| 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 | 48.5 | Very low | 44.5 | Very low | 245 Ų | 245 | 189.7 Ų | 189.7 | 100% | 1.207 | 90% | 0.901 | S | S | * | * | 0 | 114.5 | 0 | -73.4 | 173.2 | -169.7 | 0 | 0 | 108.6 | |||||
| 2 | R | 45 | Very low | 44.9 | Very low | 253 Ų | 253 | 186.3 Ų | 186.3 | 96% | 0.955 | 89% | 0.889 | S | S | * | * | P | Polyproline II helix | trans | -82 | 119.7 | -179.2 | -71.8 | 178.8 | -177.1 | 152.5 | 0.7 | 109.1 | M4 | R2-M4 PolarHBondContact O-N 3.46Š|
| 3 | R | 41.9 | Very low | 44.9 | Very low | 248 Ų | 248 | 180.5 Ų | 180.5 | 94% | 0.936 | 88% | 0.876 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 117.5 | 168.6 | -63.4 | -174 | -163.3 | -172.4 | 4.7 | 107.9 | A5 | R3-A5 PolarHBondContact O-N 3.42Š|
| 4 | M | 42.1 | Very low | 45.2 | Very low | 187 Ų | 187 | 182.1 Ų | 182.1 | 92% | 0.921 | 88% | 0.877 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 121.9 | 170.4 | -71.7 | -142.4 | -134.6 | 0 | 0 | 108.9 | R2 | R2-M4 PolarHBondContact O-N 3.46Š|
| 5 | A | 45.4 | Very low | 45.3 | Very low | 80 Ų | 80 | 181.2 Ų | 181.2 | 66% | 0.661 | 87% | 0.871 | S | S | * | * | P | Polyproline II helix | trans | -74 | 121.7 | 171.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | R3 K7 | R3-A5 PolarHBondContact O-N 3.42Å; A5-K7 HydrophobicContact CB-CG 4.45Å; A5-K7 PolarHBondContact O-N 3.27Å |
| 6 | L | 42.8 | Very low | 45.2 | Very low | 186 Ų | 186 | 174.4 Ų | 174.4 | 97% | 0.974 | 86% | 0.863 | S | S | * | * | trans | -67 | 80.8 | 167 | -80.8 | 152 | 0 | 0 | 0 | 109.2 | ||||
| 7 | K | 45.3 | Very low | 45.2 | Very low | 178 Ų | 178 | 176.6 Ų | 176.6 | 77% | 0.774 | 86% | 0.861 | S | S | * | * | trans | -108.6 | 94.9 | 164.8 | -69.7 | -175 | 179.5 | -175.2 | 0 | 107 | A5 | A5-K7 HydrophobicContact CB-CG 4.45Å; A5-K7 PolarHBondContact O-N 3.27Å | ||
| 8 | K | 47 | Very low | 45.3 | Very low | 204 Ų | 204 | 175.5 Ų | 175.5 | 89% | 0.887 | 86% | 0.859 | S | S | * | * | trans | 167.1 | 77.6 | 154.3 | -91 | 161.2 | -166.5 | -163.4 | 0 | 109.7 | K10 | K8-K10 PolarHBondContact O-N 3.15Š| ||
| 9 | L | 39.8 | Very low | 45.2 | Very low | 181 Ų | 181 | 174.4 Ų | 174.4 | 95% | 0.948 | 86% | 0.856 | S | S | * | * | trans | -74.8 | 105.8 | 155.9 | -153.4 | 77.1 | 0 | 0 | 0 | 106 | ||||
| 10 | K | 47.5 | Very low | 45.4 | Very low | 188 Ų | 188 | 168.5 Ų | 168.5 | 82% | 0.817 | 83% | 0.828 | S | S | * | * | trans | -81.7 | 117.6 | -175.8 | -159.1 | 165.6 | -179.7 | 172.3 | 0 | 107.5 | K8 I12 | K8-K10 PolarHBondContact O-N 3.15Å; K10-I12 PolarHBondContact O-N 3.44Å | ||
| 11 | V | 43.7 | Very low | 45.4 | Very low | 137 Ų | 137 | 166.2 Ų | 166.2 | 83% | 0.83 | 82% | 0.819 | S | S | * | * | trans | -27.4 | 116.4 | 170.9 | 178.9 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 12 | I | 49.4 | Very low | 45.4 | Very low | 149 Ų | 149 | 159 Ų | 159 | 76% | 0.764 | 79% | 0.785 | S | S | * | * | trans | -90.3 | 127.3 | 171.6 | -60.4 | 173.9 | 0 | 0 | 0 | 107.4 | K10 | K10-I12 PolarHBondContact O-N 3.44Š| ||
| 13 | P | 45.4 | Very low | 45.4 | Very low | 110 Ų | 110 | 154.7 Ų | 154.7 | 71% | 0.714 | 77% | 0.774 | S | S | * | * | trans | -64.2 | 143 | -179.6 | -18.4 | 31 | 0 | 0 | 0 | 112.8 | E15 | P13-E15 VanDerWaalsContact C-N 3.29Å; P13-E15 PolarHBondContact O-N 3.5Å | ||
| 14 | K | 49.5 | Very low | 45.6 | Very low | 204 Ų | 204 | 149.6 Ų | 149.6 | 89% | 0.887 | 77% | 0.765 | S | S | * | * | trans | -82.7 | 26 | -170.9 | -74.6 | -173.8 | 171.2 | -176.2 | 0 | 115.4 | ||||
| 15 | E | 46.1 | Very low | 46 | Very low | 168 Ų | 168 | 147.4 Ų | 147.4 | 79% | 0.785 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -110.1 | 108.3 | -179.9 | -112.6 | 68.9 | -145.1 | 0 | 0 | 110.5 | P13 | P13-E15 VanDerWaalsContact C-N 3.29Å; P13-E15 PolarHBondContact O-N 3.5Å |
| 16 | G | 43.6 | Very low | 46.2 | Very low | 72 Ų | 72 | 151 Ų | 151 | 74% | 0.742 | 76% | 0.76 | S | S | * | * | S | Bend | trans | 105.4 | 6.8 | 150.8 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||
| 17 | Y | 46 | Very low | 46.5 | Very low | 213 Ų | 213 | 149.6 Ų | 149.6 | 84% | 0.835 | 75% | 0.754 | S | S | * | * | trans | -131.5 | 116.4 | 175.2 | -63.2 | -84.1 | 0 | 0 | 0 | 111.7 | L19 | Y17-L19 VanDerWaalsContact C-N 3.31Å; Y17-L19 PolarHBondContact O-N 3.35Å | ||
| 18 | L | 46.7 | Very low | 46.6 | Very low | 156 Ų | 156 | 148.1 Ų | 148.1 | 82% | 0.817 | 75% | 0.754 | S | S | * | * | trans | -60.1 | 95.2 | 161.5 | -84.2 | 162.5 | 0 | 0 | 0 | 108.3 | L20 | L18-L20 HydrophobicContact CB-CD1 3.94Å; L18-L20 HydrophobicContact CB-CG 4.43Å; L18-L20 HydrophobicContact CD1-CD1 4.24Å; L18-L20 HydrophobicContact CD2-CD1 3.94Å; L18-L20 HydrophobicContact CD2-CG 4.39Å; L18-L20 HydrophobicContact CG-CD1 4.27Å; L18-L20 PolarHBondContact O-N 3.34Å | ||
| 19 | L | 43.2 | Very low | 46.6 | Very low | 155 Ų | 155 | 146.3 Ų | 146.3 | 81% | 0.812 | 75% | 0.754 | S | S | * | * | trans | -67.4 | 83.8 | 158.4 | -84.4 | 163.7 | 0 | 0 | 0 | 107.4 | Y17 L21 | Y17-L19 VanDerWaalsContact C-N 3.31Å; Y17-L19 PolarHBondContact O-N 3.35Å; L19-L21 VanDerWaalsContact C-N 3.34Å | ||
| 20 | L | 48.2 | Very low | 47 | Very low | 56 Ų | 56 | 144.6 Ų | 144.6 | 29% | 0.293 | 74% | 0.744 | S | S | . | * | trans | -98.1 | 74.2 | 162.7 | -73.9 | 149.4 | 0 | 0 | 0 | 107.2 | L18 D22 R147 | L18-L20 HydrophobicContact CB-CD1 3.94Å; L18-L20 HydrophobicContact CB-CG 4.43Å; L18-L20 HydrophobicContact CD1-CD1 4.24Å; L18-L20 HydrophobicContact CD2-CD1 3.94Å; L18-L20 HydrophobicContact CD2-CG 4.39Å; L18-L20 HydrophobicContact CG-CD1 4.27Å; L18-L20 PolarHBondContact O-N 3.34Å; L20-D22 WeakPolarHBondContact CD2-OD1 3.36Å; L20-D22 PolarHBondContact O-N 3.31Å; L20-D22 VanDerWaalsContact O-N 3.13Å; L20-R147 VanDerWaalsContact CD1-NH2 3.33Å | ||
| 21 | L | 46.7 | Very low | 46.8 | Very low | 121 Ų | 121 | 145.2 Ų | 145.2 | 63% | 0.634 | 75% | 0.747 | S | S | * | * | trans | -75.5 | 75 | 149.9 | -71.3 | 169.9 | 0 | 0 | 0 | 106 | L19 F23 | L19-L21 VanDerWaalsContact C-N 3.34Å; L21-F23 HydrophobicContact CB-CD2 4.1Å; L21-F23 HydrophobicContact CB-CE2 3.84Å; L21-F23 HydrophobicContact CD1-CE2 4.24Å; L21-F23 HydrophobicContact CD2-CE2 4.45Å; L21-F23 HydrophobicContact CG-CE2 4.41Å; L21-F23 PolarHBondContact O-N 3.03Å | ||
| 22 | D | 47.2 | Very low | 46.8 | Very low | 94 Ų | 94 | 144.7 Ų | 144.7 | 50% | 0.503 | 74% | 0.744 | S | S | . | * | trans | -73.8 | 91.1 | 162 | -63.7 | -26.8 | 0 | 0 | 0 | 104.6 | L20 D24 R147 | L20-D22 WeakPolarHBondContact CD2-OD1 3.36Å; L20-D22 PolarHBondContact O-N 3.31Å; L20-D22 VanDerWaalsContact O-N 3.13Å; D22-D24 VanDerWaalsContact C-N 3.34Å; D22-D24 PolarHBondContact O-N 3.47Å; D22-D24 VanDerWaalsContact O-N 3.16Å; D22-R147 IonicContact OD2-NH2 3.85Å; D22-R147 PolarHBondContact OD2-NH2 3.38Å | ||
| 23 | F | 46 | Very low | 46.4 | Very low | 162 Ų | 162 | 142.5 Ų | 142.5 | 71% | 0.711 | 74% | 0.742 | S | S | * | * | trans | -67.7 | 103.3 | 159.4 | -71.9 | -87.3 | 0 | 0 | 0 | 105 | L21 D25 | L21-F23 HydrophobicContact CB-CD2 4.1Å; L21-F23 HydrophobicContact CB-CE2 3.84Å; L21-F23 HydrophobicContact CD1-CE2 4.24Å; L21-F23 HydrophobicContact CD2-CE2 4.45Å; L21-F23 HydrophobicContact CG-CE2 4.41Å; L21-F23 PolarHBondContact O-N 3.03Å; F23-D25 PolarHBondContact O-N 3.02Å | ||
| 24 | D | 46.4 | Very low | 46.2 | Very low | 141 Ų | 141 | 146.5 Ų | 146.5 | 75% | 0.754 | 75% | 0.751 | S | S | * | * | trans | -60.7 | 81.5 | 162.3 | -82.9 | -29.1 | 0 | 0 | 0 | 107 | D22 | D22-D24 VanDerWaalsContact C-N 3.34Å; D22-D24 PolarHBondContact O-N 3.47Å; D22-D24 VanDerWaalsContact O-N 3.16Å | ||
| 25 | D | 51.1 | Low | 45.6 | Very low | 141 Ų | 141 | 145.6 Ų | 145.6 | 75% | 0.754 | 75% | 0.75 | S | S | * | * | trans | -88 | 106.5 | 158.4 | -96 | -17.6 | 0 | 0 | 0 | 106.5 | F23 | F23-D25 PolarHBondContact O-N 3.02Š| ||
| 26 | E | 48.9 | Very low | 45.2 | Very low | 154 Ų | 154 | 142 Ų | 142 | 72% | 0.72 | 75% | 0.749 | S | S | * | * | trans | 59.3 | 107.8 | 144.4 | -57.7 | -74.8 | 147.8 | 0 | 0 | 117.4 | D28 | E26-D28 PolarHBondContact O-N 3.35Š| ||
| 27 | D | 48.4 | Very low | 44.8 | Very low | 158 Ų | 158 | 147.5 Ų | 147.5 | 85% | 0.845 | 76% | 0.76 | S | S | * | * | trans | 8.3 | 73.5 | 136.8 | -61.6 | -41.3 | 0 | 0 | 0 | 117.2 | ||||
| 28 | D | 48.6 | Very low | 44.8 | Very low | 146 Ų | 146 | 141.8 Ų | 141.8 | 78% | 0.781 | 75% | 0.751 | S | S | * | * | trans | -106.1 | 100.8 | 160.7 | -92.3 | -24 | 0 | 0 | 0 | 108.9 | E26 I30 | E26-D28 PolarHBondContact O-N 3.35Å; D28-I30 VanDerWaalsContact C-N 3.28Å; D28-I30 PolarHBondContact O-N 2.94Å | ||
| 29 | D | 45.7 | Very low | 44.4 | Very low | 167 Ų | 167 | 143.4 Ų | 143.4 | 89% | 0.893 | 76% | 0.755 | S | S | * | * | trans | -53.3 | 84.7 | 167.2 | -77.5 | -44.8 | 0 | 0 | 0 | 110.9 | K31 | D29-K31 VanDerWaalsContact C-N 3.28Å; D29-K31 PolarHBondContact O-N 3.16Å | ||
| 30 | I | 48.4 | Very low | 44.4 | Very low | 144 Ų | 144 | 142.5 Ų | 142.5 | 74% | 0.738 | 76% | 0.756 | S | S | * | * | trans | -76.4 | 89.4 | 169.5 | -56.6 | 176.9 | 0 | 0 | 0 | 108 | D28 V32 | D28-I30 VanDerWaalsContact C-N 3.28Å; D28-I30 PolarHBondContact O-N 2.94Å; I30-V32 VanDerWaalsContact C-N 3.33Å; I30-V32 HydrophobicContact CG2-CG2 4.13Å; I30-V32 PolarHBondContact O-N 2.94Å | ||
| 31 | K | 44.1 | Very low | 44.3 | Very low | 201 Ų | 201 | 149.4 Ų | 149.4 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | trans | -60.7 | 90.5 | 165.3 | -140.4 | -172.7 | -169.4 | -165.4 | 0 | 108.9 | D29 S33 | D29-K31 VanDerWaalsContact C-N 3.28Å; D29-K31 PolarHBondContact O-N 3.16Å; K31-S33 PolarHBondContact O-N 3.42Å | ||
| 32 | V | 42.6 | Very low | 44.4 | Very low | 126 Ų | 126 | 149 Ų | 149 | 76% | 0.764 | 79% | 0.79 | S | S | * | * | trans | -71.5 | 99 | 170 | 177.3 | 0 | 0 | 0 | 0 | 107.9 | I30 E34 | I30-V32 VanDerWaalsContact C-N 3.33Å; I30-V32 HydrophobicContact CG2-CG2 4.13Å; I30-V32 PolarHBondContact O-N 2.94Å; V32-E34 PolarHBondContact O-N 3.22Å | ||
| 33 | S | 41.8 | Very low | 44.4 | Very low | 104 Ų | 104 | 149.9 Ų | 149.9 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | trans | -62.4 | 115.2 | 166.4 | 37.1 | 0 | 0 | 0 | 0 | 110 | K31 E35 | K31-S33 PolarHBondContact O-N 3.42Å; S33-E35 VanDerWaalsContact C-N 3.34Å; S33-E35 PolarHBondContact O-N 2.91Å | ||
| 34 | E | 40.8 | Very low | 44 | Very low | 193 Ų | 193 | 146.9 Ų | 146.9 | 90% | 0.902 | 81% | 0.807 | S | S | * | * | trans | -68.5 | 81.8 | 170.2 | -175.8 | -179 | -177.9 | 0 | 0 | 109.7 | V32 | V32-E34 PolarHBondContact O-N 3.22Š| ||
| 35 | E | 37.2 | Very low | 44.1 | Very low | 186 Ų | 186 | 150 Ų | 150 | 87% | 0.869 | 81% | 0.814 | S | S | * | * | trans | -161 | 82.5 | 171.6 | -122.1 | 176 | -166.4 | 0 | 0 | 111.2 | S33 | S33-E35 VanDerWaalsContact C-N 3.34Å; S33-E35 PolarHBondContact O-N 2.91Å | ||
| 36 | A | 37.2 | Very low | 43.9 | Very low | 92 Ų | 92 | 149.6 Ų | 149.6 | 76% | 0.76 | 81% | 0.811 | S | S | * | * | trans | 179.7 | 71.1 | 153.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 37 | L | 36.2 | Very low | 43.8 | Very low | 187 Ų | 187 | 150.6 Ų | 150.6 | 98% | 0.979 | 81% | 0.814 | S | S | * | * | trans | -96.2 | 83.9 | 156.6 | -71.4 | 177.3 | 0 | 0 | 0 | 108.2 | ||||
| 38 | S | 45.9 | Very low | 43.4 | Very low | 93 Ų | 93 | 150.2 Ų | 150.2 | 65% | 0.65 | 81% | 0.811 | S | S | * | * | trans | -147.9 | 115.2 | 163.3 | 64.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 39 | E | 38.4 | Very low | 43.3 | Very low | 190 Ų | 190 | 151.7 Ų | 151.7 | 89% | 0.888 | 81% | 0.814 | S | S | * | * | trans | 56.4 | 85.7 | 152.4 | -69.2 | -180 | 135.7 | 0 | 0 | 118 | ||||
| 40 | V | 42.6 | Very low | 43.2 | Very low | 137 Ų | 137 | 151.2 Ų | 151.2 | 83% | 0.83 | 81% | 0.811 | S | S | * | * | trans | -122.8 | 103.4 | 147.5 | 178.1 | 0 | 0 | 0 | 0 | 109.5 | S42 | V40-S42 PolarHBondContact O-N 2.95Š| ||
| 41 | K | 46.5 | Very low | 43 | Very low | 201 Ų | 201 | 151.9 Ų | 151.9 | 87% | 0.874 | 82% | 0.815 | S | S | * | * | trans | -61.8 | 112.3 | 168.4 | -172.4 | 173.5 | -174.9 | 175 | 0 | 109.1 | ||||
| 42 | S | 49.2 | Very low | 42.7 | Very low | 111 Ų | 111 | 147.4 Ų | 147.4 | 78% | 0.776 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 133.3 | 177.5 | -27.5 | 0 | 0 | 0 | 0 | 111 | V40 | V40-S42 PolarHBondContact O-N 2.95Š|
