| 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 | 41.9 | Very low | 44.9 | Very low | 248 Ų | 248 | 188.3 Ų | 188.3 | 100% | 1.222 | 89% | 0.893 | S | S | * | * | 0 | 92.5 | 0 | -79.1 | -176.6 | -145.2 | 0 | 0 | 110.7 | |||||
| 2 | R | 50.6 | Low | 45.3 | Very low | 246 Ų | 246 | 184.1 Ų | 184.1 | 93% | 0.928 | 88% | 0.877 | S | S | * | * | trans | -117 | 109.7 | 164.1 | -81.2 | -178 | 178.9 | 156.1 | -0.4 | 107 | M4 | R2-M4 PolarHBondContact O-N 3.45Š| ||
| 3 | R | 43.6 | Very low | 45.3 | Very low | 253 Ų | 253 | 176.8 Ų | 176.8 | 96% | 0.955 | 86% | 0.855 | S | S | * | * | trans | -75.7 | 109 | 170.3 | -67.4 | -175.9 | -167.6 | 176.4 | 4.2 | 107 | ||||
| 4 | M | 45.9 | Very low | 45.9 | Very low | 180 Ų | 180 | 177.9 Ų | 177.9 | 89% | 0.887 | 85% | 0.853 | S | S | * | * | trans | -78.4 | 122.1 | 167.7 | -71.7 | -143.3 | -149.7 | 0 | 0 | 108.8 | R2 L6 | R2-M4 PolarHBondContact O-N 3.45Å; M4-L6 PolarHBondContact O-N 3.32Å | ||
| 5 | A | 46.2 | Very low | 46.1 | Very low | 82 Ų | 82 | 176.5 Ų | 176.5 | 68% | 0.678 | 85% | 0.845 | S | S | * | * | trans | -69.6 | 113.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | K7 | A5-K7 HydrophobicContact CB-CG 4.45Å; A5-K7 PolarHBondContact O-N 3.43Å | ||
| 6 | L | 42.9 | Very low | 46 | Very low | 179 Ų | 179 | 169.1 Ų | 169.1 | 94% | 0.937 | 83% | 0.83 | S | S | * | * | trans | -69.6 | 78.5 | 162.7 | -79.7 | 155.6 | 0 | 0 | 0 | 108.5 | M4 | M4-L6 PolarHBondContact O-N 3.32Š| ||
| 7 | K | 46.6 | Very low | 46 | Very low | 182 Ų | 182 | 170.2 Ų | 170.2 | 79% | 0.791 | 82% | 0.824 | S | S | * | * | trans | -103.9 | 129.6 | 161.9 | -70.8 | -176.3 | 177.9 | -177.4 | 0 | 106.7 | A5 | A5-K7 HydrophobicContact CB-CG 4.45Å; A5-K7 PolarHBondContact O-N 3.43Å | ||
| 8 | K | 45 | Very low | 46 | Very low | 204 Ų | 204 | 170.2 Ų | 170.2 | 89% | 0.887 | 83% | 0.828 | S | S | * | * | trans | 96.7 | 60.8 | -179.7 | -50.8 | -172.4 | -175 | -170.4 | 0 | 115.5 | ||||
| 9 | L | 39.6 | Very low | 46 | Very low | 170 Ų | 170 | 168.6 Ų | 168.6 | 89% | 0.89 | 82% | 0.823 | S | S | * | * | trans | -84.2 | 112.9 | 145.6 | -145.4 | 79.3 | 0 | 0 | 0 | 107.3 | V11 | L9-V11 PolarHBondContact O-N 3.12Š| ||
| 10 | K | 48.7 | Very low | 46 | Very low | 196 Ų | 196 | 166.8 Ų | 166.8 | 85% | 0.852 | 82% | 0.817 | S | S | * | * | trans | -58.7 | 117.1 | -178.4 | -159.5 | 164.5 | -179.6 | 172.8 | 0 | 108.4 | I12 | K10-I12 PolarHBondContact O-N 3.3Š| ||
| 11 | V | 43.4 | Very low | 45.9 | Very low | 131 Ų | 131 | 165.5 Ų | 165.5 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | trans | -53.9 | 112.8 | 171.3 | 175.2 | 0 | 0 | 0 | 0 | 107.2 | L9 P13 | L9-V11 PolarHBondContact O-N 3.12Å; V11-P13 WeakPolarHBondContact O-CD 3.38Å | ||
| 12 | I | 49.4 | Very low | 46 | Very low | 138 Ų | 138 | 159.4 Ų | 159.4 | 71% | 0.708 | 79% | 0.785 | S | S | * | * | trans | -69.5 | 119.5 | 169.2 | -60.5 | 171 | 0 | 0 | 0 | 105.4 | K10 K14 | K10-I12 PolarHBondContact O-N 3.3Å; I12-K14 PolarHBondContact O-N 3.26Å | ||
| 13 | P | 45.5 | Very low | 45.7 | Very low | 90 Ų | 90 | 154.5 Ų | 154.5 | 58% | 0.584 | 77% | 0.77 | S | S | * | * | trans | -59.9 | 126.3 | 176.3 | -17.2 | 29.7 | 0 | 0 | 0 | 109.1 | V11 E15 | V11-P13 WeakPolarHBondContact O-CD 3.38Å; P13-E15 PolarHBondContact O-N 3.43Å | ||
| 14 | K | 53.3 | Low | 45.9 | Very low | 192 Ų | 192 | 149.2 Ų | 149.2 | 84% | 0.835 | 76% | 0.761 | S | S | * | * | G | 310 helix | trans | -76.4 | -8.4 | 174.7 | -77.6 | -173.8 | 173.8 | -177.7 | 0 | 112 | I12 G16 | I12-K14 PolarHBondContact O-N 3.26Å; K14-G16 VanDerWaalsContact C-N 3.34Å; K14-G16 PolarHBondContact O-N 3.42Å |
| 15 | E | 48.6 | Very low | 45.9 | Very low | 157 Ų | 157 | 148.2 Ų | 148.2 | 73% | 0.734 | 76% | 0.759 | S | S | * | * | G | 310 helix | trans | -80.2 | 3.6 | -176.4 | -84.3 | 64.7 | -144.9 | 0 | 0 | 116.1 | P13 | P13-E15 PolarHBondContact O-N 3.43Š|
| 16 | G | 43.9 | Very low | 46.1 | Very low | 58 Ų | 58 | 151.6 Ų | 151.6 | 60% | 0.598 | 76% | 0.761 | S | S | * | * | G | 310 helix | trans | -92.5 | -8.3 | -172.2 | 0 | 0 | 0 | 0 | 0 | 117.9 | K14 | K14-G16 VanDerWaalsContact C-N 3.34Å; K14-G16 PolarHBondContact O-N 3.42Å |
| 17 | Y | 47.4 | Very low | 46.2 | Very low | 188 Ų | 188 | 149.9 Ų | 149.9 | 74% | 0.737 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -110 | 11.3 | -168.1 | -70.1 | -81.2 | 0 | 0 | 0 | 115.2 | ||
| 18 | L | 45.6 | Very low | 46.2 | Very low | 170 Ų | 170 | 148.1 Ų | 148.1 | 89% | 0.89 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -117.3 | 11.5 | -177.5 | -85.7 | 166.4 | 0 | 0 | 0 | 114.7 | ||
| 19 | L | 46 | Very low | 46.3 | Very low | 139 Ų | 139 | 145.7 Ų | 145.7 | 73% | 0.728 | 75% | 0.749 | S | S | * | * | trans | -116.3 | 22.2 | -168.8 | -103.9 | 164.4 | 0 | 0 | 0 | 116.3 | ||||
| 20 | L | 45.6 | Very low | 46.6 | Very low | 133 Ų | 133 | 142.1 Ų | 142.1 | 70% | 0.696 | 73% | 0.73 | S | S | * | * | trans | -126.1 | 58.7 | 174.6 | -84.8 | 154.5 | 0 | 0 | 0 | 111.3 | D22 | L20-D22 HydrophobicContact CD2-CB 4.47Š| ||
| 21 | L | 44.1 | Very low | 46.5 | Very low | 140 Ų | 140 | 142.3 Ų | 142.3 | 73% | 0.733 | 73% | 0.731 | S | S | * | * | trans | -99.2 | 49.3 | 146.4 | -74.9 | 167.5 | 0 | 0 | 0 | 107.8 | F23 | L21-F23 HydrophobicContact CB-CD2 4.3Å; L21-F23 HydrophobicContact CB-CE2 4.02Å; L21-F23 HydrophobicContact CD2-CE2 3.64Å; L21-F23 HydrophobicContact CD2-CZ 3.82Å; L21-F23 HydrophobicContact CG-CE2 4.32Å; L21-F23 PolarHBondContact O-N 3.3Å | ||
| 22 | D | 44.8 | Very low | 46.5 | Very low | 119 Ų | 119 | 138.5 Ų | 138.5 | 64% | 0.636 | 71% | 0.708 | S | S | * | * | trans | -77.4 | 88 | 162.9 | -70.1 | -16 | 0 | 0 | 0 | 105.6 | L20 D24 | L20-D22 HydrophobicContact CD2-CB 4.47Å; D22-D24 PolarHBondContact O-N 3.46Å | ||
| 23 | F | 44.5 | Very low | 46.4 | Very low | 143 Ų | 143 | 135 Ų | 135 | 63% | 0.627 | 70% | 0.696 | S | S | * | * | trans | -68.2 | 86.8 | 160.7 | -66.9 | -89.1 | 0 | 0 | 0 | 106.1 | L21 D25 | L21-F23 HydrophobicContact CB-CD2 4.3Å; L21-F23 HydrophobicContact CB-CE2 4.02Å; L21-F23 HydrophobicContact CD2-CE2 3.64Å; L21-F23 HydrophobicContact CD2-CZ 3.82Å; L21-F23 HydrophobicContact CG-CE2 4.32Å; L21-F23 PolarHBondContact O-N 3.3Å; F23-D25 PolarHBondContact O-N 3.05Å | ||
| 24 | D | 47.8 | Very low | 46.5 | Very low | 143 Ų | 143 | 138.3 Ų | 138.3 | 77% | 0.765 | 70% | 0.703 | S | S | * | * | trans | -59.5 | 107.7 | 161.9 | -90.5 | -24.3 | 0 | 0 | 0 | 107.2 | D22 E26 | D22-D24 PolarHBondContact O-N 3.46Å; D24-E26 PolarHBondContact O-N 3.04Å | ||
| 25 | D | 44.6 | Very low | 46.1 | Very low | 158 Ų | 158 | 136.9 Ų | 136.9 | 85% | 0.845 | 70% | 0.699 | S | S | * | * | trans | -56.4 | 99.5 | 158.5 | -92.6 | -31 | 0 | 0 | 0 | 108.2 | F23 | F23-D25 PolarHBondContact O-N 3.05Š| ||
| 26 | E | 49.7 | Very low | 45.7 | Very low | 154 Ų | 154 | 131.4 Ų | 131.4 | 72% | 0.72 | 68% | 0.681 | S | S | * | * | trans | -151.1 | 100.8 | 158.5 | -78.6 | -66.1 | 155.7 | 0 | 0 | 106.9 | D24 D28 | D24-E26 PolarHBondContact O-N 3.04Å; E26-D28 PolarHBondContact O-N 3.37Å | ||
| 27 | D | 45.6 | Very low | 45.7 | Very low | 142 Ų | 142 | 133.6 Ų | 133.6 | 76% | 0.759 | 68% | 0.678 | S | S | * | * | trans | 39.4 | 78.1 | 143.1 | -59.2 | -18.7 | 0 | 0 | 0 | 117.9 | ||||
| 28 | D | 47 | Very low | 45.9 | Very low | 145 Ų | 145 | 128.6 Ų | 128.6 | 78% | 0.775 | 67% | 0.671 | S | S | * | * | trans | -118.7 | 82.4 | 148.7 | -87.7 | -34.3 | 0 | 0 | 0 | 107.3 | E26 I30 | E26-D28 PolarHBondContact O-N 3.37Å; D28-I30 VanDerWaalsContact C-N 3.31Å; D28-I30 PolarHBondContact O-N 3.21Å | ||
| 29 | D | 48.2 | Very low | 46 | Very low | 153 Ų | 153 | 127.3 Ų | 127.3 | 82% | 0.818 | 66% | 0.66 | S | S | * | * | trans | -44.4 | 102.2 | 155.6 | -83.6 | -32.8 | 0 | 0 | 0 | 107.2 | K31 | D29-K31 PolarHBondContact O-N 2.97Š| ||
| 30 | I | 45.7 | Very low | 46 | Very low | 95 Ų | 95 | 124.8 Ų | 124.8 | 49% | 0.487 | 65% | 0.65 | S | S | . | * | trans | -61.2 | 98 | 161.2 | -57.5 | 176.4 | 0 | 0 | 0 | 103.5 | D28 V32 | D28-I30 VanDerWaalsContact C-N 3.31Å; D28-I30 PolarHBondContact O-N 3.21Å; I30-V32 HydrophobicContact CB-CG2 4.4Å; I30-V32 HydrophobicContact CG2-CG2 3.69Å; I30-V32 PolarHBondContact O-N 3.23Å | ||
| 31 | K | 46.6 | Very low | 45.8 | Very low | 201 Ų | 201 | 125 Ų | 125 | 87% | 0.874 | 65% | 0.652 | S | S | * | * | trans | -60.7 | 76.5 | 164.4 | -93.9 | -166.3 | 173 | -165.8 | 0 | 107.5 | D29 S33 | D29-K31 PolarHBondContact O-N 2.97Å; K31-S33 PolarHBondContact O-N 2.95Å | ||
| 32 | V | 43.1 | Very low | 45.9 | Very low | 51 Ų | 51 | 124.9 Ų | 124.9 | 31% | 0.309 | 65% | 0.652 | S | S | . | * | trans | -64.2 | 116.3 | 160.9 | 173.7 | 0 | 0 | 0 | 0 | 104.4 | I30 E34 | I30-V32 HydrophobicContact CB-CG2 4.4Å; I30-V32 HydrophobicContact CG2-CG2 3.69Å; I30-V32 PolarHBondContact O-N 3.23Å; V32-E34 PolarHBondContact O-N 3.37Å; V32-E34 VanDerWaalsContact O-N 3.11Å | ||
| 33 | S | 46.1 | Very low | 45.8 | Very low | 65 Ų | 65 | 125.1 Ų | 125.1 | 46% | 0.455 | 66% | 0.66 | S | S | . | * | trans | -49.2 | 121.6 | 177.6 | -179.2 | 0 | 0 | 0 | 0 | 109.7 | K31 E35 A36 | K31-S33 PolarHBondContact O-N 2.95Å; S33-E35 PolarHBondContact O-N 3.35Å; S33-E35 VanDerWaalsContact O-N 3.08Å; S33-E35 WeakPolarHBondContact OG-CB 3.37Å; S33-E35 PolarHBondContact OG-N 2.91Å; S33-E35 PolarHBondContact OG-OE2 3.06Å; S33-A36 PolarHBondContact O-N 3.16Å | ||
