| 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 | 34.3 | Very low | 29.6 | Very low | 233 Ų | 233 | 151.8 Ų | 151.8 | 100% | 1.148 | 86% | 0.856 | S | S | * | * | 0 | 75.1 | 0 | -69.6 | 172.2 | 170.8 | 0 | 0 | 105.8 | |||||
| 2 | T | 31 | Very low | 29.4 | Very low | 119 Ų | 119 | 153.3 Ų | 153.3 | 73% | 0.73 | 86% | 0.86 | S | S | * | * | 72.2 | 101.4 | 106.7 | 46 | 0 | 0 | 0 | 0 | 111 | |||||
| 3 | E | 32.3 | Very low | 29.3 | Very low | 196 Ų | 196 | 154.8 Ų | 154.8 | 92% | 0.916 | 85% | 0.852 | S | S | * | * | 62.7 | 133.2 | 96.5 | -73.8 | -177.7 | 146.8 | 0 | 0 | 111.5 | |||||
| 4 | G | 26.8 | Very low | 29.2 | Very low | 72 Ų | 72 | 152.1 Ų | 152.1 | 74% | 0.742 | 84% | 0.836 | S | S | * | * | cis | 131.6 | 148.4 | 30.9 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 5 | N | 27.8 | Very low | 29.1 | Very low | 171 Ų | 171 | 149.7 Ų | 149.7 | 91% | 0.914 | 83% | 0.827 | S | S | * | * | trans | 92.2 | 129.1 | 160.6 | -78.7 | -2 | 0 | 0 | 0 | 124.6 | ||||
| 6 | N | 31.8 | Very low | 29 | Very low | 154 Ų | 154 | 148.4 Ų | 148.4 | 82% | 0.824 | 83% | 0.825 | S | S | * | * | trans | -63.4 | 154.7 | 153.9 | -74.8 | -28.1 | 0 | 0 | 0 | 112.8 | ||||
| 7 | V | 30.7 | Very low | 28.8 | Very low | 145 Ų | 145 | 145.9 Ų | 145.9 | 88% | 0.879 | 83% | 0.829 | S | S | * | * | trans | -152.5 | 140.5 | 143.2 | 177.3 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 8 | T | 29.4 | Very low | 28.5 | Very low | 122 Ų | 122 | 141.6 Ų | 141.6 | 75% | 0.748 | 82% | 0.821 | S | S | * | * | trans | -98.5 | 178.3 | 175 | 36.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 9 | E | 29.4 | Very low | 28.4 | Very low | 184 Ų | 184 | 143 Ų | 143 | 86% | 0.86 | 83% | 0.825 | S | S | * | * | trans | 94.5 | 139.5 | 167.2 | -62.9 | -173.7 | 150.8 | 0 | 0 | 115.6 | ||||
| 10 | S | 25.7 | Very low | 28.4 | Very low | 117 Ų | 117 | 142.2 Ų | 142.2 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | cis | -164.7 | 162.7 | 36.4 | 32.1 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 11 | D | 26.9 | Very low | 28.6 | Very low | 157 Ų | 157 | 141.5 Ų | 141.5 | 84% | 0.84 | 82% | 0.823 | S | S | * | * | trans | -54.2 | 160.2 | 174.8 | -70 | -55.2 | 0 | 0 | 0 | 117.5 | ||||
| 12 | N | 26.3 | Very low | 28.3 | Very low | 169 Ų | 169 | 134.6 Ų | 134.6 | 90% | 0.904 | 80% | 0.803 | S | S | * | * | trans | -149.5 | 126.7 | 132.8 | -133.4 | 1.5 | 0 | 0 | 0 | 113.7 | ||||
| 13 | K | 28 | Very low | 28 | Very low | 173 Ų | 173 | 138.8 Ų | 138.8 | 75% | 0.752 | 81% | 0.814 | S | S | * | * | trans | -75.2 | 171.4 | 164.4 | -99.4 | 173.4 | 170.6 | -179 | 0 | 109.7 | ||||
| 14 | D | 28.8 | Very low | 27.7 | Very low | 117 Ų | 117 | 138.4 Ų | 138.4 | 63% | 0.626 | 81% | 0.812 | S | S | * | * | cis | -172.5 | 158.4 | 26.3 | -116.5 | -23.3 | 0 | 0 | 0 | 109.8 | ||||
| 15 | T | 27.7 | Very low | 27.6 | Very low | 116 Ų | 116 | 144 Ų | 144 | 71% | 0.712 | 82% | 0.816 | S | S | * | * | trans | 57.7 | 152.2 | 141.3 | 59.7 | 0 | 0 | 0 | 0 | 123 | ||||
| 16 | T | 26.7 | Very low | 27.4 | Very low | 129 Ų | 129 | 142.8 Ų | 142.8 | 79% | 0.791 | 81% | 0.81 | S | S | * | * | cis | -172.4 | 155.6 | -3.1 | 20.3 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 17 | A | 26.5 | Very low | 27.2 | Very low | 107 Ų | 107 | 140 Ų | 140 | 88% | 0.884 | 81% | 0.808 | S | S | * | * | trans | 74.3 | 134.6 | 143.7 | 0 | 0 | 0 | 0 | 0 | 124 | ||||
| 18 | G | 23.1 | Very low | 26.9 | Very low | 67 Ų | 67 | 142.7 Ų | 142.7 | 69% | 0.691 | 81% | 0.811 | S | S | * | * | trans | 146.1 | 108.2 | 147.9 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 19 | D | 26.3 | Very low | 26.7 | Very low | 169 Ų | 169 | 145.5 Ų | 145.5 | 90% | 0.904 | 82% | 0.815 | S | S | * | * | trans | 94.7 | 121.3 | 142.7 | -57.5 | -19.4 | 0 | 0 | 0 | 124.7 | ||||
| 20 | V | 28.7 | Very low | 26.5 | Very low | 126 Ų | 126 | 144 Ų | 144 | 76% | 0.764 | 81% | 0.809 | S | S | * | * | trans | -99.4 | 161.1 | 160.9 | -166.2 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 21 | P | 32.8 | Very low | 26.4 | Very low | 129 Ų | 129 | 146.1 Ų | 146.1 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | -144.2 | 158.7 | 91.4 | 28 | -6.8 | 0 | 0 | 0 | 115.7 | |||||
| 22 | A | 26.7 | Very low | 26.3 | Very low | 88 Ų | 88 | 148.2 Ų | 148.2 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | trans | -80.9 | 156.3 | 169.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 23 | E | 24.6 | Very low | 26.2 | Very low | 206 Ų | 206 | 149.7 Ų | 149.7 | 96% | 0.963 | 81% | 0.806 | S | S | * | * | trans | -125.8 | 125.5 | 156.9 | -99.7 | -174.5 | 160.9 | 0 | 0 | 109.9 | ||||
| 24 | E | 26.2 | Very low | 26 | Very low | 188 Ų | 188 | 149.8 Ų | 149.8 | 88% | 0.879 | 82% | 0.815 | S | S | * | * | trans | -123.9 | 142.2 | 174.8 | -142.7 | -177.3 | -161.6 | 0 | 0 | 106.8 | ||||
| 25 | K | 26 | Very low | 25.8 | Very low | 190 Ų | 190 | 147.6 Ų | 147.6 | 83% | 0.826 | 82% | 0.82 | S | S | * | * | trans | 165.4 | 138.5 | 157 | -94.9 | 175.8 | -177.2 | -177.7 | 0 | 107.4 | ||||
| 26 | N | 23.7 | Very low | 25.7 | Very low | 146 Ų | 146 | 151.4 Ų | 151.4 | 78% | 0.781 | 83% | 0.83 | S | S | * | * | cis | -160.9 | 154.1 | 6.2 | -110 | -16.3 | 0 | 0 | 0 | 107.9 | ||||
| 27 | A | 27 | Very low | 25.6 | Very low | 94 Ų | 94 | 151.7 Ų | 151.7 | 78% | 0.777 | 84% | 0.836 | S | S | * | * | trans | -87 | 150.9 | 167.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 28 | E | 25.4 | Very low | 25.6 | Very low | 202 Ų | 202 | 156.1 Ų | 156.1 | 94% | 0.944 | 84% | 0.835 | S | S | * | * | trans | -150.8 | 130 | 151.9 | -112.6 | 172.7 | -162.7 | 0 | 0 | 110.3 | ||||
| 29 | E | 24.9 | Very low | 25.7 | Very low | 181 Ų | 181 | 158.7 Ų | 158.7 | 85% | 0.846 | 84% | 0.837 | S | S | * | * | trans | -84.6 | 146.6 | 175.3 | -67.4 | 174.2 | 129.9 | 0 | 0 | 111.1 | ||||
| 30 | E | 24.4 | Very low | 25.7 | Very low | 154 Ų | 154 | 158.2 Ų | 158.2 | 72% | 0.72 | 83% | 0.834 | S | S | * | * | 167.7 | 137.1 | 114.5 | -91.6 | -150.7 | 144.8 | 0 | 0 | 114.7 | |||||
| 31 | K | 24.5 | Very low | 25.7 | Very low | 160 Ų | 160 | 159.8 Ų | 159.8 | 70% | 0.696 | 84% | 0.837 | S | S | * | * | trans | 67.7 | 107.5 | 142.8 | -75.3 | 178.8 | -177.8 | 123.7 | 0 | 123.4 | ||||
| 32 | K | 23.9 | Very low | 25.5 | Very low | 202 Ų | 202 | 160 Ų | 160 | 88% | 0.878 | 84% | 0.836 | S | S | * | * | 33.5 | 118.6 | 122.8 | -73.8 | -177 | 174.4 | 179.1 | 0 | 119.1 | |||||
| 33 | E | 24.7 | Very low | 25.6 | Very low | 200 Ų | 200 | 164.3 Ų | 164.3 | 94% | 0.935 | 84% | 0.841 | S | S | * | * | -157.8 | 141.8 | 114.8 | -119.3 | 175.1 | 177.9 | 0 | 0 | 112.3 | |||||
| 34 | N | 23.8 | Very low | 25.8 | Very low | 175 Ų | 175 | 163.9 Ų | 163.9 | 94% | 0.936 | 84% | 0.836 | S | S | * | * | trans | -74.6 | 144.1 | -178.5 | -104.9 | -15.1 | 0 | 0 | 0 | 111.3 | ||||
| 35 | G | 24 | Very low | 26.1 | Very low | 71 Ų | 71 | 159.2 Ų | 159.2 | 73% | 0.732 | 83% | 0.83 | S | S | * | * | trans | 173.7 | 85.8 | 164.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 36 | E | 25.6 | Very low | 26.3 | Very low | 196 Ų | 196 | 155 Ų | 155 | 92% | 0.916 | 82% | 0.824 | S | S | * | * | trans | 33.3 | 115 | 150.1 | -59.1 | -176.8 | 137.6 | 0 | 0 | 120.4 | ||||
| 37 | C | 24.3 | Very low | 26.8 | Very low | 135 Ų | 135 | 153.4 Ų | 153.4 | 91% | 0.912 | 82% | 0.822 | S | S | * | * | -161.5 | 133.2 | 119.9 | -148.9 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 38 | K | 27.2 | Very low | 27.2 | Very low | 200 Ų | 200 | 154.8 Ų | 154.8 | 87% | 0.87 | 82% | 0.823 | S | S | * | * | trans | -66.6 | 138.1 | -176.6 | -80.8 | 169.1 | 172.8 | 170 | 0 | 112.3 | D40 | K38-D40 PolarHBondContact O-N 3.29Š| ||
| 39 | V | 25.6 | Very low | 28 | Very low | 121 Ų | 121 | 149.7 Ų | 149.7 | 73% | 0.733 | 82% | 0.815 | S | S | * | * | trans | -33.7 | 113.2 | 166.2 | -172.7 | 0 | 0 | 0 | 0 | 114.3 | L41 | V39-L41 HydrophobicContact CG1-CD2 4.31Å; V39-L41 HydrophobicContact CG1-CG 4.18Å | ||
| 40 | D | 25.3 | Very low | 28.8 | Very low | 158 Ų | 158 | 145.5 Ų | 145.5 | 85% | 0.845 | 81% | 0.812 | S | S | * | * | trans | -97 | 117.1 | 149.8 | -84.8 | -36.9 | 0 | 0 | 0 | 108.2 | K38 V42 | K38-D40 PolarHBondContact O-N 3.29Å; D40-V42 PolarHBondContact O-N 3.44Å; D40-V42 VanDerWaalsContact O-N 3.09Å | ||
| 41 | L | 28.1 | Very low | 29.5 | Very low | 159 Ų | 159 | 142.5 Ų | 142.5 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | trans | -66.6 | 104.8 | 175.8 | -73 | 161.1 | 0 | 0 | 0 | 108.5 | V39 E43 | V39-L41 HydrophobicContact CG1-CD2 4.31Å; V39-L41 HydrophobicContact CG1-CG 4.18Å; L41-E43 PolarHBondContact O-N 3.4Å | ||
| 42 | V | 29.3 | Very low | 30.6 | Very low | 135 Ų | 135 | 143.9 Ų | 143.9 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | trans | -58.3 | 107.6 | 164.8 | 174.9 | 0 | 0 | 0 | 0 | 107.8 | D40 K44 | D40-V42 PolarHBondContact O-N 3.44Å; D40-V42 VanDerWaalsContact O-N 3.09Å; V42-K44 PolarHBondContact O-N 3.26Å | ||
| 43 | E | 29.6 | Very low | 31.9 | Very low | 178 Ų | 178 | 141 Ų | 141 | 83% | 0.832 | 82% | 0.821 | S | S | * | * | trans | -53.6 | 110 | 165.7 | -172 | 173.3 | 179.4 | 0 | 0 | 107.7 | L41 A45 | L41-E43 PolarHBondContact O-N 3.4Å; E43-A45 VanDerWaalsContact C-N 3.27Å; E43-A45 PolarHBondContact O-N 3.24Å | ||
| 44 | K | 27.9 | Very low | 33.8 | Very low | 197 Ų | 197 | 138 Ų | 138 | 86% | 0.857 | 81% | 0.807 | S | S | * | * | trans | -65.5 | 92.3 | 178.1 | -162.7 | 178.4 | -170.6 | 177.5 | 0 | 107.4 | V42 S46 | V42-K44 PolarHBondContact O-N 3.26Å; K44-S46 PolarHBondContact O-N 2.78Å | ||
| 45 | A | 32.1 | Very low | 36.4 | Very low | 89 Ų | 89 | 132.6 Ų | 132.6 | 74% | 0.736 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 116 | 175.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | E43 | E43-A45 VanDerWaalsContact C-N 3.27Å; E43-A45 PolarHBondContact O-N 3.24Å |
| 46 | S | 31.1 | Very low | 39.2 | Very low | 101 Ų | 101 | 135.1 Ų | 135.1 | 71% | 0.706 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -50.9 | 135.9 | 167.5 | -36.9 | 0 | 0 | 0 | 0 | 108.4 | K44 | K44-S46 PolarHBondContact O-N 2.78Š|
| 47 | P | 34.1 | Very low | 42.1 | Very low | 113 Ų | 113 | 127.4 Ų | 127.4 | 73% | 0.734 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 143 | 170.9 | 24.1 | -31 | 0 | 0 | 0 | 108.8 | A49 | P47-A49 PolarHBondContact O-N 2.87Å; P47-A49 VanDerWaalsContact O-N 3.08Å |
| 48 | P | 36 | Very low | 45.1 | Very low | 124 Ų | 124 | 124.3 Ų | 124.3 | 81% | 0.805 | 72% | 0.718 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 122.9 | -178.3 | 21.4 | -30.3 | 0 | 0 | 0 | 108.4 | A50 | P48-A50 PolarHBondContact O-N 3.2Š|
| 49 | A | 41.4 | Very low | 47.8 | Very low | 95 Ų | 95 | 116.3 Ų | 116.3 | 79% | 0.785 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -49.4 | 116.9 | 173 | 0 | 0 | 0 | 0 | 0 | 107.3 | P47 A51 | P47-A49 PolarHBondContact O-N 2.87Å; P47-A49 VanDerWaalsContact O-N 3.08Å; A49-A51 PolarHBondContact O-N 3.18Å |
| 50 | A | 41.1 | Very low | 50.8 | Low | 93 Ų | 93 | 111 Ų | 111 | 77% | 0.769 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -48.4 | 119.8 | 173 | 0 | 0 | 0 | 0 | 0 | 107.1 | P48 E52 | P48-A50 PolarHBondContact O-N 3.2Å; A50-E52 PolarHBondContact O-N 3.39Å |
| 51 | A | 40.4 | Very low | 53.9 | Low | 91 Ų | 91 | 106.4 Ų | 106.4 | 75% | 0.752 | 64% | 0.644 | S | S | * | * | trans | -53.7 | 108.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 107.4 | A49 V53 | A49-A51 PolarHBondContact O-N 3.18Å; A51-V53 PolarHBondContact O-N 3.49Å | ||
| 52 | E | 47.2 | Very low | 57 | Low | 189 Ų | 189 | 105.3 Ų | 105.3 | 88% | 0.883 | 63% | 0.628 | S | S | * | * | trans | -57.2 | 109.6 | 169.9 | -74.9 | -174.2 | 168.6 | 0 | 0 | 105.8 | A50 E54 | A50-E52 PolarHBondContact O-N 3.39Å; E52-E54 VanDerWaalsContact C-N 3.31Å; E52-E54 PolarHBondContact O-N 3.08Å | ||
| 53 | V | 50.2 | Low | 60 | Low | 140 Ų | 140 | 98.9 Ų | 98.9 | 85% | 0.848 | 59% | 0.59 | S | S | * | * | trans | -60.8 | 99.9 | 174.6 | 178 | 0 | 0 | 0 | 0 | 106.2 | A51 F55 | A51-V53 PolarHBondContact O-N 3.49Å; V53-F55 PolarHBondContact O-N 3.05Å; V53-F55 VanDerWaalsContact O-N 3.13Å | ||
| 54 | E | 65.9 | Low | 63.2 | Low | 137 Ų | 137 | 95 Ų | 95 | 64% | 0.64 | 57% | 0.567 | S | S | * | * | trans | -60.2 | 118.5 | -178.1 | -167.3 | 179.3 | 174.9 | 0 | 0 | 108.1 | E52 V56 K189 | E52-E54 VanDerWaalsContact C-N 3.31Å; E52-E54 PolarHBondContact O-N 3.08Å; E54-V56 PolarHBondContact O-N 3.33Å; E54-V56 VanDerWaalsContact O-N 3.1Å; E54-K189 IonicContact OE1-NZ 2.7Å; E54-K189 PolarHBondContact OE1-NZ 3.35Å | ||
| 55 | F | 78.3 | Confident | 66.4 | Low | 62 Ų | 62 | 88.3 Ų | 88.3 | 27% | 0.272 | 54% | 0.543 | S | S | . | . | trans | -56.3 | 119.8 | -178.8 | 173.6 | -92.7 | 0 | 0 | 0 | 110.1 | V53 H57 L247 L248 | V53-F55 PolarHBondContact O-N 3.05Å; V53-F55 VanDerWaalsContact O-N 3.13Å; F55-H57 AromaticContact CD1-CE1 3.93Å; F55-H57 AromaticContact CD1-NE2 3.97Å; F55-H57 AromaticContact CE1-ND1 3.8Å; F55-H57 PolarHBondContact O-N 3.11Å; F55-L247 HydrophobicContact CE2-CB 4.22Å; F55-L247 WeakPolarHBondContact CE2-O 3Å; F55-L247 HydrophobicContact CZ-CB 3.61Å; F55-L248 HydrophobicContact CB-CD2 4.19Å; F55-L248 HydrophobicContact CD1-CD2 3.36Å; F55-L248 HydrophobicContact CD1-CG 4.44Å; F55-L248 HydrophobicContact CD2-CD2 4.42Å; F55-L248 HydrophobicContact CE1-CD2 3.79Å; F55-L248 HydrophobicContact CE1-CG 4.42Å; F55-L248 HydrophobicContact CG-CD2 3.73Å; F55-L248 HydrophobicContact CZ-CD2 4.49Å | ||
| 56 | V | 83.3 | Confident | 69.4 | Low | 125 Ų | 125 | 84.1 Ų | 84.1 | 76% | 0.758 | 51% | 0.508 | S | S | * | . | trans | -83.5 | 112.8 | 179.6 | -176.9 | 0 | 0 | 0 | 0 | 109.1 | E54 | E54-V56 PolarHBondContact O-N 3.33Å; E54-V56 VanDerWaalsContact O-N 3.1Å | ||
| 57 | H | 86.7 | Confident | 72.5 | Confident | 34 Ų | 34 | 80 Ų | 80 | 16% | 0.157 | 48% | 0.478 | C | S | . | . | trans | -67.1 | 133.6 | 175.6 | -65.9 | -92.1 | 0 | 0 | 0 | 110.6 | F55 E59 G185 H186 K189 | F55-H57 AromaticContact CD1-CE1 3.93Å; F55-H57 AromaticContact CD1-NE2 3.97Å; F55-H57 AromaticContact CE1-ND1 3.8Å; F55-H57 PolarHBondContact O-N 3.11Å; H57-E59 HydrophobicContact CB-CG 4.43Å; H57-E59 PolarHBondContact O-N 3.33Å; H57-G185 PolarHBondContact CE1-O 3.4Å; H57-G185 PolarHBondContact ND1-O 2.83Å; H57-H186 PolarHBondContact ND1-O 3.35Å; H57-K189 HydrophobicContact CB-CB 4.24Å | ||
| 58 | P | 86.3 | Confident | 75.5 | Confident | 70 Ų | 70 | 79.5 Ų | 79.5 | 46% | 0.455 | 47% | 0.469 | S | S | . | . | trans | -60.5 | -25.4 | -178.9 | -25.7 | 32.4 | 0 | 0 | 0 | 115 | G60 Y187 L247 | P58-G60 PolarHBondContact O-N 3.26Å; P58-G60 VanDerWaalsContact O-N 3.15Å; P58-Y187 HydrophobicContact CG-CD1 4.42Å; P58-L247 HydrophobicContact CG-CD1 3.57Å | ||
| 59 | E | 85 | Confident | 78.4 | Confident | 31 Ų | 31 | 74 Ų | 74 | 15% | 0.145 | 43% | 0.434 | C | S | . | . | trans | 53.7 | 35.6 | 178.7 | -67.6 | -67.8 | 163.1 | 0 | 0 | 113.2 | H57 Y187 K189 K190 R191 | H57-E59 HydrophobicContact CB-CG 4.43Å; H57-E59 PolarHBondContact O-N 3.33Å; E59-Y187 WeakPolarHBondContact CA-O 3.44Å; E59-Y187 PolarHBondContact N-O 2.87Å; E59-K189 WeakPolarHBondContact OE1-CA 3.47Å; E59-K189 PolarHBondContact OE1-N 3.32Å; E59-K190 PolarHBondContact OE1-N 2.78Å; E59-R191 VanDerWaalsContact O-CZ 3.25Å; E59-R191 PolarHBondContact O-NE 3.41Å; E59-R191 PolarHBondContact O-NH2 2.99Å; E59-R191 WeakPolarHBondContact OE2-CG 3.27Å; E59-R191 IonicContact OE2-CZ 3.81Å; E59-R191 IonicContact OE2-NE 3.84Å; E59-R191 PolarHBondContact OE2-NE 3.23Å; E59-R191 IonicContact OE2-NH2 3.86Å | ||
| 60 | G | 86.9 | Confident | 81 | Confident | 10 Ų | 10 | 69.5 Ų | 69.5 | 10% | 0.103 | 40% | 0.397 | C | S | . | . | S | Bend | trans | 153.8 | -155.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114 | P58 W62 G63 | P58-G60 PolarHBondContact O-N 3.26Å; P58-G60 VanDerWaalsContact O-N 3.15Å; G60-W62 PolarHBondContact O-N 3.38Å; G60-G63 PolarHBondContact O-N 3.43Å |
| 61 | G | 91 | Very high | 83.6 | Confident | 61 Ų | 61 | 67.4 Ų | 67.4 | 63% | 0.629 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.7 | -123.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | G63 W64 | G61-G63 PolarHBondContact O-N 3.21Å; G61-G63 VanDerWaalsContact O-N 3.1Å; G61-W64 PolarHBondContact O-N 3.18Å |
| 62 | W | 93.9 | Very high | 86.3 | Confident | 136 Ų | 136 | 67.1 Ų | 67.1 | 52% | 0.515 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -58.6 | -21.9 | 176.3 | -165 | -99.6 | 0 | 0 | 0 | 113.4 | G60 W64 V65 V66 Y187 T243 | G60-W62 PolarHBondContact O-N 3.38Å; W62-W64 PolarHBondContact O-N 3.23Å; W62-V65 HydrophobicContact CD2-CB 4.29Å; W62-V65 HydrophobicContact CD2-CG2 4.41Å; W62-V65 HydrophobicContact CE3-CB 4.45Å; W62-V65 HydrophobicContact CE3-CG2 4.12Å; W62-V65 HydrophobicContact CH2-CG1 4.31Å; W62-V65 HydrophobicContact CZ2-CG1 4.17Å; W62-V65 HydrophobicContact CZ3-CG2 4.34Å; W62-V65 WeakPolarHBondContact O-CB 3.45Å; W62-V65 PolarHBondContact O-N 3.33Å; W62-V66 PolarHBondContact O-N 3.22Å; W62-Y187 HydrophobicContact CB-CE1 4.22Å; W62-T243 PolarHBondContact NE1-O 3.17Å |
| 63 | G | 92.6 | Very high | 88.7 | Confident | 0 Ų | 0 | 58.1 Ų | 58.1 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -57.5 | -30.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | G60 G61 V66 M67 F188 | G60-G63 PolarHBondContact O-N 3.43Å; G61-G63 PolarHBondContact O-N 3.21Å; G61-G63 VanDerWaalsContact O-N 3.1Å; G63-V66 PolarHBondContact O-N 2.9Å; G63-M67 WeakPolarHBondContact O-CB 3.46Å; G63-M67 PolarHBondContact O-N 3.1Å; G63-F188 VanDerWaalsContact C-CZ 3.49Å; G63-F188 WeakPolarHBondContact O-CE2 3.49Å |
| 64 | W | 95.1 | Very high | 90.8 | Very high | 96 Ų | 96 | 51.6 Ų | 51.6 | 36% | 0.364 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -71.6 | -34.4 | 175.9 | -65 | 118.4 | 0 | 0 | 0 | 112.8 | G61 W62 M67 L68 F188 V195 | G61-W64 PolarHBondContact O-N 3.18Å; W62-W64 PolarHBondContact O-N 3.23Å; W64-M67 HydrophobicContact CE3-CE 3.68Å; W64-M67 HydrophobicContact CZ3-CE 4.08Å; W64-M67 WeakPolarHBondContact O-CB 3.45Å; W64-M67 PolarHBondContact O-N 3.33Å; W64-L68 WeakPolarHBondContact O-CG 3.33Å; W64-L68 PolarHBondContact O-N 2.94Å; W64-F188 HydrophobicContact CD2-CZ 4.24Å; W64-F188 HydrophobicContact CE3-CZ 4.3Å; W64-F188 HydrophobicContact CZ2-CE1 4.45Å; W64-V195 HydrophobicContact CZ3-CG2 4.46Å |
| 65 | V | 96.3 | Very high | 92.2 | Very high | 58 Ų | 58 | 45 Ų | 45 | 35% | 0.352 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -65.8 | -46.1 | 173.4 | -179 | 0 | 0 | 0 | 0 | 109.8 | W62 M67 L68 A69 T243 | W62-V65 HydrophobicContact CD2-CB 4.29Å; W62-V65 HydrophobicContact CD2-CG2 4.41Å; W62-V65 HydrophobicContact CE3-CB 4.45Å; W62-V65 HydrophobicContact CE3-CG2 4.12Å; W62-V65 HydrophobicContact CH2-CG1 4.31Å; W62-V65 HydrophobicContact CZ2-CG1 4.17Å; W62-V65 HydrophobicContact CZ3-CG2 4.34Å; W62-V65 WeakPolarHBondContact O-CB 3.45Å; W62-V65 PolarHBondContact O-N 3.33Å; V65-M67 VanDerWaalsContact C-N 3.29Å; V65-M67 PolarHBondContact O-N 2.97Å; V65-L68 PolarHBondContact O-N 3.36Å; V65-A69 WeakPolarHBondContact O-CB 3.42Å; V65-A69 PolarHBondContact O-N 3.11Å; V65-T243 HydrophobicContact CG1-CG2 4.28Å |
| 66 | V | 95.8 | Very high | 93 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.3 | -40.8 | 175 | 174.7 | 0 | 0 | 0 | 0 | 110.9 | W62 G63 A69 S70 I183 L184 Y187 Y244 | W62-V66 PolarHBondContact O-N 3.22Å; G63-V66 PolarHBondContact O-N 2.9Å; V66-A69 PolarHBondContact O-N 3.44Å; V66-S70 WeakPolarHBondContact O-CB 3.47Å; V66-S70 PolarHBondContact O-N 3.27Å; V66-S70 PolarHBondContact O-OG 3.31Å; V66-S70 VanDerWaalsContact O-OG 3.1Å; V66-I183 HydrophobicContact CG1-CB 4.38Å; V66-I183 HydrophobicContact CG1-CG1 3.93Å; V66-I183 HydrophobicContact CG1-CG2 3.58Å; V66-L184 HydrophobicContact CG1-CD2 4.18Å; V66-Y187 HydrophobicContact CG1-CD2 4.4Å; V66-Y187 HydrophobicContact CG1-CE2 4.41Å; V66-Y187 HydrophobicContact CG2-CD2 4.48Å; V66-Y187 HydrophobicContact CG2-CE2 3.96Å; V66-Y244 HydrophobicContact CG1-CD1 3.91Å; V66-Y244 HydrophobicContact CG1-CE1 4.17Å |
| 67 | M | 95.3 | Very high | 93.6 | Very high | 14 Ų | 14 | 36.2 Ų | 36.2 | 7% | 0.069 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.5 | -47.7 | 175.5 | -178.5 | -78.7 | -71.3 | 0 | 0 | 111.9 | G63 W64 V65 A69 S70 M71 L184 V195 I198 V199 | G63-M67 WeakPolarHBondContact O-CB 3.46Å; G63-M67 PolarHBondContact O-N 3.1Å; W64-M67 HydrophobicContact CE3-CE 3.68Å; W64-M67 HydrophobicContact CZ3-CE 4.08Å; W64-M67 WeakPolarHBondContact O-CB 3.45Å; W64-M67 PolarHBondContact O-N 3.33Å; V65-M67 VanDerWaalsContact C-N 3.29Å; V65-M67 PolarHBondContact O-N 2.97Å; M67-A69 PolarHBondContact O-N 3.07Å; M67-S70 PolarHBondContact O-N 3.19Å; M67-M71 WeakPolarHBondContact O-CB 3.45Å; M67-M71 PolarHBondContact O-N 3.14Å; M67-L184 HydrophobicContact CB-CD2 4.24Å; M67-V195 HydrophobicContact CB-CG1 4.24Å; M67-V195 HydrophobicContact CG-CG1 3.74Å; M67-I198 HydrophobicContact CE-CG2 4.18Å; M67-I198 HydrophobicContact SD-CB 4.24Å; M67-I198 HydrophobicContact SD-CG2 3.57Å; M67-I198 VanDerWaalsContact SD-CG2 3.57Å; M67-V199 HydrophobicContact CG-CG2 3.91Å; M67-V199 WeakPolarHBondContact O-CG2 3.48Å; M67-V199 HydrophobicContact SD-CG2 4.31Å |
| 68 | L | 96.4 | Very high | 94 | Very high | 103 Ų | 103 | 35.5 Ų | 35.5 | 54% | 0.539 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -65 | -38.6 | 177.6 | -69 | 174.3 | 0 | 0 | 0 | 112.3 | W64 V65 M71 W72 | W64-L68 WeakPolarHBondContact O-CG 3.33Å; W64-L68 PolarHBondContact O-N 2.94Å; V65-L68 PolarHBondContact O-N 3.36Å; L68-M71 WeakPolarHBondContact O-CB 3.34Å; L68-M71 PolarHBondContact O-N 2.98Å; L68-W72 PolarHBondContact O-N 3.5Å |
| 69 | A | 97.1 | Very high | 94.4 | Very high | 10 Ų | 10 | 32.1 Ų | 32.1 | 8% | 0.083 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -61.7 | -44.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | V65 V66 M67 W72 C73 A240 T243 Y244 | V65-A69 WeakPolarHBondContact O-CB 3.42Å; V65-A69 PolarHBondContact O-N 3.11Å; V66-A69 PolarHBondContact O-N 3.44Å; M67-A69 PolarHBondContact O-N 3.07Å; A69-W72 PolarHBondContact O-N 3.13Å; A69-C73 PolarHBondContact O-N 3.39Å; A69-A240 HydrophobicContact CB-CB 3.89Å; A69-T243 WeakPolarHBondContact CB-OG1 3.45Å; A69-Y244 HydrophobicContact CB-CE1 3.9Å |
| 70 | S | 96.3 | Very high | 94.9 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -66.5 | -37 | 174.8 | -62.5 | 0 | 0 | 0 | 0 | 112.3 | V66 M67 C73 N74 S180 | V66-S70 WeakPolarHBondContact O-CB 3.47Å; V66-S70 PolarHBondContact O-N 3.27Å; V66-S70 PolarHBondContact O-OG 3.31Å; V66-S70 VanDerWaalsContact O-OG 3.1Å; M67-S70 PolarHBondContact O-N 3.19Å; S70-C73 WeakPolarHBondContact O-CB 2.89Å; S70-C73 PolarHBondContact O-N 2.91Å; S70-N74 WeakPolarHBondContact O-CB 3.34Å; S70-N74 PolarHBondContact O-N 3.15Å; S70-S180 WeakPolarHBondContact CB-O 3.18Å; S70-S180 PolarHBondContact OG-O 3.03Å |
| 71 | M | 95.8 | Very high | 95.3 | Very high | 49 Ų | 49 | 30.2 Ų | 30.2 | 24% | 0.241 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62 | -42.9 | 174 | -175.6 | -173.5 | 171.9 | 0 | 0 | 111.1 | M67 L68 G75 I198 V199 V205 | M67-M71 WeakPolarHBondContact O-CB 3.45Å; M67-M71 PolarHBondContact O-N 3.14Å; L68-M71 WeakPolarHBondContact O-CB 3.34Å; L68-M71 PolarHBondContact O-N 2.98Å; M71-G75 WeakPolarHBondContact O-CA 3.5Å; M71-G75 PolarHBondContact O-N 2.97Å; M71-I198 HydrophobicContact SD-CG2 4.18Å; M71-V199 HydrophobicContact CB-CG2 4.32Å; M71-V205 HydrophobicContact CE-CG2 4.5Å |
| 72 | W | 96.9 | Very high | 95.3 | Very high | 84 Ų | 84 | 28 Ų | 28 | 32% | 0.318 | 13% | 0.127 | S | C | . | . | H | α-helix | trans | -62.2 | -44.7 | 173.1 | -178.3 | -86.8 | 0 | 0 | 0 | 111.8 | L68 A69 G75 S76 F206 L233 V236 | L68-W72 PolarHBondContact O-N 3.5Å; A69-W72 PolarHBondContact O-N 3.13Å; W72-G75 PolarHBondContact O-N 3.41Å; W72-S76 WeakPolarHBondContact O-CB 3.44Å; W72-S76 PolarHBondContact O-N 3.08Å; W72-S76 PolarHBondContact O-OG 3.38Å; W72-S76 VanDerWaalsContact O-OG 3.1Å; W72-F206 HydrophobicContact CD2-CZ 4.09Å; W72-F206 HydrophobicContact CE3-CE2 4.27Å; W72-F206 AromaticContact CE3-CZ 3.77Å; W72-F206 HydrophobicContact CE3-CZ 3.77Å; W72-F206 HydrophobicContact CH2-CZ 4.06Å; W72-F206 HydrophobicContact CZ2-CZ 4.35Å; W72-F206 HydrophobicContact CZ3-CE2 4.49Å; W72-F206 AromaticContact CZ3-CZ 3.76Å; W72-F206 HydrophobicContact CZ3-CZ 3.76Å; W72-L233 HydrophobicContact CH2-CD2 3.98Å; W72-L233 HydrophobicContact CZ2-CD2 3.59Å; W72-L233 PolarHBondContact NE1-O 3.38Å; W72-V236 HydrophobicContact CD2-CG1 4.02Å; W72-V236 VanDerWaalsContact CE2-CG1 3.4Å; W72-V236 HydrophobicContact CG-CG1 4.33Å; W72-V236 HydrophobicContact CH2-CG1 4.46Å; W72-V236 HydrophobicContact CZ2-CB 3.8Å; W72-V236 HydrophobicContact CZ2-CG1 3.66Å; W72-V236 HydrophobicContact CZ2-CG2 4.14Å |
| 73 | C | 96.9 | Very high | 95.3 | Very high | 0 Ų | 0 | 21.6 Ų | 21.6 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -57.4 | -53.1 | 176.9 | 177.5 | 0 | 0 | 0 | 0 | 112.4 | A69 S70 G75 S76 V77 A176 L237 | A69-C73 PolarHBondContact O-N 3.39Å; S70-C73 WeakPolarHBondContact O-CB 2.89Å; S70-C73 PolarHBondContact O-N 2.91Å; C73-G75 VanDerWaalsContact C-N 3.29Å; C73-G75 PolarHBondContact O-N 3.37Å; C73-S76 PolarHBondContact O-OG 3.2Å; C73-V77 WeakPolarHBondContact O-CB 3.46Å; C73-V77 VanDerWaalsContact O-CG2 3.29Å; C73-V77 WeakPolarHBondContact O-CG2 3.41Å; C73-V77 PolarHBondContact O-N 3.06Å; C73-V77 VanDerWaalsContact O-N 3.13Å; C73-A176 PolarHBondContact SG-O 3.49Å; C73-A176 VanDerWaalsContact SG-O 3.4Å; C73-L237 HydrophobicContact CB-CD1 3.32Å; C73-L237 VanDerWaalsContact SG-CD1 3.56Å |
| 74 | N | 94.8 | Very high | 95.4 | Very high | 3 Ų | 3 | 21.6 Ų | 21.6 | 2% | 0.016 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -64 | -38.5 | 178.3 | -178.1 | 63.5 | 0 | 0 | 0 | 111.5 | S70 F78 Y177 V199 T200 | S70-N74 WeakPolarHBondContact O-CB 3.34Å; S70-N74 PolarHBondContact O-N 3.15Å; N74-F78 PolarHBondContact O-N 2.95Å; N74-F78 WeakPolarHBondContact OD1-CD2 3.44Å; N74-F78 WeakPolarHBondContact OD1-CE2 3.29Å; N74-Y177 HydrophobicContact CB-CE2 4.45Å; N74-Y177 WeakPolarHBondContact OD1-CE2 3.4Å; N74-V199 HydrophobicContact CB-CG1 3.99Å; N74-V199 PolarHBondContact ND2-O 2.8Å; N74-T200 VanDerWaalsContact ND2-CA 3.31Å; N74-T200 WeakPolarHBondContact ND2-CA 3.24Å; N74-T200 PolarHBondContact ND2-O 3.39Å |
| 75 | G | 95.2 | Very high | 95.2 | Very high | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -59 | -55.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | M71 W72 C73 G79 F206 | M71-G75 WeakPolarHBondContact O-CA 3.5Å; M71-G75 PolarHBondContact O-N 2.97Å; W72-G75 PolarHBondContact O-N 3.41Å; C73-G75 VanDerWaalsContact C-N 3.29Å; C73-G75 PolarHBondContact O-N 3.37Å; G75-G79 WeakPolarHBondContact O-CA 3.26Å; G75-G79 PolarHBondContact O-N 3.38Å; G75-F206 VanDerWaalsContact C-CG 3.43Å; G75-F206 WeakPolarHBondContact O-CB 3.39Å; G75-F206 VanDerWaalsContact O-CG 3.28Å; G75-F206 WeakPolarHBondContact O-CG 3.34Å |
| 76 | S | 95.9 | Very high | 95.1 | Very high | 0 Ų | 0 | 14.6 Ų | 14.6 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -67.9 | -44.1 | -175.1 | 63.2 | 0 | 0 | 0 | 0 | 112.5 | W72 C73 I80 | W72-S76 WeakPolarHBondContact O-CB 3.44Å; W72-S76 PolarHBondContact O-N 3.08Å; W72-S76 PolarHBondContact O-OG 3.38Å; W72-S76 VanDerWaalsContact O-OG 3.1Å; C73-S76 PolarHBondContact O-OG 3.2Å; S76-I80 VanDerWaalsContact O-CG1 3.25Å; S76-I80 WeakPolarHBondContact O-CG1 3.18Å; S76-I80 PolarHBondContact O-N 3.11Å |
| 77 | V | 96.4 | Very high | 95 | Very high | 1 Ų | 1 | 14.7 Ų | 14.7 | 1% | 0.006 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -62.4 | -57.7 | -179.2 | 171.7 | 0 | 0 | 0 | 0 | 110.9 | C73 Q81 I118 C173 L237 | C73-V77 WeakPolarHBondContact O-CB 3.46Å; C73-V77 VanDerWaalsContact O-CG2 3.29Å; C73-V77 WeakPolarHBondContact O-CG2 3.41Å; C73-V77 PolarHBondContact O-N 3.06Å; C73-V77 VanDerWaalsContact O-N 3.13Å; V77-Q81 WeakPolarHBondContact O-CB 3.35Å; V77-Q81 PolarHBondContact O-N 3.36Å; V77-I118 HydrophobicContact CG1-CD1 4.01Å; V77-C173 HydrophobicContact CG1-CB 3.85Å; V77-C173 HydrophobicContact CG2-CB 4.08Å; V77-L237 HydrophobicContact CG2-CD2 4.27Å |
| 78 | F | 93.9 | Very high | 95 | Very high | 19 Ų | 19 | 14 Ų | 14 | 8% | 0.083 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -76 | -25.1 | -179.1 | -72.7 | -72.3 | 0 | 0 | 0 | 113 | N74 Q81 N82 M115 F119 Y177 | N74-F78 PolarHBondContact O-N 2.95Å; N74-F78 WeakPolarHBondContact OD1-CD2 3.44Å; N74-F78 WeakPolarHBondContact OD1-CE2 3.29Å; F78-Q81 PolarHBondContact O-N 3.34Å; F78-N82 WeakPolarHBondContact O-CB 3.15Å; F78-N82 PolarHBondContact O-N 3.45Å; F78-N82 PolarHBondContact O-ND2 3.08Å; F78-M115 HydrophobicContact CD1-CE 3.98Å; F78-M115 HydrophobicContact CD1-SD 4.46Å; F78-M115 HydrophobicContact CE1-CE 3.85Å; F78-M115 HydrophobicContact CE1-SD 4.25Å; F78-F119 HydrophobicContact CE1-CE1 4.15Å; F78-F119 AromaticContact CE1-CZ 3.84Å; F78-F119 HydrophobicContact CE1-CZ 3.84Å; F78-F119 HydrophobicContact CZ-CE1 4.03Å; F78-F119 HydrophobicContact CZ-CZ 4.18Å; F78-Y177 HydrophobicContact CD2-CE2 4.49Å; F78-Y177 HydrophobicContact CE2-CD2 4.05Å; F78-Y177 HydrophobicContact CE2-CE1 4.11Å; F78-Y177 AromaticContact CE2-CE2 3.62Å; F78-Y177 HydrophobicContact CE2-CE2 3.62Å; F78-Y177 HydrophobicContact CE2-CG 4.47Å; F78-Y177 AromaticContact CE2-CZ 3.62Å; F78-Y177 HydrophobicContact CZ-CE1 4.18Å; F78-Y177 HydrophobicContact CZ-CE2 4.47Å |
| 79 | G | 94.6 | Very high | 94.7 | Very high | 0 Ų | 0 | 9.5 Ų | 9.5 | 0% | 0 | 4% | 0.044 | C | C | . | . | H | α-helix | trans | -61.3 | -51 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112 | G75 Q81 S83 L210 | G75-G79 WeakPolarHBondContact O-CA 3.26Å; G75-G79 PolarHBondContact O-N 3.38Å; G79-Q81 VanDerWaalsContact C-N 3.28Å; G79-Q81 PolarHBondContact O-N 3.21Å; G79-S83 VanDerWaalsContact O-CB 3.25Å; G79-S83 WeakPolarHBondContact O-CB 3.29Å; G79-S83 PolarHBondContact O-N 3.4Å; G79-S83 PolarHBondContact O-OG 3.22Å; G79-L210 VanDerWaalsContact C-CD2 3.44Å |
| 80 | I | 95.3 | Very high | 94.5 | Very high | 0 Ų | 0 | 10.3 Ų | 10.3 | 0% | 0 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -59.2 | -45.4 | 175.9 | -68.4 | 168 | 0 | 0 | 0 | 109.7 | S76 S83 F84 F169 L210 L230 L233 | S76-I80 VanDerWaalsContact O-CG1 3.25Å; S76-I80 WeakPolarHBondContact O-CG1 3.18Å; S76-I80 PolarHBondContact O-N 3.11Å; I80-S83 PolarHBondContact O-N 3.43Å; I80-F84 PolarHBondContact O-N 3.39Å; I80-F169 HydrophobicContact CD1-CZ 4.13Å; I80-F169 HydrophobicContact CG2-CE1 4.18Å; I80-F169 HydrophobicContact CG2-CZ 3.99Å; I80-L210 HydrophobicContact CB-CD2 4.4Å; I80-L210 HydrophobicContact CG1-CD2 3.83Å; I80-L230 HydrophobicContact CD1-CD2 4.44Å; I80-L230 HydrophobicContact CG1-CD1 4.49Å; I80-L230 HydrophobicContact CG1-CD2 4.15Å; I80-L230 HydrophobicContact CG2-CD1 4.43Å; I80-L233 HydrophobicContact CD1-CD1 4.28Å; I80-L233 HydrophobicContact CG1-CD1 4.34Å |
| 81 | Q | 95.1 | Very high | 94.3 | Very high | 1 Ų | 1 | 10.6 Ų | 10.6 | 1% | 0.005 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -69 | -45.7 | -174.5 | -161 | 53.2 | 47.7 | 0 | 0 | 113 | V77 F78 G79 S83 F84 G111 S114 M115 I118 Y290 | V77-Q81 WeakPolarHBondContact O-CB 3.35Å; V77-Q81 PolarHBondContact O-N 3.36Å; F78-Q81 PolarHBondContact O-N 3.34Å; G79-Q81 VanDerWaalsContact C-N 3.28Å; G79-Q81 PolarHBondContact O-N 3.21Å; Q81-S83 PolarHBondContact O-N 3.26Å; Q81-F84 WeakPolarHBondContact O-CB 3.4Å; Q81-F84 PolarHBondContact O-N 2.99Å; Q81-F84 VanDerWaalsContact O-N 3.08Å; Q81-G111 PolarHBondContact NE2-O 3.45Å; Q81-S114 PolarHBondContact OE1-OG 3.23Å; Q81-M115 HydrophobicContact CB-SD 4.34Å; Q81-M115 HydrophobicContact CG-CB 3.86Å; Q81-M115 HydrophobicContact CG-CE 4.41Å; Q81-M115 HydrophobicContact CG-CG 4.1Å; Q81-M115 HydrophobicContact CG-SD 3.33Å; Q81-M115 WeakPolarHBondContact CG-SD 3.26Å; Q81-I118 HydrophobicContact CG-CD1 4.44Å; Q81-Y290 PolarHBondContact NE2-OH 3.46Å; Q81-Y290 PolarHBondContact O-OH 2.99Å |
| 82 | N | 92.4 | Very high | 94 | Very high | 15 Ų | 15 | 8.4 Ų | 8.4 | 8% | 0.08 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -68 | -25.5 | 176.6 | -68.4 | -12.7 | 0 | 0 | 0 | 112.5 | F78 F84 T207 Y293 | F78-N82 WeakPolarHBondContact O-CB 3.15Å; F78-N82 PolarHBondContact O-N 3.45Å; F78-N82 PolarHBondContact O-ND2 3.08Å; N82-F84 VanDerWaalsContact C-N 3.26Å; N82-T207 HydrophobicContact CB-CG2 3.95Å; N82-T207 PolarHBondContact ND2-OG1 3.08Å; N82-T207 VanDerWaalsContact ND2-OG1 3.07Å; N82-Y293 HydrophobicContact CB-CD1 4.21Å; N82-Y293 HydrophobicContact CB-CE1 4.4Å |
| 83 | S | 93.9 | Very high | 93.6 | Very high | 0 Ų | 0 | 8.5 Ų | 8.5 | 0% | 0 | 5% | 0.047 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.7 | 3.6 | 175.1 | -49.8 | 0 | 0 | 0 | 0 | 112.9 | G79 I80 Q81 G85 I86 P211 | G79-S83 VanDerWaalsContact O-CB 3.25Å; G79-S83 WeakPolarHBondContact O-CB 3.29Å; G79-S83 PolarHBondContact O-N 3.4Å; G79-S83 PolarHBondContact O-OG 3.22Å; I80-S83 PolarHBondContact O-N 3.43Å; Q81-S83 PolarHBondContact O-N 3.26Å; S83-G85 PolarHBondContact O-N 3.37Å; S83-G85 VanDerWaalsContact O-N 3.14Å; S83-I86 PolarHBondContact O-N 2.97Å; S83-P211 WeakPolarHBondContact OG-CD 3.15Å |
| 84 | F | 94.5 | Very high | 93.1 | Very high | 1 Ų | 1 | 12.2 Ų | 12.2 | 0% | 0.004 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -59.3 | -27.6 | -179.1 | -175.2 | -94.3 | 0 | 0 | 0 | 112.3 | I80 Q81 N82 I86 L87 Y88 L91 V110 G111 Y165 V294 | I80-F84 PolarHBondContact O-N 3.39Å; Q81-F84 WeakPolarHBondContact O-CB 3.4Å; Q81-F84 PolarHBondContact O-N 2.99Å; Q81-F84 VanDerWaalsContact O-N 3.08Å; N82-F84 VanDerWaalsContact C-N 3.26Å; F84-I86 PolarHBondContact O-N 3.35Å; F84-I86 VanDerWaalsContact O-N 3.1Å; F84-L87 HydrophobicContact CD2-CB 4.2Å; F84-L87 HydrophobicContact CD2-CD1 4.38Å; F84-L87 HydrophobicContact CE2-CB 4.41Å; F84-L87 CarbonylContact O-C 3.41Å; F84-L87 PolarHBondContact O-N 2.82Å; F84-L87 VanDerWaalsContact O-N 3.09Å; F84-Y88 HydrophobicContact CE1-CD2 4.29Å; F84-Y88 HydrophobicContact CE1-CG 4.44Å; F84-Y88 VanDerWaalsContact O-CB 3.22Å; F84-Y88 WeakPolarHBondContact O-CB 3.41Å; F84-Y88 PolarHBondContact O-N 2.98Å; F84-L91 HydrophobicContact CE2-CD1 3.97Å; F84-L91 HydrophobicContact CZ-CD1 3.84Å; F84-V110 HydrophobicContact CE2-CG1 4.26Å; F84-V110 HydrophobicContact CZ-CB 4.05Å; F84-V110 HydrophobicContact CZ-CG1 4.29Å; F84-G111 VanDerWaalsContact CE1-CA 3.41Å; F84-G111 VanDerWaalsContact CE2-CA 3.49Å; F84-Y165 AromaticContact CD2-CE1 3.91Å; F84-Y165 HydrophobicContact CD2-CE1 3.91Å; F84-Y165 AromaticContact CE2-CE1 3.84Å; F84-Y165 HydrophobicContact CE2-CE1 3.84Å; F84-V294 HydrophobicContact CD1-CG1 4.14Å; F84-V294 HydrophobicContact CD1-CG2 4.25Å; F84-V294 HydrophobicContact CE1-CG1 4.28Å |
| 85 | G | 91.5 | Very high | 92.6 | Very high | 0 Ų | 0 | 12.9 Ų | 12.9 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -55.5 | -28.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | S83 V89 Y293 V294 | S83-G85 PolarHBondContact O-N 3.37Å; S83-G85 VanDerWaalsContact O-N 3.14Å; G85-V89 WeakPolarHBondContact O-CG2 3.34Å; G85-V89 PolarHBondContact O-N 3.02Å; G85-Y293 WeakPolarHBondContact CA-O 2.99Å; G85-Y293 PolarHBondContact N-O 3.39Å; G85-V294 WeakPolarHBondContact CA-O 3.16Å |
| 86 | I | 93.5 | Very high | 91.8 | Very high | 7 Ų | 7 | 14.1 Ų | 14.1 | 4% | 0.036 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -78.5 | -47.1 | 175 | -64.7 | 165.1 | 0 | 0 | 0 | 110.6 | S83 F84 Y88 V89 S90 P211 L214 L218 M297 E311 L314 | S83-I86 PolarHBondContact O-N 2.97Å; F84-I86 PolarHBondContact O-N 3.35Å; F84-I86 VanDerWaalsContact O-N 3.1Å; I86-Y88 PolarHBondContact O-N 2.82Å; I86-V89 PolarHBondContact O-N 3.24Å; I86-S90 PolarHBondContact O-N 3.39Å; I86-P211 HydrophobicContact CD1-CB 3.41Å; I86-P211 VanDerWaalsContact CD1-CB 3.41Å; I86-P211 HydrophobicContact CD1-CG 4.24Å; I86-P211 WeakPolarHBondContact CD1-O 3.48Å; I86-L214 HydrophobicContact CG2-CB 4.32Å; I86-L218 HydrophobicContact CG2-CD1 3.53Å; I86-M297 HydrophobicContact CG1-CG 4.23Å; I86-M297 HydrophobicContact CG1-SD 4.41Å; I86-E311 HydrophobicContact CD1-CG 4.34Å; I86-L314 HydrophobicContact CD1-CD1 4.1Å; I86-L314 HydrophobicContact CG1-CD1 4.35Å |
| 87 | L | 94 | Very high | 90.1 | Very high | 2 Ų | 2 | 18.5 Ų | 18.5 | 1% | 0.01 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -59.9 | -37 | 174.7 | -65.8 | 176.2 | 0 | 0 | 0 | 111.3 | F84 S90 L91 L214 L218 L223 T226 L230 | F84-L87 HydrophobicContact CD2-CB 4.2Å; F84-L87 HydrophobicContact CD2-CD1 4.38Å; F84-L87 HydrophobicContact CE2-CB 4.41Å; F84-L87 CarbonylContact O-C 3.41Å; F84-L87 PolarHBondContact O-N 2.82Å; F84-L87 VanDerWaalsContact O-N 3.09Å; L87-S90 PolarHBondContact O-N 3.26Å; L87-L91 WeakPolarHBondContact O-CB 3.48Å; L87-L91 WeakPolarHBondContact O-CG 3.47Å; L87-L91 PolarHBondContact O-N 3.3Å; L87-L214 HydrophobicContact CD2-CD2 4.38Å; L87-L218 HydrophobicContact CD2-CD1 4.35Å; L87-L218 HydrophobicContact CD2-CD2 4.31Å; L87-L223 HydrophobicContact CD2-CD1 4.14Å; L87-T226 HydrophobicContact CD2-CG2 4.48Å; L87-L230 HydrophobicContact CD1-CD1 4.48Å |
| 88 | Y | 93.9 | Very high | 88.4 | Confident | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -58 | -48.3 | 176.5 | 168.4 | -106.2 | 0 | 0 | 0 | 111.7 | F84 I86 S90 L91 L92 S104 T107 V294 H295 K298 Y430 | F84-Y88 HydrophobicContact CE1-CD2 4.29Å; F84-Y88 HydrophobicContact CE1-CG 4.44Å; F84-Y88 VanDerWaalsContact O-CB 3.22Å; F84-Y88 WeakPolarHBondContact O-CB 3.41Å; F84-Y88 PolarHBondContact O-N 2.98Å; I86-Y88 PolarHBondContact O-N 2.82Å; Y88-S90 VanDerWaalsContact C-N 3.31Å; Y88-S90 PolarHBondContact O-N 2.97Å; Y88-L91 PolarHBondContact O-N 2.66Å; Y88-L92 VanDerWaalsContact O-CB 3.3Å; Y88-L92 WeakPolarHBondContact O-CB 3.23Å; Y88-L92 PolarHBondContact O-N 3.33Å; Y88-S104 WeakPolarHBondContact OH-CA 3.23Å; Y88-S104 VanDerWaalsContact OH-CB 3.26Å; Y88-S104 WeakPolarHBondContact OH-CB 3.09Å; Y88-T107 HydrophobicContact CD2-CG2 3.7Å; Y88-T107 HydrophobicContact CE2-CG2 3.85Å; Y88-V294 HydrophobicContact CD1-CG1 4.42Å; Y88-V294 WeakPolarHBondContact CD1-O 3.22Å; Y88-V294 HydrophobicContact CD2-CG1 4.15Å; Y88-V294 HydrophobicContact CG-CG1 4.04Å; Y88-H295 AromaticContact CE1-ND1 3.78Å; Y88-H295 AromaticContact CZ-CE1 3.9Å; Y88-H295 AromaticContact CZ-ND1 3.71Å; Y88-K298 HydrophobicContact CD1-CB 4.43Å; Y88-K298 HydrophobicContact CE1-CB 3.89Å; Y88-K298 HydrophobicContact CE1-CG 4.32Å; Y88-Y430 PolarHBondContact OH-OH 2.71Å |
| 89 | V | 91.8 | Very high | 86.6 | Confident | 8 Ų | 8 | 28.4 Ų | 28.4 | 5% | 0.048 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -61.5 | -43.1 | 177.9 | 172.5 | 0 | 0 | 0 | 0 | 110.7 | G85 I86 L92 N93 M297 K298 | G85-V89 WeakPolarHBondContact O-CG2 3.34Å; G85-V89 PolarHBondContact O-N 3.02Å; I86-V89 PolarHBondContact O-N 3.24Å; V89-L92 PolarHBondContact O-N 2.82Å; V89-N93 VanDerWaalsContact O-CG 3.25Å; V89-N93 PolarHBondContact O-N 3.21Å; V89-N93 VanDerWaalsContact O-N 3.1Å; V89-N93 PolarHBondContact O-ND2 3.27Å; V89-M297 HydrophobicContact CG2-CB 4.05Å; V89-K298 HydrophobicContact CG2-CB 4.06Å; V89-K298 HydrophobicContact CG2-CD 4.41Å |
| 90 | S | 91.9 | Very high | 84.8 | Confident | 27 Ų | 27 | 32.2 Ų | 32.2 | 19% | 0.189 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.4 | -45.3 | 177.7 | -176.9 | 0 | 0 | 0 | 0 | 112.3 | I86 L87 Y88 L92 N93 E94 | I86-S90 PolarHBondContact O-N 3.39Å; L87-S90 PolarHBondContact O-N 3.26Å; Y88-S90 VanDerWaalsContact C-N 3.31Å; Y88-S90 PolarHBondContact O-N 2.97Å; S90-L92 VanDerWaalsContact C-N 3.33Å; S90-L92 PolarHBondContact O-N 3.45Å; S90-N93 PolarHBondContact O-N 3.25Å; S90-E94 PolarHBondContact O-N 3.43Å |
| 91 | L | 91.8 | Very high | 83.3 | Confident | 5 Ų | 5 | 36.4 Ų | 36.4 | 3% | 0.026 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.4 | -43.8 | 174.8 | -74.9 | 166 | 0 | 0 | 0 | 111.4 | F84 L87 Y88 N93 E94 F95 T107 M161 L223 | F84-L91 HydrophobicContact CE2-CD1 3.97Å; F84-L91 HydrophobicContact CZ-CD1 3.84Å; L87-L91 WeakPolarHBondContact O-CB 3.48Å; L87-L91 WeakPolarHBondContact O-CG 3.47Å; L87-L91 PolarHBondContact O-N 3.3Å; Y88-L91 PolarHBondContact O-N 2.66Å; L91-N93 VanDerWaalsContact C-N 3.32Å; L91-N93 PolarHBondContact O-N 2.92Å; L91-E94 PolarHBondContact O-N 2.85Å; L91-F95 HydrophobicContact CB-CD2 4.43Å; L91-F95 HydrophobicContact CD2-CD2 4.11Å; L91-F95 HydrophobicContact CD2-CE2 3.64Å; L91-F95 WeakPolarHBondContact O-CB 3.38Å; L91-F95 WeakPolarHBondContact O-CD2 3.37Å; L91-F95 PolarHBondContact O-N 3.37Å; L91-T107 HydrophobicContact CB-CG2 3.48Å; L91-T107 VanDerWaalsContact CB-CG2 3.48Å; L91-M161 HydrophobicContact CD1-SD 4.42Å; L91-M161 HydrophobicContact CD2-CE 4.07Å; L91-M161 HydrophobicContact CD2-SD 3.47Å; L91-M161 WeakPolarHBondContact CD2-SD 3.02Å; L91-L223 HydrophobicContact CD2-CD2 3.53Å; L91-L223 HydrophobicContact CG-CD1 4.49Å; L91-L223 HydrophobicContact CG-CD2 4.1Å |
| 92 | L | 90.1 | Very high | 82 | Confident | 4 Ų | 4 | 40.2 Ų | 40.2 | 2% | 0.021 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60.9 | -44.5 | 179.2 | -169.9 | 69.9 | 0 | 0 | 0 | 110.4 | Y88 V89 S90 E94 F95 S96 T107 K298 | Y88-L92 VanDerWaalsContact O-CB 3.3Å; Y88-L92 WeakPolarHBondContact O-CB 3.23Å; Y88-L92 PolarHBondContact O-N 3.33Å; V89-L92 PolarHBondContact O-N 2.82Å; S90-L92 VanDerWaalsContact C-N 3.33Å; S90-L92 PolarHBondContact O-N 3.45Å; L92-E94 PolarHBondContact O-N 3.48Å; L92-F95 PolarHBondContact O-N 3.02Å; L92-S96 WeakPolarHBondContact CD1-OG 3.46Å; L92-S96 WeakPolarHBondContact O-CB 3.34Å; L92-S96 PolarHBondContact O-N 3.05Å; L92-S96 PolarHBondContact O-OG 3.11Å; L92-T107 HydrophobicContact CB-CG2 4.32Å; L92-K298 HydrophobicContact CD2-CD 4.1Å; L92-K298 HydrophobicContact CD2-CG 4.47Å |
| 93 | N | 88.4 | Confident | 81.6 | Confident | 85 Ų | 85 | 40.5 Ų | 40.5 | 46% | 0.455 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -64.1 | -40.6 | 178.1 | -66 | -17.6 | 0 | 0 | 0 | 112.6 | V89 S90 L91 S97 | V89-N93 VanDerWaalsContact O-CG 3.25Å; V89-N93 PolarHBondContact O-N 3.21Å; V89-N93 VanDerWaalsContact O-N 3.1Å; V89-N93 PolarHBondContact O-ND2 3.27Å; S90-N93 PolarHBondContact O-N 3.25Å; L91-N93 VanDerWaalsContact C-N 3.32Å; L91-N93 PolarHBondContact O-N 2.92Å; N93-S97 WeakPolarHBondContact O-CB 3.45Å; N93-S97 PolarHBondContact O-OG 2.85Å |
| 94 | E | 87.2 | Confident | 81.3 | Confident | 78 Ų | 78 | 40.5 Ų | 40.5 | 36% | 0.364 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -69.5 | -36.3 | 180 | -179.2 | 66.3 | -159 | 0 | 0 | 112.9 | S90 L91 L92 S97 K98 | S90-E94 PolarHBondContact O-N 3.43Å; L91-E94 PolarHBondContact O-N 2.85Å; L92-E94 PolarHBondContact O-N 3.48Å; E94-S97 PolarHBondContact O-OG 3.36Å; E94-K98 IonicContact OE1-NZ 3.5Å |
| 95 | F | 84.3 | Confident | 81.1 | Confident | 18 Ų | 18 | 41.7 Ų | 41.7 | 8% | 0.079 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -96.5 | -34.2 | -174.5 | -72.5 | -71.3 | 0 | 0 | 0 | 113.7 | L91 L92 S97 K98 K156 L158 | L91-F95 HydrophobicContact CB-CD2 4.43Å; L91-F95 HydrophobicContact CD2-CD2 4.11Å; L91-F95 HydrophobicContact CD2-CE2 3.64Å; L91-F95 WeakPolarHBondContact O-CB 3.38Å; L91-F95 WeakPolarHBondContact O-CD2 3.37Å; L91-F95 PolarHBondContact O-N 3.37Å; L92-F95 PolarHBondContact O-N 3.02Å; F95-S97 VanDerWaalsContact C-N 3.3Å; F95-S97 PolarHBondContact O-N 3.3Å; F95-K98 PolarHBondContact O-N 3.35Å; F95-K156 WeakPolarHBondContact CE1-O 3.31Å; F95-L158 HydrophobicContact CB-CD1 4.27Å; F95-L158 HydrophobicContact CB-CG 4.37Å; F95-L158 HydrophobicContact CD1-CD2 4.3Å; F95-L158 HydrophobicContact CD1-CG 3.92Å; F95-L158 HydrophobicContact CD2-CD2 3.53Å; F95-L158 HydrophobicContact CD2-CG 4.05Å; F95-L158 HydrophobicContact CE1-CD2 4.41Å; F95-L158 HydrophobicContact CE1-CG 4.17Å; F95-L158 HydrophobicContact CE2-CD2 3.7Å; F95-L158 HydrophobicContact CE2-CG 4.33Å; F95-L158 HydrophobicContact CG-CD1 4.3Å; F95-L158 HydrophobicContact CG-CD2 3.87Å; F95-L158 HydrophobicContact CG-CG 3.86Å; F95-L158 HydrophobicContact CZ-CD2 4.15Å; F95-L158 HydrophobicContact CZ-CG 4.39Å |
