-N 3.09Å; I479-T483 PolarHBondContact O-OG1 3.42Å; P480-T483 PolarHBondContact O-OG1 3.38Å; P480-T483 VanDerWaalsContact O-OG1 3.14Å; T483-L485 PolarHBondContact O-N 3.46Å; T483-G486 CarbonylContact O-C 3.56Å; T483-G486 VanDerWaalsContact O-CA 3.28Å; T483-G486 WeakPolarHBondContact O-CA 3.24Å; T483-G486 PolarHBondContact O-N 2.95Å; T483-D487 PolarHBondContact O-N 3.4Å |
| 484 | A | 94.3 | Very high | 91.4 | Very high | 0 Ų | 0 | 18.9 Ų | 18.9 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -65 | -38.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113 | A326 I329 S330 P480 G486 D487 L488 | A326-A484 HydrophobicContact CB-CB 3.78Å; A326-A484 WeakPolarHBondContact O-CB 3.27Å; I329-A484 HydrophobicContact CB-CB 3.93Å; I329-A484 HydrophobicContact CG2-CB 3.97Å; I329-A484 WeakPolarHBondContact CG2-O 3.44Å; S330-A484 WeakPolarHBondContact OG-CA 3.41Å; S330-A484 WeakPolarHBondContact OG-CB 3.26Å; P480-A484 WeakPolarHBondContact O-CB 3.39Å; P480-A484 PolarHBondContact O-N 3.02Å; A484-G486 PolarHBondContact O-N 3.29Å; A484-D487 PolarHBondContact O-N 3.41Å; A484-L488 PolarHBondContact O-N 3.44Å; A484-L488 VanDerWaalsContact O-N 3.08Å |
| 485 | L | 95.7 | Very high | 92 | Very high | 41 Ų | 41 | 19.6 Ų | 19.6 | 22% | 0.215 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -63.8 | -35.4 | 170.7 | -175.5 | 62.2 | 0 | 0 | 0 | 111.1 | L456 I459 Y481 T483 L488 L489 | L456-L485 HydrophobicContact CD2-CB 4.24Å; L456-L485 HydrophobicContact CD2-CD2 4.32Å; L456-L485 HydrophobicContact CD2-CG 4.16Å; I459-L485 HydrophobicContact CD1-CD2 3.39Å; I459-L485 HydrophobicContact CG2-CD2 4.13Å; Y481-L485 WeakPolarHBondContact O-CB 3.32Å; Y481-L485 PolarHBondContact O-N 3.41Å; T483-L485 PolarHBondContact O-N 3.46Å; L485-L488 PolarHBondContact O-N 2.89Å; L485-L489 HydrophobicContact CD1-CD1 4.04Å; L485-L489 HydrophobicContact CD1-CG 3.96Å; L485-L489 HydrophobicContact CD2-CD1 4.28Å; L485-L489 HydrophobicContact CG-CD1 3.76Å; L485-L489 HydrophobicContact CG-CG 4.11Å; L485-L489 VanDerWaalsContact O-CB 3.28Å; L485-L489 WeakPolarHBondContact O-CB 3.35Å; L485-L489 VanDerWaalsContact O-CG 3.25Å; L485-L489 WeakPolarHBondContact O-CG 3.43Å; L485-L489 PolarHBondContact O-N 2.98Å |
| 486 | G | 95.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -62.8 | -41.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q452 L482 T483 A484 G490 | Q452-G486 PolarHBondContact NE2-O 2.87Å; L482-G486 PolarHBondContact O-N 2.85Å; T483-G486 CarbonylContact O-C 3.56Å; T483-G486 VanDerWaalsContact O-CA 3.28Å; T483-G486 WeakPolarHBondContact O-CA 3.24Å; T483-G486 PolarHBondContact O-N 2.95Å; A484-G486 PolarHBondContact O-N 3.29Å; G486-G490 WeakPolarHBondContact O-CA 3.28Å; G486-G490 PolarHBondContact O-N 2.86Å |