| 34 | E | 48.2 | Very low | 45.6 | Very low | 158 Ų | 158 | 122.7 Ų | 122.7 | 74% | 0.738 | 67% | 0.667 | S | S | * | * | G | 310 helix | trans | -59.7 | -15.5 | 176.4 | -164 | 176.2 | 178.5 | 0 | 0 | 111.9 | V32 A36 L37 | V32-E34 PolarHBondContact O-N 3.37Å; V32-E34 VanDerWaalsContact O-N 3.11Å; E34-A36 PolarHBondContact O-N 3.45Å; E34-A36 VanDerWaalsContact O-N 3.15Å; E34-L37 PolarHBondContact O-N 3.14Å |
| 35 | E | 44.5 | Very low | 45.1 | Very low | 162 Ų | 162 | 123.8 Ų | 123.8 | 76% | 0.757 | 67% | 0.671 | S | S | * | * | G | 310 helix | trans | -62 | -20.7 | 176.8 | -71.1 | 176.5 | 141.8 | 0 | 0 | 113.7 | S33 | S33-E35 PolarHBondContact O-N 3.35Å; S33-E35 VanDerWaalsContact O-N 3.08Å; S33-E35 WeakPolarHBondContact OG-CB 3.37Å; S33-E35 PolarHBondContact OG-N 2.91Å; S33-E35 PolarHBondContact OG-OE2 3.06Å |
| 36 | A | 40.1 | Very low | 44.9 | Very low | 42 Ų | 42 | 119.5 Ų | 119.5 | 35% | 0.347 | 66% | 0.664 | S | S | . | * | G | 310 helix | trans | -88.1 | -12.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | S33 E34 | S33-A36 PolarHBondContact O-N 3.16Å; E34-A36 PolarHBondContact O-N 3.45Å; E34-A36 VanDerWaalsContact O-N 3.15Å |
| 37 | L | 45.5 | Very low | 44.6 | Very low | 105 Ų | 105 | 121.5 Ų | 121.5 | 55% | 0.55 | 67% | 0.67 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.8 | -22.7 | -176.6 | -65.6 | 175 | 0 | 0 | 0 | 112.7 | E34 E39 V40 | E34-L37 PolarHBondContact O-N 3.14Å; L37-E39 VanDerWaalsContact C-N 3.3Å; L37-E39 PolarHBondContact O-N 2.96Å; L37-V40 PolarHBondContact O-N 3.43Å |
| 38 | S | 51.3 | Low | 44.5 | Very low | 82 Ų | 82 | 121.8 Ų | 121.8 | 57% | 0.573 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -73.3 | -20.4 | 179.6 | 57.5 | 0 | 0 | 0 | 0 | 114 | V40 | S38-V40 VanDerWaalsContact C-N 3.32Š|
| 39 | E | 47.8 | Very low | 44.2 | Very low | 144 Ų | 144 | 122.9 Ų | 122.9 | 67% | 0.673 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -85.8 | -5.4 | -178.9 | -133.3 | 170.9 | -162.7 | 0 | 0 | 113.2 | L37 | L37-E39 VanDerWaalsContact C-N 3.3Å; L37-E39 PolarHBondContact O-N 2.96Å |
| 40 | V | 45.7 | Very low | 43.6 | Very low | 85 Ų | 85 | 123 Ų | 123 | 52% | 0.515 | 67% | 0.673 | S | S | . | * | G | 310 helix | trans | -105.6 | 26.9 | 174.7 | -170.6 | 0 | 0 | 0 | 0 | 110.8 | L37 S38 N42 | L37-V40 PolarHBondContact O-N 3.43Å; S38-V40 VanDerWaalsContact C-N 3.32Å; V40-N42 PolarHBondContact O-N 2.76Å |
| 41 | N | 41 | Very low | 43.4 | Very low | 137 Ų | 137 | 126 Ų | 126 | 73% | 0.733 | 69% | 0.688 | S | S | * | * | trans | -84.7 | 92.3 | 164.4 | -86.5 | -35.4 | 0 | 0 | 0 | 109.2 | ||||
| 42 | N | 45.6 | Very low | 43 | Very low | 138 Ų | 138 | 121.4 Ų | 121.4 | 74% | 0.738 | 68% | 0.682 | S | S | * | * | trans | -52.3 | 133.9 | 166.8 | -68.4 | -59.8 | 0 | 0 | 0 | 109.5 | V40 A44 | V40-N42 PolarHBondContact O-N 2.76Å; N42-A44 PolarHBondContact O-N 2.96Å; N42-A44 VanDerWaalsContact O-N 3.1Å | ||
| 43 | P | 42.3 | Very low | 43.4 | Very low | 124 Ų | 124 | 124.5 Ų | 124.5 | 81% | 0.805 | 70% | 0.703 | S | S | * | * | trans | -60 | 123 | 165.5 | 26.7 | -30.3 | 0 | 0 | 0 | 107.2 | I45 | P43-I45 PolarHBondContact O-N 3.36Š| ||
| 44 | A | 41.2 | Very low | 43.2 | Very low | 93 Ų | 93 | 129.8 Ų | 129.8 | 77% | 0.769 | 72% | 0.72 | S | S | * | * | trans | -44 | 132.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | N42 G46 | N42-A44 PolarHBondContact O-N 2.96Å; N42-A44 VanDerWaalsContact O-N 3.1Å; A44-G46 PolarHBondContact O-N 3.31Å | ||
| 45 | I | 38.1 | Very low | 42.7 | Very low | 165 Ų | 165 | 129.2 Ų | 129.2 | 85% | 0.846 | 73% | 0.727 | S | S | * | * | trans | -55.5 | 93.8 | 156.4 | -83.7 | 166.4 | 0 | 0 | 0 | 106.5 | P43 K47 | P43-I45 PolarHBondContact O-N 3.36Å; I45-K47 PolarHBondContact O-N 2.96Å | ||
| 46 | G | 39.1 | Very low | 42.7 | Very low | 68 Ų | 68 | 129.7 Ų | 129.7 | 70% | 0.701 | 73% | 0.727 | S | S | * | * | trans | -70.6 | 105.5 | 164.9 | 0 | 0 | 0 | 0 | 0 | 107.2 | A44 D48 | A44-G46 PolarHBondContact O-N 3.31Å; G46-D48 PolarHBondContact O-N 3.21Å | ||
| 47 | K | 43.5 | Very low | 42.7 | Very low | 197 Ų | 197 | 131.2 Ų | 131.2 | 86% | 0.857 | 75% | 0.746 | S | S | * | * | trans | -62.5 | 110.9 | 158.2 | -66.3 | 175.7 | 177.3 | 177.8 | 0 | 106.4 | I45 | I45-K47 PolarHBondContact O-N 2.96Š| ||
| 48 | D | 43 | Very low | 43 | Very low | 147 Ų | 147 | 132.3 Ų | 132.3 | 79% | 0.786 | 75% | 0.753 | S | S | * | * | trans | -149 | 154.5 | 154.8 | -139.2 | -13.4 | 0 | 0 | 0 | 112.2 | G46 | G46-D48 PolarHBondContact O-N 3.21Š| ||
| 49 | E | 41.8 | Very low | 43.2 | Very low | 168 Ų | 168 | 138.4 Ų | 138.4 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | trans | -73.6 | 131.2 | -151.2 | -69.2 | 161.8 | 162.9 | 0 | 0 | 115.1 | I51 | E49-I51 PolarHBondContact O-N 2.96Š| ||
| 50 | N | 36.3 | Very low | 43.8 | Very low | 157 Ų | 157 | 137 Ų | 137 | 84% | 0.84 | 77% | 0.769 | S | S | * | * | 33.4 | 86 | 129.1 | -154.4 | 4.2 | 0 | 0 | 0 | 118 | |||||
| 51 | I | 41.3 | Very low | 44.4 | Very low | 156 Ų | 156 | 138.8 Ų | 138.8 | 80% | 0.8 | 77% | 0.773 | S | S | * | * | trans | -138.5 | 109.3 | 151 | -55.6 | -179.5 | 0 | 0 | 0 | 108.9 | E49 P53 | E49-I51 PolarHBondContact O-N 2.96Å; I51-P53 WeakPolarHBondContact O-CD 3.42Å | ||
| 52 | S | 38.5 | Very low | 45.6 | Very low | 106 Ų | 106 | 135 Ų | 135 | 74% | 0.741 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 124.8 | 167.1 | 174.1 | 0 | 0 | 0 | 0 | 110 | ||
| 53 | P | 50.6 | Low | 46.7 | Very low | 115 Ų | 115 | 135.3 Ų | 135.3 | 75% | 0.747 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -91.7 | 131.6 | 164.9 | -1.1 | 21.7 | 0 | 0 | 0 | 109.8 | I51 | I51-P53 WeakPolarHBondContact O-CD 3.42Š|
| 54 | Q | 41.6 | Very low | 48.2 | Very low | 176 Ų | 176 | 135.1 Ų | 135.1 | 82% | 0.822 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 137.1 | 174.3 | -70.7 | 177.3 | -22 | 0 | 0 | 112.6 | K56 | Q54-K56 PolarHBondContact O-N 3.44Å; Q54-K56 VanDerWaalsContact O-N 3.1Å |
| 55 | V | 37.3 | Very low | 49.7 | Very low | 146 Ų | 146 | 135 Ų | 135 | 89% | 0.885 | 74% | 0.742 | S | S | * | * | trans | -57.6 | 106.3 | 169 | 174.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 56 | K | 44.8 | Very low | 51.5 | Low | 173 Ų | 173 | 128.5 Ų | 128.5 | 75% | 0.752 | 72% | 0.716 | S | S | * | * | trans | -117.3 | 117 | 154.2 | -77.4 | -172.5 | 177.4 | -179.3 | 0 | 106.9 | Q54 D58 | Q54-K56 PolarHBondContact O-N 3.44Å; Q54-K56 VanDerWaalsContact O-N 3.1Å; K56-D58 PolarHBondContact O-N 3.3Å | ||
| 57 | G | 39.7 | Very low | 53.4 | Low | 73 Ų | 73 | 127.2 Ų | 127.2 | 75% | 0.753 | 70% | 0.696 | S | S | * | * | trans | -69.2 | 121 | 177.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 58 | D | 52 | Low | 55.3 | Low | 128 Ų | 128 | 121.1 Ų | 121.1 | 68% | 0.684 | 68% | 0.675 | S | S | * | * | trans | -139 | 134.8 | 166.3 | -92.2 | -32.7 | 0 | 0 | 0 | 108.2 | K56 D60 | K56-D58 PolarHBondContact O-N 3.3Å; D58-D60 PolarHBondContact O-N 3.01Å | ||
| 59 | E | 55.4 | Low | 57.3 | Low | 211 Ų | 211 | 119.6 Ų | 119.6 | 99% | 0.986 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.6 | 12.5 | -172.7 | -64.7 | 174.8 | 150.3 | 0 | 0 | 113.7 | ||
| 60 | D | 60.2 | Low | 59.4 | Low | 115 Ų | 115 | 117.1 Ų | 117.1 | 62% | 0.615 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.3 | -8.9 | -177.8 | -165.2 | 26.7 | 0 | 0 | 0 | 114 | D58 G62 H63 | D58-D60 PolarHBondContact O-N 3.01Å; D60-G62 PolarHBondContact O-N 3.42Å; D60-G62 VanDerWaalsContact O-N 3.09Å; D60-H63 PolarHBondContact O-N 3.49Å |
| 61 | M | 59.5 | Low | 62 | Low | 121 Ų | 121 | 116 Ų | 116 | 60% | 0.596 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -58.9 | -27.2 | 177.7 | -72 | -68.6 | -171.9 | 0 | 0 | 112.9 | V65 | M61-V65 WeakPolarHBondContact O-CB 3.37Å; M61-V65 WeakPolarHBondContact O-CG2 3.46Å; M61-V65 PolarHBondContact O-N 3.07Å |
| 62 | G | 65 | Low | 64.2 | Low | 59 Ų | 59 | 110.8 Ų | 110.8 | 61% | 0.608 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -66.4 | -36.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | D60 G66 | D60-G62 PolarHBondContact O-N 3.42Å; D60-G62 VanDerWaalsContact O-N 3.09Å; G62-G66 PolarHBondContact O-N 2.94Å |
| 63 | H | 69.5 | Low | 66.7 | Low | 143 Ų | 143 | 107.5 Ų | 107.5 | 66% | 0.662 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -76.3 | -39.2 | -178.9 | -173.5 | -98 | 0 | 0 | 0 | 111.5 | D60 G66 S67 | D60-H63 PolarHBondContact O-N 3.49Å; H63-G66 PolarHBondContact O-N 3.43Å; H63-S67 WeakPolarHBondContact O-CB 3.43Å; H63-S67 PolarHBondContact O-N 3.02Å |
| 64 | E | 73.4 | Confident | 68.6 | Low | 120 Ų | 120 | 106.7 Ų | 106.7 | 56% | 0.561 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -64.1 | -46.3 | 174.1 | -173 | 174.6 | -177.6 | 0 | 0 | 111.8 | G66 S67 T68 | E64-G66 VanDerWaalsContact C-N 3.32Å; E64-G66 PolarHBondContact O-N 2.97Å; E64-S67 PolarHBondContact O-N 3.46Å; E64-S67 PolarHBondContact O-OG 3.24Å; E64-T68 WeakPolarHBondContact O-CG2 3.42Å; E64-T68 PolarHBondContact O-N 3.49Å; E64-T68 PolarHBondContact O-OG1 2.96Å |
| 65 | V | 74.1 | Confident | 71.1 | Confident | 91 Ų | 91 | 102.7 Ų | 102.7 | 55% | 0.552 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -62.4 | -39.5 | 176.2 | 174.1 | 0 | 0 | 0 | 0 | 111.3 | M61 T68 L69 | M61-V65 WeakPolarHBondContact O-CB 3.37Å; M61-V65 WeakPolarHBondContact O-CG2 3.46Å; M61-V65 PolarHBondContact O-N 3.07Å; V65-T68 WeakPolarHBondContact CA-OG1 3.42Å; V65-T68 PolarHBondContact O-OG1 3.4Å; V65-L69 VanDerWaalsContact O-CB 3.25Å; V65-L69 WeakPolarHBondContact O-CB 3.36Å; V65-L69 PolarHBondContact O-N 3.47Å |