| 96 | S | 76.7 | Confident | 81.1 | Confident | 26 Ų | 26 | 47 Ų | 47 | 18% | 0.182 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -69.7 | -26.8 | 177 | -70.3 | 0 | 0 | 0 | 0 | 113.2 | L92 K98 G100 | L92-S96 WeakPolarHBondContact CD1-OG 3.46Å; L92-S96 WeakPolarHBondContact O-CB 3.34Å; L92-S96 PolarHBondContact O-N 3.05Å; L92-S96 PolarHBondContact O-OG 3.11Å; S96-K98 PolarHBondContact O-N 2.65Å; S96-G100 PolarHBondContact O-N 3.17Å |
| 97 | S | 60.9 | Low | 81.1 | Confident | 92 Ų | 92 | 46.7 Ų | 46.7 | 64% | 0.643 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -67.9 | -15.7 | 177.9 | 44.8 | 0 | 0 | 0 | 0 | 113.8 | N93 E94 F95 | N93-S97 WeakPolarHBondContact O-CB 3.45Å; N93-S97 PolarHBondContact O-OG 2.85Å; E94-S97 PolarHBondContact O-OG 3.36Å; F95-S97 VanDerWaalsContact C-N 3.3Å; F95-S97 PolarHBondContact O-N 3.3Å |
| 98 | K | 59.9 | Low | 81.1 | Confident | 117 Ų | 117 | 46.6 Ų | 46.6 | 51% | 0.509 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -90.3 | -33.2 | 178.9 | -69.4 | 179.4 | -175 | 161 | 0 | 114 | E94 F95 S96 | E94-K98 IonicContact OE1-NZ 3.5Å; F95-K98 PolarHBondContact O-N 3.35Å; S96-K98 PolarHBondContact O-N 2.65Å |
| 99 | D | 56.8 | Low | 81.2 | Confident | 111 Ų | 111 | 49.9 Ų | 49.9 | 59% | 0.594 | 28% | 0.284 | S | S | * | . | H | α-helix | trans | -113.8 | -7.6 | -169.1 | -67.8 | -26.8 | 0 | 0 | 0 | 114.7 | V101 M103 | D99-V101 PolarHBondContact O-N 2.92Å; D99-V101 VanDerWaalsContact O-N 3.08Å; D99-M103 HydrophobicContact CB-CE 4.08Å |
| 100 | G | 57.1 | Low | 81.4 | Confident | 79 Ų | 79 | 49.5 Ų | 49.5 | 81% | 0.814 | 28% | 0.282 | S | S | * | . | S | Bend | trans | 65.5 | 11.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | S96 | S96-G100 PolarHBondContact O-N 3.17Š|
| 101 | V | 63.9 | Low | 81.6 | Confident | 89 Ų | 89 | 48.2 Ų | 48.2 | 54% | 0.539 | 27% | 0.273 | S | S | . | . | S | Bend | trans | -118.1 | 140.8 | -179.7 | 178.9 | 0 | 0 | 0 | 0 | 109.5 | D99 M103 | D99-V101 PolarHBondContact O-N 2.92Å; D99-V101 VanDerWaalsContact O-N 3.08Å; V101-M103 HydrophobicContact CB-CE 4.17Å; V101-M103 HydrophobicContact CG1-CE 4.45Å; V101-M103 WeakPolarHBondContact O-CG 3.28Å; V101-M103 PolarHBondContact O-N 3.3Å; V101-M103 VanDerWaalsContact O-N 3.13Å |
| 102 | D | 67.7 | Low | 81.8 | Confident | 80 Ų | 80 | 48 Ų | 48 | 43% | 0.428 | 27% | 0.272 | S | S | . | . | trans | -61.1 | 112.9 | 170.4 | -82.7 | -49.1 | 0 | 0 | 0 | 110 | R424 D425 | D102-R424 IonicContact OD1-CZ 3.85Å; D102-R424 IonicContact OD1-NH1 3.56Å; D102-R424 PolarHBondContact OD1-NH1 3.33Å; D102-R424 IonicContact OD1-NH2 3.17Å; D102-R424 PolarHBondContact OD1-NH2 3.25Å; D102-R424 IonicContact OD2-NH2 3.58Å; D102-D425 HydrophobicContact CB-CB 4.47Å | ||
| 103 | M | 83.4 | Confident | 82.2 | Confident | 21 Ų | 21 | 48.8 Ų | 48.8 | 10% | 0.103 | 28% | 0.276 | C | S | . | . | trans | -110.5 | 28.9 | -172.8 | -72.2 | -85.6 | 179.2 | 0 | 0 | 111.5 | D99 V101 S105 K106 T107 | D99-M103 HydrophobicContact CB-CE 4.08Å; V101-M103 HydrophobicContact CB-CE 4.17Å; V101-M103 HydrophobicContact CG1-CE 4.45Å; V101-M103 WeakPolarHBondContact O-CG 3.28Å; V101-M103 PolarHBondContact O-N 3.3Å; V101-M103 VanDerWaalsContact O-N 3.13Å; M103-S105 VanDerWaalsContact C-N 3.33Å; M103-S105 PolarHBondContact O-N 3.39Å; M103-K106 PolarHBondContact O-N 2.85Å; M103-K106 HydrophobicContact SD-CB 4.4Å; M103-K106 HydrophobicContact SD-CD 3.55Å; M103-K106 VanDerWaalsContact SD-CD 3.55Å; M103-K106 HydrophobicContact SD-CG 4.21Å; M103-T107 WeakPolarHBondContact O-CB 3.3Å; M103-T107 PolarHBondContact O-N 2.82Å; M103-T107 PolarHBondContact O-OG1 3.43Å; M103-T107 VanDerWaalsContact O-OG1 3.12Å | ||
| 104 | S | 87.2 | Confident | 82.6 | Confident | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.3 | -43.9 | -172.1 | -41.8 | 0 | 0 | 0 | 0 | 111.7 | Y88 S108 R424 D425 | Y88-S104 WeakPolarHBondContact OH-CA 3.23Å; Y88-S104 VanDerWaalsContact OH-CB 3.26Å; Y88-S104 WeakPolarHBondContact OH-CB 3.09Å; S104-S108 WeakPolarHBondContact O-CB 3.49Å; S104-S108 PolarHBondContact O-N 3.35Å; S104-S108 PolarHBondContact O-OG 3.21Å; S104-R424 WeakPolarHBondContact OG-CD 3.34Å; S104-R424 PolarHBondContact OG-NH1 3.21Å; S104-D425 WeakPolarHBondContact CB-OD1 3.38Å; S104-D425 PolarHBondContact N-OD1 3.45Å; S104-D425 PolarHBondContact N-OD2 3.26Å; S104-D425 PolarHBondContact OG-OD1 2.92Å |
| 105 | S | 91.8 | Very high | 83 | Confident | 27 Ų | 27 | 41.3 Ų | 41.3 | 19% | 0.189 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -58.9 | -53.3 | 177.8 | -170.2 | 0 | 0 | 0 | 0 | 110.8 | M103 T107 S108 F109 P418 D425 | M103-S105 VanDerWaalsContact C-N 3.33Å; M103-S105 PolarHBondContact O-N 3.39Å; S105-T107 PolarHBondContact O-N 3.05Å; S105-S108 PolarHBondContact O-N 3.27Å; S105-S108 PolarHBondContact O-OG 2.88Å; S105-F109 PolarHBondContact O-N 3.29Å; S105-F109 VanDerWaalsContact O-N 3.1Å; S105-P418 PolarHBondContact OG-O 2.89Å; S105-D425 WeakPolarHBondContact CB-OD2 3.36Å; S105-D425 PolarHBondContact N-OD2 3.49Å |
| 106 | K | 91.6 | Very high | 83.6 | Confident | 111 Ų | 111 | 40.5 Ų | 40.5 | 48% | 0.483 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.8 | -46.6 | -179.1 | -67.1 | -163.3 | -163.6 | 166.5 | 0 | 112.4 | M103 S108 F109 L158 Y162 | M103-K106 PolarHBondContact O-N 2.85Å; M103-K106 HydrophobicContact SD-CB 4.4Å; M103-K106 HydrophobicContact SD-CD 3.55Å; M103-K106 VanDerWaalsContact SD-CD 3.55Å; M103-K106 HydrophobicContact SD-CG 4.21Å; K106-S108 PolarHBondContact O-N 2.9Å; K106-F109 WeakPolarHBondContact O-CB 3.26Å; K106-F109 PolarHBondContact O-N 3.33Å; K106-L158 HydrophobicContact CB-CD1 4.21Å; K106-Y162 WeakPolarHBondContact CB-OH 3.49Å; K106-Y162 WeakPolarHBondContact O-CE1 3.34Å; K106-Y162 PolarHBondContact O-OH 2.95Å; K106-Y162 VanDerWaalsContact O-OH 3.11Å |
| 107 | T | 93.3 | Very high | 84.6 | Confident | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -67 | -39 | -179.7 | -57.4 | 0 | 0 | 0 | 0 | 111.9 | Y88 L91 L92 M103 S105 F109 V110 | Y88-T107 HydrophobicContact CD2-CG2 3.7Å; Y88-T107 HydrophobicContact CE2-CG2 3.85Å; L91-T107 HydrophobicContact CB-CG2 3.48Å; L91-T107 VanDerWaalsContact CB-CG2 3.48Å; L92-T107 HydrophobicContact CB-CG2 4.32Å; M103-T107 WeakPolarHBondContact O-CB 3.3Å; M103-T107 PolarHBondContact O-N 2.82Å; M103-T107 PolarHBondContact O-OG1 3.43Å; M103-T107 VanDerWaalsContact O-OG1 3.12Å; S105-T107 PolarHBondContact O-N 3.05Å; T107-F109 PolarHBondContact O-N 3.48Å; T107-V110 PolarHBondContact O-N 3.4Å |
| 108 | S | 94.4 | Very high | 86.2 | Confident | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -68.1 | -24.9 | 177.9 | 69.8 | 0 | 0 | 0 | 0 | 112.9 | S104 S105 K106 V110 G111 S112 H295 P417 P418 | S104-S108 WeakPolarHBondContact O-CB 3.49Å; S104-S108 PolarHBondContact O-N 3.35Å; S104-S108 PolarHBondContact O-OG 3.21Å; S105-S108 PolarHBondContact O-N 3.27Å; S105-S108 PolarHBondContact O-OG 2.88Å; K106-S108 PolarHBondContact O-N 2.9Å; S108-V110 VanDerWaalsContact C-N 3.27Å; S108-V110 PolarHBondContact O-N 2.89Å; S108-G111 PolarHBondContact O-N 3.46Å; S108-S112 PolarHBondContact O-N 3.34Å; S108-S112 PolarHBondContact O-OG 3.28Å; S108-H295 VanDerWaalsContact CB-CE1 3.42Å; S108-H295 WeakPolarHBondContact CB-CE1 3.47Å; S108-P417 PolarHBondContact OG-O 3.15Å; S108-P418 WeakPolarHBondContact OG-CA 3.17Å |
| 109 | F | 96.1 | Very high | 87.9 | Confident | 69 Ų | 69 | 31.6 Ų | 31.6 | 30% | 0.303 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -63 | -30.8 | 176.1 | -169.7 | -123.8 | 0 | 0 | 0 | 113 | S105 K106 T107 G111 S112 L113 Y162 V414 P418 | S105-F109 PolarHBondContact O-N 3.29Å; S105-F109 VanDerWaalsContact O-N 3.1Å; K106-F109 WeakPolarHBondContact O-CB 3.26Å; K106-F109 PolarHBondContact O-N 3.33Å; T107-F109 PolarHBondContact O-N 3.48Å; F109-G111 PolarHBondContact O-N 2.9Å; F109-S112 WeakPolarHBondContact CA-OG 3.17Å; F109-S112 PolarHBondContact O-OG 3.13Å; F109-L113 HydrophobicContact CE1-CD2 4.15Å; F109-L113 HydrophobicContact CZ-CD1 4.35Å; F109-L113 HydrophobicContact CZ-CD2 4.43Å; F109-L113 WeakPolarHBondContact O-CB 3.15Å; F109-L113 PolarHBondContact O-N 3.04Å; F109-Y162 HydrophobicContact CB-CE1 4.05Å; F109-Y162 AromaticContact CD1-CD1 3.78Å; F109-Y162 HydrophobicContact CD1-CD1 3.78Å; F109-Y162 HydrophobicContact CD1-CD2 4.46Å; F109-Y162 AromaticContact CD1-CE1 3.64Å; F109-Y162 HydrophobicContact CD1-CE1 3.64Å; F109-Y162 HydrophobicContact CD1-CE2 4.36Å; F109-Y162 HydrophobicContact CD1-CG 4.23Å; F109-Y162 AromaticContact CD1-CZ 3.96Å; F109-Y162 HydrophobicContact CE1-CD1 4.47Å; F109-Y162 HydrophobicContact CG-CE1 4.31Å; F109-V414 HydrophobicContact CD2-CG1 4.22Å; F109-V414 HydrophobicContact CE2-CG1 3.53Å; F109-V414 HydrophobicContact CZ-CG1 4.42Å; F109-P418 HydrophobicContact CB-CG 4.01Å; F109-P418 HydrophobicContact CD2-CB 4.38Å; F109-P418 HydrophobicContact CD2-CG 3.55Å; F109-P418 HydrophobicContact CE2-CG 4.5Å; F109-P418 HydrophobicContact CG-CG 4.25Å |
| 110 | V | 96.1 | Very high | 89.7 | Confident | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -57.3 | -51.3 | 176.7 | 178.3 | 0 | 0 | 0 | 0 | 111.1 | F84 T107 S108 S114 L158 M161 Y162 Y165 | F84-V110 HydrophobicContact CE2-CG1 4.26Å; F84-V110 HydrophobicContact CZ-CB 4.05Å; F84-V110 HydrophobicContact CZ-CG1 4.29Å; T107-V110 PolarHBondContact O-N 3.4Å; S108-V110 VanDerWaalsContact C-N 3.27Å; S108-V110 PolarHBondContact O-N 2.89Å; V110-S114 WeakPolarHBondContact O-CB 3.41Å; V110-S114 PolarHBondContact O-N 3.18Å; V110-S114 VanDerWaalsContact O-N 3.16Å; V110-L158 HydrophobicContact CG2-CD2 4.13Å; V110-M161 HydrophobicContact CG1-CG 3.82Å; V110-M161 HydrophobicContact CG1-SD 4.2Å; V110-M161 HydrophobicContact CG2-CG 4.42Å; V110-Y162 HydrophobicContact CB-CD1 4.4Å; V110-Y162 HydrophobicContact CB-CE1 4.48Å; V110-Y162 HydrophobicContact CG2-CD1 3.64Å; V110-Y162 HydrophobicContact CG2-CE1 3.48Å; V110-Y162 VanDerWaalsContact CG2-CE1 3.48Å; V110-Y165 HydrophobicContact CG1-CD1 3.6Å; V110-Y165 HydrophobicContact CG1-CE1 4.38Å; V110-Y165 HydrophobicContact CG1-CG 4.09Å |
| 111 | G | 94.9 | Very high | 91.3 | Very high | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -75.4 | -38.8 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q81 F84 S108 F109 S114 M115 | Q81-G111 PolarHBondContact NE2-O 3.45Å; F84-G111 VanDerWaalsContact CE1-CA 3.41Å; F84-G111 VanDerWaalsContact CE2-CA 3.49Å; S108-G111 PolarHBondContact O-N 3.46Å; F109-G111 PolarHBondContact O-N 2.9Å; G111-S114 WeakPolarHBondContact O-CB 3.12Å; G111-S114 PolarHBondContact O-N 3.35Å; G111-M115 PolarHBondContact O-N 2.82Å |
| 112 | S | 96.7 | Very high | 92.5 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -67.5 | -40 | 178.6 | 77.5 | 0 | 0 | 0 | 0 | 112.1 | S108 F109 S114 M115 G116 M413 V414 P418 | S108-S112 PolarHBondContact O-N 3.34Å; S108-S112 PolarHBondContact O-OG 3.28Å; F109-S112 WeakPolarHBondContact CA-OG 3.17Å; F109-S112 PolarHBondContact O-OG 3.13Å; S112-S114 VanDerWaalsContact C-N 3.31Å; S112-S114 PolarHBondContact O-N 3.33Å; S112-M115 PolarHBondContact O-N 3.44Å; S112-G116 PolarHBondContact O-N 3.26Å; S112-M413 WeakPolarHBondContact CB-O 3.37Å; S112-V414 VanDerWaalsContact CB-O 3.27Å; S112-V414 WeakPolarHBondContact CB-O 3.46Å; S112-V414 PolarHBondContact OG-O 3.1Å; S112-P418 WeakPolarHBondContact OG-CD 3.38Å; S112-P418 WeakPolarHBondContact OG-CG 3.36Å |
| 113 | L | 97.5 | Very high | 93.2 | Very high | 21 Ų | 21 | 21.3 Ų | 21.3 | 11% | 0.11 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -59.3 | -44.4 | 171.3 | -177.2 | 61.3 | 0 | 0 | 0 | 110.4 | F109 G116 M117 I167 | F109-L113 HydrophobicContact CE1-CD2 4.15Å; F109-L113 HydrophobicContact CZ-CD1 4.35Å; F109-L113 HydrophobicContact CZ-CD2 4.43Å; F109-L113 WeakPolarHBondContact O-CB 3.15Å; F109-L113 PolarHBondContact O-N 3.04Å; L113-G116 PolarHBondContact O-N 3.34Å; L113-M117 HydrophobicContact CD1-CG 4Å; L113-M117 HydrophobicContact CG-CG 4.29Å; L113-M117 VanDerWaalsContact O-CB 3.3Å; L113-M117 WeakPolarHBondContact O-CB 3.09Å; L113-M117 VanDerWaalsContact O-CG 3.24Å; L113-M117 WeakPolarHBondContact O-CG 3.39Å; L113-M117 PolarHBondContact O-N 3.41Å; L113-I167 HydrophobicContact CD2-CG1 4.16Å; L113-I167 HydrophobicContact CG-CG1 4.48Å |
| 114 | S | 97.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 23.8 Ų | 23.8 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -59.9 | -51.7 | 177.6 | -158.5 | 0 | 0 | 0 | 0 | 112.6 | Q81 V110 G111 S112 G116 M117 I118 Y165 G166 A170 | Q81-S114 PolarHBondContact OE1-OG 3.23Å; V110-S114 WeakPolarHBondContact O-CB 3.41Å; V110-S114 PolarHBondContact O-N 3.18Å; V110-S114 VanDerWaalsContact O-N 3.16Å; G111-S114 WeakPolarHBondContact O-CB 3.12Å; G111-S114 PolarHBondContact O-N 3.35Å; S112-S114 VanDerWaalsContact C-N 3.31Å; S112-S114 PolarHBondContact O-N 3.33Å; S114-G116 VanDerWaalsContact C-N 3.33Å; S114-G116 PolarHBondContact O-N 2.8Å; S114-M117 PolarHBondContact O-N 3.37Å; S114-I118 WeakPolarHBondContact O-CG1 3.48Å; S114-I118 PolarHBondContact O-N 3.27Å; S114-I118 VanDerWaalsContact O-N 3.09Å; S114-Y165 PolarHBondContact OG-O 3.26Å; S114-G166 WeakPolarHBondContact CA-O 3.39Å; S114-A170 VanDerWaalsContact O-CB 3.25Å; S114-A170 WeakPolarHBondContact O-CB 3.36Å |
| 115 | M | 96.1 | Very high | 93.5 | Very high | 7 Ų | 7 | 23.8 Ų | 23.8 | 3% | 0.034 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -59.9 | -44 | 176.8 | -172.3 | 57.4 | 153.8 | 0 | 0 | 112 | F78 Q81 G111 S112 I118 F119 Y290 M413 | F78-M115 HydrophobicContact CD1-CE 3.98Å; F78-M115 HydrophobicContact CD1-SD 4.46Å; F78-M115 HydrophobicContact CE1-CE 3.85Å; F78-M115 HydrophobicContact CE1-SD 4.25Å; Q81-M115 HydrophobicContact CB-SD 4.34Å; Q81-M115 HydrophobicContact CG-CB 3.86Å; Q81-M115 HydrophobicContact CG-CE 4.41Å; Q81-M115 HydrophobicContact CG-CG 4.1Å; Q81-M115 HydrophobicContact CG-SD 3.33Å; Q81-M115 WeakPolarHBondContact CG-SD 3.26Å; G111-M115 PolarHBondContact O-N 2.82Å; S112-M115 PolarHBondContact O-N 3.44Å; M115-I118 PolarHBondContact O-N 3.42Å; M115-F119 HydrophobicContact CE-CE2 3.64Å; M115-F119 HydrophobicContact CE-CZ 3.87Å; M115-F119 HydrophobicContact CG-CD2 4.43Å; M115-F119 HydrophobicContact CG-CE2 4.08Å; M115-F119 WeakPolarHBondContact O-CD2 3.27Å; M115-F119 PolarHBondContact O-N 3.1Å; M115-F119 HydrophobicContact SD-CD2 4.48Å; M115-F119 HydrophobicContact SD-CE2 3.82Å; M115-F119 HydrophobicContact SD-CZ 4.31Å; M115-Y290 HydrophobicContact CB-CD1 4.38Å; M115-Y290 HydrophobicContact CB-CE1 3.9Å; M115-Y290 HydrophobicContact CG-CE1 4.33Å; M115-Y290 HydrophobicContact CG-CE2 4.31Å; M115-M413 HydrophobicContact CG-CB 4.24Å; M115-M413 HydrophobicContact CG-CG 4.3Å; M115-M413 HydrophobicContact CG-SD 4.24Å |
| 116 | G | 96.4 | Very high | 93 | Very high | 1 Ų | 1 | 23.2 Ų | 23.2 | 1% | 0.01 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -64.7 | -41.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | S112 L113 S114 I118 F119 F120 S410 | S112-G116 PolarHBondContact O-N 3.26Å; L113-G116 PolarHBondContact O-N 3.34Å; S114-G116 VanDerWaalsContact C-N 3.33Å; S114-G116 PolarHBondContact O-N 2.8Å; G116-I118 VanDerWaalsContact C-N 3.34Å; G116-I118 PolarHBondContact O-N 3.27Å; G116-F119 PolarHBondContact O-N 3.44Å; G116-F120 WeakPolarHBondContact O-CB 2.89Å; G116-F120 PolarHBondContact O-N 3.31Å; G116-S410 WeakPolarHBondContact O-CB 3.46Å |
| 117 | M | 96.9 | Very high | 92.5 | Very high | 32 Ų | 32 | 19 Ų | 19 | 16% | 0.158 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -65.5 | -35.4 | 177.5 | -76.5 | -55.5 | -55.9 | 0 | 0 | 112.4 | L113 S114 F119 F120 C121 G166 I167 A170 | L113-M117 HydrophobicContact CD1-CG 4Å; L113-M117 HydrophobicContact CG-CG 4.29Å; L113-M117 VanDerWaalsContact O-CB 3.3Å; L113-M117 WeakPolarHBondContact O-CB 3.09Å; L113-M117 VanDerWaalsContact O-CG 3.24Å; L113-M117 WeakPolarHBondContact O-CG 3.39Å; L113-M117 PolarHBondContact O-N 3.41Å; S114-M117 PolarHBondContact O-N 3.37Å; M117-F119 VanDerWaalsContact C-N 3.27Å; M117-F119 PolarHBondContact O-N 3.34Å; M117-F120 HydrophobicContact CE-CD1 4.11Å; M117-F120 PolarHBondContact O-N 2.75Å; M117-F120 HydrophobicContact SD-CD1 4.26Å; M117-C121 WeakPolarHBondContact O-CB 3.27Å; M117-C121 PolarHBondContact O-N 3.05Å; M117-C121 VanDerWaalsContact O-N 3.1Å; M117-G166 WeakPolarHBondContact CB-O 3.35Å; M117-G166 WeakPolarHBondContact CG-O 3.4Å; M117-I167 HydrophobicContact CE-CG2 4.38Å; M117-I167 HydrophobicContact CG-CG1 4.34Å; M117-A170 HydrophobicContact CB-CB 3.53Å |
| 118 | I | 95.9 | Very high | 92.1 | Very high | 1 Ų | 1 | 22.9 Ų | 22.9 | 1% | 0.005 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -55 | -45.7 | 173.2 | -71.2 | 167.2 | 0 | 0 | 0 | 110.6 | V77 Q81 S114 M115 G116 S122 A170 C173 S174 | V77-I118 HydrophobicContact CG1-CD1 4.01Å; Q81-I118 HydrophobicContact CG-CD1 4.44Å; S114-I118 WeakPolarHBondContact O-CG1 3.48Å; S114-I118 PolarHBondContact O-N 3.27Å; S114-I118 VanDerWaalsContact O-N 3.09Å; M115-I118 PolarHBondContact O-N 3.42Å; G116-I118 VanDerWaalsContact C-N 3.34Å; G116-I118 PolarHBondContact O-N 3.27Å; I118-S122 PolarHBondContact O-OG 3.48Å; I118-A170 HydrophobicContact CG1-CB 4.05Å; I118-A170 WeakPolarHBondContact CG1-O 3.24Å; I118-C173 HydrophobicContact CD1-CB 4.04Å; I118-C173 HydrophobicContact CG1-CB 3.95Å; I118-S174 VanDerWaalsContact O-CB 3.27Å; I118-S174 WeakPolarHBondContact O-CB 3.38Å; I118-S174 PolarHBondContact O-OG 3.01Å |
| 119 | F | 94 | Very high | 91.7 | Very high | 14 Ų | 14 | 23.1 Ų | 23.1 | 6% | 0.061 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -81.5 | -35.5 | -179.4 | -66.6 | -50.5 | 0 | 0 | 0 | 114 | F78 M115 G116 M117 C121 S122 L406 M413 | F78-F119 HydrophobicContact CE1-CE1 4.15Å; F78-F119 AromaticContact CE1-CZ 3.84Å; F78-F119 HydrophobicContact CE1-CZ 3.84Å; F78-F119 HydrophobicContact CZ-CE1 4.03Å; F78-F119 HydrophobicContact CZ-CZ 4.18Å; M115-F119 HydrophobicContact CE-CE2 3.64Å; M115-F119 HydrophobicContact CE-CZ 3.87Å; M115-F119 HydrophobicContact CG-CD2 4.43Å; M115-F119 HydrophobicContact CG-CE2 4.08Å; M115-F119 WeakPolarHBondContact O-CD2 3.27Å; M115-F119 PolarHBondContact O-N 3.1Å; M115-F119 HydrophobicContact SD-CD2 4.48Å; M115-F119 HydrophobicContact SD-CE2 3.82Å; M115-F119 HydrophobicContact SD-CZ 4.31Å; G116-F119 PolarHBondContact O-N 3.44Å; M117-F119 VanDerWaalsContact C-N 3.27Å; M117-F119 PolarHBondContact O-N 3.34Å; F119-C121 VanDerWaalsContact C-N 3.27Å; F119-C121 PolarHBondContact O-N 2.95Å; F119-S122 WeakPolarHBondContact O-CB 3.19Å; F119-S122 PolarHBondContact O-N 3.16Å; F119-S122 VanDerWaalsContact O-N 3.13Å; F119-S122 PolarHBondContact O-OG 2.97Å; F119-L406 HydrophobicContact CB-CB 4.37Å; F119-L406 WeakPolarHBondContact CB-O 3.37Å; F119-L406 HydrophobicContact CD1-CB 4.03Å; F119-L406 HydrophobicContact CD1-CD1 4.28Å; F119-L406 HydrophobicContact CD1-CD2 3.75Å; F119-L406 HydrophobicContact CD1-CG 4.22Å; F119-L406 HydrophobicContact CE1-CD2 3.74Å; F119-M413 HydrophobicContact CD2-CG 4.04Å; F119-M413 HydrophobicContact CE2-CG 4.11Å |
| 120 | F | 94.7 | Very high | 90.9 | Very high | 112 Ų | 112 | 24.5 Ų | 24.5 | 49% | 0.491 | 12% | 0.123 | S | C | . | . | H | α-helix | trans | -60.4 | -39.5 | 178.4 | -179.5 | -104.2 | 0 | 0 | 0 | 111.4 | G116 M117 S122 P123 | G116-F120 WeakPolarHBondContact O-CB 2.89Å; G116-F120 PolarHBondContact O-N 3.31Å; M117-F120 HydrophobicContact CE-CD1 4.11Å; M117-F120 PolarHBondContact O-N 2.75Å; M117-F120 HydrophobicContact SD-CD1 4.26Å; F120-S122 VanDerWaalsContact C-N 3.31Å; F120-S122 PolarHBondContact O-N 2.93Å; F120-P123 WeakPolarHBondContact O-CD 3.44Å |
| 121 | C | 92.3 | Very high | 90.2 | Very high | 8 Ų | 8 | 28.6 Ų | 28.6 | 5% | 0.054 | 14% | 0.144 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.5 | -14.9 | 178.5 | -72.9 | 0 | 0 | 0 | 0 | 113.9 | M117 F119 I124 V125 S174 | M117-C121 WeakPolarHBondContact O-CB 3.27Å; M117-C121 PolarHBondContact O-N 3.05Å; M117-C121 VanDerWaalsContact O-N 3.1Å; F119-C121 VanDerWaalsContact C-N 3.27Å; F119-C121 PolarHBondContact O-N 2.95Å; C121-I124 WeakPolarHBondContact O-CA 3.33Å; C121-I124 WeakPolarHBondContact O-CB 3.45Å; C121-I124 PolarHBondContact O-N 2.94Å; C121-V125 HydrophobicContact CB-CG2 4.34Å; C121-V125 WeakPolarHBondContact O-CG2 3.46Å; C121-V125 PolarHBondContact O-N 3.45Å; C121-S174 WeakPolarHBondContact CB-OG 3.49Å |
| 122 | S | 87.5 | Confident | 89.8 | Confident | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -53.2 | -43.5 | -172.5 | -57.2 | 0 | 0 | 0 | 0 | 114.9 | I118 F119 F120 I124 V125 S126 | I118-S122 PolarHBondContact O-OG 3.48Å; F119-S122 WeakPolarHBondContact O-CB 3.19Å; F119-S122 PolarHBondContact O-N 3.16Å; F119-S122 VanDerWaalsContact O-N 3.13Å; F119-S122 PolarHBondContact O-OG 2.97Å; F120-S122 VanDerWaalsContact C-N 3.31Å; F120-S122 PolarHBondContact O-N 2.93Å; S122-I124 VanDerWaalsContact C-N 3.35Å; S122-I124 PolarHBondContact O-N 2.88Å; S122-V125 PolarHBondContact O-N 2.83Å; S122-S126 PolarHBondContact O-N 3.3Å; S122-S126 VanDerWaalsContact O-N 3.09Å |
| 123 | P | 83.6 | Confident | 89.3 | Confident | 23 Ų | 23 | 34.8 Ų | 34.8 | 15% | 0.149 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.8 | -37.9 | 175.3 | -20.6 | 32.6 | 0 | 0 | 0 | 113.3 | F120 S126 I127 F265 G403 | F120-P123 WeakPolarHBondContact O-CD 3.44Å; P123-S126 WeakPolarHBondContact O-CB 3.29Å; P123-S126 PolarHBondContact O-N 2.7Å; P123-I127 PolarHBondContact O-N 2.84Å; P123-F265 HydrophobicContact CB-CE1 4.11Å; P123-G403 WeakPolarHBondContact CG-O 3.35Å |
| 124 | I | 88 | Confident | 88.9 | Confident | 74 Ų | 74 | 34 Ų | 34 | 38% | 0.379 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -66.5 | -44.4 | 178.3 | -58.1 | 170.9 | 0 | 0 | 0 | 109.3 | C121 S122 S126 I127 F128 F175 | C121-I124 WeakPolarHBondContact O-CA 3.33Å; C121-I124 WeakPolarHBondContact O-CB 3.45Å; C121-I124 PolarHBondContact O-N 2.94Å; S122-I124 VanDerWaalsContact C-N 3.35Å; S122-I124 PolarHBondContact O-N 2.88Å; I124-S126 VanDerWaalsContact C-N 3.27Å; I124-S126 PolarHBondContact O-N 3.43Å; I124-I127 WeakPolarHBondContact O-CB 3.34Å; I124-I127 PolarHBondContact O-N 3.19Å; I124-I127 VanDerWaalsContact O-N 3.12Å; I124-F128 HydrophobicContact CG2-CD2 4Å; I124-F128 HydrophobicContact CG2-CE2 3.96Å; I124-F128 WeakPolarHBondContact O-CD2 3.26Å; I124-F128 PolarHBondContact O-N 3.2Å; I124-F128 VanDerWaalsContact O-N 3.12Å; I124-F175 HydrophobicContact CG2-CZ 4.24Å |
| 125 | V | 87.9 | Confident | 88.8 | Confident | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.8 | -38.2 | 178 | -175.8 | 0 | 0 | 0 | 0 | 111.4 | C121 S122 I127 F128 T129 T137 F175 Q178 P179 | C121-V125 HydrophobicContact CB-CG2 4.34Å; C121-V125 WeakPolarHBondContact O-CG2 3.46Å; C121-V125 PolarHBondContact O-N 3.45Å; S122-V125 PolarHBondContact O-N 2.83Å; V125-I127 VanDerWaalsContact C-N 3.3Å; V125-I127 PolarHBondContact O-N 3.33Å; V125-F128 PolarHBondContact O-N 3.48Å; V125-T129 WeakPolarHBondContact O-CB 3.38Å; V125-T129 PolarHBondContact O-N 3.38Å; V125-T129 PolarHBondContact O-OG1 2.87Å; V125-T137 HydrophobicContact CG1-CG2 3.92Å; V125-F175 HydrophobicContact CG1-CD1 4.39Å; V125-F175 HydrophobicContact CG1-CG 4.35Å; V125-F175 HydrophobicContact CG2-CB 4.32Å; V125-F175 HydrophobicContact CG2-CD1 4.19Å; V125-F175 HydrophobicContact CG2-CD2 3.39Å; V125-F175 HydrophobicContact CG2-CE1 4.36Å; V125-F175 HydrophobicContact CG2-CE2 3.6Å; V125-F175 HydrophobicContact CG2-CG 3.71Å; V125-F175 HydrophobicContact CG2-CZ 4.09Å; V125-Q178 HydrophobicContact CB-CB 3.99Å; V125-Q178 HydrophobicContact CB-CG 4.36Å; V125-Q178 HydrophobicContact CG1-CB 3.49Å; V125-Q178 VanDerWaalsContact CG1-CB 3.49Å; V125-Q178 HydrophobicContact CG1-CG 4.16Å; V125-P179 HydrophobicContact CG1-CG 4.23Å |
| 126 | S | 80.8 | Confident | 88.8 | Confident | 15 Ų | 15 | 43.3 Ų | 43.3 | 11% | 0.105 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -56.9 | -44.8 | 175.7 | -167.8 | 0 | 0 | 0 | 0 | 111.5 | S122 P123 I124 T129 D130 | S122-S126 PolarHBondContact O-N 3.3Å; S122-S126 VanDerWaalsContact O-N 3.09Å; P123-S126 WeakPolarHBondContact O-CB 3.29Å; P123-S126 PolarHBondContact O-N 2.7Å; I124-S126 VanDerWaalsContact C-N 3.27Å; I124-S126 PolarHBondContact O-N 3.43Å; S126-T129 WeakPolarHBondContact O-CB 3.3Å; S126-T129 PolarHBondContact O-N 3.17Å; S126-D130 PolarHBondContact O-N 3.45Å |
| 127 | I | 81.9 | Confident | 88.7 | Confident | 21 Ų | 21 | 43.6 Ų | 43.6 | 11% | 0.108 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.5 | -46.6 | 177.8 | -64.7 | 169.5 | 0 | 0 | 0 | 110.8 | P123 I124 V125 T129 D130 I131 L264 F265 | P123-I127 PolarHBondContact O-N 2.84Å; I124-I127 WeakPolarHBondContact O-CB 3.34Å; I124-I127 PolarHBondContact O-N 3.19Å; I124-I127 VanDerWaalsContact O-N 3.12Å; V125-I127 VanDerWaalsContact C-N 3.3Å; V125-I127 PolarHBondContact O-N 3.33Å; I127-T129 VanDerWaalsContact C-N 3.28Å; I127-T129 PolarHBondContact O-N 3.49Å; I127-D130 PolarHBondContact O-N 3.48Å; I127-I131 HydrophobicContact CG2-CD1 3.69Å; I127-I131 VanDerWaalsContact O-CG1 3.31Å; I127-I131 WeakPolarHBondContact O-CG1 3.32Å; I127-I131 PolarHBondContact O-N 3.47Å; I127-I131 VanDerWaalsContact O-N 3.08Å; I127-L264 HydrophobicContact CD1-CB 4.35Å; I127-L264 HydrophobicContact CD1-CD1 4.2Å; I127-L264 HydrophobicContact CG1-CB 4.24Å; I127-L264 HydrophobicContact CG1-CD1 4.22Å; I127-L264 HydrophobicContact CG2-CD1 3.7Å; I127-L264 HydrophobicContact CG2-CD2 4.48Å; I127-F265 HydrophobicContact CD1-CE1 4.32Å; I127-F265 HydrophobicContact CD1-CE2 3.94Å; I127-F265 HydrophobicContact CD1-CZ 3.68Å |
| 128 | F | 85.4 | Confident | 88.6 | Confident | 83 Ų | 83 | 42.2 Ų | 42.2 | 36% | 0.364 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -64.3 | -35.5 | 178.6 | -86.8 | -107.7 | 0 | 0 | 0 | 112.2 | I124 V125 D130 I131 F132 T137 F175 | I124-F128 HydrophobicContact CG2-CD2 4Å; I124-F128 HydrophobicContact CG2-CE2 3.96Å; I124-F128 WeakPolarHBondContact O-CD2 3.26Å; I124-F128 PolarHBondContact O-N 3.2Å; I124-F128 VanDerWaalsContact O-N 3.12Å; V125-F128 PolarHBondContact O-N 3.48Å; F128-D130 VanDerWaalsContact C-N 3.33Å; F128-I131 PolarHBondContact O-N 3.05Å; F128-F132 HydrophobicContact CB-CD2 4.28Å; F128-F132 AromaticContact CD1-CD2 3.6Å; F128-F132 HydrophobicContact CD1-CD2 3.6Å; F128-F132 AromaticContact CD1-CE2 3.42Å; F128-F132 HydrophobicContact CD1-CE2 3.42Å; F128-F132 VanDerWaalsContact CD1-CE2 3.42Å; F128-F132 HydrophobicContact CE1-CD2 4.32Å; F128-F132 AromaticContact CE1-CE2 3.69Å; F128-F132 HydrophobicContact CE1-CE2 3.69Å; F128-F132 HydrophobicContact CG-CD2 4.25Å; F128-F132 HydrophobicContact CG-CE2 4.25Å; F128-F132 WeakPolarHBondContact O-CB 3.35Å; F128-F132 WeakPolarHBondContact O-CD2 3.19Å; F128-F132 PolarHBondContact O-N 3.36Å; F128-T137 HydrophobicContact CB-CG2 4.15Å; F128-T137 PolarHBondContact O-OG1 3.26Å; F128-F175 HydrophobicContact CB-CE1 3.92Å; F128-F175 AromaticContact CD1-CE1 3.92Å; F128-F175 HydrophobicContact CD1-CE1 3.92Å; F128-F175 HydrophobicContact CD2-CE1 4.22Å; F128-F175 HydrophobicContact CD2-CZ 4.33Å; F128-F175 AromaticContact CG-CE1 3.76Å; F128-F175 HydrophobicContact CG-CE1 3.76Å; F128-F175 HydrophobicContact CG-CZ 4.32Å |
| 129 | T | 85.6 | Confident | 88.7 | Confident | 5 Ų | 5 | 43.3 Ų | 43.3 | 3% | 0.031 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.2 | -39 | 176.3 | -55.8 | 0 | 0 | 0 | 0 | 111.1 | V125 S126 I127 G133 C134 P179 V182 | V125-T129 WeakPolarHBondContact O-CB 3.38Å; V125-T129 PolarHBondContact O-N 3.38Å; V125-T129 PolarHBondContact O-OG1 2.87Å; S126-T129 WeakPolarHBondContact O-CB 3.3Å; S126-T129 PolarHBondContact O-N 3.17Å; I127-T129 VanDerWaalsContact C-N 3.28Å; I127-T129 PolarHBondContact O-N 3.49Å; T129-G133 CarbonylContact O-C 3.51Å; T129-G133 WeakPolarHBondContact O-CA 3.09Å; T129-G133 PolarHBondContact O-N 3.29Å; T129-C134 HydrophobicContact CG2-CB 4.31Å; T129-P179 HydrophobicContact CG2-CB 4.11Å; T129-P179 HydrophobicContact CG2-CG 4.45Å; T129-V182 HydrophobicContact CG2-CB 4.44Å; T129-V182 HydrophobicContact CG2-CG1 4.32Å |
| 130 | D | 79.1 | Confident | 88.9 | Confident | 98 Ų | 98 | 44.4 Ų | 44.4 | 52% | 0.524 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -69.2 | -34.8 | 177 | -70.6 | -22.4 | 0 | 0 | 0 | 112.3 | S126 I127 F128 | S126-D130 PolarHBondContact O-N 3.45Å; I127-D130 PolarHBondContact O-N 3.48Å; F128-D130 VanDerWaalsContact C-N 3.33Å |
| 131 | I | 81.9 | Confident | 89 | Confident | 85 Ų | 85 | 39.1 Ų | 39.1 | 44% | 0.436 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -81.7 | -51.7 | -177.9 | -64.4 | 167 | 0 | 0 | 0 | 112 | I127 F128 F259 | I127-I131 HydrophobicContact CG2-CD1 3.69Å; I127-I131 VanDerWaalsContact O-CG1 3.31Å; I127-I131 WeakPolarHBondContact O-CG1 3.32Å; I127-I131 PolarHBondContact O-N 3.47Å; I127-I131 VanDerWaalsContact O-N 3.08Å; F128-I131 PolarHBondContact O-N 3.05Å; I131-F259 HydrophobicContact CD1-CE2 3.84Å; I131-F259 HydrophobicContact CD1-CZ 4.41Å |
| 132 | F | 85.4 | Confident | 89.3 | Confident | 106 Ų | 106 | 38.8 Ų | 38.8 | 47% | 0.465 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -98.6 | -9.4 | -171.5 | -59.8 | -69.5 | 0 | 0 | 0 | 113.2 | F128 I136 | F128-F132 HydrophobicContact CB-CD2 4.28Å; F128-F132 AromaticContact CD1-CD2 3.6Å; F128-F132 HydrophobicContact CD1-CD2 3.6Å; F128-F132 AromaticContact CD1-CE2 3.42Å; F128-F132 HydrophobicContact CD1-CE2 3.42Å; F128-F132 VanDerWaalsContact CD1-CE2 3.42Å; F128-F132 HydrophobicContact CE1-CD2 4.32Å; F128-F132 AromaticContact CE1-CE2 3.69Å; F128-F132 HydrophobicContact CE1-CE2 3.69Å; F128-F132 HydrophobicContact CG-CD2 4.25Å; F128-F132 HydrophobicContact CG-CE2 4.25Å; F128-F132 WeakPolarHBondContact O-CB 3.35Å; F128-F132 WeakPolarHBondContact O-CD2 3.19Å; F128-F132 PolarHBondContact O-N 3.36Å; F132-I136 HydrophobicContact CB-CB 4.3Å; F132-I136 HydrophobicContact CB-CG2 4.28Å |
| 133 | G | 87.5 | Confident | 89.8 | Confident | 24 Ų | 24 | 40.6 Ų | 40.6 | 25% | 0.247 | 22% | 0.223 | C | C | . | . | trans | 80.2 | 159.6 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | T129 R135 I136 T137 | T129-G133 CarbonylContact O-C 3.51Å; T129-G133 WeakPolarHBondContact O-CA 3.09Å; T129-G133 PolarHBondContact O-N 3.29Å; G133-R135 VanDerWaalsContact C-N 3.32Å; G133-R135 PolarHBondContact O-N 3.04Å; G133-I136 PolarHBondContact O-N 3.23Å; G133-T137 PolarHBondContact O-N 2.53Å; G133-T137 PolarHBondContact O-OG1 3.38Å | ||
| 134 | C | 89.3 | Confident | 90.5 | Very high | 4 Ų | 4 | 42.9 Ų | 42.9 | 3% | 0.027 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.2 | -34.6 | -169.7 | -49.1 | 0 | 0 | 0 | 0 | 114.6 | T129 A138 P179 I183 | T129-C134 HydrophobicContact CG2-CB 4.31Å; C134-A138 WeakPolarHBondContact O-CB 2.99Å; C134-A138 PolarHBondContact O-N 3.32Å; C134-P179 HydrophobicContact CB-CB 3.85Å; C134-P179 WeakPolarHBondContact O-CB 3.18Å; C134-I183 HydrophobicContact CB-CB 4.18Å; C134-I183 HydrophobicContact CB-CD1 4.23Å |
| 135 | R | 95 | Very high | 91 | Very high | 93 Ų | 93 | 39.3 Ų | 39.3 | 35% | 0.351 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -65.8 | -53.3 | -177.5 | -175.7 | -176.8 | -65.9 | -171.9 | -7.9 | 111.9 | G133 A138 V139 Y244 | G133-R135 VanDerWaalsContact C-N 3.32Å; G133-R135 PolarHBondContact O-N 3.04Å; R135-A138 PolarHBondContact O-N 3.13Å; R135-V139 HydrophobicContact CG-CG2 4.41Å; R135-V139 WeakPolarHBondContact O-CB 3.46Å; R135-V139 VanDerWaalsContact O-CG2 3.3Å; R135-V139 WeakPolarHBondContact O-CG2 3.31Å; R135-V139 PolarHBondContact O-N 2.96Å; R135-Y244 WeakPolarHBondContact CB-O 3.34Å; R135-Y244 PolarHBondContact NE-O 2.93Å; R135-Y244 PolarHBondContact NH2-O 3.32Å |
| 136 | I | 94.6 | Very high | 91.5 | Very high | 110 Ų | 110 | 40.9 Ų | 40.9 | 56% | 0.564 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -65.1 | -45.1 | -174.5 | -61.6 | -179.9 | 0 | 0 | 0 | 109.4 | F132 G133 A138 G140 | F132-I136 HydrophobicContact CB-CB 4.3Å; F132-I136 HydrophobicContact CB-CG2 4.28Å; G133-I136 PolarHBondContact O-N 3.23Å; I136-A138 PolarHBondContact O-N 3.43Å; I136-G140 PolarHBondContact O-N 3.49Å |
| 137 | T | 94.7 | Very high | 92.3 | Very high | 8 Ų | 8 | 44.5 Ų | 44.5 | 5% | 0.049 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -60.4 | -45.5 | 177.7 | -49.2 | 0 | 0 | 0 | 0 | 111.7 | V125 F128 G133 G141 F175 P179 | V125-T137 HydrophobicContact CG1-CG2 3.92Å; F128-T137 HydrophobicContact CB-CG2 4.15Å; F128-T137 PolarHBondContact O-OG1 3.26Å; G133-T137 PolarHBondContact O-N 2.53Å; G133-T137 PolarHBondContact O-OG1 3.38Å; T137-G141 PolarHBondContact O-N 3.17Å; T137-F175 CarbonylContact C-O 3.55Å; T137-F175 HydrophobicContact CG2-CD1 3.77Å; T137-F175 HydrophobicContact CG2-CE1 4.43Å; T137-P179 HydrophobicContact CG2-CG 3.7Å |
| 138 | A | 96.3 | Very high | 93.1 | Very high | 3 Ų | 3 | 43.5 Ų | 43.5 | 3% | 0.025 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.3 | -47.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113 | C134 R135 I136 G141 A142 P179 Y244 | C134-A138 WeakPolarHBondContact O-CB 2.99Å; C134-A138 PolarHBondContact O-N 3.32Å; R135-A138 PolarHBondContact O-N 3.13Å; I136-A138 PolarHBondContact O-N 3.43Å; A138-G141 PolarHBondContact O-N 2.86Å; A138-A142 WeakPolarHBondContact O-CB 3.34Å; A138-A142 PolarHBondContact O-N 2.95Å; A138-P179 HydrophobicContact CB-CB 4.15Å; A138-P179 HydrophobicContact CB-CG 4.23Å; A138-Y244 HydrophobicContact CB-CD2 3.78Å; A138-Y244 HydrophobicContact CB-CE2 3.63Å |
| 139 | V | 97.8 | Very high | 93.7 | Very high | 24 Ų | 24 | 39.6 Ų | 39.6 | 15% | 0.145 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66 | -44.7 | -179.4 | 172.7 | 0 | 0 | 0 | 0 | 110.7 | R135 A142 A143 I238 F242 | R135-V139 HydrophobicContact CG-CG2 4.41Å; R135-V139 WeakPolarHBondContact O-CB 3.46Å; R135-V139 VanDerWaalsContact O-CG2 3.3Å; R135-V139 WeakPolarHBondContact O-CG2 3.31Å; R135-V139 PolarHBondContact O-N 2.96Å; V139-A142 PolarHBondContact O-N 3.48Å; V139-A143 WeakPolarHBondContact O-CB 3.48Å; V139-A143 PolarHBondContact O-N 3.3Å; V139-I238 HydrophobicContact CG1-CG2 4.11Å; V139-F242 HydrophobicContact CG1-CE1 4.12Å; V139-F242 HydrophobicContact CG1-CE2 4.3Å; V139-F242 HydrophobicContact CG1-CZ 3.82Å; V139-F242 HydrophobicContact CG2-CD1 4.19Å; V139-F242 HydrophobicContact CG2-CE1 4.25Å; V139-F242 HydrophobicContact CG2-CG 4.34Å; V139-F242 HydrophobicContact CG2-CZ 4.48Å |
| 140 | G | 97.4 | Very high | 94.3 | Very high | 36 Ų | 36 | 42.5 Ų | 42.5 | 37% | 0.371 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -61.6 | -44.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | I136 A143 V144 | I136-G140 PolarHBondContact O-N 3.49Å; G140-A143 PolarHBondContact O-N 2.84Å; G140-V144 WeakPolarHBondContact O-CG2 3.4Å; G140-V144 PolarHBondContact O-N 2.87Å |
| 141 | G | 97.4 | Very high | 95.2 | Very high | 2 Ų | 2 | 39.6 Ų | 39.6 | 2% | 0.021 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -59 | -49.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | T137 A138 A143 V144 G145 G172 F175 | T137-G141 PolarHBondContact O-N 3.17Å; A138-G141 PolarHBondContact O-N 2.86Å; G141-A143 VanDerWaalsContact C-N 3.3Å; G141-A143 PolarHBondContact O-N 3.08Å; G141-V144 PolarHBondContact O-N 3.19Å; G141-G145 PolarHBondContact O-N 3.35Å; G141-G172 CarbonylContact C-O 3.28Å; G141-G172 WeakPolarHBondContact CA-O 3.36Å; G141-G172 CarbonylContact O-C 3.41Å; G141-G172 VanDerWaalsContact O-C 3.28Å; G141-G172 WeakPolarHBondContact O-CA 3.34Å; G141-G172 VanDerWaalsContact O-O 3.11Å; G141-F175 VanDerWaalsContact CA-CB 3.42Å |
| 142 | A | 98.1 | Very high | 95.9 | Very high | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.8 | -37.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | A138 V139 G145 L146 A176 L237 I238 | A138-A142 WeakPolarHBondContact O-CB 3.34Å; A138-A142 PolarHBondContact O-N 2.95Å; V139-A142 PolarHBondContact O-N 3.48Å; A142-G145 PolarHBondContact O-N 3.04Å; A142-L146 WeakPolarHBondContact O-CB 3.18Å; A142-L146 PolarHBondContact O-N 3.24Å; A142-A176 HydrophobicContact CB-CB 4.14Å; A142-L237 HydrophobicContact CB-CB 4.23Å; A142-L237 HydrophobicContact CB-CD2 4.16Å; A142-L237 HydrophobicContact CB-CG 3.8Å; A142-I238 HydrophobicContact CB-CB 4.41Å; A142-I238 HydrophobicContact CB-CG1 3.58Å |
| 143 | A | 98.3 | Very high | 96.5 | Very high | 38 Ų | 38 | 30.5 Ų | 30.5 | 31% | 0.314 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -65.7 | -45.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | V139 G140 G141 G145 L146 V147 I238 | V139-A143 WeakPolarHBondContact O-CB 3.48Å; V139-A143 PolarHBondContact O-N 3.3Å; G140-A143 PolarHBondContact O-N 2.84Å; G141-A143 VanDerWaalsContact C-N 3.3Å; G141-A143 PolarHBondContact O-N 3.08Å; A143-G145 VanDerWaalsContact C-N 3.28Å; A143-G145 PolarHBondContact O-N 3.45Å; A143-L146 PolarHBondContact O-N 3.23Å; A143-V147 WeakPolarHBondContact O-CG2 3.3Å; A143-V147 PolarHBondContact O-N 3.29Å; A143-I238 HydrophobicContact CB-CD1 4.2Å |
| 144 | V | 98.3 | Very high | 96.8 | Very high | 71 Ų | 71 | 35.5 Ų | 35.5 | 43% | 0.43 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -60.5 | -41.5 | 173.8 | 172.3 | 0 | 0 | 0 | 0 | 110.8 | G140 G141 V147 G148 V168 | G140-V144 WeakPolarHBondContact O-CG2 3.4Å; G140-V144 PolarHBondContact O-N 2.87Å; G141-V144 PolarHBondContact O-N 3.19Å; V144-V147 PolarHBondContact O-N 2.94Å; V144-G148 PolarHBondContact O-N 3.45Å; V144-V168 HydrophobicContact CG1-CG1 3.98Å |
| 145 | G | 98.2 | Very high | 97 | Very high | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -60.9 | -46.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | G141 A142 A143 V147 G148 L149 F169 | G141-G145 PolarHBondContact O-N 3.35Å; A142-G145 PolarHBondContact O-N 3.04Å; A143-G145 VanDerWaalsContact C-N 3.28Å; A143-G145 PolarHBondContact O-N 3.45Å; G145-V147 PolarHBondContact O-N 3.2Å; G145-G148 PolarHBondContact O-N 3.33Å; G145-L149 WeakPolarHBondContact O-CB 3.47Å; G145-L149 PolarHBondContact O-N 3.02Å; G145-F169 WeakPolarHBondContact O-CD2 3.19Å |
| 146 | L | 98.4 | Very high | 96.7 | Very high | 33 Ų | 33 | 38.6 Ų | 38.6 | 17% | 0.173 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.2 | -46.6 | 175.3 | -176.9 | 149.1 | 0 | 0 | 0 | 111.6 | A142 A143 L149 L150 C231 M234 F235 I238 | A142-L146 WeakPolarHBondContact O-CB 3.18Å; A142-L146 PolarHBondContact O-N 3.24Å; A143-L146 PolarHBondContact O-N 3.23Å; L146-L149 PolarHBondContact O-N 3.39Å; L146-L150 WeakPolarHBondContact O-CB 3.41Å; L146-L150 PolarHBondContact O-N 3.32Å; L146-C231 HydrophobicContact CG-CB 4.48Å; L146-M234 HydrophobicContact CB-CB 3.92Å; L146-M234 HydrophobicContact CD1-CB 4.38Å; L146-M234 HydrophobicContact CG-CB 4.4Å; L146-F235 HydrophobicContact CD1-CB 3.81Å; L146-F235 HydrophobicContact CD1-CD2 4.24Å; L146-I238 HydrophobicContact CB-CD1 4.43Å; L146-I238 HydrophobicContact CD1-CD1 3.97Å |
| 147 | V | 98.3 | Very high | 96.5 | Very high | 90 Ų | 90 | 35.8 Ų | 35.8 | 55% | 0.545 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -62.7 | -43.7 | 177.8 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | A143 V144 G145 L150 A151 | A143-V147 WeakPolarHBondContact O-CG2 3.3Å; A143-V147 PolarHBondContact O-N 3.29Å; V144-V147 PolarHBondContact O-N 2.94Å; G145-V147 PolarHBondContact O-N 3.2Å; V147-L150 PolarHBondContact O-N 3.17Å; V147-A151 WeakPolarHBondContact O-CB 3.25Å; V147-A151 PolarHBondContact O-N 2.84Å |
| 148 | G | 98.1 | Very high | 96.2 | Very high | 1 Ų | 1 | 36.2 Ų | 36.2 | 1% | 0.01 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -59.4 | -49.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | V144 G145 A151 S152 | V144-G148 PolarHBondContact O-N 3.45Å; G145-G148 PolarHBondContact O-N 3.33Å; G148-A151 PolarHBondContact O-N 2.82Å; G148-S152 PolarHBondContact O-N 3.41Å; G148-S152 PolarHBondContact O-OG 2.85Å |
| 149 | L | 97.9 | Very high | 95.9 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -67.3 | -41 | -179.8 | -170.2 | 61.7 | 0 | 0 | 0 | 112.4 | G145 L146 S152 S153 Y165 F169 L227 L230 M234 | G145-L149 WeakPolarHBondContact O-CB 3.47Å; G145-L149 PolarHBondContact O-N 3.02Å; L146-L149 PolarHBondContact O-N 3.39Å; L149-S152 WeakPolarHBondContact O-CB 3.47Å; L149-S152 PolarHBondContact O-N 3.23Å; L149-S153 PolarHBondContact O-N 3.39Å; L149-Y165 HydrophobicContact CD1-CD2 3.89Å; L149-Y165 HydrophobicContact CD1-CE2 3.74Å; L149-F169 HydrophobicContact CB-CD2 3.71Å; L149-F169 HydrophobicContact CB-CE2 4.11Å; L149-F169 HydrophobicContact CB-CG 4.32Å; L149-F169 HydrophobicContact CD1-CD2 4.27Å; L149-F169 HydrophobicContact CD1-CE2 4.25Å; L149-F169 HydrophobicContact CD1-CG 4.44Å; L149-F169 HydrophobicContact CD1-CZ 4.44Å; L149-F169 HydrophobicContact CD2-CD2 4.4Å; L149-F169 HydrophobicContact CD2-CE2 3.95Å; L149-F169 HydrophobicContact CG-CD2 4.35Å; L149-F169 HydrophobicContact CG-CE2 4.34Å; L149-L227 HydrophobicContact CD1-CD2 4.08Å; L149-L230 HydrophobicContact CD2-CB 3.77Å; L149-M234 HydrophobicContact CD2-CG 3.92Å |
| 150 | L | 98.1 | Very high | 95.8 | Very high | 67 Ų | 67 | 43.9 Ų | 43.9 | 35% | 0.351 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -64.7 | -43.3 | 175.9 | -178.1 | 60.4 | 0 | 0 | 0 | 110.7 | L146 V147 S152 S153 F154 R228 | L146-L150 WeakPolarHBondContact O-CB 3.41Å; L146-L150 PolarHBondContact O-N 3.32Å; V147-L150 PolarHBondContact O-N 3.17Å; L150-S152 VanDerWaalsContact C-N 3.33Å; L150-S152 PolarHBondContact O-N 3.35Å; L150-S153 VanDerWaalsContact O-CB 3.3Å; L150-S153 WeakPolarHBondContact O-CB 3.31Å; L150-S153 PolarHBondContact O-N 3.05Å; L150-S153 VanDerWaalsContact O-N 3.09Å; L150-S153 PolarHBondContact O-OG 2.65Å; L150-F154 HydrophobicContact CD1-CE2 4Å; L150-F154 HydrophobicContact CG-CE2 4.11Å; L150-F154 WeakPolarHBondContact O-CD2 3.45Å; L150-F154 WeakPolarHBondContact O-CE2 3.3Å; L150-R228 HydrophobicContact CD1-CG 4.27Å |
| 151 | A | 97.6 | Very high | 95.7 | Very high | 36 Ų | 36 | 42.4 Ų | 42.4 | 30% | 0.298 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -59.1 | -44.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111 | V147 G148 S153 F154 V155 T164 | V147-A151 WeakPolarHBondContact O-CB 3.25Å; V147-A151 PolarHBondContact O-N 2.84Å; G148-A151 PolarHBondContact O-N 2.82Å; A151-S153 PolarHBondContact O-N 3.13Å; A151-S153 VanDerWaalsContact O-N 3.13Å; A151-F154 PolarHBondContact O-N 3.47Å; A151-V155 WeakPolarHBondContact O-CG2 3.42Å; A151-T164 HydrophobicContact CB-CG2 3.89Å |
| 152 | S | 97.3 | Very high | 95.7 | Very high | 1 Ų | 1 | 43.9 Ų | 43.9 | 1% | 0.007 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -56.6 | -28.8 | 175.4 | -59.4 | 0 | 0 | 0 | 0 | 113.5 | G148 L149 L150 F154 V155 T164 Y165 | G148-S152 PolarHBondContact O-N 3.41Å; G148-S152 PolarHBondContact O-OG 2.85Å; L149-S152 WeakPolarHBondContact O-CB 3.47Å; L149-S152 PolarHBondContact O-N 3.23Å; L150-S152 VanDerWaalsContact C-N 3.33Å; L150-S152 PolarHBondContact O-N 3.35Å; S152-F154 PolarHBondContact O-N 3Å; S152-V155 PolarHBondContact O-N 2.74Å; S152-T164 VanDerWaalsContact OG-CB 3.22Å; S152-T164 WeakPolarHBondContact OG-CB 3.01Å; S152-T164 PolarHBondContact OG-OG1 3.33Å; S152-Y165 WeakPolarHBondContact OG-CA 3.16Å; S152-Y165 WeakPolarHBondContact OG-CB 3.46Å; S152-Y165 PolarHBondContact OG-N 2.94Å; S152-Y165 VanDerWaalsContact OG-N 3.09Å |