| 487 | D | 94.9 | Very high | 93.7 | Very high | 11 Ų | 11 | 19.8 Ų | 19.8 | 6% | 0.059 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -62.7 | -47.1 | 174.9 | -63.6 | -24.9 | 0 | 0 | 0 | 111.5 | S330 N357 T483 A484 T491 | S330-D487 PolarHBondContact OG-OD2 3.41Å; N357-D487 PolarHBondContact OD1-O 3.3Å; T483-D487 PolarHBondContact O-N 3.4Å; A484-D487 PolarHBondContact O-N 3.41Å; D487-T491 VanDerWaalsContact O-CB 3.29Å; D487-T491 WeakPolarHBondContact O-CB 3.3Å; D487-T491 PolarHBondContact O-N 3.45Å; D487-T491 PolarHBondContact O-OG1 2.95Å |
| 488 | L | 96.8 | Very high | 94 | Very high | 45 Ų | 45 | 18.8 Ų | 18.8 | 24% | 0.236 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -65.9 | -49.4 | -179.8 | 176.6 | 60.9 | 0 | 0 | 0 | 111.8 | I329 V332 I336 A484 L485 G492 | I329-L488 HydrophobicContact CG2-CB 4.11Å; I329-L488 HydrophobicContact CG2-CD2 4.04Å; V332-L488 HydrophobicContact CB-CD1 4.14Å; V332-L488 HydrophobicContact CG1-CD1 3.76Å; I336-L488 HydrophobicContact CD1-CD1 3.86Å; A484-L488 PolarHBondContact O-N 3.44Å; A484-L488 VanDerWaalsContact O-N 3.08Å; L485-L488 PolarHBondContact O-N 2.89Å; L488-G492 PolarHBondContact O-N 3.23Å |
| 489 | L | 97.6 | Very high | 94.2 | Very high | 38 Ų | 38 | 22.9 Ų | 22.9 | 20% | 0.199 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -66.6 | -43.1 | 179.7 | -70.3 | 177.3 | 0 | 0 | 0 | 111.5 | Q452 I455 L456 L485 G492 L493 | Q452-L489 HydrophobicContact CG-CB 4.05Å; I455-L489 HydrophobicContact CB-CD1 4.11Å; I455-L489 HydrophobicContact CG2-CD1 3.55Å; L456-L489 HydrophobicContact CD2-CD1 4.34Å; L485-L489 HydrophobicContact CD1-CD1 4.04Å; L485-L489 HydrophobicContact CD1-CG 3.96Å; L485-L489 HydrophobicContact CD2-CD1 4.28Å; L485-L489 HydrophobicContact CG-CD1 3.76Å; L485-L489 HydrophobicContact CG-CG 4.11Å; L485-L489 VanDerWaalsContact O-CB 3.28Å; L485-L489 WeakPolarHBondContact O-CB 3.35Å; L485-L489 VanDerWaalsContact O-CG 3.25Å; L485-L489 WeakPolarHBondContact O-CG 3.43Å; L485-L489 PolarHBondContact O-N 2.98Å; L489-G492 PolarHBondContact O-N 2.95Å; L489-L493 WeakPolarHBondContact O-CB 3.4Å; L489-L493 WeakPolarHBondContact O-CG 3.47Å; L489-L493 PolarHBondContact O-N 3.25Å |
| 490 | G | 97.1 | Very high | 94.4 | Very high | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -62.2 | -51.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | N357 G486 L494 | N357-G490 VanDerWaalsContact OD1-CA 3.28Å; N357-G490 WeakPolarHBondContact OD1-CA 3.27Å; G486-G490 WeakPolarHBondContact O-CA 3.28Å; G486-G490 PolarHBondContact O-N 2.86Å; G490-L494 WeakPolarHBondContact O-CB 3.41Å; G490-L494 PolarHBondContact O-N 3.39Å |