| 66 | G | 75.5 | Confident | 73.8 | Confident | 29 Ų | 29 | 100.5 Ų | 100.5 | 30% | 0.299 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -60.9 | -50 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | G62 H63 E64 T68 L69 D70 | G62-G66 PolarHBondContact O-N 2.94Å; H63-G66 PolarHBondContact O-N 3.43Å; E64-G66 VanDerWaalsContact C-N 3.32Å; E64-G66 PolarHBondContact O-N 2.97Å; G66-T68 VanDerWaalsContact C-N 3.32Å; G66-T68 PolarHBondContact O-N 3.09Å; G66-L69 PolarHBondContact O-N 2.9Å; G66-D70 PolarHBondContact O-N 3.33Å |
| 67 | S | 78.5 | Confident | 76.1 | Confident | 40 Ų | 40 | 99.4 Ų | 99.4 | 28% | 0.28 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -64.8 | -33.9 | -178.7 | 77.7 | 0 | 0 | 0 | 0 | 113.7 | H63 E64 K71 | H63-S67 WeakPolarHBondContact O-CB 3.43Å; H63-S67 PolarHBondContact O-N 3.02Å; E64-S67 PolarHBondContact O-N 3.46Å; E64-S67 PolarHBondContact O-OG 3.24Å; S67-K71 VanDerWaalsContact O-CG 3.27Å; S67-K71 WeakPolarHBondContact O-CG 3.48Å; S67-K71 PolarHBondContact O-N 3.33Å |
| 68 | T | 82.4 | Confident | 78.8 | Confident | 70 Ų | 70 | 101.6 Ų | 101.6 | 43% | 0.429 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -75 | -37 | 176.7 | 49.1 | 0 | 0 | 0 | 0 | 111.1 | E64 V65 G66 S72 | E64-T68 WeakPolarHBondContact O-CG2 3.42Å; E64-T68 PolarHBondContact O-N 3.49Å; E64-T68 PolarHBondContact O-OG1 2.96Å; V65-T68 WeakPolarHBondContact CA-OG1 3.42Å; V65-T68 PolarHBondContact O-OG1 3.4Å; G66-T68 VanDerWaalsContact C-N 3.32Å; G66-T68 PolarHBondContact O-N 3.09Å; T68-S72 PolarHBondContact O-N 3.21Å |
| 69 | L | 86.5 | Confident | 80.9 | Confident | 114 Ų | 114 | 99.7 Ų | 99.7 | 60% | 0.597 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.5 | -43.9 | 173.9 | -171 | 64.8 | 0 | 0 | 0 | 111.7 | V65 G66 K71 S72 G73 | V65-L69 VanDerWaalsContact O-CB 3.25Å; V65-L69 WeakPolarHBondContact O-CB 3.36Å; V65-L69 PolarHBondContact O-N 3.47Å; G66-L69 PolarHBondContact O-N 2.9Å; L69-K71 PolarHBondContact O-N 3.39Å; L69-S72 PolarHBondContact O-N 2.89Å; L69-S72 VanDerWaalsContact O-N 3.15Å; L69-S72 PolarHBondContact O-OG 3.49Å; L69-G73 PolarHBondContact O-N 3.18Å |
| 70 | D | 86.3 | Confident | 82.8 | Confident | 117 Ų | 117 | 94.4 Ų | 94.4 | 63% | 0.626 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.1 | -46.1 | 176.7 | -75.7 | -16.3 | 0 | 0 | 0 | 111.5 | G66 S72 G73 D74 | G66-D70 PolarHBondContact O-N 3.33Å; D70-S72 VanDerWaalsContact C-N 3.32Å; D70-S72 PolarHBondContact O-N 2.77Å; D70-G73 PolarHBondContact O-N 3.34Å; D70-G73 VanDerWaalsContact O-N 3.12Å; D70-D74 PolarHBondContact O-N 3.03Å |
| 71 | K | 89.3 | Confident | 84.5 | Confident | 132 Ų | 132 | 92.5 Ų | 92.5 | 57% | 0.574 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -57.6 | -43.8 | 173.3 | -73.1 | 169.7 | -174.8 | 171.9 | 0 | 112 | S67 L69 G73 D74 D75 | S67-K71 VanDerWaalsContact O-CG 3.27Å; S67-K71 WeakPolarHBondContact O-CG 3.48Å; S67-K71 PolarHBondContact O-N 3.33Å; L69-K71 PolarHBondContact O-N 3.39Å; K71-G73 VanDerWaalsContact C-N 3.31Å; K71-G73 PolarHBondContact O-N 3.32Å; K71-D74 PolarHBondContact O-N 2.98Å; K71-D75 PolarHBondContact O-N 2.99Å |
| 72 | S | 88 | Confident | 86.3 | Confident | 48 Ų | 48 | 89.1 Ų | 89.1 | 34% | 0.336 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.2 | -36.6 | 177 | 79.7 | 0 | 0 | 0 | 0 | 112.3 | T68 L69 D70 D75 I76 | T68-S72 PolarHBondContact O-N 3.21Å; L69-S72 PolarHBondContact O-N 2.89Å; L69-S72 VanDerWaalsContact O-N 3.15Å; L69-S72 PolarHBondContact O-OG 3.49Å; D70-S72 VanDerWaalsContact C-N 3.32Å; D70-S72 PolarHBondContact O-N 2.77Å; S72-D75 PolarHBondContact O-N 3.01Å; S72-I76 WeakPolarHBondContact O-CB 3.43Å; S72-I76 WeakPolarHBondContact O-CD1 3.48Å; S72-I76 WeakPolarHBondContact O-CG1 3.42Å; S72-I76 PolarHBondContact O-N 3.1Å |
| 73 | G | 90.6 | Very high | 87.8 | Confident | 36 Ų | 36 | 92.4 Ų | 92.4 | 37% | 0.371 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.6 | -44.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L69 D70 K71 I76 Y77 | L69-G73 PolarHBondContact O-N 3.18Å; D70-G73 PolarHBondContact O-N 3.34Å; D70-G73 VanDerWaalsContact O-N 3.12Å; K71-G73 VanDerWaalsContact C-N 3.31Å; K71-G73 PolarHBondContact O-N 3.32Å; G73-I76 PolarHBondContact O-N 3.27Å; G73-Y77 WeakPolarHBondContact O-CB 3.36Å; G73-Y77 PolarHBondContact O-N 2.9Å |
| 74 | D | 92 | Very high | 89.1 | Confident | 99 Ų | 99 | 92 Ų | 92 | 53% | 0.529 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.4 | -43 | 175.1 | -81.7 | -12 | 0 | 0 | 0 | 112.1 | D70 K71 Y77 K78 | D70-D74 PolarHBondContact O-N 3.03Å; K71-D74 PolarHBondContact O-N 2.98Å; D74-Y77 PolarHBondContact O-N 3.44Å; D74-K78 WeakPolarHBondContact O-CG 3.44Å; D74-K78 PolarHBondContact O-N 3.46Å |
| 75 | D | 92.3 | Very high | 90.3 | Very high | 91 Ų | 91 | 91 Ų | 91 | 49% | 0.487 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -68.3 | -38.5 | 179 | -71 | -18 | 0 | 0 | 0 | 111.8 | K71 S72 K78 T79 | K71-D75 PolarHBondContact O-N 2.99Å; S72-D75 PolarHBondContact O-N 3.01Å; D75-K78 IonicContact OD1-NZ 3.73Å; D75-T79 WeakPolarHBondContact O-CB 3.4Å; D75-T79 PolarHBondContact O-N 3.34Å; D75-T79 PolarHBondContact O-OG1 3.08Å |
| 76 | I | 93.9 | Very high | 91.3 | Very high | 100 Ų | 100 | 92 Ų | 92 | 51% | 0.513 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -61 | -46.6 | 170.6 | -70.7 | 162.8 | 0 | 0 | 0 | 110.2 | S72 G73 T79 L80 | S72-I76 WeakPolarHBondContact O-CB 3.43Å; S72-I76 WeakPolarHBondContact O-CD1 3.48Å; S72-I76 WeakPolarHBondContact O-CG1 3.42Å; S72-I76 PolarHBondContact O-N 3.1Å; G73-I76 PolarHBondContact O-N 3.27Å; I76-T79 PolarHBondContact O-N 3.47Å; I76-L80 HydrophobicContact CG2-CD1 3.89Å; I76-L80 HydrophobicContact CG2-CG 4.33Å; I76-L80 WeakPolarHBondContact O-CB 3.46Å; I76-L80 VanDerWaalsContact O-CG 3.32Å; I76-L80 WeakPolarHBondContact O-CG 3.36Å; I76-L80 PolarHBondContact O-N 3.08Å |
| 77 | Y | 95 | Very high | 92.4 | Very high | 150 Ų | 150 | 95.2 Ų | 95.2 | 59% | 0.588 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -61.6 | -46.4 | 179.9 | 178 | -96.8 | 0 | 0 | 0 | 112 | G73 D74 L80 H81 | G73-Y77 WeakPolarHBondContact O-CB 3.36Å; G73-Y77 PolarHBondContact O-N 2.9Å; D74-Y77 PolarHBondContact O-N 3.44Å; Y77-L80 PolarHBondContact O-N 2.86Å; Y77-H81 WeakPolarHBondContact O-CB 3.48Å; Y77-H81 PolarHBondContact O-N 3.26Å |
| 78 | K | 96 | Very high | 93.2 | Very high | 119 Ų | 119 | 97.7 Ų | 97.7 | 52% | 0.517 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59.5 | -47.4 | 175.5 | -71.6 | 169.8 | -168.9 | 161.9 | 0 | 111.4 | D74 D75 L80 H81 I82 | D74-K78 WeakPolarHBondContact O-CG 3.44Å; D74-K78 PolarHBondContact O-N 3.46Å; D75-K78 IonicContact OD1-NZ 3.73Å; K78-L80 PolarHBondContact O-N 3.43Å; K78-H81 WeakPolarHBondContact O-CB 3.38Å; K78-H81 PolarHBondContact O-N 2.96Å; K78-H81 VanDerWaalsContact O-N 3.14Å; K78-I82 WeakPolarHBondContact O-CG1 3.39Å; K78-I82 PolarHBondContact O-N 3.49Å |
| 79 | T | 94.7 | Very high | 93.9 | Very high | 88 Ų | 88 | 97.6 Ų | 97.6 | 54% | 0.54 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60 | -44.8 | 178.5 | -58.3 | 0 | 0 | 0 | 0 | 111.6 | D75 I76 H81 I82 K83 | D75-T79 WeakPolarHBondContact O-CB 3.4Å; D75-T79 PolarHBondContact O-N 3.34Å; D75-T79 PolarHBondContact O-OG1 3.08Å; I76-T79 PolarHBondContact O-N 3.47Å; T79-H81 VanDerWaalsContact C-N 3.34Å; T79-H81 PolarHBondContact O-N 3.05Å; T79-I82 PolarHBondContact O-N 2.92Å; T79-K83 WeakPolarHBondContact O-CB 3.46Å; T79-K83 PolarHBondContact O-N 2.86Å |
| 80 | L | 97.1 | Very high | 94.4 | Very high | 100 Ų | 100 | 97.2 Ų | 97.2 | 52% | 0.524 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64.7 | -37.3 | 175.7 | -73.1 | 175.9 | 0 | 0 | 0 | 112.2 | I76 Y77 K78 R84 | I76-L80 HydrophobicContact CG2-CD1 3.89Å; I76-L80 HydrophobicContact CG2-CG 4.33Å; I76-L80 WeakPolarHBondContact O-CB 3.46Å; I76-L80 VanDerWaalsContact O-CG 3.32Å; I76-L80 WeakPolarHBondContact O-CG 3.36Å; I76-L80 PolarHBondContact O-N 3.08Å; Y77-L80 PolarHBondContact O-N 2.86Å; K78-L80 PolarHBondContact O-N 3.43Å; L80-R84 WeakPolarHBondContact O-CB 3.43Å; L80-R84 PolarHBondContact O-N 3.4Å |
| 81 | H | 95.8 | Very high | 94.9 | Very high | 75 Ų | 75 | 95.9 Ų | 95.9 | 35% | 0.347 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -65.2 | -46.6 | 176.8 | -169.3 | 82.3 | 0 | 0 | 0 | 111.8 | Y77 K78 T79 R84 K85 | Y77-H81 WeakPolarHBondContact O-CB 3.48Å; Y77-H81 PolarHBondContact O-N 3.26Å; K78-H81 WeakPolarHBondContact O-CB 3.38Å; K78-H81 PolarHBondContact O-N 2.96Å; K78-H81 VanDerWaalsContact O-N 3.14Å; T79-H81 VanDerWaalsContact C-N 3.34Å; T79-H81 PolarHBondContact O-N 3.05Å; H81-R84 PolarHBondContact O-N 3.11Å; H81-K85 PolarHBondContact O-N 3.19Å |
| 82 | I | 96.2 | Very high | 95.3 | Very high | 51 Ų | 51 | 97.2 Ų | 97.2 | 26% | 0.262 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -59.9 | -49.3 | 175.7 | -68 | 165.1 | 0 | 0 | 0 | 110.1 | K78 T79 R84 K85 W86 | K78-I82 WeakPolarHBondContact O-CG1 3.39Å; K78-I82 PolarHBondContact O-N 3.49Å; T79-I82 PolarHBondContact O-N 2.92Å; I82-R84 VanDerWaalsContact C-N 3.31Å; I82-R84 PolarHBondContact O-N 3.26Å; I82-K85 PolarHBondContact O-N 3.41Å; I82-K85 VanDerWaalsContact O-N 3.15Å; I82-W86 PolarHBondContact O-N 3.16Å |