| 153 | S | 96.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 27% | 0.268 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -18.8 | 177.1 | 82.4 | 0 | 0 | 0 | 0 | 114.6 | L149 L150 A151 Q224 R228 | L149-S153 PolarHBondContact O-N 3.39Å; L150-S153 VanDerWaalsContact O-CB 3.3Å; L150-S153 WeakPolarHBondContact O-CB 3.31Å; L150-S153 PolarHBondContact O-N 3.05Å; L150-S153 VanDerWaalsContact O-N 3.09Å; L150-S153 PolarHBondContact O-OG 2.65Å; A151-S153 PolarHBondContact O-N 3.13Å; A151-S153 VanDerWaalsContact O-N 3.13Å; S153-Q224 WeakPolarHBondContact CB-O 3.42Å; S153-Q224 WeakPolarHBondContact O-CB 3.34Å; S153-Q224 WeakPolarHBondContact O-CG 3.39Å; S153-R228 WeakPolarHBondContact OG-CG 3.4Å; S153-R228 PolarHBondContact OG-NE 3.46Å |
| 154 | F | 95.3 | Very high | 95.6 | Very high | 129 Ų | 129 | 48.6 Ų | 48.6 | 57% | 0.566 | 26% | 0.257 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.9 | -7.6 | 177.6 | -60.6 | -78.7 | 0 | 0 | 0 | 112.9 | L150 A151 S152 | L150-F154 HydrophobicContact CD1-CE2 4Å; L150-F154 HydrophobicContact CG-CE2 4.11Å; L150-F154 WeakPolarHBondContact O-CD2 3.45Å; L150-F154 WeakPolarHBondContact O-CE2 3.3Å; A151-F154 PolarHBondContact O-N 3.47Å; S152-F154 PolarHBondContact O-N 3Å |
| 155 | V | 93 | Very high | 95.6 | Very high | 20 Ų | 20 | 45.4 Ų | 45.4 | 12% | 0.121 | 24% | 0.237 | C | C | . | . | trans | -81.5 | 130.6 | -173.6 | 171.4 | 0 | 0 | 0 | 0 | 110.8 | A151 S152 S157 V160 M161 T164 | A151-V155 WeakPolarHBondContact O-CG2 3.42Å; S152-V155 PolarHBondContact O-N 2.74Å; V155-S157 WeakPolarHBondContact CG1-O 3.34Å; V155-V160 HydrophobicContact CG1-CB 3.73Å; V155-V160 HydrophobicContact CG1-CG1 4.05Å; V155-V160 HydrophobicContact CG2-CB 4.27Å; V155-V160 HydrophobicContact CG2-CG1 3.64Å; V155-M161 HydrophobicContact CG1-CB 4Å; V155-T164 HydrophobicContact CG2-CG2 4.14Å | ||
| 156 | K | 88 | Confident | 95.5 | Very high | 142 Ų | 142 | 45.4 Ų | 45.4 | 62% | 0.617 | 24% | 0.237 | S | C | * | . | trans | -116.9 | 16.2 | 176.4 | -61.2 | -175.4 | -179.7 | -178.1 | 0 | 113.4 | F95 | F95-K156 WeakPolarHBondContact CE1-O 3.31Š| ||
| 157 | S | 90.1 | Very high | 95.5 | Very high | 50 Ų | 50 | 46.8 Ų | 46.8 | 35% | 0.35 | 24% | 0.244 | S | C | . | . | S | Bend | trans | -133.7 | 136 | 177.8 | 171 | 0 | 0 | 0 | 0 | 110.1 | V155 D159 V160 M161 | V155-S157 WeakPolarHBondContact CG1-O 3.34Å; S157-D159 VanDerWaalsContact C-N 3.3Å; S157-D159 PolarHBondContact O-N 3.25Å; S157-D159 PolarHBondContact OG-N 2.75Å; S157-V160 PolarHBondContact O-N 2.67Å; S157-M161 PolarHBondContact O-N 3.07Å; S157-M161 VanDerWaalsContact O-N 3.14Å |
| 158 | L | 89.4 | Confident | 95.5 | Very high | 18 Ų | 18 | 44.2 Ų | 44.2 | 9% | 0.094 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.2 | -37.7 | 179.7 | -73.6 | 177.4 | 0 | 0 | 0 | 112.3 | F95 K106 V110 V160 M161 Y162 | F95-L158 HydrophobicContact CB-CD1 4.27Å; F95-L158 HydrophobicContact CB-CG 4.37Å; F95-L158 HydrophobicContact CD1-CD2 4.3Å; F95-L158 HydrophobicContact CD1-CG 3.92Å; F95-L158 HydrophobicContact CD2-CD2 3.53Å; F95-L158 HydrophobicContact CD2-CG 4.05Å; F95-L158 HydrophobicContact CE1-CD2 4.41Å; F95-L158 HydrophobicContact CE1-CG 4.17Å; F95-L158 HydrophobicContact CE2-CD2 3.7Å; F95-L158 HydrophobicContact CE2-CG 4.33Å; F95-L158 HydrophobicContact CG-CD1 4.3Å; F95-L158 HydrophobicContact CG-CD2 3.87Å; F95-L158 HydrophobicContact CG-CG 3.86Å; F95-L158 HydrophobicContact CZ-CD2 4.15Å; F95-L158 HydrophobicContact CZ-CG 4.39Å; K106-L158 HydrophobicContact CB-CD1 4.21Å; V110-L158 HydrophobicContact CG2-CD2 4.13Å; L158-V160 VanDerWaalsContact C-N 3.33Å; L158-V160 PolarHBondContact O-N 3.26Å; L158-M161 CarbonylContact O-C 3.5Å; L158-M161 WeakPolarHBondContact O-CA 3.3Å; L158-M161 WeakPolarHBondContact O-CB 3.48Å; L158-M161 PolarHBondContact O-N 2.9Å; L158-Y162 PolarHBondContact O-N 2.69Å |
| 159 | D | 90.8 | Very high | 95.5 | Very high | 115 Ų | 115 | 44.2 Ų | 44.2 | 62% | 0.615 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -63.5 | -41.2 | -176.7 | -60.7 | -33.1 | 0 | 0 | 0 | 111.8 | S157 M161 Y162 | S157-D159 VanDerWaalsContact C-N 3.3Å; S157-D159 PolarHBondContact O-N 3.25Å; S157-D159 PolarHBondContact OG-N 2.75Å; D159-M161 VanDerWaalsContact C-N 3.28Å; D159-M161 PolarHBondContact O-N 2.96Å; D159-Y162 PolarHBondContact O-N 3.12Å |
| 160 | V | 94.9 | Very high | 95.5 | Very high | 72 Ų | 72 | 44.2 Ų | 44.2 | 44% | 0.436 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -73.1 | -25.9 | 175.6 | -172.8 | 0 | 0 | 0 | 0 | 110.9 | V155 S157 L158 F163 T164 | V155-V160 HydrophobicContact CG1-CB 3.73Å; V155-V160 HydrophobicContact CG1-CG1 4.05Å; V155-V160 HydrophobicContact CG2-CB 4.27Å; V155-V160 HydrophobicContact CG2-CG1 3.64Å; S157-V160 PolarHBondContact O-N 2.67Å; L158-V160 VanDerWaalsContact C-N 3.33Å; L158-V160 PolarHBondContact O-N 3.26Å; V160-F163 PolarHBondContact O-N 3.08Å; V160-T164 HydrophobicContact CG1-CG2 4.3Å; V160-T164 WeakPolarHBondContact O-CG2 3.29Å; V160-T164 PolarHBondContact O-N 3.2Å; V160-T164 PolarHBondContact O-OG1 3.4Å |
| 161 | M | 95.1 | Very high | 95.5 | Very high | 5 Ų | 5 | 42.3 Ų | 42.3 | 3% | 0.025 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -74.4 | -32.8 | 176.1 | -164.4 | 167.3 | -99.9 | 0 | 0 | 112.1 | L91 V110 V155 S157 L158 D159 F163 T164 Y165 G166 L227 | L91-M161 HydrophobicContact CD1-SD 4.42Å; L91-M161 HydrophobicContact CD2-CE 4.07Å; L91-M161 HydrophobicContact CD2-SD 3.47Å; L91-M161 WeakPolarHBondContact CD2-SD 3.02Å; V110-M161 HydrophobicContact CG1-CG 3.82Å; V110-M161 HydrophobicContact CG1-SD 4.2Å; V110-M161 HydrophobicContact CG2-CG 4.42Å; V155-M161 HydrophobicContact CG1-CB 4Å; S157-M161 PolarHBondContact O-N 3.07Å; S157-M161 VanDerWaalsContact O-N 3.14Å; L158-M161 CarbonylContact O-C 3.5Å; L158-M161 WeakPolarHBondContact O-CA 3.3Å; L158-M161 WeakPolarHBondContact O-CB 3.48Å; L158-M161 PolarHBondContact O-N 2.9Å; D159-M161 VanDerWaalsContact C-N 3.28Å; D159-M161 PolarHBondContact O-N 2.96Å; M161-F163 PolarHBondContact O-N 3.04Å; M161-T164 PolarHBondContact O-N 2.89Å; M161-Y165 WeakPolarHBondContact O-CB 3.1Å; M161-Y165 PolarHBondContact O-N 3.24Å; M161-G166 PolarHBondContact O-N 2.87Å; M161-L227 HydrophobicContact CE-CD1 4.16Å |
| 162 | Y | 96.6 | Very high | 95.5 | Very high | 34 Ų | 34 | 40.6 Ų | 40.6 | 13% | 0.133 | 21% | 0.206 | C | C | . | . | I | π-helix | trans | -57.4 | -41 | 169.1 | -57.8 | -37.8 | 0 | 0 | 0 | 111.3 | K106 F109 V110 L158 D159 G166 I167 | K106-Y162 WeakPolarHBondContact CB-OH 3.49Å; K106-Y162 WeakPolarHBondContact O-CE1 3.34Å; K106-Y162 PolarHBondContact O-OH 2.95Å; K106-Y162 VanDerWaalsContact O-OH 3.11Å; F109-Y162 HydrophobicContact CB-CE1 4.05Å; F109-Y162 AromaticContact CD1-CD1 3.78Å; F109-Y162 HydrophobicContact CD1-CD1 3.78Å; F109-Y162 HydrophobicContact CD1-CD2 4.46Å; F109-Y162 AromaticContact CD1-CE1 3.64Å; F109-Y162 HydrophobicContact CD1-CE1 3.64Å; F109-Y162 HydrophobicContact CD1-CE2 4.36Å; F109-Y162 HydrophobicContact CD1-CG 4.23Å; F109-Y162 AromaticContact CD1-CZ 3.96Å; F109-Y162 HydrophobicContact CE1-CD1 4.47Å; F109-Y162 HydrophobicContact CG-CE1 4.31Å; V110-Y162 HydrophobicContact CB-CD1 4.4Å; V110-Y162 HydrophobicContact CB-CE1 4.48Å; V110-Y162 HydrophobicContact CG2-CD1 3.64Å; V110-Y162 HydrophobicContact CG2-CE1 3.48Å; V110-Y162 VanDerWaalsContact CG2-CE1 3.48Å; L158-Y162 PolarHBondContact O-N 2.69Å; D159-Y162 PolarHBondContact O-N 3.12Å; Y162-G166 CarbonylContact O-C 3.21Å; Y162-G166 WeakPolarHBondContact O-CA 3.31Å; Y162-G166 PolarHBondContact O-N 2.94Å; Y162-I167 PolarHBondContact O-N 3.45Å |
| 163 | F | 97.6 | Very high | 95.5 | Very high | 124 Ų | 124 | 40.6 Ų | 40.6 | 54% | 0.544 | 21% | 0.206 | S | C | . | . | I | π-helix | trans | -71.6 | -54 | 177.1 | -177.5 | -108.7 | 0 | 0 | 0 | 112.2 | V160 M161 I167 V168 | V160-F163 PolarHBondContact O-N 3.08Å; M161-F163 PolarHBondContact O-N 3.04Å; F163-I167 HydrophobicContact CD2-CD1 4.46Å; F163-I167 WeakPolarHBondContact O-CB 3.36Å; F163-I167 PolarHBondContact O-N 3.36Å; F163-V168 HydrophobicContact CD1-CG2 4.27Å; F163-V168 HydrophobicContact CE1-CG2 3.87Å; F163-V168 HydrophobicContact CE2-CG2 4.25Å; F163-V168 HydrophobicContact CZ-CG2 3.86Å; F163-V168 WeakPolarHBondContact O-CG2 3.42Å; F163-V168 PolarHBondContact O-N 3.24Å |
| 164 | T | 97.8 | Very high | 95.5 | Very high | 12 Ų | 12 | 40.6 Ų | 40.6 | 7% | 0.074 | 21% | 0.206 | C | C | . | . | I | π-helix | trans | -71.1 | -51.6 | -173.3 | 54 | 0 | 0 | 0 | 0 | 113.2 | A151 S152 V155 V160 M161 V168 F169 | A151-T164 HydrophobicContact CB-CG2 3.89Å; S152-T164 VanDerWaalsContact OG-CB 3.22Å; S152-T164 WeakPolarHBondContact OG-CB 3.01Å; S152-T164 PolarHBondContact OG-OG1 3.33Å; V155-T164 HydrophobicContact CG2-CG2 4.14Å; V160-T164 HydrophobicContact CG1-CG2 4.3Å; V160-T164 WeakPolarHBondContact O-CG2 3.29Å; V160-T164 PolarHBondContact O-N 3.2Å; V160-T164 PolarHBondContact O-OG1 3.4Å; M161-T164 PolarHBondContact O-N 2.89Å; T164-V168 WeakPolarHBondContact O-CB 3.22Å; T164-F169 WeakPolarHBondContact O-CB 3.37Å; T164-F169 PolarHBondContact O-N 2.47Å |
| 165 | Y | 97.8 | Very high | 95.5 | Very high | 4 Ų | 4 | 36.5 Ų | 36.5 | 2% | 0.016 | 19% | 0.188 | C | C | . | . | I | π-helix | trans | -86.8 | -43.4 | -177.7 | -170.3 | -87.5 | 0 | 0 | 0 | 111.8 | F84 V110 S114 L149 S152 M161 F169 L227 | F84-Y165 AromaticContact CD2-CE1 3.91Å; F84-Y165 HydrophobicContact CD2-CE1 3.91Å; F84-Y165 AromaticContact CE2-CE1 3.84Å; F84-Y165 HydrophobicContact CE2-CE1 3.84Å; V110-Y165 HydrophobicContact CG1-CD1 3.6Å; V110-Y165 HydrophobicContact CG1-CE1 4.38Å; V110-Y165 HydrophobicContact CG1-CG 4.09Å; S114-Y165 PolarHBondContact OG-O 3.26Å; L149-Y165 HydrophobicContact CD1-CD2 3.89Å; L149-Y165 HydrophobicContact CD1-CE2 3.74Å; S152-Y165 WeakPolarHBondContact OG-CA 3.16Å; S152-Y165 WeakPolarHBondContact OG-CB 3.46Å; S152-Y165 PolarHBondContact OG-N 2.94Å; S152-Y165 VanDerWaalsContact OG-N 3.09Å; M161-Y165 WeakPolarHBondContact O-CB 3.1Å; M161-Y165 PolarHBondContact O-N 3.24Å; Y165-F169 HydrophobicContact CD1-CD1 4.49Å; Y165-F169 HydrophobicContact CD2-CD1 4.05Å; Y165-F169 HydrophobicContact CE1-CD1 4.39Å; Y165-F169 AromaticContact CE2-CD1 3.94Å; Y165-F169 HydrophobicContact CE2-CD1 3.94Å; Y165-F169 AromaticContact CE2-CE1 3.98Å; Y165-F169 HydrophobicContact CE2-CE1 3.98Å; Y165-F169 HydrophobicContact CG-CD1 4.33Å; Y165-F169 AromaticContact CZ-CE1 3.97Å; Y165-L227 HydrophobicContact CE2-CD2 4.4Å |
| 166 | G | 97.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 18% | 0.183 | C | C | . | . | I | π-helix | trans | -72 | -39.7 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | S114 M117 M161 Y162 A170 | S114-G166 WeakPolarHBondContact CA-O 3.39Å; M117-G166 WeakPolarHBondContact CB-O 3.35Å; M117-G166 WeakPolarHBondContact CG-O 3.4Å; M161-G166 PolarHBondContact O-N 2.87Å; Y162-G166 CarbonylContact O-C 3.21Å; Y162-G166 WeakPolarHBondContact O-CA 3.31Å; Y162-G166 PolarHBondContact O-N 2.94Å; G166-A170 WeakPolarHBondContact O-CB 3.33Å |
| 167 | I | 97.9 | Very high | 96 | Very high | 63 Ų | 63 | 30 Ų | 30 | 32% | 0.323 | 16% | 0.158 | S | C | . | . | I | π-helix | trans | -107.1 | -61.5 | -176.1 | -61.4 | 171.5 | 0 | 0 | 0 | 111.4 | L113 M117 Y162 F163 A170 C171 | L113-I167 HydrophobicContact CD2-CG1 4.16Å; L113-I167 HydrophobicContact CG-CG1 4.48Å; M117-I167 HydrophobicContact CE-CG2 4.38Å; M117-I167 HydrophobicContact CG-CG1 4.34Å; Y162-I167 PolarHBondContact O-N 3.45Å; F163-I167 HydrophobicContact CD2-CD1 4.46Å; F163-I167 WeakPolarHBondContact O-CB 3.36Å; F163-I167 PolarHBondContact O-N 3.36Å; I167-A170 PolarHBondContact O-N 3.33Å; I167-C171 VanDerWaalsContact O-CB 3.23Å; I167-C171 WeakPolarHBondContact O-CB 3.41Å; I167-C171 PolarHBondContact O-N 3.35Å; I167-C171 PolarHBondContact O-SG 3.33Å |
| 168 | V | 98.3 | Very high | 96 | Very high | 35 Ų | 35 | 28.1 Ų | 28.1 | 21% | 0.212 | 14% | 0.143 | C | C | . | . | I | π-helix | trans | -65.4 | -52 | -170.1 | 179.5 | 0 | 0 | 0 | 0 | 111.8 | V144 F163 T164 A170 C171 G172 | V144-V168 HydrophobicContact CG1-CG1 3.98Å; F163-V168 HydrophobicContact CD1-CG2 4.27Å; F163-V168 HydrophobicContact CE1-CG2 3.87Å; F163-V168 HydrophobicContact CE2-CG2 4.25Å; F163-V168 HydrophobicContact CZ-CG2 3.86Å; F163-V168 WeakPolarHBondContact O-CG2 3.42Å; F163-V168 PolarHBondContact O-N 3.24Å; T164-V168 WeakPolarHBondContact O-CB 3.22Å; V168-A170 PolarHBondContact O-N 3.34Å; V168-C171 PolarHBondContact O-N 3.25Å; V168-G172 PolarHBondContact O-N 3.08Å |
| 169 | F | 98.4 | Very high | 96.1 | Very high | 1 Ų | 1 | 27.3 Ų | 27.3 | 0% | 0.004 | 14% | 0.139 | C | C | . | . | I | π-helix | trans | -58 | -49 | 176.5 | 167.3 | -115.3 | 0 | 0 | 0 | 111.5 | I80 G145 L149 T164 Y165 G172 C173 M234 | I80-F169 HydrophobicContact CD1-CZ 4.13Å; I80-F169 HydrophobicContact CG2-CE1 4.18Å; I80-F169 HydrophobicContact CG2-CZ 3.99Å; G145-F169 WeakPolarHBondContact O-CD2 3.19Å; L149-F169 HydrophobicContact CB-CD2 3.71Å; L149-F169 HydrophobicContact CB-CE2 4.11Å; L149-F169 HydrophobicContact CB-CG 4.32Å; L149-F169 HydrophobicContact CD1-CD2 4.27Å; L149-F169 HydrophobicContact CD1-CE2 4.25Å; L149-F169 HydrophobicContact CD1-CG 4.44Å; L149-F169 HydrophobicContact CD1-CZ 4.44Å; L149-F169 HydrophobicContact CD2-CD2 4.4Å; L149-F169 HydrophobicContact CD2-CE2 3.95Å; L149-F169 HydrophobicContact CG-CD2 4.35Å; L149-F169 HydrophobicContact CG-CE2 4.34Å; T164-F169 WeakPolarHBondContact O-CB 3.37Å; T164-F169 PolarHBondContact O-N 2.47Å; Y165-F169 HydrophobicContact CD1-CD1 4.49Å; Y165-F169 HydrophobicContact CD2-CD1 4.05Å; Y165-F169 HydrophobicContact CE1-CD1 4.39Å; Y165-F169 AromaticContact CE2-CD1 3.94Å; Y165-F169 HydrophobicContact CE2-CD1 3.94Å; Y165-F169 AromaticContact CE2-CE1 3.98Å; Y165-F169 HydrophobicContact CE2-CE1 3.98Å; Y165-F169 HydrophobicContact CG-CD1 4.33Å; Y165-F169 AromaticContact CZ-CE1 3.97Å; F169-G172 WeakPolarHBondContact O-CA 3.2Å; F169-G172 PolarHBondContact O-N 3.14Å; F169-G172 VanDerWaalsContact O-N 3.15Å; F169-C173 WeakPolarHBondContact CE2-SG 3.35Å; F169-C173 WeakPolarHBondContact CZ-SG 3.37Å; F169-C173 PolarHBondContact O-N 3.45Å; F169-C173 PolarHBondContact O-SG 3.33Å; F169-M234 HydrophobicContact CD2-CE 4.41Å; F169-M234 HydrophobicContact CE2-CE 3.97Å; F169-M234 HydrophobicContact CE2-CG 4.22Å; F169-M234 HydrophobicContact CE2-SD 3.86Å |
| 170 | A | 98 | Very high | 96.2 | Very high | 0 Ų | 0 | 21.8 Ų | 21.8 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -62.5 | -43.3 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | S114 M117 I118 G166 I167 V168 G172 C173 S174 | S114-A170 VanDerWaalsContact O-CB 3.25Å; S114-A170 WeakPolarHBondContact O-CB 3.36Å; M117-A170 HydrophobicContact CB-CB 3.53Å; I118-A170 HydrophobicContact CG1-CB 4.05Å; I118-A170 WeakPolarHBondContact CG1-O 3.24Å; G166-A170 WeakPolarHBondContact O-CB 3.33Å; I167-A170 PolarHBondContact O-N 3.33Å; V168-A170 PolarHBondContact O-N 3.34Å; A170-G172 VanDerWaalsContact C-N 3.32Å; A170-G172 PolarHBondContact O-N 3.05Å; A170-C173 WeakPolarHBondContact O-CB 3.46Å; A170-C173 PolarHBondContact O-N 3.46Å; A170-S174 PolarHBondContact O-N 3.04Å |
| 171 | C | 97.7 | Very high | 95.9 | Very high | 28 Ų | 28 | 20.5 Ų | 20.5 | 19% | 0.189 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -58.2 | -47.2 | 172.3 | -74.4 | 0 | 0 | 0 | 0 | 110.1 | I167 V168 C173 S174 F175 | I167-C171 VanDerWaalsContact O-CB 3.23Å; I167-C171 WeakPolarHBondContact O-CB 3.41Å; I167-C171 PolarHBondContact O-N 3.35Å; I167-C171 PolarHBondContact O-SG 3.33Å; V168-C171 PolarHBondContact O-N 3.25Å; C171-C173 PolarHBondContact O-N 2.96Å; C171-S174 WeakPolarHBondContact O-CB 3.46Å; C171-S174 PolarHBondContact O-N 3.24Å; C171-F175 VanDerWaalsContact O-CD2 3.28Å; C171-F175 WeakPolarHBondContact O-CD2 3.19Å; C171-F175 PolarHBondContact O-N 3.39Å |
| 172 | G | 97.7 | Very high | 95.5 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -57.6 | -45.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | G141 V168 F169 A170 S174 F175 A176 | G141-G172 CarbonylContact C-O 3.28Å; G141-G172 WeakPolarHBondContact CA-O 3.36Å; G141-G172 CarbonylContact O-C 3.41Å; G141-G172 VanDerWaalsContact O-C 3.28Å; G141-G172 WeakPolarHBondContact O-CA 3.34Å; G141-G172 VanDerWaalsContact O-O 3.11Å; V168-G172 PolarHBondContact O-N 3.08Å; F169-G172 WeakPolarHBondContact O-CA 3.2Å; F169-G172 PolarHBondContact O-N 3.14Å; F169-G172 VanDerWaalsContact O-N 3.15Å; A170-G172 VanDerWaalsContact C-N 3.32Å; A170-G172 PolarHBondContact O-N 3.05Å; G172-S174 PolarHBondContact O-N 3.32Å; G172-F175 PolarHBondContact O-N 3.09Å; G172-A176 WeakPolarHBondContact O-CB 3.37Å; G172-A176 PolarHBondContact O-N 3.35Å |
| 173 | C | 97.8 | Very high | 95.1 | Very high | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -59 | -42.7 | 174 | -74.3 | 0 | 0 | 0 | 0 | 112.6 | V77 I118 F169 A170 C171 A176 Y177 | V77-C173 HydrophobicContact CG1-CB 3.85Å; V77-C173 HydrophobicContact CG2-CB 4.08Å; I118-C173 HydrophobicContact CD1-CB 4.04Å; I118-C173 HydrophobicContact CG1-CB 3.95Å; F169-C173 WeakPolarHBondContact CE2-SG 3.35Å; F169-C173 WeakPolarHBondContact CZ-SG 3.37Å; F169-C173 PolarHBondContact O-N 3.45Å; F169-C173 PolarHBondContact O-SG 3.33Å; A170-C173 WeakPolarHBondContact O-CB 3.46Å; A170-C173 PolarHBondContact O-N 3.46Å; C171-C173 PolarHBondContact O-N 2.96Å; C173-A176 PolarHBondContact O-N 3.42Å; C173-Y177 WeakPolarHBondContact O-CB 3.48Å; C173-Y177 PolarHBondContact O-N 2.85Å |
| 174 | S | 96.1 | Very high | 94.7 | Very high | 0 Ų | 0 | 14.5 Ų | 14.5 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -60.4 | -48.3 | 175.7 | -164.7 | 0 | 0 | 0 | 0 | 111.8 | I118 C121 A170 C171 G172 A176 Y177 Q178 | I118-S174 VanDerWaalsContact O-CB 3.27Å; I118-S174 WeakPolarHBondContact O-CB 3.38Å; I118-S174 PolarHBondContact O-OG 3.01Å; C121-S174 WeakPolarHBondContact CB-OG 3.49Å; A170-S174 PolarHBondContact O-N 3.04Å; C171-S174 WeakPolarHBondContact O-CB 3.46Å; C171-S174 PolarHBondContact O-N 3.24Å; G172-S174 PolarHBondContact O-N 3.32Å; S174-A176 VanDerWaalsContact C-N 3.27Å; S174-A176 PolarHBondContact O-N 2.88Å; S174-Y177 PolarHBondContact O-N 3.45Å; S174-Q178 PolarHBondContact O-N 3.39Å; S174-Q178 VanDerWaalsContact O-N 3.09Å |
| 175 | F | 95.8 | Very high | 94.1 | Very high | 44 Ų | 44 | 15 Ų | 15 | 19% | 0.193 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -65.5 | -28.3 | 179.6 | -87.1 | -104.2 | 0 | 0 | 0 | 112.7 | I124 V125 F128 T137 G141 C171 G172 P179 | I124-F175 HydrophobicContact CG2-CZ 4.24Å; V125-F175 HydrophobicContact CG1-CD1 4.39Å; V125-F175 HydrophobicContact CG1-CG 4.35Å; V125-F175 HydrophobicContact CG2-CB 4.32Å; V125-F175 HydrophobicContact CG2-CD1 4.19Å; V125-F175 HydrophobicContact CG2-CD2 3.39Å; V125-F175 HydrophobicContact CG2-CE1 4.36Å; V125-F175 HydrophobicContact CG2-CE2 3.6Å; V125-F175 HydrophobicContact CG2-CG 3.71Å; V125-F175 HydrophobicContact CG2-CZ 4.09Å; F128-F175 HydrophobicContact CB-CE1 3.92Å; F128-F175 AromaticContact CD1-CE1 3.92Å; F128-F175 HydrophobicContact CD1-CE1 3.92Å; F128-F175 HydrophobicContact CD2-CE1 4.22Å; F128-F175 HydrophobicContact CD2-CZ 4.33Å; F128-F175 AromaticContact CG-CE1 3.76Å; F128-F175 HydrophobicContact CG-CE1 3.76Å; F128-F175 HydrophobicContact CG-CZ 4.32Å; T137-F175 CarbonylContact C-O 3.55Å; T137-F175 HydrophobicContact CG2-CD1 3.77Å; T137-F175 HydrophobicContact CG2-CE1 4.43Å; G141-F175 VanDerWaalsContact CA-CB 3.42Å; C171-F175 VanDerWaalsContact O-CD2 3.28Å; C171-F175 WeakPolarHBondContact O-CD2 3.19Å; C171-F175 PolarHBondContact O-N 3.39Å; G172-F175 PolarHBondContact O-N 3.09Å; F175-P179 WeakPolarHBondContact O-CD 3.22Å; F175-P179 WeakPolarHBondContact O-CG 3.36Å |
| 176 | A | 96.6 | Very high | 93.6 | Very high | 1 Ų | 1 | 16 Ų | 16 | 1% | 0.008 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -79.4 | -40.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | C73 A142 G172 C173 S174 L237 | C73-A176 PolarHBondContact SG-O 3.49Å; C73-A176 VanDerWaalsContact SG-O 3.4Å; A142-A176 HydrophobicContact CB-CB 4.14Å; G172-A176 WeakPolarHBondContact O-CB 3.37Å; G172-A176 PolarHBondContact O-N 3.35Å; C173-A176 PolarHBondContact O-N 3.42Å; S174-A176 VanDerWaalsContact C-N 3.27Å; S174-A176 PolarHBondContact O-N 2.88Å; A176-L237 HydrophobicContact CB-CD2 3.63Å; A176-L237 HydrophobicContact CB-CG 4.19Å |
| 177 | Y | 94.1 | Very high | 93.2 | Very high | 25 Ų | 25 | 16.2 Ų | 16.2 | 10% | 0.098 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -70.4 | -53.4 | -173.9 | 168.8 | -116.2 | 0 | 0 | 0 | 113.1 | N74 F78 C173 S174 S180 L181 | N74-Y177 HydrophobicContact CB-CE2 4.45Å; N74-Y177 WeakPolarHBondContact OD1-CE2 3.4Å; F78-Y177 HydrophobicContact CD2-CE2 4.49Å; F78-Y177 HydrophobicContact CE2-CD2 4.05Å; F78-Y177 HydrophobicContact CE2-CE1 4.11Å; F78-Y177 AromaticContact CE2-CE2 3.62Å; F78-Y177 HydrophobicContact CE2-CE2 3.62Å; F78-Y177 HydrophobicContact CE2-CG 4.47Å; F78-Y177 AromaticContact CE2-CZ 3.62Å; F78-Y177 HydrophobicContact CZ-CE1 4.18Å; F78-Y177 HydrophobicContact CZ-CE2 4.47Å; C173-Y177 WeakPolarHBondContact O-CB 3.48Å; C173-Y177 PolarHBondContact O-N 2.85Å; S174-Y177 PolarHBondContact O-N 3.45Å; Y177-S180 VanDerWaalsContact O-CB 3.29Å; Y177-S180 WeakPolarHBondContact O-CB 3.21Å; Y177-S180 PolarHBondContact O-N 3.34Å; Y177-S180 VanDerWaalsContact O-N 3.09Å; Y177-S180 PolarHBondContact O-OG 2.71Å; Y177-L181 HydrophobicContact CE1-CD1 4.29Å; Y177-L181 HydrophobicContact CE2-CD1 3.82Å; Y177-L181 HydrophobicContact CE2-CD2 4.47Å; Y177-L181 HydrophobicContact CE2-CG 4.09Å; Y177-L181 WeakPolarHBondContact OH-CD1 3.47Å |
| 178 | Q | 89.8 | Confident | 92.5 | Very high | 10 Ų | 10 | 13.3 Ų | 13.3 | 5% | 0.047 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -58.7 | -47.1 | -172.6 | -166.5 | 75.2 | 11.3 | 0 | 0 | 113 | V125 S174 S180 L181 V182 | V125-Q178 HydrophobicContact CB-CB 3.99Å; V125-Q178 HydrophobicContact CB-CG 4.36Å; V125-Q178 HydrophobicContact CG1-CB 3.49Å; V125-Q178 VanDerWaalsContact CG1-CB 3.49Å; V125-Q178 HydrophobicContact CG1-CG 4.16Å; S174-Q178 PolarHBondContact O-N 3.39Å; S174-Q178 VanDerWaalsContact O-N 3.09Å; Q178-S180 PolarHBondContact O-N 3.41Å; Q178-L181 PolarHBondContact O-N 2.91Å; Q178-L181 VanDerWaalsContact O-N 3.14Å; Q178-V182 PolarHBondContact O-N 2.96Å |
| 179 | P | 91.5 | Very high | 91.8 | Very high | 0 Ų | 0 | 17.1 Ų | 17.1 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -67.1 | -24.2 | -179.6 | -13.9 | 28 | 0 | 0 | 0 | 113.1 | V125 T129 C134 T137 A138 F175 L181 V182 I183 | V125-P179 HydrophobicContact CG1-CG 4.23Å; T129-P179 HydrophobicContact CG2-CB 4.11Å; T129-P179 HydrophobicContact CG2-CG 4.45Å; C134-P179 HydrophobicContact CB-CB 3.85Å; C134-P179 WeakPolarHBondContact O-CB 3.18Å; T137-P179 HydrophobicContact CG2-CG 3.7Å; A138-P179 HydrophobicContact CB-CB 4.15Å; A138-P179 HydrophobicContact CB-CG 4.23Å; F175-P179 WeakPolarHBondContact O-CD 3.22Å; F175-P179 WeakPolarHBondContact O-CG 3.36Å; P179-L181 PolarHBondContact O-N 3.27Å; P179-V182 PolarHBondContact O-N 3.4Å; P179-I183 WeakPolarHBondContact O-CB 3.49Å; P179-I183 WeakPolarHBondContact O-CG2 3.26Å; P179-I183 PolarHBondContact O-N 3.25Å |
| 180 | S | 93.4 | Very high | 90.9 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.2 | -27.9 | 175.3 | 82.8 | 0 | 0 | 0 | 0 | 112.6 | S70 Y177 Q178 I183 L184 Y244 | S70-S180 WeakPolarHBondContact CB-O 3.18Å; S70-S180 PolarHBondContact OG-O 3.03Å; Y177-S180 VanDerWaalsContact O-CB 3.29Å; Y177-S180 WeakPolarHBondContact O-CB 3.21Å; Y177-S180 PolarHBondContact O-N 3.34Å; Y177-S180 VanDerWaalsContact O-N 3.09Å; Y177-S180 PolarHBondContact O-OG 2.71Å; Q178-S180 PolarHBondContact O-N 3.41Å; S180-I183 WeakPolarHBondContact O-CG2 3.28Å; S180-L184 WeakPolarHBondContact O-CG 3.36Å; S180-Y244 WeakPolarHBondContact CB-OH 3.34Å |
| 181 | L | 88.9 | Confident | 90 | Very high | 44 Ų | 44 | 31 Ų | 31 | 23% | 0.23 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -85.8 | -40.3 | 174.7 | -63.4 | -176.2 | 0 | 0 | 0 | 111.9 | Y177 Q178 P179 I183 L184 V199 | Y177-L181 HydrophobicContact CE1-CD1 4.29Å; Y177-L181 HydrophobicContact CE2-CD1 3.82Å; Y177-L181 HydrophobicContact CE2-CD2 4.47Å; Y177-L181 HydrophobicContact CE2-CG 4.09Å; Y177-L181 WeakPolarHBondContact OH-CD1 3.47Å; Q178-L181 PolarHBondContact O-N 2.91Å; Q178-L181 VanDerWaalsContact O-N 3.14Å; P179-L181 PolarHBondContact O-N 3.27Å; L181-I183 PolarHBondContact O-N 2.89Å; L181-L184 HydrophobicContact CD2-CD1 4.37Å; L181-L184 PolarHBondContact O-N 3.36Å; L181-V199 HydrophobicContact CD2-CG1 3.95Å |
| 182 | V | 85.9 | Confident | 89.1 | Confident | 38 Ų | 38 | 32.1 Ų | 32.1 | 23% | 0.23 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -61.8 | -44.4 | -179.3 | 176.7 | 0 | 0 | 0 | 0 | 111.3 | T129 Q178 P179 L184 G185 H186 | T129-V182 HydrophobicContact CG2-CB 4.44Å; T129-V182 HydrophobicContact CG2-CG1 4.32Å; Q178-V182 PolarHBondContact O-N 2.96Å; P179-V182 PolarHBondContact O-N 3.4Å; V182-L184 PolarHBondContact O-N 2.94Å; V182-L184 VanDerWaalsContact O-N 3.17Å; V182-G185 PolarHBondContact O-N 3.34Å; V182-H186 PolarHBondContact O-CD2 3.07Å |
| 183 | I | 89.8 | Confident | 87.9 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 18% | 0.18 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.3 | -28.7 | -176.5 | -167.7 | 62.8 | 0 | 0 | 0 | 112.7 | V66 C134 P179 S180 L181 G185 H186 Y187 Y244 | V66-I183 HydrophobicContact CG1-CB 4.38Å; V66-I183 HydrophobicContact CG1-CG1 3.93Å; V66-I183 HydrophobicContact CG1-CG2 3.58Å; C134-I183 HydrophobicContact CB-CB 4.18Å; C134-I183 HydrophobicContact CB-CD1 4.23Å; P179-I183 WeakPolarHBondContact O-CB 3.49Å; P179-I183 WeakPolarHBondContact O-CG2 3.26Å; P179-I183 PolarHBondContact O-N 3.25Å; S180-I183 WeakPolarHBondContact O-CG2 3.28Å; L181-I183 PolarHBondContact O-N 2.89Å; I183-G185 VanDerWaalsContact C-N 3.25Å; I183-G185 PolarHBondContact O-N 3.34Å; I183-H186 HydrophobicContact CD1-CB 4.25Å; I183-H186 VanDerWaalsContact O-CB 3.28Å; I183-H186 WeakPolarHBondContact O-CB 3.44Å; I183-H186 PolarHBondContact O-N 3.29Å; I183-Y187 HydrophobicContact CD1-CE2 4.12Å; I183-Y187 HydrophobicContact CG1-CD2 4.4Å; I183-Y187 HydrophobicContact CG1-CE2 4.03Å; I183-Y187 WeakPolarHBondContact O-CD2 3.29Å; I183-Y244 HydrophobicContact CG1-CD1 4.48Å; I183-Y244 HydrophobicContact CG1-CG 4.28Å; I183-Y244 HydrophobicContact CG2-CD1 3.99Å; I183-Y244 HydrophobicContact CG2-CD2 4.35Å; I183-Y244 HydrophobicContact CG2-CE1 4.13Å; I183-Y244 HydrophobicContact CG2-CE2 4.49Å; I183-Y244 HydrophobicContact CG2-CG 4.12Å |
| 184 | L | 88.9 | Confident | 87.1 | Confident | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -62 | -36.8 | 178.2 | -58.5 | 168.6 | 0 | 0 | 0 | 111.4 | V66 M67 S180 L181 V182 H186 Y187 F188 L192 V195 N196 V199 | V66-L184 HydrophobicContact CG1-CD2 4.18Å; M67-L184 HydrophobicContact CB-CD2 4.24Å; S180-L184 WeakPolarHBondContact O-CG 3.36Å; L181-L184 HydrophobicContact CD2-CD1 4.37Å; L181-L184 PolarHBondContact O-N 3.36Å; V182-L184 PolarHBondContact O-N 2.94Å; V182-L184 VanDerWaalsContact O-N 3.17Å; L184-H186 PolarHBondContact O-N 3.47Å; L184-Y187 PolarHBondContact O-N 3.31Å; L184-Y187 VanDerWaalsContact O-N 3.07Å; L184-F188 PolarHBondContact O-N 3.17Å; L184-L192 HydrophobicContact CB-CD1 3.96Å; L184-V195 HydrophobicContact CB-CG1 4.17Å; L184-V195 HydrophobicContact CD1-CG1 4.11Å; L184-V195 HydrophobicContact CD2-CG1 3.79Å; L184-V195 HydrophobicContact CG-CG1 4.22Å; L184-N196 WeakPolarHBondContact CD1-OD1 3.42Å; L184-V199 HydrophobicContact CD1-CB 4.33Å; L184-V199 HydrophobicContact CD1-CG1 4.38Å; L184-V199 HydrophobicContact CD1-CG2 3.81Å; L184-V199 HydrophobicContact CD2-CG2 4.49Å |
| 185 | G | 84.8 | Confident | 86.6 | Confident | 23 Ų | 23 | 40 Ų | 40 | 24% | 0.237 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64.9 | -18.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | H57 V182 I183 | H57-G185 PolarHBondContact CE1-O 3.4Å; H57-G185 PolarHBondContact ND1-O 2.83Å; V182-G185 PolarHBondContact O-N 3.34Å; I183-G185 VanDerWaalsContact C-N 3.25Å; I183-G185 PolarHBondContact O-N 3.34Å |
| 186 | H | 87.1 | Confident | 86 | Confident | 24 Ų | 24 | 40.3 Ų | 40.3 | 11% | 0.111 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -77.5 | -30 | 174.3 | -62.5 | -148.8 | 0 | 0 | 0 | 110.8 | H57 V182 I183 L184 L247 L248 | H57-H186 PolarHBondContact ND1-O 3.35Å; V182-H186 PolarHBondContact O-CD2 3.07Å; I183-H186 HydrophobicContact CD1-CB 4.25Å; I183-H186 VanDerWaalsContact O-CB 3.28Å; I183-H186 WeakPolarHBondContact O-CB 3.44Å; I183-H186 PolarHBondContact O-N 3.29Å; L184-H186 PolarHBondContact O-N 3.47Å; H186-L247 HydrophobicContact CB-CB 4.5Å; H186-L248 HydrophobicContact CB-CD1 4.36Å; H186-L248 HydrophobicContact CB-CG 4.2Å; H186-L248 VanDerWaalsContact CD2-CD1 3.47Å; H186-L248 WeakPolarHBondContact CD2-CD1 3.42Å |
| 187 | Y | 88.3 | Confident | 85.1 | Confident | 5 Ų | 5 | 41.9 Ų | 41.9 | 2% | 0.02 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -95.7 | -33.4 | -176.7 | -73.7 | -94.5 | 0 | 0 | 0 | 113.5 | P58 E59 W62 V66 I183 L184 K245 L247 | P58-Y187 HydrophobicContact CG-CD1 4.42Å; E59-Y187 WeakPolarHBondContact CA-O 3.44Å; E59-Y187 PolarHBondContact N-O 2.87Å; W62-Y187 HydrophobicContact CB-CE1 4.22Å; V66-Y187 HydrophobicContact CG1-CD2 4.4Å; V66-Y187 HydrophobicContact CG1-CE2 4.41Å; V66-Y187 HydrophobicContact CG2-CD2 4.48Å; V66-Y187 HydrophobicContact CG2-CE2 3.96Å; I183-Y187 HydrophobicContact CD1-CE2 4.12Å; I183-Y187 HydrophobicContact CG1-CD2 4.4Å; I183-Y187 HydrophobicContact CG1-CE2 4.03Å; I183-Y187 WeakPolarHBondContact O-CD2 3.29Å; L184-Y187 PolarHBondContact O-N 3.31Å; L184-Y187 VanDerWaalsContact O-N 3.07Å; Y187-K245 WeakPolarHBondContact CE2-O 3.32Å; Y187-K245 WeakPolarHBondContact OH-CB 3.2Å; Y187-K245 PolarHBondContact OH-O 3.06Å; Y187-L247 HydrophobicContact CD1-CD1 3.72Å; Y187-L247 HydrophobicContact CD2-CD1 4.36Å; Y187-L247 HydrophobicContact CE1-CD1 3.38Å; Y187-L247 HydrophobicContact CE1-CG 4.19Å; Y187-L247 HydrophobicContact CE2-CD1 4.03Å; Y187-L247 HydrophobicContact CE2-CG 4.2Å; Y187-L247 HydrophobicContact CG-CD1 4.21Å |
| 188 | F | 84.3 | Confident | 84.8 | Confident | 1 Ų | 1 | 43 Ų | 43 | 0% | 0.004 | 23% | 0.233 | C | C | . | . | trans | -129.4 | 128.8 | -172 | -55 | -78.3 | 0 | 0 | 0 | 110.5 | G63 W64 L184 R191 L192 V195 | G63-F188 VanDerWaalsContact C-CZ 3.49Å; G63-F188 WeakPolarHBondContact O-CE2 3.49Å; W64-F188 HydrophobicContact CD2-CZ 4.24Å; W64-F188 HydrophobicContact CE3-CZ 4.3Å; W64-F188 HydrophobicContact CZ2-CE1 4.45Å; L184-F188 PolarHBondContact O-N 3.17Å; F188-R191 HydrophobicContact CB-CG 4.07Å; F188-R191 HydrophobicContact CD1-CG 3.47Å; F188-R191 VanDerWaalsContact CD1-CG 3.47Å; F188-R191 HydrophobicContact CE1-CG 4.2Å; F188-R191 HydrophobicContact CG-CG 4.06Å; F188-L192 HydrophobicContact CB-CB 4.48Å; F188-L192 HydrophobicContact CB-CD1 4.37Å; F188-V195 HydrophobicContact CB-CG2 4.42Å; F188-V195 HydrophobicContact CD1-CG2 4.12Å; F188-V195 HydrophobicContact CD2-CB 4.29Å; F188-V195 HydrophobicContact CD2-CG1 3.88Å; F188-V195 HydrophobicContact CD2-CG2 3.8Å; F188-V195 HydrophobicContact CE1-CG2 4.27Å; F188-V195 HydrophobicContact CE2-CG1 4.05Å; F188-V195 HydrophobicContact CE2-CG2 3.97Å; F188-V195 HydrophobicContact CG-CG2 3.86Å; F188-V195 HydrophobicContact CZ-CG2 4.18Å | ||
| 189 | K | 83.4 | Confident | 84.8 | Confident | 115 Ų | 115 | 42.5 Ų | 42.5 | 50% | 0.5 | 23% | 0.231 | S | C | . | . | S | Bend | trans | -116.4 | -48.6 | 172 | -178.8 | 174.5 | 178.6 | 176.4 | 0 | 110.6 | E54 H57 E59 | E54-K189 IonicContact OE1-NZ 2.7Å; E54-K189 PolarHBondContact OE1-NZ 3.35Å; H57-K189 HydrophobicContact CB-CB 4.24Å; E59-K189 WeakPolarHBondContact OE1-CA 3.47Å; E59-K189 PolarHBondContact OE1-N 3.32Å |
| 190 | K | 78.8 | Confident | 84.4 | Confident | 194 Ų | 194 | 44 Ų | 44 | 84% | 0.843 | 24% | 0.241 | S | C | * | . | S | Bend | trans | -71.4 | -41.1 | -178.3 | -64.9 | -176.4 | -179.8 | 179.7 | 0 | 112.6 | E59 | E59-K190 PolarHBondContact OE1-N 2.78Š|
| 191 | R | 79.9 | Confident | 84 | Confident | 100 Ų | 100 | 44.4 Ų | 44.4 | 38% | 0.377 | 24% | 0.244 | S | C | . | . | S | Bend | trans | -107.6 | 17.5 | -176.6 | 72.4 | -175.2 | 95.4 | -146.7 | 10.3 | 114.2 | E59 F188 G193 L194 V195 | E59-R191 VanDerWaalsContact O-CZ 3.25Å; E59-R191 PolarHBondContact O-NE 3.41Å; E59-R191 PolarHBondContact O-NH2 2.99Å; E59-R191 WeakPolarHBondContact OE2-CG 3.27Å; E59-R191 IonicContact OE2-CZ 3.81Å; E59-R191 IonicContact OE2-NE 3.84Å; E59-R191 PolarHBondContact OE2-NE 3.23Å; E59-R191 IonicContact OE2-NH2 3.86Å; F188-R191 HydrophobicContact CB-CG 4.07Å; F188-R191 HydrophobicContact CD1-CG 3.47Å; F188-R191 VanDerWaalsContact CD1-CG 3.47Å; F188-R191 HydrophobicContact CE1-CG 4.2Å; F188-R191 HydrophobicContact CG-CG 4.06Å; R191-G193 VanDerWaalsContact C-N 3.26Å; R191-G193 PolarHBondContact O-N 3.47Å; R191-L194 PolarHBondContact O-N 3.18Å; R191-L194 VanDerWaalsContact O-N 3.16Å; R191-V195 HydrophobicContact CG-CG2 4.05Å; R191-V195 WeakPolarHBondContact O-CG2 3.35Å; R191-V195 PolarHBondContact O-N 2.88Å; R191-V195 VanDerWaalsContact O-N 3.09Å |
| 192 | L | 78.9 | Confident | 84 | Confident | 51 Ų | 51 | 42.4 Ų | 42.4 | 27% | 0.267 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -59.4 | -36.5 | -173.7 | -175.2 | 59.2 | 0 | 0 | 0 | 112.6 | L184 F188 V195 N196 | L184-L192 HydrophobicContact CB-CD1 3.96Å; F188-L192 HydrophobicContact CB-CB 4.48Å; F188-L192 HydrophobicContact CB-CD1 4.37Å; L192-V195 PolarHBondContact O-N 2.97Å; L192-N196 WeakPolarHBondContact O-CB 3.35Å; L192-N196 PolarHBondContact O-N 3.44Å; L192-N196 PolarHBondContact O-ND2 2.94Å |
| 193 | G | 72.1 | Confident | 84.2 | Confident | 60 Ų | 60 | 40.8 Ų | 40.8 | 62% | 0.619 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -60.8 | -46.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113 | R191 V195 N196 G197 | R191-G193 VanDerWaalsContact C-N 3.26Å; R191-G193 PolarHBondContact O-N 3.47Å; G193-V195 PolarHBondContact O-N 3.1Å; G193-N196 PolarHBondContact O-N 3.28Å; G193-G197 PolarHBondContact O-N 3.35Å |
| 194 | L | 81.1 | Confident | 84 | Confident | 106 Ų | 106 | 40.9 Ų | 40.9 | 56% | 0.555 | 23% | 0.225 | S | C | * | . | H | α-helix | trans | -60.7 | -45.8 | 175.9 | 176.3 | 67.3 | 0 | 0 | 0 | 111.3 | R191 G197 I198 | R191-L194 PolarHBondContact O-N 3.18Å; R191-L194 VanDerWaalsContact O-N 3.16Å; L194-G197 PolarHBondContact O-N 2.8Å; L194-I198 HydrophobicContact CD1-CD1 4.36Å; L194-I198 HydrophobicContact CG-CD1 4.19Å; L194-I198 WeakPolarHBondContact O-CG1 3.22Å; L194-I198 PolarHBondContact O-N 3.18Å |
| 195 | V | 84.4 | Confident | 84 | Confident | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63 | -46.4 | -179.3 | 169.4 | 0 | 0 | 0 | 0 | 111 | W64 M67 L184 F188 R191 L192 G193 G197 I198 V199 | W64-V195 HydrophobicContact CZ3-CG2 4.46Å; M67-V195 HydrophobicContact CB-CG1 4.24Å; M67-V195 HydrophobicContact CG-CG1 3.74Å; L184-V195 HydrophobicContact CB-CG1 4.17Å; L184-V195 HydrophobicContact CD1-CG1 4.11Å; L184-V195 HydrophobicContact CD2-CG1 3.79Å; L184-V195 HydrophobicContact CG-CG1 4.22Å; F188-V195 HydrophobicContact CB-CG2 4.42Å; F188-V195 HydrophobicContact CD1-CG2 4.12Å; F188-V195 HydrophobicContact CD2-CB 4.29Å; F188-V195 HydrophobicContact CD2-CG1 3.88Å; F188-V195 HydrophobicContact CD2-CG2 3.8Å; F188-V195 HydrophobicContact CE1-CG2 4.27Å; F188-V195 HydrophobicContact CE2-CG1 4.05Å; F188-V195 HydrophobicContact CE2-CG2 3.97Å; F188-V195 HydrophobicContact CG-CG2 3.86Å; F188-V195 HydrophobicContact CZ-CG2 4.18Å; R191-V195 HydrophobicContact CG-CG2 4.05Å; R191-V195 WeakPolarHBondContact O-CG2 3.35Å; R191-V195 PolarHBondContact O-N 2.88Å; R191-V195 VanDerWaalsContact O-N 3.09Å; L192-V195 PolarHBondContact O-N 2.97Å; G193-V195 PolarHBondContact O-N 3.1Å; V195-G197 VanDerWaalsContact C-N 3.3Å; V195-G197 PolarHBondContact O-N 3.12Å; V195-I198 PolarHBondContact O-N 2.89Å; V195-V199 WeakPolarHBondContact O-CG2 3.46Å; V195-V199 PolarHBondContact O-N 3.25Å |
| 196 | N | 83.6 | Confident | 84.4 | Confident | 50 Ų | 50 | 44.9 Ų | 44.9 | 27% | 0.267 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -60.3 | -41.2 | 173.1 | -78.7 | -23.9 | 0 | 0 | 0 | 111.3 | L184 L192 G193 I198 V199 T200 | L184-N196 WeakPolarHBondContact CD1-OD1 3.42Å; L192-N196 WeakPolarHBondContact O-CB 3.35Å; L192-N196 PolarHBondContact O-N 3.44Å; L192-N196 PolarHBondContact O-ND2 2.94Å; G193-N196 PolarHBondContact O-N 3.28Å; N196-I198 PolarHBondContact O-N 3.27Å; N196-V199 PolarHBondContact O-N 2.83Å; N196-T200 WeakPolarHBondContact O-CB 3.48Å; N196-T200 PolarHBondContact O-N 3.46Å; N196-T200 PolarHBondContact O-OG1 3.49Å |
| 197 | G | 79.3 | Confident | 84.5 | Confident | 34 Ų | 34 | 43.9 Ų | 43.9 | 35% | 0.351 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -56.9 | -47.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | G193 L194 V195 T200 A201 | G193-G197 PolarHBondContact O-N 3.35Å; L194-G197 PolarHBondContact O-N 2.8Å; V195-G197 VanDerWaalsContact C-N 3.3Å; V195-G197 PolarHBondContact O-N 3.12Å; G197-T200 PolarHBondContact O-N 2.96Å; G197-A201 WeakPolarHBondContact O-CB 3.09Å; G197-A201 PolarHBondContact O-N 3.34Å |
| 198 | I | 86.2 | Confident | 84.6 | Confident | 47 Ų | 47 | 45 Ų | 45 | 24% | 0.241 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -64.4 | -46.2 | 177.4 | -63.9 | 166.6 | 0 | 0 | 0 | 110.9 | M67 M71 L194 V195 N196 T200 A201 G202 | M67-I198 HydrophobicContact CE-CG2 4.18Å; M67-I198 HydrophobicContact SD-CB 4.24Å; M67-I198 HydrophobicContact SD-CG2 3.57Å; M67-I198 VanDerWaalsContact SD-CG2 3.57Å; M71-I198 HydrophobicContact SD-CG2 4.18Å; L194-I198 HydrophobicContact CD1-CD1 4.36Å; L194-I198 HydrophobicContact CG-CD1 4.19Å; L194-I198 WeakPolarHBondContact O-CG1 3.22Å; L194-I198 PolarHBondContact O-N 3.18Å; V195-I198 PolarHBondContact O-N 2.89Å; N196-I198 PolarHBondContact O-N 3.27Å; I198-T200 VanDerWaalsContact C-N 3.32Å; I198-T200 PolarHBondContact O-N 3.21Å; I198-A201 WeakPolarHBondContact O-CB 3.36Å; I198-A201 PolarHBondContact O-N 3.11Å; I198-A201 VanDerWaalsContact O-N 3.16Å; I198-G202 PolarHBondContact O-N 2.92Å |
| 199 | V | 90 | Very high | 85 | Confident | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.8 | -44.7 | 178 | 167.7 | 0 | 0 | 0 | 0 | 110.8 | M67 M71 N74 L181 L184 V195 N196 G202 | M67-V199 HydrophobicContact CG-CG2 3.91Å; M67-V199 WeakPolarHBondContact O-CG2 3.48Å; M67-V199 HydrophobicContact SD-CG2 4.31Å; M71-V199 HydrophobicContact CB-CG2 4.32Å; N74-V199 HydrophobicContact CB-CG1 3.99Å; N74-V199 PolarHBondContact ND2-O 2.8Å; L181-V199 HydrophobicContact CD2-CG1 3.95Å; L184-V199 HydrophobicContact CD1-CB 4.33Å; L184-V199 HydrophobicContact CD1-CG1 4.38Å; L184-V199 HydrophobicContact CD1-CG2 3.81Å; L184-V199 HydrophobicContact CD2-CG2 4.49Å; V195-V199 WeakPolarHBondContact O-CG2 3.46Å; V195-V199 PolarHBondContact O-N 3.25Å; N196-V199 PolarHBondContact O-N 2.83Å; V199-G202 PolarHBondContact O-N 3.16Å |
| 200 | T | 83.9 | Confident | 85.5 | Confident | 33 Ų | 33 | 43.1 Ų | 43.1 | 20% | 0.202 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.6 | -33.6 | 176.6 | -53.4 | 0 | 0 | 0 | 0 | 112.3 | N74 N196 G197 I198 G202 S203 R325 I382 | N74-T200 VanDerWaalsContact ND2-CA 3.31Å; N74-T200 WeakPolarHBondContact ND2-CA 3.24Å; N74-T200 PolarHBondContact ND2-O 3.39Å; N196-T200 WeakPolarHBondContact O-CB 3.48Å; N196-T200 PolarHBondContact O-N 3.46Å; N196-T200 PolarHBondContact O-OG1 3.49Å; G197-T200 PolarHBondContact O-N 2.96Å; I198-T200 VanDerWaalsContact C-N 3.32Å; I198-T200 PolarHBondContact O-N 3.21Å; T200-G202 PolarHBondContact O-N 2.86Å; T200-S203 PolarHBondContact O-N 3.27Å; T200-S203 PolarHBondContact O-OG 3.22Å; T200-R325 PolarHBondContact O-NH1 3.18Å; T200-I382 HydrophobicContact CG2-CG2 3.9Å |
| 201 | A | 84.9 | Confident | 86.2 | Confident | 8 Ų | 8 | 33.9 Ų | 33.9 | 7% | 0.066 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -61.7 | -27.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | G197 I198 S203 G204 V205 F326 | G197-A201 WeakPolarHBondContact O-CB 3.09Å; G197-A201 PolarHBondContact O-N 3.34Å; I198-A201 WeakPolarHBondContact O-CB 3.36Å; I198-A201 PolarHBondContact O-N 3.11Å; I198-A201 VanDerWaalsContact O-N 3.16Å; A201-S203 VanDerWaalsContact C-N 3.26Å; A201-S203 PolarHBondContact O-N 3.43Å; A201-G204 WeakPolarHBondContact O-CA 3.47Å; A201-G204 PolarHBondContact O-N 3.42Å; A201-V205 PolarHBondContact O-N 2.96Å; A201-F326 HydrophobicContact CB-CE2 4.26Å; A201-F326 HydrophobicContact CB-CZ 4.27Å |
| 202 | G | 88.3 | Confident | 86.8 | Confident | 1 Ų | 1 | 32.6 Ų | 32.6 | 1% | 0.01 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -53.5 | -36.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | I198 V199 T200 G204 V205 F206 | I198-G202 PolarHBondContact O-N 2.92Å; V199-G202 PolarHBondContact O-N 3.16Å; T200-G202 PolarHBondContact O-N 2.86Å; G202-G204 VanDerWaalsContact C-N 3.31Å; G202-G204 PolarHBondContact O-N 3.23Å; G202-V205 PolarHBondContact O-N 2.99Å; G202-F206 PolarHBondContact O-N 2.87Å; G202-F206 VanDerWaalsContact O-N 3.17Å |
| 203 | S | 89.6 | Confident | 87.6 | Confident | 5 Ų | 5 | 34.2 Ų | 34.2 | 4% | 0.035 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -67.3 | -31.3 | 175.7 | 68.3 | 0 | 0 | 0 | 0 | 113 | T200 A201 T207 R325 | T200-S203 PolarHBondContact O-N 3.27Å; T200-S203 PolarHBondContact O-OG 3.22Å; A201-S203 VanDerWaalsContact C-N 3.26Å; A201-S203 PolarHBondContact O-N 3.43Å; S203-T207 VanDerWaalsContact O-CB 3.29Å; S203-T207 WeakPolarHBondContact O-CB 3.33Å; S203-T207 PolarHBondContact O-N 3.23Å; S203-T207 PolarHBondContact O-OG1 3.3Å; S203-R325 PolarHBondContact OG-NH1 2.7Å |
| 204 | G | 85.8 | Confident | 88.6 | Confident | 2 Ų | 2 | 31.3 Ų | 31.3 | 2% | 0.021 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -64.4 | -46.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | A201 G202 F206 T207 V208 | A201-G204 WeakPolarHBondContact O-CA 3.47Å; A201-G204 PolarHBondContact O-N 3.42Å; G202-G204 VanDerWaalsContact C-N 3.31Å; G202-G204 PolarHBondContact O-N 3.23Å; G204-F206 VanDerWaalsContact C-N 3.35Å; G204-F206 PolarHBondContact O-N 3.18Å; G204-T207 PolarHBondContact O-N 3.21Å; G204-V208 VanDerWaalsContact O-CG2 3.31Å; G204-V208 WeakPolarHBondContact O-CG2 3.28Å; G204-V208 PolarHBondContact O-N 3.28Å |
| 205 | V | 90 | Very high | 89.2 | Confident | 71 Ų | 71 | 27 Ų | 27 | 43% | 0.43 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -59.9 | -43.6 | 178.5 | 179 | 0 | 0 | 0 | 0 | 111.9 | M71 A201 G202 V208 T209 | M71-V205 HydrophobicContact CE-CG2 4.5Å; A201-V205 PolarHBondContact O-N 2.96Å; G202-V205 PolarHBondContact O-N 2.99Å; V205-V208 WeakPolarHBondContact O-CB 3.48Å; V205-V208 PolarHBondContact O-N 3.2Å; V205-T209 WeakPolarHBondContact O-CB 3.22Å; V205-T209 PolarHBondContact O-N 3.06Å; V205-T209 PolarHBondContact O-OG1 2.93Å |