| 491 | T | 96.5 | Very high | 94.3 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -62.9 | -44.8 | 177.4 | -45.6 | 0 | 0 | 0 | 0 | 111.7 | G333 I336 L337 T353 N357 D487 A495 | G333-T491 WeakPolarHBondContact O-CG2 3.27Å; I336-T491 HydrophobicContact CB-CG2 4.06Å; I336-T491 HydrophobicContact CG2-CG2 3.99Å; L337-T491 HydrophobicContact CB-CG2 4.01Å; T353-T491 HydrophobicContact CG2-CG2 4.19Å; N357-T491 PolarHBondContact ND2-OG1 3.44Å; N357-T491 PolarHBondContact OD1-N 3.25Å; N357-T491 VanDerWaalsContact OD1-N 3.11Å; N357-T491 PolarHBondContact OD1-OG1 3.42Å; D487-T491 VanDerWaalsContact O-CB 3.29Å; D487-T491 WeakPolarHBondContact O-CB 3.3Å; D487-T491 PolarHBondContact O-N 3.45Å; D487-T491 PolarHBondContact O-OG1 2.95Å; T491-A495 VanDerWaalsContact O-CB 3.28Å; T491-A495 WeakPolarHBondContact O-CB 3.43Å; T491-A495 PolarHBondContact O-N 3.17Å |
| 492 | G | 97.1 | Very high | 93.9 | Very high | 23 Ų | 23 | 27.8 Ų | 27.8 | 24% | 0.237 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -66.2 | -43.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | L488 L489 A495 L496 | L488-G492 PolarHBondContact O-N 3.23Å; L489-G492 PolarHBondContact O-N 2.95Å; G492-A495 PolarHBondContact O-N 3Å; G492-L496 PolarHBondContact O-N 3.38Å |
| 493 | L | 97.5 | Very high | 93.7 | Very high | 29 Ų | 29 | 33 Ų | 33 | 15% | 0.152 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -71.6 | -35.8 | 178.2 | -69.4 | 172.6 | 0 | 0 | 0 | 112 | A448 L451 Q452 L489 L496 S497 | A448-L493 HydrophobicContact CB-CB 3.89Å; L451-L493 HydrophobicContact CB-CD1 4.18Å; L451-L493 HydrophobicContact CD2-CD1 4.17Å; L451-L493 HydrophobicContact CD2-CD2 3.77Å; L451-L493 HydrophobicContact CG-CD1 4.05Å; Q452-L493 HydrophobicContact CB-CD1 3.94Å; L489-L493 WeakPolarHBondContact O-CB 3.4Å; L489-L493 WeakPolarHBondContact O-CG 3.47Å; L489-L493 PolarHBondContact O-N 3.25Å; L493-L496 PolarHBondContact O-N 2.87Å; L493-S497 WeakPolarHBondContact O-CB 3.25Å; L493-S497 PolarHBondContact O-N 3.14Å; L493-S497 PolarHBondContact O-OG 3.08Å |
| 494 | L | 95.7 | Very high | 93.3 | Very high | 1 Ų | 1 | 37.5 Ų | 37.5 | 1% | 0.005 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.1 | -45.9 | 171.9 | -174.5 | 63 | 0 | 0 | 0 | 110.5 | M349 F352 I356 Y445 G490 L496 S497 F498 | M349-L494 HydrophobicContact CG-CD2 3.61Å; M349-L494 HydrophobicContact CG-CG 3.93Å; M349-L494 HydrophobicContact SD-CD2 4.48Å; M349-L494 HydrophobicContact SD-CG 4.44Å; F352-L494 HydrophobicContact CB-CD1 4.29Å; F352-L494 HydrophobicContact CB-CD2 3.74Å; I356-L494 HydrophobicContact CD1-CB 4.32Å; I356-L494 HydrophobicContact CG2-CB 4.43Å; I356-L494 HydrophobicContact CG2-CD2 3.98Å; Y445-L494 HydrophobicContact CD2-CD1 3.66Å; Y445-L494 HydrophobicContact CE2-CD1 4.02Å; G490-L494 WeakPolarHBondContact O-CB 3.41Å; G490-L494 PolarHBondContact O-N 3.39Å; L494-L496 PolarHBondContact O-N 3.12Å; L494-S497 WeakPolarHBondContact O-CB 3.35Å; L494-S497 PolarHBondContact O-N 3.15Å; L494-F498 HydrophobicContact CD1-CD2 3.99Å; L494-F498 HydrophobicContact CD1-CE2 3.78Å; L494-F498 HydrophobicContact CG-CD2 4.08Å; L494-F498 HydrophobicContact CG-CE2 4.07Å; L494-F498 WeakPolarHBondContact O-CD2 3.42Å; L494-F498 PolarHBondContact O-N 3.46Å |