| 83 | K | 97.3 | Very high | 95.7 | Very high | 127 Ų | 127 | 99.1 Ų | 99.1 | 55% | 0.552 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -58.5 | -41.6 | 177.8 | -171.7 | -179.1 | -179.3 | -172.2 | 0 | 112.1 | T79 W86 M87 | T79-K83 WeakPolarHBondContact O-CB 3.46Å; T79-K83 PolarHBondContact O-N 2.86Å; K83-W86 PolarHBondContact O-N 3.37Å; K83-M87 HydrophobicContact CG-SD 4.5Å; K83-M87 WeakPolarHBondContact O-CG 3.28Å; K83-M87 PolarHBondContact O-N 2.94Å |
| 84 | R | 97 | Very high | 96 | Very high | 135 Ų | 135 | 98.9 Ų | 98.9 | 51% | 0.509 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -61.4 | -49 | 175.2 | -178.4 | -172.9 | -61.2 | 153.5 | 3.3 | 111.2 | L80 H81 I82 W86 M87 E88 | L80-R84 WeakPolarHBondContact O-CB 3.43Å; L80-R84 PolarHBondContact O-N 3.4Å; H81-R84 PolarHBondContact O-N 3.11Å; I82-R84 VanDerWaalsContact C-N 3.31Å; I82-R84 PolarHBondContact O-N 3.26Å; R84-W86 VanDerWaalsContact C-N 3.32Å; R84-W86 PolarHBondContact O-N 3.24Å; R84-M87 PolarHBondContact O-N 3.39Å; R84-E88 WeakPolarHBondContact CD-OE1 3.43Å; R84-E88 HydrophobicContact CG-CG 4.39Å; R84-E88 WeakPolarHBondContact CG-OE1 3.32Å; R84-E88 WeakPolarHBondContact O-CG 3.41Å; R84-E88 PolarHBondContact O-N 2.97Å |
| 85 | K | 97.4 | Very high | 96.2 | Very high | 100 Ų | 100 | 100.7 Ų | 100.7 | 44% | 0.435 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61 | -41 | 179.5 | -77.9 | -73.2 | 164.6 | -145.2 | 0 | 112.2 | H81 I82 E88 T89 | H81-K85 PolarHBondContact O-N 3.19Å; I82-K85 PolarHBondContact O-N 3.41Å; I82-K85 VanDerWaalsContact O-N 3.15Å; K85-E88 IonicContact NZ-OE2 2.82Å; K85-E88 PolarHBondContact NZ-OE2 3.41Å; K85-E88 PolarHBondContact O-N 3Å; K85-T89 PolarHBondContact O-N 2.92Å; K85-T89 PolarHBondContact O-OG1 3.39Å; K85-T89 VanDerWaalsContact O-OG1 3.09Å |
| 86 | W | 95.4 | Very high | 96.4 | Very high | 110 Ų | 110 | 102.7 Ų | 102.7 | 42% | 0.417 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.7 | -48.8 | 173.9 | 176.7 | 83.7 | 0 | 0 | 0 | 111.8 | I82 K83 R84 E88 T89 Y90 | I82-W86 PolarHBondContact O-N 3.16Å; K83-W86 PolarHBondContact O-N 3.37Å; R84-W86 VanDerWaalsContact C-N 3.32Å; R84-W86 PolarHBondContact O-N 3.24Å; W86-E88 PolarHBondContact O-N 3.04Å; W86-T89 PolarHBondContact O-N 3.39Å; W86-Y90 WeakPolarHBondContact O-CB 3.49Å; W86-Y90 PolarHBondContact O-N 3.4Å |
| 87 | M | 97.7 | Very high | 96.5 | Very high | 97 Ų | 97 | 99.6 Ų | 99.6 | 48% | 0.478 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62 | -42.9 | 177.5 | -71.5 | -179.6 | 64.5 | 0 | 0 | 112.6 | K83 R84 T89 Y90 V91 | K83-M87 HydrophobicContact CG-SD 4.5Å; K83-M87 WeakPolarHBondContact O-CG 3.28Å; K83-M87 PolarHBondContact O-N 2.94Å; R84-M87 PolarHBondContact O-N 3.39Å; M87-T89 VanDerWaalsContact C-N 3.34Å; M87-T89 PolarHBondContact O-N 3.25Å; M87-Y90 PolarHBondContact O-N 3.42Å; M87-V91 WeakPolarHBondContact O-CB 3.32Å; M87-V91 VanDerWaalsContact O-CG2 3.31Å; M87-V91 WeakPolarHBondContact O-CG2 3.46Å; M87-V91 PolarHBondContact O-N 2.96Å |
| 88 | E | 97.1 | Very high | 96.6 | Very high | 93 Ų | 93 | 96 Ų | 96 | 44% | 0.435 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -57.5 | -46.2 | 176.5 | -77 | 172.4 | -172.5 | 0 | 0 | 111.3 | R84 K85 W86 K92 | R84-E88 WeakPolarHBondContact CD-OE1 3.43Å; R84-E88 HydrophobicContact CG-CG 4.39Å; R84-E88 WeakPolarHBondContact CG-OE1 3.32Å; R84-E88 WeakPolarHBondContact O-CG 3.41Å; R84-E88 PolarHBondContact O-N 2.97Å; K85-E88 IonicContact NZ-OE2 2.82Å; K85-E88 PolarHBondContact NZ-OE2 3.41Å; K85-E88 PolarHBondContact O-N 3Å; W86-E88 PolarHBondContact O-N 3.04Å; E88-K92 VanDerWaalsContact O-CB 3.29Å; E88-K92 WeakPolarHBondContact O-CB 3.47Å; E88-K92 PolarHBondContact O-N 3.24Å; E88-K92 VanDerWaalsContact O-N 3.12Å |
| 89 | T | 97 | Very high | 96.6 | Very high | 68 Ų | 68 | 93.7 Ų | 93.7 | 42% | 0.417 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -66.3 | -48.4 | 177.4 | -60.5 | 0 | 0 | 0 | 0 | 111.4 | K85 W86 M87 V91 K92 E93 | K85-T89 PolarHBondContact O-N 2.92Å; K85-T89 PolarHBondContact O-OG1 3.39Å; K85-T89 VanDerWaalsContact O-OG1 3.09Å; W86-T89 PolarHBondContact O-N 3.39Å; M87-T89 VanDerWaalsContact C-N 3.34Å; M87-T89 PolarHBondContact O-N 3.25Å; T89-V91 PolarHBondContact O-N 2.99Å; T89-K92 WeakPolarHBondContact O-CB 3.38Å; T89-K92 PolarHBondContact O-N 3.26Å; T89-K92 VanDerWaalsContact O-N 3.16Å; T89-E93 HydrophobicContact CG2-CG 4.34Å; T89-E93 WeakPolarHBondContact O-CG 3.28Å; T89-E93 PolarHBondContact O-N 2.97Å |
| 90 | Y | 96.3 | Very high | 96.7 | Very high | 105 Ų | 105 | 93.7 Ų | 93.7 | 41% | 0.412 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -56.7 | -48 | 179.4 | 175.8 | -96.9 | 0 | 0 | 0 | 112.2 | W86 M87 K92 E93 S94 | W86-Y90 WeakPolarHBondContact O-CB 3.49Å; W86-Y90 PolarHBondContact O-N 3.4Å; M87-Y90 PolarHBondContact O-N 3.42Å; Y90-K92 PolarHBondContact O-N 3.47Å; Y90-E93 PolarHBondContact O-N 3.06Å; Y90-S94 VanDerWaalsContact O-CB 3.23Å; Y90-S94 WeakPolarHBondContact O-CB 3.33Å; Y90-S94 PolarHBondContact O-N 3.38Å; Y90-S94 PolarHBondContact O-OG 3.03Å |
| 91 | V | 97.6 | Very high | 96.7 | Very high | 89 Ų | 89 | 94.4 Ų | 94.4 | 54% | 0.539 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.5 | -42.7 | 178.2 | 171.2 | 0 | 0 | 0 | 0 | 110.8 | M87 T89 S94 F95 | M87-V91 WeakPolarHBondContact O-CB 3.32Å; M87-V91 VanDerWaalsContact O-CG2 3.31Å; M87-V91 WeakPolarHBondContact O-CG2 3.46Å; M87-V91 PolarHBondContact O-N 2.96Å; T89-V91 PolarHBondContact O-N 2.99Å; V91-S94 PolarHBondContact O-N 3.41Å; V91-F95 WeakPolarHBondContact O-CB 3.49Å; V91-F95 PolarHBondContact O-N 2.9Å |
| 92 | K | 97.7 | Very high | 96.7 | Very high | 160 Ų | 160 | 95.7 Ų | 95.7 | 70% | 0.696 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -62 | -45.2 | 178.9 | -177.9 | -178 | 177.2 | -175 | 0 | 112 | E88 T89 Y90 K96 | E88-K92 VanDerWaalsContact O-CB 3.29Å; E88-K92 WeakPolarHBondContact O-CB 3.47Å; E88-K92 PolarHBondContact O-N 3.24Å; E88-K92 VanDerWaalsContact O-N 3.12Å; T89-K92 WeakPolarHBondContact O-CB 3.38Å; T89-K92 PolarHBondContact O-N 3.26Å; T89-K92 VanDerWaalsContact O-N 3.16Å; Y90-K92 PolarHBondContact O-N 3.47Å; K92-K96 WeakPolarHBondContact O-CB 3.42Å; K92-K96 PolarHBondContact O-N 3.36Å |
| 93 | E | 96.5 | Very high | 96.8 | Very high | 88 Ų | 88 | 98.1 Ų | 98.1 | 41% | 0.411 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -69 | -43.3 | 179 | -71.2 | 177.7 | 167.6 | 0 | 0 | 111.6 | T89 Y90 F95 K96 G97 | T89-E93 HydrophobicContact CG2-CG 4.34Å; T89-E93 WeakPolarHBondContact O-CG 3.28Å; T89-E93 PolarHBondContact O-N 2.97Å; Y90-E93 PolarHBondContact O-N 3.06Å; E93-F95 VanDerWaalsContact C-N 3.34Å; E93-F95 PolarHBondContact O-N 3.34Å; E93-K96 WeakPolarHBondContact O-CB 3.48Å; E93-K96 PolarHBondContact O-N 2.93Å; E93-G97 PolarHBondContact O-N 3.4Å |
| 94 | S | 95.3 | Very high | 96.8 | Very high | 32 Ų | 32 | 99.5 Ų | 99.5 | 22% | 0.224 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -58.4 | -45.5 | 175.4 | -62.1 | 0 | 0 | 0 | 0 | 111.8 | Y90 V91 G97 S98 | Y90-S94 VanDerWaalsContact O-CB 3.23Å; Y90-S94 WeakPolarHBondContact O-CB 3.33Å; Y90-S94 PolarHBondContact O-N 3.38Å; Y90-S94 PolarHBondContact O-OG 3.03Å; V91-S94 PolarHBondContact O-N 3.41Å; S94-G97 PolarHBondContact O-N 3.3Å; S94-S98 WeakPolarHBondContact O-CB 3.4Å; S94-S98 PolarHBondContact O-N 3.37Å; S94-S98 PolarHBondContact O-OG 3Å |
| 95 | F | 96.9 | Very high | 96.7 | Very high | 136 Ų | 136 | 98.5 Ų | 98.5 | 60% | 0.596 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -66.8 | -39.8 | 177.4 | -168.8 | -108.8 | 0 | 0 | 0 | 111.8 | V91 E93 S98 N99 | V91-F95 WeakPolarHBondContact O-CB 3.49Å; V91-F95 PolarHBondContact O-N 2.9Å; E93-F95 VanDerWaalsContact C-N 3.34Å; E93-F95 PolarHBondContact O-N 3.34Å; F95-S98 PolarHBondContact O-N 2.92Å; F95-N99 VanDerWaalsContact CD1-ND2 3.29Å; F95-N99 WeakPolarHBondContact CD1-ND2 3.34Å; F95-N99 WeakPolarHBondContact CE1-ND2 3.43Å; F95-N99 WeakPolarHBondContact CZ-ND2 3.37Å; F95-N99 WeakPolarHBondContact O-CB 3.39Å; F95-N99 VanDerWaalsContact O-CG 3.29Å; F95-N99 PolarHBondContact O-N 3.42Å |
| 96 | K | 97.2 | Very high | 96.6 | Very high | 134 Ų | 134 | 96.3 Ų | 96.3 | 58% | 0.583 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -61 | -48.5 | 175.5 | -176.6 | -176.2 | 175.7 | -170.3 | 0 | 111.6 | K92 E93 N99 Q100 | K92-K96 WeakPolarHBondContact O-CB 3.42Å; K92-K96 PolarHBondContact O-N 3.36Å; E93-K96 WeakPolarHBondContact O-CB 3.48Å; E93-K96 PolarHBondContact O-N 2.93Å; K96-N99 PolarHBondContact O-N 3.31Å; K96-Q100 WeakPolarHBondContact O-CG 3.29Å; K96-Q100 PolarHBondContact O-N 3.44Å |
| 97 | G | 96.1 | Very high | 96.7 | Very high | 34 Ų | 34 | 96.2 Ų | 96.2 | 35% | 0.351 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62 | -45.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112 | E93 S94 N99 Q100 K101 | E93-G97 PolarHBondContact O-N 3.4Å; S94-G97 PolarHBondContact O-N 3.3Å; G97-N99 PolarHBondContact O-N 3.04Å; G97-Q100 PolarHBondContact O-N 2.94Å; G97-K101 PolarHBondContact O-N 3.08Å |