| 206 | F | 92.5 | Very high | 89.6 | Confident | 35 Ų | 35 | 33 Ų | 33 | 15% | 0.154 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -70.5 | -38.5 | 176.2 | -87.9 | -107.9 | 0 | 0 | 0 | 112.5 | W72 G75 G202 G204 V208 T209 L210 L233 | W72-F206 HydrophobicContact CD2-CZ 4.09Å; W72-F206 HydrophobicContact CE3-CE2 4.27Å; W72-F206 AromaticContact CE3-CZ 3.77Å; W72-F206 HydrophobicContact CE3-CZ 3.77Å; W72-F206 HydrophobicContact CH2-CZ 4.06Å; W72-F206 HydrophobicContact CZ2-CZ 4.35Å; W72-F206 HydrophobicContact CZ3-CE2 4.49Å; W72-F206 AromaticContact CZ3-CZ 3.76Å; W72-F206 HydrophobicContact CZ3-CZ 3.76Å; G75-F206 VanDerWaalsContact C-CG 3.43Å; G75-F206 WeakPolarHBondContact O-CB 3.39Å; G75-F206 VanDerWaalsContact O-CG 3.28Å; G75-F206 WeakPolarHBondContact O-CG 3.34Å; G202-F206 PolarHBondContact O-N 2.87Å; G202-F206 VanDerWaalsContact O-N 3.17Å; G204-F206 VanDerWaalsContact C-N 3.35Å; G204-F206 PolarHBondContact O-N 3.18Å; F206-V208 PolarHBondContact O-N 3.37Å; F206-T209 PolarHBondContact O-N 3.47Å; F206-L210 WeakPolarHBondContact O-CB 3.44Å; F206-L210 PolarHBondContact O-N 3.47Å; F206-L233 HydrophobicContact CE1-CD1 4.36Å; F206-L233 HydrophobicContact CE1-CD2 4.25Å |
| 207 | T | 89.4 | Confident | 90.2 | Very high | 4 Ų | 4 | 32.1 Ų | 32.1 | 3% | 0.025 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63 | -26.1 | 174.4 | -56.1 | 0 | 0 | 0 | 0 | 111.7 | N82 S203 G204 P211 | N82-T207 HydrophobicContact CB-CG2 3.95Å; N82-T207 PolarHBondContact ND2-OG1 3.08Å; N82-T207 VanDerWaalsContact ND2-OG1 3.07Å; S203-T207 VanDerWaalsContact O-CB 3.29Å; S203-T207 WeakPolarHBondContact O-CB 3.33Å; S203-T207 PolarHBondContact O-N 3.23Å; S203-T207 PolarHBondContact O-OG1 3.3Å; G204-T207 PolarHBondContact O-N 3.21Å; T207-P211 WeakPolarHBondContact O-CD 3.23Å; T207-P211 WeakPolarHBondContact O-CG 3.28Å |
| 208 | V | 91.1 | Very high | 90.9 | Very high | 29 Ų | 29 | 31.5 Ų | 31.5 | 18% | 0.176 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -77.6 | -45.8 | 173.4 | 158.2 | 0 | 0 | 0 | 0 | 112 | G204 V205 F206 F212 L315 I319 | G204-V208 VanDerWaalsContact O-CG2 3.31Å; G204-V208 WeakPolarHBondContact O-CG2 3.28Å; G204-V208 PolarHBondContact O-N 3.28Å; V205-V208 WeakPolarHBondContact O-CB 3.48Å; V205-V208 PolarHBondContact O-N 3.2Å; F206-V208 PolarHBondContact O-N 3.37Å; V208-F212 VanDerWaalsContact O-CD2 3.28Å; V208-F212 WeakPolarHBondContact O-CD2 3.3Å; V208-F212 WeakPolarHBondContact O-CE2 3.12Å; V208-L315 HydrophobicContact CB-CD1 3.98Å; V208-L315 HydrophobicContact CG1-CD1 3.28Å; V208-L315 HydrophobicContact CG2-CD1 4Å; V208-I319 HydrophobicContact CG2-CB 4.5Å; V208-I319 HydrophobicContact CG2-CG1 3.61Å |
| 209 | T | 92.8 | Very high | 91.2 | Very high | 66 Ų | 66 | 36 Ų | 36 | 41% | 0.405 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -90.3 | -40.9 | -166.6 | -48.4 | 0 | 0 | 0 | 0 | 112.5 | V205 F206 F212 I213 | V205-T209 WeakPolarHBondContact O-CB 3.22Å; V205-T209 PolarHBondContact O-N 3.06Å; V205-T209 PolarHBondContact O-OG1 2.93Å; F206-T209 PolarHBondContact O-N 3.47Å; T209-F212 PolarHBondContact O-N 2.91Å; T209-I213 HydrophobicContact CG2-CD1 3.78Å; T209-I213 PolarHBondContact O-N 3.07Å |
| 210 | L | 93.5 | Very high | 91.4 | Very high | 10 Ų | 10 | 42.2 Ų | 42.2 | 5% | 0.052 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -65.6 | -36.7 | -172.3 | -163.6 | 67.2 | 0 | 0 | 0 | 113.7 | G79 I80 F206 F212 I213 L214 L230 L233 | G79-L210 VanDerWaalsContact C-CD2 3.44Å; I80-L210 HydrophobicContact CB-CD2 4.4Å; I80-L210 HydrophobicContact CG1-CD2 3.83Å; F206-L210 WeakPolarHBondContact O-CB 3.44Å; F206-L210 PolarHBondContact O-N 3.47Å; L210-F212 PolarHBondContact O-N 3.44Å; L210-I213 PolarHBondContact O-N 3.48Å; L210-L214 HydrophobicContact CD1-CG 4.44Å; L210-L214 HydrophobicContact CD2-CD1 4.18Å; L210-L214 HydrophobicContact CG-CD1 3.86Å; L210-L214 HydrophobicContact CG-CG 4.02Å; L210-L214 WeakPolarHBondContact O-CB 3.4Å; L210-L214 VanDerWaalsContact O-CG 3.31Å; L210-L214 WeakPolarHBondContact O-CG 3.39Å; L210-L214 PolarHBondContact O-N 3.41Å; L210-L230 HydrophobicContact CD1-CD2 4.11Å; L210-L230 HydrophobicContact CD2-CD2 4.47Å; L210-L233 HydrophobicContact CD1-CD1 4.02Å |
| 211 | P | 92.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -51.8 | -47.9 | 174.4 | -35.8 | 42.4 | 0 | 0 | 0 | 114.5 | S83 I86 T207 L214 S215 L314 | S83-P211 WeakPolarHBondContact OG-CD 3.15Å; I86-P211 HydrophobicContact CD1-CB 3.41Å; I86-P211 VanDerWaalsContact CD1-CB 3.41Å; I86-P211 HydrophobicContact CD1-CG 4.24Å; I86-P211 WeakPolarHBondContact CD1-O 3.48Å; T207-P211 WeakPolarHBondContact O-CD 3.23Å; T207-P211 WeakPolarHBondContact O-CG 3.28Å; P211-L214 PolarHBondContact O-N 2.97Å; P211-S215 PolarHBondContact O-N 3.06Å; P211-S215 PolarHBondContact O-OG 3.37Å; P211-L314 HydrophobicContact CB-CB 4.45Å; P211-L314 HydrophobicContact CB-CD1 4.27Å; P211-L314 HydrophobicContact CG-CB 3.99Å; P211-L314 HydrophobicContact CG-CD1 3.95Å |
| 212 | F | 93.1 | Very high | 92.3 | Very high | 73 Ų | 73 | 44.5 Ų | 44.5 | 32% | 0.32 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -67.5 | -40.2 | -179.5 | -64 | -81.8 | 0 | 0 | 0 | 112.3 | V208 T209 L210 L214 K216 E311 I312 L315 | V208-F212 VanDerWaalsContact O-CD2 3.28Å; V208-F212 WeakPolarHBondContact O-CD2 3.3Å; V208-F212 WeakPolarHBondContact O-CE2 3.12Å; T209-F212 PolarHBondContact O-N 2.91Å; L210-F212 PolarHBondContact O-N 3.44Å; F212-L214 VanDerWaalsContact C-N 3.32Å; F212-K216 WeakPolarHBondContact O-CB 3.21Å; F212-K216 PolarHBondContact O-N 2.78Å; F212-K216 VanDerWaalsContact O-N 3.17Å; F212-E311 HydrophobicContact CD1-CB 3.92Å; F212-E311 HydrophobicContact CD1-CG 4.47Å; F212-E311 HydrophobicContact CE1-CB 3.62Å; F212-E311 HydrophobicContact CZ-CB 3.97Å; F212-I312 HydrophobicContact CZ-CG1 4.48Å; F212-L315 HydrophobicContact CE2-CB 3.88Å; F212-L315 HydrophobicContact CE2-CD1 4.09Å; F212-L315 HydrophobicContact CE2-CD2 4.12Å; F212-L315 HydrophobicContact CE2-CG 4.25Å; F212-L315 HydrophobicContact CZ-CB 4.01Å; F212-L315 HydrophobicContact CZ-CD2 3.87Å; F212-L315 HydrophobicContact CZ-CG 4.4Å |
| 213 | I | 94.6 | Very high | 92.6 | Very high | 84 Ų | 84 | 45.5 Ų | 45.5 | 43% | 0.431 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -63.6 | -43.5 | 176 | -63.8 | 171.9 | 0 | 0 | 0 | 109.7 | T209 L210 K216 L217 | T209-I213 HydrophobicContact CG2-CD1 3.78Å; T209-I213 PolarHBondContact O-N 3.07Å; L210-I213 PolarHBondContact O-N 3.48Å; I213-K216 PolarHBondContact O-N 3.26Å; I213-L217 HydrophobicContact CG2-CD1 3.72Å; I213-L217 HydrophobicContact CG2-CG 4.26Å; I213-L217 WeakPolarHBondContact O-CB 3.49Å; I213-L217 VanDerWaalsContact O-CG 3.25Å; I213-L217 WeakPolarHBondContact O-CG 3.19Å; I213-L217 PolarHBondContact O-N 2.99Å |
| 214 | L | 94.4 | Very high | 92.8 | Very high | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -65.1 | -48.2 | 179.8 | -77 | 175.4 | 0 | 0 | 0 | 112.3 | I86 L87 L210 P211 F212 K216 L217 L218 T226 L230 | I86-L214 HydrophobicContact CG2-CB 4.32Å; L87-L214 HydrophobicContact CD2-CD2 4.38Å; L210-L214 HydrophobicContact CD1-CG 4.44Å; L210-L214 HydrophobicContact CD2-CD1 4.18Å; L210-L214 HydrophobicContact CG-CD1 3.86Å; L210-L214 HydrophobicContact CG-CG 4.02Å; L210-L214 WeakPolarHBondContact O-CB 3.4Å; L210-L214 VanDerWaalsContact O-CG 3.31Å; L210-L214 WeakPolarHBondContact O-CG 3.39Å; L210-L214 PolarHBondContact O-N 3.41Å; P211-L214 PolarHBondContact O-N 2.97Å; F212-L214 VanDerWaalsContact C-N 3.32Å; L214-K216 VanDerWaalsContact C-N 3.31Å; L214-K216 PolarHBondContact O-N 3.28Å; L214-L217 PolarHBondContact O-N 3.37Å; L214-L218 WeakPolarHBondContact O-CB 3.26Å; L214-L218 WeakPolarHBondContact O-CG 3.3Å; L214-L218 PolarHBondContact O-N 2.96Å; L214-T226 HydrophobicContact CD2-CG2 3.48Å; L214-T226 VanDerWaalsContact CD2-CG2 3.48Å; L214-L230 HydrophobicContact CD2-CD1 3.98Å; L214-L230 HydrophobicContact CD2-CD2 3.97Å; L214-L230 HydrophobicContact CD2-CG 4.11Å |
| 215 | S | 92.8 | Very high | 93.3 | Very high | 16 Ų | 16 | 51.7 Ų | 51.7 | 11% | 0.112 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -57.2 | -47 | 177.4 | -66.7 | 0 | 0 | 0 | 0 | 110.9 | P211 L217 L218 D219 E311 | P211-S215 PolarHBondContact O-N 3.06Å; P211-S215 PolarHBondContact O-OG 3.37Å; S215-L217 PolarHBondContact O-N 3.35Å; S215-L218 PolarHBondContact O-N 3.19Å; S215-D219 VanDerWaalsContact O-CG 3.28Å; S215-D219 PolarHBondContact O-N 3.11Å; S215-E311 WeakPolarHBondContact CB-OE1 3.25Å; S215-E311 VanDerWaalsContact OG-CG 3.29Å; S215-E311 WeakPolarHBondContact OG-CG 3.33Å; S215-E311 PolarHBondContact OG-OE1 3.22Å |
| 216 | K | 93.9 | Very high | 93.6 | Very high | 126 Ų | 126 | 48.3 Ų | 48.3 | 55% | 0.548 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62 | -44.3 | 177.7 | -172.5 | 176.8 | 179.5 | -179.9 | 0 | 113.1 | F212 I213 L214 L218 D219 E220 | F212-K216 WeakPolarHBondContact O-CB 3.21Å; F212-K216 PolarHBondContact O-N 2.78Å; F212-K216 VanDerWaalsContact O-N 3.17Å; I213-K216 PolarHBondContact O-N 3.26Å; L214-K216 VanDerWaalsContact C-N 3.31Å; L214-K216 PolarHBondContact O-N 3.28Å; K216-L218 VanDerWaalsContact C-N 3.35Å; K216-D219 PolarHBondContact O-N 3.36Å; K216-E220 WeakPolarHBondContact CE-OE1 3.25Å; K216-E220 IonicContact NZ-OE1 3.36Å; K216-E220 PolarHBondContact O-N 2.8Å |
| 217 | L | 95.1 | Very high | 93.8 | Very high | 31 Ų | 31 | 46.9 Ų | 46.9 | 16% | 0.162 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.1 | -39.3 | 177.9 | -75.4 | 173.2 | 0 | 0 | 0 | 112 | I213 L214 S215 D219 E220 V221 G222 T226 V229 | I213-L217 HydrophobicContact CG2-CD1 3.72Å; I213-L217 HydrophobicContact CG2-CG 4.26Å; I213-L217 WeakPolarHBondContact O-CB 3.49Å; I213-L217 VanDerWaalsContact O-CG 3.25Å; I213-L217 WeakPolarHBondContact O-CG 3.19Å; I213-L217 PolarHBondContact O-N 2.99Å; L214-L217 PolarHBondContact O-N 3.37Å; S215-L217 PolarHBondContact O-N 3.35Å; L217-D219 VanDerWaalsContact C-N 3.31Å; L217-D219 PolarHBondContact O-N 3.4Å; L217-E220 PolarHBondContact O-N 2.96Å; L217-V221 HydrophobicContact CB-CG2 4.37Å; L217-V221 HydrophobicContact CD2-CG2 4.15Å; L217-V221 WeakPolarHBondContact O-CG2 3.5Å; L217-V221 PolarHBondContact O-N 3.45Å; L217-G222 PolarHBondContact O-N 3.02Å; L217-T226 HydrophobicContact CB-CG2 4.03Å; L217-T226 HydrophobicContact CD1-CG2 4.44Å; L217-T226 PolarHBondContact O-OG1 3.19Å; L217-V229 HydrophobicContact CD1-CB 4.17Å; L217-V229 HydrophobicContact CD1-CG1 3.7Å; L217-V229 HydrophobicContact CD2-CG2 4.45Å |
| 218 | L | 94.5 | Very high | 94.2 | Very high | 21 Ų | 21 | 51 Ų | 51 | 11% | 0.11 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -64.4 | -39.2 | 178.2 | -71.9 | 169.3 | 0 | 0 | 0 | 111.4 | I86 L87 L214 S215 K216 G222 L223 T226 | I86-L218 HydrophobicContact CG2-CD1 3.53Å; L87-L218 HydrophobicContact CD2-CD1 4.35Å; L87-L218 HydrophobicContact CD2-CD2 4.31Å; L214-L218 WeakPolarHBondContact O-CB 3.26Å; L214-L218 WeakPolarHBondContact O-CG 3.3Å; L214-L218 PolarHBondContact O-N 2.96Å; S215-L218 PolarHBondContact O-N 3.19Å; K216-L218 VanDerWaalsContact C-N 3.35Å; L218-G222 VanDerWaalsContact O-CA 3.27Å; L218-G222 WeakPolarHBondContact O-CA 3.41Å; L218-G222 PolarHBondContact O-N 3.26Å; L218-L223 HydrophobicContact CD2-CB 4.21Å; L218-L223 HydrophobicContact CD2-CD1 3.94Å; L218-T226 HydrophobicContact CD2-CG2 3.98Å; L218-T226 HydrophobicContact CG-CG2 4.16Å; L218-T226 PolarHBondContact N-OG1 3.21Å |
| 219 | D | 91.4 | Very high | 94.5 | Very high | 141 Ų | 141 | 52.4 Ų | 52.4 | 75% | 0.754 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -71.4 | -41.6 | 178.6 | -66.8 | -20.2 | 0 | 0 | 0 | 112.3 | S215 K216 L217 | S215-D219 VanDerWaalsContact O-CG 3.28Å; S215-D219 PolarHBondContact O-N 3.11Å; K216-D219 PolarHBondContact O-N 3.36Å; L217-D219 VanDerWaalsContact C-N 3.31Å; L217-D219 PolarHBondContact O-N 3.4Å |
| 220 | E | 94.5 | Very high | 94.6 | Very high | 131 Ų | 131 | 49.5 Ų | 49.5 | 61% | 0.612 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -84.8 | -41.8 | -174.6 | -71.2 | -177.7 | 179.5 | 0 | 0 | 113.9 | K216 L217 | K216-E220 WeakPolarHBondContact CE-OE1 3.25Å; K216-E220 IonicContact NZ-OE1 3.36Å; K216-E220 PolarHBondContact O-N 2.8Å; L217-E220 PolarHBondContact O-N 2.96Å |
| 221 | V | 94.3 | Very high | 94.8 | Very high | 62 Ų | 62 | 49.6 Ų | 49.6 | 38% | 0.376 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -121.8 | -6 | -170.9 | -57.4 | 0 | 0 | 0 | 0 | 114 | L217 N225 | L217-V221 HydrophobicContact CB-CG2 4.37Å; L217-V221 HydrophobicContact CD2-CG2 4.15Å; L217-V221 WeakPolarHBondContact O-CG2 3.5Å; L217-V221 PolarHBondContact O-N 3.45Å; V221-N225 HydrophobicContact CB-CB 3.96Å; V221-N225 HydrophobicContact CG2-CB 3.83Å; V221-N225 WeakPolarHBondContact O-CB 3.46Å; V221-N225 PolarHBondContact O-ND2 3.39Å |
| 222 | G | 93.8 | Very high | 95.1 | Very high | 27 Ų | 27 | 54.4 Ų | 54.4 | 28% | 0.278 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | 80.1 | 171.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | L217 L218 Q224 T226 | L217-G222 PolarHBondContact O-N 3.02Å; L218-G222 VanDerWaalsContact O-CA 3.27Å; L218-G222 WeakPolarHBondContact O-CA 3.41Å; L218-G222 PolarHBondContact O-N 3.26Å; G222-Q224 PolarHBondContact O-N 3.01Å; G222-T226 WeakPolarHBondContact O-CB 3.46Å; G222-T226 PolarHBondContact O-N 3.07Å; G222-T226 PolarHBondContact O-OG1 2.8Å |
| 223 | L | 93.9 | Very high | 95.2 | Very high | 21 Ų | 21 | 52.2 Ų | 52.2 | 11% | 0.11 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -57.6 | -50.8 | -173.1 | 178.3 | 64.7 | 0 | 0 | 0 | 113.7 | L87 L91 L218 N225 T226 L227 | L87-L223 HydrophobicContact CD2-CD1 4.14Å; L91-L223 HydrophobicContact CD2-CD2 3.53Å; L91-L223 HydrophobicContact CG-CD1 4.49Å; L91-L223 HydrophobicContact CG-CD2 4.1Å; L218-L223 HydrophobicContact CD2-CB 4.21Å; L218-L223 HydrophobicContact CD2-CD1 3.94Å; L223-N225 PolarHBondContact O-N 3.27Å; L223-T226 WeakPolarHBondContact O-CB 3.44Å; L223-T226 PolarHBondContact O-N 2.83Å; L223-L227 HydrophobicContact CD1-CG 4.5Å; L223-L227 WeakPolarHBondContact O-CG 3.43Å; L223-L227 PolarHBondContact O-N 3.25Å |
| 224 | Q | 94.7 | Very high | 95.3 | Very high | 67 Ų | 67 | 48.2 Ų | 48.2 | 31% | 0.313 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -63.3 | -44.6 | -174.3 | -67 | 162.8 | 18.2 | 0 | 0 | 111.3 | S153 G222 L227 R228 | S153-Q224 WeakPolarHBondContact CB-O 3.42Å; S153-Q224 WeakPolarHBondContact O-CB 3.34Å; S153-Q224 WeakPolarHBondContact O-CG 3.39Å; G222-Q224 PolarHBondContact O-N 3.01Å; Q224-L227 PolarHBondContact O-N 2.97Å; Q224-R228 WeakPolarHBondContact O-CG 3.36Å; Q224-R228 PolarHBondContact O-N 3.16Å |
| 225 | N | 95.4 | Very high | 95.5 | Very high | 71 Ų | 71 | 53.4 Ų | 53.4 | 38% | 0.38 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -70.6 | -33.5 | 177 | -64.5 | -42.1 | 0 | 0 | 0 | 111.8 | V221 L223 L227 R228 V229 | V221-N225 HydrophobicContact CB-CB 3.96Å; V221-N225 HydrophobicContact CG2-CB 3.83Å; V221-N225 WeakPolarHBondContact O-CB 3.46Å; V221-N225 PolarHBondContact O-ND2 3.39Å; L223-N225 PolarHBondContact O-N 3.27Å; N225-L227 VanDerWaalsContact C-N 3.34Å; N225-L227 PolarHBondContact O-N 3.38Å; N225-R228 WeakPolarHBondContact O-CB 3.13Å; N225-R228 PolarHBondContact O-N 3.37Å; N225-R228 VanDerWaalsContact O-N 3.12Å; N225-R228 PolarHBondContact OD1-NH1 2.86Å; N225-V229 WeakPolarHBondContact O-CG2 3.47Å; N225-V229 PolarHBondContact O-N 3.01Å |
| 226 | T | 97 | Very high | 95.7 | Very high | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -58.8 | -44.6 | 172.6 | -61 | 0 | 0 | 0 | 0 | 111.5 | L87 L214 L217 L218 G222 L223 R228 V229 L230 | L87-T226 HydrophobicContact CD2-CG2 4.48Å; L214-T226 HydrophobicContact CD2-CG2 3.48Å; L214-T226 VanDerWaalsContact CD2-CG2 3.48Å; L217-T226 HydrophobicContact CB-CG2 4.03Å; L217-T226 HydrophobicContact CD1-CG2 4.44Å; L217-T226 PolarHBondContact O-OG1 3.19Å; L218-T226 HydrophobicContact CD2-CG2 3.98Å; L218-T226 HydrophobicContact CG-CG2 4.16Å; L218-T226 PolarHBondContact N-OG1 3.21Å; G222-T226 WeakPolarHBondContact O-CB 3.46Å; G222-T226 PolarHBondContact O-N 3.07Å; G222-T226 PolarHBondContact O-OG1 2.8Å; L223-T226 WeakPolarHBondContact O-CB 3.44Å; L223-T226 PolarHBondContact O-N 2.83Å; T226-R228 VanDerWaalsContact C-N 3.29Å; T226-R228 PolarHBondContact O-N 3.42Å; T226-V229 PolarHBondContact O-N 3.36Å; T226-L230 WeakPolarHBondContact O-CG 3.37Å; T226-L230 PolarHBondContact O-N 3.12Å |
| 227 | L | 96.6 | Very high | 95.8 | Very high | 5 Ų | 5 | 49.1 Ų | 49.1 | 3% | 0.026 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.9 | -35.9 | 175.1 | -65.9 | 177.4 | 0 | 0 | 0 | 112.3 | L149 M161 Y165 L223 Q224 N225 L230 C231 | L149-L227 HydrophobicContact CD1-CD2 4.08Å; M161-L227 HydrophobicContact CE-CD1 4.16Å; Y165-L227 HydrophobicContact CE2-CD2 4.4Å; L223-L227 HydrophobicContact CD1-CG 4.5Å; L223-L227 WeakPolarHBondContact O-CG 3.43Å; L223-L227 PolarHBondContact O-N 3.25Å; Q224-L227 PolarHBondContact O-N 2.97Å; N225-L227 VanDerWaalsContact C-N 3.34Å; N225-L227 PolarHBondContact O-N 3.38Å; L227-L230 HydrophobicContact CD2-CD1 4.41Å; L227-L230 PolarHBondContact O-N 3.42Å; L227-C231 PolarHBondContact O-N 3.41Å; L227-C231 PolarHBondContact O-SG 3.24Å |
| 228 | R | 97.4 | Very high | 95.9 | Very high | 90 Ų | 90 | 48.8 Ų | 48.8 | 34% | 0.34 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -67.4 | -40.4 | 174 | -65 | 171.8 | -174.4 | 163.9 | -3.9 | 112.2 | L150 S153 Q224 N225 T226 L230 C231 | L150-R228 HydrophobicContact CD1-CG 4.27Å; S153-R228 WeakPolarHBondContact OG-CG 3.4Å; S153-R228 PolarHBondContact OG-NE 3.46Å; Q224-R228 WeakPolarHBondContact O-CG 3.36Å; Q224-R228 PolarHBondContact O-N 3.16Å; N225-R228 WeakPolarHBondContact O-CB 3.13Å; N225-R228 PolarHBondContact O-N 3.37Å; N225-R228 VanDerWaalsContact O-N 3.12Å; N225-R228 PolarHBondContact OD1-NH1 2.86Å; T226-R228 VanDerWaalsContact C-N 3.29Å; T226-R228 PolarHBondContact O-N 3.42Å; R228-L230 VanDerWaalsContact C-N 3.32Å; R228-L230 PolarHBondContact O-N 3.18Å; R228-C231 WeakPolarHBondContact O-CB 3.3Å; R228-C231 PolarHBondContact O-N 3.25Å; R228-C231 VanDerWaalsContact O-N 3.11Å |
| 229 | V | 97.1 | Very high | 96.1 | Very high | 59 Ų | 59 | 52.1 Ų | 52.1 | 36% | 0.358 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -63.3 | -40.2 | 174.9 | 174 | 0 | 0 | 0 | 0 | 110.6 | L217 N225 T226 C231 I232 | L217-V229 HydrophobicContact CD1-CB 4.17Å; L217-V229 HydrophobicContact CD1-CG1 3.7Å; L217-V229 HydrophobicContact CD2-CG2 4.45Å; N225-V229 WeakPolarHBondContact O-CG2 3.47Å; N225-V229 PolarHBondContact O-N 3.01Å; T226-V229 PolarHBondContact O-N 3.36Å; V229-C231 PolarHBondContact O-N 2.84Å; V229-I232 HydrophobicContact CG1-CD1 4.38Å; V229-I232 VanDerWaalsContact O-CB 3.23Å; V229-I232 WeakPolarHBondContact O-CB 3.45Å; V229-I232 VanDerWaalsContact O-CG1 3.3Å; V229-I232 WeakPolarHBondContact O-CG1 3.37Å; V229-I232 PolarHBondContact O-N 3.05Å |
| 230 | L | 96.6 | Very high | 96.3 | Very high | 4 Ų | 4 | 45.9 Ų | 45.9 | 2% | 0.021 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -62.3 | -23 | 174.6 | -71.6 | 179.5 | 0 | 0 | 0 | 113.5 | I80 L87 L149 L210 L214 T226 L227 R228 I232 L233 | I80-L230 HydrophobicContact CD1-CD2 4.44Å; I80-L230 HydrophobicContact CG1-CD1 4.49Å; I80-L230 HydrophobicContact CG1-CD2 4.15Å; I80-L230 HydrophobicContact CG2-CD1 4.43Å; L87-L230 HydrophobicContact CD1-CD1 4.48Å; L149-L230 HydrophobicContact CD2-CB 3.77Å; L210-L230 HydrophobicContact CD1-CD2 4.11Å; L210-L230 HydrophobicContact CD2-CD2 4.47Å; L214-L230 HydrophobicContact CD2-CD1 3.98Å; L214-L230 HydrophobicContact CD2-CD2 3.97Å; L214-L230 HydrophobicContact CD2-CG 4.11Å; T226-L230 WeakPolarHBondContact O-CG 3.37Å; T226-L230 PolarHBondContact O-N 3.12Å; L227-L230 HydrophobicContact CD2-CD1 4.41Å; L227-L230 PolarHBondContact O-N 3.42Å; R228-L230 VanDerWaalsContact C-N 3.32Å; R228-L230 PolarHBondContact O-N 3.18Å; L230-I232 PolarHBondContact O-N 3.46Å; L230-L233 HydrophobicContact CD2-CD1 3.87Å; L230-L233 WeakPolarHBondContact O-CB 3.33Å; L230-L233 PolarHBondContact O-N 3.07Å |
| 231 | C | 97.6 | Very high | 96.3 | Very high | 13 Ų | 13 | 39.7 Ų | 39.7 | 9% | 0.088 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62.3 | -23.1 | 172.8 | -61.9 | 0 | 0 | 0 | 0 | 112.4 | L146 L227 R228 V229 L233 M234 F235 | L146-C231 HydrophobicContact CG-CB 4.48Å; L227-C231 PolarHBondContact O-N 3.41Å; L227-C231 PolarHBondContact O-SG 3.24Å; R228-C231 WeakPolarHBondContact O-CB 3.3Å; R228-C231 PolarHBondContact O-N 3.25Å; R228-C231 VanDerWaalsContact O-N 3.11Å; V229-C231 PolarHBondContact O-N 2.84Å; C231-L233 VanDerWaalsContact C-N 3.3Å; C231-L233 PolarHBondContact O-N 3.45Å; C231-M234 PolarHBondContact O-N 3.37Å; C231-F235 WeakPolarHBondContact O-CB 3.33Å; C231-F235 PolarHBondContact O-N 3.38Å |
| 232 | I | 97.5 | Very high | 96.4 | Very high | 101 Ų | 101 | 42.3 Ų | 42.3 | 52% | 0.518 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -61.7 | -41.1 | 173.4 | -59.6 | 172 | 0 | 0 | 0 | 110.2 | V229 L230 M234 F235 V236 | V229-I232 HydrophobicContact CG1-CD1 4.38Å; V229-I232 VanDerWaalsContact O-CB 3.23Å; V229-I232 WeakPolarHBondContact O-CB 3.45Å; V229-I232 VanDerWaalsContact O-CG1 3.3Å; V229-I232 WeakPolarHBondContact O-CG1 3.37Å; V229-I232 PolarHBondContact O-N 3.05Å; L230-I232 PolarHBondContact O-N 3.46Å; I232-M234 VanDerWaalsContact C-N 3.28Å; I232-M234 PolarHBondContact O-N 2.85Å; I232-F235 PolarHBondContact O-N 2.76Å; I232-V236 WeakPolarHBondContact O-CG2 3.26Å; I232-V236 PolarHBondContact O-N 2.98Å |
| 233 | L | 96.5 | Very high | 96.5 | Very high | 26 Ų | 26 | 42.4 Ų | 42.4 | 14% | 0.136 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.6 | -38.8 | 177.3 | -59.6 | -177.7 | 0 | 0 | 0 | 111.6 | W72 I80 F206 L210 L230 C231 L237 | W72-L233 HydrophobicContact CH2-CD2 3.98Å; W72-L233 HydrophobicContact CZ2-CD2 3.59Å; W72-L233 PolarHBondContact NE1-O 3.38Å; I80-L233 HydrophobicContact CD1-CD1 4.28Å; I80-L233 HydrophobicContact CG1-CD1 4.34Å; F206-L233 HydrophobicContact CE1-CD1 4.36Å; F206-L233 HydrophobicContact CE1-CD2 4.25Å; L210-L233 HydrophobicContact CD1-CD1 4.02Å; L230-L233 HydrophobicContact CD2-CD1 3.87Å; L230-L233 WeakPolarHBondContact O-CB 3.33Å; L230-L233 PolarHBondContact O-N 3.07Å; C231-L233 VanDerWaalsContact C-N 3.3Å; C231-L233 PolarHBondContact O-N 3.45Å; L233-L237 PolarHBondContact O-N 3.16Å |
| 234 | M | 96.6 | Very high | 96.5 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -70.6 | -35.7 | 175.8 | -60.6 | -54.4 | -70.9 | 0 | 0 | 112.1 | L146 L149 F169 C231 I232 L237 I238 | L146-M234 HydrophobicContact CB-CB 3.92Å; L146-M234 HydrophobicContact CD1-CB 4.38Å; L146-M234 HydrophobicContact CG-CB 4.4Å; L149-M234 HydrophobicContact CD2-CG 3.92Å; F169-M234 HydrophobicContact CD2-CE 4.41Å; F169-M234 HydrophobicContact CE2-CE 3.97Å; F169-M234 HydrophobicContact CE2-CG 4.22Å; F169-M234 HydrophobicContact CE2-SD 3.86Å; C231-M234 PolarHBondContact O-N 3.37Å; I232-M234 VanDerWaalsContact C-N 3.28Å; I232-M234 PolarHBondContact O-N 2.85Å; M234-L237 HydrophobicContact CE-CD2 4.16Å; M234-L237 VanDerWaalsContact O-CB 3.29Å; M234-L237 WeakPolarHBondContact O-CB 3.47Å; M234-L237 PolarHBondContact O-N 2.9Å; M234-L237 HydrophobicContact SD-CD2 4.35Å; M234-I238 WeakPolarHBondContact O-CG1 3.27Å; M234-I238 PolarHBondContact O-N 3.43Å; M234-I238 VanDerWaalsContact O-N 3.08Å |
| 235 | F | 97.9 | Very high | 96.2 | Very high | 109 Ų | 109 | 43.9 Ų | 43.9 | 48% | 0.478 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -66.1 | -44.2 | 174.9 | -177.2 | -101.8 | 0 | 0 | 0 | 111.5 | L146 C231 I232 L237 I238 L239 | L146-F235 HydrophobicContact CD1-CB 3.81Å; L146-F235 HydrophobicContact CD1-CD2 4.24Å; C231-F235 WeakPolarHBondContact O-CB 3.33Å; C231-F235 PolarHBondContact O-N 3.38Å; I232-F235 PolarHBondContact O-N 2.76Å; F235-L237 PolarHBondContact O-N 3.14Å; F235-I238 WeakPolarHBondContact O-CB 3.3Å; F235-I238 PolarHBondContact O-N 3.39Å; F235-I238 VanDerWaalsContact O-N 3.11Å; F235-L239 HydrophobicContact CD1-CD1 4.24Å; F235-L239 HydrophobicContact CE1-CD1 3.82Å; F235-L239 HydrophobicContact CE1-CG 4.24Å; F235-L239 HydrophobicContact CZ-CD2 4.48Å; F235-L239 PolarHBondContact O-N 3.45Å |
| 236 | V | 97.8 | Very high | 95.5 | Very high | 48 Ų | 48 | 43.8 Ų | 43.8 | 29% | 0.291 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -60.6 | -33.2 | 172.7 | 178.2 | 0 | 0 | 0 | 0 | 110.8 | W72 I232 L239 A240 | W72-V236 HydrophobicContact CD2-CG1 4.02Å; W72-V236 VanDerWaalsContact CE2-CG1 3.4Å; W72-V236 HydrophobicContact CG-CG1 4.33Å; W72-V236 HydrophobicContact CH2-CG1 4.46Å; W72-V236 HydrophobicContact CZ2-CB 3.8Å; W72-V236 HydrophobicContact CZ2-CG1 3.66Å; W72-V236 HydrophobicContact CZ2-CG2 4.14Å; I232-V236 WeakPolarHBondContact O-CG2 3.26Å; I232-V236 PolarHBondContact O-N 2.98Å; V236-L239 WeakPolarHBondContact O-CB 3.39Å; V236-L239 PolarHBondContact O-N 3.38Å; V236-A240 WeakPolarHBondContact O-CB 3.26Å; V236-A240 PolarHBondContact O-N 3.15Å |
| 237 | L | 95.8 | Very high | 94.7 | Very high | 4 Ų | 4 | 46.1 Ų | 46.1 | 2% | 0.021 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.6 | -37.3 | 175.3 | -175.9 | 54.1 | 0 | 0 | 0 | 113.1 | C73 V77 A142 A176 L233 M234 F235 L239 A240 G241 | C73-L237 HydrophobicContact CB-CD1 3.32Å; C73-L237 VanDerWaalsContact SG-CD1 3.56Å; V77-L237 HydrophobicContact CG2-CD2 4.27Å; A142-L237 HydrophobicContact CB-CB 4.23Å; A142-L237 HydrophobicContact CB-CD2 4.16Å; A142-L237 HydrophobicContact CB-CG 3.8Å; A176-L237 HydrophobicContact CB-CD2 3.63Å; A176-L237 HydrophobicContact CB-CG 4.19Å; L233-L237 PolarHBondContact O-N 3.16Å; M234-L237 HydrophobicContact CE-CD2 4.16Å; M234-L237 VanDerWaalsContact O-CB 3.29Å; M234-L237 WeakPolarHBondContact O-CB 3.47Å; M234-L237 PolarHBondContact O-N 2.9Å; M234-L237 HydrophobicContact SD-CD2 4.35Å; F235-L237 PolarHBondContact O-N 3.14Å; L237-L239 VanDerWaalsContact C-N 3.34Å; L237-A240 PolarHBondContact O-N 3.04Å; L237-G241 PolarHBondContact O-N 2.78Å |
| 238 | I | 97.9 | Very high | 93.6 | Very high | 25 Ų | 25 | 49 Ų | 49 | 13% | 0.128 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -59.3 | -47.9 | 171.3 | -63 | 169.9 | 0 | 0 | 0 | 109.6 | V139 A142 A143 L146 M234 F235 A240 G241 F242 | V139-I238 HydrophobicContact CG1-CG2 4.11Å; A142-I238 HydrophobicContact CB-CB 4.41Å; A142-I238 HydrophobicContact CB-CG1 3.58Å; A143-I238 HydrophobicContact CB-CD1 4.2Å; L146-I238 HydrophobicContact CB-CD1 4.43Å; L146-I238 HydrophobicContact CD1-CD1 3.97Å; M234-I238 WeakPolarHBondContact O-CG1 3.27Å; M234-I238 PolarHBondContact O-N 3.43Å; M234-I238 VanDerWaalsContact O-N 3.08Å; F235-I238 WeakPolarHBondContact O-CB 3.3Å; F235-I238 PolarHBondContact O-N 3.39Å; F235-I238 VanDerWaalsContact O-N 3.11Å; I238-A240 PolarHBondContact O-N 3.42Å; I238-G241 PolarHBondContact O-N 2.98Å; I238-F242 HydrophobicContact CG2-CE2 3.92Å; I238-F242 VanDerWaalsContact O-CD2 3.3Å; I238-F242 WeakPolarHBondContact O-CD2 3.41Å; I238-F242 PolarHBondContact O-N 2.97Å |
| 239 | L | 97.6 | Very high | 91.7 | Very high | 90 Ų | 90 | 49.4 Ų | 49.4 | 47% | 0.471 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61.7 | -44.3 | 178.1 | -60.5 | -178.6 | 0 | 0 | 0 | 112.2 | F235 V236 L237 G241 F242 | F235-L239 HydrophobicContact CD1-CD1 4.24Å; F235-L239 HydrophobicContact CE1-CD1 3.82Å; F235-L239 HydrophobicContact CE1-CG 4.24Å; F235-L239 HydrophobicContact CZ-CD2 4.48Å; F235-L239 PolarHBondContact O-N 3.45Å; V236-L239 WeakPolarHBondContact O-CB 3.39Å; V236-L239 PolarHBondContact O-N 3.38Å; L237-L239 VanDerWaalsContact C-N 3.34Å; L239-G241 VanDerWaalsContact C-N 3.29Å; L239-G241 PolarHBondContact O-N 3.35Å; L239-F242 PolarHBondContact O-N 3.47Å |
| 240 | A | 96 | Very high | 89.7 | Confident | 11 Ų | 11 | 51 Ų | 51 | 9% | 0.091 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59.3 | -40 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | A69 V236 L237 I238 F242 T243 | A69-A240 HydrophobicContact CB-CB 3.89Å; V236-A240 WeakPolarHBondContact O-CB 3.26Å; V236-A240 PolarHBondContact O-N 3.15Å; L237-A240 PolarHBondContact O-N 3.04Å; I238-A240 PolarHBondContact O-N 3.42Å; A240-F242 VanDerWaalsContact C-N 3.29Å; A240-F242 PolarHBondContact O-N 3.16Å; A240-T243 WeakPolarHBondContact O-CB 3.38Å; A240-T243 WeakPolarHBondContact O-CG2 3.27Å; A240-T243 PolarHBondContact O-N 2.99Å; A240-T243 PolarHBondContact O-OG1 3.49Å |
| 241 | G | 94.7 | Very high | 87.6 | Confident | 1 Ų | 1 | 59.8 Ų | 59.8 | 1% | 0.01 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -60 | -32.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | L237 I238 L239 T243 Y244 | L237-G241 PolarHBondContact O-N 2.78Å; I238-G241 PolarHBondContact O-N 2.98Å; L239-G241 VanDerWaalsContact C-N 3.29Å; L239-G241 PolarHBondContact O-N 3.35Å; G241-T243 PolarHBondContact O-N 3.24Å; G241-Y244 WeakPolarHBondContact O-CB 3.42Å; G241-Y244 PolarHBondContact O-N 3.18Å; G241-Y244 VanDerWaalsContact O-N 3.16Å |
| 242 | F | 96.5 | Very high | 85.1 | Confident | 116 Ų | 116 | 64.9 Ų | 64.9 | 51% | 0.509 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -65.3 | -22.8 | 176.3 | -72.4 | -65.6 | 0 | 0 | 0 | 113.4 | V139 I238 L239 A240 Y244 | V139-F242 HydrophobicContact CG1-CE1 4.12Å; V139-F242 HydrophobicContact CG1-CE2 4.3Å; V139-F242 HydrophobicContact CG1-CZ 3.82Å; V139-F242 HydrophobicContact CG2-CD1 4.19Å; V139-F242 HydrophobicContact CG2-CE1 4.25Å; V139-F242 HydrophobicContact CG2-CG 4.34Å; V139-F242 HydrophobicContact CG2-CZ 4.48Å; I238-F242 HydrophobicContact CG2-CE2 3.92Å; I238-F242 VanDerWaalsContact O-CD2 3.3Å; I238-F242 WeakPolarHBondContact O-CD2 3.41Å; I238-F242 PolarHBondContact O-N 2.97Å; L239-F242 PolarHBondContact O-N 3.47Å; A240-F242 VanDerWaalsContact C-N 3.29Å; A240-F242 PolarHBondContact O-N 3.16Å; F242-Y244 PolarHBondContact O-N 2.96Å |
| 243 | T | 96 | Very high | 82.5 | Confident | 29 Ų | 29 | 64.5 Ų | 64.5 | 18% | 0.178 | 36% | 0.364 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.5 | -20.2 | 177 | 73.5 | 0 | 0 | 0 | 0 | 112.7 | W62 V65 A69 A240 G241 K245 | W62-T243 PolarHBondContact NE1-O 3.17Å; V65-T243 HydrophobicContact CG1-CG2 4.28Å; A69-T243 WeakPolarHBondContact CB-OG1 3.45Å; A240-T243 WeakPolarHBondContact O-CB 3.38Å; A240-T243 WeakPolarHBondContact O-CG2 3.27Å; A240-T243 PolarHBondContact O-N 2.99Å; A240-T243 PolarHBondContact O-OG1 3.49Å; G241-T243 PolarHBondContact O-N 3.24Å; T243-K245 PolarHBondContact O-N 3.11Å |
| 244 | Y | 93.6 | Very high | 80 | Confident | 1 Ų | 1 | 69 Ų | 69 | 0% | 0.004 | 39% | 0.386 | C | S | . | . | trans | -69.5 | 96.3 | -178 | -62 | -10.4 | 0 | 0 | 0 | 109.9 | V66 A69 R135 A138 S180 I183 G241 F242 P246 | V66-Y244 HydrophobicContact CG1-CD1 3.91Å; V66-Y244 HydrophobicContact CG1-CE1 4.17Å; A69-Y244 HydrophobicContact CB-CE1 3.9Å; R135-Y244 WeakPolarHBondContact CB-O 3.34Å; R135-Y244 PolarHBondContact NE-O 2.93Å; R135-Y244 PolarHBondContact NH2-O 3.32Å; A138-Y244 HydrophobicContact CB-CD2 3.78Å; A138-Y244 HydrophobicContact CB-CE2 3.63Å; S180-Y244 WeakPolarHBondContact CB-OH 3.34Å; I183-Y244 HydrophobicContact CG1-CD1 4.48Å; I183-Y244 HydrophobicContact CG1-CG 4.28Å; I183-Y244 HydrophobicContact CG2-CD1 3.99Å; I183-Y244 HydrophobicContact CG2-CD2 4.35Å; I183-Y244 HydrophobicContact CG2-CE1 4.13Å; I183-Y244 HydrophobicContact CG2-CE2 4.49Å; I183-Y244 HydrophobicContact CG2-CG 4.12Å; G241-Y244 WeakPolarHBondContact O-CB 3.42Å; G241-Y244 PolarHBondContact O-N 3.18Å; G241-Y244 VanDerWaalsContact O-N 3.16Å; F242-Y244 PolarHBondContact O-N 2.96Å; Y244-P246 WeakPolarHBondContact O-CD 3.43Å | ||
| 245 | K | 88.4 | Confident | 77.3 | Confident | 118 Ų | 118 | 75.1 Ų | 75.1 | 51% | 0.513 | 42% | 0.424 | S | S | . | . | trans | -95.2 | 112.1 | 173.6 | -179.5 | -179.5 | -177.9 | -178.7 | 0 | 108.7 | Y187 T243 L247 | Y187-K245 WeakPolarHBondContact CE2-O 3.32Å; Y187-K245 WeakPolarHBondContact OH-CB 3.2Å; Y187-K245 PolarHBondContact OH-O 3.06Å; T243-K245 PolarHBondContact O-N 3.11Å; K245-L247 HydrophobicContact CD-CD2 4.33Å; K245-L247 HydrophobicContact CG-CD2 4.18Å; K245-L247 PolarHBondContact O-N 3.04Å | ||
| 246 | P | 79.5 | Confident | 74.6 | Confident | 70 Ų | 70 | 78.9 Ų | 78.9 | 46% | 0.455 | 44% | 0.443 | S | S | . | . | trans | -68.1 | 125.6 | 179.2 | 27.6 | -32.2 | 0 | 0 | 0 | 109.3 | Y244 | Y244-P246 WeakPolarHBondContact O-CD 3.43Š| ||
| 247 | L | 80.2 | Confident | 71.9 | Confident | 49 Ų | 49 | 80.7 Ų | 80.7 | 26% | 0.257 | 45% | 0.454 | S | S | . | . | trans | -108.9 | -28.1 | -179.8 | -57.7 | -179.8 | 0 | 0 | 0 | 114 | F55 P58 H186 Y187 K245 | F55-L247 HydrophobicContact CE2-CB 4.22Å; F55-L247 WeakPolarHBondContact CE2-O 3Å; F55-L247 HydrophobicContact CZ-CB 3.61Å; P58-L247 HydrophobicContact CG-CD1 3.57Å; H186-L247 HydrophobicContact CB-CB 4.5Å; Y187-L247 HydrophobicContact CD1-CD1 3.72Å; Y187-L247 HydrophobicContact CD2-CD1 4.36Å; Y187-L247 HydrophobicContact CE1-CD1 3.38Å; Y187-L247 HydrophobicContact CE1-CG 4.19Å; Y187-L247 HydrophobicContact CE2-CD1 4.03Å; Y187-L247 HydrophobicContact CE2-CG 4.2Å; Y187-L247 HydrophobicContact CG-CD1 4.21Å; K245-L247 HydrophobicContact CD-CD2 4.33Å; K245-L247 HydrophobicContact CG-CD2 4.18Å; K245-L247 PolarHBondContact O-N 3.04Å | ||
| 248 | L | 73.3 | Confident | 69.5 | Low | 66 Ų | 66 | 83.5 Ų | 83.5 | 35% | 0.346 | 48% | 0.484 | S | S | . | . | S | Bend | trans | -67 | 132.7 | 174.4 | -71.6 | 172.3 | 0 | 0 | 0 | 109.3 | F55 H186 A250 | F55-L248 HydrophobicContact CB-CD2 4.19Å; F55-L248 HydrophobicContact CD1-CD2 3.36Å; F55-L248 HydrophobicContact CD1-CG 4.44Å; F55-L248 HydrophobicContact CD2-CD2 4.42Å; F55-L248 HydrophobicContact CE1-CD2 3.79Å; F55-L248 HydrophobicContact CE1-CG 4.42Å; F55-L248 HydrophobicContact CG-CD2 3.73Å; F55-L248 HydrophobicContact CZ-CD2 4.49Å; H186-L248 HydrophobicContact CB-CD1 4.36Å; H186-L248 HydrophobicContact CB-CG 4.2Å; H186-L248 VanDerWaalsContact CD2-CD1 3.47Å; H186-L248 WeakPolarHBondContact CD2-CD1 3.42Å; L248-A250 PolarHBondContact O-N 3.38Å |
| 249 | P | 59 | Low | 67.3 | Low | 98 Ų | 98 | 89.3 Ų | 89.3 | 64% | 0.636 | 51% | 0.508 | S | S | * | . | P | Polyproline II helix | trans | -56.8 | 133.7 | 176.9 | 21.6 | -30 | 0 | 0 | 0 | 108.8 | K251 | P249-K251 PolarHBondContact O-N 2.89Å; P249-K251 VanDerWaalsContact O-N 3.12Å |
| 250 | A | 54.5 | Low | 65.2 | Low | 93 Ų | 93 | 92.9 Ų | 92.9 | 77% | 0.769 | 52% | 0.515 | S | S | * | . | P | Polyproline II helix | trans | -52.3 | 124.8 | 171.5 | 0 | 0 | 0 | 0 | 0 | 107.1 | L248 P252 | L248-A250 PolarHBondContact O-N 3.38Å; A250-P252 VanDerWaalsContact O-N 3.17Å |
| 251 | K | 53.5 | Low | 63.3 | Low | 188 Ų | 188 | 96.8 Ų | 96.8 | 82% | 0.817 | 53% | 0.534 | S | S | * | . | P | Polyproline II helix | trans | -49 | 130.6 | 168.5 | -75.3 | 179.5 | 180 | 169.8 | 0 | 106 | P249 A253 | P249-K251 PolarHBondContact O-N 2.89Å; P249-K251 VanDerWaalsContact O-N 3.12Å; K251-A253 PolarHBondContact O-N 3.44Å; K251-A253 VanDerWaalsContact O-N 3.08Å |
| 252 | P | 43.2 | Very low | 61.4 | Low | 119 Ų | 119 | 101 Ų | 101 | 77% | 0.773 | 56% | 0.564 | S | S | * | * | P | Polyproline II helix | trans | -48 | 125.6 | -171.5 | 15.1 | -28.5 | 0 | 0 | 0 | 108.8 | A250 M254 | A250-P252 VanDerWaalsContact O-N 3.17Å; P252-M254 PolarHBondContact O-N 3.43Å |
| 253 | A | 43.4 | Very low | 59.4 | Low | 93 Ų | 93 | 102.3 Ų | 102.3 | 77% | 0.769 | 57% | 0.565 | S | S | * | * | trans | -48.5 | 111.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 106.9 | K251 T255 | K251-A253 PolarHBondContact O-N 3.44Å; K251-A253 VanDerWaalsContact O-N 3.08Å; A253-T255 PolarHBondContact O-N 3.42Å | ||
| 254 | M | 43.7 | Very low | 57.9 | Low | 122 Ų | 122 | 102.8 Ų | 102.8 | 60% | 0.601 | 57% | 0.567 | S | S | * | * | trans | -66.3 | 101.2 | -166.7 | -154.6 | 173.6 | 77.8 | 0 | 0 | 107.3 | P252 Q256 | P252-M254 PolarHBondContact O-N 3.43Å; M254-Q256 PolarHBondContact O-N 3.32Å | ||
| 255 | T | 39.8 | Very low | 56.7 | Low | 128 Ų | 128 | 105.2 Ų | 105.2 | 79% | 0.785 | 58% | 0.577 | S | S | * | * | trans | -54.5 | 114.2 | 174.6 | 32.4 | 0 | 0 | 0 | 0 | 108.6 | A253 T257 | A253-T255 PolarHBondContact O-N 3.42Å; T255-T257 PolarHBondContact O-N 2.82Å | ||
| 256 | Q | 42.8 | Very low | 56.1 | Low | 188 Ų | 188 | 101.4 Ų | 101.4 | 88% | 0.879 | 56% | 0.563 | S | S | * | * | S | Bend | trans | 41.5 | 74.8 | 159.2 | -57.9 | -150.1 | -4.6 | 0 | 0 | 117.1 | M254 | M254-Q256 PolarHBondContact O-N 3.32Š|
| 257 | T | 40.2 | Very low | 56.3 | Low | 86 Ų | 86 | 103.6 Ų | 103.6 | 53% | 0.528 | 57% | 0.568 | S | S | . | * | trans | -150.9 | 129.2 | 140.1 | 37.5 | 0 | 0 | 0 | 0 | 107.8 | T255 R263 | T255-T257 PolarHBondContact O-N 2.82Å; T257-R263 PolarHBondContact OG1-NH1 2.81Å | ||
| 258 | G | 46.5 | Very low | 56.4 | Low | 62 Ų | 62 | 105.3 Ų | 105.3 | 64% | 0.639 | 58% | 0.578 | S | S | * | * | trans | -47.5 | 161.2 | -163.8 | 0 | 0 | 0 | 0 | 0 | 117.5 | R260 | G258-R260 VanDerWaalsContact C-N 3.27Å; G258-R260 PolarHBondContact O-N 2.99Å | ||
| 259 | F | 51.8 | Low | 57.1 | Low | 147 Ų | 147 | 102.4 Ų | 102.4 | 65% | 0.645 | 56% | 0.562 | S | S | * | * | trans | -52.7 | 79.3 | 178.9 | -164.2 | -100.4 | 0 | 0 | 0 | 112.3 | I131 L261 L264 | I131-F259 HydrophobicContact CD1-CE2 3.84Å; I131-F259 HydrophobicContact CD1-CZ 4.41Å; F259-L261 HydrophobicContact CD1-CD1 3.61Å; F259-L261 HydrophobicContact CE1-CD1 3.39Å; F259-L261 PolarHBondContact O-N 3.32Å; F259-L264 HydrophobicContact CE2-CD1 4.36Å; F259-L264 HydrophobicContact CZ-CD1 4.14Å | ||
| 260 | R | 51.8 | Low | 58.5 | Low | 165 Ų | 165 | 100.3 Ų | 100.3 | 62% | 0.623 | 54% | 0.542 | S | S | * | . | trans | -87.4 | 101.8 | 176.2 | -88.1 | -175.1 | 174.5 | 176.7 | 0.2 | 108.7 | G258 S262 R263 | G258-R260 VanDerWaalsContact C-N 3.27Å; G258-R260 PolarHBondContact O-N 2.99Å; R260-S262 PolarHBondContact O-N 3.45Å; R260-R263 PolarHBondContact O-N 2.93Å | ||
| 261 | L | 56.8 | Low | 60.1 | Low | 93 Ų | 93 | 103 Ų | 103 | 49% | 0.487 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -47.8 | -31.3 | 170 | -100.9 | 75.7 | 0 | 0 | 0 | 112.8 | F259 R263 L264 F265 | F259-L261 HydrophobicContact CD1-CD1 3.61Å; F259-L261 HydrophobicContact CE1-CD1 3.39Å; F259-L261 PolarHBondContact O-N 3.32Å; L261-R263 PolarHBondContact O-N 2.84Å; L261-L264 PolarHBondContact O-N 3.3Å; L261-F265 HydrophobicContact CD2-CE2 4.18Å; L261-F265 HydrophobicContact CG-CE2 4.37Å; L261-F265 WeakPolarHBondContact O-CD2 3.39Å; L261-F265 PolarHBondContact O-N 2.83Å; L261-F265 VanDerWaalsContact O-N 3.11Å |
| 262 | S | 54.4 | Low | 61.7 | Low | 91 Ų | 91 | 95.7 Ų | 95.7 | 64% | 0.636 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -66 | -18.4 | 178.4 | 62.1 | 0 | 0 | 0 | 0 | 114.8 | R260 | R260-S262 PolarHBondContact O-N 3.45Å |
| 263 | R | 55.8 | Low | 63.9 | Low | 142 Ų | 142 | 92.3 Ų | 92.3 | 54% | 0.536 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -88.3 | -18.4 | 171.3 | -72.3 | -174.5 | -176.2 | 160.5 | 3.2 | 112.8 | T257 R260 L261 | T257-R263 PolarHBondContact OG1-NH1 2.81Å; R260-R263 PolarHBondContact O-N 2.93Å; L261-R263 PolarHBondContact O-N 2.84Å |
| 264 | L | 63.1 | Low | 66.1 | Low | 39 Ų | 39 | 88 Ų | 88 | 20% | 0.204 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -86.4 | -33 | 178.4 | -65.9 | 170.2 | 0 | 0 | 0 | 111.8 | I127 F259 L261 Q400 | I127-L264 HydrophobicContact CD1-CB 4.35Å; I127-L264 HydrophobicContact CD1-CD1 4.2Å; I127-L264 HydrophobicContact CG1-CB 4.24Å; I127-L264 HydrophobicContact CG1-CD1 4.22Å; I127-L264 HydrophobicContact CG2-CD1 3.7Å; I127-L264 HydrophobicContact CG2-CD2 4.48Å; F259-L264 HydrophobicContact CE2-CD1 4.36Å; F259-L264 HydrophobicContact CZ-CD1 4.14Å; L261-L264 PolarHBondContact O-N 3.3Å; L264-Q400 PolarHBondContact O-NE2 2.96Å |
| 265 | F | 69.7 | Low | 68.5 | Low | 52 Ų | 52 | 82.1 Ų | 82.1 | 23% | 0.228 | 42% | 0.422 | C | S | . | . | S | Bend | trans | -99.9 | 107.1 | 176.2 | -68.5 | -64.3 | 0 | 0 | 0 | 111.1 | P123 I127 L261 M267 F404 | P123-F265 HydrophobicContact CB-CE1 4.11Å; I127-F265 HydrophobicContact CD1-CE1 4.32Å; I127-F265 HydrophobicContact CD1-CE2 3.94Å; I127-F265 HydrophobicContact CD1-CZ 3.68Å; L261-F265 HydrophobicContact CD2-CE2 4.18Å; L261-F265 HydrophobicContact CG-CE2 4.37Å; L261-F265 WeakPolarHBondContact O-CD2 3.39Å; L261-F265 PolarHBondContact O-N 2.83Å; L261-F265 VanDerWaalsContact O-N 3.11Å; F265-M267 VanDerWaalsContact C-N 3.32Å; F265-M267 HydrophobicContact CB-CE 4.19Å; F265-M267 PolarHBondContact O-N 2.97Å; F265-F404 HydrophobicContact CB-CZ 4.06Å; F265-F404 AromaticContact CD1-CE1 3.34Å; F265-F404 HydrophobicContact CD1-CE1 3.34Å; F265-F404 AromaticContact CD1-CZ 3.41Å; F265-F404 HydrophobicContact CD1-CZ 3.41Å; F265-F404 VanDerWaalsContact CD1-CZ 3.41Å; F265-F404 AromaticContact CE1-CE1 3.7Å; F265-F404 HydrophobicContact CE1-CE1 3.7Å; F265-F404 HydrophobicContact CE1-CZ 4.23Å; F265-F404 HydrophobicContact CG-CE1 4.29Å; F265-F404 HydrophobicContact CG-CZ 4.13Å |
| 266 | N | 75 | Confident | 71.1 | Confident | 38 Ų | 38 | 81 Ų | 81 | 20% | 0.203 | 40% | 0.403 | C | S | . | . | trans | -73.3 | 87.6 | 175.2 | -170.9 | 0.4 | 0 | 0 | 0 | 110.6 | N268 I269 D397 | N266-N268 PolarHBondContact O-N 3.27Å; N266-N268 VanDerWaalsContact O-N 3.07Å; N266-N268 WeakPolarHBondContact OD1-CB 3.41Å; N266-N268 PolarHBondContact OD1-N 3.44Å; N266-N268 VanDerWaalsContact OD1-N 3.15Å; N266-N268 PolarHBondContact OD1-ND2 2.89Å; N266-I269 HydrophobicContact CB-CD1 4.19Å; N266-I269 HydrophobicContact CB-CG1 4.49Å; N266-I269 WeakPolarHBondContact O-CB 3.01Å; N266-I269 WeakPolarHBondContact O-CD1 3.46Å; N266-I269 WeakPolarHBondContact O-CG1 3.46Å; N266-I269 PolarHBondContact O-N 3.34Å; N266-D397 PolarHBondContact ND2-OD1 2.86Å; N266-D397 PolarHBondContact ND2-OD2 3.12Å; N266-D397 VanDerWaalsContact ND2-OD2 3.12Å | ||
| 267 | M | 82.9 | Confident | 73.5 | Confident | 116 Ų | 116 | 73.7 Ų | 73.7 | 57% | 0.571 | 37% | 0.37 | S | S | * | . | G | 310 helix | trans | -66.7 | -9.9 | -179.8 | -145.9 | 62.4 | 65 | 0 | 0 | 113.2 | F265 I269 W270 | F265-M267 VanDerWaalsContact C-N 3.32Å; F265-M267 HydrophobicContact CB-CE 4.19Å; F265-M267 PolarHBondContact O-N 2.97Å; M267-I269 PolarHBondContact O-N 3.39Å; M267-W270 PolarHBondContact O-N 3.06Å; M267-W270 HydrophobicContact SD-CG 4.3Å |
| 268 | N | 83.9 | Confident | 76.1 | Confident | 86 Ų | 86 | 69.6 Ų | 69.6 | 46% | 0.46 | 34% | 0.344 | S | S | . | . | G | 310 helix | trans | -63.6 | -24.9 | 174.6 | -64.3 | -53.1 | 0 | 0 | 0 | 112.5 | N266 W270 K271 | N266-N268 PolarHBondContact O-N 3.27Å; N266-N268 VanDerWaalsContact O-N 3.07Å; N266-N268 WeakPolarHBondContact OD1-CB 3.41Å; N266-N268 PolarHBondContact OD1-N 3.44Å; N266-N268 VanDerWaalsContact OD1-N 3.15Å; N266-N268 PolarHBondContact OD1-ND2 2.89Å; N268-W270 PolarHBondContact O-N 3.27Å; N268-K271 HydrophobicContact CB-CD 4.44Å; N268-K271 VanDerWaalsContact O-CB 3.25Å; N268-K271 WeakPolarHBondContact O-CB 3.48Å; N268-K271 PolarHBondContact O-N 2.92Å; N268-K271 WeakPolarHBondContact OD1-CE 3.43Å; N268-K271 PolarHBondContact OD1-NZ 3.1Å |