| 43 | P | 45.4 | Very low | 42.7 | Very low | 114 Ų | 114 | 147.2 Ų | 147.2 | 74% | 0.74 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -98.1 | 139.3 | 153.7 | 30.2 | -18.4 | 0 | 0 | 0 | 110.1 | ||
| 44 | A | 37.9 | Very low | 42.5 | Very low | 99 Ų | 99 | 151.4 Ų | 151.4 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 142.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 45 | F | 49.5 | Very low | 42.2 | Very low | 206 Ų | 206 | 146.4 Ų | 146.4 | 90% | 0.904 | 81% | 0.81 | S | S | * | * | trans | -126.1 | 123.1 | 160.2 | -102.8 | -87.2 | 0 | 0 | 0 | 110.2 | ||||
| 46 | D | 46.9 | Very low | 42.4 | Very low | 132 Ų | 132 | 146.4 Ų | 146.4 | 71% | 0.706 | 81% | 0.809 | S | S | * | * | trans | -79.9 | 131.2 | 175.8 | -95.2 | -53.2 | 0 | 0 | 0 | 111.7 | ||||
| 47 | K | 47.1 | Very low | 42.5 | Very low | 176 Ų | 176 | 146.3 Ų | 146.3 | 77% | 0.765 | 81% | 0.809 | S | S | * | * | trans | 42.3 | 139.4 | 137 | -59.4 | 178.1 | -175.1 | 170.3 | 0 | 122.5 | ||||
| 48 | N | 40.2 | Very low | 43 | Very low | 150 Ų | 150 | 144.4 Ų | 144.4 | 80% | 0.802 | 80% | 0.8 | S | S | * | * | trans | 88.6 | 134.1 | 169.8 | 84.4 | 33.7 | 0 | 0 | 0 | 113 | ||||
| 49 | E | 45.2 | Very low | 43.2 | Very low | 177 Ų | 177 | 148.4 Ų | 148.4 | 83% | 0.827 | 81% | 0.808 | S | S | * | * | cis | -139.7 | 144.3 | 32.4 | -74.3 | 171.9 | 132.7 | 0 | 0 | 113.9 | ||||
| 50 | N | 43 | Very low | 43.4 | Very low | 156 Ų | 156 | 145.2 Ų | 145.2 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | trans | -21.3 | 105.6 | 155.5 | -166.4 | 16.2 | 0 | 0 | 0 | 118.7 | ||||
| 51 | I | 44.8 | Very low | 43.8 | Very low | 159 Ų | 159 | 147.5 Ų | 147.5 | 82% | 0.815 | 80% | 0.801 | S | S | * | * | trans | -149.3 | 108.2 | 147.1 | -54 | -178.3 | 0 | 0 | 0 | 108.9 | ||||
| 52 | S | 38 | Very low | 43.8 | Very low | 107 Ų | 107 | 140.6 Ų | 140.6 | 75% | 0.748 | 79% | 0.787 | S | S | * | * | trans | -89.7 | 148.8 | 158.8 | -67.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 53 | P | 43.4 | Very low | 43.6 | Very low | 122 Ų | 122 | 142.4 Ų | 142.4 | 79% | 0.792 | 79% | 0.788 | S | S | * | * | -130.1 | 142.2 | 109.8 | 8.7 | 12.5 | 0 | 0 | 0 | 113.9 | |||||
| 54 | Q | 36.8 | Very low | 43.7 | Very low | 192 Ų | 192 | 144.8 Ų | 144.8 | 90% | 0.897 | 79% | 0.789 | S | S | * | * | trans | -47.3 | 157.9 | 154.3 | -60.9 | 167 | -89.4 | 0 | 0 | 110.4 | ||||
| 55 | A | 35.1 | Very low | 44.2 | Very low | 88 Ų | 88 | 144.9 Ų | 144.9 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | cis | -144.5 | 163.5 | 5.3 | 0 | 0 | 0 | 0 | 0 | 104.5 | ||||
| 56 | E | 41.6 | Very low | 44 | Very low | 185 Ų | 185 | 142.2 Ų | 142.2 | 86% | 0.864 | 78% | 0.775 | S | S | * | * | -156.8 | 143.1 | 78.9 | -59.2 | -144.7 | 155.8 | 0 | 0 | 109.9 | |||||
| 57 | A | 38.6 | Very low | 44.1 | Very low | 91 Ų | 91 | 140.4 Ų | 140.4 | 75% | 0.752 | 77% | 0.772 | S | S | * | * | trans | -76.7 | 123.6 | 173 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 58 | D | 46.3 | Very low | 44 | Very low | 147 Ų | 147 | 140.9 Ų | 140.9 | 79% | 0.786 | 78% | 0.78 | S | S | * | * | trans | -140.7 | 91.5 | 155.5 | -78.4 | -33 | 0 | 0 | 0 | 103.7 | ||||
| 59 | E | 49.9 | Very low | 44.1 | Very low | 177 Ų | 177 | 141.6 Ų | 141.6 | 83% | 0.827 | 78% | 0.782 | S | S | * | * | 67.2 | 106 | 96.4 | -68 | -160.1 | -179.1 | 0 | 0 | 112.7 | |||||
| 60 | D | 42.8 | Very low | 43.8 | Very low | 122 Ų | 122 | 139.7 Ų | 139.7 | 65% | 0.652 | 78% | 0.778 | S | S | * | * | trans | 61.6 | 95.1 | 131.8 | -165.4 | 23.9 | 0 | 0 | 0 | 119 | ||||
| 61 | M | 51.8 | Low | 43.9 | Very low | 185 Ų | 185 | 142 Ų | 142 | 91% | 0.911 | 78% | 0.78 | S | S | * | * | trans | -143.1 | 43 | 150.6 | -66.8 | -60 | -80.1 | 0 | 0 | 110 | ||||
| 62 | G | 45.4 | Very low | 44 | Very low | 57 Ų | 57 | 139.8 Ų | 139.8 | 59% | 0.588 | 78% | 0.78 | S | S | * | * | trans | -90.2 | -13.3 | -174.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 63 | D | 46.3 | Very low | 44 | Very low | 149 Ų | 149 | 142.4 Ų | 142.4 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -112.6 | 16.2 | -158.2 | -79.1 | -3.4 | 0 | 0 | 0 | 116.2 | ||
| 64 | E | 47.2 | Very low | 43.9 | Very low | 163 Ų | 163 | 142.3 Ų | 142.3 | 76% | 0.762 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -123.1 | 40.1 | -177.4 | -150.1 | 178.9 | -175.1 | 0 | 0 | 115 | ||
| 65 | V | 48 | Very low | 44.3 | Very low | 102 Ų | 102 | 139.1 Ų | 139.1 | 62% | 0.618 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -128.5 | -3.1 | 167.8 | -67.1 | 0 | 0 | 0 | 0 | 115.2 | W120 | V65-W120 HydrophobicContact CG1-CZ2 4.14Š|
| 66 | D | 44.9 | Very low | 44.9 | Very low | 150 Ų | 150 | 141.3 Ų | 141.3 | 80% | 0.802 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -97.7 | -5.8 | -179.5 | -98.3 | -2.1 | 0 | 0 | 0 | 114.7 | ||
| 67 | S | 50.6 | Low | 45.3 | Very low | 93 Ų | 93 | 138.5 Ų | 138.5 | 65% | 0.65 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -98 | -0.7 | -171.8 | 66.2 | 0 | 0 | 0 | 0 | 116.3 | ||
| 68 | M | 44.3 | Very low | 45.6 | Very low | 186 Ų | 186 | 138.8 Ų | 138.8 | 92% | 0.916 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -112.7 | -1.3 | 175.9 | -69.8 | -165.6 | 106.9 | 0 | 0 | 114.5 | D70 | M68-D70 VanDerWaalsContact C-N 3.31Å; M68-D70 PolarHBondContact O-N 3.34Å |
| 69 | L | 43.4 | Very low | 45.4 | Very low | 165 Ų | 165 | 139.3 Ų | 139.3 | 86% | 0.864 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -96.4 | 40.6 | 174.9 | -147.5 | 106.4 | 0 | 0 | 0 | 111.8 | ||
| 70 | D | 38 | Very low | 45 | Very low | 137 Ų | 137 | 134.4 Ų | 134.4 | 73% | 0.733 | 76% | 0.764 | S | S | * | * | trans | -144.2 | 54.3 | -179.4 | -171.6 | 30.6 | 0 | 0 | 0 | 112.2 | M68 | M68-D70 VanDerWaalsContact C-N 3.31Å; M68-D70 PolarHBondContact O-N 3.34Å | ||
| 71 | K | 46 | Very low | 45.1 | Very low | 204 Ų | 204 | 137.5 Ų | 137.5 | 89% | 0.887 | 77% | 0.771 | S | S | * | * | trans | -155.8 | 79.9 | 166.2 | -64.1 | -168.4 | -177.2 | 172.9 | 0 | 112 | ||||
| 72 | S | 46.8 | Very low | 44.7 | Very low | 114 Ų | 114 | 136.7 Ų | 136.7 | 80% | 0.797 | 77% | 0.771 | S | S | * | * | trans | 170.3 | 79.3 | 135.6 | 60.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 73 | E | 37.9 | Very low | 44.5 | Very low | 162 Ų | 162 | 137.3 Ų | 137.3 | 76% | 0.757 | 78% | 0.777 | S | S | * | * | 43.6 | 83.2 | 122.3 | -142.5 | 169.5 | -153.9 | 0 | 0 | 116.8 | N75 | E73-N75 PolarHBondContact O-N 3.35Š| |||
| 74 | V | 40 | Very low | 44.2 | Very low | 120 Ų | 120 | 137.6 Ų | 137.6 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | trans | -69.2 | 87.5 | 156.9 | 178.6 | 0 | 0 | 0 | 0 | 107.6 | N76 | V74-N76 HydrophobicContact CG1-CB 4.48Å; V74-N76 VanDerWaalsContact CG1-ND2 3.35Å; V74-N76 WeakPolarHBondContact CG1-ND2 3.36Å; V74-N76 PolarHBondContact O-N 3.05Å | ||
| 75 | N | 46.2 | Very low | 44.1 | Very low | 125 Ų | 125 | 138 Ų | 138 | 67% | 0.668 | 78% | 0.784 | S | S | * | * | trans | -71.4 | 82.6 | 166 | -86.6 | -39.9 | 0 | 0 | 0 | 109.3 | E73 P77 | E73-N75 PolarHBondContact O-N 3.35Å; N75-P77 WeakPolarHBondContact O-CD 3.37Å | ||
| 76 | N | 47.1 | Very low | 43.9 | Very low | 133 Ų | 133 | 137.8 Ų | 137.8 | 71% | 0.711 | 79% | 0.787 | S | S | * | * | trans | -88.1 | 108 | 160.2 | -77.6 | -29.6 | 0 | 0 | 0 | 107.5 | V74 A78 | V74-N76 HydrophobicContact CG1-CB 4.48Å; V74-N76 VanDerWaalsContact CG1-ND2 3.35Å; V74-N76 WeakPolarHBondContact CG1-ND2 3.36Å; V74-N76 PolarHBondContact O-N 3.05Å; N76-A78 PolarHBondContact O-N 3.18Å | ||
| 77 | P | 50.7 | Low | 43.9 | Very low | 127 Ų | 127 | 135.5 Ų | 135.5 | 83% | 0.825 | 78% | 0.78 | S | S | * | * | trans | -68.3 | 110.4 | 176 | 23.2 | -24.1 | 0 | 0 | 0 | 108.7 | N75 I79 | N75-P77 WeakPolarHBondContact O-CD 3.37Å; P77-I79 PolarHBondContact O-N 2.95Å | ||
| 78 | A | 44.3 | Very low | 43.5 | Very low | 96 Ų | 96 | 139.1 Ų | 139.1 | 79% | 0.793 | 79% | 0.787 | S | S | * | * | trans | -58.2 | 130.3 | 172 | 0 | 0 | 0 | 0 | 0 | 110.3 | N76 G80 | N76-A78 PolarHBondContact O-N 3.18Å; A78-G80 PolarHBondContact O-N 2.74Å; A78-G80 VanDerWaalsContact O-N 3.12Å | ||
| 79 | I | 42.3 | Very low | 43.4 | Very low | 159 Ų | 159 | 136.7 Ų | 136.7 | 82% | 0.815 | 78% | 0.783 | S | S | * | * | trans | -39.8 | 107.2 | 172.1 | -73.9 | 152.8 | 0 | 0 | 0 | 112.1 | P77 K81 | P77-I79 PolarHBondContact O-N 2.95Å; I79-K81 HydrophobicContact CG2-CG 4.35Å | ||
| 80 | G | 42 | Very low | 43.7 | Very low | 74 Ų | 74 | 137.2 Ų | 137.2 | 76% | 0.763 | 78% | 0.778 | S | S | * | * | trans | -98.1 | 109.4 | 158.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | A78 D82 | A78-G80 PolarHBondContact O-N 2.74Å; A78-G80 VanDerWaalsContact O-N 3.12Å; G80-D82 PolarHBondContact O-N 3.49Å | ||
| 81 | K | 44.8 | Very low | 44.1 | Very low | 186 Ų | 186 | 133.2 Ų | 133.2 | 81% | 0.809 | 77% | 0.769 | S | S | * | * | trans | -70.4 | 119 | 169.7 | -70.8 | 176 | 175.5 | 175.1 | 0 | 108.7 | I79 | I79-K81 HydrophobicContact CG2-CG 4.35Š| ||
| 82 | D | 43.4 | Very low | 44.5 | Very low | 168 Ų | 168 | 130.8 Ų | 130.8 | 90% | 0.898 | 77% | 0.765 | S | S | * | * | trans | -172.5 | 134.1 | 139.8 | -97.9 | -19.8 | 0 | 0 | 0 | 112.4 | G80 | G80-D82 PolarHBondContact O-N 3.49Š| ||
| 83 | G | 40.5 | Very low | 45 | Very low | 70 Ų | 70 | 133.8 Ų | 133.8 | 72% | 0.722 | 77% | 0.767 | S | S | * | * | trans | 80.7 | 67.8 | 138.7 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 84 | N | 39.1 | Very low | 46.3 | Very low | 155 Ų | 155 | 132 Ų | 132 | 83% | 0.829 | 76% | 0.763 | S | S | * | * | 36.8 | 93.3 | 129.9 | -166.6 | 17.4 | 0 | 0 | 0 | 119.8 | |||||
| 85 | I | 45.2 | Very low | 47.9 | Very low | 171 Ų | 171 | 132.3 Ų | 132.3 | 88% | 0.877 | 76% | 0.758 | S | S | * | * | trans | -146.6 | 124.5 | 140 | -54.6 | -177.4 | 0 | 0 | 0 | 108.7 | ||||
| 86 | S | 45 | Very low | 49.4 | Very low | 99 Ų | 99 | 128.7 Ų | 128.7 | 69% | 0.692 | 75% | 0.749 | S | S | * | * | trans | -114.3 | 164.2 | 175 | -159.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 87 | P | 43.4 | Very low | 51.1 | Low | 101 Ų | 101 | 129.1 Ų | 129.1 | 66% | 0.656 | 75% | 0.747 | S | S | * | * | -127.2 | 134.8 | -72.1 | 34.9 | -19 | 0 | 0 | 0 | 111 | V89 | P87-V89 PolarHBondContact O-N 3.23Š| |||
| 88 | Q | 42.4 | Very low | 52.8 | Low | 170 Ų | 170 | 127.5 Ų | 127.5 | 79% | 0.794 | 73% | 0.728 | S | S | * | * | trans | -92.1 | 99.9 | 168 | -79.9 | -160.5 | 4.9 | 0 | 0 | 110.3 | K90 | Q88-K90 PolarHBondContact O-N 3.39Š| ||
| 89 | V | 42.4 | Very low | 54.8 | Low | 135 Ų | 135 | 126.7 Ų | 126.7 | 82% | 0.818 | 71% | 0.714 | S | S | * | * | trans | -60.1 | 99.9 | 163.2 | 174.4 | 0 | 0 | 0 | 0 | 108.2 | P87 | P87-V89 PolarHBondContact O-N 3.23Š| ||
| 90 | K | 49.6 | Very low | 57 | Low | 176 Ų | 176 | 120.4 Ų | 120.4 | 77% | 0.765 | 69% | 0.688 | S | S | * | * | trans | -122.4 | 103.9 | 165.6 | -88.5 | -176 | 175.5 | 178.1 | 0 | 107.6 | Q88 | Q88-K90 PolarHBondContact O-N 3.39Š| ||
| 91 | G | 46.8 | Very low | 59.3 | Low | 52 Ų | 52 | 118.7 Ų | 118.7 | 54% | 0.536 | 66% | 0.664 | S | S | . | * | trans | 41.2 | 105.5 | 160.2 | 0 | 0 | 0 | 0 | 0 | 117.7 | E93 | G91-E93 PolarHBondContact O-N 3.36Š| ||
| 92 | D | 54.7 | Low | 61.5 | Low | 153 Ų | 153 | 114.8 Ų | 114.8 | 82% | 0.818 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.2 | 2.3 | 172.8 | -67.6 | -32.3 | 0 | 0 | 0 | 115.3 | ||
| 93 | E | 57.7 | Low | 64 | Low | 178 Ų | 178 | 112.2 Ų | 112.2 | 83% | 0.832 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -78.8 | -32.2 | -179.1 | -66.5 | -178.3 | 175.8 | 0 | 0 | 113.2 | G91 G96 H97 | G91-E93 PolarHBondContact O-N 3.36Å; E93-G96 PolarHBondContact O-N 3.42Å; E93-H97 PolarHBondContact O-N 3.21Å |
| 94 | D | 65.4 | Low | 66.5 | Low | 125 Ų | 125 | 114.5 Ų | 114.5 | 67% | 0.668 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -75.2 | -38.4 | -177.4 | -164.9 | 23.4 | 0 | 0 | 0 | 112.1 | G96 H97 E98 | D94-G96 VanDerWaalsContact C-N 3.26Å; D94-G96 PolarHBondContact O-N 3Å; D94-H97 PolarHBondContact O-N 3.41Å; D94-E98 PolarHBondContact O-N 3.33Å |