| 495 | A | 94.8 | Very high | 92.3 | Very high | 14 Ų | 14 | 39.5 Ų | 39.5 | 12% | 0.116 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -58.8 | -44.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | I336 T340 M349 T491 G492 S497 F498 H499 | I336-A495 HydrophobicContact CG2-CB 3.73Å; T340-A495 HydrophobicContact CG2-CB 3.71Å; M349-A495 VanDerWaalsContact CE-CA 3.42Å; M349-A495 HydrophobicContact CE-CB 3.86Å; M349-A495 HydrophobicContact SD-CB 4.03Å; T491-A495 VanDerWaalsContact O-CB 3.28Å; T491-A495 WeakPolarHBondContact O-CB 3.43Å; T491-A495 PolarHBondContact O-N 3.17Å; G492-A495 PolarHBondContact O-N 3Å; A495-S497 VanDerWaalsContact C-N 3.28Å; A495-S497 PolarHBondContact O-N 3.4Å; A495-F498 PolarHBondContact O-N 2.81Å; A495-H499 WeakPolarHBondContact O-CB 3.5Å; A495-H499 PolarHBondContact O-N 3.31Å |
| 496 | L | 94.4 | Very high | 90.8 | Very high | 101 Ų | 101 | 39.6 Ų | 39.6 | 53% | 0.529 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -61 | -39.5 | 174.2 | -178.4 | 62.2 | 0 | 0 | 0 | 111.8 | G492 L493 L494 H499 V500 | G492-L496 PolarHBondContact O-N 3.38Å; L493-L496 PolarHBondContact O-N 2.87Å; L494-L496 PolarHBondContact O-N 3.12Å; L496-H499 PolarHBondContact O-N 2.97Å; L496-V500 HydrophobicContact CD1-CG2 4.21Å; L496-V500 HydrophobicContact CG-CG2 4.46Å; L496-V500 VanDerWaalsContact O-CG2 3.29Å; L496-V500 WeakPolarHBondContact O-CG2 3.38Å; L496-V500 PolarHBondContact O-N 3.3Å |
| 497 | S | 92.7 | Very high | 89 | Confident | 12 Ų | 12 | 48.7 Ų | 48.7 | 8% | 0.084 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.9 | -48.3 | 178.7 | -60.8 | 0 | 0 | 0 | 0 | 111.7 | A448 L493 L494 A495 H499 V500 L501 | A448-S497 WeakPolarHBondContact CB-OG 3.4Å; L493-S497 WeakPolarHBondContact O-CB 3.25Å; L493-S497 PolarHBondContact O-N 3.14Å; L493-S497 PolarHBondContact O-OG 3.08Å; L494-S497 WeakPolarHBondContact O-CB 3.35Å; L494-S497 PolarHBondContact O-N 3.15Å; A495-S497 VanDerWaalsContact C-N 3.28Å; A495-S497 PolarHBondContact O-N 3.4Å; S497-H499 VanDerWaalsContact C-N 3.34Å; S497-H499 PolarHBondContact O-N 2.63Å; S497-V500 PolarHBondContact O-N 3.27Å; S497-L501 WeakPolarHBondContact O-CB 3.14Å; S497-L501 VanDerWaalsContact O-CG 3.24Å; S497-L501 WeakPolarHBondContact O-CG 3.26Å; S497-L501 PolarHBondContact O-N 3.28Å |
| 498 | F | 90.8 | Very high | 87 | Confident | 14 Ų | 14 | 50.6 Ų | 50.6 | 6% | 0.061 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -60.4 | -42.6 | 174.7 | -91.2 | -92.4 | 0 | 0 | 0 | 112.2 | F346 M349 F352 T435 F441 L494 A495 V500 L501 W502 | F346-F498 HydrophobicContact CD1-CB 3.71Å; F346-F498 HydrophobicContact CD1-CD1 4.14Å; F346-F498 HydrophobicContact CD1-CG 4.38Å; F346-F498 HydrophobicContact CE1-CB 4.18Å; F346-F498 WeakPolarHBondContact CE1-O 3.46Å; F346-F498 HydrophobicContact CG-CB 4.49Å; M349-F498 HydrophobicContact CB-CD2 4.44Å; M349-F498 HydrophobicContact CB-CE2 4.22Å; M349-F498 HydrophobicContact CB-CZ 4.4Å; M349-F498 HydrophobicContact CE-CB 