| 98 | S | 96.6 | Very high | 96.7 | Very high | 76 Ų | 76 | 96.1 Ų | 96.1 | 53% | 0.531 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.1 | -45.6 | 177.5 | -61.2 | 0 | 0 | 0 | 0 | 112.2 | S94 F95 Q100 K101 L102 | S94-S98 WeakPolarHBondContact O-CB 3.4Å; S94-S98 PolarHBondContact O-N 3.37Å; S94-S98 PolarHBondContact O-OG 3Å; F95-S98 PolarHBondContact O-N 2.92Å; S98-Q100 PolarHBondContact O-N 3.06Å; S98-K101 PolarHBondContact O-N 3.32Å; S98-L102 PolarHBondContact O-N 3.33Å |
| 99 | N | 96.5 | Very high | 96.6 | Very high | 69 Ų | 69 | 94.6 Ų | 94.6 | 37% | 0.369 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64 | -39.7 | 177.2 | -76.4 | -14 | 0 | 0 | 0 | 112.5 | F95 K96 G97 K101 L102 E103 | F95-N99 VanDerWaalsContact CD1-ND2 3.29Å; F95-N99 WeakPolarHBondContact CD1-ND2 3.34Å; F95-N99 WeakPolarHBondContact CE1-ND2 3.43Å; F95-N99 WeakPolarHBondContact CZ-ND2 3.37Å; F95-N99 WeakPolarHBondContact O-CB 3.39Å; F95-N99 VanDerWaalsContact O-CG 3.29Å; F95-N99 PolarHBondContact O-N 3.42Å; K96-N99 PolarHBondContact O-N 3.31Å; G97-N99 PolarHBondContact O-N 3.04Å; N99-K101 VanDerWaalsContact C-N 3.33Å; N99-K101 PolarHBondContact O-N 3.05Å; N99-L102 PolarHBondContact O-N 3.25Å; N99-E103 WeakPolarHBondContact O-CB 3.43Å; N99-E103 PolarHBondContact O-N 2.98Å |
| 100 | Q | 97 | Very high | 96.6 | Very high | 88 Ų | 88 | 97.6 Ų | 97.6 | 41% | 0.411 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.6 | -36.7 | 175.3 | -73.9 | 178.9 | -12.9 | 0 | 0 | 112.3 | K96 G97 S98 R104 | K96-Q100 WeakPolarHBondContact O-CG 3.29Å; K96-Q100 PolarHBondContact O-N 3.44Å; G97-Q100 PolarHBondContact O-N 2.94Å; S98-Q100 PolarHBondContact O-N 3.06Å; Q100-R104 WeakPolarHBondContact O-CB 3.09Å; Q100-R104 WeakPolarHBondContact O-CG 3.25Å; Q100-R104 PolarHBondContact O-N 2.77Å; Q100-R104 VanDerWaalsContact O-N 3.07Å; Q100-R104 PolarHBondContact O-NE 2.96Å |
| 101 | K | 95.9 | Very high | 96.7 | Very high | 115 Ų | 115 | 100.2 Ų | 100.2 | 50% | 0.5 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66.3 | -44.9 | 174.9 | -171.7 | 170.5 | -178 | 169.5 | 0 | 110.9 | G97 S98 N99 E103 R104 F105 | G97-K101 PolarHBondContact O-N 3.08Å; S98-K101 PolarHBondContact O-N 3.32Å; N99-K101 VanDerWaalsContact C-N 3.33Å; N99-K101 PolarHBondContact O-N 3.05Å; K101-E103 PolarHBondContact O-N 3.43Å; K101-R104 PolarHBondContact O-N 2.94Å; K101-F105 PolarHBondContact O-N 3.41Å |
| 102 | L | 96.8 | Very high | 96.7 | Very high | 102 Ų | 102 | 101.2 Ų | 101.2 | 53% | 0.534 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.7 | -45 | 175.3 | -179.8 | 61.1 | 0 | 0 | 0 | 111.9 | S98 N99 R104 F105 C106 | S98-L102 PolarHBondContact O-N 3.33Å; N99-L102 PolarHBondContact O-N 3.25Å; L102-R104 PolarHBondContact O-N 3.3Å; L102-F105 WeakPolarHBondContact O-CB 3.49Å; L102-F105 PolarHBondContact O-N 3.09Å; L102-C106 PolarHBondContact O-N 3.37Å; L102-C106 PolarHBondContact O-SG 3.07Å; L102-C106 VanDerWaalsContact O-SG 3.32Å |
| 103 | E | 97.2 | Very high | 96.7 | Very high | 103 Ų | 103 | 101.7 Ų | 101.7 | 48% | 0.481 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.1 | -43.4 | 178.3 | -169.7 | -171 | 165.5 | 0 | 0 | 111.9 | N99 K101 F105 C106 K107 | N99-E103 WeakPolarHBondContact O-CB 3.43Å; N99-E103 PolarHBondContact O-N 2.98Å; K101-E103 PolarHBondContact O-N 3.43Å; E103-F105 VanDerWaalsContact C-N 3.34Å; E103-F105 PolarHBondContact O-N 3Å; E103-C106 PolarHBondContact O-N 2.81Å; E103-K107 HydrophobicContact CG-CD 4.31Å; E103-K107 WeakPolarHBondContact O-CB 3.4Å; E103-K107 WeakPolarHBondContact O-CG 3.41Å; E103-K107 PolarHBondContact O-N 3.37Å; E103-K107 VanDerWaalsContact OE1-CE 3.32Å; E103-K107 WeakPolarHBondContact OE1-CE 3.39Å; E103-K107 IonicContact OE1-NZ 2.63Å; E103-K107 PolarHBondContact OE1-NZ 3.31Å |
| 104 | R | 97.3 | Very high | 96.8 | Very high | 156 Ų | 156 | 104.4 Ų | 104.4 | 59% | 0.589 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -58.7 | -46.2 | 174.4 | -79.4 | -177.2 | -95.3 | 165.6 | -11.6 | 111.3 | Q100 K101 L102 K107 M108 | Q100-R104 WeakPolarHBondContact O-CB 3.09Å; Q100-R104 WeakPolarHBondContact O-CG 3.25Å; Q100-R104 PolarHBondContact O-N 2.77Å; Q100-R104 VanDerWaalsContact O-N 3.07Å; Q100-R104 PolarHBondContact O-NE 2.96Å; K101-R104 PolarHBondContact O-N 2.94Å; L102-R104 PolarHBondContact O-N 3.3Å; R104-K107 PolarHBondContact O-N 3Å; R104-M108 PolarHBondContact O-N 3.35Å |
| 105 | F | 95.4 | Very high | 96.9 | Very high | 113 Ų | 113 | 106.7 Ų | 106.7 | 50% | 0.496 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.2 | -48.1 | 177.4 | 178.6 | -97.3 | 0 | 0 | 0 | 112 | K101 L102 E103 K107 M108 N109 | K101-F105 PolarHBondContact O-N 3.41Å; L102-F105 WeakPolarHBondContact O-CB 3.49Å; L102-F105 PolarHBondContact O-N 3.09Å; E103-F105 VanDerWaalsContact C-N 3.34Å; E103-F105 PolarHBondContact O-N 3Å; F105-K107 PolarHBondContact O-N 3.1Å; F105-M108 WeakPolarHBondContact O-CB 3.49Å; F105-M108 PolarHBondContact O-N 2.9Å; F105-M108 VanDerWaalsContact O-N 3.17Å; F105-N109 PolarHBondContact O-N 3.36Å |
| 106 | C | 95.5 | Very high | 96.9 | Very high | 54 Ų | 54 | 105.3 Ų | 105.3 | 37% | 0.365 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -57.7 | -46.9 | 177.1 | -71.5 | 0 | 0 | 0 | 0 | 111.8 | L102 E103 M108 N109 E110 | L102-C106 PolarHBondContact O-N 3.37Å; L102-C106 PolarHBondContact O-SG 3.07Å; L102-C106 VanDerWaalsContact O-SG 3.32Å; E103-C106 PolarHBondContact O-N 2.81Å; C106-M108 VanDerWaalsContact C-N 3.32Å; C106-M108 PolarHBondContact O-N 2.86Å; C106-N109 PolarHBondContact O-N 3.3Å; C106-E110 WeakPolarHBondContact O-CG 3.49Å; C106-E110 PolarHBondContact O-N 3.49Å |
| 107 | K | 97.7 | Very high | 96.9 | Very high | 108 Ų | 108 | 103.2 Ų | 103.2 | 47% | 0.47 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.7 | -37.7 | 176.9 | -76.8 | 172.7 | 170.5 | 169.3 | 0 | 112.7 | E103 R104 F105 R111 | E103-K107 HydrophobicContact CG-CD 4.31Å; E103-K107 WeakPolarHBondContact O-CB 3.4Å; E103-K107 WeakPolarHBondContact O-CG 3.41Å; E103-K107 PolarHBondContact O-N 3.37Å; E103-K107 VanDerWaalsContact OE1-CE 3.32Å; E103-K107 WeakPolarHBondContact OE1-CE 3.39Å; E103-K107 IonicContact OE1-NZ 2.63Å; E103-K107 PolarHBondContact OE1-NZ 3.31Å; R104-K107 PolarHBondContact O-N 3Å; F105-K107 PolarHBondContact O-N 3.1Å; K107-R111 WeakPolarHBondContact O-CB 3.43Å; K107-R111 PolarHBondContact O-N 3.04Å; K107-R111 VanDerWaalsContact O-N 3.14Å |
| 108 | M | 97 | Very high | 97 | Very high | 95 Ų | 95 | 105 Ų | 105 | 47% | 0.468 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.1 | -51.1 | 175.7 | -169.4 | 68.8 | 82.3 | 0 | 0 | 110.7 | R104 F105 C106 E110 R111 E112 | R104-M108 PolarHBondContact O-N 3.35Å; F105-M108 WeakPolarHBondContact O-CB 3.49Å; F105-M108 PolarHBondContact O-N 2.9Å; F105-M108 VanDerWaalsContact O-N 3.17Å; C106-M108 VanDerWaalsContact C-N 3.32Å; C106-M108 PolarHBondContact O-N 2.86Å; M108-E110 VanDerWaalsContact C-N 3.34Å; M108-E110 PolarHBondContact O-N 3.3Å; M108-R111 WeakPolarHBondContact O-CB 3.3Å; M108-R111 PolarHBondContact O-N 2.83Å; M108-R111 VanDerWaalsContact O-N 3.08Å; M108-E112 PolarHBondContact O-N 2.89Å |
| 109 | N | 96.1 | Very high | 97 | Very high | 62 Ų | 62 | 106.9 Ų | 106.9 | 33% | 0.332 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.9 | -40.7 | 179.6 | -176.7 | 49.2 | 0 | 0 | 0 | 112.3 | F105 C106 R111 E112 R113 | F105-N109 PolarHBondContact O-N 3.36Å; C106-N109 PolarHBondContact O-N 3.3Å; N109-R111 VanDerWaalsContact C-N 3.33Å; N109-R111 PolarHBondContact O-N 3.16Å; N109-E112 PolarHBondContact O-N 3.43Å; N109-R113 WeakPolarHBondContact O-CG 3.45Å; N109-R113 PolarHBondContact O-N 3.3Å |
| 110 | E | 97.2 | Very high | 97 | Very high | 131 Ų | 131 | 108.4 Ų | 108.4 | 61% | 0.612 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.6 | -42.4 | 173.1 | -77.4 | 177.5 | -178.5 | 0 | 0 | 112.4 | C106 M108 R113 K114 | C106-E110 WeakPolarHBondContact O-CG 3.49Å; C106-E110 PolarHBondContact O-N 3.49Å; M108-E110 VanDerWaalsContact C-N 3.34Å; M108-E110 PolarHBondContact O-N 3.3Å; E110-R113 PolarHBondContact O-N 3.28Å; E110-K114 WeakPolarHBondContact O-CB 3.39Å; E110-K114 PolarHBondContact O-N 2.89Å |
| 111 | R | 97.5 | Very high | 97.1 | Very high | 160 Ų | 160 | 106.6 Ų | 106.6 | 60% | 0.604 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64.9 | -42.8 | 177.9 | -169.1 | -173 | -60.1 | 147.9 | 0.2 | 111.6 | K107 M108 N109 K114 N115 | K107-R111 WeakPolarHBondContact O-CB 3.43Å; K107-R111 PolarHBondContact O-N 3.04Å; K107-R111 VanDerWaalsContact O-N 3.14Å; M108-R111 WeakPolarHBondContact O-CB 3.3Å; M108-R111 PolarHBondContact O-N 2.83Å; M108-R111 VanDerWaalsContact O-N 3.08Å; N109-R111 VanDerWaalsContact C-N 3.33Å; N109-R111 PolarHBondContact O-N 3.16Å; R111-K114 PolarHBondContact O-N 3.46Å; R111-N115 WeakPolarHBondContact O-CB 3.43Å; R111-N115 PolarHBondContact O-N 3Å |
| 112 | E | 97.4 | Very high | 97.2 | Very high | 110 Ų | 110 | 106.9 Ų | 106.9 | 51% | 0.514 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63 | -46.6 | 176.4 | -73.2 | -174.1 | 176.7 | 0 | 0 | 111.9 | M108 N109 K114 N115 I116 | M108-E112 PolarHBondContact O-N 2.89Å; N109-E112 PolarHBondContact O-N 3.43Å; E112-K114 VanDerWaalsContact C-N 3.3Å; E112-K114 PolarHBondContact O-N 2.87Å; E112-N115 WeakPolarHBondContact O-CB 3.41Å; E112-N115 PolarHBondContact O-N 3.22Å; E112-N115 VanDerWaalsContact O-N 3.15Å; E112-I116 WeakPolarHBondContact O-CG1 3.43Å; E112-I116 PolarHBondContact O-N 3.45Å |