| 95 | M | 72.3 | Confident | 69.2 | Low | 126 Ų | 126 | 113.4 Ų | 113.4 | 62% | 0.621 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -60.8 | -35.9 | 174.2 | -68.7 | -68.9 | -175.1 | 0 | 0 | 111.8 | V99 | M95-V99 WeakPolarHBondContact O-CB 3.37Å; M95-V99 VanDerWaalsContact O-CG2 3.24Å; M95-V99 WeakPolarHBondContact O-CG2 3.34Å; M95-V99 PolarHBondContact O-N 2.91Å |
| 96 | G | 78.9 | Confident | 71.5 | Confident | 48 Ų | 48 | 108.1 Ų | 108.1 | 50% | 0.495 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -65.9 | -40.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | E93 D94 G100 | E93-G96 PolarHBondContact O-N 3.42Å; D94-G96 VanDerWaalsContact C-N 3.26Å; D94-G96 PolarHBondContact O-N 3Å; G96-G100 PolarHBondContact O-N 2.97Å |
| 97 | H | 83.1 | Confident | 73.9 | Confident | 143 Ų | 143 | 105.1 Ų | 105.1 | 66% | 0.662 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -69.3 | -41.2 | 176.7 | -177 | -91.2 | 0 | 0 | 0 | 111.8 | E93 D94 G100 S101 | E93-H97 PolarHBondContact O-N 3.21Å; D94-H97 PolarHBondContact O-N 3.41Å; H97-G100 PolarHBondContact O-N 3.46Å; H97-S101 WeakPolarHBondContact O-CB 3.41Å; H97-S101 PolarHBondContact O-N 3.19Å |
| 98 | E | 84.9 | Confident | 76.4 | Confident | 92 Ų | 92 | 105 Ų | 105 | 43% | 0.43 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -60.4 | -52.1 | 175 | -177.4 | 174.3 | -173.5 | 0 | 0 | 111.5 | D94 G100 S101 M102 | D94-E98 PolarHBondContact O-N 3.33Å; E98-G100 VanDerWaalsContact C-N 3.32Å; E98-G100 PolarHBondContact O-N 3.01Å; E98-S101 PolarHBondContact O-N 3.49Å; E98-S101 VanDerWaalsContact O-N 3.14Å; E98-S101 PolarHBondContact O-OG 3.04Å; E98-M102 HydrophobicContact CG-CE 3.63Å; E98-M102 HydrophobicContact CG-SD 4.33Å; E98-M102 WeakPolarHBondContact O-CG 3.42Å; E98-M102 PolarHBondContact O-N 2.85Å; E98-M102 WeakPolarHBondContact OE1-CE 3.38Å |
| 99 | V | 87.3 | Confident | 79 | Confident | 80 Ų | 80 | 101.1 Ų | 101.1 | 49% | 0.485 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -60 | -42.1 | 177.6 | 172.5 | 0 | 0 | 0 | 0 | 111.1 | M95 S101 M102 L103 | M95-V99 WeakPolarHBondContact O-CB 3.37Å; M95-V99 VanDerWaalsContact O-CG2 3.24Å; M95-V99 WeakPolarHBondContact O-CG2 3.34Å; M95-V99 PolarHBondContact O-N 2.91Å; V99-S101 PolarHBondContact O-N 3.49Å; V99-M102 PolarHBondContact O-N 3.01Å; V99-L103 HydrophobicContact CG1-CD1 4.05Å; V99-L103 HydrophobicContact CG1-CG 4.36Å; V99-L103 VanDerWaalsContact O-CG 3.32Å; V99-L103 WeakPolarHBondContact O-CG 3.36Å; V99-L103 PolarHBondContact O-N 2.94Å |
| 100 | G | 88.7 | Confident | 81.5 | Confident | 27 Ų | 27 | 99.2 Ų | 99.2 | 28% | 0.278 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -57.2 | -48.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | G96 H97 E98 M102 L103 D104 | G96-G100 PolarHBondContact O-N 2.97Å; H97-G100 PolarHBondContact O-N 3.46Å; E98-G100 VanDerWaalsContact C-N 3.32Å; E98-G100 PolarHBondContact O-N 3.01Å; G100-M102 VanDerWaalsContact C-N 3.3Å; G100-M102 PolarHBondContact O-N 3.34Å; G100-L103 PolarHBondContact O-N 2.93Å; G100-D104 PolarHBondContact O-N 2.95Å |
| 101 | S | 89.9 | Confident | 83.8 | Confident | 38 Ų | 38 | 98 Ų | 98 | 27% | 0.266 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.1 | -33.2 | 178.2 | 81.2 | 0 | 0 | 0 | 0 | 113.5 | H97 E98 V99 K105 | H97-S101 WeakPolarHBondContact O-CB 3.41Å; H97-S101 PolarHBondContact O-N 3.19Å; E98-S101 PolarHBondContact O-N 3.49Å; E98-S101 VanDerWaalsContact O-N 3.14Å; E98-S101 PolarHBondContact O-OG 3.04Å; V99-S101 PolarHBondContact O-N 3.49Å; S101-K105 WeakPolarHBondContact O-CD 3.45Å; S101-K105 VanDerWaalsContact O-CG 3.24Å; S101-K105 WeakPolarHBondContact O-CG 3.48Å; S101-K105 PolarHBondContact O-N 3.35Å; S101-K105 VanDerWaalsContact O-N 3.16Å |
| 102 | M | 91.9 | Very high | 86.2 | Confident | 103 Ų | 103 | 100.8 Ų | 100.8 | 51% | 0.507 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -70.5 | -40.2 | 174.9 | -71 | -179.8 | 178.7 | 0 | 0 | 111.6 | E98 V99 G100 S106 | E98-M102 HydrophobicContact CG-CE 3.63Å; E98-M102 HydrophobicContact CG-SD 4.33Å; E98-M102 WeakPolarHBondContact O-CG 3.42Å; E98-M102 PolarHBondContact O-N 2.85Å; E98-M102 WeakPolarHBondContact OE1-CE 3.38Å; V99-M102 PolarHBondContact O-N 3.01Å; G100-M102 VanDerWaalsContact C-N 3.3Å; G100-M102 PolarHBondContact O-N 3.34Å; M102-S106 WeakPolarHBondContact O-CB 3.33Å; M102-S106 PolarHBondContact O-N 2.99Å |
| 103 | L | 94.5 | Very high | 88.3 | Confident | 114 Ų | 114 | 97.9 Ų | 97.9 | 60% | 0.597 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.9 | -41.8 | 175.6 | -71.9 | 173.7 | 0 | 0 | 0 | 111.8 | V99 G100 S106 G107 | V99-L103 HydrophobicContact CG1-CD1 4.05Å; V99-L103 HydrophobicContact CG1-CG 4.36Å; V99-L103 VanDerWaalsContact O-CG 3.32Å; V99-L103 WeakPolarHBondContact O-CG 3.36Å; V99-L103 PolarHBondContact O-N 2.94Å; G100-L103 PolarHBondContact O-N 2.93Å; L103-S106 PolarHBondContact O-N 3.46Å; L103-G107 PolarHBondContact O-N 3.49Å |
| 104 | D | 93.5 | Very high | 90.2 | Very high | 118 Ų | 118 | 94.1 Ų | 94.1 | 63% | 0.631 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.4 | -46.8 | 176.3 | -73.9 | -17.7 | 0 | 0 | 0 | 111.2 | G100 S106 G107 D108 | G100-D104 PolarHBondContact O-N 2.95Å; D104-S106 PolarHBondContact O-N 3.32Å; D104-G107 PolarHBondContact O-N 3.25Å; D104-G107 VanDerWaalsContact O-N 3.15Å; D104-D108 PolarHBondContact O-N 3.44Å |
| 105 | K | 94.6 | Very high | 91.7 | Very high | 132 Ų | 132 | 91.9 Ų | 91.9 | 57% | 0.574 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -59 | -45.2 | 174 | -72.4 | 168.7 | -174.8 | 171.6 | 0 | 111.9 | S101 G107 D108 D109 | S101-K105 WeakPolarHBondContact O-CD 3.45Å; S101-K105 VanDerWaalsContact O-CG 3.24Å; S101-K105 WeakPolarHBondContact O-CG 3.48Å; S101-K105 PolarHBondContact O-N 3.35Å; S101-K105 VanDerWaalsContact O-N 3.16Å; K105-G107 VanDerWaalsContact C-N 3.3Å; K105-G107 PolarHBondContact O-N 2.74Å; K105-D108 PolarHBondContact O-N 3.36Å; K105-D109 PolarHBondContact O-N 3.39Å |
| 106 | S | 94.2 | Very high | 93 | Very high | 60 Ų | 60 | 91.4 Ų | 91.4 | 42% | 0.42 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.6 | -39.5 | 175.7 | -177.5 | 0 | 0 | 0 | 0 | 111.7 | M102 L103 D104 D109 I110 | M102-S106 WeakPolarHBondContact O-CB 3.33Å; M102-S106 PolarHBondContact O-N 2.99Å; L103-S106 PolarHBondContact O-N 3.46Å; D104-S106 PolarHBondContact O-N 3.32Å; S106-D109 PolarHBondContact O-N 3.01Å; S106-I110 WeakPolarHBondContact O-CB 3.49Å; S106-I110 WeakPolarHBondContact O-CD1 3.46Å; S106-I110 WeakPolarHBondContact O-CG1 3.5Å; S106-I110 PolarHBondContact O-N 2.94Å |
| 107 | G | 95.5 | Very high | 93.9 | Very high | 37 Ų | 37 | 95 Ų | 95 | 38% | 0.381 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.2 | -44.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L103 D104 K105 I110 Y111 | L103-G107 PolarHBondContact O-N 3.49Å; D104-G107 PolarHBondContact O-N 3.25Å; D104-G107 VanDerWaalsContact O-N 3.15Å; K105-G107 VanDerWaalsContact C-N 3.3Å; K105-G107 PolarHBondContact O-N 2.74Å; G107-I110 PolarHBondContact O-N 3.08Å; G107-Y111 WeakPolarHBondContact O-CB 3.4Å; G107-Y111 PolarHBondContact O-N 3.47Å |
| 108 | D | 96 | Very high | 94.6 | Very high | 99 Ų | 99 | 94.9 Ų | 94.9 | 53% | 0.529 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.4 | -43.1 | 175.4 | -82.7 | -10.6 | 0 | 0 | 0 | 112.1 | D104 K105 Y111 K112 | D104-D108 PolarHBondContact O-N 3.44Å; K105-D108 PolarHBondContact O-N 3.36Å; D108-Y111 PolarHBondContact O-N 2.98Å; D108-K112 VanDerWaalsContact O-CG 3.28Å; D108-K112 WeakPolarHBondContact O-CG 3.49Å; D108-K112 PolarHBondContact O-N 2.98Å |
| 109 | D | 96.2 | Very high | 95.2 | Very high | 87 Ų | 87 | 95.3 Ų | 95.3 | 47% | 0.465 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -70.5 | -37.1 | -179.7 | -70 | -17.9 | 0 | 0 | 0 | 111.9 | K105 S106 K112 T113 | K105-D109 PolarHBondContact O-N 3.39Å; S106-D109 PolarHBondContact O-N 3.01Å; D109-K112 IonicContact OD1-NZ 3.21Å; D109-K112 PolarHBondContact OD1-NZ 3.39Å; D109-T113 VanDerWaalsContact O-CB 3.32Å; D109-T113 WeakPolarHBondContact O-CB 3.41Å; D109-T113 PolarHBondContact O-N 3.47Å; D109-T113 PolarHBondContact O-OG1 3.18Å |
| 110 | I | 96.7 | Very high | 95.7 | Very high | 95 Ų | 95 | 98.2 Ų | 98.2 | 49% | 0.487 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.8 | -47 | 169.5 | -70.1 | 163.7 | 0 | 0 | 0 | 110.2 | S106 G107 T113 L114 | S106-I110 WeakPolarHBondContact O-CB 3.49Å; S106-I110 WeakPolarHBondContact O-CD1 3.46Å; S106-I110 WeakPolarHBondContact O-CG1 3.5Å; S106-I110 PolarHBondContact O-N 2.94Å; G107-I110 PolarHBondContact O-N 3.08Å; I110-T113 PolarHBondContact O-N 3.26Å; I110-L114 HydrophobicContact CG2-CD1 3.92Å; I110-L114 HydrophobicContact CG2-CG 4.36Å; I110-L114 WeakPolarHBondContact O-CB 3.45Å; I110-L114 WeakPolarHBondContact O-CG 3.46Å; I110-L114 PolarHBondContact O-N 3.07Å |
| 111 | Y | 97.5 | Very high | 96.2 | Very high | 152 Ų | 152 | 101.4 Ų | 101.4 | 60% | 0.596 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.4 | -47 | 179.8 | 178.9 | -93 | 0 | 0 | 0 | 112 | G107 D108 T113 L114 H115 | G107-Y111 WeakPolarHBondContact O-CB 3.4Å; G107-Y111 PolarHBondContact O-N 3.47Å; D108-Y111 PolarHBondContact O-N 2.98Å; Y111-T113 PolarHBondContact O-N 2.9Å; Y111-L114 PolarHBondContact O-N 2.86Å; Y111-H115 WeakPolarHBondContact O-CB 3.44Å; Y111-H115 PolarHBondContact O-N 2.96Å |
| 112 | K | 97.7 | Very high | 96.6 | Very high | 110 Ų | 110 | 104 Ų | 104 | 48% | 0.478 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.4 | -46 | 176.1 | -70.9 | 168.2 | -162.6 | 156.8 | 0 | 111.4 | D108 D109 L114 H115 I116 | D108-K112 VanDerWaalsContact O-CG 3.28Å; D108-K112 WeakPolarHBondContact O-CG 3.49Å; D108-K112 PolarHBondContact O-N 2.98Å; D109-K112 IonicContact OD1-NZ 3.21Å; D109-K112 PolarHBondContact OD1-NZ 3.39Å; K112-L114 PolarHBondContact O-N 3.44Å; K112-H115 PolarHBondContact O-N 3.3Å; K112-I116 WeakPolarHBondContact O-CG1 3.47Å; K112-I116 PolarHBondContact O-N 3.16Å |
| 113 | T | 97.1 | Very high | 96.9 | Very high | 92 Ų | 92 | 102.3 Ų | 102.3 | 56% | 0.564 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.4 | -45.7 | 178.8 | -58.5 | 0 | 0 | 0 | 0 | 111.4 | D109 I110 Y111 H115 I116 K117 | D109-T113 VanDerWaalsContact O-CB 3.32Å; D109-T113 WeakPolarHBondContact O-CB 3.41Å; D109-T113 PolarHBondContact O-N 3.47Å; D109-T113 PolarHBondContact O-OG1 3.18Å; I110-T113 PolarHBondContact O-N 3.26Å; Y111-T113 PolarHBondContact O-N 2.9Å; T113-H115 VanDerWaalsContact C-N 3.34Å; T113-H115 PolarHBondContact O-N 3.41Å; T113-I116 PolarHBondContact O-N 2.95Å; T113-K117 WeakPolarHBondContact O-CB 3.4Å; T113-K117 PolarHBondContact O-N 3.49Å |
| 114 | L | 98.1 | Very high | 97.1 | Very high | 99 Ų | 99 | 103.3 Ų | 103.3 | 52% | 0.518 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.6 | -38.6 | 175.7 | -73.2 | 175.8 | 0 | 0 | 0 | 112.2 | I110 Y111 K112 K117 R118 | I110-L114 HydrophobicContact CG2-CD1 3.92Å; I110-L114 HydrophobicContact CG2-CG 4.36Å; I110-L114 WeakPolarHBondContact O-CB 3.45Å; I110-L114 WeakPolarHBondContact O-CG 3.46Å; I110-L114 PolarHBondContact O-N 3.07Å; Y111-L114 PolarHBondContact O-N 2.86Å; K112-L114 PolarHBondContact O-N 3.44Å; L114-K117 PolarHBondContact O-N 2.85Å; L114-R118 WeakPolarHBondContact O-CB 3.47Å; L114-R118 PolarHBondContact O-N 3.24Å |
| 115 | H | 97.7 | Very high | 97.3 | Very high | 77 Ų | 77 | 102 Ų | 102 | 36% | 0.356 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.3 | -45.8 | 176.9 | -170.7 | 84.3 | 0 | 0 | 0 | 111.8 | Y111 K112 T113 R118 K119 | Y111-H115 WeakPolarHBondContact O-CB 3.44Å; Y111-H115 PolarHBondContact O-N 2.96Å; K112-H115 PolarHBondContact O-N 3.3Å; T113-H115 VanDerWaalsContact C-N 3.34Å; T113-H115 PolarHBondContact O-N 3.41Å; H115-R118 PolarHBondContact O-N 3.38Å; H115-K119 PolarHBondContact O-N 2.96Å |
| 116 | I | 98 | Very high | 97.5 | Very high | 116 Ų | 116 | 103.5 Ų | 103.5 | 60% | 0.595 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60.9 | -48.6 | 175.6 | -68.1 | 165.2 | 0 | 0 | 0 | 110.3 | K112 T113 R118 K119 W120 | K112-I116 WeakPolarHBondContact O-CG1 3.47Å; K112-I116 PolarHBondContact O-N 3.16Å; T113-I116 PolarHBondContact O-N 2.95Å; I116-R118 VanDerWaalsContact C-N 3.32Å; I116-R118 PolarHBondContact O-N 3.09Å; I116-K119 PolarHBondContact O-N 3.43Å; I116-W120 PolarHBondContact O-N 3.17Å |