3.89Å; M349-F498 HydrophobicContact CE-CD2 3.97Å; M349-F498 HydrophobicContact CE-CG 3.99Å; M349-F498 HydrophobicContact CG-CD2 4.39Å; M349-F498 HydrophobicContact CG-CE2 4.34Å; F352-F498 HydrophobicContact CD2-CE2 4.11Å; F352-F498 AromaticContact CD2-CZ 3.82Å; F352-F498 HydrophobicContact CD2-CZ 3.82Å; F352-F498 HydrophobicContact CE2-CZ 4.09Å; T435-F498 HydrophobicContact CG2-CE1 4.13Å; F441-F498 HydrophobicContact CE2-CD2 4.42Å; F441-F498 HydrophobicContact CE2-CE1 4.19Å; F441-F498 AromaticContact CE2-CE2 3.67Å; F441-F498 HydrophobicContact CE2-CE2 3.67Å; F441-F498 AromaticContact CE2-CZ 3.54Å; F441-F498 HydrophobicContact CE2-CZ 3.54Å; F441-F498 HydrophobicContact CZ-CE2 4.2Å; F441-F498 HydrophobicContact CZ-CZ 4.11Å; L494-F498 HydrophobicContact CD1-CD2 3.99Å; L494-F498 HydrophobicContact CD1-CE2 3.78Å; L494-F498 HydrophobicContact CG-CD2 4.08Å; L494-F498 HydrophobicContact CG-CE2 4.07Å; L494-F498 WeakPolarHBondContact O-CD2 3.42Å; L494-F498 PolarHBondContact O-N 3.46Å; A495-F498 PolarHBondContact O-N 2.81Å; F498-V500 PolarHBondContact O-N 3.46Å; F498-L501 PolarHBondContact O-N 2.97Å; F498-W502 WeakPolarHBondContact O-CB 3.44Å; F498-W502 PolarHBondContact O-N 3.12Å |
| 499 | H | 91.1 | Very high | 84.6 | Confident | 86 Ų | 86 | 51.1 Ų | 51.1 | 40% | 0.398 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63 | -43 | 177.6 | -169.8 | 69.3 | 0 | 0 | 0 | 112.4 | F346 A495 L496 S497 W502 L503 | F346-H499 AromaticContact CZ-ND1 3.94Å; A495-H499 WeakPolarHBondContact O-CB 3.5Å; A495-H499 PolarHBondContact O-N 3.31Å; L496-H499 PolarHBondContact O-N 2.97Å; S497-H499 VanDerWaalsContact C-N 3.34Å; S497-H499 PolarHBondContact O-N 2.63Å; H499-W502 PolarHBondContact O-N 3.5Å; H499-L503 WeakPolarHBondContact O-CG 3.45Å; H499-L503 PolarHBondContact O-N 3.47Å |
| 500 | V | 90.7 | Very high | 82 | Confident | 42 Ų | 42 | 56.6 Ų | 56.6 | 26% | 0.255 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -67.2 | -40.8 | 177.1 | 172.5 | 0 | 0 | 0 | 0 | 111.5 | F444 L496 S497 F498 W502 L503 I504 | F444-V500 HydrophobicContact CD1-CG1 4.32Å; F444-V500 HydrophobicContact CE1-CB 4.26Å; F444-V500 HydrophobicContact CE1-CG1 3.5Å; F444-V500 VanDerWaalsContact CE1-CG1 3.5Å; F444-V500 HydrophobicContact CZ-CG1 3.7Å; L496-V500 HydrophobicContact CD1-CG2 4.21Å; L496-V500 HydrophobicContact CG-CG2 4.46Å; L496-V500 VanDerWaalsContact O-CG2 3.29Å; L496-V500 WeakPolarHBondContact O-CG2 3.38Å; L496-V500 PolarHBondContact O-N 3.3Å; S497-V500 PolarHBondContact O-N 3.27Å; F498-V500 PolarHBondContact O-N 3.46Å; V500-W502 VanDerWaalsContact C-N 3.33Å; V500-W502 PolarHBondContact O-N 3Å; V500-L503 PolarHBondContact O-N 3.31Å; V500-I504 HydrophobicContact CG1-CD1 3.67Å; V500-I504 HydrophobicContact CG1-CG1 4.33Å; V500-I504 VanDerWaalsContact O-CG1 3.32Å; V500-I504 WeakPolarHBondContact O-CG1 3.28Å; V500-I504 PolarHBondContact O-N 2.98Å |