| 269 | I | 86.4 | Confident | 78.3 | Confident | 4 Ų | 4 | 66.7 Ų | 66.7 | 2% | 0.021 | 31% | 0.314 | C | S | . | . | G | 310 helix | trans | -53.5 | -39.9 | 175.1 | -68.4 | 167.4 | 0 | 0 | 0 | 111 | N266 M267 K271 S272 Y275 V393 D397 Q400 A401 F404 | N266-I269 HydrophobicContact CB-CD1 4.19Å; N266-I269 HydrophobicContact CB-CG1 4.49Å; N266-I269 WeakPolarHBondContact O-CB 3.01Å; N266-I269 WeakPolarHBondContact O-CD1 3.46Å; N266-I269 WeakPolarHBondContact O-CG1 3.46Å; N266-I269 PolarHBondContact O-N 3.34Å; M267-I269 PolarHBondContact O-N 3.39Å; I269-K271 PolarHBondContact O-N 3.39Å; I269-S272 WeakPolarHBondContact O-CB 3.34Å; I269-S272 PolarHBondContact O-N 3.22Å; I269-S272 VanDerWaalsContact O-N 3.15Å; I269-Y275 HydrophobicContact CG2-CD1 3.39Å; I269-Y275 HydrophobicContact CG2-CD2 4.3Å; I269-Y275 HydrophobicContact CG2-CE1 3.3Å; I269-Y275 HydrophobicContact CG2-CE2 4.22Å; I269-Y275 HydrophobicContact CG2-CG 3.9Å; I269-V393 HydrophobicContact CG2-CG1 3.89Å; I269-D397 HydrophobicContact CD1-CB 3.98Å; I269-D397 HydrophobicContact CG1-CB 3.81Å; I269-Q400 HydrophobicContact CD1-CB 3.69Å; I269-A401 HydrophobicContact CD1-CB 4.38Å; I269-A401 HydrophobicContact CG2-CB 4.12Å; I269-F404 HydrophobicContact CD1-CD2 4.4Å; I269-F404 HydrophobicContact CD1-CE2 4.14Å |
| 270 | W | 89.8 | Confident | 80.3 | Confident | 55 Ų | 55 | 65.5 Ų | 65.5 | 21% | 0.208 | 31% | 0.309 | C | S | . | . | G | 310 helix | trans | -72.3 | -7.4 | -179.7 | -62.7 | 93.8 | 0 | 0 | 0 | 114.3 | M267 N268 S272 Y275 R276 A279 F280 F404 L408 | M267-W270 PolarHBondContact O-N 3.06Å; M267-W270 HydrophobicContact SD-CG 4.3Å; N268-W270 PolarHBondContact O-N 3.27Å; W270-S272 VanDerWaalsContact C-N 3.31Å; W270-Y275 HydrophobicContact CD2-CE1 4.39Å; W270-Y275 HydrophobicContact CE3-CE1 4.42Å; W270-Y275 HydrophobicContact CH2-CE1 4.44Å; W270-Y275 HydrophobicContact CZ2-CE1 4.45Å; W270-Y275 HydrophobicContact CZ3-CE1 4.43Å; W270-R276 HydrophobicContact CE3-CG 4.11Å; W270-R276 WeakPolarHBondContact O-CD 3.48Å; W270-R276 WeakPolarHBondContact O-CG 3.19Å; W270-R276 PolarHBondContact O-NH1 3.01Å; W270-A279 HydrophobicContact CH2-CB 4.26Å; W270-A279 HydrophobicContact CZ3-CB 4.22Å; W270-F280 HydrophobicContact CE3-CE2 4.47Å; W270-F280 HydrophobicContact CH2-CE2 4.48Å; W270-F280 HydrophobicContact CH2-CZ 4.38Å; W270-F280 HydrophobicContact CZ3-CD2 4.47Å; W270-F280 AromaticContact CZ3-CE2 3.65Å; W270-F280 HydrophobicContact CZ3-CE2 3.65Å; W270-F280 AromaticContact CZ3-CZ 3.92Å; W270-F280 HydrophobicContact CZ3-CZ 3.92Å; W270-F404 HydrophobicContact CZ2-CB 4.27Å; W270-F404 HydrophobicContact CZ2-CD2 4.46Å; W270-F404 HydrophobicContact CZ2-CG 4.29Å; W270-F404 AromaticContact NE1-CD2 3.95Å; W270-F404 AromaticContact NE1-CE2 3.84Å; W270-L408 HydrophobicContact CH2-CD1 4.02Å |
| 271 | K | 87.2 | Confident | 82.3 | Confident | 148 Ų | 148 | 57.8 Ų | 57.8 | 64% | 0.643 | 28% | 0.281 | S | S | * | . | G | 310 helix | trans | -73.2 | -26.5 | 170.6 | -64.3 | 175.7 | 174.3 | 167.6 | 0 | 111.6 | N268 I269 V273 | N268-K271 HydrophobicContact CB-CD 4.44Å; N268-K271 VanDerWaalsContact O-CB 3.25Å; N268-K271 WeakPolarHBondContact O-CB 3.48Å; N268-K271 PolarHBondContact O-N 2.92Å; N268-K271 WeakPolarHBondContact OD1-CE 3.43Å; N268-K271 PolarHBondContact OD1-NZ 3.1Å; I269-K271 PolarHBondContact O-N 3.39Å; K271-V273 PolarHBondContact O-N 3.06Å |
| 272 | S | 87.3 | Confident | 84.1 | Confident | 35 Ų | 35 | 53.4 Ų | 53.4 | 25% | 0.245 | 26% | 0.258 | C | S | . | . | trans | -70.4 | 111.8 | 175.7 | 178.8 | 0 | 0 | 0 | 0 | 110.3 | I269 W270 G274 Y275 R276 L392 | I269-S272 WeakPolarHBondContact O-CB 3.34Å; I269-S272 PolarHBondContact O-N 3.22Å; I269-S272 VanDerWaalsContact O-N 3.15Å; W270-S272 VanDerWaalsContact C-N 3.31Å; S272-G274 VanDerWaalsContact C-N 3.29Å; S272-G274 PolarHBondContact O-N 3.19Å; S272-Y275 PolarHBondContact O-N 3.4Å; S272-Y275 PolarHBondContact OG-N 3.46Å; S272-R276 PolarHBondContact O-N 3.26Å; S272-L392 PolarHBondContact OG-O 3.43Å; S272-L392 VanDerWaalsContact OG-O 3.09Å | ||
| 273 | V | 89.5 | Confident | 86 | Confident | 48 Ų | 48 | 49.7 Ų | 49.7 | 29% | 0.291 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -60.8 | -41 | 180 | -171.9 | 0 | 0 | 0 | 0 | 110.9 | K271 R276 I277 V454 | K271-V273 PolarHBondContact O-N 3.06Å; V273-R276 PolarHBondContact O-N 3.13Å; V273-I277 HydrophobicContact CG1-CD1 4.25Å; V273-I277 WeakPolarHBondContact O-CG1 3.35Å; V273-I277 PolarHBondContact O-N 3.17Å; V273-I277 VanDerWaalsContact O-N 3.15Å; V273-V454 HydrophobicContact CB-CG1 3.88Å; V273-V454 HydrophobicContact CG1-CG1 3.67Å |
| 274 | G | 90.9 | Very high | 87.7 | Confident | 2 Ų | 2 | 45.3 Ų | 45.3 | 2% | 0.021 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -62.3 | -44 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | S272 R276 I277 W278 | S272-G274 VanDerWaalsContact C-N 3.29Å; S272-G274 PolarHBondContact O-N 3.19Å; G274-R276 PolarHBondContact O-N 3.21Å; G274-I277 PolarHBondContact O-N 2.83Å; G274-W278 WeakPolarHBondContact O-CB 3.35Å; G274-W278 PolarHBondContact O-N 3.39Å |
| 275 | Y | 92.3 | Very high | 89.2 | Confident | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -61.5 | -40.5 | 174.8 | -179.7 | -98.6 | 0 | 0 | 0 | 112.6 | I269 W270 S272 W278 A279 V393 A401 F404 | I269-Y275 HydrophobicContact CG2-CD1 3.39Å; I269-Y275 HydrophobicContact CG2-CD2 4.3Å; I269-Y275 HydrophobicContact CG2-CE1 3.3Å; I269-Y275 HydrophobicContact CG2-CE2 4.22Å; I269-Y275 HydrophobicContact CG2-CG 3.9Å; W270-Y275 HydrophobicContact CD2-CE1 4.39Å; W270-Y275 HydrophobicContact CE3-CE1 4.42Å; W270-Y275 HydrophobicContact CH2-CE1 4.44Å; W270-Y275 HydrophobicContact CZ2-CE1 4.45Å; W270-Y275 HydrophobicContact CZ3-CE1 4.43Å; S272-Y275 PolarHBondContact O-N 3.4Å; S272-Y275 PolarHBondContact OG-N 3.46Å; Y275-W278 AromaticContact CD2-CE3 3.96Å; Y275-W278 HydrophobicContact CD2-CE3 3.96Å; Y275-W278 HydrophobicContact CD2-CZ3 4.41Å; Y275-W278 AromaticContact CE2-CE3 3.9Å; Y275-W278 HydrophobicContact CE2-CE3 3.9Å; Y275-W278 HydrophobicContact CE2-CZ3 4.06Å; Y275-W278 PolarHBondContact O-N 3.18Å; Y275-A279 HydrophobicContact CD1-CB 4.32Å; Y275-A279 HydrophobicContact CE1-CB 3.85Å; Y275-A279 HydrophobicContact CE2-CB 4.39Å; Y275-A279 WeakPolarHBondContact O-CB 3.13Å; Y275-A279 PolarHBondContact O-N 3.45Å; Y275-V393 HydrophobicContact CD2-CG1 3.73Å; Y275-V393 HydrophobicContact CE2-CG1 4.5Å; Y275-V393 HydrophobicContact CG-CG1 3.82Å; Y275-A401 HydrophobicContact CD2-CB 4.23Å; Y275-A401 HydrophobicContact CE2-CB 3.57Å; Y275-A401 PolarHBondContact OH-O 2.64Å; Y275-F404 WeakPolarHBondContact OH-CB 3.36Å |
| 276 | R | 94.4 | Very high | 90.3 | Very high | 104 Ų | 104 | 41 Ų | 41 | 39% | 0.392 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -60.6 | -48 | 176.8 | -69.5 | -170.5 | -66.6 | -133.2 | 12.3 | 112.5 | W270 S272 V273 G274 W278 A279 F280 | W270-R276 HydrophobicContact CE3-CG 4.11Å; W270-R276 WeakPolarHBondContact O-CD 3.48Å; W270-R276 WeakPolarHBondContact O-CG 3.19Å; W270-R276 PolarHBondContact O-NH1 3.01Å; S272-R276 PolarHBondContact O-N 3.26Å; V273-R276 PolarHBondContact O-N 3.13Å; G274-R276 PolarHBondContact O-N 3.21Å; R276-W278 PolarHBondContact O-N 3.03Å; R276-A279 PolarHBondContact O-N 3.23Å; R276-F280 VanDerWaalsContact O-CD2 3.26Å; R276-F280 WeakPolarHBondContact O-CD2 3.01Å; R276-F280 PolarHBondContact O-N 2.81Å; R276-F280 VanDerWaalsContact O-N 3.14Å |
| 277 | I | 93.6 | Very high | 91 | Very high | 35 Ų | 35 | 43.9 Ų | 43.9 | 18% | 0.179 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.7 | -41.6 | 178.4 | -62.9 | 168.2 | 0 | 0 | 0 | 109.6 | V273 G274 G281 V447 L450 I451 V454 | V273-I277 HydrophobicContact CG1-CD1 4.25Å; V273-I277 WeakPolarHBondContact O-CG1 3.35Å; V273-I277 PolarHBondContact O-N 3.17Å; V273-I277 VanDerWaalsContact O-N 3.15Å; G274-I277 PolarHBondContact O-N 2.83Å; I277-G281 VanDerWaalsContact O-CA 3.31Å; I277-G281 WeakPolarHBondContact O-CA 3.46Å; I277-G281 PolarHBondContact O-N 3.33Å; I277-V447 HydrophobicContact CG2-CG1 4.24Å; I277-L450 HydrophobicContact CD1-CB 4.43Å; I277-L450 HydrophobicContact CG2-CB 4.5Å; I277-I451 HydrophobicContact CB-CD1 4.46Å; I277-I451 HydrophobicContact CB-CG1 3.86Å; I277-I451 HydrophobicContact CG2-CD1 4.13Å; I277-I451 HydrophobicContact CG2-CG1 3.59Å; I277-V454 HydrophobicContact CD1-CB 4.44Å; I277-V454 HydrophobicContact CD1-CG2 3.85Å |
| 278 | W | 94.2 | Very high | 91.4 | Very high | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -66.4 | -47.3 | 178.6 | -167 | 70.1 | 0 | 0 | 0 | 113.1 | G274 Y275 R276 F280 G281 I282 M385 I388 A389 L392 L405 I451 | G274-W278 WeakPolarHBondContact O-CB 3.35Å; G274-W278 PolarHBondContact O-N 3.39Å; Y275-W278 AromaticContact CD2-CE3 3.96Å; Y275-W278 HydrophobicContact CD2-CE3 3.96Å; Y275-W278 HydrophobicContact CD2-CZ3 4.41Å; Y275-W278 AromaticContact CE2-CE3 3.9Å; Y275-W278 HydrophobicContact CE2-CE3 3.9Å; Y275-W278 HydrophobicContact CE2-CZ3 4.06Å; Y275-W278 PolarHBondContact O-N 3.18Å; R276-W278 PolarHBondContact O-N 3.03Å; W278-F280 VanDerWaalsContact C-N 3.31Å; W278-F280 PolarHBondContact O-N 3.36Å; W278-G281 PolarHBondContact O-N 3.39Å; W278-I282 HydrophobicContact CD2-CD1 3.77Å; W278-I282 HydrophobicContact CE3-CD1 4.46Å; W278-I282 HydrophobicContact CG-CD1 4.16Å; W278-I282 HydrophobicContact CH2-CD1 4.27Å; W278-I282 HydrophobicContact CZ2-CD1 3.52Å; W278-I282 VanDerWaalsContact NE1-CD1 3.32Å; W278-I282 PolarHBondContact O-N 3.38Å; W278-M385 HydrophobicContact CH2-CG 3.75Å; W278-M385 WeakPolarHBondContact CH2-O 3.46Å; W278-M385 HydrophobicContact CZ2-CB 4.5Å; W278-M385 HydrophobicContact CZ2-CG 3.75Å; W278-M385 WeakPolarHBondContact CZ2-O 3.46Å; W278-I388 HydrophobicContact CD2-CG2 4.16Å; W278-I388 HydrophobicContact CG-CG2 4.36Å; W278-I388 HydrophobicContact CZ2-CB 4.1Å; W278-I388 HydrophobicContact CZ2-CG2 3.94Å; W278-A389 HydrophobicContact CH2-CB 3.78Å; W278-A389 HydrophobicContact CZ3-CB 3.92Å; W278-L392 HydrophobicContact CB-CD1 3.8Å; W278-L392 HydrophobicContact CD2-CD1 3.92Å; W278-L392 HydrophobicContact CE3-CD1 4.17Å; W278-L392 HydrophobicContact CG-CD1 3.78Å; W278-L405 HydrophobicContact CE3-CD2 4.07Å; W278-L405 HydrophobicContact CH2-CD2 3.24Å; W278-L405 HydrophobicContact CH2-CG 4.5Å; W278-L405 HydrophobicContact CZ2-CD2 3.82Å; W278-L405 HydrophobicContact CZ3-CB 4.26Å; W278-L405 HydrophobicContact CZ3-CD2 3.39Å; W278-L405 HydrophobicContact CZ3-CG 4.25Å; W278-I451 HydrophobicContact CB-CD1 3.67Å; W278-I451 HydrophobicContact CG-CD1 4.11Å |
| 279 | A | 93.1 | Very high | 91.7 | Very high | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -64.1 | -32 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | W270 Y275 R276 P283 L408 | W270-A279 HydrophobicContact CH2-CB 4.26Å; W270-A279 HydrophobicContact CZ3-CB 4.22Å; Y275-A279 HydrophobicContact CD1-CB 4.32Å; Y275-A279 HydrophobicContact CE1-CB 3.85Å; Y275-A279 HydrophobicContact CE2-CB 4.39Å; Y275-A279 WeakPolarHBondContact O-CB 3.13Å; Y275-A279 PolarHBondContact O-N 3.45Å; R276-A279 PolarHBondContact O-N 3.23Å; A279-P283 WeakPolarHBondContact O-CD 3.43Å; A279-P283 WeakPolarHBondContact O-CG 3.21Å; A279-L408 HydrophobicContact CB-CD1 4.22Å; A279-L408 VanDerWaalsContact O-CD1 3.24Å; A279-L408 WeakPolarHBondContact O-CD1 3.33Å |
| 280 | F | 93.8 | Very high | 92.1 | Very high | 123 Ų | 123 | 35.4 Ų | 35.4 | 54% | 0.539 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -93.5 | -31.1 | 173.7 | -69.7 | -69 | 0 | 0 | 0 | 113.2 | W270 R276 W278 A284 L408 | W270-F280 HydrophobicContact CE3-CE2 4.47Å; W270-F280 HydrophobicContact CH2-CE2 4.48Å; W270-F280 HydrophobicContact CH2-CZ 4.38Å; W270-F280 HydrophobicContact CZ3-CD2 4.47Å; W270-F280 AromaticContact CZ3-CE2 3.65Å; W270-F280 HydrophobicContact CZ3-CE2 3.65Å; W270-F280 AromaticContact CZ3-CZ 3.92Å; W270-F280 HydrophobicContact CZ3-CZ 3.92Å; R276-F280 VanDerWaalsContact O-CD2 3.26Å; R276-F280 WeakPolarHBondContact O-CD2 3.01Å; R276-F280 PolarHBondContact O-N 2.81Å; R276-F280 VanDerWaalsContact O-N 3.14Å; W278-F280 VanDerWaalsContact C-N 3.31Å; W278-F280 PolarHBondContact O-N 3.36Å; F280-A284 WeakPolarHBondContact O-CB 3.42Å; F280-A284 PolarHBondContact O-N 3.13Å; F280-L408 HydrophobicContact CD1-CD1 4.38Å; F280-L408 HydrophobicContact CE1-CD1 4.28Å |
| 281 | G | 94.1 | Very high | 92.3 | Very high | 3 Ų | 3 | 33 Ų | 33 | 3% | 0.031 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -68.4 | -40.9 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | I277 W278 A284 A285 | I277-G281 VanDerWaalsContact O-CA 3.31Å; I277-G281 WeakPolarHBondContact O-CA 3.46Å; I277-G281 PolarHBondContact O-N 3.33Å; W278-G281 PolarHBondContact O-N 3.39Å; G281-A284 PolarHBondContact O-N 3.09Å; G281-A285 WeakPolarHBondContact O-CB 3.49Å; G281-A285 PolarHBondContact O-N 3.31Å |
| 282 | I | 94.3 | Very high | 92.6 | Very high | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -62.8 | -54.9 | 177.3 | -74.8 | 175.9 | 0 | 0 | 0 | 111.6 | W278 A284 A285 L286 Q344 F348 F381 L405 M409 L448 | W278-I282 HydrophobicContact CD2-CD1 3.77Å; W278-I282 HydrophobicContact CE3-CD1 4.46Å; W278-I282 HydrophobicContact CG-CD1 4.16Å; W278-I282 HydrophobicContact CH2-CD1 4.27Å; W278-I282 HydrophobicContact CZ2-CD1 3.52Å; W278-I282 VanDerWaalsContact NE1-CD1 3.32Å; W278-I282 PolarHBondContact O-N 3.38Å; I282-A284 VanDerWaalsContact C-N 3.25Å; I282-A284 PolarHBondContact O-N 2.84Å; I282-A285 WeakPolarHBondContact O-CA 3.44Å; I282-A285 VanDerWaalsContact O-CB 3.26Å; I282-A285 WeakPolarHBondContact O-CB 3.36Å; I282-A285 PolarHBondContact O-N 3.49Å; I282-L286 HydrophobicContact CG2-CD1 3.55Å; I282-L286 HydrophobicContact CG2-CG 4.21Å; I282-L286 VanDerWaalsContact O-CG 3.27Å; I282-L286 WeakPolarHBondContact O-CG 3.36Å; I282-L286 PolarHBondContact O-N 3Å; I282-Q344 VanDerWaalsContact CD1-NE2 3.33Å; I282-F348 HydrophobicContact CG1-CE2 4.36Å; I282-F348 HydrophobicContact CG1-CZ 4.43Å; I282-F381 HydrophobicContact CG2-CE2 4.49Å; I282-F381 HydrophobicContact CG2-CZ 4.48Å; I282-L405 HydrophobicContact CB-CD1 3.79Å; I282-L405 HydrophobicContact CD1-CD1 3.89Å; I282-L405 HydrophobicContact CD1-CD2 3.66Å; I282-L405 HydrophobicContact CD1-CG 4.43Å; I282-L405 HydrophobicContact CG1-CD1 4.41Å; I282-L405 HydrophobicContact CG2-CD1 3.88Å; I282-M409 HydrophobicContact CG2-CE 4.31Å; I282-M409 HydrophobicContact CG2-CG 3.9Å; I282-M409 HydrophobicContact CG2-SD 3.91Å; I282-L448 HydrophobicContact CG1-CD1 4.26Å |
| 283 | P | 93.9 | Very high | 92.7 | Very high | 13 Ų | 13 | 24.8 Ų | 24.8 | 8% | 0.084 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -56.6 | -39.4 | 177.6 | -26.6 | 34 | 0 | 0 | 0 | 113.1 | A279 A285 L286 L408 M409 P412 | A279-P283 WeakPolarHBondContact O-CD 3.43Å; A279-P283 WeakPolarHBondContact O-CG 3.21Å; P283-A285 VanDerWaalsContact C-N 3.25Å; P283-A285 PolarHBondContact O-N 2.91Å; P283-L286 PolarHBondContact O-N 2.96Å; P283-L286 VanDerWaalsContact O-N 3.12Å; P283-L408 HydrophobicContact CB-CB 4.4Å; P283-L408 HydrophobicContact CG-CB 3.54Å; P283-M409 HydrophobicContact CG-CG 4.3Å; P283-P412 HydrophobicContact CB-CG 4.13Å; P283-P412 WeakPolarHBondContact O-CG 3.44Å |
| 284 | A | 92.5 | Very high | 92.9 | Very high | 50 Ų | 50 | 22.5 Ų | 22.5 | 41% | 0.413 | 11% | 0.107 | S | C | . | . | H | α-helix | trans | -60.2 | -36.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | F280 G281 I282 L286 P440 | F280-A284 WeakPolarHBondContact O-CB 3.42Å; F280-A284 PolarHBondContact O-N 3.13Å; G281-A284 PolarHBondContact O-N 3.09Å; I282-A284 VanDerWaalsContact C-N 3.25Å; I282-A284 PolarHBondContact O-N 2.84Å; A284-L286 VanDerWaalsContact C-N 3.29Å; A284-L286 PolarHBondContact O-N 2.63Å; A284-P440 WeakPolarHBondContact O-CB 3.34Å |
| 285 | A | 93.9 | Very high | 93.1 | Very high | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -69.3 | -21.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | G281 I282 P283 F348 P440 P441 | G281-A285 WeakPolarHBondContact O-CB 3.49Å; G281-A285 PolarHBondContact O-N 3.31Å; I282-A285 WeakPolarHBondContact O-CA 3.44Å; I282-A285 VanDerWaalsContact O-CB 3.26Å; I282-A285 WeakPolarHBondContact O-CB 3.36Å; I282-A285 PolarHBondContact O-N 3.49Å; P283-A285 VanDerWaalsContact C-N 3.25Å; P283-A285 PolarHBondContact O-N 2.91Å; A285-F348 HydrophobicContact CB-CD1 4.08Å; A285-F348 HydrophobicContact CB-CD2 4.25Å; A285-F348 HydrophobicContact CB-CE1 3.9Å; A285-F348 HydrophobicContact CB-CE2 4.05Å; A285-F348 HydrophobicContact CB-CG 4.26Å; A285-F348 HydrophobicContact CB-CZ 3.87Å; A285-P440 WeakPolarHBondContact CA-O 3.28Å; A285-P440 CarbonylContact O-C 3.59Å; A285-P441 VanDerWaalsContact O-CA 3.28Å; A285-P441 WeakPolarHBondContact O-CA 3.4Å; A285-P441 VanDerWaalsContact O-CD 3.26Å; A285-P441 WeakPolarHBondContact O-CD 3.31Å; A285-P441 VanDerWaalsContact O-CG 3.29Å; A285-P441 WeakPolarHBondContact O-CG 3.47Å; A285-P441 VanDerWaalsContact O-N 3.1Å |
| 286 | L | 93.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 11% | 0.106 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -97.4 | -2.6 | -165 | -72.5 | 172.1 | 0 | 0 | 0 | 115.7 | I282 P283 A284 G288 Y289 F348 F381 M409 P412 M413 | I282-L286 HydrophobicContact CG2-CD1 3.55Å; I282-L286 HydrophobicContact CG2-CG 4.21Å; I282-L286 VanDerWaalsContact O-CG 3.27Å; I282-L286 WeakPolarHBondContact O-CG 3.36Å; I282-L286 PolarHBondContact O-N 3Å; P283-L286 PolarHBondContact O-N 2.96Å; P283-L286 VanDerWaalsContact O-N 3.12Å; A284-L286 VanDerWaalsContact C-N 3.29Å; A284-L286 PolarHBondContact O-N 2.63Å; L286-G288 PolarHBondContact O-N 3.46Å; L286-Y289 HydrophobicContact CD2-CD1 4Å; L286-Y289 HydrophobicContact CD2-CD2 3.99Å; L286-Y289 HydrophobicContact CD2-CG 3.58Å; L286-Y289 WeakPolarHBondContact O-CB 3.47Å; L286-Y289 PolarHBondContact O-N 3.22Å; L286-F348 HydrophobicContact CD2-CE1 3.92Å; L286-F348 HydrophobicContact CD2-CZ 4.44Å; L286-F381 HydrophobicContact CD1-CZ 4.5Å; L286-F381 HydrophobicContact CD2-CE1 4.15Å; L286-F381 HydrophobicContact CD2-CZ 4.05Å; L286-M409 HydrophobicContact CD1-CB 4.06Å; L286-M409 HydrophobicContact CD1-CE 3.3Å; L286-M409 HydrophobicContact CD1-CG 3.57Å; L286-M409 HydrophobicContact CD1-SD 4.06Å; L286-P412 HydrophobicContact CB-CB 4.04Å; L286-P412 HydrophobicContact CB-CG 3.95Å; L286-M413 HydrophobicContact CB-CE 3.7Å; L286-M413 HydrophobicContact CD1-CE 4.31Å; L286-M413 HydrophobicContact CD2-CE 4.3Å; L286-M413 HydrophobicContact CG-CE 4.33Å |
| 287 | Y | 90.1 | Very high | 93.1 | Very high | 99 Ų | 99 | 17.4 Ų | 17.4 | 39% | 0.388 | 9% | 0.087 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -53.9 | -31.5 | -176.6 | -98.5 | -89.1 | 0 | 0 | 0 | 114 | P412 A415 G416 | Y287-P412 HydrophobicContact CD1-CB 4.39Å; Y287-P412 HydrophobicContact CD2-CB 3.74Å; Y287-P412 HydrophobicContact CE2-CB 4.08Å; Y287-P412 HydrophobicContact CG-CB 3.91Å; Y287-A415 HydrophobicContact CD1-CB 4.35Å; Y287-A415 HydrophobicContact CE1-CB 3.85Å; Y287-G416 WeakPolarHBondContact O-CA 3.3Å |
| 288 | G | 89.6 | Confident | 93 | Very high | 2 Ų | 2 | 17 Ų | 17 | 2% | 0.021 | 8% | 0.084 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -102.9 | -4.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | L286 Y290 V291 P292 A437 | L286-G288 PolarHBondContact O-N 3.46Å; G288-Y290 PolarHBondContact O-N 2.99Å; G288-V291 WeakPolarHBondContact O-CB 3.42Å; G288-V291 PolarHBondContact O-N 3.4Å; G288-P292 WeakPolarHBondContact O-CD 3.49Å; G288-A437 WeakPolarHBondContact CA-O 3.46Å |
| 289 | Y | 91.7 | Very high | 93 | Very high | 25 Ų | 25 | 17.2 Ų | 17.2 | 10% | 0.098 | 9% | 0.085 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -63.8 | -38.4 | -171.3 | 167.2 | -91.4 | 0 | 0 | 0 | 112.9 | L286 P292 Y293 I351 D378 F381 M413 | L286-Y289 HydrophobicContact CD2-CD1 4Å; L286-Y289 HydrophobicContact CD2-CD2 3.99Å; L286-Y289 HydrophobicContact CD2-CG 3.58Å; L286-Y289 WeakPolarHBondContact O-CB 3.47Å; L286-Y289 PolarHBondContact O-N 3.22Å; Y289-P292 WeakPolarHBondContact O-CD 3.44Å; Y289-Y293 HydrophobicContact CE1-CE2 4.35Å; Y289-I351 HydrophobicContact CD2-CG2 4.41Å; Y289-I351 HydrophobicContact CE2-CD1 4.49Å; Y289-D378 WeakPolarHBondContact CE2-OD1 3.45Å; Y289-D378 PolarHBondContact OH-OD1 2.92Å; Y289-F381 HydrophobicContact CE2-CD1 4.25Å; Y289-F381 HydrophobicContact CE2-CE1 4.4Å; Y289-M413 HydrophobicContact CD1-CE 3.59Å; Y289-M413 HydrophobicContact CD1-SD 4.07Å; Y289-M413 HydrophobicContact CE1-CE 4.47Å; Y289-M413 HydrophobicContact CG-CE 4.31Å |
| 290 | Y | 93.3 | Very high | 93 | Very high | 2 Ų | 2 | 17.2 Ų | 17.2 | 1% | 0.008 | 9% | 0.085 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.9 | -7.5 | -177.3 | -164.2 | -128.1 | 0 | 0 | 0 | 113.6 | Q81 M115 G288 Y293 V294 M413 P417 | Q81-Y290 PolarHBondContact NE2-OH 3.46Å; Q81-Y290 PolarHBondContact O-OH 2.99Å; M115-Y290 HydrophobicContact CB-CD1 4.38Å; M115-Y290 HydrophobicContact CB-CE1 3.9Å; M115-Y290 HydrophobicContact CG-CE1 4.33Å; M115-Y290 HydrophobicContact CG-CE2 4.31Å; G288-Y290 PolarHBondContact O-N 2.99Å; Y290-Y293 HydrophobicContact CD2-CD2 4.11Å; Y290-Y293 HydrophobicContact CD2-CG 4.23Å; Y290-Y293 HydrophobicContact CE2-CG 4.33Å; Y290-Y293 PolarHBondContact O-N 3.09Å; Y290-V294 HydrophobicContact CD1-CG2 3.89Å; Y290-V294 HydrophobicContact CE1-CG2 3.43Å; Y290-V294 VanDerWaalsContact CE1-CG2 3.43Å; Y290-V294 HydrophobicContact CE2-CG2 4.46Å; Y290-V294 PolarHBondContact O-N 3.18Å; Y290-M413 HydrophobicContact CG-SD 4.17Å; Y290-P417 HydrophobicContact CD1-CG 3.48Å; Y290-P417 VanDerWaalsContact CD1-CG 3.48Å; Y290-P417 HydrophobicContact CE1-CG 4.14Å; Y290-P417 HydrophobicContact CG-CG 4.28Å |
| 291 | V | 95.3 | Very high | 92.8 | Very high | 4 Ų | 4 | 13.6 Ų | 13.6 | 2% | 0.024 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -62.1 | -47.5 | -178.3 | 171 | 0 | 0 | 0 | 0 | 112.1 | G288 Y293 V294 H295 A420 F434 A437 | G288-V291 WeakPolarHBondContact O-CB 3.42Å; G288-V291 PolarHBondContact O-N 3.4Å; V291-Y293 VanDerWaalsContact C-N 3.34Å; V291-Y293 PolarHBondContact O-N 3.31Å; V291-V294 PolarHBondContact O-N 3.22Å; V291-H295 PolarHBondContact O-N 2.89Å; V291-A420 HydrophobicContact CB-CB 4.36Å; V291-A420 HydrophobicContact CG1-CB 3.59Å; V291-A420 HydrophobicContact CG2-CB 3.84Å; V291-F434 HydrophobicContact CG1-CD1 4.25Å; V291-F434 HydrophobicContact CG1-CE1 4.04Å; V291-A437 HydrophobicContact CB-CB 4.02Å; V291-A437 HydrophobicContact CG1-CB 4.12Å; V291-A437 HydrophobicContact CG2-CB 4.23Å |
| 292 | P | 92.2 | Very high | 92.6 | Very high | 2 Ų | 2 | 17.2 Ų | 17.2 | 1% | 0.013 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -59.6 | -38.8 | 175.7 | -24.8 | 35.3 | 0 | 0 | 0 | 114 | G288 Y289 V294 L296 I358 M374 F434 | G288-P292 WeakPolarHBondContact O-CD 3.49Å; Y289-P292 WeakPolarHBondContact O-CD 3.44Å; P292-V294 VanDerWaalsContact C-N 3.26Å; P292-V294 PolarHBondContact O-N 3.45Å; P292-L296 WeakPolarHBondContact O-CB 3.19Å; P292-L296 PolarHBondContact O-N 3.03Å; P292-L296 VanDerWaalsContact O-N 3.13Å; P292-I358 HydrophobicContact CB-CD1 4.21Å; P292-I358 HydrophobicContact CG-CD1 4.13Å; P292-M374 HydrophobicContact CB-CE 3.92Å; P292-M374 HydrophobicContact CB-SD 4.13Å; P292-M374 HydrophobicContact CG-SD 4.11Å; P292-F434 HydrophobicContact CB-CE1 4.29Å; P292-F434 HydrophobicContact CG-CD1 4.48Å; P292-F434 HydrophobicContact CG-CE1 4.16Å |
| 293 | Y | 90 | Very high | 92.5 | Very high | 8 Ų | 8 | 21.1 Ų | 21.1 | 3% | 0.031 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -63 | -32.8 | 179.8 | -72.9 | -81.8 | 0 | 0 | 0 | 113.1 | N82 G85 Y289 Y290 V291 L314 I317 D378 | N82-Y293 HydrophobicContact CB-CD1 4.21Å; N82-Y293 HydrophobicContact CB-CE1 4.4Å; G85-Y293 WeakPolarHBondContact CA-O 2.99Å; G85-Y293 PolarHBondContact N-O 3.39Å; Y289-Y293 HydrophobicContact CE1-CE2 4.35Å; Y290-Y293 HydrophobicContact CD2-CD2 4.11Å; Y290-Y293 HydrophobicContact CD2-CG 4.23Å; Y290-Y293 HydrophobicContact CE2-CG 4.33Å; Y290-Y293 PolarHBondContact O-N 3.09Å; V291-Y293 VanDerWaalsContact C-N 3.34Å; V291-Y293 PolarHBondContact O-N 3.31Å; Y293-L314 HydrophobicContact CD1-CD2 4.39Å; Y293-I317 HydrophobicContact CE1-CG2 3.9Å; Y293-D378 PolarHBondContact OH-OD1 3.07Å |
| 294 | V | 94.6 | Very high | 92.4 | Very high | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -89.9 | -48 | -178.9 | -179.6 | 0 | 0 | 0 | 0 | 112.1 | F84 G85 Y88 Y290 V291 P292 P417 | F84-V294 HydrophobicContact CD1-CG1 4.14Å; F84-V294 HydrophobicContact CD1-CG2 4.25Å; F84-V294 HydrophobicContact CE1-CG1 4.28Å; G85-V294 WeakPolarHBondContact CA-O 3.16Å; Y88-V294 HydrophobicContact CD1-CG1 4.42Å; Y88-V294 WeakPolarHBondContact CD1-O 3.22Å; Y88-V294 HydrophobicContact CD2-CG1 4.15Å; Y88-V294 HydrophobicContact CG-CG1 4.04Å; Y290-V294 HydrophobicContact CD1-CG2 3.89Å; Y290-V294 HydrophobicContact CE1-CG2 3.43Å; Y290-V294 VanDerWaalsContact CE1-CG2 3.43Å; Y290-V294 HydrophobicContact CE2-CG2 4.46Å; Y290-V294 PolarHBondContact O-N 3.18Å; V291-V294 PolarHBondContact O-N 3.22Å; P292-V294 VanDerWaalsContact C-N 3.26Å; P292-V294 PolarHBondContact O-N 3.45Å; V294-P417 HydrophobicContact CB-CB 4.11Å; V294-P417 HydrophobicContact CB-CG 4.4Å; V294-P417 HydrophobicContact CG1-CB 4.2Å; V294-P417 HydrophobicContact CG2-CB 4.01Å; V294-P417 HydrophobicContact CG2-CG 3.87Å |
| 295 | H | 95.3 | Very high | 92.2 | Very high | 0 Ų | 0 | 21.7 Ų | 21.7 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -99.6 | -14.8 | -165.2 | -67 | -67.7 | 0 | 0 | 0 | 114.6 | Y88 S108 V291 M297 K298 H299 P417 Y430 F434 | Y88-H295 AromaticContact CE1-ND1 3.78Å; Y88-H295 AromaticContact CZ-CE1 3.9Å; Y88-H295 AromaticContact CZ-ND1 3.71Å; S108-H295 VanDerWaalsContact CB-CE1 3.42Å; S108-H295 WeakPolarHBondContact CB-CE1 3.47Å; V291-H295 PolarHBondContact O-N 2.89Å; H295-M297 VanDerWaalsContact C-N 3.33Å; H295-M297 PolarHBondContact O-N 3.39Å; H295-K298 PolarHBondContact O-N 3.47Å; H295-H299 PolarHBondContact O-N 3Å; H295-P417 PolarHBondContact NE2-O 3.18Å; H295-Y430 HydrophobicContact CB-CD1 3.88Å; H295-Y430 HydrophobicContact CB-CE1 3.71Å; H295-Y430 AromaticContact CE1-CE1 3.89Å; H295-Y430 AromaticContact CG-CE1 3.54Å; H295-Y430 AromaticContact ND1-CE1 3.19Å; H295-Y430 WeakPolarHBondContact ND1-CE1 3.12Å; H295-Y430 AromaticContact ND1-CZ 3.65Å; H295-Y430 PolarHBondContact ND1-OH 3.09Å; H295-F434 HydrophobicContact CB-CZ 4.28Å |
| 296 | L | 93.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -60.1 | -41.2 | -176.8 | -178.7 | 63.9 | 0 | 0 | 0 | 112.5 | P292 K298 H299 V300 L313 I317 I358 L367 | P292-L296 WeakPolarHBondContact O-CB 3.19Å; P292-L296 PolarHBondContact O-N 3.03Å; P292-L296 VanDerWaalsContact O-N 3.13Å; L296-K298 VanDerWaalsContact C-N 3.3Å; L296-K298 PolarHBondContact O-N 2.9Å; L296-H299 PolarHBondContact O-N 2.95Å; L296-V300 HydrophobicContact CD1-CG2 4.22Å; L296-V300 HydrophobicContact CG-CG2 4.41Å; L296-V300 WeakPolarHBondContact O-CG2 3.36Å; L296-V300 PolarHBondContact O-N 3.2Å; L296-L313 HydrophobicContact CD1-CD1 4.47Å; L296-L313 HydrophobicContact CD2-CB 4.16Å; L296-L313 HydrophobicContact CD2-CD1 4.17Å; L296-L313 HydrophobicContact CG-CD1 4.15Å; L296-I317 HydrophobicContact CD2-CD1 4.33Å; L296-I358 HydrophobicContact CD1-CD1 4.45Å; L296-I358 HydrophobicContact CD1-CG2 3.97Å; L296-L367 HydrophobicContact CD1-CD1 4.2Å; L296-L367 HydrophobicContact CD1-CD2 4.21Å |
| 297 | M | 91.8 | Very high | 91.2 | Very high | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60 | -41.7 | 179.4 | -63 | -59.3 | 108.3 | 0 | 0 | 111.9 | I86 V89 H295 Q301 K310 L313 L314 | I86-M297 HydrophobicContact CG1-CG 4.23Å; I86-M297 HydrophobicContact CG1-SD 4.41Å; V89-M297 HydrophobicContact CG2-CB 4.05Å; H295-M297 VanDerWaalsContact C-N 3.33Å; H295-M297 PolarHBondContact O-N 3.39Å; M297-Q301 PolarHBondContact O-N 3.2Å; M297-K310 HydrophobicContact CB-CD 4.28Å; M297-K310 WeakPolarHBondContact CE-O 3.45Å; M297-K310 HydrophobicContact SD-CB 3.95Å; M297-K310 HydrophobicContact SD-CD 4.38Å; M297-K310 HydrophobicContact SD-CG 3.92Å; M297-L313 HydrophobicContact CE-CB 4.13Å; M297-L314 HydrophobicContact CE-CD1 4.06Å; M297-L314 HydrophobicContact CE-CD2 4.09Å; M297-L314 HydrophobicContact CE-CG 3.57Å; M297-L314 HydrophobicContact CG-CD1 4.48Å; M297-L314 HydrophobicContact SD-CD1 4.14Å; M297-L314 HydrophobicContact SD-CG 4.25Å |
| 298 | K | 92.2 | Very high | 91.1 | Very high | 26 Ų | 26 | 31.1 Ų | 31.1 | 11% | 0.113 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -72.6 | -43.2 | 179.1 | -175.5 | 63.6 | -179.3 | -177.7 | 0 | 111.3 | Y88 V89 L92 H295 L296 V300 Q301 E302 Y430 | Y88-K298 HydrophobicContact CD1-CB 4.43Å; Y88-K298 HydrophobicContact CE1-CB 3.89Å; Y88-K298 HydrophobicContact CE1-CG 4.32Å; V89-K298 HydrophobicContact CG2-CB 4.06Å; V89-K298 HydrophobicContact CG2-CD 4.41Å; L92-K298 HydrophobicContact CD2-CD 4.1Å; L92-K298 HydrophobicContact CD2-CG 4.47Å; H295-K298 PolarHBondContact O-N 3.47Å; L296-K298 VanDerWaalsContact C-N 3.3Å; L296-K298 PolarHBondContact O-N 2.9Å; K298-V300 VanDerWaalsContact C-N 3.3Å; K298-V300 PolarHBondContact O-N 3.08Å; K298-Q301 WeakPolarHBondContact O-CB 3.29Å; K298-Q301 PolarHBondContact O-N 3.29Å; K298-E302 WeakPolarHBondContact CE-OE1 3.33Å; K298-E302 WeakPolarHBondContact O-CG 3.43Å; K298-E302 PolarHBondContact O-N 3.38Å; K298-Y430 HydrophobicContact CB-CE2 4.15Å; K298-Y430 HydrophobicContact CG-CE2 3.74Å |
| 299 | H | 93.5 | Very high | 91 | Very high | 4 Ų | 4 | 34.6 Ų | 34.6 | 2% | 0.019 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -56.3 | -43.5 | 175.1 | 174.7 | 76.5 | 0 | 0 | 0 | 112.4 | H295 L296 E302 R303 Y430 D431 F434 | H295-H299 PolarHBondContact O-N 3Å; L296-H299 PolarHBondContact O-N 2.95Å; H299-E302 PolarHBondContact O-N 3.34Å; H299-R303 WeakPolarHBondContact O-CB 3.17Å; H299-R303 PolarHBondContact O-N 2.93Å; H299-Y430 HydrophobicContact CB-CD2 4.13Å; H299-Y430 HydrophobicContact CB-CG 4.4Å; H299-D431 IonicContact CE1-OD1 3.51Å; H299-D431 PolarHBondContact CE1-OD1 3.27Å; H299-D431 VanDerWaalsContact CE1-OD1 3.26Å; H299-D431 IonicContact ND1-OD1 3.79Å; H299-F434 HydrophobicContact CB-CE2 3.78Å; H299-F434 HydrophobicContact CB-CZ 4.35Å; H299-F434 AromaticContact CG-CE2 3.69Å; H299-F434 AromaticContact ND1-CE2 3.98Å |
| 300 | V | 93.1 | Very high | 90.8 | Very high | 1 Ų | 1 | 34.9 Ų | 34.9 | 1% | 0.006 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -64.3 | -43.2 | 177.5 | 171.3 | 0 | 0 | 0 | 0 | 111.4 | L296 K298 E302 R303 F304 V308 K310 L313 F364 L367 | L296-V300 HydrophobicContact CD1-CG2 4.22Å; L296-V300 HydrophobicContact CG-CG2 4.41Å; L296-V300 WeakPolarHBondContact O-CG2 3.36Å; L296-V300 PolarHBondContact O-N 3.2Å; K298-V300 VanDerWaalsContact C-N 3.3Å; K298-V300 PolarHBondContact O-N 3.08Å; V300-E302 VanDerWaalsContact C-N 3.3Å; V300-E302 PolarHBondContact O-N 2.92Å; V300-R303 PolarHBondContact O-N 3.27Å; V300-F304 HydrophobicContact CG1-CD2 4.18Å; V300-F304 PolarHBondContact O-N 3Å; V300-V308 HydrophobicContact CG1-CG1 4.4Å; V300-K310 HydrophobicContact CB-CB 4.34Å; V300-K310 HydrophobicContact CG1-CB 3.86Å; V300-L313 HydrophobicContact CB-CD1 4.49Å; V300-L313 HydrophobicContact CG2-CD1 3.41Å; V300-L313 VanDerWaalsContact CG2-CD1 3.41Å; V300-F364 HydrophobicContact CG1-CE2 4.09Å; V300-L367 HydrophobicContact CG2-CD2 3.46Å; V300-L367 VanDerWaalsContact CG2-CD2 3.46Å |
| 301 | Q | 90.4 | Very high | 90.6 | Very high | 47 Ų | 47 | 36 Ų | 36 | 22% | 0.22 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.4 | -37.8 | 177.7 | -179.9 | 173.3 | -16.3 | 0 | 0 | 112.1 | M297 K298 G305 | M297-Q301 PolarHBondContact O-N 3.2Å; K298-Q301 WeakPolarHBondContact O-CB 3.29Å; K298-Q301 PolarHBondContact O-N 3.29Å; Q301-G305 CarbonylContact O-C 3.59Å; Q301-G305 VanDerWaalsContact O-CA 3.27Å; Q301-G305 WeakPolarHBondContact O-CA 3.44Å; Q301-G305 PolarHBondContact O-N 3.29Å |
| 302 | E | 90.3 | Very high | 90.4 | Very high | 78 Ų | 78 | 38.2 Ų | 38.2 | 36% | 0.364 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -72.1 | -38.8 | 176.5 | -71.2 | 174.8 | 176.2 | 0 | 0 | 112.4 | K298 H299 V300 R424 Y430 | K298-E302 WeakPolarHBondContact CE-OE1 3.33Å; K298-E302 WeakPolarHBondContact O-CG 3.43Å; K298-E302 PolarHBondContact O-N 3.38Å; H299-E302 PolarHBondContact O-N 3.34Å; V300-E302 VanDerWaalsContact C-N 3.3Å; V300-E302 PolarHBondContact O-N 2.92Å; E302-R424 IonicContact OE1-CZ 3.26Å; E302-R424 IonicContact OE1-NE 3.7Å; E302-R424 IonicContact OE1-NH2 3.02Å; E302-Y430 WeakPolarHBondContact OE2-CD2 3.49Å |
| 303 | R | 91.3 | Very high | 90.4 | Very high | 83 Ų | 83 | 38.1 Ų | 38.1 | 31% | 0.313 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -86.8 | -40.6 | -172.6 | -167.1 | 171.5 | -169.5 | 117.2 | -4.6 | 114.3 | H299 V300 P359 C361 N362 D431 | H299-R303 WeakPolarHBondContact O-CB 3.17Å; H299-R303 PolarHBondContact O-N 2.93Å; V300-R303 PolarHBondContact O-N 3.27Å; R303-P359 PolarHBondContact NH1-O 3.26Å; R303-P359 VanDerWaalsContact NH1-O 3.11Å; R303-P359 PolarHBondContact NH2-O 3.39Å; R303-C361 PolarHBondContact NE-O 3.4Å; R303-N362 PolarHBondContact NH2-OD1 2.89Å; R303-D431 IonicContact NH1-OD1 3.99Å; R303-D431 IonicContact NH1-OD2 3.98Å; R303-D431 PolarHBondContact NH1-OD2 3.41Å |
| 304 | F | 91.2 | Very high | 90.4 | Very high | 51 Ų | 51 | 37.7 Ų | 37.7 | 22% | 0.224 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -110 | -4.3 | -174.9 | -60.2 | -80.1 | 0 | 0 | 0 | 113.4 | V300 V308 C361 N362 F364 L367 | V300-F304 HydrophobicContact CG1-CD2 4.18Å; V300-F304 PolarHBondContact O-N 3Å; F304-V308 HydrophobicContact CB-CB 4.46Å; F304-V308 HydrophobicContact CB-CG2 3.83Å; F304-C361 WeakPolarHBondContact CZ-O 3.45Å; F304-N362 WeakPolarHBondContact CE1-O 3.21Å; F304-F364 HydrophobicContact CD1-CB 4.45Å; F304-F364 HydrophobicContact CD2-CD2 4.49Å; F304-F364 HydrophobicContact CE1-CB 4.41Å; F304-L367 HydrophobicContact CE2-CD2 4.15Å |
| 305 | G | 88.6 | Confident | 90.3 | Very high | 24 Ų | 24 | 39.6 Ų | 39.6 | 25% | 0.247 | 21% | 0.207 | C | C | . | . | trans | 89.7 | 170.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q301 N307 | Q301-G305 CarbonylContact O-C 3.59Å; Q301-G305 VanDerWaalsContact O-CA 3.27Å; Q301-G305 WeakPolarHBondContact O-CA 3.44Å; Q301-G305 PolarHBondContact O-N 3.29Å; G305-N307 PolarHBondContact O-N 2.91Å | ||
| 306 | P | 83.4 | Confident | 90.2 | Very high | 95 Ų | 95 | 40.4 Ų | 40.4 | 62% | 0.617 | 21% | 0.212 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -75.4 | -19.6 | -171.9 | 29.9 | -35.8 | 0 | 0 | 0 | 114.4 | V308 | P306-V308 VanDerWaalsContact C-N 3.27Å; P306-V308 PolarHBondContact O-N 3.37Å |
| 307 | N | 83.6 | Confident | 90.1 | Very high | 160 Ų | 160 | 40.4 Ų | 40.4 | 86% | 0.856 | 21% | 0.213 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -82.1 | -4.1 | -174.1 | -63.8 | -20.9 | 0 | 0 | 0 | 113.6 | G305 | G305-N307 PolarHBondContact O-N 2.91Š|
| 308 | V | 88.1 | Confident | 90.1 | Very high | 41 Ų | 41 | 40.5 Ų | 40.5 | 25% | 0.248 | 21% | 0.214 | C | C | . | . | S | Bend | trans | -83 | 134.9 | 179.7 | 179.5 | 0 | 0 | 0 | 0 | 109.9 | V300 F304 P306 K310 F364 | V300-V308 HydrophobicContact CG1-CG1 4.4Å; F304-V308 HydrophobicContact CB-CB 4.46Å; F304-V308 HydrophobicContact CB-CG2 3.83Å; P306-V308 VanDerWaalsContact C-N 3.27Å; P306-V308 PolarHBondContact O-N 3.37Å; V308-K310 PolarHBondContact O-N 3.37Å; V308-F364 HydrophobicContact CG1-CD1 4.04Å; V308-F364 HydrophobicContact CG1-CD2 3.51Å; V308-F364 HydrophobicContact CG1-CE1 3.88Å; V308-F364 HydrophobicContact CG1-CE2 3.34Å; V308-F364 HydrophobicContact CG1-CG 3.86Å; V308-F364 HydrophobicContact CG1-CZ 3.54Å |
| 309 | N | 87.2 | Confident | 90.1 | Very high | 75 Ų | 75 | 43 Ų | 43 | 40% | 0.401 | 23% | 0.227 | S | C | . | . | trans | -73.5 | 78.4 | 178.3 | -168.2 | -25.1 | 0 | 0 | 0 | 110.5 | E311 I312 F364 | N309-E311 PolarHBondContact O-N 3.48Å; N309-E311 PolarHBondContact OD1-OE2 2.83Å; N309-I312 HydrophobicContact CB-CD1 3.81Å; N309-I312 HydrophobicContact CB-CG1 4.22Å; N309-I312 WeakPolarHBondContact O-CB 3.42Å; N309-I312 PolarHBondContact O-N 3.48Å; N309-F364 WeakPolarHBondContact O-CZ 3.48Å | ||
| 310 | K | 88.3 | Confident | 90.1 | Very high | 31 Ų | 31 | 43.5 Ų | 43.5 | 14% | 0.135 | 23% | 0.23 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64.4 | -24.6 | -178.2 | 60.1 | -170.1 | 175.9 | -173 | 0 | 112.6 | M297 V300 V308 I312 L313 | M297-K310 HydrophobicContact CB-CD 4.28Å; M297-K310 WeakPolarHBondContact CE-O 3.45Å; M297-K310 HydrophobicContact SD-CB 3.95Å; M297-K310 HydrophobicContact SD-CD 4.38Å; M297-K310 HydrophobicContact SD-CG 3.92Å; V300-K310 HydrophobicContact CB-CB 4.34Å; V300-K310 HydrophobicContact CG1-CB 3.86Å; V308-K310 PolarHBondContact O-N 3.37Å; K310-I312 PolarHBondContact O-N 3.49Å; K310-L313 WeakPolarHBondContact O-CB 3.42Å; K310-L313 PolarHBondContact O-N 3.44Å |
| 311 | E | 88.6 | Confident | 90.1 | Very high | 25 Ų | 25 | 43.6 Ų | 43.6 | 12% | 0.117 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60.1 | -31.2 | 177.1 | -62.1 | 72.9 | -163.7 | 0 | 0 | 111.9 | I86 F212 S215 N309 L313 L314 L315 | I86-E311 HydrophobicContact CD1-CG 4.34Å; F212-E311 HydrophobicContact CD1-CB 3.92Å; F212-E311 HydrophobicContact CD1-CG 4.47Å; F212-E311 HydrophobicContact CE1-CB 3.62Å; F212-E311 HydrophobicContact CZ-CB 3.97Å; S215-E311 WeakPolarHBondContact CB-OE1 3.25Å; S215-E311 VanDerWaalsContact OG-CG 3.29Å; S215-E311 WeakPolarHBondContact OG-CG 3.33Å; S215-E311 PolarHBondContact OG-OE1 3.22Å; N309-E311 PolarHBondContact O-N 3.48Å; N309-E311 PolarHBondContact OD1-OE2 2.83Å; E311-L313 PolarHBondContact O-N 3.37Å; E311-L313 VanDerWaalsContact O-N 3.14Å; E311-L314 PolarHBondContact O-N 3.06Å; E311-L315 PolarHBondContact O-N 3.44Å; E311-L315 VanDerWaalsContact O-N 3.07Å |
| 312 | I | 91.4 | Very high | 90 | Very high | 51 Ų | 51 | 42.5 Ų | 42.5 | 26% | 0.262 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -57.2 | -28.3 | 175.3 | -67.7 | 173.1 | 0 | 0 | 0 | 111.8 | F212 N309 K310 L315 C316 I368 | F212-I312 HydrophobicContact CZ-CG1 4.48Å; N309-I312 HydrophobicContact CB-CD1 3.81Å; N309-I312 HydrophobicContact CB-CG1 4.22Å; N309-I312 WeakPolarHBondContact O-CB 3.42Å; N309-I312 PolarHBondContact O-N 3.48Å; K310-I312 PolarHBondContact O-N 3.49Å; I312-L315 WeakPolarHBondContact O-CB 3.47Å; I312-L315 PolarHBondContact O-N 2.93Å; I312-C316 WeakPolarHBondContact O-CB 3.43Å; I312-C316 PolarHBondContact O-N 3.14Å; I312-C316 PolarHBondContact O-SG 2.96Å; I312-I368 HydrophobicContact CG2-CD1 4.38Å |
| 313 | L | 92.2 | Very high | 90.1 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -70.9 | -42.6 | 179.8 | -58.9 | 175.9 | 0 | 0 | 0 | 112 | L296 M297 V300 K310 E311 L315 C316 I317 F364 L367 I368 | L296-L313 HydrophobicContact CD1-CD1 4.47Å; L296-L313 HydrophobicContact CD2-CB 4.16Å; L296-L313 HydrophobicContact CD2-CD1 4.17Å; L296-L313 HydrophobicContact CG-CD1 4.15Å; M297-L313 HydrophobicContact CE-CB 4.13Å; V300-L313 HydrophobicContact CB-CD1 4.49Å; V300-L313 HydrophobicContact CG2-CD1 3.41Å; V300-L313 VanDerWaalsContact CG2-CD1 3.41Å; K310-L313 WeakPolarHBondContact O-CB 3.42Å; K310-L313 PolarHBondContact O-N 3.44Å; E311-L313 PolarHBondContact O-N 3.37Å; E311-L313 VanDerWaalsContact O-N 3.14Å; L313-L315 VanDerWaalsContact C-N 3.32Å; L313-C316 PolarHBondContact O-N 3.24Å; L313-I317 WeakPolarHBondContact O-CG1 3.19Å; L313-I317 PolarHBondContact O-N 3.06Å; L313-F364 HydrophobicContact CD1-CE2 4.06Å; L313-F364 HydrophobicContact CD2-CE2 4.04Å; L313-F364 HydrophobicContact CD2-CZ 4.12Å; L313-F364 HydrophobicContact CG-CE2 4.08Å; L313-F364 HydrophobicContact CG-CZ 4.2Å; L313-L367 HydrophobicContact CD1-CD2 3.63Å; L313-L367 HydrophobicContact CD1-CG 4.11Å; L313-L367 HydrophobicContact CD2-CD2 4.43Å; L313-L367 HydrophobicContact CD2-CG 4.14Å; L313-I368 HydrophobicContact CD2-CB 4.5Å; L313-I368 HydrophobicContact CD2-CG1 3.77Å |
| 314 | L | 89 | Confident | 90 | Very high | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -67.3 | -36.1 | 173.6 | -68.1 | 177.8 | 0 | 0 | 0 | 111.3 | I86 P211 Y293 M297 E311 I317 G318 | I86-L314 HydrophobicContact CD1-CD1 4.1Å; I86-L314 HydrophobicContact CG1-CD1 4.35Å; P211-L314 HydrophobicContact CB-CB 4.45Å; P211-L314 HydrophobicContact CB-CD1 4.27Å; P211-L314 HydrophobicContact CG-CB 3.99Å; P211-L314 HydrophobicContact CG-CD1 3.95Å; Y293-L314 HydrophobicContact CD1-CD2 4.39Å; M297-L314 HydrophobicContact CE-CD1 4.06Å; M297-L314 HydrophobicContact CE-CD2 4.09Å; M297-L314 HydrophobicContact CE-CG 3.57Å; M297-L314 HydrophobicContact CG-CD1 4.48Å; M297-L314 HydrophobicContact SD-CD1 4.14Å; M297-L314 HydrophobicContact SD-CG 4.25Å; E311-L314 PolarHBondContact O-N 3.06Å; L314-I317 HydrophobicContact CD2-CD1 4.36Å; L314-I317 PolarHBondContact O-N 3.01Å; L314-G318 PolarHBondContact O-N 2.95Å |
| 315 | L | 92.2 | Very high | 89.8 | Confident | 40 Ų | 40 | 37.9 Ų | 37.9 | 21% | 0.209 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -55.2 | -51.2 | 170.2 | 173.2 | 69.2 | 0 | 0 | 0 | 111.1 | V208 F212 E311 I312 L313 I317 G318 I319 | V208-L315 HydrophobicContact CB-CD1 3.98Å; V208-L315 HydrophobicContact CG1-CD1 3.28Å; V208-L315 HydrophobicContact CG2-CD1 4Å; F212-L315 HydrophobicContact CE2-CB 3.88Å; F212-L315 HydrophobicContact CE2-CD1 4.09Å; F212-L315 HydrophobicContact CE2-CD2 4.12Å; F212-L315 HydrophobicContact CE2-CG 4.25Å; F212-L315 HydrophobicContact CZ-CB 4.01Å; F212-L315 HydrophobicContact CZ-CD2 3.87Å; F212-L315 HydrophobicContact CZ-CG 4.4Å; E311-L315 PolarHBondContact O-N 3.44Å; E311-L315 VanDerWaalsContact O-N 3.07Å; I312-L315 WeakPolarHBondContact O-CB 3.47Å; I312-L315 PolarHBondContact O-N 2.93Å; L313-L315 VanDerWaalsContact C-N 3.32Å; L315-I317 PolarHBondContact O-N 3.36Å; L315-G318 PolarHBondContact O-N 3.25Å; L315-I319 HydrophobicContact CD1-CD1 3.68Å; L315-I319 HydrophobicContact CD1-CG1 4.13Å; L315-I319 HydrophobicContact CG-CD1 3.93Å; L315-I319 WeakPolarHBondContact O-CG1 3.42Å; L315-I319 PolarHBondContact O-N 3.42Å |
| 316 | C | 93.4 | Very high | 89.6 | Confident | 16 Ų | 16 | 42.3 Ų | 42.3 | 11% | 0.108 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -60.7 | -44.4 | 179.3 | -73.6 | 0 | 0 | 0 | 0 | 112.2 | I312 L313 T320 C371 L372 | I312-C316 WeakPolarHBondContact O-CB 3.43Å; I312-C316 PolarHBondContact O-N 3.14Å; I312-C316 PolarHBondContact O-SG 2.96Å; L313-C316 PolarHBondContact O-N 3.24Å; C316-T320 WeakPolarHBondContact O-CB 3.28Å; C316-T320 PolarHBondContact O-N 3.38Å; C316-T320 VanDerWaalsContact O-N 3.11Å; C316-T320 PolarHBondContact O-OG1 3.16Å; C316-C371 HydrophobicContact CB-CB 4.3Å; C316-L372 HydrophobicContact CB-CD2 3.66Å; C316-L372 HydrophobicContact CB-CG 4.03Å |
| 317 | I | 93.3 | Very high | 89.8 | Confident | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.005 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -60.8 | -47.2 | 175.5 | -67.1 | 164 | 0 | 0 | 0 | 110.4 | Y293 L296 L313 L314 L315 T320 S321 C371 M374 | Y293-I317 HydrophobicContact CE1-CG2 3.9Å; L296-I317 HydrophobicContact CD2-CD1 4.33Å; L313-I317 WeakPolarHBondContact O-CG1 3.19Å; L313-I317 PolarHBondContact O-N 3.06Å; L314-I317 HydrophobicContact CD2-CD1 4.36Å; L314-I317 PolarHBondContact O-N 3.01Å; L315-I317 PolarHBondContact O-N 3.36Å; I317-T320 PolarHBondContact O-OG1 3.26Å; I317-S321 WeakPolarHBondContact O-CB 3.46Å; I317-S321 PolarHBondContact O-N 3.22Å; I317-C371 HydrophobicContact CD1-CB 4.31Å; I317-C371 HydrophobicContact CG1-CB 3.85Å; I317-C371 WeakPolarHBondContact CG1-O 3.48Å; I317-M374 HydrophobicContact CD1-CE 3.36Å; I317-M374 HydrophobicContact CG1-CE 3.87Å |
| 318 | G | 90.9 | Very high | 90 | Very high | 2 Ų | 2 | 35.7 Ų | 35.7 | 2% | 0.021 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64.3 | -45.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | L314 L315 C322 | L314-G318 PolarHBondContact O-N 2.95Å; L315-G318 PolarHBondContact O-N 3.25Å; G318-C322 WeakPolarHBondContact O-CB 3.45Å; G318-C322 PolarHBondContact O-N 3.49Å |