| 117 | K | 98.2 | Very high | 97.6 | Very high | 125 Ų | 125 | 106.7 Ų | 106.7 | 54% | 0.543 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.7 | -42.6 | 178.3 | -171 | -175.8 | -179.3 | -167 | 0 | 111.9 | T113 L114 W120 M121 | T113-K117 WeakPolarHBondContact O-CB 3.4Å; T113-K117 PolarHBondContact O-N 3.49Å; L114-K117 PolarHBondContact O-N 2.85Å; K117-W120 PolarHBondContact O-N 3.37Å; K117-M121 WeakPolarHBondContact O-CG 3.29Å; K117-M121 PolarHBondContact O-N 3.24Å |
| 118 | R | 98.2 | Very high | 97.7 | Very high | 139 Ų | 139 | 107.1 Ų | 107.1 | 53% | 0.525 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.8 | -49.1 | 175.4 | -178.6 | -173.6 | -61.2 | 152.3 | 3 | 111.2 | L114 H115 I116 W120 M121 E122 | L114-R118 WeakPolarHBondContact O-CB 3.47Å; L114-R118 PolarHBondContact O-N 3.24Å; H115-R118 PolarHBondContact O-N 3.38Å; I116-R118 VanDerWaalsContact C-N 3.32Å; I116-R118 PolarHBondContact O-N 3.09Å; R118-W120 VanDerWaalsContact C-N 3.31Å; R118-W120 PolarHBondContact O-N 3.22Å; R118-M121 PolarHBondContact O-N 3.01Å; R118-E122 WeakPolarHBondContact CD-OE1 3.41Å; R118-E122 HydrophobicContact CG-CG 4.37Å; R118-E122 WeakPolarHBondContact CG-OE1 3.46Å; R118-E122 WeakPolarHBondContact O-CG 3.38Å; R118-E122 PolarHBondContact O-N 3.25Å |
| 119 | K | 98.3 | Very high | 97.8 | Very high | 102 Ų | 102 | 108.9 Ų | 108.9 | 44% | 0.443 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.6 | -41.3 | 179.4 | -78.5 | -74 | 162.8 | -143.8 | 0 | 112.2 | H115 I116 E122 T123 | H115-K119 PolarHBondContact O-N 2.96Å; I116-K119 PolarHBondContact O-N 3.43Å; K119-E122 IonicContact NZ-OE2 2.8Å; K119-E122 PolarHBondContact NZ-OE2 3.46Å; K119-E122 PolarHBondContact O-N 3.44Å; K119-T123 PolarHBondContact O-N 3.41Å; K119-T123 VanDerWaalsContact O-N 3.09Å; K119-T123 PolarHBondContact O-OG1 2.92Å; K119-T123 VanDerWaalsContact O-OG1 3.08Å |
| 120 | W | 97.7 | Very high | 97.9 | Very high | 140 Ų | 140 | 111 Ų | 111 | 53% | 0.53 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.3 | -48.5 | 174.3 | 175.7 | 83.5 | 0 | 0 | 0 | 111.9 | V65 I116 K117 R118 E122 T123 Y124 | V65-W120 HydrophobicContact CG1-CZ2 4.14Å; I116-W120 PolarHBondContact O-N 3.17Å; K117-W120 PolarHBondContact O-N 3.37Å; R118-W120 VanDerWaalsContact C-N 3.31Å; R118-W120 PolarHBondContact O-N 3.22Å; W120-E122 PolarHBondContact O-N 3.05Å; W120-T123 PolarHBondContact O-N 3.41Å; W120-Y124 WeakPolarHBondContact O-CB 3.49Å; W120-Y124 PolarHBondContact O-N 3.29Å |
| 121 | M | 98.5 | Very high | 97.9 | Very high | 94 Ų | 94 | 108.2 Ų | 108.2 | 46% | 0.463 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62 | -43.1 | 177.6 | -73.9 | 179.3 | 53.8 | 0 | 0 | 112.9 | K117 R118 T123 Y124 V125 | K117-M121 WeakPolarHBondContact O-CG 3.29Å; K117-M121 PolarHBondContact O-N 3.24Å; R118-M121 PolarHBondContact O-N 3.01Å; M121-T123 VanDerWaalsContact C-N 3.33Å; M121-T123 PolarHBondContact O-N 2.98Å; M121-Y124 PolarHBondContact O-N 3.41Å; M121-V125 WeakPolarHBondContact O-CB 3.32Å; M121-V125 WeakPolarHBondContact O-CG2 3.48Å; M121-V125 PolarHBondContact O-N 2.95Å |
| 122 | E | 98.2 | Very high | 98 | Very high | 92 Ų | 92 | 104.4 Ų | 104.4 | 43% | 0.43 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -57.5 | -46.5 | 176.5 | -76.5 | 171.7 | -172.5 | 0 | 0 | 111.1 | R118 K119 W120 K126 | R118-E122 WeakPolarHBondContact CD-OE1 3.41Å; R118-E122 HydrophobicContact CG-CG 4.37Å; R118-E122 WeakPolarHBondContact CG-OE1 3.46Å; R118-E122 WeakPolarHBondContact O-CG 3.38Å; R118-E122 PolarHBondContact O-N 3.25Å; K119-E122 IonicContact NZ-OE2 2.8Å; K119-E122 PolarHBondContact NZ-OE2 3.46Å; K119-E122 PolarHBondContact O-N 3.44Å; W120-E122 PolarHBondContact O-N 3.05Å; E122-K126 VanDerWaalsContact O-CB 3.3Å; E122-K126 WeakPolarHBondContact O-CB 3.45Å; E122-K126 PolarHBondContact O-N 3.47Å; E122-K126 VanDerWaalsContact O-N 3.12Å |
| 123 | T | 98.3 | Very high | 98 | Very high | 68 Ų | 68 | 102.6 Ų | 102.6 | 42% | 0.417 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.6 | -48.2 | 176.8 | -60.2 | 0 | 0 | 0 | 0 | 111.5 | K119 W120 M121 V125 K126 E127 | K119-T123 PolarHBondContact O-N 3.41Å; K119-T123 VanDerWaalsContact O-N 3.09Å; K119-T123 PolarHBondContact O-OG1 2.92Å; K119-T123 VanDerWaalsContact O-OG1 3.08Å; W120-T123 PolarHBondContact O-N 3.41Å; M121-T123 VanDerWaalsContact C-N 3.33Å; M121-T123 PolarHBondContact O-N 2.98Å; T123-V125 PolarHBondContact O-N 3.16Å; T123-K126 WeakPolarHBondContact O-CB 3.37Å; T123-K126 PolarHBondContact O-N 2.96Å; T123-K126 VanDerWaalsContact O-N 3.16Å; T123-E127 HydrophobicContact CG2-CG 4.31Å; T123-E127 WeakPolarHBondContact CG2-OE1 3.33Å; T123-E127 WeakPolarHBondContact O-CG 3.29Å; T123-E127 PolarHBondContact O-N 3.3Å |
| 124 | Y | 98.1 | Very high | 98 | Very high | 135 Ų | 135 | 102.8 Ų | 102.8 | 53% | 0.529 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -57.3 | -47.7 | -180 | 175.2 | -97.1 | 0 | 0 | 0 | 112.1 | W120 M121 K126 E127 S128 | W120-Y124 WeakPolarHBondContact O-CB 3.49Å; W120-Y124 PolarHBondContact O-N 3.29Å; M121-Y124 PolarHBondContact O-N 3.41Å; Y124-K126 PolarHBondContact O-N 3.3Å; Y124-E127 PolarHBondContact O-N 3.35Å; Y124-S128 WeakPolarHBondContact O-CB 3.25Å; Y124-S128 PolarHBondContact O-N 3.36Å; Y124-S128 PolarHBondContact O-OG 3.4Å |
| 125 | V | 98.4 | Very high | 98 | Very high | 91 Ų | 91 | 105.3 Ų | 105.3 | 55% | 0.552 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.9 | -42.7 | 178.1 | 171.1 | 0 | 0 | 0 | 0 | 110.7 | M121 T123 S128 F129 | M121-V125 WeakPolarHBondContact O-CB 3.32Å; M121-V125 WeakPolarHBondContact O-CG2 3.48Å; M121-V125 PolarHBondContact O-N 2.95Å; T123-V125 PolarHBondContact O-N 3.16Å; V125-S128 PolarHBondContact O-N 2.93Å; V125-F129 WeakPolarHBondContact O-CB 3.47Å; V125-F129 PolarHBondContact O-N 3.03Å |
| 126 | K | 98.2 | Very high | 98 | Very high | 163 Ų | 163 | 106.5 Ų | 106.5 | 71% | 0.709 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.8 | -45.3 | 178.7 | -177.4 | 179.3 | 179 | 179.7 | 0 | 112 | E122 T123 Y124 K130 | E122-K126 VanDerWaalsContact O-CB 3.3Å; E122-K126 WeakPolarHBondContact O-CB 3.45Å; E122-K126 PolarHBondContact O-N 3.47Å; E122-K126 VanDerWaalsContact O-N 3.12Å; T123-K126 WeakPolarHBondContact O-CB 3.37Å; T123-K126 PolarHBondContact O-N 2.96Å; T123-K126 VanDerWaalsContact O-N 3.16Å; Y124-K126 PolarHBondContact O-N 3.3Å; K126-K130 WeakPolarHBondContact O-CB 3.47Å; K126-K130 PolarHBondContact O-N 3.27Å |
| 127 | E | 98 | Very high | 98 | Very high | 128 Ų | 128 | 105.8 Ų | 105.8 | 60% | 0.598 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -68.7 | -42.3 | 178.8 | -71.5 | 175.6 | 172.4 | 0 | 0 | 111.6 | T123 Y124 F129 K130 G131 | T123-E127 HydrophobicContact CG2-CG 4.31Å; T123-E127 WeakPolarHBondContact CG2-OE1 3.33Å; T123-E127 WeakPolarHBondContact O-CG 3.29Å; T123-E127 PolarHBondContact O-N 3.3Å; Y124-E127 PolarHBondContact O-N 3.35Å; E127-F129 PolarHBondContact O-N 2.94Å; E127-K130 PolarHBondContact O-N 2.91Å; E127-G131 PolarHBondContact O-N 3.4Å |
| 128 | S | 97.1 | Very high | 98 | Very high | 45 Ų | 45 | 107.7 Ų | 107.7 | 32% | 0.315 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.4 | -45.8 | 175.4 | -63 | 0 | 0 | 0 | 0 | 111.9 | Y124 V125 G131 S132 | Y124-S128 WeakPolarHBondContact O-CB 3.25Å; Y124-S128 PolarHBondContact O-N 3.36Å; Y124-S128 PolarHBondContact O-OG 3.4Å; V125-S128 PolarHBondContact O-N 2.93Å; S128-G131 PolarHBondContact O-N 3.3Å; S128-S132 VanDerWaalsContact O-CB 3.32Å; S128-S132 WeakPolarHBondContact O-CB 3.49Å; S128-S132 PolarHBondContact O-N 3.49Å; S128-S132 PolarHBondContact O-OG 3.45Å |
| 129 | F | 97.8 | Very high | 97.9 | Very high | 136 Ų | 136 | 107.6 Ų | 107.6 | 60% | 0.596 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -67 | -41.6 | 177.9 | -169.2 | -108.5 | 0 | 0 | 0 | 111.6 | V125 E127 S132 N133 | V125-F129 WeakPolarHBondContact O-CB 3.47Å; V125-F129 PolarHBondContact O-N 3.03Å; E127-F129 PolarHBondContact O-N 2.94Å; F129-S132 PolarHBondContact O-N 2.91Å; F129-N133 WeakPolarHBondContact CD1-ND2 3.38Å; F129-N133 WeakPolarHBondContact CE1-ND2 3.4Å; F129-N133 WeakPolarHBondContact CZ-ND2 3.43Å; F129-N133 WeakPolarHBondContact O-CB 3.49Å; F129-N133 PolarHBondContact O-N 3.45Å |
| 130 | K | 98.1 | Very high | 97.8 | Very high | 133 Ų | 133 | 105.8 Ų | 105.8 | 58% | 0.578 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -59.2 | -48.6 | 175.2 | -176.7 | -177.5 | 177.5 | -173.7 | 0 | 111.6 | K126 E127 N133 Q134 | K126-K130 WeakPolarHBondContact O-CB 3.47Å; K126-K130 PolarHBondContact O-N 3.27Å; E127-K130 PolarHBondContact O-N 2.91Å; K130-N133 PolarHBondContact O-N 3.44Å; K130-Q134 WeakPolarHBondContact O-CG 3.33Å; K130-Q134 PolarHBondContact O-N 3.05Å |
| 131 | G | 97.7 | Very high | 97.9 | Very high | 35 Ų | 35 | 104.1 Ų | 104.1 | 36% | 0.361 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.2 | -42.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | E127 S128 Q134 K135 | E127-G131 PolarHBondContact O-N 3.4Å; S128-G131 PolarHBondContact O-N 3.3Å; G131-Q134 PolarHBondContact O-N 3.08Å; G131-K135 PolarHBondContact O-N 3.34Å |
| 132 | S | 97.9 | Very high | 97.8 | Very high | 73 Ų | 73 | 102.3 Ų | 102.3 | 51% | 0.51 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.7 | -45.7 | 177.3 | -60.8 | 0 | 0 | 0 | 0 | 112 | S128 F129 Q134 K135 L136 | S128-S132 VanDerWaalsContact O-CB 3.32Å; S128-S132 WeakPolarHBondContact O-CB 3.49Å; S128-S132 PolarHBondContact O-N 3.49Å; S128-S132 PolarHBondContact O-OG 3.45Å; F129-S132 PolarHBondContact O-N 2.91Å; S132-Q134 PolarHBondContact O-N 3.39Å; S132-K135 PolarHBondContact O-N 2.98Å; S132-L136 PolarHBondContact O-N 2.93Å |
| 133 | N | 97.6 | Very high | 97.8 | Very high | 71 Ų | 71 | 101.6 Ų | 101.6 | 38% | 0.38 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.7 | -40.8 | 177.1 | -75.3 | -5.1 | 0 | 0 | 0 | 112.2 | F129 K130 K135 L136 E137 | F129-N133 WeakPolarHBondContact CD1-ND2 3.38Å; F129-N133 WeakPolarHBondContact CE1-ND2 3.4Å; F129-N133 WeakPolarHBondContact CZ-ND2 3.43Å; F129-N133 WeakPolarHBondContact O-CB 3.49Å; F129-N133 PolarHBondContact O-N 3.45Å; K130-N133 PolarHBondContact O-N 3.44Å; N133-K135 VanDerWaalsContact C-N 3.3Å; N133-K135 PolarHBondContact O-N 3.32Å; N133-L136 PolarHBondContact O-N 3.24Å; N133-E137 WeakPolarHBondContact O-CB 3.39Å; N133-E137 PolarHBondContact O-N 2.98Å |
| 134 | Q | 98.1 | Very high | 97.7 | Very high | 97 Ų | 97 | 104.6 Ų | 104.6 | 45% | 0.453 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.6 | -34.9 | 174.4 | -74.2 | 179.4 | -11.3 | 0 | 0 | 112.5 | K130 G131 S132 R138 | K130-Q134 WeakPolarHBondContact O-CG 3.33Å; K130-Q134 PolarHBondContact O-N 3.05Å; G131-Q134 PolarHBondContact O-N 3.08Å; S132-Q134 PolarHBondContact O-N 3.39Å; Q134-R138 WeakPolarHBondContact O-CB 3.37Å; Q134-R138 VanDerWaalsContact O-CG 3.31Å; Q134-R138 WeakPolarHBondContact O-CG 3.39Å; Q134-R138 PolarHBondContact O-N 3.14Å; Q134-R138 VanDerWaalsContact O-N 3.16Å; Q134-R138 PolarHBondContact O-NE 2.98Å |
| 135 | K | 97.9 | Very high | 97.7 | Very high | 152 Ų | 152 | 106.1 Ų | 106.1 | 66% | 0.661 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -68.3 | -44.5 | 174.4 | -170.1 | 173.7 | -177.4 | 174.2 | 0 | 111 | G131 S132 N133 R138 F139 | G131-K135 PolarHBondContact O-N 3.34Å; S132-K135 PolarHBondContact O-N 2.98Å; N133-K135 VanDerWaalsContact C-N 3.3Å; N133-K135 PolarHBondContact O-N 3.32Å; K135-R138 PolarHBondContact O-N 2.91Å; K135-F139 WeakPolarHBondContact O-CB 3.47Å; K135-F139 PolarHBondContact O-N 3.38Å |
| 136 | L | 97.7 | Very high | 97.7 | Very high | 102 Ų | 102 | 107 Ų | 107 | 53% | 0.534 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.5 | -46.5 | 176.4 | -179.7 | 60.8 | 0 | 0 | 0 | 111.9 | S132 N133 R138 F139 C140 | S132-L136 PolarHBondContact O-N 2.93Å; N133-L136 PolarHBondContact O-N 3.24Å; L136-R138 PolarHBondContact O-N 3.09Å; L136-F139 WeakPolarHBondContact O-CB 3.06Å; L136-F139 PolarHBondContact O-N 2.79Å; L136-C140 PolarHBondContact O-N 3.13Å; L136-C140 PolarHBondContact O-SG 3.06Å; L136-C140 VanDerWaalsContact O-SG 3.33Å |