| 501 | L | 88.4 | Confident | 79.1 | Confident | 9 Ų | 9 | 60.8 Ų | 60.8 | 5% | 0.047 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -59.7 | -44.3 | 175.3 | -74.8 | 166.5 | 0 | 0 | 0 | 111.8 | I440 F441 F444 S497 F498 L503 I504 G505 D506 | I440-L501 HydrophobicContact CB-CD2 4.37Å; I440-L501 HydrophobicContact CG2-CD2 3.58Å; F441-L501 HydrophobicContact CB-CD1 4.32Å; F441-L501 HydrophobicContact CD2-CD1 3.57Å; F441-L501 HydrophobicContact CE2-CD1 4.34Å; F441-L501 HydrophobicContact CG-CD1 4.39Å; F444-L501 HydrophobicContact CB-CD1 4.29Å; F444-L501 HydrophobicContact CB-CD2 4.43Å; F444-L501 HydrophobicContact CB-CG 4.33Å; F444-L501 HydrophobicContact CD2-CD2 3.55Å; F444-L501 HydrophobicContact CD2-CG 4.09Å; F444-L501 HydrophobicContact CE2-CD2 4.09Å; F444-L501 HydrophobicContact CG-CD2 4.19Å; F444-L501 HydrophobicContact CG-CG 4.26Å; S497-L501 WeakPolarHBondContact O-CB 3.14Å; S497-L501 VanDerWaalsContact O-CG 3.24Å; S497-L501 WeakPolarHBondContact O-CG 3.26Å; S497-L501 PolarHBondContact O-N 3.28Å; F498-L501 PolarHBondContact O-N 2.97Å; L501-L503 VanDerWaalsContact C-N 3.33Å; L501-L503 PolarHBondContact O-N 3.05Å; L501-I504 PolarHBondContact O-N 3.3Å; L501-G505 PolarHBondContact O-N 2.98Å; L501-D506 HydrophobicContact CD2-CB 4.45Å; L501-D506 PolarHBondContact O-N 3.26Å |
| 502 | W | 85.7 | Confident | 75.9 | Confident | 113 Ų | 113 | 63.8 Ų | 63.8 | 43% | 0.428 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -60.8 | -40.8 | 174.9 | -178.8 | 87.4 | 0 | 0 | 0 | 112.3 | N345 F346 F498 H499 V500 G505 | N345-W502 PolarHBondContact OD1-NE1 3.15Å; F346-W502 HydrophobicContact CE1-CB 3.78Å; F346-W502 HydrophobicContact CE1-CG 4.18Å; F346-W502 HydrophobicContact CZ-CB 4.22Å; F346-W502 HydrophobicContact CZ-CG 4.28Å; F498-W502 WeakPolarHBondContact O-CB 3.44Å; F498-W502 PolarHBondContact O-N 3.12Å; H499-W502 PolarHBondContact O-N 3.5Å; V500-W502 VanDerWaalsContact C-N 3.33Å; V500-W502 PolarHBondContact O-N 3Å; W502-G505 PolarHBondContact O-N 3.02Å |
| 503 | L | 87.4 | Confident | 72.7 | Confident | 109 Ų | 109 | 74.2 Ų | 74.2 | 57% | 0.571 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -67.1 | -35.3 | 175.8 | -71.7 | 173.8 | 0 | 0 | 0 | 113.5 | H499 V500 L501 G505 | H499-L503 WeakPolarHBondContact O-CG 3.45Å; H499-L503 PolarHBondContact O-N 3.47Å; V500-L503 PolarHBondContact O-N 3.31Å; L501-L503 VanDerWaalsContact C-N 3.33Å; L501-L503 PolarHBondContact O-N 3.05Å; L503-G505 PolarHBondContact O-N 2.76Å |
| 504 | I | 84.7 | Confident | 71.4 | Confident | 100 Ų | 100 | 76.5 Ų | 76.5 | 51% | 0.513 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -71.9 | -18.2 | 177.9 | -69.1 | 168.3 | 0 | 0 | 0 | 111.3 | F444 V500 L501 | F444-I504 HydrophobicContact CE2-CD1 3.83Å; F444-I504 HydrophobicContact CZ-CD1 3.6Å; V500-I504 HydrophobicContact CG1-CD1 3.67Å; V500-I504 HydrophobicContact CG1-CG1 4.33Å; V500-I504 VanDerWaalsContact O-CG1 3.32Å; V500-I504 WeakPolarHBondContact O-CG1 3.28Å; V500-I504 PolarHBondContact O-N 2.98Å; L501-I504 PolarHBondContact O-N 3.3Å |