| 113 | R | 97.4 | Very high | 97.2 | Very high | 170 Ų | 170 | 108 Ų | 108 | 64% | 0.642 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -57.1 | -44.3 | 174.7 | -74.7 | 179.7 | 59.3 | 136.3 | 1.5 | 111.8 | N109 E110 I116 N117 | N109-R113 WeakPolarHBondContact O-CG 3.45Å; N109-R113 PolarHBondContact O-N 3.3Å; E110-R113 PolarHBondContact O-N 3.28Å; R113-I116 PolarHBondContact O-N 3.09Å; R113-N117 WeakPolarHBondContact O-CB 3.42Å; R113-N117 PolarHBondContact O-N 3.39Å |
| 114 | K | 97.9 | Very high | 97.2 | Very high | 144 Ų | 144 | 108.6 Ų | 108.6 | 63% | 0.626 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.8 | -42.9 | 176.5 | -171.9 | 177 | -178.5 | 178.6 | 0 | 111.7 | E110 R111 E112 N117 N118 | E110-K114 WeakPolarHBondContact O-CB 3.39Å; E110-K114 PolarHBondContact O-N 2.89Å; R111-K114 PolarHBondContact O-N 3.46Å; E112-K114 VanDerWaalsContact C-N 3.3Å; E112-K114 PolarHBondContact O-N 2.87Å; K114-N117 PolarHBondContact O-N 3.28Å; K114-N118 WeakPolarHBondContact O-CB 3.47Å; K114-N118 PolarHBondContact O-N 3.39Å; K114-N118 PolarHBondContact O-OD1 3.07Å |
| 115 | N | 97.6 | Very high | 97.3 | Very high | 81 Ų | 81 | 105.7 Ų | 105.7 | 43% | 0.433 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.3 | -45.8 | 177.4 | -175.9 | 39.4 | 0 | 0 | 0 | 112 | R111 E112 N118 K119 | R111-N115 WeakPolarHBondContact O-CB 3.43Å; R111-N115 PolarHBondContact O-N 3Å; E112-N115 WeakPolarHBondContact O-CB 3.41Å; E112-N115 PolarHBondContact O-N 3.22Å; E112-N115 VanDerWaalsContact O-N 3.15Å; N115-N118 PolarHBondContact O-N 3.36Å; N115-K119 WeakPolarHBondContact O-CG 3.37Å; N115-K119 PolarHBondContact O-N 2.87Å; N115-K119 VanDerWaalsContact O-N 3.07Å |
| 116 | I | 96.9 | Very high | 97.4 | Very high | 106 Ų | 106 | 104.4 Ų | 104.4 | 54% | 0.544 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61 | -47.4 | 176.5 | -67.6 | 166.7 | 0 | 0 | 0 | 110.5 | E112 R113 N118 K119 F120 | E112-I116 WeakPolarHBondContact O-CG1 3.43Å; E112-I116 PolarHBondContact O-N 3.45Å; R113-I116 PolarHBondContact O-N 3.09Å; I116-N118 VanDerWaalsContact C-N 3.35Å; I116-N118 PolarHBondContact O-N 3.45Å; I116-K119 PolarHBondContact O-N 3.2Å; I116-F120 PolarHBondContact O-N 2.93Å; I116-F120 VanDerWaalsContact O-N 3.09Å |
| 117 | N | 97.7 | Very high | 97.5 | Very high | 90 Ų | 90 | 106.1 Ų | 106.1 | 48% | 0.481 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.4 | -43.3 | 179 | -171.7 | 57.7 | 0 | 0 | 0 | 111.9 | R113 K114 F120 C121 | R113-N117 WeakPolarHBondContact O-CB 3.42Å; R113-N117 PolarHBondContact O-N 3.39Å; K114-N117 PolarHBondContact O-N 3.28Å; N117-F120 PolarHBondContact O-N 3.23Å; N117-C121 WeakPolarHBondContact O-CB 3.37Å; N117-C121 PolarHBondContact O-N 3.34Å; N117-C121 PolarHBondContact O-SG 3.44Å |
| 118 | N | 97.9 | Very high | 97.6 | Very high | 72 Ų | 72 | 106.9 Ų | 106.9 | 39% | 0.385 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.3 | -48.1 | 178 | -73.6 | -2.8 | 0 | 0 | 0 | 111.9 | K114 N115 I116 F120 C121 E122 | K114-N118 WeakPolarHBondContact O-CB 3.47Å; K114-N118 PolarHBondContact O-N 3.39Å; K114-N118 PolarHBondContact O-OD1 3.07Å; N115-N118 PolarHBondContact O-N 3.36Å; I116-N118 VanDerWaalsContact C-N 3.35Å; I116-N118 PolarHBondContact O-N 3.45Å; N118-F120 PolarHBondContact O-N 3.3Å; N118-C121 WeakPolarHBondContact O-CB 3.45Å; N118-C121 PolarHBondContact O-N 2.89Å; N118-E122 WeakPolarHBondContact O-CG 3.34Å; N118-E122 PolarHBondContact O-N 3.26Å |
| 119 | K | 97.7 | Very high | 97.6 | Very high | 116 Ų | 116 | 107.9 Ų | 107.9 | 50% | 0.504 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.2 | -39 | 176.7 | -71.8 | 177.3 | 180 | -177.3 | 0 | 112.1 | N115 I116 Q123 | N115-K119 WeakPolarHBondContact O-CG 3.37Å; N115-K119 PolarHBondContact O-N 2.87Å; N115-K119 VanDerWaalsContact O-N 3.07Å; I116-K119 PolarHBondContact O-N 3.2Å; K119-Q123 WeakPolarHBondContact O-CG 3.32Å; K119-Q123 PolarHBondContact O-N 2.97Å; K119-Q123 VanDerWaalsContact O-N 3.16Å |
| 120 | F | 96.6 | Very high | 97.7 | Very high | 100 Ų | 100 | 111 Ų | 111 | 44% | 0.439 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -70.9 | -41.5 | 178.3 | -166.6 | -124.7 | 0 | 0 | 0 | 112.2 | I116 N117 N118 E122 Q123 Y124 | I116-F120 PolarHBondContact O-N 2.93Å; I116-F120 VanDerWaalsContact O-N 3.09Å; N117-F120 PolarHBondContact O-N 3.23Å; N118-F120 PolarHBondContact O-N 3.3Å; F120-E122 PolarHBondContact O-N 3.06Å; F120-Q123 PolarHBondContact O-N 3.47Å; F120-Y124 AromaticContact CD1-CD2 3.95Å; F120-Y124 HydrophobicContact CD1-CD2 3.95Å; F120-Y124 AromaticContact CD1-CE2 3.59Å; F120-Y124 HydrophobicContact CD1-CE2 3.59Å; F120-Y124 HydrophobicContact CD2-CE2 4.35Å; F120-Y124 AromaticContact CE1-CD2 3.93Å; F120-Y124 HydrophobicContact CE1-CD2 3.93Å; F120-Y124 AromaticContact CE1-CE2 3.1Å; F120-Y124 HydrophobicContact CE1-CE2 3.1Å; F120-Y124 AromaticContact CE1-CZ 3.87Å; F120-Y124 AromaticContact CE2-CE2 3.87Å; F120-Y124 HydrophobicContact CE2-CE2 3.87Å; F120-Y124 HydrophobicContact CG-CD2 4.34Å; F120-Y124 HydrophobicContact CG-CE2 4.22Å; F120-Y124 HydrophobicContact CZ-CD2 4.18Å; F120-Y124 AromaticContact CZ-CE2 3.22Å; F120-Y124 HydrophobicContact CZ-CE2 3.22Å; F120-Y124 AromaticContact CZ-CZ 3.55Å; F120-Y124 VanDerWaalsContact CZ-OH 3.3Å; F120-Y124 WeakPolarHBondContact CZ-OH 3.48Å; F120-Y124 WeakPolarHBondContact O-CD2 3.4Å; F120-Y124 PolarHBondContact O-N 2.91Å |
| 121 | C | 98 | Very high | 97.8 | Very high | 51 Ų | 51 | 107.6 Ų | 107.6 | 35% | 0.345 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.4 | -44.5 | 172.6 | -71.6 | 0 | 0 | 0 | 0 | 111.7 | N117 N118 Q123 Y124 I125 | N117-C121 WeakPolarHBondContact O-CB 3.37Å; N117-C121 PolarHBondContact O-N 3.34Å; N117-C121 PolarHBondContact O-SG 3.44Å; N118-C121 WeakPolarHBondContact O-CB 3.45Å; N118-C121 PolarHBondContact O-N 2.89Å; C121-Q123 VanDerWaalsContact C-N 3.34Å; C121-Q123 PolarHBondContact O-N 3.37Å; C121-Y124 PolarHBondContact O-N 3.15Å; C121-I125 WeakPolarHBondContact O-CB 3.47Å; C121-I125 VanDerWaalsContact O-CG1 3.25Å; C121-I125 WeakPolarHBondContact O-CG1 3.38Å; C121-I125 PolarHBondContact O-N 3.39Å |
| 122 | E | 98 | Very high | 97.9 | Very high | 121 Ų | 121 | 104.6 Ų | 104.6 | 57% | 0.565 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -58.5 | -43.7 | 176.3 | -74.8 | 170.8 | -173.1 | 0 | 0 | 112.2 | N118 F120 I125 T126 | N118-E122 WeakPolarHBondContact O-CG 3.34Å; N118-E122 PolarHBondContact O-N 3.26Å; F120-E122 PolarHBondContact O-N 3.06Å; E122-I125 PolarHBondContact O-N 2.98Å; E122-T126 WeakPolarHBondContact O-CB 3.41Å; E122-T126 PolarHBondContact O-N 3.08Å; E122-T126 PolarHBondContact O-OG1 2.98Å |
| 123 | Q | 97.6 | Very high | 97.9 | Very high | 124 Ų | 124 | 104.9 Ų | 104.9 | 58% | 0.579 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.9 | -43.5 | 175.6 | -74.1 | -179.8 | -8.6 | 0 | 0 | 112.2 | K119 F120 C121 T127 | K119-Q123 WeakPolarHBondContact O-CG 3.32Å; K119-Q123 PolarHBondContact O-N 2.97Å; K119-Q123 VanDerWaalsContact O-N 3.16Å; F120-Q123 PolarHBondContact O-N 3.47Å; C121-Q123 VanDerWaalsContact C-N 3.34Å; C121-Q123 PolarHBondContact O-N 3.37Å; Q123-T127 WeakPolarHBondContact O-CB 3.32Å; Q123-T127 PolarHBondContact O-N 3.36Å; Q123-T127 PolarHBondContact O-OG1 3.36Å |
| 124 | Y | 97.5 | Very high | 98 | Very high | 116 Ų | 116 | 100.9 Ų | 100.9 | 46% | 0.455 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65 | -47.5 | 176.6 | -86.4 | -57.6 | 0 | 0 | 0 | 112.5 | F120 C121 T126 T127 F128 | F120-Y124 AromaticContact CD1-CD2 3.95Å; F120-Y124 HydrophobicContact CD1-CD2 3.95Å; F120-Y124 AromaticContact CD1-CE2 3.59Å; F120-Y124 HydrophobicContact CD1-CE2 3.59Å; F120-Y124 HydrophobicContact CD2-CE2 4.35Å; F120-Y124 AromaticContact CE1-CD2 3.93Å; F120-Y124 HydrophobicContact CE1-CD2 3.93Å; F120-Y124 AromaticContact CE1-CE2 3.1Å; F120-Y124 HydrophobicContact CE1-CE2 3.1Å; F120-Y124 AromaticContact CE1-CZ 3.87Å; F120-Y124 AromaticContact CE2-CE2 3.87Å; F120-Y124 HydrophobicContact CE2-CE2 3.87Å; F120-Y124 HydrophobicContact CG-CD2 4.34Å; F120-Y124 HydrophobicContact CG-CE2 4.22Å; F120-Y124 HydrophobicContact CZ-CD2 4.18Å; F120-Y124 AromaticContact CZ-CE2 3.22Å; F120-Y124 HydrophobicContact CZ-CE2 3.22Å; F120-Y124 AromaticContact CZ-CZ 3.55Å; F120-Y124 VanDerWaalsContact CZ-OH 3.3Å; F120-Y124 WeakPolarHBondContact CZ-OH 3.48Å; F120-Y124 WeakPolarHBondContact O-CD2 3.4Å; F120-Y124 PolarHBondContact O-N 2.91Å; C121-Y124 PolarHBondContact O-N 3.15Å; Y124-T126 VanDerWaalsContact C-N 3.29Å; Y124-T126 PolarHBondContact O-N 3.35Å; Y124-T127 PolarHBondContact O-N 2.98Å; Y124-T127 VanDerWaalsContact O-N 3.09Å; Y124-F128 AromaticContact CD1-CE2 3.84Å; Y124-F128 HydrophobicContact CD1-CE2 3.84Å; Y124-F128 HydrophobicContact CD1-CZ 4.47Å; Y124-F128 HydrophobicContact CG-CE2 4.28Å; Y124-F128 WeakPolarHBondContact O-CD2 3.5Å; Y124-F128 PolarHBondContact O-N 3.45Å |
| 125 | I | 98.3 | Very high | 98 | Very high | 95 Ų | 95 | 97.7 Ų | 97.7 | 49% | 0.487 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -55.6 | -48.8 | 178.6 | -70.3 | 164.2 | 0 | 0 | 0 | 109.7 | C121 E122 T127 F128 Q129 | C121-I125 WeakPolarHBondContact O-CB 3.47Å; C121-I125 VanDerWaalsContact O-CG1 3.25Å; C121-I125 WeakPolarHBondContact O-CG1 3.38Å; C121-I125 PolarHBondContact O-N 3.39Å; E122-I125 PolarHBondContact O-N 2.98Å; I125-T127 VanDerWaalsContact C-N 3.31Å; I125-T127 PolarHBondContact O-N 3.03Å; I125-F128 PolarHBondContact O-N 3.42Å; I125-Q129 HydrophobicContact CG2-CG 4.41Å; I125-Q129 WeakPolarHBondContact O-CB 3.47Å; I125-Q129 VanDerWaalsContact O-CG 3.29Å; I125-Q129 WeakPolarHBondContact O-CG 3.36Å; I125-Q129 PolarHBondContact O-N 3.49Å |