| 137 | E | 97.8 | Very high | 97.6 | Very high | 100 Ų | 100 | 104.1 Ų | 104.1 | 47% | 0.467 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.1 | -44.6 | 178.1 | -173.1 | -173 | 175.2 | 0 | 0 | 111.6 | N133 F139 C140 K141 | N133-E137 WeakPolarHBondContact O-CB 3.39Å; N133-E137 PolarHBondContact O-N 2.98Å; E137-F139 VanDerWaalsContact C-N 3.34Å; E137-F139 PolarHBondContact O-N 3.07Å; E137-C140 PolarHBondContact O-N 2.94Å; E137-K141 HydrophobicContact CG-CD 4.33Å; E137-K141 WeakPolarHBondContact O-CB 3.31Å; E137-K141 WeakPolarHBondContact O-CG 3.46Å; E137-K141 PolarHBondContact O-N 3.28Å; E137-K141 WeakPolarHBondContact OE1-CE 3.37Å; E137-K141 IonicContact OE1-NZ 2.63Å; E137-K141 PolarHBondContact OE1-NZ 3.22Å |
| 138 | R | 98.1 | Very high | 97.6 | Very high | 165 Ų | 165 | 103.8 Ų | 103.8 | 62% | 0.623 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61 | -42.5 | 175.1 | -77 | -174.5 | -69.9 | 168.6 | -3.3 | 112 | Q134 K135 L136 T142 | Q134-R138 WeakPolarHBondContact O-CB 3.37Å; Q134-R138 VanDerWaalsContact O-CG 3.31Å; Q134-R138 WeakPolarHBondContact O-CG 3.39Å; Q134-R138 PolarHBondContact O-N 3.14Å; Q134-R138 VanDerWaalsContact O-N 3.16Å; Q134-R138 PolarHBondContact O-NE 2.98Å; K135-R138 PolarHBondContact O-N 2.91Å; L136-R138 PolarHBondContact O-N 3.09Å; R138-T142 WeakPolarHBondContact O-CB 3.38Å; R138-T142 PolarHBondContact O-N 3.42Å; R138-T142 PolarHBondContact O-OG1 2.78Å |
| 139 | F | 97.1 | Very high | 97.6 | Very high | 137 Ų | 137 | 105.5 Ų | 105.5 | 60% | 0.601 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.8 | -49.9 | 176.5 | 177.6 | -97.9 | 0 | 0 | 0 | 111.2 | K135 L136 E137 K141 T142 N143 | K135-F139 WeakPolarHBondContact O-CB 3.47Å; K135-F139 PolarHBondContact O-N 3.38Å; L136-F139 WeakPolarHBondContact O-CB 3.06Å; L136-F139 PolarHBondContact O-N 2.79Å; E137-F139 VanDerWaalsContact C-N 3.34Å; E137-F139 PolarHBondContact O-N 3.07Å; F139-K141 PolarHBondContact O-N 3.43Å; F139-T142 PolarHBondContact O-N 3.02Å; F139-T142 VanDerWaalsContact O-N 3.17Å; F139-N143 WeakPolarHBondContact O-CB 3.35Å; F139-N143 PolarHBondContact O-N 3.18Å |
| 140 | C | 96.5 | Very high | 97.6 | Very high | 64 Ų | 64 | 103.6 Ų | 103.6 | 43% | 0.432 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -57.6 | -49 | 177.9 | -69.3 | 0 | 0 | 0 | 0 | 112.2 | L136 E137 T142 N143 E144 | L136-C140 PolarHBondContact O-N 3.13Å; L136-C140 PolarHBondContact O-SG 3.06Å; L136-C140 VanDerWaalsContact O-SG 3.33Å; E137-C140 PolarHBondContact O-N 2.94Å; C140-T142 VanDerWaalsContact C-N 3.28Å; C140-T142 PolarHBondContact O-N 3.37Å; C140-N143 PolarHBondContact O-N 3.17Å; C140-E144 WeakPolarHBondContact O-CB 3.48Å; C140-E144 PolarHBondContact O-N 3.39Å |
| 141 | K | 98.1 | Very high | 97.5 | Very high | 105 Ų | 105 | 100.7 Ų | 100.7 | 46% | 0.457 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.6 | -34.9 | 177.7 | -73.1 | 179.5 | -177 | 174.6 | 0 | 112.9 | E137 F139 R145 | E137-K141 HydrophobicContact CG-CD 4.33Å; E137-K141 WeakPolarHBondContact O-CB 3.31Å; E137-K141 WeakPolarHBondContact O-CG 3.46Å; E137-K141 PolarHBondContact O-N 3.28Å; E137-K141 WeakPolarHBondContact OE1-CE 3.37Å; E137-K141 IonicContact OE1-NZ 2.63Å; E137-K141 PolarHBondContact OE1-NZ 3.22Å; F139-K141 PolarHBondContact O-N 3.43Å; K141-R145 WeakPolarHBondContact O-CB 3.24Å; K141-R145 PolarHBondContact O-N 3.37Å; K141-R145 VanDerWaalsContact O-N 3.13Å |
| 142 | T | 97.8 | Very high | 97.5 | Very high | 57 Ų | 57 | 102.7 Ų | 102.7 | 35% | 0.35 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -68.9 | -48.9 | 177.3 | -58.4 | 0 | 0 | 0 | 0 | 110.5 | R138 F139 C140 E144 R145 E146 | R138-T142 WeakPolarHBondContact O-CB 3.38Å; R138-T142 PolarHBondContact O-N 3.42Å; R138-T142 PolarHBondContact O-OG1 2.78Å; F139-T142 PolarHBondContact O-N 3.02Å; F139-T142 VanDerWaalsContact O-N 3.17Å; C140-T142 VanDerWaalsContact C-N 3.28Å; C140-T142 PolarHBondContact O-N 3.37Å; T142-E144 VanDerWaalsContact C-N 3.35Å; T142-E144 PolarHBondContact O-N 2.91Å; T142-R145 WeakPolarHBondContact O-CB 3.45Å; T142-R145 PolarHBondContact O-N 2.85Å; T142-E146 WeakPolarHBondContact O-CG 3.47Å; T142-E146 PolarHBondContact O-N 2.85Å |
| 143 | N | 96.8 | Very high | 97.5 | Very high | 77 Ų | 77 | 104.6 Ų | 104.6 | 41% | 0.412 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.2 | -40.7 | 177.5 | -177.8 | 66 | 0 | 0 | 0 | 112.6 | F139 C140 E146 R147 | F139-N143 WeakPolarHBondContact O-CB 3.35Å; F139-N143 PolarHBondContact O-N 3.18Å; C140-N143 PolarHBondContact O-N 3.17Å; N143-E146 PolarHBondContact O-N 3.41Å; N143-R147 WeakPolarHBondContact O-CG 3.18Å; N143-R147 PolarHBondContact O-N 3.48Å |
| 144 | E | 97.1 | Very high | 97.4 | Very high | 131 Ų | 131 | 106.3 Ų | 106.3 | 61% | 0.612 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -60.8 | -45.4 | 174.4 | -172.7 | -173.1 | 168.6 | 0 | 0 | 111.8 | C140 T142 E146 R147 K148 | C140-E144 WeakPolarHBondContact O-CB 3.48Å; C140-E144 PolarHBondContact O-N 3.39Å; T142-E144 VanDerWaalsContact C-N 3.35Å; T142-E144 PolarHBondContact O-N 2.91Å; E144-E146 VanDerWaalsContact C-N 3.35Å; E144-E146 PolarHBondContact O-N 3.24Å; E144-R147 PolarHBondContact O-N 3.26Å; E144-K148 PolarHBondContact O-N 3.42Å |
| 145 | R | 97.8 | Very high | 97.4 | Very high | 167 Ų | 167 | 104.2 Ų | 104.2 | 63% | 0.63 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.4 | -41.4 | 176.8 | -169 | -172.7 | -57.3 | 130 | 3.9 | 112 | K141 T142 K148 N149 | K141-R145 WeakPolarHBondContact O-CB 3.24Å; K141-R145 PolarHBondContact O-N 3.37Å; K141-R145 VanDerWaalsContact O-N 3.13Å; T142-R145 WeakPolarHBondContact O-CB 3.45Å; T142-R145 PolarHBondContact O-N 2.85Å; R145-K148 PolarHBondContact O-N 2.99Å; R145-N149 WeakPolarHBondContact O-CB 3.36Å; R145-N149 PolarHBondContact O-N 2.86Å |
| 146 | E | 97.9 | Very high | 97.4 | Very high | 110 Ų | 110 | 103 Ų | 103 | 51% | 0.514 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.6 | -45.5 | 176.9 | -74.3 | 179.4 | 179.1 | 0 | 0 | 111.7 | T142 N143 E144 K148 N149 I150 | T142-E146 WeakPolarHBondContact O-CG 3.47Å; T142-E146 PolarHBondContact O-N 2.85Å; N143-E146 PolarHBondContact O-N 3.41Å; E144-E146 VanDerWaalsContact C-N 3.35Å; E144-E146 PolarHBondContact O-N 3.24Å; E146-K148 PolarHBondContact O-N 2.94Å; E146-N149 WeakPolarHBondContact O-CB 3.38Å; E146-N149 PolarHBondContact O-N 3.29Å; E146-I150 WeakPolarHBondContact O-CG1 3.47Å; E146-I150 PolarHBondContact O-N 3.42Å |
| 147 | R | 97 | Very high | 97.4 | Very high | 102 Ų | 102 | 104 Ų | 104 | 39% | 0.385 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -57.2 | -48.1 | 173.3 | -79.5 | 177.4 | 39 | 154.1 | -5.4 | 112 | L20 D22 N143 E144 N149 I150 N151 | L20-R147 VanDerWaalsContact CD1-NH2 3.33Å; D22-R147 IonicContact OD2-NH2 3.85Å; D22-R147 PolarHBondContact OD2-NH2 3.38Å; N143-R147 WeakPolarHBondContact O-CG 3.18Å; N143-R147 PolarHBondContact O-N 3.48Å; E144-R147 PolarHBondContact O-N 3.26Å; R147-N149 VanDerWaalsContact C-N 3.32Å; R147-N149 PolarHBondContact O-N 3.14Å; R147-I150 PolarHBondContact O-N 3.42Å; R147-N151 PolarHBondContact O-N 3.25Å |
| 148 | K | 97.7 | Very high | 97.3 | Very high | 121 Ų | 121 | 105.9 Ų | 105.9 | 53% | 0.526 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.8 | -42 | 178.1 | -172 | 165.8 | -174.7 | 155.7 | 0 | 111.5 | E144 R145 E146 N151 N152 | E144-K148 PolarHBondContact O-N 3.42Å; R145-K148 PolarHBondContact O-N 2.99Å; E146-K148 PolarHBondContact O-N 2.94Å; K148-N151 PolarHBondContact O-N 3.14Å; K148-N152 WeakPolarHBondContact O-CB 3.47Å; K148-N152 PolarHBondContact O-N 3.36Å; K148-N152 PolarHBondContact O-OD1 3.07Å |
| 149 | N | 97.7 | Very high | 97.3 | Very high | 81 Ų | 81 | 102.6 Ų | 102.6 | 43% | 0.433 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.1 | -43.3 | 176.2 | -178.1 | 45.9 | 0 | 0 | 0 | 112.4 | R145 E146 R147 K153 | R145-N149 WeakPolarHBondContact O-CB 3.36Å; R145-N149 PolarHBondContact O-N 2.86Å; E146-N149 WeakPolarHBondContact O-CB 3.38Å; E146-N149 PolarHBondContact O-N 3.29Å; R147-N149 VanDerWaalsContact C-N 3.32Å; R147-N149 PolarHBondContact O-N 3.14Å; N149-K153 WeakPolarHBondContact O-CG 3.41Å; N149-K153 PolarHBondContact O-N 2.89Å; N149-K153 VanDerWaalsContact O-N 3.14Å |
| 150 | I | 97 | Very high | 97.3 | Very high | 95 Ų | 95 | 100.2 Ų | 100.2 | 49% | 0.487 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63 | -49 | 175.9 | -68.5 | 166.2 | 0 | 0 | 0 | 110.2 | E146 R147 N152 K153 F154 | E146-I150 WeakPolarHBondContact O-CG1 3.47Å; E146-I150 PolarHBondContact O-N 3.42Å; R147-I150 PolarHBondContact O-N 3.42Å; I150-N152 VanDerWaalsContact C-N 3.35Å; I150-N152 PolarHBondContact O-N 2.88Å; I150-K153 PolarHBondContact O-N 3.27Å; I150-F154 HydrophobicContact CG2-CD2 3.8Å; I150-F154 HydrophobicContact CG2-CE2 3.83Å; I150-F154 WeakPolarHBondContact O-CD2 3.5Å; I150-F154 PolarHBondContact O-N 2.84Å; I150-F154 VanDerWaalsContact O-N 3.07Å |
| 151 | N | 97.1 | Very high | 97.4 | Very high | 73 Ų | 73 | 101.5 Ų | 101.5 | 39% | 0.39 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -58.9 | -45.9 | 179.4 | -169.1 | 30.7 | 0 | 0 | 0 | 111.6 | R147 K148 K153 F154 C155 | R147-N151 PolarHBondContact O-N 3.25Å; K148-N151 PolarHBondContact O-N 3.14Å; N151-K153 VanDerWaalsContact C-N 3.35Å; N151-K153 PolarHBondContact O-N 2.85Å; N151-F154 PolarHBondContact O-N 2.97Å; N151-F154 VanDerWaalsContact O-N 3.14Å; N151-C155 WeakPolarHBondContact O-CB 3.35Å; N151-C155 PolarHBondContact O-N 3.26Å; N151-C155 PolarHBondContact O-SG 3.42Å; N151-C155 VanDerWaalsContact O-SG 3.36Å |
| 152 | N | 97.6 | Very high | 97.4 | Very high | 76 Ų | 76 | 102.5 Ų | 102.5 | 41% | 0.406 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.1 | -45.4 | 177.9 | -72 | -6.1 | 0 | 0 | 0 | 112 | K148 I150 F154 C155 E156 | K148-N152 WeakPolarHBondContact O-CB 3.47Å; K148-N152 PolarHBondContact O-N 3.36Å; K148-N152 PolarHBondContact O-OD1 3.07Å; I150-N152 VanDerWaalsContact C-N 3.35Å; I150-N152 PolarHBondContact O-N 2.88Å; N152-F154 VanDerWaalsContact C-N 3.33Å; N152-F154 PolarHBondContact O-N 3.34Å; N152-C155 PolarHBondContact O-N 3.47Å; N152-E156 WeakPolarHBondContact O-CG 3.4Å; N152-E156 PolarHBondContact O-N 2.94Å |
| 153 | K | 97.4 | Very high | 97.4 | Very high | 114 Ų | 114 | 105.3 Ų | 105.3 | 50% | 0.496 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.2 | -40.6 | 176.7 | -72.2 | 174.2 | -179.2 | -178.4 | 0 | 112.3 | N149 I150 N151 Q157 | N149-K153 WeakPolarHBondContact O-CG 3.41Å; N149-K153 PolarHBondContact O-N 2.89Å; N149-K153 VanDerWaalsContact O-N 3.14Å; I150-K153 PolarHBondContact O-N 3.27Å; N151-K153 VanDerWaalsContact C-N 3.35Å; N151-K153 PolarHBondContact O-N 2.85Å; K153-Q157 WeakPolarHBondContact O-CG 3.44Å; K153-Q157 PolarHBondContact O-N 3.37Å |
| 154 | F | 96.1 | Very high | 97.5 | Very high | 106 Ų | 106 | 108.1 Ų | 108.1 | 47% | 0.465 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.7 | -46.2 | 174.8 | -89 | -76 | 0 | 0 | 0 | 111.5 | I150 N151 N152 E156 Q157 Y158 | I150-F154 HydrophobicContact CG2-CD2 3.8Å; I150-F154 HydrophobicContact CG2-CE2 3.83Å; I150-F154 WeakPolarHBondContact O-CD2 3.5Å; I150-F154 PolarHBondContact O-N 2.84Å; I150-F154 VanDerWaalsContact O-N 3.07Å; N151-F154 PolarHBondContact O-N 2.97Å; N151-F154 VanDerWaalsContact O-N 3.14Å; N152-F154 VanDerWaalsContact C-N 3.33Å; N152-F154 PolarHBondContact O-N 3.34Å; F154-E156 VanDerWaalsContact C-N 3.34Å; F154-E156 PolarHBondContact O-N 2.92Å; F154-Q157 WeakPolarHBondContact O-CB 3.48Å; F154-Q157 PolarHBondContact O-N 3.26Å; F154-Y158 HydrophobicContact CD1-CE2 4.34Å; F154-Y158 WeakPolarHBondContact O-CD2 3.49Å; F154-Y158 PolarHBondContact O-N 3.46Å |
| 155 | C | 97.3 | Very high | 97.6 | Very high | 54 Ų | 54 | 104.7 Ų | 104.7 | 37% | 0.365 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -57.2 | -45.3 | 176.4 | -73 | 0 | 0 | 0 | 0 | 111.8 | N151 N152 Q157 Y158 I159 | N151-C155 WeakPolarHBondContact O-CB 3.35Å; N151-C155 PolarHBondContact O-N 3.26Å; N151-C155 PolarHBondContact O-SG 3.42Å; N151-C155 VanDerWaalsContact O-SG 3.36Å; N152-C155 PolarHBondContact O-N 3.47Å; C155-Q157 VanDerWaalsContact C-N 3.34Å; C155-Q157 PolarHBondContact O-N 3.44Å; C155-Y158 PolarHBondContact O-N 2.97Å; C155-I159 WeakPolarHBondContact O-CB 3.4Å; C155-I159 VanDerWaalsContact O-CG1 3.24Å; C155-I159 WeakPolarHBondContact O-CG1 3.39Å; C155-I159 PolarHBondContact O-N 3.4Å |