| 505 | G | 73.1 | Confident | 70.2 | Confident | 41 Ų | 41 | 80.4 Ų | 80.4 | 42% | 0.423 | 44% | 0.436 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.2 | 20.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | L501 W502 L503 R507 | L501-G505 PolarHBondContact O-N 2.98Å; W502-G505 PolarHBondContact O-N 3.02Å; L503-G505 PolarHBondContact O-N 2.76Å; G505-R507 PolarHBondContact O-N 3.13Å |
| 506 | D | 65.3 | Low | 68.8 | Low | 43 Ų | 43 | 84.1 Ų | 84.1 | 23% | 0.23 | 45% | 0.454 | C | S | . | . | trans | -70.5 | 69.4 | 159 | -157.1 | 31.6 | 0 | 0 | 0 | 106.9 | T438 L501 D508 | T438-D506 PolarHBondContact OG1-OD2 3.27Å; L501-D506 HydrophobicContact CD2-CB 4.45Å; L501-D506 PolarHBondContact O-N 3.26Å; D506-D508 PolarHBondContact O-N 2.66Å | ||
| 507 | R | 57.5 | Low | 67.3 | Low | 192 Ų | 192 | 83.1 Ų | 83.1 | 73% | 0.725 | 45% | 0.449 | S | S | * | . | trans | -79.8 | 60.6 | -177.5 | -66.1 | -178.5 | 177.7 | 168.2 | -1.4 | 108.6 | G505 T509 | G505-R507 PolarHBondContact O-N 3.13Å; R507-T509 PolarHBondContact O-N 3.12Å | ||
| 508 | D | 52.5 | Low | 65.7 | Low | 50 Ų | 50 | 87.6 Ų | 87.6 | 27% | 0.267 | 47% | 0.472 | S | S | . | . | trans | -69.9 | 68.8 | 158.9 | -85.6 | -62.8 | 0 | 0 | 0 | 108.7 | T436 T438 D506 | T436-D508 PolarHBondContact OG1-OD1 3.26Å; T436-D508 PolarHBondContact OG1-OD2 3.13Å; T438-D508 WeakPolarHBondContact CG2-OD2 3.45Å; D506-D508 PolarHBondContact O-N 2.66Å | ||
| 509 | T | 46.6 | Very low | 64 | Low | 57 Ų | 57 | 92.5 Ų | 92.5 | 35% | 0.35 | 50% | 0.5 | S | S | . | . | trans | -109.1 | 46.1 | 160.9 | 55.8 | 0 | 0 | 0 | 0 | 107.6 | R507 V511 G512 | R507-T509 PolarHBondContact O-N 3.12Å; T509-V511 PolarHBondContact O-N 3.23Å; T509-G512 PolarHBondContact O-N 3.01Å | ||
| 510 | D | 43 | Very low | 62.1 | Low | 153 Ų | 153 | 92.9 Ų | 92.9 | 82% | 0.818 | 51% | 0.507 | S | S | * | . | trans | -71.9 | 33.2 | 160.3 | -110.5 | 12.4 | 0 | 0 | 0 | 111.2 | ||||
| 511 | V | 35.4 | Very low | 59.9 | Low | 87 Ų | 87 | 96.8 Ų | 96.8 | 53% | 0.527 | 53% | 0.526 | S | S | . | . | trans | -133 | 65.7 | 162.3 | -81.2 | 0 | 0 | 0 | 0 | 106 | H434 T509 | H434-V511 HydrophobicContact CB-CG1 3.95Å; H434-V511 HydrophobicContact CB-CG2 4.24Å; T509-V511 PolarHBondContact O-N 3.23Å | ||
| 512 | G | 28.9 | Very low | 57.5 | Low | 63 Ų | 63 | 104.2 Ų | 104.2 | 65% | 0.649 | 57% | 0.566 | S | S | * | * | trans | -156.2 | 29.2 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112 | T509 | T509-G512 PolarHBondContact O-N 3.01Š| ||
| 513 | D | 29.9 | Very low | 54.9 | Low | 242 Ų | 242 | 103.4 Ų | 103.4 | 100% | 1.294 | 58% | 0.579 | S | S | * | * | trans | -136.8 | 0 | 158 | -91.7 | -22.9 | 0 | 0 | 0 | 108.7 |
Retrieved 513 of 513 residues in 4094.1 ms
(Link to these results)