| 319 | I | 92.6 | Very high | 89.6 | Confident | 77 Ų | 77 | 34.8 Ų | 34.8 | 40% | 0.395 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -62.1 | -50.2 | 177.6 | -68.8 | 174.3 | 0 | 0 | 0 | 110.2 | V208 L315 C322 L323 | V208-I319 HydrophobicContact CG2-CB 4.5Å; V208-I319 HydrophobicContact CG2-CG1 3.61Å; L315-I319 HydrophobicContact CD1-CD1 3.68Å; L315-I319 HydrophobicContact CD1-CG1 4.13Å; L315-I319 HydrophobicContact CG-CD1 3.93Å; L315-I319 WeakPolarHBondContact O-CG1 3.42Å; L315-I319 PolarHBondContact O-N 3.42Å; I319-C322 WeakPolarHBondContact O-CB 3.32Å; I319-C322 PolarHBondContact O-N 3.09Å; I319-L323 HydrophobicContact CG2-CD1 4.05Å; I319-L323 WeakPolarHBondContact O-CG 3.46Å; I319-L323 PolarHBondContact O-N 3.49Å |
| 320 | T | 94.2 | Very high | 89.2 | Confident | 15 Ų | 15 | 34.6 Ų | 34.6 | 9% | 0.092 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -71.9 | -31.8 | -176.2 | 52.6 | 0 | 0 | 0 | 0 | 112.6 | C316 I317 C322 L323 G324 L372 G375 L376 | C316-T320 WeakPolarHBondContact O-CB 3.28Å; C316-T320 PolarHBondContact O-N 3.38Å; C316-T320 VanDerWaalsContact O-N 3.11Å; C316-T320 PolarHBondContact O-OG1 3.16Å; I317-T320 PolarHBondContact O-OG1 3.26Å; T320-C322 VanDerWaalsContact C-N 3.34Å; T320-L323 PolarHBondContact O-N 3.5Å; T320-G324 PolarHBondContact O-N 2.66Å; T320-L372 VanDerWaalsContact CB-O 3.26Å; T320-L372 WeakPolarHBondContact CB-O 3.43Å; T320-L372 HydrophobicContact CG2-CB 4.02Å; T320-L372 HydrophobicContact CG2-CD2 3.35Å; T320-L372 HydrophobicContact CG2-CG 4.29Å; T320-L372 WeakPolarHBondContact CG2-O 3.42Å; T320-L372 PolarHBondContact OG1-O 2.83Å; T320-L372 VanDerWaalsContact OG1-O 3.05Å; T320-G375 VanDerWaalsContact OG1-CA 3.3Å; T320-G375 WeakPolarHBondContact OG1-CA 3.48Å; T320-L376 WeakPolarHBondContact O-CA 3.25Å; T320-L376 PolarHBondContact OG1-N 3.29Å |
| 321 | S | 91.9 | Very high | 89 | Confident | 4 Ų | 4 | 35.6 Ų | 35.6 | 3% | 0.028 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.9 | -39.9 | 170.6 | -176.9 | 0 | 0 | 0 | 0 | 111.7 | I317 G324 R325 G375 D378 G379 | I317-S321 WeakPolarHBondContact O-CB 3.46Å; I317-S321 PolarHBondContact O-N 3.22Å; S321-G324 PolarHBondContact O-N 3.11Å; S321-R325 VanDerWaalsContact O-CG 3.3Å; S321-R325 WeakPolarHBondContact O-CG 3.41Å; S321-R325 PolarHBondContact O-N 3.1Å; S321-R325 PolarHBondContact OG-NH2 2.86Å; S321-R325 VanDerWaalsContact OG-NH2 3.13Å; S321-G375 WeakPolarHBondContact CA-O 3.39Å; S321-G375 WeakPolarHBondContact CB-O 3.38Å; S321-G375 PolarHBondContact N-O 3.49Å; S321-D378 WeakPolarHBondContact CB-OD2 3.38Å; S321-D378 PolarHBondContact OG-OD2 3.33Å; S321-G379 WeakPolarHBondContact O-CA 3.22Å; S321-G379 PolarHBondContact OG-N 2.82Å |
| 322 | C | 88.9 | Confident | 88.5 | Confident | 24 Ų | 24 | 34.6 Ų | 34.6 | 16% | 0.162 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.9 | -50.6 | 172 | -164.1 | 0 | 0 | 0 | 0 | 111.4 | G318 I319 T320 G324 R325 F326 | G318-C322 WeakPolarHBondContact O-CB 3.45Å; G318-C322 PolarHBondContact O-N 3.49Å; I319-C322 WeakPolarHBondContact O-CB 3.32Å; I319-C322 PolarHBondContact O-N 3.09Å; T320-C322 VanDerWaalsContact C-N 3.34Å; C322-G324 VanDerWaalsContact C-N 3.33Å; C322-G324 PolarHBondContact O-N 3.39Å; C322-R325 PolarHBondContact O-N 3.23Å; C322-F326 WeakPolarHBondContact O-CD2 2.99Å; C322-F326 PolarHBondContact O-N 3.18Å |
| 323 | L | 91.1 | Very high | 87.9 | Confident | 90 Ų | 90 | 38.6 Ų | 38.6 | 47% | 0.471 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -59.3 | -41.8 | 176.5 | -70.5 | 171.4 | 0 | 0 | 0 | 112.4 | I319 T320 R325 F326 I327 | I319-L323 HydrophobicContact CG2-CD1 4.05Å; I319-L323 WeakPolarHBondContact O-CG 3.46Å; I319-L323 PolarHBondContact O-N 3.49Å; T320-L323 PolarHBondContact O-N 3.5Å; L323-R325 VanDerWaalsContact C-N 3.34Å; L323-R325 PolarHBondContact O-N 3.45Å; L323-F326 PolarHBondContact O-N 2.89Å; L323-I327 VanDerWaalsContact O-CG1 3.3Å; L323-I327 WeakPolarHBondContact O-CG1 3.36Å; L323-I327 PolarHBondContact O-N 3.09Å |
| 324 | G | 89.6 | Confident | 87.3 | Confident | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.2 | -41.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | T320 S321 C322 F326 I327 F328 | T320-G324 PolarHBondContact O-N 2.66Å; S321-G324 PolarHBondContact O-N 3.11Å; C322-G324 VanDerWaalsContact C-N 3.33Å; C322-G324 PolarHBondContact O-N 3.39Å; G324-F326 VanDerWaalsContact C-N 3.32Å; G324-F326 PolarHBondContact O-N 2.59Å; G324-I327 PolarHBondContact O-N 3.25Å; G324-F328 VanDerWaalsContact O-CB 3.3Å; G324-F328 WeakPolarHBondContact O-CB 3.43Å; G324-F328 VanDerWaalsContact O-CD2 3.31Å; G324-F328 WeakPolarHBondContact O-CD2 3.4Å; G324-F328 PolarHBondContact O-N 3.08Å |
| 325 | R | 87.7 | Confident | 86.8 | Confident | 25 Ų | 25 | 48.5 Ų | 48.5 | 9% | 0.094 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.8 | -39.9 | 175.2 | -70 | 169.7 | -170.7 | 154.6 | 10.4 | 112.1 | T200 S203 S321 C322 L323 G329 D378 G379 C383 | T200-R325 PolarHBondContact O-NH1 3.18Å; S203-R325 PolarHBondContact OG-NH1 2.7Å; S321-R325 VanDerWaalsContact O-CG 3.3Å; S321-R325 WeakPolarHBondContact O-CG 3.41Å; S321-R325 PolarHBondContact O-N 3.1Å; S321-R325 PolarHBondContact OG-NH2 2.86Å; S321-R325 VanDerWaalsContact OG-NH2 3.13Å; C322-R325 PolarHBondContact O-N 3.23Å; L323-R325 VanDerWaalsContact C-N 3.34Å; L323-R325 PolarHBondContact O-N 3.45Å; R325-G329 WeakPolarHBondContact O-CA 3.34Å; R325-G329 PolarHBondContact O-N 3.28Å; R325-D378 IonicContact NH2-OD2 2.82Å; R325-G379 VanDerWaalsContact CG-O 3.3Å; R325-G379 WeakPolarHBondContact CG-O 3.35Å; R325-C383 HydrophobicContact CB-CB 4.25Å; R325-C383 HydrophobicContact CG-CB 4.14Å |
| 326 | F | 83.9 | Confident | 86.1 | Confident | 116 Ų | 116 | 55.1 Ų | 55.1 | 51% | 0.509 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -68 | -53.3 | 175.4 | -76 | -70.5 | 0 | 0 | 0 | 111.9 | A201 C322 L323 G324 S330 | A201-F326 HydrophobicContact CB-CE2 4.26Å; A201-F326 HydrophobicContact CB-CZ 4.27Å; C322-F326 WeakPolarHBondContact O-CD2 2.99Å; C322-F326 PolarHBondContact O-N 3.18Å; L323-F326 PolarHBondContact O-N 2.89Å; G324-F326 VanDerWaalsContact C-N 3.32Å; G324-F326 PolarHBondContact O-N 2.59Å; F326-S330 PolarHBondContact O-N 3.4Å; F326-S330 VanDerWaalsContact O-N 3.11Å; F326-S330 PolarHBondContact O-OG 2.96Å |
| 327 | I | 88.4 | Confident | 85 | Confident | 89 Ų | 89 | 55.2 Ų | 55.2 | 46% | 0.456 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.1 | -57.3 | -177.3 | -65.5 | 165 | 0 | 0 | 0 | 110.1 | L323 G324 S330 V331 L376 | L323-I327 VanDerWaalsContact O-CG1 3.3Å; L323-I327 WeakPolarHBondContact O-CG1 3.36Å; L323-I327 PolarHBondContact O-N 3.09Å; G324-I327 PolarHBondContact O-N 3.25Å; I327-S330 PolarHBondContact O-N 2.87Å; I327-V331 VanDerWaalsContact O-CG2 3.28Å; I327-V331 WeakPolarHBondContact O-CG2 3.39Å; I327-V331 PolarHBondContact O-N 3.48Å; I327-L376 HydrophobicContact CD1-CD1 4.24Å |
| 328 | F | 86.4 | Confident | 83.8 | Confident | 27 Ų | 27 | 55.9 Ų | 55.9 | 12% | 0.118 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -77.8 | -23 | -174.5 | -66.5 | -76 | 0 | 0 | 0 | 113.1 | G324 V331 A332 L343 L376 F377 C380 I384 | G324-F328 VanDerWaalsContact O-CB 3.3Å; G324-F328 WeakPolarHBondContact O-CB 3.43Å; G324-F328 VanDerWaalsContact O-CD2 3.31Å; G324-F328 WeakPolarHBondContact O-CD2 3.4Å; G324-F328 PolarHBondContact O-N 3.08Å; F328-V331 PolarHBondContact O-N 3.33Å; F328-A332 VanDerWaalsContact O-CB 3.26Å; F328-A332 WeakPolarHBondContact O-CB 3.2Å; F328-A332 PolarHBondContact O-N 3.32Å; F328-L343 HydrophobicContact CD1-CD2 4.14Å; F328-L343 HydrophobicContact CE1-CD2 4.37Å; F328-L376 HydrophobicContact CE2-CD1 4.13Å; F328-L376 HydrophobicContact CE2-CG 4.05Å; F328-F377 HydrophobicContact CZ-CE1 4.02Å; F328-F377 HydrophobicContact CZ-CZ 4.43Å; F328-C380 HydrophobicContact CB-CB 3.89Å; F328-C380 HydrophobicContact CD1-CB 4.27Å; F328-C380 VanDerWaalsContact CD1-SG 3.6Å; F328-C380 HydrophobicContact CD2-CB 3.43Å; F328-C380 VanDerWaalsContact CD2-CB 3.43Å; F328-C380 HydrophobicContact CE2-CB 3.96Å; F328-C380 HydrophobicContact CG-CB 3.6Å; F328-C380 WeakPolarHBondContact CG-SG 3.28Å; F328-I384 HydrophobicContact CB-CD1 4.4Å |
| 329 | G | 80.5 | Confident | 83.3 | Confident | 23 Ų | 23 | 59.9 Ų | 59.9 | 24% | 0.237 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -61.7 | -47.6 | 168.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | R325 A332 | R325-G329 WeakPolarHBondContact O-CA 3.34Å; R325-G329 PolarHBondContact O-N 3.28Å; G329-A332 PolarHBondContact O-N 2.85Å |
| 330 | S | 79.8 | Confident | 83 | Confident | 70 Ų | 70 | 57.5 Ų | 57.5 | 49% | 0.49 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -66.7 | -40.6 | 174.3 | -61.3 | 0 | 0 | 0 | 0 | 112.6 | F326 I327 A332 D333 F334 | F326-S330 PolarHBondContact O-N 3.4Å; F326-S330 VanDerWaalsContact O-N 3.11Å; F326-S330 PolarHBondContact O-OG 2.96Å; I327-S330 PolarHBondContact O-N 2.87Å; S330-A332 VanDerWaalsContact C-N 3.28Å; S330-A332 PolarHBondContact O-N 3.28Å; S330-D333 PolarHBondContact O-N 3.38Å; S330-F334 WeakPolarHBondContact O-CD2 3.17Å; S330-F334 WeakPolarHBondContact O-CE2 3.49Å |
| 331 | V | 83.5 | Confident | 82.8 | Confident | 53 Ų | 53 | 56.8 Ų | 56.8 | 32% | 0.321 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.5 | -37.3 | 176 | 172.5 | 0 | 0 | 0 | 0 | 111.5 | I327 F328 D333 F334 V335 L343 | I327-V331 VanDerWaalsContact O-CG2 3.28Å; I327-V331 WeakPolarHBondContact O-CG2 3.39Å; I327-V331 PolarHBondContact O-N 3.48Å; F328-V331 PolarHBondContact O-N 3.33Å; V331-D333 PolarHBondContact O-N 2.86Å; V331-F334 PolarHBondContact O-N 3.3Å; V331-V335 HydrophobicContact CG1-CG2 4.08Å; V331-V335 WeakPolarHBondContact O-CG2 3.22Å; V331-V335 PolarHBondContact O-N 3.43Å; V331-V335 VanDerWaalsContact O-N 3.08Å; V331-L343 HydrophobicContact CG1-CD1 4.22Å; V331-L343 HydrophobicContact CG1-CD2 4.35Å |
| 332 | A | 78.4 | Confident | 82.7 | Confident | 3 Ų | 3 | 61.3 Ų | 61.3 | 3% | 0.025 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -62.1 | -26.2 | 179 | 0 | 0 | 0 | 0 | 0 | 113.1 | F328 G329 S330 K340 I384 | F328-A332 VanDerWaalsContact O-CB 3.26Å; F328-A332 WeakPolarHBondContact O-CB 3.2Å; F328-A332 PolarHBondContact O-N 3.32Å; G329-A332 PolarHBondContact O-N 2.85Å; S330-A332 VanDerWaalsContact C-N 3.28Å; S330-A332 PolarHBondContact O-N 3.28Å; A332-K340 WeakPolarHBondContact O-CE 3.31Å; A332-I384 HydrophobicContact CB-CG1 4.16Å |
| 333 | D | 79 | Confident | 82.9 | Confident | 136 Ų | 136 | 61.3 Ų | 61.3 | 73% | 0.727 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -72.3 | -30.7 | 175.2 | -67.3 | -25.8 | 0 | 0 | 0 | 112.2 | S330 V331 | S330-D333 PolarHBondContact O-N 3.38Å; V331-D333 PolarHBondContact O-N 2.86Å |
| 334 | F | 79 | Confident | 82.9 | Confident | 171 Ų | 171 | 57 Ų | 57 | 75% | 0.75 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -81.6 | -29.9 | 176.6 | -62.4 | -73.8 | 0 | 0 | 0 | 112.8 | S330 V331 K336 | S330-F334 WeakPolarHBondContact O-CD2 3.17Å; S330-F334 WeakPolarHBondContact O-CE2 3.49Å; V331-F334 PolarHBondContact O-N 3.3Å; F334-K336 PolarHBondContact O-N 3.28Å |
| 335 | V | 79 | Confident | 83.1 | Confident | 37 Ų | 37 | 58 Ų | 58 | 22% | 0.224 | 30% | 0.299 | C | S | . | . | S | Bend | trans | -79.4 | 114.9 | 178.5 | 178.6 | 0 | 0 | 0 | 0 | 109.8 | V331 N339 K340 L343 | V331-V335 HydrophobicContact CG1-CG2 4.08Å; V331-V335 WeakPolarHBondContact O-CG2 3.22Å; V331-V335 PolarHBondContact O-N 3.43Å; V331-V335 VanDerWaalsContact O-N 3.08Å; V335-N339 HydrophobicContact CG1-CB 3.78Å; V335-K340 HydrophobicContact CB-CG 4.34Å; V335-K340 HydrophobicContact CG1-CG 4.01Å; V335-K340 WeakPolarHBondContact O-CE 3.38Å; V335-L343 HydrophobicContact CB-CD1 4.32Å; V335-L343 HydrophobicContact CG1-CD1 4.5Å; V335-L343 HydrophobicContact CG2-CD1 4Å |
| 336 | K | 75.9 | Confident | 83.5 | Confident | 178 Ų | 178 | 60.6 Ų | 60.6 | 77% | 0.774 | 31% | 0.314 | S | S | * | . | trans | -90.4 | 135.5 | -177.5 | -66.5 | 179.9 | -179.1 | 176.7 | 0 | 112.3 | F334 | F334-K336 PolarHBondContact O-N 3.28Š| ||
| 337 | G | 71.9 | Confident | 84 | Confident | 18 Ų | 18 | 55 Ų | 55 | 19% | 0.186 | 29% | 0.29 | C | S | . | . | G | 310 helix | trans | 68.6 | -160.8 | 170.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | N339 K340 E391 | G337-N339 PolarHBondContact O-N 3.33Å; G337-K340 WeakPolarHBondContact O-CG 3.12Å; G337-K340 PolarHBondContact O-N 3.13Å; G337-E391 WeakPolarHBondContact CA-OE1 3.24Å; G337-E391 WeakPolarHBondContact CA-OE2 3.3Å; G337-E391 PolarHBondContact N-OE1 3.08Å |
| 338 | S | 67.4 | Low | 84.4 | Confident | 15 Ų | 15 | 50.9 Ų | 50.9 | 11% | 0.105 | 27% | 0.269 | C | S | . | . | G | 310 helix | trans | -59.3 | -7.7 | -173.6 | 53.2 | 0 | 0 | 0 | 0 | 115.4 | K340 V341 E391 E455 | S338-K340 PolarHBondContact O-N 3.39Å; S338-V341 VanDerWaalsContact O-CB 3.28Å; S338-V341 WeakPolarHBondContact O-CB 3.31Å; S338-V341 WeakPolarHBondContact O-CG2 3.48Å; S338-V341 PolarHBondContact O-N 3.17Å; S338-E391 PolarHBondContact N-OE2 2.97Å; S338-E455 VanDerWaalsContact CB-CD 3.5Å; S338-E455 WeakPolarHBondContact CB-OE1 3.38Å; S338-E455 WeakPolarHBondContact CB-OE2 3.5Å |
| 339 | N | 79.8 | Confident | 84.8 | Confident | 86 Ų | 86 | 54.9 Ų | 54.9 | 46% | 0.46 | 29% | 0.286 | S | S | . | . | G | 310 helix | trans | -60.5 | -19.6 | 169 | -67.4 | -24 | 0 | 0 | 0 | 113 | V335 G337 V341 F342 | V335-N339 HydrophobicContact CG1-CB 3.78Å; G337-N339 PolarHBondContact O-N 3.33Å; N339-V341 PolarHBondContact O-N 3.45Å; N339-F342 HydrophobicContact CB-CD2 4.31Å; N339-F342 WeakPolarHBondContact O-CB 3.48Å; N339-F342 PolarHBondContact O-N 2.86Å |
| 340 | K | 86.2 | Confident | 85.6 | Confident | 27 Ų | 27 | 54.9 Ų | 54.9 | 12% | 0.117 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -56.5 | -29.8 | 169.4 | -69.5 | 174.2 | -176.4 | 168.4 | 0 | 112.6 | A332 V335 G337 S338 F342 L343 Q344 I384 P387 I388 E391 | A332-K340 WeakPolarHBondContact O-CE 3.31Å; V335-K340 HydrophobicContact CB-CG 4.34Å; V335-K340 HydrophobicContact CG1-CG 4.01Å; V335-K340 WeakPolarHBondContact O-CE 3.38Å; G337-K340 WeakPolarHBondContact O-CG 3.12Å; G337-K340 PolarHBondContact O-N 3.13Å; S338-K340 PolarHBondContact O-N 3.39Å; K340-F342 PolarHBondContact O-N 3.49Å; K340-L343 WeakPolarHBondContact O-CB 3.35Å; K340-L343 PolarHBondContact O-N 3.42Å; K340-Q344 PolarHBondContact O-N 3.11Å; K340-I384 HydrophobicContact CB-CG2 4.28Å; K340-P387 HydrophobicContact CD-CB 4.19Å; K340-I388 HydrophobicContact CB-CD1 4.45Å; K340-I388 HydrophobicContact CB-CG1 3.91Å; K340-E391 VanDerWaalsContact CE-OE1 3.22Å; K340-E391 WeakPolarHBondContact CE-OE1 3.42Å; K340-E391 IonicContact NZ-OE1 2.82Å; K340-E391 PolarHBondContact NZ-OE1 2.95Å |
| 341 | V | 89.5 | Confident | 86.4 | Confident | 1 Ų | 1 | 51.7 Ų | 51.7 | 1% | 0.006 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.9 | -32.9 | 175.7 | -178.9 | 0 | 0 | 0 | 0 | 111.1 | S338 N339 L343 Q344 V345 I388 L448 I451 P452 | S338-V341 VanDerWaalsContact O-CB 3.28Å; S338-V341 WeakPolarHBondContact O-CB 3.31Å; S338-V341 WeakPolarHBondContact O-CG2 3.48Å; S338-V341 PolarHBondContact O-N 3.17Å; N339-V341 PolarHBondContact O-N 3.45Å; V341-L343 VanDerWaalsContact C-N 3.3Å; V341-L343 PolarHBondContact O-N 3.3Å; V341-Q344 CarbonylContact O-C 3.55Å; V341-Q344 WeakPolarHBondContact O-CA 3.48Å; V341-Q344 WeakPolarHBondContact O-CB 3.46Å; V341-Q344 PolarHBondContact O-N 2.87Å; V341-V345 HydrophobicContact CG1-CG2 4.26Å; V341-V345 WeakPolarHBondContact O-CG2 3.43Å; V341-V345 PolarHBondContact O-N 3.28Å; V341-I388 HydrophobicContact CG2-CD1 4.08Å; V341-I388 HydrophobicContact CG2-CG1 4.38Å; V341-I388 HydrophobicContact CG2-CG2 4.21Å; V341-L448 HydrophobicContact CG1-CB 4.06Å; V341-L448 WeakPolarHBondContact CG1-O 3.48Å; V341-I451 HydrophobicContact CG1-CB 4.34Å; V341-I451 HydrophobicContact CG1-CD1 4.18Å; V341-I451 HydrophobicContact CG2-CB 4.34Å; V341-I451 HydrophobicContact CG2-CG2 3.98Å; V341-P452 HydrophobicContact CB-CG 4.1Å; V341-P452 HydrophobicContact CG1-CG 4.47Å |
| 342 | F | 91.3 | Very high | 87 | Confident | 98 Ų | 98 | 49.1 Ų | 49.1 | 43% | 0.43 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -65.1 | -33.2 | 177.1 | -70.3 | -65.9 | 0 | 0 | 0 | 113.1 | N339 K340 Q344 V345 L346 P452 | N339-F342 HydrophobicContact CB-CD2 4.31Å; N339-F342 WeakPolarHBondContact O-CB 3.48Å; N339-F342 PolarHBondContact O-N 2.86Å; K340-F342 PolarHBondContact O-N 3.49Å; F342-Q344 VanDerWaalsContact C-N 3.3Å; F342-V345 PolarHBondContact O-N 3.43Å; F342-L346 WeakPolarHBondContact O-CB 3.4Å; F342-L346 PolarHBondContact O-N 3.49Å; F342-P452 HydrophobicContact CD2-CG 4.35Å; F342-P452 HydrophobicContact CE1-CG 4.49Å; F342-P452 HydrophobicContact CE2-CB 3.97Å; F342-P452 HydrophobicContact CE2-CG 3.81Å; F342-P452 HydrophobicContact CZ-CB 4.1Å; F342-P452 HydrophobicContact CZ-CG 3.9Å |
| 343 | L | 91.5 | Very high | 87.9 | Confident | 24 Ų | 24 | 51.1 Ų | 51.1 | 13% | 0.126 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64 | -40.2 | 172.1 | -71.2 | 162.9 | 0 | 0 | 0 | 110.6 | F328 V331 V335 K340 V341 L346 S347 I384 | F328-L343 HydrophobicContact CD1-CD2 4.14Å; F328-L343 HydrophobicContact CE1-CD2 4.37Å; V331-L343 HydrophobicContact CG1-CD1 4.22Å; V331-L343 HydrophobicContact CG1-CD2 4.35Å; V335-L343 HydrophobicContact CB-CD1 4.32Å; V335-L343 HydrophobicContact CG1-CD1 4.5Å; V335-L343 HydrophobicContact CG2-CD1 4Å; K340-L343 WeakPolarHBondContact O-CB 3.35Å; K340-L343 PolarHBondContact O-N 3.42Å; V341-L343 VanDerWaalsContact C-N 3.3Å; V341-L343 PolarHBondContact O-N 3.3Å; L343-L346 PolarHBondContact O-N 3.15Å; L343-S347 PolarHBondContact O-N 3.3Å; L343-S347 PolarHBondContact O-OG 3.15Å; L343-I384 HydrophobicContact CB-CD1 3.33Å; L343-I384 HydrophobicContact CD1-CD1 3.61Å; L343-I384 HydrophobicContact CG-CD1 4.03Å |
| 344 | Q | 92.4 | Very high | 88.7 | Confident | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66.8 | -39.6 | 175.7 | -165.9 | 174.4 | 24.6 | 0 | 0 | 112.4 | I282 K340 V341 F342 S347 F348 F381 I388 | I282-Q344 VanDerWaalsContact CD1-NE2 3.33Å; K340-Q344 PolarHBondContact O-N 3.11Å; V341-Q344 CarbonylContact O-C 3.55Å; V341-Q344 WeakPolarHBondContact O-CA 3.48Å; V341-Q344 WeakPolarHBondContact O-CB 3.46Å; V341-Q344 PolarHBondContact O-N 2.87Å; F342-Q344 VanDerWaalsContact C-N 3.3Å; Q344-S347 WeakPolarHBondContact O-CB 3.43Å; Q344-S347 PolarHBondContact O-N 2.86Å; Q344-F348 HydrophobicContact CG-CD2 4.19Å; Q344-F348 HydrophobicContact CG-CE2 3.84Å; Q344-F348 WeakPolarHBondContact O-CD2 3.35Å; Q344-F348 PolarHBondContact O-N 3.37Å; Q344-F381 HydrophobicContact CG-CD2 4.07Å; Q344-I388 HydrophobicContact CB-CD1 3.98Å |
| 345 | V | 94.3 | Very high | 89.5 | Confident | 22 Ų | 22 | 37.5 Ų | 37.5 | 13% | 0.133 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.4 | -45.9 | 174 | 172.5 | 0 | 0 | 0 | 0 | 111 | V341 F342 S347 F348 F349 G445 L448 | V341-V345 HydrophobicContact CG1-CG2 4.26Å; V341-V345 WeakPolarHBondContact O-CG2 3.43Å; V341-V345 PolarHBondContact O-N 3.28Å; F342-V345 PolarHBondContact O-N 3.43Å; V345-S347 VanDerWaalsContact C-N 3.27Å; V345-S347 PolarHBondContact O-N 3.45Å; V345-F348 PolarHBondContact O-N 3.41Å; V345-F349 WeakPolarHBondContact O-CB 3.35Å; V345-F349 PolarHBondContact O-N 2.81Å; V345-G445 VanDerWaalsContact CG2-O 3.3Å; V345-G445 WeakPolarHBondContact CG2-O 3.5Å; V345-L448 HydrophobicContact CG2-CB 3.85Å |
| 346 | L | 94.6 | Very high | 90.3 | Very high | 78 Ų | 78 | 38.1 Ų | 38.1 | 41% | 0.408 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -57.3 | -44.1 | 176 | 178.4 | 63.2 | 0 | 0 | 0 | 110.7 | F342 L343 F349 V350 F377 | F342-L346 WeakPolarHBondContact O-CB 3.4Å; F342-L346 PolarHBondContact O-N 3.49Å; L343-L346 PolarHBondContact O-N 3.15Å; L346-F349 PolarHBondContact O-N 3.04Å; L346-V350 HydrophobicContact CD1-CG2 4.23Å; L346-V350 WeakPolarHBondContact O-CG2 3.29Å; L346-V350 PolarHBondContact O-N 3.48Å; L346-F377 HydrophobicContact CD2-CE1 3.85Å; L346-F377 HydrophobicContact CD2-CZ 4.48Å; L346-F377 HydrophobicContact CG-CD1 4.45Å; L346-F377 HydrophobicContact CG-CE1 3.76Å; L346-F377 HydrophobicContact CG-CZ 4.5Å |
| 347 | S | 95.1 | Very high | 91.3 | Very high | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -59.5 | -48.4 | 176.1 | -60.3 | 0 | 0 | 0 | 0 | 112.7 | L343 Q344 V345 F349 V350 I351 F377 C380 | L343-S347 PolarHBondContact O-N 3.3Å; L343-S347 PolarHBondContact O-OG 3.15Å; Q344-S347 WeakPolarHBondContact O-CB 3.43Å; Q344-S347 PolarHBondContact O-N 2.86Å; V345-S347 VanDerWaalsContact C-N 3.27Å; V345-S347 PolarHBondContact O-N 3.45Å; S347-F349 VanDerWaalsContact C-N 3.34Å; S347-F349 PolarHBondContact O-N 2.86Å; S347-V350 PolarHBondContact O-N 3.1Å; S347-I351 WeakPolarHBondContact O-CB 3.12Å; S347-I351 WeakPolarHBondContact O-CD1 3.32Å; S347-I351 WeakPolarHBondContact O-CG1 3.43Å; S347-I351 PolarHBondContact O-N 3.49Å; S347-F377 WeakPolarHBondContact CB-O 3.33Å; S347-F377 PolarHBondContact OG-O 3.24Å; S347-C380 WeakPolarHBondContact OG-CB 3.35Å; S347-C380 PolarHBondContact OG-SG 3.13Å |
| 348 | F | 95.9 | Very high | 92.4 | Very high | 1 Ų | 1 | 32.6 Ų | 32.6 | 0% | 0.004 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -65.2 | -37.4 | 178.7 | -76 | -49.9 | 0 | 0 | 0 | 113.1 | I282 A285 L286 Q344 V345 G352 F381 P441 L448 | I282-F348 HydrophobicContact CG1-CE2 4.36Å; I282-F348 HydrophobicContact CG1-CZ 4.43Å; A285-F348 HydrophobicContact CB-CD1 4.08Å; A285-F348 HydrophobicContact CB-CD2 4.25Å; A285-F348 HydrophobicContact CB-CE1 3.9Å; A285-F348 HydrophobicContact CB-CE2 4.05Å; A285-F348 HydrophobicContact CB-CG 4.26Å; A285-F348 HydrophobicContact CB-CZ 3.87Å; L286-F348 HydrophobicContact CD2-CE1 3.92Å; L286-F348 HydrophobicContact CD2-CZ 4.44Å; Q344-F348 HydrophobicContact CG-CD2 4.19Å; Q344-F348 HydrophobicContact CG-CE2 3.84Å; Q344-F348 WeakPolarHBondContact O-CD2 3.35Å; Q344-F348 PolarHBondContact O-N 3.37Å; V345-F348 PolarHBondContact O-N 3.41Å; F348-G352 PolarHBondContact O-N 2.9Å; F348-F381 AromaticContact CE1-CD2 3.94Å; F348-F381 HydrophobicContact CE1-CD2 3.94Å; F348-F381 AromaticContact CE1-CE2 3.91Å; F348-F381 HydrophobicContact CE1-CE2 3.91Å; F348-F381 HydrophobicContact CE1-CG 4.39Å; F348-F381 HydrophobicContact CE1-CZ 4.31Å; F348-F381 HydrophobicContact CE2-CD2 4.17Å; F348-F381 HydrophobicContact CE2-CE2 4.15Å; F348-F381 AromaticContact CZ-CD2 3.58Å; F348-F381 HydrophobicContact CZ-CD2 3.58Å; F348-F381 AromaticContact CZ-CE2 3.34Å; F348-F381 HydrophobicContact CZ-CE2 3.34Å; F348-F381 HydrophobicContact CZ-CG 4.45Å; F348-F381 HydrophobicContact CZ-CZ 4.04Å; F348-P441 HydrophobicContact CB-CB 4.27Å; F348-P441 WeakPolarHBondContact CB-O 3.48Å; F348-P441 HydrophobicContact CD1-CB 4.32Å; F348-P441 VanDerWaalsContact O-CB 3.26Å; F348-P441 WeakPolarHBondContact O-CB 3.5Å; F348-L448 HydrophobicContact CD2-CD1 3.81Å; F348-L448 HydrophobicContact CE2-CD1 3.56Å |
| 349 | F | 96.3 | Very high | 93.7 | Very high | 112 Ų | 112 | 32 Ų | 32 | 49% | 0.491 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -61.1 | -49.6 | 174.5 | -177.4 | -99.2 | 0 | 0 | 0 | 111 | V345 L346 S347 G352 V353 I442 | V345-F349 WeakPolarHBondContact O-CB 3.35Å; V345-F349 PolarHBondContact O-N 2.81Å; L346-F349 PolarHBondContact O-N 3.04Å; S347-F349 VanDerWaalsContact C-N 3.34Å; S347-F349 PolarHBondContact O-N 2.86Å; F349-G352 PolarHBondContact O-N 3.34Å; F349-V353 HydrophobicContact CD1-CG2 4.36Å; F349-V353 HydrophobicContact CE1-CG2 3.99Å; F349-V353 HydrophobicContact CE2-CG2 4.22Å; F349-V353 HydrophobicContact CZ-CG2 3.92Å; F349-V353 WeakPolarHBondContact O-CG2 3.29Å; F349-V353 PolarHBondContact O-N 3.24Å; F349-I442 HydrophobicContact CD2-CG1 4.4Å; F349-I442 HydrophobicContact CD2-CG2 4.33Å |
| 350 | V | 96.6 | Very high | 94.4 | Very high | 22 Ų | 22 | 33 Ų | 33 | 13% | 0.133 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -65.4 | -45.7 | 179.4 | 178.2 | 0 | 0 | 0 | 0 | 111.2 | L346 S347 G352 V353 M354 F377 | L346-V350 HydrophobicContact CD1-CG2 4.23Å; L346-V350 WeakPolarHBondContact O-CG2 3.29Å; L346-V350 PolarHBondContact O-N 3.48Å; S347-V350 PolarHBondContact O-N 3.1Å; V350-G352 VanDerWaalsContact C-N 3.28Å; V350-G352 PolarHBondContact O-N 2.84Å; V350-V353 PolarHBondContact O-N 3.49Å; V350-M354 HydrophobicContact CG1-CG 3.84Å; V350-M354 VanDerWaalsContact O-CB 3.27Å; V350-M354 WeakPolarHBondContact O-CB 3.4Å; V350-M354 WeakPolarHBondContact O-CG 3.17Å; V350-M354 PolarHBondContact O-N 3.44Å; V350-F377 HydrophobicContact CB-CB 4.25Å; V350-F377 HydrophobicContact CB-CD1 4.3Å; V350-F377 HydrophobicContact CB-CD2 3.75Å; V350-F377 HydrophobicContact CB-CE2 4.14Å; V350-F377 HydrophobicContact CB-CG 3.82Å; V350-F377 HydrophobicContact CG1-CB 4.32Å; V350-F377 HydrophobicContact CG1-CD2 3.35Å; V350-F377 HydrophobicContact CG1-CE2 3.77Å; V350-F377 HydrophobicContact CG1-CG 3.9Å; V350-F377 HydrophobicContact CG2-CD1 4.29Å; V350-F377 HydrophobicContact CG2-CD2 4.03Å; V350-F377 HydrophobicContact CG2-CE1 4.17Å; V350-F377 HydrophobicContact CG2-CE2 3.9Å; V350-F377 HydrophobicContact CG2-CG 4.21Å; V350-F377 HydrophobicContact CG2-CZ 3.97Å |
| 351 | I | 96.3 | Very high | 94.7 | Very high | 3 Ų | 3 | 32.3 Ų | 32.3 | 2% | 0.015 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -58.4 | -42.1 | 176.9 | -68.8 | 166.5 | 0 | 0 | 0 | 110.8 | Y289 S347 S355 F377 | Y289-I351 HydrophobicContact CD2-CG2 4.41Å; Y289-I351 HydrophobicContact CE2-CD1 4.49Å; S347-I351 WeakPolarHBondContact O-CB 3.12Å; S347-I351 WeakPolarHBondContact O-CD1 3.32Å; S347-I351 WeakPolarHBondContact O-CG1 3.43Å; S347-I351 PolarHBondContact O-N 3.49Å; I351-S355 WeakPolarHBondContact O-CB 3.41Å; I351-S355 PolarHBondContact O-N 3.14Å; I351-S355 PolarHBondContact O-OG 2.91Å; I351-F377 HydrophobicContact CG1-CB 4.24Å |
| 352 | G | 96.6 | Very high | 94.7 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -63.9 | -49.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | F348 F349 V350 S355 M356 G438 | F348-G352 PolarHBondContact O-N 2.9Å; F349-G352 PolarHBondContact O-N 3.34Å; V350-G352 VanDerWaalsContact C-N 3.28Å; V350-G352 PolarHBondContact O-N 2.84Å; G352-S355 PolarHBondContact O-N 3.34Å; G352-M356 WeakPolarHBondContact O-CG 3.47Å; G352-M356 PolarHBondContact O-N 3.34Å; G352-M356 VanDerWaalsContact O-N 3.16Å; G352-G438 WeakPolarHBondContact CA-O 3.29Å; G352-G438 VanDerWaalsContact O-CA 3.29Å; G352-G438 WeakPolarHBondContact O-CA 3.36Å |
| 353 | V | 96.9 | Very high | 94.7 | Very high | 45 Ų | 45 | 39.1 Ų | 39.1 | 27% | 0.273 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -62.7 | -46.4 | 177.4 | 175.8 | 0 | 0 | 0 | 0 | 110.9 | F349 V350 S355 M356 M357 I442 | F349-V353 HydrophobicContact CD1-CG2 4.36Å; F349-V353 HydrophobicContact CE1-CG2 3.99Å; F349-V353 HydrophobicContact CE2-CG2 4.22Å; F349-V353 HydrophobicContact CZ-CG2 3.92Å; F349-V353 WeakPolarHBondContact O-CG2 3.29Å; F349-V353 PolarHBondContact O-N 3.24Å; V350-V353 PolarHBondContact O-N 3.49Å; V353-S355 VanDerWaalsContact C-N 3.29Å; V353-S355 PolarHBondContact O-N 3Å; V353-M356 PolarHBondContact O-N 3.39Å; V353-M356 VanDerWaalsContact O-N 3.11Å; V353-M357 HydrophobicContact CG1-CG 4.38Å; V353-M357 HydrophobicContact CG1-SD 4.17Å; V353-M357 WeakPolarHBondContact O-CG 3.47Å; V353-M357 PolarHBondContact O-N 2.9Å; V353-I442 HydrophobicContact CG2-CD1 4.25Å |
| 354 | M | 96.5 | Very high | 94.7 | Very high | 20 Ų | 20 | 40.2 Ų | 40.2 | 10% | 0.099 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -60.2 | -39.4 | 178.1 | -70.9 | -52.8 | 105.7 | 0 | 0 | 111.6 | V350 M356 M357 I358 V370 L373 M374 | V350-M354 HydrophobicContact CG1-CG 3.84Å; V350-M354 VanDerWaalsContact O-CB 3.27Å; V350-M354 WeakPolarHBondContact O-CB 3.4Å; V350-M354 WeakPolarHBondContact O-CG 3.17Å; V350-M354 PolarHBondContact O-N 3.44Å; M354-M356 VanDerWaalsContact C-N 3.33Å; M354-M356 PolarHBondContact O-N 3.48Å; M354-M357 HydrophobicContact CE-SD 3.53Å; M354-M357 VanDerWaalsContact CE-SD 3.53Å; M354-M357 PolarHBondContact O-N 2.91Å; M354-M357 VanDerWaalsContact O-N 3.08Å; M354-M357 HydrophobicContact SD-SD 4.27Å; M354-I358 PolarHBondContact O-N 2.95Å; M354-V370 HydrophobicContact CB-CG1 3.99Å; M354-V370 VanDerWaalsContact O-CG1 3.26Å; M354-V370 WeakPolarHBondContact O-CG1 3.27Å; M354-V370 HydrophobicContact SD-CG1 4.35Å; M354-V370 HydrophobicContact SD-CG2 4.43Å; M354-L373 HydrophobicContact CE-CD1 4.3Å; M354-L373 HydrophobicContact CG-CB 4.02Å; M354-L373 HydrophobicContact SD-CB 3.82Å; M354-L373 HydrophobicContact SD-CD1 3.76Å; M354-L373 HydrophobicContact SD-CG 4.45Å; M354-M374 HydrophobicContact CB-CB 4.18Å |
| 355 | S | 95.4 | Very high | 94.7 | Very high | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -60.8 | -41.4 | 175.2 | -61.2 | 0 | 0 | 0 | 0 | 112.1 | I351 G352 V353 M357 I358 | I351-S355 WeakPolarHBondContact O-CB 3.41Å; I351-S355 PolarHBondContact O-N 3.14Å; I351-S355 PolarHBondContact O-OG 2.91Å; G352-S355 PolarHBondContact O-N 3.34Å; V353-S355 VanDerWaalsContact C-N 3.29Å; V353-S355 PolarHBondContact O-N 3Å; S355-M357 VanDerWaalsContact C-N 3.29Å; S355-M357 PolarHBondContact O-N 3.2Å; S355-I358 PolarHBondContact O-N 2.99Å |
| 356 | M | 96.4 | Very high | 94.7 | Very high | 51 Ų | 51 | 42.4 Ų | 42.4 | 25% | 0.251 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -70.4 | -23.5 | 174.8 | -61.4 | -175.8 | -176 | 0 | 0 | 113.3 | G352 V353 M354 P359 Y435 I439 I442 | G352-M356 WeakPolarHBondContact O-CG 3.47Å; G352-M356 PolarHBondContact O-N 3.34Å; G352-M356 VanDerWaalsContact O-N 3.16Å; V353-M356 PolarHBondContact O-N 3.39Å; V353-M356 VanDerWaalsContact O-N 3.11Å; M354-M356 VanDerWaalsContact C-N 3.33Å; M354-M356 PolarHBondContact O-N 3.48Å; M356-P359 WeakPolarHBondContact O-CD 3.35Å; M356-Y435 HydrophobicContact CB-CD1 4.14Å; M356-Y435 VanDerWaalsContact O-CE1 3.23Å; M356-Y435 WeakPolarHBondContact O-CE1 3.26Å; M356-I439 HydrophobicContact CE-CB 4.18Å; M356-I439 HydrophobicContact CE-CG1 3.42Å; M356-I439 VanDerWaalsContact CE-CG1 3.42Å; M356-I439 VanDerWaalsContact CE-N 3.34Å; M356-I442 HydrophobicContact CE-CD1 3.85Å; M356-I442 HydrophobicContact SD-CD1 4.47Å |
| 357 | M | 96 | Very high | 94.7 | Very high | 79 Ų | 79 | 38.8 Ų | 38.8 | 39% | 0.389 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -79.6 | -20 | 177.9 | -71 | -172.9 | 76.3 | 0 | 0 | 113.7 | V353 M354 S355 L360 C361 V370 | V353-M357 HydrophobicContact CG1-CG 4.38Å; V353-M357 HydrophobicContact CG1-SD 4.17Å; V353-M357 WeakPolarHBondContact O-CG 3.47Å; V353-M357 PolarHBondContact O-N 2.9Å; M354-M357 HydrophobicContact CE-SD 3.53Å; M354-M357 VanDerWaalsContact CE-SD 3.53Å; M354-M357 PolarHBondContact O-N 2.91Å; M354-M357 VanDerWaalsContact O-N 3.08Å; M354-M357 HydrophobicContact SD-SD 4.27Å; S355-M357 VanDerWaalsContact C-N 3.29Å; S355-M357 PolarHBondContact O-N 3.2Å; M357-L360 PolarHBondContact O-N 3.4Å; M357-L360 VanDerWaalsContact O-N 3.1Å; M357-C361 PolarHBondContact O-N 3.36Å; M357-C361 PolarHBondContact O-SG 3.34Å; M357-V370 HydrophobicContact CB-CG2 4.01Å |
| 358 | I | 95.8 | Very high | 94.7 | Very high | 1 Ų | 1 | 40.7 Ų | 40.7 | 1% | 0.005 | 23% | 0.225 | C | C | . | . | G | 310 helix | trans | -48.3 | -57.5 | 177.2 | -68.5 | 169.9 | 0 | 0 | 0 | 112 | P292 L296 M354 S355 L360 C361 L367 V370 F434 | P292-I358 HydrophobicContact CB-CD1 4.21Å; P292-I358 HydrophobicContact CG-CD1 4.13Å; L296-I358 HydrophobicContact CD1-CD1 4.45Å; L296-I358 HydrophobicContact CD1-CG2 3.97Å; M354-I358 PolarHBondContact O-N 2.95Å; S355-I358 PolarHBondContact O-N 2.99Å; I358-L360 PolarHBondContact O-N 3.44Å; I358-C361 WeakPolarHBondContact O-CB 3.44Å; I358-C361 PolarHBondContact O-N 2.75Å; I358-L367 HydrophobicContact CB-CD1 4.26Å; I358-L367 HydrophobicContact CG1-CD1 4.16Å; I358-L367 HydrophobicContact CG2-CD1 3.94Å; I358-V370 HydrophobicContact CG1-CG1 3.88Å; I358-F434 HydrophobicContact CB-CD1 4.41Å; I358-F434 HydrophobicContact CB-CG 4.25Å; I358-F434 HydrophobicContact CD1-CD1 3.75Å; I358-F434 HydrophobicContact CD1-CE1 3.86Å; I358-F434 HydrophobicContact CD1-CG 4.44Å; I358-F434 HydrophobicContact CG2-CD1 4.26Å; I358-F434 HydrophobicContact CG2-CD2 3.86Å; I358-F434 HydrophobicContact CG2-CE1 4.37Å; I358-F434 HydrophobicContact CG2-CE2 3.97Å; I358-F434 HydrophobicContact CG2-CG 4.03Å; I358-F434 HydrophobicContact CG2-CZ 4.24Å |
| 359 | P | 94.9 | Very high | 94.8 | Very high | 3 Ų | 3 | 43 Ų | 43 | 2% | 0.019 | 24% | 0.244 | C | C | . | . | G | 310 helix | trans | -70.6 | -14.2 | -177.6 | 28.5 | -38.1 | 0 | 0 | 0 | 114.6 | R303 M356 C361 D431 F434 Y435 | R303-P359 PolarHBondContact NH1-O 3.26Å; R303-P359 VanDerWaalsContact NH1-O 3.11Å; R303-P359 PolarHBondContact NH2-O 3.39Å; M356-P359 WeakPolarHBondContact O-CD 3.35Å; P359-C361 VanDerWaalsContact C-N 3.32Å; P359-D431 HydrophobicContact CB-CB 3.74Å; P359-F434 HydrophobicContact CG-CB 4.12Å; P359-Y435 HydrophobicContact CB-CE2 4.34Å; P359-Y435 HydrophobicContact CG-CD1 3.97Å; P359-Y435 HydrophobicContact CG-CD2 4.34Å; P359-Y435 HydrophobicContact CG-CE1 3.49Å; P359-Y435 VanDerWaalsContact CG-CE1 3.49Å; P359-Y435 HydrophobicContact CG-CE2 3.9Å; P359-Y435 HydrophobicContact CG-CG 4.35Å; P359-Y435 VanDerWaalsContact CG-CZ 3.44Å |
| 360 | L | 94.1 | Very high | 94.8 | Very high | 105 Ų | 105 | 38 Ų | 38 | 55% | 0.55 | 22% | 0.223 | S | C | . | . | G | 310 helix | trans | -83.2 | -12.5 | 176.4 | -63.8 | 173 | 0 | 0 | 0 | 112.4 | M357 I358 N362 Y435 | M357-L360 PolarHBondContact O-N 3.4Å; M357-L360 VanDerWaalsContact O-N 3.1Å; I358-L360 PolarHBondContact O-N 3.44Å; L360-N362 PolarHBondContact O-N 3.36Å; L360-Y435 WeakPolarHBondContact CD2-OH 3.17Å; L360-Y435 HydrophobicContact CG-CE1 4.25Å |
| 361 | C | 93.3 | Very high | 94.7 | Very high | 14 Ų | 14 | 37 Ų | 37 | 10% | 0.095 | 22% | 0.216 | C | C | . | . | trans | -77.7 | 106.9 | -179.5 | -67.1 | 0 | 0 | 0 | 0 | 111 | R303 F304 M357 I358 P359 L367 | R303-C361 PolarHBondContact NE-O 3.4Å; F304-C361 WeakPolarHBondContact CZ-O 3.45Å; M357-C361 PolarHBondContact O-N 3.36Å; M357-C361 PolarHBondContact O-SG 3.34Å; I358-C361 WeakPolarHBondContact O-CB 3.44Å; I358-C361 PolarHBondContact O-N 2.75Å; P359-C361 VanDerWaalsContact C-N 3.32Å; C361-L367 HydrophobicContact CB-CB 4.11Å; C361-L367 HydrophobicContact CB-CD1 4.41Å | ||
| 362 | N | 88.1 | Confident | 94.8 | Very high | 121 Ų | 121 | 40 Ų | 40 | 65% | 0.647 | 23% | 0.232 | S | C | * | . | trans | -91 | -8.5 | 175.4 | -65.6 | -41 | 0 | 0 | 0 | 113.9 | R303 F304 L360 | R303-N362 PolarHBondContact NH2-OD1 2.89Å; F304-N362 WeakPolarHBondContact CE1-O 3.21Å; L360-N362 PolarHBondContact O-N 3.36Å | ||
| 363 | I | 92.4 | Very high | 94.8 | Very high | 120 Ų | 120 | 43.7 Ų | 43.7 | 62% | 0.615 | 25% | 0.252 | S | S | * | . | S | Bend | trans | -121.5 | 139.7 | 176.4 | 53.7 | 163.7 | 0 | 0 | 0 | 109.5 | G365 G366 L367 | I363-G365 VanDerWaalsContact C-N 3.26Å; I363-G365 PolarHBondContact O-N 3.06Å; I363-G366 PolarHBondContact O-N 3Å; I363-L367 PolarHBondContact O-N 2.99Å |
| 364 | F | 91.8 | Very high | 94.7 | Very high | 47 Ų | 47 | 41.9 Ų | 41.9 | 21% | 0.206 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -59.8 | -38 | -178 | -173.9 | -114.3 | 0 | 0 | 0 | 112.2 | V300 F304 V308 N309 L313 G366 L367 I368 | V300-F364 HydrophobicContact CG1-CE2 4.09Å; F304-F364 HydrophobicContact CD1-CB 4.45Å; F304-F364 HydrophobicContact CD2-CD2 4.49Å; F304-F364 HydrophobicContact CE1-CB 4.41Å; V308-F364 HydrophobicContact CG1-CD1 4.04Å; V308-F364 HydrophobicContact CG1-CD2 3.51Å; V308-F364 HydrophobicContact CG1-CE1 3.88Å; V308-F364 HydrophobicContact CG1-CE2 3.34Å; V308-F364 HydrophobicContact CG1-CG 3.86Å; V308-F364 HydrophobicContact CG1-CZ 3.54Å; N309-F364 WeakPolarHBondContact O-CZ 3.48Å; L313-F364 HydrophobicContact CD1-CE2 4.06Å; L313-F364 HydrophobicContact CD2-CE2 4.04Å; L313-F364 HydrophobicContact CD2-CZ 4.12Å; L313-F364 HydrophobicContact CG-CE2 4.08Å; L313-F364 HydrophobicContact CG-CZ 4.2Å; F364-G366 VanDerWaalsContact C-N 3.29Å; F364-G366 PolarHBondContact O-N 3.27Å; F364-L367 WeakPolarHBondContact O-CB 3.4Å; F364-L367 PolarHBondContact O-N 3.27Å; F364-L367 VanDerWaalsContact O-N 3.11Å; F364-I368 HydrophobicContact CD1-CD1 3.94Å; F364-I368 HydrophobicContact CD1-CG1 4.4Å; F364-I368 HydrophobicContact CE1-CD1 3.77Å; F364-I368 HydrophobicContact CE1-CG1 4.17Å; F364-I368 HydrophobicContact CZ-CG1 4.5Å; F364-I368 PolarHBondContact O-N 3.38Å; F364-I368 VanDerWaalsContact O-N 3.08Å |
| 365 | G | 92.5 | Very high | 94.6 | Very high | 48 Ų | 48 | 40.9 Ų | 40.9 | 50% | 0.495 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.4 | -33.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | I363 L367 I368 A369 | I363-G365 VanDerWaalsContact C-N 3.26Å; I363-G365 PolarHBondContact O-N 3.06Å; G365-L367 VanDerWaalsContact C-N 3.34Å; G365-I368 WeakPolarHBondContact O-CB 3.34Å; G365-I368 PolarHBondContact O-N 2.61Å; G365-A369 PolarHBondContact O-N 3.17Å |
| 366 | G | 94 | Very high | 94.6 | Very high | 21 Ų | 21 | 42.9 Ų | 42.9 | 22% | 0.216 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -66 | -39.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | I363 F364 I368 A369 V370 | I363-G366 PolarHBondContact O-N 3Å; F364-G366 VanDerWaalsContact C-N 3.29Å; F364-G366 PolarHBondContact O-N 3.27Å; G366-I368 VanDerWaalsContact C-N 3.34Å; G366-I368 PolarHBondContact O-N 3.39Å; G366-A369 WeakPolarHBondContact O-CB 3.42Å; G366-A369 PolarHBondContact O-N 3.31Å; G366-V370 PolarHBondContact O-N 2.8Å; G366-V370 VanDerWaalsContact O-N 3.08Å |
| 367 | L | 94.6 | Very high | 94.6 | Very high | 1 Ų | 1 | 41.8 Ų | 41.8 | 1% | 0.005 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -68.1 | -34.7 | 177.3 | -170.6 | 61.6 | 0 | 0 | 0 | 112.4 | L296 V300 F304 L313 I358 C361 I363 F364 G365 A369 V370 C371 | L296-L367 HydrophobicContact CD1-CD1 4.2Å; L296-L367 HydrophobicContact CD1-CD2 4.21Å; V300-L367 HydrophobicContact CG2-CD2 3.46Å; V300-L367 VanDerWaalsContact CG2-CD2 3.46Å; F304-L367 HydrophobicContact CE2-CD2 4.15Å; L313-L367 HydrophobicContact CD1-CD2 3.63Å; L313-L367 HydrophobicContact CD1-CG 4.11Å; L313-L367 HydrophobicContact CD2-CD2 4.43Å; L313-L367 HydrophobicContact CD2-CG 4.14Å; I358-L367 HydrophobicContact CB-CD1 4.26Å; I358-L367 HydrophobicContact CG1-CD1 4.16Å; I358-L367 HydrophobicContact CG2-CD1 3.94Å; C361-L367 HydrophobicContact CB-CB 4.11Å; C361-L367 HydrophobicContact CB-CD1 4.41Å; I363-L367 PolarHBondContact O-N 2.99Å; F364-L367 WeakPolarHBondContact O-CB 3.4Å; F364-L367 PolarHBondContact O-N 3.27Å; F364-L367 VanDerWaalsContact O-N 3.11Å; G365-L367 VanDerWaalsContact C-N 3.34Å; L367-A369 VanDerWaalsContact C-N 3.35Å; L367-V370 PolarHBondContact O-N 3.15Å; L367-C371 WeakPolarHBondContact O-CB 3.4Å; L367-C371 PolarHBondContact O-N 3.32Å; L367-C371 PolarHBondContact O-SG 3.07Å |
| 368 | I | 95.7 | Very high | 94.4 | Very high | 41 Ų | 41 | 38.2 Ų | 38.2 | 21% | 0.21 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -58.6 | -47.5 | 170.5 | -66.3 | 173.4 | 0 | 0 | 0 | 110.3 | I312 L313 F364 G365 G366 V370 C371 L372 | I312-I368 HydrophobicContact CG2-CD1 4.38Å; L313-I368 HydrophobicContact CD2-CB 4.5Å; L313-I368 HydrophobicContact CD2-CG1 3.77Å; F364-I368 HydrophobicContact CD1-CD1 3.94Å; F364-I368 HydrophobicContact CD1-CG1 4.4Å; F364-I368 HydrophobicContact CE1-CD1 3.77Å; F364-I368 HydrophobicContact CE1-CG1 4.17Å; F364-I368 HydrophobicContact CZ-CG1 4.5Å; F364-I368 PolarHBondContact O-N 3.38Å; F364-I368 VanDerWaalsContact O-N 3.08Å; G365-I368 WeakPolarHBondContact O-CB 3.34Å; G365-I368 PolarHBondContact O-N 2.61Å; G366-I368 VanDerWaalsContact C-N 3.34Å; G366-I368 PolarHBondContact O-N 3.39Å; I368-V370 VanDerWaalsContact C-N 3.33Å; I368-V370 PolarHBondContact O-N 3.14Å; I368-C371 WeakPolarHBondContact O-CB 3.48Å; I368-C371 PolarHBondContact O-N 3.1Å; I368-C371 VanDerWaalsContact O-N 3.15Å; I368-L372 HydrophobicContact CG2-CD1 3.97Å; I368-L372 HydrophobicContact CG2-CG 4.28Å; I368-L372 WeakPolarHBondContact O-CG 3.46Å; I368-L372 PolarHBondContact O-N 2.63Å |
| 369 | A | 96.4 | Very high | 94.2 | Very high | 50 Ų | 50 | 38.1 Ų | 38.1 | 41% | 0.413 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -60.4 | -41.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | G365 G366 L367 L372 L373 | G365-A369 PolarHBondContact O-N 3.17Å; G366-A369 WeakPolarHBondContact O-CB 3.42Å; G366-A369 PolarHBondContact O-N 3.31Å; L367-A369 VanDerWaalsContact C-N 3.35Å; A369-L372 PolarHBondContact O-N 3.24Å; A369-L373 PolarHBondContact O-N 3.46Å; A369-L373 VanDerWaalsContact O-N 3.13Å |
| 370 | V | 96.4 | Very high | 94.1 | Very high | 6 Ų | 6 | 38 Ų | 38 | 4% | 0.036 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -59.6 | -45.8 | 173.6 | 171 | 0 | 0 | 0 | 0 | 111.2 | M354 M357 I358 G366 L367 I368 L372 L373 M374 | M354-V370 HydrophobicContact CB-CG1 3.99Å; M354-V370 VanDerWaalsContact O-CG1 3.26Å; M354-V370 WeakPolarHBondContact O-CG1 3.27Å; M354-V370 HydrophobicContact SD-CG1 4.35Å; M354-V370 HydrophobicContact SD-CG2 4.43Å; M357-V370 HydrophobicContact CB-CG2 4.01Å; I358-V370 HydrophobicContact CG1-CG1 3.88Å; G366-V370 PolarHBondContact O-N 2.8Å; G366-V370 VanDerWaalsContact O-N 3.08Å; L367-V370 PolarHBondContact O-N 3.15Å; I368-V370 VanDerWaalsContact C-N 3.33Å; I368-V370 PolarHBondContact O-N 3.14Å; V370-L372 PolarHBondContact O-N 3.02Å; V370-L373 PolarHBondContact O-N 3.03Å; V370-M374 VanDerWaalsContact O-CB 3.29Å; V370-M374 WeakPolarHBondContact O-CB 3.37Å; V370-M374 PolarHBondContact O-N 2.86Å |
| 371 | C | 95.6 | Very high | 94 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65.1 | -37.8 | 179.5 | -71.3 | 0 | 0 | 0 | 0 | 113.2 | C316 I317 L367 I368 G375 | C316-C371 HydrophobicContact CB-CB 4.3Å; I317-C371 HydrophobicContact CD1-CB 4.31Å; I317-C371 HydrophobicContact CG1-CB 3.85Å; I317-C371 WeakPolarHBondContact CG1-O 3.48Å; L367-C371 WeakPolarHBondContact O-CB 3.4Å; L367-C371 PolarHBondContact O-N 3.32Å; L367-C371 PolarHBondContact O-SG 3.07Å; I368-C371 WeakPolarHBondContact O-CB 3.48Å; I368-C371 PolarHBondContact O-N 3.1Å; I368-C371 VanDerWaalsContact O-N 3.15Å; C371-G375 PolarHBondContact O-N 2.91Å |
| 372 | L | 96.7 | Very high | 93.8 | Very high | 66 Ų | 66 | 34.5 Ų | 34.5 | 35% | 0.346 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -64 | -44.5 | 175.5 | -71.3 | 170 | 0 | 0 | 0 | 111.8 | C316 T320 I368 A369 V370 L376 | C316-L372 HydrophobicContact CB-CD2 3.66Å; C316-L372 HydrophobicContact CB-CG 4.03Å; T320-L372 VanDerWaalsContact CB-O 3.26Å; T320-L372 WeakPolarHBondContact CB-O 3.43Å; T320-L372 HydrophobicContact CG2-CB 4.02Å; T320-L372 HydrophobicContact CG2-CD2 3.35Å; T320-L372 HydrophobicContact CG2-CG 4.29Å; T320-L372 WeakPolarHBondContact CG2-O 3.42Å; T320-L372 PolarHBondContact OG1-O 2.83Å; T320-L372 VanDerWaalsContact OG1-O 3.05Å; I368-L372 HydrophobicContact CG2-CD1 3.97Å; I368-L372 HydrophobicContact CG2-CG 4.28Å; I368-L372 WeakPolarHBondContact O-CG 3.46Å; I368-L372 PolarHBondContact O-N 2.63Å; A369-L372 PolarHBondContact O-N 3.24Å; V370-L372 PolarHBondContact O-N 3.02Å; L372-L376 WeakPolarHBondContact O-CB 3.19Å; L372-L376 PolarHBondContact O-N 2.75Å |
| 373 | L | 96.9 | Very high | 93.7 | Very high | 79 Ų | 79 | 30.1 Ų | 30.1 | 41% | 0.414 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -69.1 | -43.3 | 177.3 | -72 | 175.8 | 0 | 0 | 0 | 111.6 | M354 A369 V370 G375 L376 F377 | M354-L373 HydrophobicContact CE-CD1 4.3Å; M354-L373 HydrophobicContact CG-CB 4.02Å; M354-L373 HydrophobicContact SD-CB 3.82Å; M354-L373 HydrophobicContact SD-CD1 3.76Å; M354-L373 HydrophobicContact SD-CG 4.45Å; A369-L373 PolarHBondContact O-N 3.46Å; A369-L373 VanDerWaalsContact O-N 3.13Å; V370-L373 PolarHBondContact O-N 3.03Å; L373-G375 VanDerWaalsContact C-N 3.35Å; L373-G375 PolarHBondContact O-N 3.47Å; L373-L376 PolarHBondContact O-N 2.73Å; L373-F377 WeakPolarHBondContact O-CD2 3.49Å; L373-F377 PolarHBondContact O-N 3.05Å |