| 156 | E | 97.3 | Very high | 97.6 | Very high | 126 Ų | 126 | 101.4 Ų | 101.4 | 59% | 0.589 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -58.1 | -43.5 | 175.5 | -75.4 | 174.3 | -176.4 | 0 | 0 | 112.3 | N152 F154 T160 | N152-E156 WeakPolarHBondContact O-CG 3.4Å; N152-E156 PolarHBondContact O-N 2.94Å; F154-E156 VanDerWaalsContact C-N 3.34Å; F154-E156 PolarHBondContact O-N 2.92Å; E156-T160 WeakPolarHBondContact O-CB 3.38Å; E156-T160 PolarHBondContact O-N 3.36Å; E156-T160 PolarHBondContact O-OG1 3.31Å |
| 157 | Q | 97.3 | Very high | 97.6 | Very high | 123 Ų | 123 | 102.1 Ų | 102.1 | 58% | 0.575 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63.8 | -44 | 176.3 | -73.5 | -178.6 | -7.4 | 0 | 0 | 112.2 | K153 F154 C155 T161 | K153-Q157 WeakPolarHBondContact O-CG 3.44Å; K153-Q157 PolarHBondContact O-N 3.37Å; F154-Q157 WeakPolarHBondContact O-CB 3.48Å; F154-Q157 PolarHBondContact O-N 3.26Å; C155-Q157 VanDerWaalsContact C-N 3.34Å; C155-Q157 PolarHBondContact O-N 3.44Å; Q157-T161 WeakPolarHBondContact O-CB 3.34Å; Q157-T161 PolarHBondContact O-N 2.92Å; Q157-T161 PolarHBondContact O-OG1 3.13Å |
| 158 | Y | 96.5 | Very high | 97.7 | Very high | 140 Ų | 140 | 101.5 Ų | 101.5 | 55% | 0.549 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.3 | -48.8 | 177 | -82.5 | -66.1 | 0 | 0 | 0 | 111.5 | F154 C155 T160 T161 F162 | F154-Y158 HydrophobicContact CD1-CE2 4.34Å; F154-Y158 WeakPolarHBondContact O-CD2 3.49Å; F154-Y158 PolarHBondContact O-N 3.46Å; C155-Y158 PolarHBondContact O-N 2.97Å; Y158-T160 VanDerWaalsContact C-N 3.32Å; Y158-T160 PolarHBondContact O-N 2.94Å; Y158-T161 PolarHBondContact O-N 2.93Å; Y158-T161 VanDerWaalsContact O-N 3.14Å; Y158-F162 AromaticContact CD1-CE2 4Å; Y158-F162 HydrophobicContact CD1-CE2 4Å; Y158-F162 HydrophobicContact CG-CE2 4.47Å; Y158-F162 WeakPolarHBondContact O-CD2 3.31Å; Y158-F162 PolarHBondContact O-N 2.92Å |
| 159 | I | 97.7 | Very high | 97.7 | Very high | 95 Ų | 95 | 99.5 Ų | 99.5 | 49% | 0.487 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -56.3 | -48.8 | 178.3 | -70.1 | 164.9 | 0 | 0 | 0 | 110.2 | C155 T161 F162 Q163 | C155-I159 WeakPolarHBondContact O-CB 3.4Å; C155-I159 VanDerWaalsContact O-CG1 3.24Å; C155-I159 WeakPolarHBondContact O-CG1 3.39Å; C155-I159 PolarHBondContact O-N 3.4Å; I159-T161 VanDerWaalsContact C-N 3.31Å; I159-T161 PolarHBondContact O-N 3.36Å; I159-F162 PolarHBondContact O-N 2.94Å; I159-Q163 HydrophobicContact CG2-CG 4.4Å; I159-Q163 WeakPolarHBondContact O-CB 3.47Å; I159-Q163 VanDerWaalsContact O-CG 3.31Å; I159-Q163 WeakPolarHBondContact O-CG 3.21Å; I159-Q163 PolarHBondContact O-N 2.76Å |
| 160 | T | 97.9 | Very high | 97.7 | Very high | 87 Ų | 87 | 101.6 Ų | 101.6 | 53% | 0.534 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.4 | -41.8 | 178.7 | -56.6 | 0 | 0 | 0 | 0 | 111.7 | E156 Y158 K164 | E156-T160 WeakPolarHBondContact O-CB 3.38Å; E156-T160 PolarHBondContact O-N 3.36Å; E156-T160 PolarHBondContact O-OG1 3.31Å; Y158-T160 VanDerWaalsContact C-N 3.32Å; Y158-T160 PolarHBondContact O-N 2.94Å; T160-K164 WeakPolarHBondContact O-CB 3.49Å; T160-K164 PolarHBondContact O-N 3.22Å |
| 161 | T | 98.1 | Very high | 97.8 | Very high | 91 Ų | 91 | 102.8 Ų | 102.8 | 56% | 0.558 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -66.7 | -42.7 | 179.1 | -58.6 | 0 | 0 | 0 | 0 | 111.7 | Q157 Y158 I159 K164 S165 | Q157-T161 WeakPolarHBondContact O-CB 3.34Å; Q157-T161 PolarHBondContact O-N 2.92Å; Q157-T161 PolarHBondContact O-OG1 3.13Å; Y158-T161 PolarHBondContact O-N 2.93Å; Y158-T161 VanDerWaalsContact O-N 3.14Å; I159-T161 VanDerWaalsContact C-N 3.31Å; I159-T161 PolarHBondContact O-N 3.36Å; T161-K164 PolarHBondContact O-N 3.17Å; T161-S165 WeakPolarHBondContact O-CB 3.22Å; T161-S165 PolarHBondContact O-N 2.89Å |
| 162 | F | 98.2 | Very high | 97.9 | Very high | 127 Ų | 127 | 105.3 Ų | 105.3 | 56% | 0.557 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -66.9 | -43.6 | 177.5 | -75 | -59 | 0 | 0 | 0 | 112 | Y158 I159 K164 S165 D166 | Y158-F162 AromaticContact CD1-CE2 4Å; Y158-F162 HydrophobicContact CD1-CE2 4Å; Y158-F162 HydrophobicContact CG-CE2 4.47Å; Y158-F162 WeakPolarHBondContact O-CD2 3.31Å; Y158-F162 PolarHBondContact O-N 2.92Å; I159-F162 PolarHBondContact O-N 2.94Å; F162-K164 VanDerWaalsContact C-N 3.31Å; F162-K164 PolarHBondContact O-N 3.03Å; F162-S165 WeakPolarHBondContact O-CB 3.32Å; F162-S165 PolarHBondContact O-N 3.16Å; F162-S165 VanDerWaalsContact O-N 3.13Å; F162-D166 PolarHBondContact O-N 3.29Å |
| 163 | Q | 98.4 | Very high | 97.9 | Very high | 116 Ų | 116 | 105.6 Ų | 105.6 | 54% | 0.542 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -57.7 | -43.9 | 174.5 | -74.6 | 175.9 | -16.9 | 0 | 0 | 111.8 | I159 D166 M167 | I159-Q163 HydrophobicContact CG2-CG 4.4Å; I159-Q163 WeakPolarHBondContact O-CB 3.47Å; I159-Q163 VanDerWaalsContact O-CG 3.31Å; I159-Q163 WeakPolarHBondContact O-CG 3.21Å; I159-Q163 PolarHBondContact O-N 2.76Å; Q163-D166 PolarHBondContact O-N 3.2Å; Q163-M167 WeakPolarHBondContact O-CG 3.38Å; Q163-M167 PolarHBondContact O-N 3.43Å |
| 164 | K | 98.3 | Very high | 98 | Very high | 135 Ų | 135 | 105.3 Ų | 105.3 | 59% | 0.587 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.6 | -44.9 | 174.8 | -176.3 | -179.8 | 176.6 | -176.6 | 0 | 111.8 | T160 T161 F162 D166 M167 D168 | T160-K164 WeakPolarHBondContact O-CB 3.49Å; T160-K164 PolarHBondContact O-N 3.22Å; T161-K164 PolarHBondContact O-N 3.17Å; F162-K164 VanDerWaalsContact C-N 3.31Å; F162-K164 PolarHBondContact O-N 3.03Å; K164-D166 VanDerWaalsContact C-N 3.32Å; K164-D166 PolarHBondContact O-N 3.34Å; K164-M167 WeakPolarHBondContact O-CB 3.39Å; K164-M167 PolarHBondContact O-N 3.13Å; K164-D168 PolarHBondContact O-N 2.98Å |
| 165 | S | 98.4 | Very high | 98.1 | Very high | 59 Ų | 59 | 105.3 Ų | 105.3 | 41% | 0.413 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.5 | -42.2 | 176.8 | -176.2 | 0 | 0 | 0 | 0 | 111.9 | T161 F162 D168 V169 | T161-S165 WeakPolarHBondContact O-CB 3.22Å; T161-S165 PolarHBondContact O-N 2.89Å; F162-S165 WeakPolarHBondContact O-CB 3.32Å; F162-S165 PolarHBondContact O-N 3.16Å; F162-S165 VanDerWaalsContact O-N 3.13Å; S165-D168 PolarHBondContact O-N 3.47Å; S165-V169 WeakPolarHBondContact O-CG2 3.38Å; S165-V169 PolarHBondContact O-N 3.44Å |
| 166 | D | 98.5 | Very high | 98.1 | Very high | 99 Ų | 99 | 108.3 Ų | 108.3 | 53% | 0.529 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.1 | -41.8 | 177.9 | -74.4 | -20 | 0 | 0 | 0 | 111.5 | F162 Q163 K164 V169 Q170 | F162-D166 PolarHBondContact O-N 3.29Å; Q163-D166 PolarHBondContact O-N 3.2Å; K164-D166 VanDerWaalsContact C-N 3.32Å; K164-D166 PolarHBondContact O-N 3.34Å; D166-V169 PolarHBondContact O-N 2.97Å; D166-Q170 WeakPolarHBondContact O-CG 3.34Å; D166-Q170 PolarHBondContact O-N 3.33Å |
| 167 | M | 98.4 | Very high | 98.2 | Very high | 125 Ų | 125 | 108.4 Ų | 108.4 | 62% | 0.616 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -60.7 | -44.2 | 172.8 | -73.8 | 175 | 50.2 | 0 | 0 | 112.3 | Q163 K164 V169 Q170 K171 | Q163-M167 WeakPolarHBondContact O-CG 3.38Å; Q163-M167 PolarHBondContact O-N 3.43Å; K164-M167 WeakPolarHBondContact O-CB 3.39Å; K164-M167 PolarHBondContact O-N 3.13Å; M167-V169 VanDerWaalsContact C-N 3.31Å; M167-V169 PolarHBondContact O-N 2.87Å; M167-Q170 PolarHBondContact O-N 2.92Å; M167-K171 WeakPolarHBondContact O-CB 3.35Å; M167-K171 PolarHBondContact O-N 3.05Å |
| 168 | D | 98.5 | Very high | 98.2 | Very high | 89 Ų | 89 | 109.1 Ų | 109.1 | 48% | 0.476 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.4 | -38.2 | 178.5 | -73.1 | -24.3 | 0 | 0 | 0 | 111.2 | K164 S165 K171 F172 | K164-D168 PolarHBondContact O-N 2.98Å; S165-D168 PolarHBondContact O-N 3.47Å; D168-K171 PolarHBondContact O-N 3.18Å; D168-F172 WeakPolarHBondContact O-CB 2.95Å; D168-F172 PolarHBondContact O-N 3.4Å |
| 169 | V | 98.4 | Very high | 98.3 | Very high | 78 Ų | 78 | 106.2 Ų | 106.2 | 47% | 0.473 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.3 | -42.2 | 174.1 | 169.6 | 0 | 0 | 0 | 0 | 111.9 | S165 D166 M167 F172 N173 | S165-V169 WeakPolarHBondContact O-CG2 3.38Å; S165-V169 PolarHBondContact O-N 3.44Å; D166-V169 PolarHBondContact O-N 2.97Å; M167-V169 VanDerWaalsContact C-N 3.31Å; M167-V169 PolarHBondContact O-N 2.87Å; V169-F172 PolarHBondContact O-N 2.82Å; V169-N173 PolarHBondContact O-N 3.37Å; V169-N173 PolarHBondContact O-ND2 3.39Å |
| 170 | Q | 98.4 | Very high | 98.3 | Very high | 126 Ų | 126 | 105.6 Ų | 105.6 | 59% | 0.589 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -61.2 | -49.6 | 175.4 | -73.2 | 177.8 | 3.3 | 0 | 0 | 111 | D166 M167 F172 N173 E174 | D166-Q170 WeakPolarHBondContact O-CG 3.34Å; D166-Q170 PolarHBondContact O-N 3.33Å; M167-Q170 PolarHBondContact O-N 2.92Å; Q170-F172 VanDerWaalsContact C-N 3.33Å; Q170-F172 PolarHBondContact O-N 2.85Å; Q170-N173 WeakPolarHBondContact O-CB 3.42Å; Q170-N173 PolarHBondContact O-N 2.84Å; Q170-N173 VanDerWaalsContact O-N 3.09Å; Q170-E174 PolarHBondContact O-N 2.92Å; Q170-E174 VanDerWaalsContact O-N 3.08Å |
| 171 | K | 98.6 | Very high | 98.3 | Very high | 119 Ų | 119 | 105 Ų | 105 | 52% | 0.517 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59 | -43.4 | 177.7 | -174.3 | -178.1 | 175.5 | -171.3 | 0 | 112.1 | M167 D168 N173 E174 E175 | M167-K171 WeakPolarHBondContact O-CB 3.35Å; M167-K171 PolarHBondContact O-N 3.05Å; D168-K171 PolarHBondContact O-N 3.18Å; K171-N173 VanDerWaalsContact C-N 3.3Å; K171-N173 PolarHBondContact O-N 3.43Å; K171-E174 PolarHBondContact O-N 3.32Å; K171-E175 VanDerWaalsContact CE-OE1 3.29Å; K171-E175 WeakPolarHBondContact CE-OE1 3.34Å; K171-E175 PolarHBondContact O-N 3.16Å |
| 172 | F | 98.4 | Very high | 98.3 | Very high | 126 Ų | 126 | 104 Ų | 104 | 55% | 0.553 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -58.9 | -41.5 | 175.4 | 173.2 | -98.4 | 0 | 0 | 0 | 112.1 | D168 V169 Q170 E175 K176 | D168-F172 WeakPolarHBondContact O-CB 2.95Å; D168-F172 PolarHBondContact O-N 3.4Å; V169-F172 PolarHBondContact O-N 2.82Å; Q170-F172 VanDerWaalsContact C-N 3.33Å; Q170-F172 PolarHBondContact O-N 2.85Å; F172-E175 PolarHBondContact O-N 2.95Å; F172-K176 HydrophobicContact CE1-CD 4.33Å; F172-K176 VanDerWaalsContact O-CB 3.25Å; F172-K176 WeakPolarHBondContact O-CB 3.42Å; F172-K176 PolarHBondContact O-N 3.17Å |
| 173 | N | 98.4 | Very high | 98.3 | Very high | 82 Ų | 82 | 101.6 Ų | 101.6 | 44% | 0.439 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.2 | -39.4 | 178.1 | -75.5 | -36.2 | 0 | 0 | 0 | 112.4 | V169 Q170 K171 K176 E177 | V169-N173 PolarHBondContact O-N 3.37Å; V169-N173 PolarHBondContact O-ND2 3.39Å; Q170-N173 WeakPolarHBondContact O-CB 3.42Å; Q170-N173 PolarHBondContact O-N 2.84Å; Q170-N173 VanDerWaalsContact O-N 3.09Å; K171-N173 VanDerWaalsContact C-N 3.3Å; K171-N173 PolarHBondContact O-N 3.43Å; N173-K176 PolarHBondContact O-N 3.43Å; N173-E177 PolarHBondContact O-N 3Å |
| 174 | E | 98.4 | Very high | 98.3 | Very high | 109 Ų | 109 | 101 Ų | 101 | 51% | 0.509 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.8 | -44.9 | 174.5 | -67.8 | 178.9 | -170.5 | 0 | 0 | 112.3 | Q170 K171 K176 E177 K178 | Q170-E174 PolarHBondContact O-N 2.92Å; Q170-E174 VanDerWaalsContact O-N 3.08Å; K171-E174 PolarHBondContact O-N 3.32Å; E174-K176 VanDerWaalsContact C-N 3.34Å; E174-E177 PolarHBondContact O-N 3.48Å; E174-K178 WeakPolarHBondContact O-CG 3.48Å; E174-K178 PolarHBondContact O-N 3.37Å |
| 175 | E | 98.3 | Very high | 98.3 | Very high | 106 Ų | 106 | 102 Ų | 102 | 50% | 0.495 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64 | -41.1 | 177 | -73.3 | 179.8 | -175.3 | 0 | 0 | 111.5 | K171 F172 K178 S179 | K171-E175 VanDerWaalsContact CE-OE1 3.29Å; K171-E175 WeakPolarHBondContact CE-OE1 3.34Å; K171-E175 PolarHBondContact O-N 3.16Å; F172-E175 PolarHBondContact O-N 2.95Å; E175-K178 PolarHBondContact O-N 3.3Å; E175-S179 WeakPolarHBondContact O-CB 3.47Å; E175-S179 PolarHBondContact O-N 3.03Å |
| 176 | K | 98.3 | Very high | 98.3 | Very high | 117 Ų | 117 | 105.7 Ų | 105.7 | 51% | 0.509 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -59.9 | -45.4 | 174.2 | 177.4 | -175.5 | 172.1 | -174.7 | 0 | 111.6 | F172 N173 E174 S179 V180 | F172-K176 HydrophobicContact CE1-CD 4.33Å; F172-K176 VanDerWaalsContact O-CB 3.25Å; F172-K176 WeakPolarHBondContact O-CB 3.42Å; F172-K176 PolarHBondContact O-N 3.17Å; N173-K176 PolarHBondContact O-N 3.43Å; E174-K176 VanDerWaalsContact C-N 3.34Å; K176-S179 PolarHBondContact O-N 2.63Å; K176-V180 WeakPolarHBondContact O-CG2 3.35Å; K176-V180 PolarHBondContact O-N 2.8Å |