| 126 | T | 98.1 | Very high | 98 | Very high | 87 Ų | 87 | 99.7 Ų | 99.7 | 53% | 0.534 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60 | -41.8 | 178 | -54.5 | 0 | 0 | 0 | 0 | 111.8 | E122 Y124 K130 | E122-T126 WeakPolarHBondContact O-CB 3.41Å; E122-T126 PolarHBondContact O-N 3.08Å; E122-T126 PolarHBondContact O-OG1 2.98Å; Y124-T126 VanDerWaalsContact C-N 3.29Å; Y124-T126 PolarHBondContact O-N 3.35Å; T126-K130 WeakPolarHBondContact O-CB 3.37Å; T126-K130 PolarHBondContact O-N 3.14Å |
| 127 | T | 98.3 | Very high | 98.1 | Very high | 89 Ų | 89 | 100.5 Ų | 100.5 | 55% | 0.546 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.8 | -43.3 | 179.4 | -58 | 0 | 0 | 0 | 0 | 111.8 | Q123 Y124 I125 K130 S131 | Q123-T127 WeakPolarHBondContact O-CB 3.32Å; Q123-T127 PolarHBondContact O-N 3.36Å; Q123-T127 PolarHBondContact O-OG1 3.36Å; Y124-T127 PolarHBondContact O-N 2.98Å; Y124-T127 VanDerWaalsContact O-N 3.09Å; I125-T127 VanDerWaalsContact C-N 3.31Å; I125-T127 PolarHBondContact O-N 3.03Å; T127-K130 PolarHBondContact O-N 2.98Å; T127-S131 PolarHBondContact O-N 3.21Å |
| 128 | F | 98.4 | Very high | 98.2 | Very high | 124 Ų | 124 | 102.1 Ų | 102.1 | 54% | 0.544 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -67.6 | -43.6 | 178.3 | -75.9 | -61.2 | 0 | 0 | 0 | 111.8 | Y124 I125 K130 S131 D132 | Y124-F128 AromaticContact CD1-CE2 3.84Å; Y124-F128 HydrophobicContact CD1-CE2 3.84Å; Y124-F128 HydrophobicContact CD1-CZ 4.47Å; Y124-F128 HydrophobicContact CG-CE2 4.28Å; Y124-F128 WeakPolarHBondContact O-CD2 3.5Å; Y124-F128 PolarHBondContact O-N 3.45Å; I125-F128 PolarHBondContact O-N 3.42Å; F128-K130 VanDerWaalsContact C-N 3.3Å; F128-K130 PolarHBondContact O-N 3.31Å; F128-S131 WeakPolarHBondContact O-CB 3.37Å; F128-S131 PolarHBondContact O-N 2.98Å; F128-S131 VanDerWaalsContact O-N 3.1Å; F128-D132 PolarHBondContact O-N 2.99Å |
| 129 | Q | 98.5 | Very high | 98.2 | Very high | 117 Ų | 117 | 102.6 Ų | 102.6 | 55% | 0.547 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -56.6 | -44.6 | 173.6 | -75 | 174.9 | -23.4 | 0 | 0 | 111.7 | I125 D132 M133 | I125-Q129 HydrophobicContact CG2-CG 4.41Å; I125-Q129 WeakPolarHBondContact O-CB 3.47Å; I125-Q129 VanDerWaalsContact O-CG 3.29Å; I125-Q129 WeakPolarHBondContact O-CG 3.36Å; I125-Q129 PolarHBondContact O-N 3.49Å; Q129-D132 PolarHBondContact O-N 3.25Å; Q129-M133 WeakPolarHBondContact O-CG 3.48Å; Q129-M133 PolarHBondContact O-N 2.96Å |
| 130 | K | 98.3 | Very high | 98.2 | Very high | 126 Ų | 126 | 102.3 Ų | 102.3 | 55% | 0.548 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.8 | -44.8 | 175.2 | -175.4 | 179.1 | 177.6 | -178.9 | 0 | 112 | T126 T127 F128 D132 M133 D134 | T126-K130 WeakPolarHBondContact O-CB 3.37Å; T126-K130 PolarHBondContact O-N 3.14Å; T127-K130 PolarHBondContact O-N 2.98Å; F128-K130 VanDerWaalsContact C-N 3.3Å; F128-K130 PolarHBondContact O-N 3.31Å; K130-D132 VanDerWaalsContact C-N 3.31Å; K130-D132 PolarHBondContact O-N 3.17Å; K130-M133 PolarHBondContact O-N 3.41Å; K130-D134 PolarHBondContact O-N 2.98Å |
| 131 | S | 98.6 | Very high | 98.3 | Very high | 60 Ų | 60 | 102.6 Ų | 102.6 | 42% | 0.42 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.5 | -41.3 | 176.8 | -173.7 | 0 | 0 | 0 | 0 | 112 | T127 F128 D134 V135 | T127-S131 PolarHBondContact O-N 3.21Å; F128-S131 WeakPolarHBondContact O-CB 3.37Å; F128-S131 PolarHBondContact O-N 2.98Å; F128-S131 VanDerWaalsContact O-N 3.1Å; S131-D134 PolarHBondContact O-N 2.91Å; S131-V135 WeakPolarHBondContact O-CG2 3.38Å; S131-V135 PolarHBondContact O-N 3.33Å |
| 132 | D | 98.6 | Very high | 98.3 | Very high | 97 Ų | 97 | 106 Ų | 106 | 52% | 0.519 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.9 | -41.9 | 178.4 | -71.2 | -20.8 | 0 | 0 | 0 | 111.5 | F128 Q129 K130 V135 Q136 | F128-D132 PolarHBondContact O-N 2.99Å; Q129-D132 PolarHBondContact O-N 3.25Å; K130-D132 VanDerWaalsContact C-N 3.31Å; K130-D132 PolarHBondContact O-N 3.17Å; D132-V135 PolarHBondContact O-N 2.84Å; D132-Q136 WeakPolarHBondContact O-CG 3.23Å; D132-Q136 PolarHBondContact O-N 3.41Å |
| 133 | M | 98.5 | Very high | 98.3 | Very high | 116 Ų | 116 | 106.3 Ų | 106.3 | 57% | 0.571 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.6 | -42.9 | 173.1 | -66.8 | -171.2 | -29.3 | 0 | 0 | 112 | Q129 K130 V135 Q136 K137 | Q129-M133 WeakPolarHBondContact O-CG 3.48Å; Q129-M133 PolarHBondContact O-N 2.96Å; K130-M133 PolarHBondContact O-N 3.41Å; M133-V135 VanDerWaalsContact C-N 3.3Å; M133-V135 PolarHBondContact O-N 3.5Å; M133-Q136 PolarHBondContact O-N 3.41Å; M133-K137 WeakPolarHBondContact O-CB 3.47Å; M133-K137 PolarHBondContact O-N 3.37Å |
| 134 | D | 98.6 | Very high | 98.3 | Very high | 87 Ų | 87 | 107 Ų | 107 | 47% | 0.465 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63 | -37.7 | 178.3 | -72.7 | -22.6 | 0 | 0 | 0 | 111.1 | K130 S131 F138 | K130-D134 PolarHBondContact O-N 2.98Å; S131-D134 PolarHBondContact O-N 2.91Å; D134-F138 WeakPolarHBondContact O-CB 2.94Å; D134-F138 PolarHBondContact O-N 2.99Å |
| 135 | V | 98.6 | Very high | 98.4 | Very high | 77 Ų | 77 | 105.3 Ų | 105.3 | 47% | 0.467 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.2 | -43 | 174.2 | 169.5 | 0 | 0 | 0 | 0 | 111.7 | S131 D132 M133 F138 N139 | S131-V135 WeakPolarHBondContact O-CG2 3.38Å; S131-V135 PolarHBondContact O-N 3.33Å; D132-V135 PolarHBondContact O-N 2.84Å; M133-V135 VanDerWaalsContact C-N 3.3Å; M133-V135 PolarHBondContact O-N 3.5Å; V135-F138 PolarHBondContact O-N 3.32Å; V135-N139 PolarHBondContact O-N 2.89Å; V135-N139 PolarHBondContact O-ND2 2.87Å |
| 136 | Q | 98.4 | Very high | 98.4 | Very high | 123 Ų | 123 | 104.7 Ų | 104.7 | 58% | 0.575 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.5 | -49.6 | 175.6 | -73.2 | 177.2 | -3.3 | 0 | 0 | 111 | D132 M133 F138 N139 E140 | D132-Q136 WeakPolarHBondContact O-CG 3.23Å; D132-Q136 PolarHBondContact O-N 3.41Å; M133-Q136 PolarHBondContact O-N 3.41Å; Q136-F138 VanDerWaalsContact C-N 3.33Å; Q136-F138 PolarHBondContact O-N 3.39Å; Q136-N139 WeakPolarHBondContact O-CB 3.44Å; Q136-N139 PolarHBondContact O-N 3.47Å; Q136-N139 VanDerWaalsContact O-N 3.08Å; Q136-E140 PolarHBondContact O-N 2.96Å |
| 137 | K | 98.6 | Very high | 98.4 | Very high | 122 Ų | 122 | 104.2 Ų | 104.2 | 53% | 0.53 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.1 | -42.8 | 177.4 | -174.2 | -179.3 | 176.3 | -173.8 | 0 | 112.2 | M133 N139 E140 E141 | M133-K137 WeakPolarHBondContact O-CB 3.47Å; M133-K137 PolarHBondContact O-N 3.37Å; K137-N139 VanDerWaalsContact C-N 3.3Å; K137-N139 PolarHBondContact O-N 3.36Å; K137-E140 PolarHBondContact O-N 3.23Å; K137-E141 VanDerWaalsContact CE-OE1 3.28Å; K137-E141 WeakPolarHBondContact CE-OE1 3.33Å; K137-E141 PolarHBondContact O-N 3.48Å |
| 138 | F | 98.5 | Very high | 98.4 | Very high | 125 Ų | 125 | 103.4 Ų | 103.4 | 55% | 0.548 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.4 | -41.1 | 175.3 | 173.2 | -97.7 | 0 | 0 | 0 | 112.1 | D134 V135 Q136 E141 K142 | D134-F138 WeakPolarHBondContact O-CB 2.94Å; D134-F138 PolarHBondContact O-N 2.99Å; V135-F138 PolarHBondContact O-N 3.32Å; Q136-F138 VanDerWaalsContact C-N 3.33Å; Q136-F138 PolarHBondContact O-N 3.39Å; F138-E141 PolarHBondContact O-N 3.07Å; F138-K142 HydrophobicContact CE1-CD 4.41Å; F138-K142 VanDerWaalsContact O-CB 3.28Å; F138-K142 WeakPolarHBondContact O-CB 3.45Å; F138-K142 PolarHBondContact O-N 2.98Å |
| 139 | N | 98.4 | Very high | 98.3 | Very high | 81 Ų | 81 | 101.1 Ų | 101.1 | 43% | 0.433 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.4 | -40 | 178.1 | -74.1 | -31 | 0 | 0 | 0 | 112.3 | V135 Q136 K137 K142 E143 | V135-N139 PolarHBondContact O-N 2.89Å; V135-N139 PolarHBondContact O-ND2 2.87Å; Q136-N139 WeakPolarHBondContact O-CB 3.44Å; Q136-N139 PolarHBondContact O-N 3.47Å; Q136-N139 VanDerWaalsContact O-N 3.08Å; K137-N139 VanDerWaalsContact C-N 3.3Å; K137-N139 PolarHBondContact O-N 3.36Å; N139-K142 WeakPolarHBondContact O-CB 3.31Å; N139-K142 PolarHBondContact O-N 3.46Å; N139-E143 PolarHBondContact O-N 3.5Å |
| 140 | E | 98.3 | Very high | 98.3 | Very high | 111 Ų | 111 | 100.4 Ų | 100.4 | 52% | 0.519 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.4 | -44.6 | 174.3 | -67.8 | 177.9 | -170.2 | 0 | 0 | 112.3 | Q136 K137 K142 E143 K144 | Q136-E140 PolarHBondContact O-N 2.96Å; K137-E140 PolarHBondContact O-N 3.23Å; E140-K142 VanDerWaalsContact C-N 3.34Å; E140-E143 PolarHBondContact O-N 2.92Å; E140-K144 WeakPolarHBondContact O-CG 3.36Å; E140-K144 PolarHBondContact O-N 2.76Å |
| 141 | E | 98.3 | Very high | 98.3 | Very high | 106 Ų | 106 | 101.7 Ų | 101.7 | 50% | 0.495 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.1 | -41.1 | 176.6 | -73.5 | 179.3 | -175.3 | 0 | 0 | 111.4 | K137 F138 K144 S145 | K137-E141 VanDerWaalsContact CE-OE1 3.28Å; K137-E141 WeakPolarHBondContact CE-OE1 3.33Å; K137-E141 PolarHBondContact O-N 3.48Å; F138-E141 PolarHBondContact O-N 3.07Å; E141-K144 PolarHBondContact O-N 2.63Å; E141-S145 WeakPolarHBondContact O-CB 3.29Å; E141-S145 PolarHBondContact O-N 2.82Å |