| 374 | M | 94.9 | Very high | 93.5 | Very high | 6 Ų | 6 | 24.4 Ų | 24.4 | 3% | 0.03 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59.7 | -45.7 | 177.1 | -170.8 | 177.7 | 72.1 | 0 | 0 | 111.3 | P292 I317 M354 V370 D378 | P292-M374 HydrophobicContact CB-CE 3.92Å; P292-M374 HydrophobicContact CB-SD 4.13Å; P292-M374 HydrophobicContact CG-SD 4.11Å; I317-M374 HydrophobicContact CD1-CE 3.36Å; I317-M374 HydrophobicContact CG1-CE 3.87Å; M354-M374 HydrophobicContact CB-CB 4.18Å; V370-M374 VanDerWaalsContact O-CB 3.29Å; V370-M374 WeakPolarHBondContact O-CB 3.37Å; V370-M374 PolarHBondContact O-N 2.86Å; M374-D378 VanDerWaalsContact O-CB 3.24Å; M374-D378 WeakPolarHBondContact O-CB 2.98Å; M374-D378 PolarHBondContact O-N 3.16Å |
| 375 | G | 94.9 | Very high | 93.3 | Very high | 0 Ų | 0 | 23.2 Ų | 23.2 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -64 | -43 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | T320 S321 C371 L373 F377 D378 G379 | T320-G375 VanDerWaalsContact OG1-CA 3.3Å; T320-G375 WeakPolarHBondContact OG1-CA 3.48Å; S321-G375 WeakPolarHBondContact CA-O 3.39Å; S321-G375 WeakPolarHBondContact CB-O 3.38Å; S321-G375 PolarHBondContact N-O 3.49Å; C371-G375 PolarHBondContact O-N 2.91Å; L373-G375 VanDerWaalsContact C-N 3.35Å; L373-G375 PolarHBondContact O-N 3.47Å; G375-F377 VanDerWaalsContact C-N 3.33Å; G375-F377 PolarHBondContact O-N 3.07Å; G375-D378 WeakPolarHBondContact O-CB 3.3Å; G375-D378 PolarHBondContact O-N 2.63Å; G375-G379 PolarHBondContact O-N 3.3Å |
| 376 | L | 95.3 | Very high | 92.9 | Very high | 42 Ų | 42 | 23 Ų | 23 | 22% | 0.22 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -56 | -46.6 | 177.8 | -178.9 | 66.7 | 0 | 0 | 0 | 112.5 | T320 I327 F328 L372 L373 G379 C380 | T320-L376 WeakPolarHBondContact O-CA 3.25Å; T320-L376 PolarHBondContact OG1-N 3.29Å; I327-L376 HydrophobicContact CD1-CD1 4.24Å; F328-L376 HydrophobicContact CE2-CD1 4.13Å; F328-L376 HydrophobicContact CE2-CG 4.05Å; L372-L376 WeakPolarHBondContact O-CB 3.19Å; L372-L376 PolarHBondContact O-N 2.75Å; L373-L376 PolarHBondContact O-N 2.73Å; L376-G379 PolarHBondContact O-N 3.25Å; L376-C380 PolarHBondContact O-N 2.91Å |
| 377 | F | 95.7 | Very high | 92.5 | Very high | 27 Ų | 27 | 23.9 Ų | 23.9 | 12% | 0.118 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -81.2 | -23.8 | -179.8 | -76.8 | -79.3 | 0 | 0 | 0 | 113.7 | F328 L346 S347 V350 I351 L373 G375 G379 C380 F381 | F328-F377 HydrophobicContact CZ-CE1 4.02Å; F328-F377 HydrophobicContact CZ-CZ 4.43Å; L346-F377 HydrophobicContact CD2-CE1 3.85Å; L346-F377 HydrophobicContact CD2-CZ 4.48Å; L346-F377 HydrophobicContact CG-CD1 4.45Å; L346-F377 HydrophobicContact CG-CE1 3.76Å; L346-F377 HydrophobicContact CG-CZ 4.5Å; S347-F377 WeakPolarHBondContact CB-O 3.33Å; S347-F377 PolarHBondContact OG-O 3.24Å; V350-F377 HydrophobicContact CB-CB 4.25Å; V350-F377 HydrophobicContact CB-CD1 4.3Å; V350-F377 HydrophobicContact CB-CD2 3.75Å; V350-F377 HydrophobicContact CB-CE2 4.14Å; V350-F377 HydrophobicContact CB-CG 3.82Å; V350-F377 HydrophobicContact CG1-CB 4.32Å; V350-F377 HydrophobicContact CG1-CD2 3.35Å; V350-F377 HydrophobicContact CG1-CE2 3.77Å; V350-F377 HydrophobicContact CG1-CG 3.9Å; V350-F377 HydrophobicContact CG2-CD1 4.29Å; V350-F377 HydrophobicContact CG2-CD2 4.03Å; V350-F377 HydrophobicContact CG2-CE1 4.17Å; V350-F377 HydrophobicContact CG2-CE2 3.9Å; V350-F377 HydrophobicContact CG2-CG 4.21Å; V350-F377 HydrophobicContact CG2-CZ 3.97Å; I351-F377 HydrophobicContact CG1-CB 4.24Å; L373-F377 WeakPolarHBondContact O-CD2 3.49Å; L373-F377 PolarHBondContact O-N 3.05Å; G375-F377 VanDerWaalsContact C-N 3.33Å; G375-F377 PolarHBondContact O-N 3.07Å; F377-G379 VanDerWaalsContact C-N 3.32Å; F377-C380 WeakPolarHBondContact O-CB 3.48Å; F377-C380 PolarHBondContact O-N 3.24Å; F377-F381 PolarHBondContact O-N 3.34Å |
| 378 | D | 93.4 | Very high | 92.2 | Very high | 4 Ų | 4 | 24 Ų | 24 | 2% | 0.021 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -57.9 | -47.3 | 163.6 | 173.2 | 83.5 | 0 | 0 | 0 | 110.8 | Y289 Y293 S321 R325 M374 G375 C380 F381 I382 | Y289-D378 WeakPolarHBondContact CE2-OD1 3.45Å; Y289-D378 PolarHBondContact OH-OD1 2.92Å; Y293-D378 PolarHBondContact OH-OD1 3.07Å; S321-D378 WeakPolarHBondContact CB-OD2 3.38Å; S321-D378 PolarHBondContact OG-OD2 3.33Å; R325-D378 IonicContact NH2-OD2 2.82Å; M374-D378 VanDerWaalsContact O-CB 3.24Å; M374-D378 WeakPolarHBondContact O-CB 2.98Å; M374-D378 PolarHBondContact O-N 3.16Å; G375-D378 WeakPolarHBondContact O-CB 3.3Å; G375-D378 PolarHBondContact O-N 2.63Å; D378-C380 VanDerWaalsContact C-N 3.31Å; D378-C380 PolarHBondContact O-N 3.39Å; D378-F381 PolarHBondContact O-N 2.94Å; D378-I382 WeakPolarHBondContact O-CG1 3.5Å; D378-I382 PolarHBondContact O-N 3.07Å |
| 379 | G | 91.1 | Very high | 91.8 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -57.5 | -43.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | S321 R325 G375 L376 F377 I382 C383 | S321-G379 WeakPolarHBondContact O-CA 3.22Å; S321-G379 PolarHBondContact OG-N 2.82Å; R325-G379 VanDerWaalsContact CG-O 3.3Å; R325-G379 WeakPolarHBondContact CG-O 3.35Å; G375-G379 PolarHBondContact O-N 3.3Å; L376-G379 PolarHBondContact O-N 3.25Å; F377-G379 VanDerWaalsContact C-N 3.32Å; G379-I382 PolarHBondContact O-N 3.21Å; G379-C383 PolarHBondContact O-N 3.44Å; G379-C383 PolarHBondContact O-SG 3.17Å |
| 380 | C | 91.8 | Very high | 91.2 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -59.9 | -48.1 | 174.6 | -176.4 | 0 | 0 | 0 | 0 | 112.5 | F328 S347 L376 F377 D378 I382 C383 I384 | F328-C380 HydrophobicContact CB-CB 3.89Å; F328-C380 HydrophobicContact CD1-CB 4.27Å; F328-C380 VanDerWaalsContact CD1-SG 3.6Å; F328-C380 HydrophobicContact CD2-CB 3.43Å; F328-C380 VanDerWaalsContact CD2-CB 3.43Å; F328-C380 HydrophobicContact CE2-CB 3.96Å; F328-C380 HydrophobicContact CG-CB 3.6Å; F328-C380 WeakPolarHBondContact CG-SG 3.28Å; S347-C380 WeakPolarHBondContact OG-CB 3.35Å; S347-C380 PolarHBondContact OG-SG 3.13Å; L376-C380 PolarHBondContact O-N 2.91Å; F377-C380 WeakPolarHBondContact O-CB 3.48Å; F377-C380 PolarHBondContact O-N 3.24Å; D378-C380 VanDerWaalsContact C-N 3.31Å; D378-C380 PolarHBondContact O-N 3.39Å; C380-I382 PolarHBondContact O-N 3.36Å; C380-C383 PolarHBondContact O-SG 3.46Å; C380-C383 VanDerWaalsContact O-SG 3.37Å; C380-I384 WeakPolarHBondContact O-CB 3.16Å; C380-I384 WeakPolarHBondContact O-CG1 3.36Å; C380-I384 PolarHBondContact O-N 3.23Å; C380-I384 VanDerWaalsContact SG-CD1 3.51Å |
| 381 | F | 92.4 | Very high | 90.7 | Very high | 1 Ų | 1 | 27 Ų | 27 | 0% | 0.004 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -57 | -49 | 177.8 | 161.2 | -116.9 | 0 | 0 | 0 | 111.6 | I282 L286 Y289 Q344 F348 F377 D378 M385 M409 | I282-F381 HydrophobicContact CG2-CE2 4.49Å; I282-F381 HydrophobicContact CG2-CZ 4.48Å; L286-F381 HydrophobicContact CD1-CZ 4.5Å; L286-F381 HydrophobicContact CD2-CE1 4.15Å; L286-F381 HydrophobicContact CD2-CZ 4.05Å; Y289-F381 HydrophobicContact CE2-CD1 4.25Å; Y289-F381 HydrophobicContact CE2-CE1 4.4Å; Q344-F381 HydrophobicContact CG-CD2 4.07Å; F348-F381 AromaticContact CE1-CD2 3.94Å; F348-F381 HydrophobicContact CE1-CD2 3.94Å; F348-F381 AromaticContact CE1-CE2 3.91Å; F348-F381 HydrophobicContact CE1-CE2 3.91Å; F348-F381 HydrophobicContact CE1-CG 4.39Å; F348-F381 HydrophobicContact CE1-CZ 4.31Å; F348-F381 HydrophobicContact CE2-CD2 4.17Å; F348-F381 HydrophobicContact CE2-CE2 4.15Å; F348-F381 AromaticContact CZ-CD2 3.58Å; F348-F381 HydrophobicContact CZ-CD2 3.58Å; F348-F381 AromaticContact CZ-CE2 3.34Å; F348-F381 HydrophobicContact CZ-CE2 3.34Å; F348-F381 HydrophobicContact CZ-CG 4.45Å; F348-F381 HydrophobicContact CZ-CZ 4.04Å; F377-F381 PolarHBondContact O-N 3.34Å; D378-F381 PolarHBondContact O-N 2.94Å; F381-M385 PolarHBondContact O-N 3.35Å; F381-M409 HydrophobicContact CE1-CE 4.49Å; F381-M409 HydrophobicContact CZ-CE 3.97Å |
| 382 | I | 89.4 | Confident | 90.3 | Very high | 44 Ų | 44 | 27.8 Ų | 27.8 | 23% | 0.226 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -67 | -43.8 | -176.5 | -63.4 | -64.3 | 0 | 0 | 0 | 111.9 | T200 D378 G379 C380 | T200-I382 HydrophobicContact CG2-CG2 3.9Å; D378-I382 WeakPolarHBondContact O-CG1 3.5Å; D378-I382 PolarHBondContact O-N 3.07Å; G379-I382 PolarHBondContact O-N 3.21Å; C380-I382 PolarHBondContact O-N 3.36Å |
| 383 | C | 85.8 | Confident | 89.7 | Confident | 29 Ų | 29 | 26 Ų | 26 | 20% | 0.196 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -72.3 | -31.7 | -175.7 | 68.2 | 0 | 0 | 0 | 0 | 113.5 | R325 G379 C380 P387 | R325-C383 HydrophobicContact CB-CB 4.25Å; R325-C383 HydrophobicContact CG-CB 4.14Å; G379-C383 PolarHBondContact O-N 3.44Å; G379-C383 PolarHBondContact O-SG 3.17Å; C380-C383 PolarHBondContact O-SG 3.46Å; C380-C383 VanDerWaalsContact O-SG 3.37Å; C383-P387 WeakPolarHBondContact O-CD 3.23Å |
| 384 | I | 87.8 | Confident | 88.9 | Confident | 0 Ų | 0 | 23.6 Ų | 23.6 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -83.3 | -17.1 | -176.2 | -64.5 | 179.9 | 0 | 0 | 0 | 112.5 | F328 A332 K340 L343 C380 A386 P387 I388 | F328-I384 HydrophobicContact CB-CD1 4.4Å; A332-I384 HydrophobicContact CB-CG1 4.16Å; K340-I384 HydrophobicContact CB-CG2 4.28Å; L343-I384 HydrophobicContact CB-CD1 3.33Å; L343-I384 HydrophobicContact CD1-CD1 3.61Å; L343-I384 HydrophobicContact CG-CD1 4.03Å; C380-I384 WeakPolarHBondContact O-CB 3.16Å; C380-I384 WeakPolarHBondContact O-CG1 3.36Å; C380-I384 PolarHBondContact O-N 3.23Å; C380-I384 VanDerWaalsContact SG-CD1 3.51Å; I384-A386 PolarHBondContact O-N 3.02Å; I384-P387 VanDerWaalsContact O-CD 3.29Å; I384-P387 WeakPolarHBondContact O-CD 3.49Å; I384-I388 HydrophobicContact CG2-CD1 3.47Å; I384-I388 VanDerWaalsContact CG2-CD1 3.47Å; I384-I388 HydrophobicContact CG2-CG1 3.74Å; I384-I388 WeakPolarHBondContact O-CG1 3.49Å; I384-I388 PolarHBondContact O-N 3.34Å |
| 385 | M | 88.9 | Confident | 87.9 | Confident | 23 Ų | 23 | 26.5 Ų | 26.5 | 11% | 0.113 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -55.5 | -47.7 | -179.6 | -173.1 | 175.5 | 69.7 | 0 | 0 | 113 | W278 F381 I388 A389 L405 L406 M409 | W278-M385 HydrophobicContact CH2-CG 3.75Å; W278-M385 WeakPolarHBondContact CH2-O 3.46Å; W278-M385 HydrophobicContact CZ2-CB 4.5Å; W278-M385 HydrophobicContact CZ2-CG 3.75Å; W278-M385 WeakPolarHBondContact CZ2-O 3.46Å; F381-M385 PolarHBondContact O-N 3.35Å; M385-I388 PolarHBondContact O-N 3.26Å; M385-A389 PolarHBondContact O-N 2.9Å; M385-A389 VanDerWaalsContact O-N 3.08Å; M385-L405 HydrophobicContact CG-CD2 3.85Å; M385-L405 HydrophobicContact SD-CD2 3.66Å; M385-L406 HydrophobicContact CE-CD2 4.15Å; M385-M409 HydrophobicContact SD-SD 4.33Å |
| 386 | A | 84.1 | Confident | 86.7 | Confident | 44 Ų | 44 | 36.3 Ų | 36.3 | 36% | 0.364 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -69.4 | -45 | -180 | 0 | 0 | 0 | 0 | 0 | 113.4 | I384 I388 A389 F390 I402 | I384-A386 PolarHBondContact O-N 3.02Å; A386-I388 VanDerWaalsContact C-N 3.32Å; A386-I388 PolarHBondContact O-N 3.09Å; A386-A389 PolarHBondContact O-N 3.39Å; A386-F390 PolarHBondContact O-N 2.98Å; A386-I402 HydrophobicContact CB-CD1 3.95Å |
| 387 | P | 84.9 | Confident | 85.9 | Confident | 38 Ų | 38 | 36.3 Ų | 36.3 | 25% | 0.247 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -54.3 | -41.1 | 170.6 | -29.8 | 34.3 | 0 | 0 | 0 | 114.6 | K340 C383 I384 F390 E391 | K340-P387 HydrophobicContact CD-CB 4.19Å; C383-P387 WeakPolarHBondContact O-CD 3.23Å; I384-P387 VanDerWaalsContact O-CD 3.29Å; I384-P387 WeakPolarHBondContact O-CD 3.49Å; P387-F390 PolarHBondContact O-N 3.29Å; P387-E391 PolarHBondContact O-N 3.14Å; P387-E391 VanDerWaalsContact O-N 3.11Å |
| 388 | I | 88.3 | Confident | 85.1 | Confident | 3 Ų | 3 | 36.5 Ų | 36.5 | 2% | 0.015 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -67.3 | -45.6 | 177.4 | -69.7 | 172.3 | 0 | 0 | 0 | 110.7 | W278 K340 V341 Q344 I384 M385 A386 F390 E391 L392 | W278-I388 HydrophobicContact CD2-CG2 4.16Å; W278-I388 HydrophobicContact CG-CG2 4.36Å; W278-I388 HydrophobicContact CZ2-CB 4.1Å; W278-I388 HydrophobicContact CZ2-CG2 3.94Å; K340-I388 HydrophobicContact CB-CD1 4.45Å; K340-I388 HydrophobicContact CB-CG1 3.91Å; V341-I388 HydrophobicContact CG2-CD1 4.08Å; V341-I388 HydrophobicContact CG2-CG1 4.38Å; V341-I388 HydrophobicContact CG2-CG2 4.21Å; Q344-I388 HydrophobicContact CB-CD1 3.98Å; I384-I388 HydrophobicContact CG2-CD1 3.47Å; I384-I388 VanDerWaalsContact CG2-CD1 3.47Å; I384-I388 HydrophobicContact CG2-CG1 3.74Å; I384-I388 WeakPolarHBondContact O-CG1 3.49Å; I384-I388 PolarHBondContact O-N 3.34Å; M385-I388 PolarHBondContact O-N 3.26Å; A386-I388 VanDerWaalsContact C-N 3.32Å; A386-I388 PolarHBondContact O-N 3.09Å; I388-F390 VanDerWaalsContact C-N 3.26Å; I388-F390 PolarHBondContact O-N 3.36Å; I388-E391 PolarHBondContact O-N 3.33Å; I388-E391 VanDerWaalsContact O-N 3.13Å; I388-L392 HydrophobicContact CG2-CD1 3.54Å; I388-L392 HydrophobicContact CG2-CG 4.07Å; I388-L392 WeakPolarHBondContact O-CB 3.47Å; I388-L392 WeakPolarHBondContact O-CG 3.27Å; I388-L392 PolarHBondContact O-N 2.95Å |
| 389 | A | 87.4 | Confident | 84.2 | Confident | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -56 | -44.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | W278 M385 A386 E391 L392 V393 V398 I402 | W278-A389 HydrophobicContact CH2-CB 3.78Å; W278-A389 HydrophobicContact CZ3-CB 3.92Å; M385-A389 PolarHBondContact O-N 2.9Å; M385-A389 VanDerWaalsContact O-N 3.08Å; A386-A389 PolarHBondContact O-N 3.39Å; A389-E391 VanDerWaalsContact C-N 3.34Å; A389-E391 PolarHBondContact O-N 2.99Å; A389-L392 PolarHBondContact O-N 3.42Å; A389-V393 WeakPolarHBondContact O-CG2 3.48Å; A389-V393 PolarHBondContact O-N 2.91Å; A389-V393 VanDerWaalsContact O-N 3.12Å; A389-V398 HydrophobicContact CB-CG2 3.8Å; A389-I402 HydrophobicContact CB-CD1 4.18Å; A389-I402 HydrophobicContact CB-CG1 3.71Å |
| 390 | F | 84.5 | Confident | 83.6 | Confident | 109 Ų | 109 | 41.2 Ų | 41.2 | 48% | 0.478 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -57.9 | -43.7 | 176.9 | -179.6 | -87.7 | 0 | 0 | 0 | 112.4 | A386 P387 I388 G394 A395 V398 | A386-F390 PolarHBondContact O-N 2.98Å; P387-F390 PolarHBondContact O-N 3.29Å; I388-F390 VanDerWaalsContact C-N 3.26Å; I388-F390 PolarHBondContact O-N 3.36Å; F390-G394 WeakPolarHBondContact O-CA 3.34Å; F390-G394 PolarHBondContact O-N 3.24Å; F390-A395 HydrophobicContact CD2-CB 4.24Å; F390-A395 HydrophobicContact CE2-CB 3.45Å; F390-A395 VanDerWaalsContact CE2-CB 3.45Å; F390-A395 HydrophobicContact CZ-CB 4.1Å; F390-V398 HydrophobicContact CB-CG2 4.14Å |
| 391 | E | 84.9 | Confident | 83.3 | Confident | 53 Ų | 53 | 41.2 Ų | 41.2 | 25% | 0.248 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -70.8 | -33.5 | 179.2 | -72.7 | -169.8 | 170.4 | 0 | 0 | 113.7 | G337 S338 K340 P387 I388 A389 | G337-E391 WeakPolarHBondContact CA-OE1 3.24Å; G337-E391 WeakPolarHBondContact CA-OE2 3.3Å; G337-E391 PolarHBondContact N-OE1 3.08Å; S338-E391 PolarHBondContact N-OE2 2.97Å; K340-E391 VanDerWaalsContact CE-OE1 3.22Å; K340-E391 WeakPolarHBondContact CE-OE1 3.42Å; K340-E391 IonicContact NZ-OE1 2.82Å; K340-E391 PolarHBondContact NZ-OE1 2.95Å; P387-E391 PolarHBondContact O-N 3.14Å; P387-E391 VanDerWaalsContact O-N 3.11Å; I388-E391 PolarHBondContact O-N 3.33Å; I388-E391 VanDerWaalsContact O-N 3.13Å; A389-E391 VanDerWaalsContact C-N 3.34Å; A389-E391 PolarHBondContact O-N 2.99Å |
| 392 | L | 86.4 | Confident | 82.9 | Confident | 15 Ų | 15 | 42.8 Ų | 42.8 | 8% | 0.079 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -76.5 | -34 | -176.5 | -74.4 | 175.2 | 0 | 0 | 0 | 114.1 | S272 W278 I388 A389 I451 E455 | S272-L392 PolarHBondContact OG-O 3.43Å; S272-L392 VanDerWaalsContact OG-O 3.09Å; W278-L392 HydrophobicContact CB-CD1 3.8Å; W278-L392 HydrophobicContact CD2-CD1 3.92Å; W278-L392 HydrophobicContact CE3-CD1 4.17Å; W278-L392 HydrophobicContact CG-CD1 3.78Å; I388-L392 HydrophobicContact CG2-CD1 3.54Å; I388-L392 HydrophobicContact CG2-CG 4.07Å; I388-L392 WeakPolarHBondContact O-CB 3.47Å; I388-L392 WeakPolarHBondContact O-CG 3.27Å; I388-L392 PolarHBondContact O-N 2.95Å; A389-L392 PolarHBondContact O-N 3.42Å; L392-I451 HydrophobicContact CD2-CG2 4.04Å; L392-E455 WeakPolarHBondContact CD2-OE1 3.49Å |
| 393 | V | 85.4 | Confident | 82.7 | Confident | 28 Ų | 28 | 40.8 Ų | 40.8 | 17% | 0.17 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -125.1 | -15.8 | -172.6 | -54.9 | 0 | 0 | 0 | 0 | 114 | I269 Y275 A389 D397 V398 A401 | I269-V393 HydrophobicContact CG2-CG1 3.89Å; Y275-V393 HydrophobicContact CD2-CG1 3.73Å; Y275-V393 HydrophobicContact CE2-CG1 4.5Å; Y275-V393 HydrophobicContact CG-CG1 3.82Å; A389-V393 WeakPolarHBondContact O-CG2 3.48Å; A389-V393 PolarHBondContact O-N 2.91Å; A389-V393 VanDerWaalsContact O-N 3.12Å; V393-D397 HydrophobicContact CB-CB 4.36Å; V393-D397 HydrophobicContact CG2-CB 4.2Å; V393-V398 HydrophobicContact CG2-CB 4.47Å; V393-A401 HydrophobicContact CB-CB 4.48Å; V393-A401 HydrophobicContact CG1-CB 4.15Å; V393-A401 HydrophobicContact CG2-CB 3.64Å |
| 394 | G | 80.3 | Confident | 82.7 | Confident | 29 Ų | 29 | 40.8 Ų | 40.8 | 30% | 0.299 | 23% | 0.229 | S | C | . | . | trans | 86.1 | 167.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | F390 K396 D397 V398 | F390-G394 WeakPolarHBondContact O-CA 3.34Å; F390-G394 PolarHBondContact O-N 3.24Å; G394-K396 VanDerWaalsContact C-N 3.28Å; G394-K396 PolarHBondContact O-N 3.35Å; G394-D397 PolarHBondContact O-N 2.99Å; G394-V398 PolarHBondContact O-N 3.36Å | ||
| 395 | A | 72.3 | Confident | 82.9 | Confident | 67 Ų | 67 | 40.8 Ų | 40.8 | 55% | 0.554 | 23% | 0.229 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -58.9 | -33.2 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | F390 | F390-A395 HydrophobicContact CD2-CB 4.24Å; F390-A395 HydrophobicContact CE2-CB 3.45Å; F390-A395 VanDerWaalsContact CE2-CB 3.45Å; F390-A395 HydrophobicContact CZ-CB 4.1Å |
| 396 | K | 70.8 | Confident | 82.9 | Confident | 206 Ų | 206 | 40 Ų | 40 | 90% | 0.896 | 23% | 0.225 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -71.6 | -32.6 | -174.5 | -65.9 | -175.6 | 178.8 | -177.8 | 0 | 112.5 | G394 | G394-K396 VanDerWaalsContact C-N 3.28Å; G394-K396 PolarHBondContact O-N 3.35Å |
| 397 | D | 78.9 | Confident | 83.3 | Confident | 43 Ų | 43 | 38.6 Ų | 38.6 | 23% | 0.23 | 22% | 0.215 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -113.4 | -2.7 | -167.9 | -67.8 | -31.3 | 0 | 0 | 0 | 113.7 | N266 I269 V393 G394 S399 Q400 A401 | N266-D397 PolarHBondContact ND2-OD1 2.86Å; N266-D397 PolarHBondContact ND2-OD2 3.12Å; N266-D397 VanDerWaalsContact ND2-OD2 3.12Å; I269-D397 HydrophobicContact CD1-CB 3.98Å; I269-D397 HydrophobicContact CG1-CB 3.81Å; V393-D397 HydrophobicContact CB-CB 4.36Å; V393-D397 HydrophobicContact CG2-CB 4.2Å; G394-D397 PolarHBondContact O-N 2.99Å; D397-S399 VanDerWaalsContact C-N 3.33Å; D397-S399 PolarHBondContact O-N 2.93Å; D397-Q400 PolarHBondContact O-N 2.83Å; D397-A401 WeakPolarHBondContact O-CB 3.24Å; D397-A401 PolarHBondContact O-N 3.39Å |
| 398 | V | 78.9 | Confident | 83.7 | Confident | 31 Ų | 31 | 39 Ų | 39 | 19% | 0.188 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -57.5 | -39.6 | -174.7 | 68.7 | 0 | 0 | 0 | 0 | 113.8 | A389 F390 V393 G394 A401 I402 | A389-V398 HydrophobicContact CB-CG2 3.8Å; F390-V398 HydrophobicContact CB-CG2 4.14Å; V393-V398 HydrophobicContact CG2-CB 4.47Å; G394-V398 PolarHBondContact O-N 3.36Å; V398-A401 PolarHBondContact O-N 3.27Å; V398-I402 HydrophobicContact CG2-CD1 3.95Å; V398-I402 HydrophobicContact CG2-CG1 4.44Å; V398-I402 WeakPolarHBondContact O-CG1 3.44Å; V398-I402 PolarHBondContact O-N 3.39Å |
| 399 | S | 74.3 | Confident | 83.9 | Confident | 55 Ų | 55 | 39.2 Ų | 39.2 | 39% | 0.385 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -63.6 | -46.4 | -179.1 | -178.5 | 0 | 0 | 0 | 0 | 111.7 | D397 I402 G403 | D397-S399 VanDerWaalsContact C-N 3.33Å; D397-S399 PolarHBondContact O-N 2.93Å; S399-I402 PolarHBondContact O-N 2.94Å; S399-G403 PolarHBondContact O-N 3.44Å |
| 400 | Q | 79 | Confident | 84.3 | Confident | 47 Ų | 47 | 39.5 Ų | 39.5 | 22% | 0.22 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -69.5 | -37.1 | 178.4 | -66 | -163.5 | -4.2 | 0 | 0 | 111.8 | L264 I269 D397 G403 F404 | L264-Q400 PolarHBondContact O-NE2 2.96Å; I269-Q400 HydrophobicContact CD1-CB 3.69Å; D397-Q400 PolarHBondContact O-N 2.83Å; Q400-G403 PolarHBondContact O-N 2.81Å; Q400-F404 VanDerWaalsContact O-CD2 3.23Å; Q400-F404 WeakPolarHBondContact O-CD2 3.47Å; Q400-F404 WeakPolarHBondContact O-CG 3.17Å; Q400-F404 PolarHBondContact O-N 3.42Å |
| 401 | A | 84.9 | Confident | 84.8 | Confident | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -60.7 | -47.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | I269 Y275 V393 D397 V398 G403 F404 L405 | I269-A401 HydrophobicContact CD1-CB 4.38Å; I269-A401 HydrophobicContact CG2-CB 4.12Å; Y275-A401 HydrophobicContact CD2-CB 4.23Å; Y275-A401 HydrophobicContact CE2-CB 3.57Å; Y275-A401 PolarHBondContact OH-O 2.64Å; V393-A401 HydrophobicContact CB-CB 4.48Å; V393-A401 HydrophobicContact CG1-CB 4.15Å; V393-A401 HydrophobicContact CG2-CB 3.64Å; D397-A401 WeakPolarHBondContact O-CB 3.24Å; D397-A401 PolarHBondContact O-N 3.39Å; V398-A401 PolarHBondContact O-N 3.27Å; A401-G403 VanDerWaalsContact C-N 3.33Å; A401-G403 PolarHBondContact O-N 3.48Å; A401-F404 PolarHBondContact O-N 2.97Å; A401-L405 WeakPolarHBondContact O-CB 3.17Å; A401-L405 PolarHBondContact O-N 3.09Å |
| 402 | I | 84.4 | Confident | 85.3 | Confident | 34 Ų | 34 | 36.6 Ų | 36.6 | 17% | 0.174 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -62.3 | -43 | 174.2 | -67.4 | 169.8 | 0 | 0 | 0 | 110.3 | A386 A389 V398 S399 F404 L405 L406 | A386-I402 HydrophobicContact CB-CD1 3.95Å; A389-I402 HydrophobicContact CB-CD1 4.18Å; A389-I402 HydrophobicContact CB-CG1 3.71Å; V398-I402 HydrophobicContact CG2-CD1 3.95Å; V398-I402 HydrophobicContact CG2-CG1 4.44Å; V398-I402 WeakPolarHBondContact O-CG1 3.44Å; V398-I402 PolarHBondContact O-N 3.39Å; S399-I402 PolarHBondContact O-N 2.94Å; I402-F404 PolarHBondContact O-N 3.46Å; I402-L405 WeakPolarHBondContact O-CB 3.32Å; I402-L405 PolarHBondContact O-N 3.22Å; I402-L406 HydrophobicContact CG2-CD1 3.97Å; I402-L406 HydrophobicContact CG2-CG 4.11Å; I402-L406 VanDerWaalsContact O-CG 3.3Å; I402-L406 WeakPolarHBondContact O-CG 3.42Å; I402-L406 PolarHBondContact O-N 2.89Å |
| 403 | G | 83.6 | Confident | 85.6 | Confident | 3 Ų | 3 | 35.9 Ų | 35.9 | 3% | 0.031 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -57.3 | -47.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | P123 S399 Q400 A401 L406 G407 | P123-G403 WeakPolarHBondContact CG-O 3.35Å; S399-G403 PolarHBondContact O-N 3.44Å; Q400-G403 PolarHBondContact O-N 2.81Å; A401-G403 VanDerWaalsContact C-N 3.33Å; A401-G403 PolarHBondContact O-N 3.48Å; G403-L406 PolarHBondContact O-N 2.93Å; G403-G407 PolarHBondContact O-N 2.98Å |
| 404 | F | 87.4 | Confident | 86.1 | Confident | 29 Ų | 29 | 36 Ų | 36 | 13% | 0.127 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.3 | -42.6 | 175.1 | -71.8 | -44.6 | 0 | 0 | 0 | 112.5 | F265 I269 W270 Y275 Q400 A401 I402 G407 L408 | F265-F404 HydrophobicContact CB-CZ 4.06Å; F265-F404 AromaticContact CD1-CE1 3.34Å; F265-F404 HydrophobicContact CD1-CE1 3.34Å; F265-F404 AromaticContact CD1-CZ 3.41Å; F265-F404 HydrophobicContact CD1-CZ 3.41Å; F265-F404 VanDerWaalsContact CD1-CZ 3.41Å; F265-F404 AromaticContact CE1-CE1 3.7Å; F265-F404 HydrophobicContact CE1-CE1 3.7Å; F265-F404 HydrophobicContact CE1-CZ 4.23Å; F265-F404 HydrophobicContact CG-CE1 4.29Å; F265-F404 HydrophobicContact CG-CZ 4.13Å; I269-F404 HydrophobicContact CD1-CD2 4.4Å; I269-F404 HydrophobicContact CD1-CE2 4.14Å; W270-F404 HydrophobicContact CZ2-CB 4.27Å; W270-F404 HydrophobicContact CZ2-CD2 4.46Å; W270-F404 HydrophobicContact CZ2-CG 4.29Å; W270-F404 AromaticContact NE1-CD2 3.95Å; W270-F404 AromaticContact NE1-CE2 3.84Å; Y275-F404 WeakPolarHBondContact OH-CB 3.36Å; Q400-F404 VanDerWaalsContact O-CD2 3.23Å; Q400-F404 WeakPolarHBondContact O-CD2 3.47Å; Q400-F404 WeakPolarHBondContact O-CG 3.17Å; Q400-F404 PolarHBondContact O-N 3.42Å; A401-F404 PolarHBondContact O-N 2.97Å; I402-F404 PolarHBondContact O-N 3.46Å; F404-G407 PolarHBondContact O-N 3.26Å; F404-L408 PolarHBondContact O-N 3.46Å |
| 405 | L | 90.6 | Very high | 86.9 | Confident | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -58.5 | -52.2 | 176.2 | 172.6 | 67.7 | 0 | 0 | 0 | 110.6 | W278 I282 M385 A401 I402 G407 L408 M409 | W278-L405 HydrophobicContact CE3-CD2 4.07Å; W278-L405 HydrophobicContact CH2-CD2 3.24Å; W278-L405 HydrophobicContact CH2-CG 4.5Å; W278-L405 HydrophobicContact CZ2-CD2 3.82Å; W278-L405 HydrophobicContact CZ3-CB 4.26Å; W278-L405 HydrophobicContact CZ3-CD2 3.39Å; W278-L405 HydrophobicContact CZ3-CG 4.25Å; I282-L405 HydrophobicContact CB-CD1 3.79Å; I282-L405 HydrophobicContact CD1-CD1 3.89Å; I282-L405 HydrophobicContact CD1-CD2 3.66Å; I282-L405 HydrophobicContact CD1-CG 4.43Å; I282-L405 HydrophobicContact CG1-CD1 4.41Å; I282-L405 HydrophobicContact CG2-CD1 3.88Å; M385-L405 HydrophobicContact CG-CD2 3.85Å; M385-L405 HydrophobicContact SD-CD2 3.66Å; A401-L405 WeakPolarHBondContact O-CB 3.17Å; A401-L405 PolarHBondContact O-N 3.09Å; I402-L405 WeakPolarHBondContact O-CB 3.32Å; I402-L405 PolarHBondContact O-N 3.22Å; L405-G407 VanDerWaalsContact C-N 3.28Å; L405-G407 PolarHBondContact O-N 3.44Å; L405-L408 PolarHBondContact O-N 3.38Å; L405-M409 HydrophobicContact CD1-CG 4.28Å; L405-M409 HydrophobicContact CD1-SD 4.25Å; L405-M409 HydrophobicContact CD2-SD 4.15Å; L405-M409 HydrophobicContact CG-CG 4.31Å; L405-M409 HydrophobicContact CG-SD 3.79Å; L405-M409 VanDerWaalsContact O-CG 3.28Å; L405-M409 WeakPolarHBondContact O-CG 3.43Å; L405-M409 PolarHBondContact O-N 2.95Å |
| 406 | L | 89.7 | Confident | 88 | Confident | 6 Ų | 6 | 33 Ų | 33 | 3% | 0.031 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -57.1 | -44.9 | 177.8 | -67.4 | -179.8 | 0 | 0 | 0 | 110.5 | F119 M385 I402 G403 L408 M409 S410 | F119-L406 HydrophobicContact CB-CB 4.37Å; F119-L406 WeakPolarHBondContact CB-O 3.37Å; F119-L406 HydrophobicContact CD1-CB 4.03Å; F119-L406 HydrophobicContact CD1-CD1 4.28Å; F119-L406 HydrophobicContact CD1-CD2 3.75Å; F119-L406 HydrophobicContact CD1-CG 4.22Å; F119-L406 HydrophobicContact CE1-CD2 3.74Å; M385-L406 HydrophobicContact CE-CD2 4.15Å; I402-L406 HydrophobicContact CG2-CD1 3.97Å; I402-L406 HydrophobicContact CG2-CG 4.11Å; I402-L406 VanDerWaalsContact O-CG 3.3Å; I402-L406 WeakPolarHBondContact O-CG 3.42Å; I402-L406 PolarHBondContact O-N 2.89Å; G403-L406 PolarHBondContact O-N 2.93Å; L406-L408 VanDerWaalsContact C-N 3.28Å; L406-L408 PolarHBondContact O-N 3.44Å; L406-M409 HydrophobicContact CD2-CE 4.46Å; L406-M409 HydrophobicContact CD2-SD 3.86Å; L406-M409 WeakPolarHBondContact O-CA 3.5Å; L406-M409 WeakPolarHBondContact O-CB 3.47Å; L406-M409 PolarHBondContact O-N 3.35Å; L406-S410 PolarHBondContact O-N 3.41Å |
| 407 | G | 91.4 | Very high | 89.2 | Confident | 14 Ų | 14 | 23.1 Ų | 23.1 | 14% | 0.144 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -53.5 | -43.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113 | G403 F404 L405 S410 | G403-G407 PolarHBondContact O-N 2.98Å; F404-G407 PolarHBondContact O-N 3.26Å; L405-G407 VanDerWaalsContact C-N 3.28Å; L405-G407 PolarHBondContact O-N 3.44Å; G407-S410 WeakPolarHBondContact O-CB 3.34Å; G407-S410 PolarHBondContact O-N 2.88Å; G407-S410 PolarHBondContact O-OG 2.92Å |
| 408 | L | 93.3 | Very high | 90 | Very high | 46 Ų | 46 | 22 Ų | 22 | 24% | 0.241 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -72.5 | -31.4 | 175.1 | -66.8 | 176.8 | 0 | 0 | 0 | 113.6 | W270 A279 F280 P283 F404 L405 L406 S410 P412 | W270-L408 HydrophobicContact CH2-CD1 4.02Å; A279-L408 HydrophobicContact CB-CD1 4.22Å; A279-L408 VanDerWaalsContact O-CD1 3.24Å; A279-L408 WeakPolarHBondContact O-CD1 3.33Å; F280-L408 HydrophobicContact CD1-CD1 4.38Å; F280-L408 HydrophobicContact CE1-CD1 4.28Å; P283-L408 HydrophobicContact CB-CB 4.4Å; P283-L408 HydrophobicContact CG-CB 3.54Å; F404-L408 PolarHBondContact O-N 3.46Å; L405-L408 PolarHBondContact O-N 3.38Å; L406-L408 VanDerWaalsContact C-N 3.28Å; L406-L408 PolarHBondContact O-N 3.44Å; L408-S410 PolarHBondContact O-N 2.93Å; L408-P412 WeakPolarHBondContact O-CD 3.3Å |
| 409 | M | 93.8 | Very high | 90.8 | Very high | 8 Ų | 8 | 24.6 Ų | 24.6 | 4% | 0.039 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -65.5 | -17.8 | 174.3 | -65.8 | 168.8 | 67.4 | 0 | 0 | 112.5 | I282 P283 L286 F381 M385 L405 L406 I411 P412 M413 | I282-M409 HydrophobicContact CG2-CE 4.31Å; I282-M409 HydrophobicContact CG2-CG 3.9Å; I282-M409 HydrophobicContact CG2-SD 3.91Å; P283-M409 HydrophobicContact CG-CG 4.3Å; L286-M409 HydrophobicContact CD1-CB 4.06Å; L286-M409 HydrophobicContact CD1-CE 3.3Å; L286-M409 HydrophobicContact CD1-CG 3.57Å; L286-M409 HydrophobicContact CD1-SD 4.06Å; F381-M409 HydrophobicContact CE1-CE 4.49Å; F381-M409 HydrophobicContact CZ-CE 3.97Å; M385-M409 HydrophobicContact SD-SD 4.33Å; L405-M409 HydrophobicContact CD1-CG 4.28Å; L405-M409 HydrophobicContact CD1-SD 4.25Å; L405-M409 HydrophobicContact CD2-SD 4.15Å; L405-M409 HydrophobicContact CG-CG 4.31Å; L405-M409 HydrophobicContact CG-SD 3.79Å; L405-M409 VanDerWaalsContact O-CG 3.28Å; L405-M409 WeakPolarHBondContact O-CG 3.43Å; L405-M409 PolarHBondContact O-N 2.95Å; L406-M409 HydrophobicContact CD2-CE 4.46Å; L406-M409 HydrophobicContact CD2-SD 3.86Å; L406-M409 WeakPolarHBondContact O-CA 3.5Å; L406-M409 WeakPolarHBondContact O-CB 3.47Å; L406-M409 PolarHBondContact O-N 3.35Å; M409-I411 PolarHBondContact O-N 3.08Å; M409-P412 WeakPolarHBondContact O-CD 3.26Å; M409-P412 WeakPolarHBondContact O-CG 3.43Å; M409-M413 WeakPolarHBondContact O-CG 3.3Å; M409-M413 PolarHBondContact O-N 3.22Å |
| 410 | S | 95.2 | Very high | 91.8 | Very high | 7 Ų | 7 | 22.2 Ų | 22.2 | 5% | 0.049 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -57.6 | -44.1 | 178.1 | 66 | 0 | 0 | 0 | 0 | 113.3 | G116 L406 G407 L408 M413 V414 | G116-S410 WeakPolarHBondContact O-CB 3.46Å; L406-S410 PolarHBondContact O-N 3.41Å; G407-S410 WeakPolarHBondContact O-CB 3.34Å; G407-S410 PolarHBondContact O-N 2.88Å; G407-S410 PolarHBondContact O-OG 2.92Å; L408-S410 PolarHBondContact O-N 2.93Å; S410-M413 WeakPolarHBondContact O-CB 3.35Å; S410-M413 PolarHBondContact O-N 3.45Å; S410-V414 WeakPolarHBondContact O-CG2 3.35Å; S410-V414 PolarHBondContact O-N 3.19Å |
| 411 | I | 94.9 | Very high | 92.5 | Very high | 98 Ų | 98 | 20 Ų | 20 | 50% | 0.503 | 12% | 0.115 | S | C | . | . | H | α-helix | trans | -57.4 | -56.5 | -176.5 | -59 | 172.1 | 0 | 0 | 0 | 112.1 | M409 M413 V414 A415 | M409-I411 PolarHBondContact O-N 3.08Å; I411-M413 VanDerWaalsContact C-N 3.28Å; I411-M413 PolarHBondContact O-N 3.06Å; I411-V414 PolarHBondContact O-N 3.26Å; I411-A415 WeakPolarHBondContact O-CB 3.45Å; I411-A415 PolarHBondContact O-N 3.04Å |
| 412 | P | 94.9 | Very high | 93 | Very high | 2 Ų | 2 | 25.1 Ų | 25.1 | 1% | 0.013 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -63.6 | -33.7 | 178.1 | 24.6 | -35.1 | 0 | 0 | 0 | 112.5 | P283 L286 Y287 L408 M409 A415 G416 | P283-P412 HydrophobicContact CB-CG 4.13Å; P283-P412 WeakPolarHBondContact O-CG 3.44Å; L286-P412 HydrophobicContact CB-CB 4.04Å; L286-P412 HydrophobicContact CB-CG 3.95Å; Y287-P412 HydrophobicContact CD1-CB 4.39Å; Y287-P412 HydrophobicContact CD2-CB 3.74Å; Y287-P412 HydrophobicContact CE2-CB 4.08Å; Y287-P412 HydrophobicContact CG-CB 3.91Å; L408-P412 WeakPolarHBondContact O-CD 3.3Å; M409-P412 WeakPolarHBondContact O-CD 3.26Å; M409-P412 WeakPolarHBondContact O-CG 3.43Å; P412-A415 PolarHBondContact O-N 3.41Å; P412-G416 PolarHBondContact O-N 3.27Å |
| 413 | M | 93.9 | Very high | 93.4 | Very high | 1 Ų | 1 | 25.1 Ų | 25.1 | 1% | 0.005 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -64.1 | -39.8 | 177 | -68.8 | -63.2 | 105.7 | 0 | 0 | 112.2 | S112 M115 F119 L286 Y289 Y290 M409 S410 I411 P417 | S112-M413 WeakPolarHBondContact CB-O 3.37Å; M115-M413 HydrophobicContact CG-CB 4.24Å; M115-M413 HydrophobicContact CG-CG 4.3Å; M115-M413 HydrophobicContact CG-SD 4.24Å; F119-M413 HydrophobicContact CD2-CG 4.04Å; F119-M413 HydrophobicContact CE2-CG 4.11Å; L286-M413 HydrophobicContact CB-CE 3.7Å; L286-M413 HydrophobicContact CD1-CE 4.31Å; L286-M413 HydrophobicContact CD2-CE 4.3Å; L286-M413 HydrophobicContact CG-CE 4.33Å; Y289-M413 HydrophobicContact CD1-CE 3.59Å; Y289-M413 HydrophobicContact CD1-SD 4.07Å; Y289-M413 HydrophobicContact CE1-CE 4.47Å; Y289-M413 HydrophobicContact CG-CE 4.31Å; Y290-M413 HydrophobicContact CG-SD 4.17Å; M409-M413 WeakPolarHBondContact O-CG 3.3Å; M409-M413 PolarHBondContact O-N 3.22Å; S410-M413 WeakPolarHBondContact O-CB 3.35Å; S410-M413 PolarHBondContact O-N 3.45Å; I411-M413 VanDerWaalsContact C-N 3.28Å; I411-M413 PolarHBondContact O-N 3.06Å; M413-P417 WeakPolarHBondContact O-CD 3.07Å |
| 414 | V | 96.4 | Very high | 93.9 | Very high | 31 Ų | 31 | 26 Ų | 26 | 19% | 0.188 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -71.3 | -47 | 175.4 | 178.7 | 0 | 0 | 0 | 0 | 111.2 | F109 S112 S410 I411 P418 | F109-V414 HydrophobicContact CD2-CG1 4.22Å; F109-V414 HydrophobicContact CE2-CG1 3.53Å; F109-V414 HydrophobicContact CZ-CG1 4.42Å; S112-V414 VanDerWaalsContact CB-O 3.27Å; S112-V414 WeakPolarHBondContact CB-O 3.46Å; S112-V414 PolarHBondContact OG-O 3.1Å; S410-V414 WeakPolarHBondContact O-CG2 3.35Å; S410-V414 PolarHBondContact O-N 3.19Å; I411-V414 PolarHBondContact O-N 3.26Å; V414-P418 WeakPolarHBondContact O-CD 3.39Å; V414-P418 WeakPolarHBondContact O-CG 3.41Å |
| 415 | A | 95.9 | Very high | 94.1 | Very high | 26 Ų | 26 | 26.7 Ų | 26.7 | 22% | 0.215 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -76.3 | -34.4 | -169.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y287 I411 P412 P418 I419 | Y287-A415 HydrophobicContact CD1-CB 4.35Å; Y287-A415 HydrophobicContact CE1-CB 3.85Å; I411-A415 WeakPolarHBondContact O-CB 3.45Å; I411-A415 PolarHBondContact O-N 3.04Å; P412-A415 PolarHBondContact O-N 3.41Å; A415-P418 WeakPolarHBondContact O-CD 3.45Å; A415-I419 HydrophobicContact CB-CD1 4.12Å; A415-I419 WeakPolarHBondContact O-CB 3.36Å; A415-I419 WeakPolarHBondContact O-CD1 3.18Å; A415-I419 WeakPolarHBondContact O-CG1 3.49Å; A415-I419 PolarHBondContact O-N 2.99Å |
| 416 | G | 95.4 | Very high | 94.2 | Very high | 5 Ų | 5 | 33.9 Ų | 33.9 | 5% | 0.052 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -56.1 | -62.3 | -172.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y287 P412 I419 A420 | Y287-G416 WeakPolarHBondContact O-CA 3.3Å; P412-G416 PolarHBondContact O-N 3.27Å; G416-I419 PolarHBondContact O-N 3.18Å; G416-A420 PolarHBondContact O-N 3.33Å |
| 417 | P | 95.6 | Very high | 94.3 | Very high | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.2 | -41.9 | -177.4 | -21.3 | 31.6 | 0 | 0 | 0 | 115 | S108 Y290 V294 H295 M413 I419 A420 G421 | S108-P417 PolarHBondContact OG-O 3.15Å; Y290-P417 HydrophobicContact CD1-CG 3.48Å; Y290-P417 VanDerWaalsContact CD1-CG 3.48Å; Y290-P417 HydrophobicContact CE1-CG 4.14Å; Y290-P417 HydrophobicContact CG-CG 4.28Å; V294-P417 HydrophobicContact CB-CB 4.11Å; V294-P417 HydrophobicContact CB-CG 4.4Å; V294-P417 HydrophobicContact CG1-CB 4.2Å; V294-P417 HydrophobicContact CG2-CB 4.01Å; V294-P417 HydrophobicContact CG2-CG 3.87Å; H295-P417 PolarHBondContact NE2-O 3.18Å; M413-P417 WeakPolarHBondContact O-CD 3.07Å; P417-I419 VanDerWaalsContact C-N 3.34Å; P417-I419 PolarHBondContact O-N 3.02Å; P417-A420 WeakPolarHBondContact O-CB 3.02Å; P417-A420 PolarHBondContact O-N 3.36Å; P417-G421 PolarHBondContact O-N 3.34Å |
| 418 | P | 95.4 | Very high | 94.2 | Very high | 18 Ų | 18 | 40.1 Ų | 40.1 | 12% | 0.117 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.5 | -38.4 | 175 | -24.5 | 32.2 | 0 | 0 | 0 | 113.8 | S105 S108 F109 S112 V414 A415 G421 F422 | S105-P418 PolarHBondContact OG-O 2.89Å; S108-P418 WeakPolarHBondContact OG-CA 3.17Å; F109-P418 HydrophobicContact CB-CG 4.01Å; F109-P418 HydrophobicContact CD2-CB 4.38Å; F109-P418 HydrophobicContact CD2-CG 3.55Å; F109-P418 HydrophobicContact CE2-CG 4.5Å; F109-P418 HydrophobicContact CG-CG 4.25Å; S112-P418 WeakPolarHBondContact OG-CD 3.38Å; S112-P418 WeakPolarHBondContact OG-CG 3.36Å; V414-P418 WeakPolarHBondContact O-CD 3.39Å; V414-P418 WeakPolarHBondContact O-CG 3.41Å; A415-P418 WeakPolarHBondContact O-CD 3.45Å; P418-G421 PolarHBondContact O-N 3.22Å; P418-F422 WeakPolarHBondContact O-CB 3.48Å; P418-F422 PolarHBondContact O-N 2.71Å |
| 419 | I | 95.9 | Very high | 94.1 | Very high | 87 Ų | 87 | 40 Ų | 40 | 45% | 0.446 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -64.8 | -45.4 | 174.8 | -68.2 | 167.3 | 0 | 0 | 0 | 109.6 | A415 G416 P417 G421 F422 L423 | A415-I419 HydrophobicContact CB-CD1 4.12Å; A415-I419 WeakPolarHBondContact O-CB 3.36Å; A415-I419 WeakPolarHBondContact O-CD1 3.18Å; A415-I419 WeakPolarHBondContact O-CG1 3.49Å; A415-I419 PolarHBondContact O-N 2.99Å; G416-I419 PolarHBondContact O-N 3.18Å; P417-I419 VanDerWaalsContact C-N 3.34Å; P417-I419 PolarHBondContact O-N 3.02Å; I419-G421 VanDerWaalsContact C-N 3.35Å; I419-G421 PolarHBondContact O-N 3.04Å; I419-F422 PolarHBondContact O-N 2.97Å; I419-L423 HydrophobicContact CG2-CD1 4.4Å; I419-L423 WeakPolarHBondContact O-CG 3.17Å; I419-L423 PolarHBondContact O-N 3.48Å |
| 420 | A | 95.5 | Very high | 94.1 | Very high | 4 Ų | 4 | 39.6 Ų | 39.6 | 3% | 0.033 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60.7 | -42.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | V291 G416 P417 L423 R424 A433 | V291-A420 HydrophobicContact CB-CB 4.36Å; V291-A420 HydrophobicContact CG1-CB 3.59Å; V291-A420 HydrophobicContact CG2-CB 3.84Å; G416-A420 PolarHBondContact O-N 3.33Å; P417-A420 WeakPolarHBondContact O-CB 3.02Å; P417-A420 PolarHBondContact O-N 3.36Å; A420-L423 PolarHBondContact O-N 3.06Å; A420-R424 PolarHBondContact O-N 2.75Å; A420-A433 HydrophobicContact CB-CB 3.76Å |
| 421 | G | 94.3 | Very high | 94.1 | Very high | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.4 | -41.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | P417 P418 I419 L423 R424 D425 | P417-G421 PolarHBondContact O-N 3.34Å; P418-G421 PolarHBondContact O-N 3.22Å; I419-G421 VanDerWaalsContact C-N 3.35Å; I419-G421 PolarHBondContact O-N 3.04Å; G421-L423 VanDerWaalsContact C-N 3.35Å; G421-L423 PolarHBondContact O-N 3.36Å; G421-R424 PolarHBondContact O-N 3.33Å; G421-D425 PolarHBondContact O-N 3.28Å |
| 422 | F | 94.5 | Very high | 94 | Very high | 108 Ų | 108 | 41 Ų | 41 | 47% | 0.474 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -63.1 | -40.8 | 176.2 | 173.7 | -96.9 | 0 | 0 | 0 | 112 | P418 I419 R424 D425 K426 | P418-F422 WeakPolarHBondContact O-CB 3.48Å; P418-F422 PolarHBondContact O-N 2.71Å; I419-F422 PolarHBondContact O-N 2.97Å; F422-R424 VanDerWaalsContact C-N 3.32Å; F422-R424 PolarHBondContact O-N 2.73Å; F422-D425 PolarHBondContact O-N 3.03Å; F422-K426 HydrophobicContact CE1-CG 4.12Å; F422-K426 HydrophobicContact CE2-CG 4.15Å; F422-K426 HydrophobicContact CZ-CG 3.9Å; F422-K426 WeakPolarHBondContact O-CG 3.37Å; F422-K426 PolarHBondContact O-N 3.28Å |
| 423 | L | 94.4 | Very high | 94.1 | Very high | 34 Ų | 34 | 41 Ų | 41 | 18% | 0.178 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -61.6 | -41.9 | 173.9 | -70.6 | 170.3 | 0 | 0 | 0 | 111.1 | I419 A420 G421 K426 L427 A433 L436 | I419-L423 HydrophobicContact CG2-CD1 4.4Å; I419-L423 WeakPolarHBondContact O-CG 3.17Å; I419-L423 PolarHBondContact O-N 3.48Å; A420-L423 PolarHBondContact O-N 3.06Å; G421-L423 VanDerWaalsContact C-N 3.35Å; G421-L423 PolarHBondContact O-N 3.36Å; L423-K426 PolarHBondContact O-N 3.04Å; L423-L427 HydrophobicContact CD2-CD1 4.4Å; L423-L427 VanDerWaalsContact O-CB 3.23Å; L423-L427 WeakPolarHBondContact O-CB 3.36Å; L423-L427 WeakPolarHBondContact O-CG 3.13Å; L423-L427 PolarHBondContact O-N 3.28Å; L423-A433 HydrophobicContact CB-CB 4.24Å; L423-A433 HydrophobicContact CD1-CB 4.16Å; L423-L436 HydrophobicContact CD1-CD1 3.75Å |
| 424 | R | 93.3 | Very high | 94.2 | Very high | 22 Ų | 22 | 41 Ų | 41 | 8% | 0.083 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.9 | -44.7 | 173.7 | -179.3 | -103 | 176.7 | -175.7 | -17.8 | 112.3 | D102 S104 E302 A420 G421 F422 K426 L427 G428 Y430 | D102-R424 IonicContact OD1-CZ 3.85Å; D102-R424 IonicContact OD1-NH1 3.56Å; D102-R424 PolarHBondContact OD1-NH1 3.33Å; D102-R424 IonicContact OD1-NH2 3.17Å; D102-R424 PolarHBondContact OD1-NH2 3.25Å; D102-R424 IonicContact OD2-NH2 3.58Å; S104-R424 WeakPolarHBondContact OG-CD 3.34Å; S104-R424 PolarHBondContact OG-NH1 3.21Å; E302-R424 IonicContact OE1-CZ 3.26Å; E302-R424 IonicContact OE1-NE 3.7Å; E302-R424 IonicContact OE1-NH2 3.02Å; A420-R424 PolarHBondContact O-N 2.75Å; G421-R424 PolarHBondContact O-N 3.33Å; F422-R424 VanDerWaalsContact C-N 3.32Å; F422-R424 PolarHBondContact O-N 2.73Å; R424-K426 PolarHBondContact O-N 2.92Å; R424-L427 PolarHBondContact O-N 3.47Å; R424-G428 WeakPolarHBondContact O-CA 3.28Å; R424-G428 PolarHBondContact O-N 3.4Å; R424-Y430 HydrophobicContact CB-CD1 3.77Å; R424-Y430 HydrophobicContact CB-CD2 4.43Å; R424-Y430 HydrophobicContact CB-CE1 3.59Å; R424-Y430 HydrophobicContact CB-CE2 4.28Å; R424-Y430 HydrophobicContact CB-CG 4.2Å; R424-Y430 HydrophobicContact CG-CD1 4.12Å; R424-Y430 HydrophobicContact CG-CD2 3.87Å; R424-Y430 HydrophobicContact CG-CE1 3.86Å; R424-Y430 HydrophobicContact CG-CE2 3.59Å; R424-Y430 HydrophobicContact CG-CG 4.14Å |
| 425 | D | 92.3 | Very high | 94.2 | Very high | 44 Ų | 44 | 43.3 Ų | 43.3 | 24% | 0.235 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60.9 | -28.1 | 179 | -63.2 | -25.1 | 0 | 0 | 0 | 111.8 | D102 S104 S105 G421 F422 | D102-D425 HydrophobicContact CB-CB 4.47Å; S104-D425 WeakPolarHBondContact CB-OD1 3.38Å; S104-D425 PolarHBondContact N-OD1 3.45Å; S104-D425 PolarHBondContact N-OD2 3.26Å; S104-D425 PolarHBondContact OG-OD1 2.92Å; S105-D425 WeakPolarHBondContact CB-OD2 3.36Å; S105-D425 PolarHBondContact N-OD2 3.49Å; G421-D425 PolarHBondContact O-N 3.28Å; F422-D425 PolarHBondContact O-N 3.03Å |
| 426 | K | 91.2 | Very high | 94.2 | Very high | 151 Ų | 151 | 45.6 Ų | 45.6 | 66% | 0.657 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -90.8 | -36.9 | 177.5 | -71.9 | -65.5 | -174.6 | -175.3 | 0 | 114.7 | F422 L423 R424 | F422-K426 HydrophobicContact CE1-CG 4.12Å; F422-K426 HydrophobicContact CE2-CG 4.15Å; F422-K426 HydrophobicContact CZ-CG 3.9Å; F422-K426 WeakPolarHBondContact O-CG 3.37Å; F422-K426 PolarHBondContact O-N 3.28Å; L423-K426 PolarHBondContact O-N 3.04Å; R424-K426 PolarHBondContact O-N 2.92Å |
| 427 | L | 92.3 | Very high | 94.2 | Very high | 97 Ų | 97 | 45.6 Ų | 45.6 | 51% | 0.508 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -103.9 | -9.2 | -170.7 | -60.2 | 172.6 | 0 | 0 | 0 | 113.3 | L423 R424 S429 M432 | L423-L427 HydrophobicContact CD2-CD1 4.4Å; L423-L427 VanDerWaalsContact O-CB 3.23Å; L423-L427 WeakPolarHBondContact O-CB 3.36Å; L423-L427 WeakPolarHBondContact O-CG 3.13Å; L423-L427 PolarHBondContact O-N 3.28Å; R424-L427 PolarHBondContact O-N 3.47Å; L427-S429 PolarHBondContact O-N 3.12Å; L427-M432 HydrophobicContact CD1-CB 3.6Å; L427-M432 HydrophobicContact CD1-CG 3.82Å |