| 177 | E | 98.3 | Very high | 98.3 | Very high | 128 Ų | 128 | 106 Ų | 106 | 60% | 0.598 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.7 | -44.1 | 178.2 | -173.7 | 177 | 177.6 | 0 | 0 | 111.7 | N173 E174 S179 V180 N181 | N173-E177 PolarHBondContact O-N 3Å; E174-E177 PolarHBondContact O-N 3.48Å; E177-S179 VanDerWaalsContact C-N 3.33Å; E177-S179 PolarHBondContact O-N 2.79Å; E177-V180 PolarHBondContact O-N 3.49Å; E177-N181 PolarHBondContact O-N 2.88Å; E177-N181 PolarHBondContact O-ND2 3.44Å |
| 178 | K | 98.3 | Very high | 98.3 | Very high | 137 Ų | 137 | 105.1 Ų | 105.1 | 60% | 0.596 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -57.6 | -44.9 | 174 | -71.3 | 169.8 | -173.6 | 166 | 0 | 111.8 | E174 E175 N181 S182 | E174-K178 WeakPolarHBondContact O-CG 3.48Å; E174-K178 PolarHBondContact O-N 3.37Å; E175-K178 PolarHBondContact O-N 3.3Å; K178-N181 PolarHBondContact O-N 3.46Å; K178-S182 PolarHBondContact O-N 2.89Å |
| 179 | S | 97.9 | Very high | 98.3 | Very high | 80 Ų | 80 | 103.7 Ų | 103.7 | 56% | 0.559 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64 | -44 | 177.9 | 178 | 0 | 0 | 0 | 0 | 112.3 | E175 K176 E177 N181 S182 C183 | E175-S179 WeakPolarHBondContact O-CB 3.47Å; E175-S179 PolarHBondContact O-N 3.03Å; K176-S179 PolarHBondContact O-N 2.63Å; E177-S179 VanDerWaalsContact C-N 3.33Å; E177-S179 PolarHBondContact O-N 2.79Å; S179-N181 PolarHBondContact O-N 2.88Å; S179-S182 PolarHBondContact O-N 3.29Å; S179-C183 WeakPolarHBondContact O-CB 3.4Å; S179-C183 PolarHBondContact O-N 2.75Å |
| 180 | V | 98.4 | Very high | 98.3 | Very high | 81 Ų | 81 | 106 Ų | 106 | 49% | 0.491 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -59.6 | -45.7 | 176 | 169.7 | 0 | 0 | 0 | 0 | 111 | K176 E177 S182 C183 Q184 | K176-V180 WeakPolarHBondContact O-CG2 3.35Å; K176-V180 PolarHBondContact O-N 2.8Å; E177-V180 PolarHBondContact O-N 3.49Å; V180-S182 VanDerWaalsContact C-N 3.34Å; V180-S182 PolarHBondContact O-N 3.46Å; V180-C183 PolarHBondContact O-N 2.92Å; V180-Q184 PolarHBondContact O-N 3.45Å |
| 181 | N | 98.3 | Very high | 98.3 | Very high | 74 Ų | 74 | 106.3 Ų | 106.3 | 40% | 0.396 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.5 | -39.7 | 177.7 | -72.8 | -27.8 | 0 | 0 | 0 | 112.3 | E177 K178 S179 Q184 K185 | E177-N181 PolarHBondContact O-N 2.88Å; E177-N181 PolarHBondContact O-ND2 3.44Å; K178-N181 PolarHBondContact O-N 3.46Å; S179-N181 PolarHBondContact O-N 2.88Å; N181-Q184 PolarHBondContact O-N 2.89Å; N181-K185 WeakPolarHBondContact O-CG 3.37Å; N181-K185 PolarHBondContact O-N 3.49Å; N181-K185 VanDerWaalsContact O-N 3.16Å |
| 182 | S | 98.1 | Very high | 98.3 | Very high | 71 Ų | 71 | 106.7 Ų | 106.7 | 50% | 0.497 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.8 | -47.2 | 175.1 | -168 | 0 | 0 | 0 | 0 | 111.7 | K178 S179 V180 Q184 K185 E186 | K178-S182 PolarHBondContact O-N 2.89Å; S179-S182 PolarHBondContact O-N 3.29Å; V180-S182 VanDerWaalsContact C-N 3.34Å; V180-S182 PolarHBondContact O-N 3.46Å; S182-Q184 VanDerWaalsContact C-N 3.29Å; S182-Q184 PolarHBondContact O-N 2.99Å; S182-K185 PolarHBondContact O-N 2.91Å; S182-K185 VanDerWaalsContact O-N 3.17Å; S182-E186 PolarHBondContact O-N 3.16Å |
| 183 | C | 97.9 | Very high | 98.2 | Very high | 77 Ų | 77 | 104.5 Ų | 104.5 | 52% | 0.52 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.7 | -39.9 | 177.8 | -177.4 | 0 | 0 | 0 | 0 | 111.7 | S179 V180 E186 Q187 | S179-C183 WeakPolarHBondContact O-CB 3.4Å; S179-C183 PolarHBondContact O-N 2.75Å; V180-C183 PolarHBondContact O-N 2.92Å; C183-E186 PolarHBondContact O-N 2.91Å; C183-Q187 VanDerWaalsContact O-CB 3.29Å; C183-Q187 WeakPolarHBondContact O-CB 3.34Å; C183-Q187 PolarHBondContact O-N 3.4Å |
| 184 | Q | 98.4 | Very high | 98.2 | Very high | 102 Ų | 102 | 107.1 Ų | 107.1 | 48% | 0.477 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.5 | -42.7 | 175.7 | -176.4 | 178.1 | -17.1 | 0 | 0 | 112.4 | V180 N181 S182 Q187 Q188 | V180-Q184 PolarHBondContact O-N 3.45Å; N181-Q184 PolarHBondContact O-N 2.89Å; S182-Q184 VanDerWaalsContact C-N 3.29Å; S182-Q184 PolarHBondContact O-N 2.99Å; Q184-Q187 PolarHBondContact O-N 2.93Å; Q184-Q188 WeakPolarHBondContact O-CG 3.32Å; Q184-Q188 PolarHBondContact O-N 3.08Å |
| 185 | K | 98.4 | Very high | 98.2 | Very high | 156 Ų | 156 | 105 Ų | 105 | 68% | 0.678 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63 | -45.6 | 176 | -72.3 | 177.7 | -178.8 | 179.9 | 0 | 111.4 | N181 S182 Q187 Q188 A189 | N181-K185 WeakPolarHBondContact O-CG 3.37Å; N181-K185 PolarHBondContact O-N 3.49Å; N181-K185 VanDerWaalsContact O-N 3.16Å; S182-K185 PolarHBondContact O-N 2.91Å; S182-K185 VanDerWaalsContact O-N 3.17Å; K185-Q187 VanDerWaalsContact C-N 3.34Å; K185-Q187 PolarHBondContact O-N 3.38Å; K185-Q188 PolarHBondContact O-N 3.29Å; K185-A189 PolarHBondContact O-N 3.05Å |
| 186 | E | 98 | Very high | 98.2 | Very high | 138 Ų | 138 | 103 Ų | 103 | 65% | 0.645 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -62.9 | -41.7 | 177.5 | -171.2 | 174.8 | -177.5 | 0 | 0 | 111.5 | S182 C183 Q188 A189 L190 | S182-E186 PolarHBondContact O-N 3.16Å; C183-E186 PolarHBondContact O-N 2.91Å; E186-Q188 VanDerWaalsContact C-N 3.31Å; E186-Q188 PolarHBondContact O-N 3.12Å; E186-A189 PolarHBondContact O-N 3.01Å; E186-L190 WeakPolarHBondContact O-CB 3.42Å; E186-L190 PolarHBondContact O-N 3.31Å |
| 187 | Q | 98.2 | Very high | 98.2 | Very high | 105 Ų | 105 | 103.8 Ų | 103.8 | 49% | 0.491 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.8 | -39.1 | 175 | -169.5 | -174.2 | 27.4 | 0 | 0 | 112.2 | C183 Q184 K185 K191 | C183-Q187 VanDerWaalsContact O-CB 3.29Å; C183-Q187 WeakPolarHBondContact O-CB 3.34Å; C183-Q187 PolarHBondContact O-N 3.4Å; Q184-Q187 PolarHBondContact O-N 2.93Å; K185-Q187 VanDerWaalsContact C-N 3.34Å; K185-Q187 PolarHBondContact O-N 3.38Å; Q187-K191 WeakPolarHBondContact O-CG 3.3Å; Q187-K191 PolarHBondContact O-N 2.84Å; Q187-K191 VanDerWaalsContact O-N 3.16Å |
| 188 | Q | 98.4 | Very high | 98.2 | Very high | 107 Ų | 107 | 101.7 Ų | 101.7 | 50% | 0.5 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -67.1 | -44.9 | 174.9 | -72.7 | 178.5 | -0.1 | 0 | 0 | 111.7 | Q184 K185 E186 L190 K191 L192 | Q184-Q188 WeakPolarHBondContact O-CG 3.32Å; Q184-Q188 PolarHBondContact O-N 3.08Å; K185-Q188 PolarHBondContact O-N 3.29Å; E186-Q188 VanDerWaalsContact C-N 3.31Å; E186-Q188 PolarHBondContact O-N 3.12Å; Q188-L190 VanDerWaalsContact C-N 3.33Å; Q188-L190 PolarHBondContact O-N 3.47Å; Q188-K191 PolarHBondContact O-N 3.43Å; Q188-L192 PolarHBondContact O-N 3.45Å; Q188-L192 VanDerWaalsContact O-N 3.09Å |
| 189 | A | 98.3 | Very high | 98.2 | Very high | 58 Ų | 58 | 101.2 Ų | 101.2 | 48% | 0.479 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60 | -42.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | K185 E186 K191 L192 S193 | K185-A189 PolarHBondContact O-N 3.05Å; E186-A189 PolarHBondContact O-N 3.01Å; A189-K191 PolarHBondContact O-N 3.43Å; A189-L192 PolarHBondContact O-N 3.24Å; A189-S193 WeakPolarHBondContact O-CB 3.34Å; A189-S193 PolarHBondContact O-N 2.99Å |
| 190 | L | 98.3 | Very high | 98.2 | Very high | 126 Ų | 126 | 101.4 Ų | 101.4 | 66% | 0.66 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -60.3 | -44.4 | 176.1 | -170.3 | 94.7 | 0 | 0 | 0 | 111.9 | E186 Q188 S193 K194 | E186-L190 WeakPolarHBondContact O-CB 3.42Å; E186-L190 PolarHBondContact O-N 3.31Å; Q188-L190 VanDerWaalsContact C-N 3.33Å; Q188-L190 PolarHBondContact O-N 3.47Å; L190-S193 PolarHBondContact O-N 3.47Å; L190-K194 WeakPolarHBondContact O-CB 3.32Å; L190-K194 PolarHBondContact O-N 3.17Å |
| 191 | K | 98.3 | Very high | 98.1 | Very high | 133 Ų | 133 | 101.9 Ų | 101.9 | 58% | 0.578 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -60.9 | -44.5 | 177.1 | -75.6 | 175.9 | -178.4 | 178.5 | 0 | 111.8 | Q187 Q188 A189 K194 C195 | Q187-K191 WeakPolarHBondContact O-CG 3.3Å; Q187-K191 PolarHBondContact O-N 2.84Å; Q187-K191 VanDerWaalsContact O-N 3.16Å; Q188-K191 PolarHBondContact O-N 3.43Å; A189-K191 PolarHBondContact O-N 3.43Å; K191-K194 PolarHBondContact O-N 3.36Å; K191-C195 PolarHBondContact O-N 2.96Å; K191-C195 VanDerWaalsContact O-N 3.07Å |
| 192 | L | 98.3 | Very high | 98.1 | Very high | 128 Ų | 128 | 103.4 Ų | 103.4 | 67% | 0.67 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -64.7 | -45.2 | 177.6 | -70.8 | 173.6 | 0 | 0 | 0 | 111.8 | Q188 A189 K194 C195 S196 | Q188-L192 PolarHBondContact O-N 3.45Å; Q188-L192 VanDerWaalsContact O-N 3.09Å; A189-L192 PolarHBondContact O-N 3.24Å; L192-K194 VanDerWaalsContact C-N 3.31Å; L192-K194 PolarHBondContact O-N 2.96Å; L192-C195 WeakPolarHBondContact O-CB 3.39Å; L192-C195 PolarHBondContact O-N 2.9Å; L192-S196 PolarHBondContact O-N 2.89Å |
| 193 | S | 98 | Very high | 98.1 | Very high | 79 Ų | 79 | 102.2 Ų | 102.2 | 55% | 0.552 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -58.2 | -43.5 | 176.4 | -173.1 | 0 | 0 | 0 | 0 | 111.8 | A189 L190 S196 Q197 | A189-S193 WeakPolarHBondContact O-CB 3.34Å; A189-S193 PolarHBondContact O-N 2.99Å; L190-S193 PolarHBondContact O-N 3.47Å; S193-S196 PolarHBondContact O-N 3.09Å; S193-Q197 WeakPolarHBondContact O-CB 3.44Å; S193-Q197 PolarHBondContact O-N 3.5Å |
| 194 | K | 98.3 | Very high | 98.1 | Very high | 137 Ų | 137 | 102.3 Ų | 102.3 | 60% | 0.596 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -64 | -40.6 | 177.3 | -172.1 | 176.4 | -178.3 | 177.4 | 0 | 112.1 | L190 K191 L192 N198 | L190-K194 WeakPolarHBondContact O-CB 3.32Å; L190-K194 PolarHBondContact O-N 3.17Å; K191-K194 PolarHBondContact O-N 3.36Å; L192-K194 VanDerWaalsContact C-N 3.31Å; L192-K194 PolarHBondContact O-N 2.96Å; K194-N198 PolarHBondContact O-N 2.93Å; K194-N198 VanDerWaalsContact O-N 3.08Å |
| 195 | C | 98.1 | Very high | 98.1 | Very high | 64 Ų | 64 | 102.3 Ų | 102.3 | 43% | 0.432 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.9 | -48 | 175.6 | -171.4 | 0 | 0 | 0 | 0 | 111.5 | K191 L192 Q197 N198 Q199 | K191-C195 PolarHBondContact O-N 2.96Å; K191-C195 VanDerWaalsContact O-N 3.07Å; L192-C195 WeakPolarHBondContact O-CB 3.39Å; L192-C195 PolarHBondContact O-N 2.9Å; C195-Q197 PolarHBondContact O-N 3.49Å; C195-N198 PolarHBondContact O-N 3.47Å; C195-Q199 WeakPolarHBondContact O-CG 3.38Å; C195-Q199 PolarHBondContact O-N 3.4Å |
| 196 | S | 97.8 | Very high | 98.1 | Very high | 64 Ų | 64 | 101.4 Ų | 101.4 | 45% | 0.448 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.5 | -41 | 178.5 | 176.3 | 0 | 0 | 0 | 0 | 112.6 | L192 S193 Q199 T200 | L192-S196 PolarHBondContact O-N 2.89Å; S193-S196 PolarHBondContact O-N 3.09Å; S196-Q199 PolarHBondContact O-N 2.75Å; S196-T200 WeakPolarHBondContact O-CB 3.35Å; S196-T200 PolarHBondContact O-N 3.36Å; S196-T200 PolarHBondContact O-OG1 3.22Å |
| 197 | Q | 98 | Very high | 98 | Very high | 134 Ų | 134 | 100.8 Ų | 100.8 | 63% | 0.626 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.1 | -43.8 | 175.4 | -172.5 | -179.5 | 16.5 | 0 | 0 | 111.6 | S193 C195 T200 L201 | S193-Q197 WeakPolarHBondContact O-CB 3.44Å; S193-Q197 PolarHBondContact O-N 3.5Å; C195-Q197 PolarHBondContact O-N 3.49Å; Q197-T200 PolarHBondContact O-N 3.36Å; Q197-L201 WeakPolarHBondContact O-CB 3.34Å; Q197-L201 PolarHBondContact O-N 2.94Å |
| 198 | N | 98.1 | Very high | 98 | Very high | 85 Ų | 85 | 101.6 Ų | 101.6 | 46% | 0.455 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.9 | -44.1 | 176.5 | -74 | -14.9 | 0 | 0 | 0 | 111.8 | K194 C195 T200 L201 E202 | K194-N198 PolarHBondContact O-N 2.93Å; K194-N198 VanDerWaalsContact O-N 3.08Å; C195-N198 PolarHBondContact O-N 3.47Å; N198-T200 VanDerWaalsContact C-N 3.33Å; N198-T200 PolarHBondContact O-N 2.92Å; N198-L201 WeakPolarHBondContact O-CB 3.45Å; N198-L201 PolarHBondContact O-N 2.97Å; N198-E202 WeakPolarHBondContact O-CG 3.38Å; N198-E202 PolarHBondContact O-N 3.43Å |