| 428 | G | 89.1 | Confident | 94.2 | Very high | 54 Ų | 54 | 45.6 Ų | 45.6 | 56% | 0.557 | 24% | 0.24 | S | C | * | . | S | Bend | trans | 73.6 | 0.7 | -179 | 0 | 0 | 0 | 0 | 0 | 115 | R424 | R424-G428 WeakPolarHBondContact O-CA 3.28Å; R424-G428 PolarHBondContact O-N 3.4Å |
| 429 | S | 91.9 | Very high | 94.3 | Very high | 43 Ų | 43 | 48 Ų | 48 | 30% | 0.301 | 25% | 0.251 | S | S | . | . | S | Bend | trans | -145.5 | 156.6 | 178.7 | 66.3 | 0 | 0 | 0 | 0 | 112 | L427 D431 | L427-S429 PolarHBondContact O-N 3.12Å; S429-D431 VanDerWaalsContact C-N 3.34Å |
| 430 | Y | 93.3 | Very high | 94.3 | Very high | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 24% | 0.239 | C | C | . | . | S | Bend | trans | -84.8 | -4.2 | 175.7 | -72.5 | -78.8 | 0 | 0 | 0 | 114.1 | Y88 H295 K298 H299 E302 R424 M432 A433 F434 | Y88-Y430 PolarHBondContact OH-OH 2.71Å; H295-Y430 HydrophobicContact CB-CD1 3.88Å; H295-Y430 HydrophobicContact CB-CE1 3.71Å; H295-Y430 AromaticContact CE1-CE1 3.89Å; H295-Y430 AromaticContact CG-CE1 3.54Å; H295-Y430 AromaticContact ND1-CE1 3.19Å; H295-Y430 WeakPolarHBondContact ND1-CE1 3.12Å; H295-Y430 AromaticContact ND1-CZ 3.65Å; H295-Y430 PolarHBondContact ND1-OH 3.09Å; K298-Y430 HydrophobicContact CB-CE2 4.15Å; K298-Y430 HydrophobicContact CG-CE2 3.74Å; H299-Y430 HydrophobicContact CB-CD2 4.13Å; H299-Y430 HydrophobicContact CB-CG 4.4Å; E302-Y430 WeakPolarHBondContact OE2-CD2 3.49Å; R424-Y430 HydrophobicContact CB-CD1 3.77Å; R424-Y430 HydrophobicContact CB-CD2 4.43Å; R424-Y430 HydrophobicContact CB-CE1 3.59Å; R424-Y430 HydrophobicContact CB-CE2 4.28Å; R424-Y430 HydrophobicContact CB-CG 4.2Å; R424-Y430 HydrophobicContact CG-CD1 4.12Å; R424-Y430 HydrophobicContact CG-CD2 3.87Å; R424-Y430 HydrophobicContact CG-CE1 3.86Å; R424-Y430 HydrophobicContact CG-CE2 3.59Å; R424-Y430 HydrophobicContact CG-CG 4.14Å; Y430-M432 PolarHBondContact O-N 3.38Å; Y430-A433 WeakPolarHBondContact O-CA 3.36Å; Y430-A433 WeakPolarHBondContact O-CB 3.43Å; Y430-A433 PolarHBondContact O-N 3.28Å; Y430-F434 HydrophobicContact CG-CE2 4.42Å; Y430-F434 VanDerWaalsContact O-CD2 3.26Å; Y430-F434 WeakPolarHBondContact O-CD2 3.47Å; Y430-F434 PolarHBondContact O-N 3.38Å |
| 431 | D | 94.8 | Very high | 94.3 | Very high | 43 Ų | 43 | 45.1 Ų | 45.1 | 23% | 0.23 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -59.1 | -48.6 | -170.5 | -69.6 | 8.5 | 0 | 0 | 0 | 111.7 | H299 R303 P359 S429 A433 F434 Y435 | H299-D431 IonicContact CE1-OD1 3.51Å; H299-D431 PolarHBondContact CE1-OD1 3.27Å; H299-D431 VanDerWaalsContact CE1-OD1 3.26Å; H299-D431 IonicContact ND1-OD1 3.79Å; R303-D431 IonicContact NH1-OD1 3.99Å; R303-D431 IonicContact NH1-OD2 3.98Å; R303-D431 PolarHBondContact NH1-OD2 3.41Å; P359-D431 HydrophobicContact CB-CB 3.74Å; S429-D431 VanDerWaalsContact C-N 3.34Å; D431-A433 VanDerWaalsContact C-N 3.3Å; D431-A433 PolarHBondContact O-N 3.09Å; D431-F434 PolarHBondContact O-N 3.34Å; D431-Y435 HydrophobicContact CB-CE2 4.23Å; D431-Y435 WeakPolarHBondContact O-CD2 3.37Å; D431-Y435 PolarHBondContact O-N 2.82Å |
| 432 | M | 94.5 | Very high | 94.3 | Very high | 91 Ų | 91 | 46.9 Ų | 46.9 | 45% | 0.448 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -63.7 | -35.8 | 176.3 | -169.8 | 57.9 | 133.4 | 0 | 0 | 112.5 | L427 Y430 F434 Y435 L436 | L427-M432 HydrophobicContact CD1-CB 3.6Å; L427-M432 HydrophobicContact CD1-CG 3.82Å; Y430-M432 PolarHBondContact O-N 3.38Å; M432-F434 VanDerWaalsContact C-N 3.33Å; M432-F434 PolarHBondContact O-N 3.24Å; M432-Y435 PolarHBondContact O-N 3.36Å; M432-L436 HydrophobicContact CG-CD1 4.07Å; M432-L436 HydrophobicContact CG-CG 4.37Å; M432-L436 WeakPolarHBondContact O-CB 3.36Å; M432-L436 VanDerWaalsContact O-CG 3.31Å; M432-L436 WeakPolarHBondContact O-CG 3.22Å; M432-L436 PolarHBondContact O-N 2.86Å; M432-L436 HydrophobicContact SD-CD1 4.42Å; M432-L436 HydrophobicContact SD-CG 4.25Å |
| 433 | A | 95.8 | Very high | 94.3 | Very high | 3 Ų | 3 | 46.3 Ų | 46.3 | 3% | 0.025 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.6 | -39.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | A420 L423 Y430 D431 A437 | A420-A433 HydrophobicContact CB-CB 3.76Å; L423-A433 HydrophobicContact CB-CB 4.24Å; L423-A433 HydrophobicContact CD1-CB 4.16Å; Y430-A433 WeakPolarHBondContact O-CA 3.36Å; Y430-A433 WeakPolarHBondContact O-CB 3.43Å; Y430-A433 PolarHBondContact O-N 3.28Å; D431-A433 VanDerWaalsContact C-N 3.3Å; D431-A433 PolarHBondContact O-N 3.09Å; A433-A437 WeakPolarHBondContact O-CB 3.38Å; A433-A437 PolarHBondContact O-N 3.4Å |
| 434 | F | 96.7 | Very high | 94.2 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -71.8 | -40.2 | 176.4 | -75.8 | -59.7 | 0 | 0 | 0 | 113.3 | V291 P292 H295 H299 I358 P359 Y430 D431 M432 L436 A437 G438 | V291-F434 HydrophobicContact CG1-CD1 4.25Å; V291-F434 HydrophobicContact CG1-CE1 4.04Å; P292-F434 HydrophobicContact CB-CE1 4.29Å; P292-F434 HydrophobicContact CG-CD1 4.48Å; P292-F434 HydrophobicContact CG-CE1 4.16Å; H295-F434 HydrophobicContact CB-CZ 4.28Å; H299-F434 HydrophobicContact CB-CE2 3.78Å; H299-F434 HydrophobicContact CB-CZ 4.35Å; H299-F434 AromaticContact CG-CE2 3.69Å; H299-F434 AromaticContact ND1-CE2 3.98Å; I358-F434 HydrophobicContact CB-CD1 4.41Å; I358-F434 HydrophobicContact CB-CG 4.25Å; I358-F434 HydrophobicContact CD1-CD1 3.75Å; I358-F434 HydrophobicContact CD1-CE1 3.86Å; I358-F434 HydrophobicContact CD1-CG 4.44Å; I358-F434 HydrophobicContact CG2-CD1 4.26Å; I358-F434 HydrophobicContact CG2-CD2 3.86Å; I358-F434 HydrophobicContact CG2-CE1 4.37Å; I358-F434 HydrophobicContact CG2-CE2 3.97Å; I358-F434 HydrophobicContact CG2-CG 4.03Å; I358-F434 HydrophobicContact CG2-CZ 4.24Å; P359-F434 HydrophobicContact CG-CB 4.12Å; Y430-F434 HydrophobicContact CG-CE2 4.42Å; Y430-F434 VanDerWaalsContact O-CD2 3.26Å; Y430-F434 WeakPolarHBondContact O-CD2 3.47Å; Y430-F434 PolarHBondContact O-N 3.38Å; D431-F434 PolarHBondContact O-N 3.34Å; M432-F434 VanDerWaalsContact C-N 3.33Å; M432-F434 PolarHBondContact O-N 3.24Å; F434-L436 VanDerWaalsContact C-N 3.35Å; F434-L436 PolarHBondContact O-N 3.01Å; F434-A437 PolarHBondContact O-N 3.49Å; F434-G438 PolarHBondContact O-N 3.11Å |
| 435 | Y | 96.4 | Very high | 94.2 | Very high | 79 Ų | 79 | 43.8 Ų | 43.8 | 31% | 0.31 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -58.4 | -48.1 | 172.6 | -68.8 | -51.3 | 0 | 0 | 0 | 111.2 | M356 P359 L360 D431 M432 A437 G438 | M356-Y435 HydrophobicContact CB-CD1 4.14Å; M356-Y435 VanDerWaalsContact O-CE1 3.23Å; M356-Y435 WeakPolarHBondContact O-CE1 3.26Å; P359-Y435 HydrophobicContact CB-CE2 4.34Å; P359-Y435 HydrophobicContact CG-CD1 3.97Å; P359-Y435 HydrophobicContact CG-CD2 4.34Å; P359-Y435 HydrophobicContact CG-CE1 3.49Å; P359-Y435 VanDerWaalsContact CG-CE1 3.49Å; P359-Y435 HydrophobicContact CG-CE2 3.9Å; P359-Y435 HydrophobicContact CG-CG 4.35Å; P359-Y435 VanDerWaalsContact CG-CZ 3.44Å; L360-Y435 WeakPolarHBondContact CD2-OH 3.17Å; L360-Y435 HydrophobicContact CG-CE1 4.25Å; D431-Y435 HydrophobicContact CB-CE2 4.23Å; D431-Y435 WeakPolarHBondContact O-CD2 3.37Å; D431-Y435 PolarHBondContact O-N 2.82Å; M432-Y435 PolarHBondContact O-N 3.36Å; Y435-A437 VanDerWaalsContact C-N 3.35Å; Y435-A437 PolarHBondContact O-N 3.1Å; Y435-G438 PolarHBondContact O-N 2.92Å |
| 436 | L | 95.9 | Very high | 94.2 | Very high | 74 Ų | 74 | 47 Ų | 47 | 39% | 0.387 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -69.5 | -31.2 | 178.8 | -67.1 | 179.2 | 0 | 0 | 0 | 112.7 | L423 M432 F434 G438 I439 P440 | L423-L436 HydrophobicContact CD1-CD1 3.75Å; M432-L436 HydrophobicContact CG-CD1 4.07Å; M432-L436 HydrophobicContact CG-CG 4.37Å; M432-L436 WeakPolarHBondContact O-CB 3.36Å; M432-L436 VanDerWaalsContact O-CG 3.31Å; M432-L436 WeakPolarHBondContact O-CG 3.22Å; M432-L436 PolarHBondContact O-N 2.86Å; M432-L436 HydrophobicContact SD-CD1 4.42Å; M432-L436 HydrophobicContact SD-CG 4.25Å; F434-L436 VanDerWaalsContact C-N 3.35Å; F434-L436 PolarHBondContact O-N 3.01Å; L436-G438 VanDerWaalsContact C-N 3.27Å; L436-G438 PolarHBondContact O-N 2.96Å; L436-I439 HydrophobicContact CD2-CD1 3.75Å; L436-I439 PolarHBondContact O-N 3.17Å; L436-P440 WeakPolarHBondContact O-CD 3.38Å |
| 437 | A | 95.3 | Very high | 94.2 | Very high | 6 Ų | 6 | 42.6 Ų | 42.6 | 5% | 0.05 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -65.4 | -28.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113 | G288 V291 A433 F434 Y435 P441 | G288-A437 WeakPolarHBondContact CA-O 3.46Å; V291-A437 HydrophobicContact CB-CB 4.02Å; V291-A437 HydrophobicContact CG1-CB 4.12Å; V291-A437 HydrophobicContact CG2-CB 4.23Å; A433-A437 WeakPolarHBondContact O-CB 3.38Å; A433-A437 PolarHBondContact O-N 3.4Å; F434-A437 PolarHBondContact O-N 3.49Å; Y435-A437 VanDerWaalsContact C-N 3.35Å; Y435-A437 PolarHBondContact O-N 3.1Å; A437-P441 VanDerWaalsContact O-CD 3.24Å; A437-P441 WeakPolarHBondContact O-CD 3.43Å |
| 438 | G | 95.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -76.9 | -20.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 115 | G352 F434 Y435 L436 P441 I442 | G352-G438 WeakPolarHBondContact CA-O 3.29Å; G352-G438 VanDerWaalsContact O-CA 3.29Å; G352-G438 WeakPolarHBondContact O-CA 3.36Å; F434-G438 PolarHBondContact O-N 3.11Å; Y435-G438 PolarHBondContact O-N 2.92Å; L436-G438 VanDerWaalsContact C-N 3.27Å; L436-G438 PolarHBondContact O-N 2.96Å; G438-P441 WeakPolarHBondContact O-CD 3.43Å; G438-I442 WeakPolarHBondContact O-CG1 3.48Å |
| 439 | I | 96.4 | Very high | 94.3 | Very high | 69 Ų | 69 | 37.7 Ų | 37.7 | 35% | 0.354 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -68.2 | -50.4 | -175 | -59 | 174.3 | 0 | 0 | 0 | 112.1 | M356 L436 I442 I443 | M356-I439 HydrophobicContact CE-CB 4.18Å; M356-I439 HydrophobicContact CE-CG1 3.42Å; M356-I439 VanDerWaalsContact CE-CG1 3.42Å; M356-I439 VanDerWaalsContact CE-N 3.34Å; L436-I439 HydrophobicContact CD2-CD1 3.75Å; L436-I439 PolarHBondContact O-N 3.17Å; I439-I442 PolarHBondContact O-N 3.15Å; I439-I443 HydrophobicContact CG2-CD1 3.48Å; I439-I443 VanDerWaalsContact CG2-CD1 3.48Å; I439-I443 HydrophobicContact CG2-CG1 4.05Å; I439-I443 PolarHBondContact O-N 3.22Å |
| 440 | P | 95.9 | Very high | 94.2 | Very high | 28 Ų | 28 | 40 Ų | 40 | 18% | 0.182 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -57.8 | -44.5 | -177.3 | -20.3 | 29.3 | 0 | 0 | 0 | 113.9 | A284 A285 L436 I442 I443 G444 | A284-P440 WeakPolarHBondContact O-CB 3.34Å; A285-P440 WeakPolarHBondContact CA-O 3.28Å; A285-P440 CarbonylContact O-C 3.59Å; L436-P440 WeakPolarHBondContact O-CD 3.38Å; P440-I442 VanDerWaalsContact C-N 3.31Å; P440-I442 PolarHBondContact O-N 3.2Å; P440-I443 PolarHBondContact O-N 3.21Å; P440-G444 PolarHBondContact O-N 3.27Å |
| 441 | P | 95.4 | Very high | 94 | Very high | 1 Ų | 1 | 40 Ų | 40 | 1% | 0.006 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -54.6 | -44.4 | 175.2 | -27.2 | 32.8 | 0 | 0 | 0 | 113.3 | A285 F348 A437 G438 G445 | A285-P441 VanDerWaalsContact O-CA 3.28Å; A285-P441 WeakPolarHBondContact O-CA 3.4Å; A285-P441 VanDerWaalsContact O-CD 3.26Å; A285-P441 WeakPolarHBondContact O-CD 3.31Å; A285-P441 VanDerWaalsContact O-CG 3.29Å; A285-P441 WeakPolarHBondContact O-CG 3.47Å; A285-P441 VanDerWaalsContact O-N 3.1Å; F348-P441 HydrophobicContact CB-CB 4.27Å; F348-P441 WeakPolarHBondContact CB-O 3.48Å; F348-P441 HydrophobicContact CD1-CB 4.32Å; F348-P441 VanDerWaalsContact O-CB 3.26Å; F348-P441 WeakPolarHBondContact O-CB 3.5Å; A437-P441 VanDerWaalsContact O-CD 3.24Å; A437-P441 WeakPolarHBondContact O-CD 3.43Å; G438-P441 WeakPolarHBondContact O-CD 3.43Å; P441-G445 PolarHBondContact O-N 2.9Å |
| 442 | I | 95.4 | Very high | 93.6 | Very high | 37 Ų | 37 | 38.5 Ų | 38.5 | 19% | 0.19 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64.9 | -48.9 | -179.8 | -62.7 | 169.6 | 0 | 0 | 0 | 110.5 | F349 V353 M356 G438 I439 P440 G445 I446 | F349-I442 HydrophobicContact CD2-CG1 4.4Å; F349-I442 HydrophobicContact CD2-CG2 4.33Å; V353-I442 HydrophobicContact CG2-CD1 4.25Å; M356-I442 HydrophobicContact CE-CD1 3.85Å; M356-I442 HydrophobicContact SD-CD1 4.47Å; G438-I442 WeakPolarHBondContact O-CG1 3.48Å; I439-I442 PolarHBondContact O-N 3.15Å; P440-I442 VanDerWaalsContact C-N 3.31Å; P440-I442 PolarHBondContact O-N 3.2Å; I442-G445 PolarHBondContact O-N 3.39Å; I442-I446 HydrophobicContact CG2-CD1 4.25Å; I442-I446 WeakPolarHBondContact O-CG1 3.5Å; I442-I446 PolarHBondContact O-N 2.96Å |
| 443 | I | 94.4 | Very high | 93.2 | Very high | 97 Ų | 97 | 41.5 Ų | 41.5 | 50% | 0.497 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -63.2 | -46.4 | 179.4 | -64.1 | 179.5 | 0 | 0 | 0 | 110.8 | I439 P440 G445 I446 V447 | I439-I443 HydrophobicContact CG2-CD1 3.48Å; I439-I443 VanDerWaalsContact CG2-CD1 3.48Å; I439-I443 HydrophobicContact CG2-CG1 4.05Å; I439-I443 PolarHBondContact O-N 3.22Å; P440-I443 PolarHBondContact O-N 3.21Å; I443-G445 VanDerWaalsContact C-N 3.34Å; I443-G445 PolarHBondContact O-N 3.1Å; I443-I446 WeakPolarHBondContact O-CB 3.44Å; I443-I446 PolarHBondContact O-N 3.24Å; I443-I446 VanDerWaalsContact O-N 3.16Å; I443-V447 WeakPolarHBondContact O-CG2 3.37Å; I443-V447 PolarHBondContact O-N 3.37Å |
| 444 | G | 92.4 | Very high | 92.9 | Very high | 1 Ų | 1 | 42.3 Ų | 42.3 | 1% | 0.01 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -61.2 | -41.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | P440 I446 V447 L448 | P440-G444 PolarHBondContact O-N 3.27Å; G444-I446 VanDerWaalsContact C-N 3.34Å; G444-I446 PolarHBondContact O-N 2.95Å; G444-V447 WeakPolarHBondContact O-CB 3.48Å; G444-V447 PolarHBondContact O-N 3.08Å; G444-V447 VanDerWaalsContact O-N 3.15Å; G444-L448 WeakPolarHBondContact O-CG 3.46Å; G444-L448 PolarHBondContact O-N 3.23Å |
| 445 | G | 91.9 | Very high | 92.4 | Very high | 2 Ų | 2 | 43.1 Ų | 43.1 | 2% | 0.021 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -56.5 | -44.7 | 172 | 0 | 0 | 0 | 0 | 0 | 112.6 | V345 P441 I442 I443 V447 L448 C449 | V345-G445 VanDerWaalsContact CG2-O 3.3Å; V345-G445 WeakPolarHBondContact CG2-O 3.5Å; P441-G445 PolarHBondContact O-N 2.9Å; I442-G445 PolarHBondContact O-N 3.39Å; I443-G445 VanDerWaalsContact C-N 3.34Å; I443-G445 PolarHBondContact O-N 3.1Å; G445-V447 VanDerWaalsContact C-N 3.32Å; G445-V447 PolarHBondContact O-N 2.62Å; G445-L448 PolarHBondContact O-N 3.33Å; G445-L448 VanDerWaalsContact O-N 3.16Å; G445-C449 PolarHBondContact O-N 3.02Å |
| 446 | I | 92.3 | Very high | 91.8 | Very high | 112 Ų | 112 | 41.4 Ų | 41.4 | 57% | 0.574 | 22% | 0.221 | S | C | * | . | H | α-helix | trans | -61.2 | -41.3 | 176 | -66.1 | 164.1 | 0 | 0 | 0 | 111.3 | I442 I443 G444 L448 C449 | I442-I446 HydrophobicContact CG2-CD1 4.25Å; I442-I446 WeakPolarHBondContact O-CG1 3.5Å; I442-I446 PolarHBondContact O-N 2.96Å; I443-I446 WeakPolarHBondContact O-CB 3.44Å; I443-I446 PolarHBondContact O-N 3.24Å; I443-I446 VanDerWaalsContact O-N 3.16Å; G444-I446 VanDerWaalsContact C-N 3.34Å; G444-I446 PolarHBondContact O-N 2.95Å; I446-L448 VanDerWaalsContact C-N 3.31Å; I446-L448 PolarHBondContact O-N 2.87Å; I446-C449 WeakPolarHBondContact O-CB 3.45Å; I446-C449 PolarHBondContact O-N 3.12Å |
| 447 | V | 92.8 | Very high | 91.4 | Very high | 57 Ų | 57 | 44.2 Ų | 44.2 | 35% | 0.345 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -62.4 | -39.5 | 176.1 | 174 | 0 | 0 | 0 | 0 | 111.3 | I277 I443 G444 G445 C449 L450 | I277-V447 HydrophobicContact CG2-CG1 4.24Å; I443-V447 WeakPolarHBondContact O-CG2 3.37Å; I443-V447 PolarHBondContact O-N 3.37Å; G444-V447 WeakPolarHBondContact O-CB 3.48Å; G444-V447 PolarHBondContact O-N 3.08Å; G444-V447 VanDerWaalsContact O-N 3.15Å; G445-V447 VanDerWaalsContact C-N 3.32Å; G445-V447 PolarHBondContact O-N 2.62Å; V447-C449 VanDerWaalsContact C-N 3.27Å; V447-C449 PolarHBondContact O-N 2.91Å; V447-L450 VanDerWaalsContact O-CB 3.31Å; V447-L450 WeakPolarHBondContact O-CB 3.46Å; V447-L450 WeakPolarHBondContact O-CG 3.23Å; V447-L450 PolarHBondContact O-N 3.44Å; V447-L450 VanDerWaalsContact O-N 3.14Å |
| 448 | L | 92.3 | Very high | 90.9 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -67.5 | -23.4 | 179.6 | -65.3 | 178.8 | 0 | 0 | 0 | 113.2 | I282 V341 V345 F348 G444 G445 I446 L450 I451 | I282-L448 HydrophobicContact CG1-CD1 4.26Å; V341-L448 HydrophobicContact CG1-CB 4.06Å; V341-L448 WeakPolarHBondContact CG1-O 3.48Å; V345-L448 HydrophobicContact CG2-CB 3.85Å; F348-L448 HydrophobicContact CD2-CD1 3.81Å; F348-L448 HydrophobicContact CE2-CD1 3.56Å; G444-L448 WeakPolarHBondContact O-CG 3.46Å; G444-L448 PolarHBondContact O-N 3.23Å; G445-L448 PolarHBondContact O-N 3.33Å; G445-L448 VanDerWaalsContact O-N 3.16Å; I446-L448 VanDerWaalsContact C-N 3.31Å; I446-L448 PolarHBondContact O-N 2.87Å; L448-L450 PolarHBondContact O-N 2.7Å; L448-L450 VanDerWaalsContact O-N 3.08Å; L448-I451 HydrophobicContact CB-CD1 4.3Å; L448-I451 HydrophobicContact CD2-CD1 3.56Å; L448-I451 WeakPolarHBondContact O-CB 3.27Å; L448-I451 PolarHBondContact O-N 2.9Å |
| 449 | C | 90.9 | Very high | 90.3 | Very high | 49 Ų | 49 | 53.2 Ų | 53.2 | 33% | 0.331 | 26% | 0.263 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59 | -18.9 | 171.4 | -69.5 | 0 | 0 | 0 | 0 | 113.6 | G445 I446 V447 I451 P452 | G445-C449 PolarHBondContact O-N 3.02Å; I446-C449 WeakPolarHBondContact O-CB 3.45Å; I446-C449 PolarHBondContact O-N 3.12Å; V447-C449 VanDerWaalsContact C-N 3.27Å; V447-C449 PolarHBondContact O-N 2.91Å; C449-I451 VanDerWaalsContact C-N 3.27Å; C449-I451 PolarHBondContact O-N 3.37Å; C449-P452 WeakPolarHBondContact O-CD 3.37Å |
| 450 | L | 89.6 | Confident | 89.8 | Confident | 90 Ų | 90 | 58.8 Ų | 58.8 | 47% | 0.471 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -70.5 | -23.4 | 175.2 | -60.9 | 175.7 | 0 | 0 | 0 | 112.5 | I277 V447 L448 W453 V454 | I277-L450 HydrophobicContact CD1-CB 4.43Å; I277-L450 HydrophobicContact CG2-CB 4.5Å; V447-L450 VanDerWaalsContact O-CB 3.31Å; V447-L450 WeakPolarHBondContact O-CB 3.46Å; V447-L450 WeakPolarHBondContact O-CG 3.23Å; V447-L450 PolarHBondContact O-N 3.44Å; V447-L450 VanDerWaalsContact O-N 3.14Å; L448-L450 PolarHBondContact O-N 2.7Å; L448-L450 VanDerWaalsContact O-N 3.08Å; L450-W453 PolarHBondContact O-N 3.24Å; L450-V454 WeakPolarHBondContact O-CB 3.45Å; L450-V454 VanDerWaalsContact O-CG2 3.3Å; L450-V454 WeakPolarHBondContact O-CG2 3.42Å; L450-V454 PolarHBondContact O-N 3.12Å |
| 451 | I | 89.3 | Confident | 89.3 | Confident | 0 Ų | 0 | 62.4 Ų | 62.4 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.1 | -53.8 | -174.8 | -62.3 | 163.3 | 0 | 0 | 0 | 111.9 | I277 W278 V341 L392 L448 C449 W453 V454 E455 | I277-I451 HydrophobicContact CB-CD1 4.46Å; I277-I451 HydrophobicContact CB-CG1 3.86Å; I277-I451 HydrophobicContact CG2-CD1 4.13Å; I277-I451 HydrophobicContact CG2-CG1 3.59Å; W278-I451 HydrophobicContact CB-CD1 3.67Å; W278-I451 HydrophobicContact CG-CD1 4.11Å; V341-I451 HydrophobicContact CG1-CB 4.34Å; V341-I451 HydrophobicContact CG1-CD1 4.18Å; V341-I451 HydrophobicContact CG2-CB 4.34Å; V341-I451 HydrophobicContact CG2-CG2 3.98Å; L392-I451 HydrophobicContact CD2-CG2 4.04Å; L448-I451 HydrophobicContact CB-CD1 4.3Å; L448-I451 HydrophobicContact CD2-CD1 3.56Å; L448-I451 WeakPolarHBondContact O-CB 3.27Å; L448-I451 PolarHBondContact O-N 2.9Å; C449-I451 VanDerWaalsContact C-N 3.27Å; C449-I451 PolarHBondContact O-N 3.37Å; I451-W453 PolarHBondContact O-N 3.44Å; I451-V454 PolarHBondContact O-N 3.15Å; I451-E455 HydrophobicContact CG2-CG 4.5Å; I451-E455 WeakPolarHBondContact O-CB 3.5Å; I451-E455 PolarHBondContact O-N 2.98Å |
| 452 | P | 87.1 | Confident | 88.8 | Confident | 12 Ų | 12 | 68.7 Ų | 68.7 | 8% | 0.078 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -55.1 | -38.4 | 177.1 | -25.6 | 33.4 | 0 | 0 | 0 | 113 | V341 F342 C449 A456 | V341-P452 HydrophobicContact CB-CG 4.1Å; V341-P452 HydrophobicContact CG1-CG 4.47Å; F342-P452 HydrophobicContact CD2-CG 4.35Å; F342-P452 HydrophobicContact CE1-CG 4.49Å; F342-P452 HydrophobicContact CE2-CB 3.97Å; F342-P452 HydrophobicContact CE2-CG 3.81Å; F342-P452 HydrophobicContact CZ-CB 4.1Å; F342-P452 HydrophobicContact CZ-CG 3.9Å; C449-P452 WeakPolarHBondContact O-CD 3.37Å; P452-A456 VanDerWaalsContact O-CB 3.27Å; P452-A456 WeakPolarHBondContact O-CB 3.13Å; P452-A456 PolarHBondContact O-N 3.11Å |
| 453 | W | 86.1 | Confident | 88.3 | Confident | 155 Ų | 155 | 74.1 Ų | 74.1 | 59% | 0.587 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -67 | -47.6 | 178.9 | -179.4 | 78.9 | 0 | 0 | 0 | 112.5 | L450 I451 E455 A456 R457 | L450-W453 PolarHBondContact O-N 3.24Å; I451-W453 PolarHBondContact O-N 3.44Å; W453-E455 VanDerWaalsContact C-N 3.33Å; W453-E455 PolarHBondContact O-N 2.82Å; W453-A456 PolarHBondContact O-N 3.46Å; W453-R457 WeakPolarHBondContact O-CB 3.44Å; W453-R457 PolarHBondContact O-N 2.94Å |
| 454 | V | 88.1 | Confident | 88 | Confident | 19 Ų | 19 | 77 Ų | 77 | 12% | 0.115 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -62 | -42.7 | 177 | 169.2 | 0 | 0 | 0 | 0 | 110.9 | V273 I277 L450 I451 R457 N458 | V273-V454 HydrophobicContact CB-CG1 3.88Å; V273-V454 HydrophobicContact CG1-CG1 3.67Å; I277-V454 HydrophobicContact CD1-CB 4.44Å; I277-V454 HydrophobicContact CD1-CG2 3.85Å; L450-V454 WeakPolarHBondContact O-CB 3.45Å; L450-V454 VanDerWaalsContact O-CG2 3.3Å; L450-V454 WeakPolarHBondContact O-CG2 3.42Å; L450-V454 PolarHBondContact O-N 3.12Å; I451-V454 PolarHBondContact O-N 3.15Å; V454-R457 PolarHBondContact O-N 3Å; V454-N458 PolarHBondContact O-N 2.87Å |
| 455 | E | 86.3 | Confident | 87.7 | Confident | 18 Ų | 18 | 82.5 Ų | 82.5 | 8% | 0.084 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -65.6 | -44.4 | 177.2 | -83.7 | -166.2 | -130.8 | 0 | 0 | 112.9 | S338 L392 I451 W453 R457 N458 R459 | S338-E455 VanDerWaalsContact CB-CD 3.5Å; S338-E455 WeakPolarHBondContact CB-OE1 3.38Å; S338-E455 WeakPolarHBondContact CB-OE2 3.5Å; L392-E455 WeakPolarHBondContact CD2-OE1 3.49Å; I451-E455 HydrophobicContact CG2-CG 4.5Å; I451-E455 WeakPolarHBondContact O-CB 3.5Å; I451-E455 PolarHBondContact O-N 2.98Å; W453-E455 VanDerWaalsContact C-N 3.33Å; W453-E455 PolarHBondContact O-N 2.82Å; E455-R457 PolarHBondContact O-N 2.81Å; E455-N458 PolarHBondContact O-N 2.81Å; E455-R459 WeakPolarHBondContact O-CG 3.46Å; E455-R459 PolarHBondContact O-N 3.13Å; E455-R459 IonicContact OE2-NE 2.62Å; E455-R459 IonicContact OE2-NH2 3.9Å |
| 456 | A | 85.1 | Confident | 87.4 | Confident | 43 Ų | 43 | 84 Ų | 84 | 36% | 0.355 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -58.9 | -40.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111 | P452 W453 R460 | P452-A456 VanDerWaalsContact O-CB 3.27Å; P452-A456 WeakPolarHBondContact O-CB 3.13Å; P452-A456 PolarHBondContact O-N 3.11Å; W453-A456 PolarHBondContact O-N 3.46Å; A456-R460 VanDerWaalsContact O-CG 3.26Å; A456-R460 WeakPolarHBondContact O-CG 3.47Å; A456-R460 PolarHBondContact O-N 3.28Å; A456-R460 VanDerWaalsContact O-N 3.08Å |
| 457 | R | 87.2 | Confident | 87.1 | Confident | 133 Ų | 133 | 82.8 Ų | 82.8 | 50% | 0.502 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -65.1 | -44.1 | 175.3 | -172 | 178.3 | -177 | -173.1 | 0.2 | 112.2 | W453 V454 E455 R460 K461 | W453-R457 WeakPolarHBondContact O-CB 3.44Å; W453-R457 PolarHBondContact O-N 2.94Å; V454-R457 PolarHBondContact O-N 3Å; E455-R457 PolarHBondContact O-N 2.81Å; R457-R460 PolarHBondContact O-N 3.4Å; R457-K461 PolarHBondContact O-N 3.07Å |
| 458 | N | 84.9 | Confident | 86.8 | Confident | 57 Ų | 57 | 82.9 Ų | 82.9 | 31% | 0.305 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -65.7 | -43.1 | 179 | -74.8 | -9.9 | 0 | 0 | 0 | 111.9 | V454 E455 R460 K461 Q462 | V454-N458 PolarHBondContact O-N 2.87Å; E455-N458 PolarHBondContact O-N 2.81Å; N458-R460 VanDerWaalsContact C-N 3.31Å; N458-R460 PolarHBondContact O-N 3.47Å; N458-K461 PolarHBondContact O-N 3.42Å; N458-K461 VanDerWaalsContact O-N 3.17Å; N458-Q462 PolarHBondContact O-N 2.94Å |
| 459 | R | 82.7 | Confident | 86.5 | Confident | 137 Ų | 137 | 89.7 Ų | 89.7 | 52% | 0.517 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -60.2 | -40.8 | 174.5 | -70.3 | 177.8 | -170.3 | -120.2 | 3.6 | 111.7 | E455 Q462 K463 | E455-R459 WeakPolarHBondContact O-CG 3.46Å; E455-R459 PolarHBondContact O-N 3.13Å; E455-R459 IonicContact OE2-NE 2.62Å; E455-R459 IonicContact OE2-NH2 3.9Å; R459-Q462 PolarHBondContact O-N 3.12Å; R459-K463 WeakPolarHBondContact O-CB 3.08Å; R459-K463 PolarHBondContact O-N 2.88Å |
| 460 | R | 86.1 | Confident | 86.2 | Confident | 186 Ų | 186 | 93.8 Ų | 93.8 | 70% | 0.702 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -63.1 | -40.7 | 174.7 | -74.1 | 174 | -175.1 | -170.3 | 2.6 | 112.4 | A456 R457 N458 K464 | A456-R460 VanDerWaalsContact O-CG 3.26Å; A456-R460 WeakPolarHBondContact O-CG 3.47Å; A456-R460 PolarHBondContact O-N 3.28Å; A456-R460 VanDerWaalsContact O-N 3.08Å; R457-R460 PolarHBondContact O-N 3.4Å; N458-R460 VanDerWaalsContact C-N 3.31Å; N458-R460 PolarHBondContact O-N 3.47Å; R460-K464 WeakPolarHBondContact O-CG 3.42Å; R460-K464 PolarHBondContact O-N 2.94Å; R460-K464 VanDerWaalsContact O-N 3.11Å |
| 461 | K | 86.1 | Confident | 86.1 | Confident | 105 Ų | 105 | 95.9 Ų | 95.9 | 46% | 0.457 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.8 | -49.1 | 175.7 | -75.6 | -174.9 | 173.2 | -169.9 | 0 | 111.8 | R457 N458 K463 K464 E465 | R457-K461 PolarHBondContact O-N 3.07Å; N458-K461 PolarHBondContact O-N 3.42Å; N458-K461 VanDerWaalsContact O-N 3.17Å; K461-K463 VanDerWaalsContact C-N 3.31Å; K461-K463 PolarHBondContact O-N 2.93Å; K461-K464 WeakPolarHBondContact O-CB 3.29Å; K461-K464 PolarHBondContact O-N 3.4Å; K461-K464 VanDerWaalsContact O-N 3.1Å; K461-E465 WeakPolarHBondContact O-CG 3.41Å; K461-E465 PolarHBondContact O-N 2.92Å |
| 462 | Q | 83.9 | Confident | 86 | Confident | 132 Ų | 132 | 100 Ų | 100 | 62% | 0.617 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -60.2 | -39.9 | 177.8 | -72.4 | 178.3 | -11 | 0 | 0 | 112.3 | N458 R459 K464 E465 G466 | N458-Q462 PolarHBondContact O-N 2.94Å; R459-Q462 PolarHBondContact O-N 3.12Å; Q462-K464 PolarHBondContact O-N 3.37Å; Q462-E465 PolarHBondContact O-N 3.04Å; Q462-G466 PolarHBondContact O-N 3.27Å |
| 463 | K | 85.8 | Confident | 86.1 | Confident | 151 Ų | 151 | 103.7 Ų | 103.7 | 66% | 0.657 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -63.3 | -40.5 | 175.2 | -170.2 | 173.3 | -178.5 | 177.8 | 0 | 112 | R459 K461 L467 | R459-K463 WeakPolarHBondContact O-CB 3.08Å; R459-K463 PolarHBondContact O-N 2.88Å; K461-K463 VanDerWaalsContact C-N 3.31Å; K461-K463 PolarHBondContact O-N 2.93Å; K463-L467 HydrophobicContact CG-CD1 4.23Å; K463-L467 WeakPolarHBondContact O-CB 3.31Å; K463-L467 WeakPolarHBondContact O-CD1 3.36Å; K463-L467 VanDerWaalsContact O-CG 3.27Å; K463-L467 WeakPolarHBondContact O-CG 3.45Å; K463-L467 PolarHBondContact O-N 3.03Å |
| 464 | K | 87.4 | Confident | 86.1 | Confident | 158 Ų | 158 | 99.6 Ų | 99.6 | 69% | 0.687 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -66.1 | -43.5 | 175.6 | -74.3 | -175.7 | 177.1 | -164.9 | 0 | 112.3 | R460 K461 Q462 L467 S468 | R460-K464 WeakPolarHBondContact O-CG 3.42Å; R460-K464 PolarHBondContact O-N 2.94Å; R460-K464 VanDerWaalsContact O-N 3.11Å; K461-K464 WeakPolarHBondContact O-CB 3.29Å; K461-K464 PolarHBondContact O-N 3.4Å; K461-K464 VanDerWaalsContact O-N 3.1Å; Q462-K464 PolarHBondContact O-N 3.37Å; K464-L467 PolarHBondContact O-N 3.34Å; K464-S468 WeakPolarHBondContact O-CB 3.41Å; K464-S468 PolarHBondContact O-N 3.26Å |
| 465 | E | 86.9 | Confident | 86.2 | Confident | 116 Ų | 116 | 104.3 Ų | 104.3 | 54% | 0.542 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.2 | -38.6 | 176.8 | -71.4 | 170.5 | -169.4 | 0 | 0 | 112 | K461 Q462 S468 K469 | K461-E465 WeakPolarHBondContact O-CG 3.41Å; K461-E465 PolarHBondContact O-N 2.92Å; Q462-E465 PolarHBondContact O-N 3.04Å; E465-S468 PolarHBondContact O-N 2.99Å; E465-K469 WeakPolarHBondContact O-CG 3.42Å; E465-K469 PolarHBondContact O-N 2.92Å |
| 466 | G | 84.2 | Confident | 86.4 | Confident | 35 Ų | 35 | 110 Ų | 110 | 36% | 0.361 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.7 | -48.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q462 S468 K469 E470 | Q462-G466 PolarHBondContact O-N 3.27Å; G466-S468 VanDerWaalsContact C-N 3.33Å; G466-S468 PolarHBondContact O-N 2.87Å; G466-K469 PolarHBondContact O-N 2.88Å; G466-E470 WeakPolarHBondContact O-CB 3.49Å; G466-E470 PolarHBondContact O-N 3.08Å |
| 467 | L | 86.7 | Confident | 86.3 | Confident | 86 Ų | 86 | 113.8 Ų | 113.8 | 45% | 0.45 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -60.6 | -41.2 | 175.8 | -73.6 | 166 | 0 | 0 | 0 | 112.1 | K463 K464 E470 Q471 | K463-L467 HydrophobicContact CG-CD1 4.23Å; K463-L467 WeakPolarHBondContact O-CB 3.31Å; K463-L467 WeakPolarHBondContact O-CD1 3.36Å; K463-L467 VanDerWaalsContact O-CG 3.27Å; K463-L467 WeakPolarHBondContact O-CG 3.45Å; K463-L467 PolarHBondContact O-N 3.03Å; K464-L467 PolarHBondContact O-N 3.34Å; L467-E470 PolarHBondContact O-N 3.08Å; L467-Q471 WeakPolarHBondContact O-CB 3.18Å; L467-Q471 VanDerWaalsContact O-CG 3.29Å; L467-Q471 WeakPolarHBondContact O-CG 3.34Å; L467-Q471 PolarHBondContact O-N 3.48Å |
| 468 | S | 86 | Confident | 86.4 | Confident | 58 Ų | 58 | 111.4 Ų | 111.4 | 41% | 0.406 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.6 | -41.7 | 176.4 | -171.8 | 0 | 0 | 0 | 0 | 112 | K464 E465 G466 Q471 D472 | K464-S468 WeakPolarHBondContact O-CB 3.41Å; K464-S468 PolarHBondContact O-N 3.26Å; E465-S468 PolarHBondContact O-N 2.99Å; G466-S468 VanDerWaalsContact C-N 3.33Å; G466-S468 PolarHBondContact O-N 2.87Å; S468-Q471 PolarHBondContact O-N 3.25Å; S468-D472 PolarHBondContact O-N 3.08Å |
| 469 | K | 86.6 | Confident | 86.6 | Confident | 143 Ų | 143 | 114.4 Ų | 114.4 | 62% | 0.622 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -67.3 | -39.5 | 176.1 | -74.5 | 178.8 | -178.3 | -177.2 | 0 | 112.2 | E465 G466 Q471 D472 V473 | E465-K469 WeakPolarHBondContact O-CG 3.42Å; E465-K469 PolarHBondContact O-N 2.92Å; G466-K469 PolarHBondContact O-N 2.88Å; K469-Q471 VanDerWaalsContact C-N 3.34Å; K469-D472 PolarHBondContact O-N 3.35Å; K469-V473 VanDerWaalsContact O-CG2 3.26Å; K469-V473 WeakPolarHBondContact O-CG2 3.25Å; K469-V473 PolarHBondContact O-N 3.04Å |
| 470 | E | 84.9 | Confident | 86.8 | Confident | 136 Ų | 136 | 113 Ų | 113 | 64% | 0.636 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -65.4 | -40.5 | 177.4 | -164.4 | 171.9 | -171.2 | 0 | 0 | 110.8 | G466 L467 V473 S474 | G466-E470 WeakPolarHBondContact O-CB 3.49Å; G466-E470 PolarHBondContact O-N 3.08Å; L467-E470 PolarHBondContact O-N 3.08Å; E470-V473 PolarHBondContact O-N 3.06Å; E470-S474 WeakPolarHBondContact O-CB 3.26Å; E470-S474 PolarHBondContact O-N 3.47Å |
| 471 | Q | 85.9 | Confident | 86.8 | Confident | 134 Ų | 134 | 110.1 Ų | 110.1 | 63% | 0.626 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -61.5 | -47.3 | 171.1 | -75.2 | 177.4 | -31.5 | 0 | 0 | 112.2 | L467 S468 K469 V473 S474 Q475 | L467-Q471 WeakPolarHBondContact O-CB 3.18Å; L467-Q471 VanDerWaalsContact O-CG 3.29Å; L467-Q471 WeakPolarHBondContact O-CG 3.34Å; L467-Q471 PolarHBondContact O-N 3.48Å; S468-Q471 PolarHBondContact O-N 3.25Å; K469-Q471 VanDerWaalsContact C-N 3.34Å; Q471-V473 VanDerWaalsContact C-N 3.33Å; Q471-V473 PolarHBondContact O-N 2.7Å; Q471-S474 PolarHBondContact O-N 3.02Å; Q471-Q475 WeakPolarHBondContact O-CB 3.37Å; Q471-Q475 PolarHBondContact O-N 3Å |
| 472 | D | 88.1 | Confident | 86.7 | Confident | 86 Ų | 86 | 111.3 Ų | 111.3 | 46% | 0.46 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -59.8 | -40.9 | 176.8 | -81.1 | -7 | 0 | 0 | 0 | 112.3 | S468 K469 K476 | S468-D472 PolarHBondContact O-N 3.08Å; K469-D472 PolarHBondContact O-N 3.35Å; D472-K476 WeakPolarHBondContact O-CB 3.41Å; D472-K476 WeakPolarHBondContact O-CG 3.36Å; D472-K476 PolarHBondContact O-N 2.94Å |
| 473 | V | 88.8 | Confident | 86.7 | Confident | 89 Ų | 89 | 107.8 Ų | 107.8 | 54% | 0.539 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -68.5 | -43.8 | 177.8 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | K469 E470 Q471 Q475 K476 M477 | K469-V473 VanDerWaalsContact O-CG2 3.26Å; K469-V473 WeakPolarHBondContact O-CG2 3.25Å; K469-V473 PolarHBondContact O-N 3.04Å; E470-V473 PolarHBondContact O-N 3.06Å; Q471-V473 VanDerWaalsContact C-N 3.33Å; Q471-V473 PolarHBondContact O-N 2.7Å; V473-Q475 VanDerWaalsContact C-N 3.33Å; V473-Q475 PolarHBondContact O-N 2.81Å; V473-K476 PolarHBondContact O-N 3.24Å; V473-M477 WeakPolarHBondContact O-CG 3.5Å; V473-M477 PolarHBondContact O-N 3.47Å |
| 474 | S | 87.4 | Confident | 86.3 | Confident | 70 Ų | 70 | 106.9 Ų | 106.9 | 49% | 0.49 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.5 | -42.7 | 177.2 | -142.7 | 0 | 0 | 0 | 0 | 111.3 | E470 Q471 M477 I478 | E470-S474 WeakPolarHBondContact O-CB 3.26Å; E470-S474 PolarHBondContact O-N 3.47Å; Q471-S474 PolarHBondContact O-N 3.02Å; S474-M477 PolarHBondContact O-N 3.06Å; S474-I478 WeakPolarHBondContact O-CG1 3.45Å; S474-I478 PolarHBondContact O-N 3.44Å; S474-I478 VanDerWaalsContact O-N 3.08Å |
| 475 | Q | 88.4 | Confident | 85.8 | Confident | 117 Ų | 117 | 105.5 Ų | 105.5 | 55% | 0.547 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65 | -41.8 | 178.1 | -167 | 165 | -9.1 | 0 | 0 | 112.1 | Q471 V473 M477 I478 E479 | Q471-Q475 WeakPolarHBondContact O-CB 3.37Å; Q471-Q475 PolarHBondContact O-N 3Å; V473-Q475 VanDerWaalsContact C-N 3.33Å; V473-Q475 PolarHBondContact O-N 2.81Å; Q475-M477 PolarHBondContact O-N 3.49Å; Q475-I478 PolarHBondContact O-N 3.05Å; Q475-E479 PolarHBondContact O-N 3.42Å |
| 476 | K | 90.7 | Very high | 85.3 | Confident | 137 Ų | 137 | 104.7 Ų | 104.7 | 60% | 0.596 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.4 | -37.1 | 173.3 | -75.7 | 178 | 179.9 | -177.7 | 0 | 113.3 | D472 V473 E479 L480 | D472-K476 WeakPolarHBondContact O-CB 3.41Å; D472-K476 WeakPolarHBondContact O-CG 3.36Å; D472-K476 PolarHBondContact O-N 2.94Å; V473-K476 PolarHBondContact O-N 3.24Å; K476-E479 PolarHBondContact O-N 3.06Å; K476-L480 PolarHBondContact O-N 3.11Å |
| 477 | M | 84.4 | Confident | 84.8 | Confident | 124 Ų | 124 | 105.8 Ų | 105.8 | 61% | 0.611 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -65.7 | -41.7 | 175.9 | -72.1 | -123.9 | -83.3 | 0 | 0 | 111.7 | V473 S474 Q475 E479 L480 E481 | V473-M477 WeakPolarHBondContact O-CG 3.5Å; V473-M477 PolarHBondContact O-N 3.47Å; S474-M477 PolarHBondContact O-N 3.06Å; Q475-M477 PolarHBondContact O-N 3.49Å; M477-E479 VanDerWaalsContact C-N 3.35Å; M477-E479 PolarHBondContact O-N 3.02Å; M477-L480 WeakPolarHBondContact O-CB 3.33Å; M477-L480 PolarHBondContact O-N 2.97Å; M477-E481 PolarHBondContact O-N 3.28Å |
| 478 | I | 89.3 | Confident | 84.1 | Confident | 83 Ų | 83 | 109.6 Ų | 109.6 | 43% | 0.426 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.2 | -40.4 | 175.8 | -65.5 | 164.5 | 0 | 0 | 0 | 111.4 | S474 Q475 L480 E481 K482 | S474-I478 WeakPolarHBondContact O-CG1 3.45Å; S474-I478 PolarHBondContact O-N 3.44Å; S474-I478 VanDerWaalsContact O-N 3.08Å; Q475-I478 PolarHBondContact O-N 3.05Å; I478-L480 VanDerWaalsContact C-N 3.34Å; I478-E481 PolarHBondContact O-N 2.88Å; I478-K482 WeakPolarHBondContact O-CG 3.39Å; I478-K482 PolarHBondContact O-N 3.38Å |
| 479 | E | 87.8 | Confident | 83.3 | Confident | 119 Ų | 119 | 112.1 Ų | 112.1 | 56% | 0.556 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -64.3 | -38.3 | 175.6 | -75.1 | 177.6 | 179.8 | 0 | 0 | 112.3 | Q475 K476 M477 A483 | Q475-E479 PolarHBondContact O-N 3.42Å; K476-E479 PolarHBondContact O-N 3.06Å; M477-E479 VanDerWaalsContact C-N 3.35Å; M477-E479 PolarHBondContact O-N 3.02Å; E479-A483 WeakPolarHBondContact O-CB 3.45Å; E479-A483 PolarHBondContact O-N 2.86Å |
| 480 | L | 86.4 | Confident | 82.3 | Confident | 109 Ų | 109 | 112.9 Ų | 112.9 | 57% | 0.571 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -64.9 | -43.9 | 174.2 | -96.6 | 148.5 | 0 | 0 | 0 | 112.4 | K476 M477 I478 A483 Q484 | K476-L480 PolarHBondContact O-N 3.11Å; M477-L480 WeakPolarHBondContact O-CB 3.33Å; M477-L480 PolarHBondContact O-N 2.97Å; I478-L480 VanDerWaalsContact C-N 3.34Å; L480-A483 PolarHBondContact O-N 3.41Å; L480-Q484 WeakPolarHBondContact O-CG 3.48Å; L480-Q484 PolarHBondContact O-N 2.96Å |
| 481 | E | 86.1 | Confident | 81 | Confident | 125 Ų | 125 | 116.3 Ų | 116.3 | 58% | 0.584 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -61.5 | -45.3 | 175.8 | -76.5 | -179.3 | 160.2 | 0 | 0 | 111.5 | M477 I478 A483 Q484 E485 | M477-E481 PolarHBondContact O-N 3.28Å; I478-E481 PolarHBondContact O-N 2.88Å; E481-A483 PolarHBondContact O-N 2.93Å; E481-Q484 WeakPolarHBondContact O-CB 3.35Å; E481-Q484 PolarHBondContact O-N 3.37Å; E481-Q484 VanDerWaalsContact O-N 3.17Å; E481-E485 PolarHBondContact O-N 3.02Å |
| 482 | K | 85.8 | Confident | 79.6 | Confident | 129 Ų | 129 | 112 Ų | 112 | 56% | 0.561 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -60.8 | -43.8 | 175.1 | -75.5 | -178.7 | 178.8 | -178.3 | 0 | 112.4 | I478 Q484 E485 D486 | I478-K482 WeakPolarHBondContact O-CG 3.39Å; I478-K482 PolarHBondContact O-N 3.38Å; K482-Q484 VanDerWaalsContact C-N 3.26Å; K482-Q484 PolarHBondContact O-N 3.46Å; K482-E485 PolarHBondContact O-N 2.8Å; K482-D486 WeakPolarHBondContact O-CB 3.43Å; K482-D486 PolarHBondContact O-N 3.26Å |
| 483 | A | 82.3 | Confident | 78 | Confident | 59 Ų | 59 | 114.1 Ų | 114.1 | 49% | 0.488 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.2 | -33.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | E479 L480 E481 A487 | E479-A483 WeakPolarHBondContact O-CB 3.45Å; E479-A483 PolarHBondContact O-N 2.86Å; L480-A483 PolarHBondContact O-N 3.41Å; E481-A483 PolarHBondContact O-N 2.93Å; A483-A487 VanDerWaalsContact O-CB 3.3Å; A483-A487 WeakPolarHBondContact O-CB 3.36Å; A483-A487 PolarHBondContact O-N 3.17Å |
| 484 | Q | 77.7 | Confident | 76.2 | Confident | 131 Ų | 131 | 114.5 Ų | 114.5 | 61% | 0.612 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -71.7 | -41.6 | 174.3 | -74.7 | -180 | -14.9 | 0 | 0 | 112.4 | L480 E481 K482 A487 K488 | L480-Q484 WeakPolarHBondContact O-CG 3.48Å; L480-Q484 PolarHBondContact O-N 2.96Å; E481-Q484 WeakPolarHBondContact O-CB 3.35Å; E481-Q484 PolarHBondContact O-N 3.37Å; E481-Q484 VanDerWaalsContact O-N 3.17Å; K482-Q484 VanDerWaalsContact C-N 3.26Å; K482-Q484 PolarHBondContact O-N 3.46Å; Q484-A487 PolarHBondContact O-N 3.34Å; Q484-K488 WeakPolarHBondContact O-CB 3.35Å; Q484-K488 PolarHBondContact O-N 2.88Å |
| 485 | E | 77.8 | Confident | 74.4 | Confident | 130 Ų | 130 | 117.1 Ų | 117.1 | 61% | 0.607 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -61.5 | -45.8 | 173 | -79.4 | -172.3 | 152.9 | 0 | 0 | 111.6 | E481 K482 A487 K488 N489 | E481-E485 PolarHBondContact O-N 3.02Å; K482-E485 PolarHBondContact O-N 2.8Å; E485-A487 VanDerWaalsContact C-N 3.32Å; E485-A487 PolarHBondContact O-N 3Å; E485-K488 PolarHBondContact O-N 3.04Å; E485-K488 VanDerWaalsContact O-N 3.11Å; E485-N489 PolarHBondContact O-N 3.07Å |
| 486 | D | 76.9 | Confident | 72.3 | Confident | 98 Ų | 98 | 122 Ų | 122 | 52% | 0.524 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -61.8 | -40.1 | 176.5 | -75.9 | -20.2 | 0 | 0 | 0 | 111.9 | K482 K488 K490 | K482-D486 WeakPolarHBondContact O-CB 3.43Å; K482-D486 PolarHBondContact O-N 3.26Å; D486-K488 VanDerWaalsContact C-N 3.33Å; D486-K490 WeakPolarHBondContact O-CB 3.3Å; D486-K490 WeakPolarHBondContact O-CG 3.5Å; D486-K490 PolarHBondContact O-N 3.24Å; D486-K490 VanDerWaalsContact O-N 3.07Å |
| 487 | A | 73.4 | Confident | 71.4 | Confident | 58 Ų | 58 | 121.3 Ų | 121.3 | 48% | 0.479 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -66.9 | -34.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | A483 Q484 E485 R491 | A483-A487 VanDerWaalsContact O-CB 3.3Å; A483-A487 WeakPolarHBondContact O-CB 3.36Å; A483-A487 PolarHBondContact O-N 3.17Å; Q484-A487 PolarHBondContact O-N 3.34Å; E485-A487 VanDerWaalsContact C-N 3.32Å; E485-A487 PolarHBondContact O-N 3Å; A487-R491 PolarHBondContact O-N 3.15Å |
| 488 | K | 71.8 | Confident | 70.7 | Confident | 166 Ų | 166 | 121.1 Ų | 121.1 | 72% | 0.722 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -73 | -41.1 | 178.5 | -155.9 | 176.7 | -174.5 | -177.6 | 0 | 111.6 | Q484 E485 D486 R491 G492 | Q484-K488 WeakPolarHBondContact O-CB 3.35Å; Q484-K488 PolarHBondContact O-N 2.88Å; E485-K488 PolarHBondContact O-N 3.04Å; E485-K488 VanDerWaalsContact O-N 3.11Å; D486-K488 VanDerWaalsContact C-N 3.33Å; K488-R491 PolarHBondContact O-N 3.22Å; K488-G492 PolarHBondContact O-N 3.23Å |
| 489 | N | 68.9 | Low | 69.6 | Low | 111 Ų | 111 | 123.2 Ų | 123.2 | 59% | 0.594 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -62.2 | -45.2 | 173.5 | -85.3 | -10.9 | 0 | 0 | 0 | 111.7 | E485 R491 G492 D493 | E485-N489 PolarHBondContact O-N 3.07Å; N489-R491 PolarHBondContact O-N 3.06Å; N489-G492 PolarHBondContact O-N 3.24Å; N489-G492 VanDerWaalsContact O-N 3.15Å; N489-D493 PolarHBondContact O-N 3.09Å |
| 490 | K | 66.4 | Low | 68.6 | Low | 160 Ų | 160 | 123.5 Ų | 123.5 | 70% | 0.696 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -61.4 | -28.2 | 175.5 | -75.7 | 178.1 | -180 | 177.6 | 0 | 113.9 | D486 S494 | D486-K490 WeakPolarHBondContact O-CB 3.3Å; D486-K490 WeakPolarHBondContact O-CG 3.5Å; D486-K490 PolarHBondContact O-N 3.24Å; D486-K490 VanDerWaalsContact O-N 3.07Å; K490-S494 PolarHBondContact O-OG 3.49Å |
| 491 | R | 57.4 | Low | 67.5 | Low | 207 Ų | 207 | 124.4 Ų | 124.4 | 78% | 0.781 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -83 | -26.2 | 177.9 | -149.9 | 175.7 | -168.8 | -172.5 | 2.6 | 112.8 | A487 K488 N489 | A487-R491 PolarHBondContact O-N 3.15Å; K488-R491 PolarHBondContact O-N 3.22Å; N489-R491 PolarHBondContact O-N 3.06Å |
| 492 | G | 55.9 | Low | 66.2 | Low | 43 Ų | 43 | 124.3 Ų | 124.3 | 44% | 0.443 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -71.2 | -37.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | K488 N489 S494 V495 | K488-G492 PolarHBondContact O-N 3.23Å; N489-G492 PolarHBondContact O-N 3.24Å; N489-G492 VanDerWaalsContact O-N 3.15Å; G492-S494 PolarHBondContact O-N 3.44Å; G492-V495 PolarHBondContact O-N 3.36Å |
| 493 | D | 53.8 | Low | 64.8 | Low | 132 Ų | 132 | 124 Ų | 124 | 71% | 0.706 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -2.1 | 178.7 | -73.2 | -18.1 | 0 | 0 | 0 | 114.2 | N489 | N489-D493 PolarHBondContact O-N 3.09Š|
| 494 | S | 50.9 | Low | 63.5 | Low | 96 Ų | 96 | 129 Ų | 129 | 67% | 0.671 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101 | 6.6 | 177.4 | -59.6 | 0 | 0 | 0 | 0 | 114 | K490 G492 | K490-S494 PolarHBondContact O-OG 3.49Å; G492-S494 PolarHBondContact O-N 3.44Å |
| 495 | V | 50.8 | Low | 62.3 | Low | 126 Ų | 126 | 128.8 Ų | 128.8 | 76% | 0.764 | 68% | 0.678 | S | S | * | * | trans | -119.4 | 7.8 | -177.9 | -169.6 | 0 | 0 | 0 | 0 | 112.7 | G492 | G492-V495 PolarHBondContact O-N 3.36Š| ||
| 496 | L | 43.3 | Very low | 60.9 | Low | 219 Ų | 219 | 128.7 Ų | 128.7 | 100% | 1.147 | 68% | 0.684 | S | S | * | * | trans | -110.4 | 0 | 165.4 | -75.4 | 165.8 | 0 | 0 | 0 | 108.7 |
Retrieved 496 of 496 residues in 704.8 ms
(Link to these results)