| 199 | Q | 97.8 | Very high | 97.9 | Very high | 127 Ų | 127 | 103.2 Ų | 103.2 | 59% | 0.593 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -60.6 | -42.7 | 175.9 | -72.4 | 173.6 | -18.2 | 0 | 0 | 112 | C195 S196 L201 E202 A203 | C195-Q199 WeakPolarHBondContact O-CG 3.38Å; C195-Q199 PolarHBondContact O-N 3.4Å; S196-Q199 PolarHBondContact O-N 2.75Å; Q199-L201 VanDerWaalsContact C-N 3.33Å; Q199-L201 PolarHBondContact O-N 2.8Å; Q199-E202 PolarHBondContact O-N 3.12Å; Q199-A203 PolarHBondContact O-N 2.9Å |
| 200 | T | 98 | Very high | 97.8 | Very high | 83 Ų | 83 | 107 Ų | 107 | 51% | 0.509 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.5 | -42.4 | 176.8 | -55.3 | 0 | 0 | 0 | 0 | 111 | S196 Q197 N198 A203 V204 | S196-T200 WeakPolarHBondContact O-CB 3.35Å; S196-T200 PolarHBondContact O-N 3.36Å; S196-T200 PolarHBondContact O-OG1 3.22Å; Q197-T200 PolarHBondContact O-N 3.36Å; N198-T200 VanDerWaalsContact C-N 3.33Å; N198-T200 PolarHBondContact O-N 2.92Å; T200-A203 PolarHBondContact O-N 3.3Å; T200-V204 WeakPolarHBondContact O-CG2 3.41Å; T200-V204 PolarHBondContact O-N 2.96Å |
| 201 | L | 98 | Very high | 97.7 | Very high | 91 Ų | 91 | 104.4 Ų | 104.4 | 48% | 0.476 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.2 | -44.3 | 176.3 | 179.3 | 63.5 | 0 | 0 | 0 | 111.9 | Q197 N198 Q199 V204 K205 | Q197-L201 WeakPolarHBondContact O-CB 3.34Å; Q197-L201 PolarHBondContact O-N 2.94Å; N198-L201 WeakPolarHBondContact O-CB 3.45Å; N198-L201 PolarHBondContact O-N 2.97Å; Q199-L201 VanDerWaalsContact C-N 3.33Å; Q199-L201 PolarHBondContact O-N 2.8Å; L201-V204 PolarHBondContact O-N 3.41Å; L201-K205 WeakPolarHBondContact O-CG 3.28Å; L201-K205 PolarHBondContact O-N 3.36Å |
| 202 | E | 98.1 | Very high | 97.5 | Very high | 106 Ų | 106 | 102.4 Ų | 102.4 | 50% | 0.495 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.9 | -41.7 | 176.7 | -66.8 | -52.5 | 128.8 | 0 | 0 | 112.1 | N198 Q199 V204 K205 E206 | N198-E202 WeakPolarHBondContact O-CG 3.38Å; N198-E202 PolarHBondContact O-N 3.43Å; Q199-E202 PolarHBondContact O-N 3.12Å; E202-V204 VanDerWaalsContact C-N 3.34Å; E202-V204 PolarHBondContact O-N 2.9Å; E202-K205 WeakPolarHBondContact O-CB 3.39Å; E202-K205 PolarHBondContact O-N 3.49Å; E202-K205 IonicContact OE1-NZ 2.92Å; E202-K205 PolarHBondContact OE1-NZ 3Å; E202-K205 IonicContact OE2-NZ 2.74Å; E202-E206 PolarHBondContact O-N 3.34Å |
| 203 | A | 98 | Very high | 97.3 | Very high | 46 Ų | 46 | 101.5 Ų | 101.5 | 38% | 0.38 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.2 | -39.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q199 T200 E206 M207 | Q199-A203 PolarHBondContact O-N 2.9Å; T200-A203 PolarHBondContact O-N 3.3Å; A203-E206 PolarHBondContact O-N 3.21Å; A203-M207 WeakPolarHBondContact O-CG 3.17Å; A203-M207 PolarHBondContact O-N 3.48Å |
| 204 | V | 98 | Very high | 97.2 | Very high | 79 Ų | 79 | 101.4 Ų | 101.4 | 48% | 0.479 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.7 | -40.4 | 175 | 170.7 | 0 | 0 | 0 | 0 | 111.2 | T200 L201 E202 M207 H208 | T200-V204 WeakPolarHBondContact O-CG2 3.41Å; T200-V204 PolarHBondContact O-N 2.96Å; L201-V204 PolarHBondContact O-N 3.41Å; E202-V204 VanDerWaalsContact C-N 3.34Å; E202-V204 PolarHBondContact O-N 2.9Å; V204-M207 PolarHBondContact O-N 2.97Å; V204-H208 WeakPolarHBondContact O-CB 3.45Å; V204-H208 PolarHBondContact O-N 3.45Å |
| 205 | K | 97.9 | Very high | 96.9 | Very high | 103 Ų | 103 | 99.4 Ų | 99.4 | 45% | 0.448 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.4 | -46.7 | 175.4 | -71.9 | 173.2 | -176.6 | 170.1 | 0 | 111.9 | L201 E202 M207 H208 E209 | L201-K205 WeakPolarHBondContact O-CG 3.28Å; L201-K205 PolarHBondContact O-N 3.36Å; E202-K205 WeakPolarHBondContact O-CB 3.39Å; E202-K205 PolarHBondContact O-N 3.49Å; E202-K205 IonicContact OE1-NZ 2.92Å; E202-K205 PolarHBondContact OE1-NZ 3Å; E202-K205 IonicContact OE2-NZ 2.74Å; K205-M207 PolarHBondContact O-N 2.9Å; K205-H208 WeakPolarHBondContact O-CB 3.46Å; K205-H208 PolarHBondContact O-N 3.15Å; K205-E209 PolarHBondContact O-N 2.93Å |
| 206 | E | 97.7 | Very high | 96.6 | Very high | 136 Ų | 136 | 102 Ų | 102 | 64% | 0.636 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.1 | -44.6 | 178.3 | -173.2 | -173.7 | 166.7 | 0 | 0 | 111.5 | E202 A203 H208 E209 K210 | E202-E206 PolarHBondContact O-N 3.34Å; A203-E206 PolarHBondContact O-N 3.21Å; E206-H208 VanDerWaalsContact C-N 3.32Å; E206-H208 PolarHBondContact O-N 2.8Å; E206-E209 PolarHBondContact O-N 3.45Å; E206-K210 WeakPolarHBondContact O-CB 3.46Å; E206-K210 PolarHBondContact O-N 2.97Å |
| 207 | M | 97.2 | Very high | 96.3 | Very high | 125 Ų | 125 | 102.8 Ų | 102.8 | 62% | 0.616 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.2 | -40.5 | 175.3 | -75.3 | -157.4 | -58.4 | 0 | 0 | 112.5 | A203 V204 K205 S211 | A203-M207 WeakPolarHBondContact O-CG 3.17Å; A203-M207 PolarHBondContact O-N 3.48Å; V204-M207 PolarHBondContact O-N 2.97Å; K205-M207 PolarHBondContact O-N 2.9Å; M207-S211 WeakPolarHBondContact O-CB 3.32Å; M207-S211 PolarHBondContact O-N 2.88Å; M207-S211 PolarHBondContact O-OG 3.49Å |
| 208 | H | 97.5 | Very high | 95.7 | Very high | 122 Ų | 122 | 101.7 Ų | 101.7 | 57% | 0.565 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.1 | -46.7 | 176.4 | 174 | -89.8 | 0 | 0 | 0 | 111.4 | V204 K205 E206 K210 S211 M212 | V204-H208 WeakPolarHBondContact O-CB 3.45Å; V204-H208 PolarHBondContact O-N 3.45Å; K205-H208 WeakPolarHBondContact O-CB 3.46Å; K205-H208 PolarHBondContact O-N 3.15Å; E206-H208 VanDerWaalsContact C-N 3.32Å; E206-H208 PolarHBondContact O-N 2.8Å; H208-K210 PolarHBondContact O-N 3.44Å; H208-S211 PolarHBondContact O-N 3.45Å; H208-M212 WeakPolarHBondContact O-CG 3.24Å; H208-M212 PolarHBondContact O-N 3.26Å |
| 209 | E | 96.6 | Very high | 94.9 | Very high | 141 Ų | 141 | 100.4 Ų | 100.4 | 66% | 0.659 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -58.8 | -48.1 | 177.1 | -175 | 170.6 | -168.7 | 0 | 0 | 111.7 | K205 E206 S211 M212 E213 | K205-E209 PolarHBondContact O-N 2.93Å; E206-E209 PolarHBondContact O-N 3.45Å; E209-S211 VanDerWaalsContact C-N 3.32Å; E209-S211 PolarHBondContact O-N 3.32Å; E209-M212 PolarHBondContact O-N 2.91Å; E209-E213 PolarHBondContact O-N 3.2Å |
| 210 | K | 96.2 | Very high | 93.8 | Very high | 139 Ų | 139 | 99.5 Ų | 99.5 | 60% | 0.604 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.8 | -38.2 | 176 | -171 | 173 | -174.1 | 170.6 | 0 | 112.9 | E206 H208 E213 V214 | E206-K210 WeakPolarHBondContact O-CB 3.46Å; E206-K210 PolarHBondContact O-N 2.97Å; H208-K210 PolarHBondContact O-N 3.44Å; K210-E213 PolarHBondContact O-N 2.93Å; K210-V214 WeakPolarHBondContact O-CG2 3.09Å; K210-V214 PolarHBondContact O-N 2.74Å |
| 211 | S | 95.5 | Very high | 92.1 | Very high | 71 Ų | 71 | 103.8 Ų | 103.8 | 50% | 0.497 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -65 | -43.5 | 176.4 | -60.4 | 0 | 0 | 0 | 0 | 111.4 | M207 H208 E209 E213 V214 V215 | M207-S211 WeakPolarHBondContact O-CB 3.32Å; M207-S211 PolarHBondContact O-N 2.88Å; M207-S211 PolarHBondContact O-OG 3.49Å; H208-S211 PolarHBondContact O-N 3.45Å; E209-S211 VanDerWaalsContact C-N 3.32Å; E209-S211 PolarHBondContact O-N 3.32Å; S211-E213 VanDerWaalsContact C-N 3.35Å; S211-V214 PolarHBondContact O-N 2.91Å; S211-V215 WeakPolarHBondContact O-CG2 3.38Å; S211-V215 PolarHBondContact O-N 3.14Å |
| 212 | M | 94.9 | Very high | 89.7 | Confident | 91 Ų | 91 | 109.4 Ų | 109.4 | 45% | 0.448 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -62.7 | -41.2 | 175.5 | -71.8 | -62.1 | -63.4 | 0 | 0 | 111.8 | H208 E209 V215 M216 | H208-M212 WeakPolarHBondContact O-CG 3.24Å; H208-M212 PolarHBondContact O-N 3.26Å; E209-M212 PolarHBondContact O-N 2.91Å; M212-V215 PolarHBondContact O-N 3.4Å; M212-M216 WeakPolarHBondContact O-CG 3.48Å; M212-M216 PolarHBondContact O-N 3.27Å |
| 213 | E | 94.7 | Very high | 89.3 | Confident | 108 Ų | 108 | 109.6 Ų | 109.6 | 51% | 0.505 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -59.5 | -46.2 | 174.8 | -173.1 | -174.5 | -179.7 | 0 | 0 | 112 | E209 K210 S211 V215 M216 N217 | E209-E213 PolarHBondContact O-N 3.2Å; K210-E213 PolarHBondContact O-N 2.93Å; S211-E213 VanDerWaalsContact C-N 3.35Å; E213-V215 PolarHBondContact O-N 3.16Å; E213-M216 PolarHBondContact O-N 2.98Å; E213-N217 WeakPolarHBondContact O-CB 3.24Å; E213-N217 VanDerWaalsContact O-CG 3.3Å; E213-N217 PolarHBondContact O-N 2.92Å; E213-N217 PolarHBondContact O-ND2 3.35Å |
| 214 | V | 94.4 | Very high | 88.8 | Confident | 78 Ų | 78 | 112.9 Ų | 112.9 | 47% | 0.473 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -60.1 | -45 | 176 | 170.7 | 0 | 0 | 0 | 0 | 111.3 | K210 S211 N217 L218 | K210-V214 WeakPolarHBondContact O-CG2 3.09Å; K210-V214 PolarHBondContact O-N 2.74Å; S211-V214 PolarHBondContact O-N 2.91Å; V214-N217 PolarHBondContact O-N 3.41Å; V214-L218 HydrophobicContact CG1-CD1 4.04Å; V214-L218 WeakPolarHBondContact O-CG 3.43Å; V214-L218 PolarHBondContact O-N 2.95Å |
| 215 | V | 93.3 | Very high | 88.3 | Confident | 94 Ų | 94 | 114.8 Ų | 114.8 | 57% | 0.57 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -62.9 | -44 | 178.4 | 171.7 | 0 | 0 | 0 | 0 | 111.4 | S211 M212 E213 L218 G219 | S211-V215 WeakPolarHBondContact O-CG2 3.38Å; S211-V215 PolarHBondContact O-N 3.14Å; M212-V215 PolarHBondContact O-N 3.4Å; E213-V215 PolarHBondContact O-N 3.16Å; V215-L218 PolarHBondContact O-N 2.92Å; V215-G219 PolarHBondContact O-N 3.48Å; V215-G219 VanDerWaalsContact O-N 3.15Å |
| 216 | M | 91 | Very high | 87.8 | Confident | 118 Ų | 118 | 115.5 Ų | 115.5 | 58% | 0.581 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -62.5 | -42.5 | 176.4 | -72.1 | -172.9 | -65.1 | 0 | 0 | 112 | M212 E213 L218 G219 T220 | M212-M216 WeakPolarHBondContact O-CG 3.48Å; M212-M216 PolarHBondContact O-N 3.27Å; E213-M216 PolarHBondContact O-N 2.98Å; M216-L218 VanDerWaalsContact C-N 3.32Å; M216-L218 PolarHBondContact O-N 3.24Å; M216-G219 PolarHBondContact O-N 3.44Å; M216-T220 PolarHBondContact O-N 3.32Å; M216-T220 PolarHBondContact O-OG1 3.04Å |
| 217 | N | 90.8 | Very high | 87.2 | Confident | 82 Ų | 82 | 114.2 Ų | 114.2 | 44% | 0.439 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -69.6 | -24.9 | 179 | -74.9 | -32.6 | 0 | 0 | 0 | 113.9 | E213 V214 T220 | E213-N217 WeakPolarHBondContact O-CB 3.24Å; E213-N217 VanDerWaalsContact O-CG 3.3Å; E213-N217 PolarHBondContact O-N 2.92Å; E213-N217 PolarHBondContact O-ND2 3.35Å; V214-N217 PolarHBondContact O-N 3.41Å; N217-T220 PolarHBondContact O-OG1 2.83Å |
| 218 | L | 87.1 | Confident | 86.5 | Confident | 111 Ų | 111 | 113.5 Ų | 113.5 | 58% | 0.581 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -77.2 | -34.4 | 172.3 | -73.6 | 169.8 | 0 | 0 | 0 | 111.8 | V214 V215 M216 T220 K221 | V214-L218 HydrophobicContact CG1-CD1 4.04Å; V214-L218 WeakPolarHBondContact O-CG 3.43Å; V214-L218 PolarHBondContact O-N 2.95Å; V215-L218 PolarHBondContact O-N 2.92Å; M216-L218 VanDerWaalsContact C-N 3.32Å; M216-L218 PolarHBondContact O-N 3.24Å; L218-T220 VanDerWaalsContact C-N 3.28Å; L218-T220 PolarHBondContact O-N 3.06Å; L218-K221 PolarHBondContact O-N 3.47Å |
| 219 | G | 79.8 | Confident | 85.7 | Confident | 58 Ų | 58 | 112.9 Ų | 112.9 | 60% | 0.598 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -68.8 | -21.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | V215 M216 | V215-G219 PolarHBondContact O-N 3.48Å; V215-G219 VanDerWaalsContact O-N 3.15Å; M216-G219 PolarHBondContact O-N 3.44Å |
| 220 | T | 74.6 | Confident | 84.9 | Confident | 108 Ų | 108 | 110.7 Ų | 110.7 | 66% | 0.663 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.9 | -7.5 | 179.2 | 53.4 | 0 | 0 | 0 | 0 | 114.3 | M216 N217 L218 | M216-T220 PolarHBondContact O-N 3.32Å; M216-T220 PolarHBondContact O-OG1 3.04Å; N217-T220 PolarHBondContact O-OG1 2.83Å; L218-T220 VanDerWaalsContact C-N 3.28Å; L218-T220 PolarHBondContact O-N 3.06Å |
| 221 | K | 62.1 | Low | 83.9 | Confident | 173 Ų | 173 | 108.3 Ų | 108.3 | 75% | 0.752 | 60% | 0.601 | S | S | * | * | trans | -98.1 | 4.3 | -178.8 | -76.9 | -177.1 | 178.9 | 176.7 | 0 | 114.6 | L218 | L218-K221 PolarHBondContact O-N 3.47Š| ||
| 222 | N | 49 | Very low | 82.9 | Confident | 208 Ų | 208 | 111.7 Ų | 111.7 | 100% | 1.112 | 61% | 0.611 | S | S | * | * | trans | -114.5 | 0 | 171.3 | -71.8 | -24.3 | 0 | 0 | 0 | 110 |
Retrieved 222 of 222 residues in 125.1 ms
(Link to these results)