| 142 | K | 98.2 | Very high | 98.3 | Very high | 121 Ų | 121 | 105.5 Ų | 105.5 | 53% | 0.526 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59.8 | -46.1 | 174.6 | 179.2 | -172.8 | 172.1 | -172 | 0 | 111.4 | F138 N139 E140 S145 V146 | F138-K142 HydrophobicContact CE1-CD 4.41Å; F138-K142 VanDerWaalsContact O-CB 3.28Å; F138-K142 WeakPolarHBondContact O-CB 3.45Å; F138-K142 PolarHBondContact O-N 2.98Å; N139-K142 WeakPolarHBondContact O-CB 3.31Å; N139-K142 PolarHBondContact O-N 3.46Å; E140-K142 VanDerWaalsContact C-N 3.34Å; K142-S145 PolarHBondContact O-N 3.44Å; K142-V146 WeakPolarHBondContact O-CG2 3.46Å; K142-V146 PolarHBondContact O-N 3.19Å |
| 143 | E | 98.2 | Very high | 98.3 | Very high | 128 Ų | 128 | 106 Ų | 106 | 60% | 0.598 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.4 | -45 | 178.8 | -172.5 | 179 | 173.1 | 0 | 0 | 111.7 | N139 E140 S145 V146 N147 | N139-E143 PolarHBondContact O-N 3.5Å; E140-E143 PolarHBondContact O-N 2.92Å; E143-S145 VanDerWaalsContact C-N 3.31Å; E143-S145 PolarHBondContact O-N 3.47Å; E143-V146 PolarHBondContact O-N 3.42Å; E143-N147 PolarHBondContact O-N 2.89Å; E143-N147 PolarHBondContact O-ND2 3.25Å |
| 144 | K | 98.2 | Very high | 98.3 | Very high | 140 Ų | 140 | 105.6 Ų | 105.6 | 61% | 0.609 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -57.2 | -44.8 | 173.7 | -71.6 | 170.8 | -174.8 | 166.9 | 0 | 111.7 | E140 E141 N147 S148 | E140-K144 WeakPolarHBondContact O-CG 3.36Å; E140-K144 PolarHBondContact O-N 2.76Å; E141-K144 PolarHBondContact O-N 2.63Å; K144-N147 PolarHBondContact O-N 3.46Å; K144-S148 PolarHBondContact O-N 3.05Å |
| 145 | S | 97.9 | Very high | 98.3 | Very high | 80 Ų | 80 | 104.2 Ų | 104.2 | 56% | 0.559 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.2 | -41.4 | 178.3 | -175 | 0 | 0 | 0 | 0 | 112.5 | E141 K142 E143 S148 C149 | E141-S145 WeakPolarHBondContact O-CB 3.29Å; E141-S145 PolarHBondContact O-N 2.82Å; K142-S145 PolarHBondContact O-N 3.44Å; E143-S145 VanDerWaalsContact C-N 3.31Å; E143-S145 PolarHBondContact O-N 3.47Å; S145-S148 PolarHBondContact O-N 3.11Å; S145-C149 WeakPolarHBondContact O-CB 3.29Å; S145-C149 PolarHBondContact O-N 2.68Å |
| 146 | V | 98.4 | Very high | 98.3 | Very high | 81 Ų | 81 | 106.5 Ų | 106.5 | 49% | 0.491 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.9 | -46.1 | 176.8 | 169 | 0 | 0 | 0 | 0 | 110.5 | K142 E143 S148 C149 Q150 | K142-V146 WeakPolarHBondContact O-CG2 3.46Å; K142-V146 PolarHBondContact O-N 3.19Å; E143-V146 PolarHBondContact O-N 3.42Å; V146-S148 VanDerWaalsContact C-N 3.33Å; V146-S148 PolarHBondContact O-N 3.26Å; V146-C149 PolarHBondContact O-N 2.9Å; V146-Q150 PolarHBondContact O-N 3.45Å |
| 147 | N | 98.3 | Very high | 98.3 | Very high | 77 Ų | 77 | 107.2 Ų | 107.2 | 41% | 0.412 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -61.3 | -40.2 | 177.6 | -72.1 | -26 | 0 | 0 | 0 | 112.3 | E143 K144 Q150 K151 | E143-N147 PolarHBondContact O-N 2.89Å; E143-N147 PolarHBondContact O-ND2 3.25Å; K144-N147 PolarHBondContact O-N 3.46Å; N147-Q150 PolarHBondContact O-N 2.9Å; N147-K151 WeakPolarHBondContact O-CG 3.39Å; N147-K151 PolarHBondContact O-N 3.48Å; N147-K151 VanDerWaalsContact O-N 3.16Å |
| 148 | S | 98.2 | Very high | 98.2 | Very high | 72 Ų | 72 | 107.1 Ų | 107.1 | 50% | 0.503 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.4 | -47 | 174.9 | -167.7 | 0 | 0 | 0 | 0 | 111.8 | K144 S145 V146 Q150 K151 E152 | K144-S148 PolarHBondContact O-N 3.05Å; S145-S148 PolarHBondContact O-N 3.11Å; V146-S148 VanDerWaalsContact C-N 3.33Å; V146-S148 PolarHBondContact O-N 3.26Å; S148-Q150 VanDerWaalsContact C-N 3.3Å; S148-Q150 PolarHBondContact O-N 2.74Å; S148-K151 PolarHBondContact O-N 3.16Å; S148-E152 PolarHBondContact O-N 3.39Å |
| 149 | C | 98 | Very high | 98.2 | Very high | 77 Ų | 77 | 104.7 Ų | 104.7 | 52% | 0.52 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.7 | -40.3 | 178 | -177 | 0 | 0 | 0 | 0 | 111.8 | S145 V146 E152 Q153 | S145-C149 WeakPolarHBondContact O-CB 3.29Å; S145-C149 PolarHBondContact O-N 2.68Å; V146-C149 PolarHBondContact O-N 2.9Å; C149-E152 PolarHBondContact O-N 3.48Å; C149-Q153 VanDerWaalsContact O-CB 3.32Å; C149-Q153 WeakPolarHBondContact O-CB 3.35Å; C149-Q153 PolarHBondContact O-N 2.92Å |
| 150 | Q | 98.4 | Very high | 98.2 | Very high | 101 Ų | 101 | 107.4 Ų | 107.4 | 47% | 0.472 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -63.6 | -42.6 | 176.2 | -175.9 | 177.6 | -14.4 | 0 | 0 | 112.4 | V146 N147 S148 Q153 Q154 | V146-Q150 PolarHBondContact O-N 3.45Å; N147-Q150 PolarHBondContact O-N 2.9Å; S148-Q150 VanDerWaalsContact C-N 3.3Å; S148-Q150 PolarHBondContact O-N 2.74Å; Q150-Q153 PolarHBondContact O-N 3.4Å; Q150-Q154 WeakPolarHBondContact O-CG 3.38Å; Q150-Q154 PolarHBondContact O-N 2.99Å |
| 151 | K | 98.3 | Very high | 98.2 | Very high | 153 Ų | 153 | 105.1 Ų | 105.1 | 67% | 0.665 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.7 | -45.5 | 175.7 | -72.4 | 177.8 | -179 | -179.7 | 0 | 111.5 | N147 S148 Q153 Q154 A155 | N147-K151 WeakPolarHBondContact O-CG 3.39Å; N147-K151 PolarHBondContact O-N 3.48Å; N147-K151 VanDerWaalsContact O-N 3.16Å; S148-K151 PolarHBondContact O-N 3.16Å; K151-Q153 VanDerWaalsContact C-N 3.34Å; K151-Q153 PolarHBondContact O-N 3.08Å; K151-Q154 PolarHBondContact O-N 3.15Å; K151-A155 PolarHBondContact O-N 3.28Å |
| 152 | E | 97.9 | Very high | 98.2 | Very high | 141 Ų | 141 | 103.9 Ų | 103.9 | 66% | 0.659 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63 | -41.3 | 177.5 | -171.2 | 174.8 | -177 | 0 | 0 | 111.5 | S148 C149 Q154 A155 L156 | S148-E152 PolarHBondContact O-N 3.39Å; C149-E152 PolarHBondContact O-N 3.48Å; E152-Q154 VanDerWaalsContact C-N 3.32Å; E152-Q154 PolarHBondContact O-N 3.01Å; E152-A155 PolarHBondContact O-N 3.29Å; E152-L156 WeakPolarHBondContact O-CB 3.38Å; E152-L156 PolarHBondContact O-N 3.26Å |
| 153 | Q | 98.2 | Very high | 98.2 | Very high | 107 Ų | 107 | 104.5 Ų | 104.5 | 50% | 0.5 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -61.4 | -39.5 | 175.1 | -168.5 | -174.1 | 30.9 | 0 | 0 | 112.2 | C149 Q150 K151 K157 | C149-Q153 VanDerWaalsContact O-CB 3.32Å; C149-Q153 WeakPolarHBondContact O-CB 3.35Å; C149-Q153 PolarHBondContact O-N 2.92Å; Q150-Q153 PolarHBondContact O-N 3.4Å; K151-Q153 VanDerWaalsContact C-N 3.34Å; K151-Q153 PolarHBondContact O-N 3.08Å; Q153-K157 WeakPolarHBondContact O-CG 3.33Å; Q153-K157 PolarHBondContact O-N 3Å; Q153-K157 VanDerWaalsContact O-N 3.11Å |
| 154 | Q | 98.3 | Very high | 98.2 | Very high | 108 Ų | 108 | 102.6 Ų | 102.6 | 51% | 0.505 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.6 | -45 | 174.8 | -72.7 | 178.1 | -1.3 | 0 | 0 | 111.7 | Q150 K151 E152 L156 K157 L158 | Q150-Q154 WeakPolarHBondContact O-CG 3.38Å; Q150-Q154 PolarHBondContact O-N 2.99Å; K151-Q154 PolarHBondContact O-N 3.15Å; E152-Q154 VanDerWaalsContact C-N 3.32Å; E152-Q154 PolarHBondContact O-N 3.01Å; Q154-L156 VanDerWaalsContact C-N 3.32Å; Q154-L156 PolarHBondContact O-N 3.23Å; Q154-K157 PolarHBondContact O-N 3.47Å; Q154-L158 PolarHBondContact O-N 2.86Å |
| 155 | A | 98.3 | Very high | 98.2 | Very high | 58 Ų | 58 | 101.8 Ų | 101.8 | 48% | 0.479 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -59.9 | -41.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | K151 E152 L158 S159 | K151-A155 PolarHBondContact O-N 3.28Å; E152-A155 PolarHBondContact O-N 3.29Å; A155-L158 PolarHBondContact O-N 3.31Å; A155-S159 WeakPolarHBondContact O-CB 3.32Å; A155-S159 PolarHBondContact O-N 3.12Å |
| 156 | L | 98.3 | Very high | 98.2 | Very high | 124 Ų | 124 | 101.9 Ų | 101.9 | 65% | 0.649 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.2 | -42.8 | 176.6 | -176 | 65.6 | 0 | 0 | 0 | 112.2 | E152 Q154 S159 K160 | E152-L156 WeakPolarHBondContact O-CB 3.38Å; E152-L156 PolarHBondContact O-N 3.26Å; Q154-L156 VanDerWaalsContact C-N 3.32Å; Q154-L156 PolarHBondContact O-N 3.23Å; L156-S159 PolarHBondContact O-N 2.95Å; L156-K160 WeakPolarHBondContact O-CB 3.43Å; L156-K160 PolarHBondContact O-N 3.06Å |
| 157 | K | 98.3 | Very high | 98.2 | Very high | 138 Ų | 138 | 102.2 Ų | 102.2 | 60% | 0.6 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -61 | -44.3 | 175.5 | -75.9 | 176.2 | -178.9 | 178.2 | 0 | 111.7 | Q153 Q154 K160 C161 | Q153-K157 WeakPolarHBondContact O-CG 3.33Å; Q153-K157 PolarHBondContact O-N 3Å; Q153-K157 VanDerWaalsContact O-N 3.11Å; Q154-K157 PolarHBondContact O-N 3.47Å; K157-K160 PolarHBondContact O-N 3.5Å; K157-C161 PolarHBondContact O-N 3.25Å; K157-C161 VanDerWaalsContact O-N 3.08Å |
| 158 | L | 98.3 | Very high | 98.2 | Very high | 121 Ų | 121 | 102.8 Ų | 102.8 | 63% | 0.634 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.4 | -48.3 | 177.1 | -72.5 | 171.5 | 0 | 0 | 0 | 111.4 | Q154 A155 K160 C161 T162 | Q154-L158 PolarHBondContact O-N 2.86Å; A155-L158 PolarHBondContact O-N 3.31Å; L158-K160 VanDerWaalsContact C-N 3.31Å; L158-K160 PolarHBondContact O-N 3.43Å; L158-C161 WeakPolarHBondContact O-CB 3.49Å; L158-C161 PolarHBondContact O-N 2.79Å; L158-C161 VanDerWaalsContact O-N 3.08Å; L158-T162 PolarHBondContact O-N 3.38Å; L158-T162 PolarHBondContact O-OG1 3.48Å |
| 159 | S | 98.1 | Very high | 98.2 | Very high | 74 Ų | 74 | 102.2 Ų | 102.2 | 52% | 0.517 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -55.9 | -45 | 177.4 | 179.1 | 0 | 0 | 0 | 0 | 112.1 | A155 L156 C161 T162 Q163 | A155-S159 WeakPolarHBondContact O-CB 3.32Å; A155-S159 PolarHBondContact O-N 3.12Å; L156-S159 PolarHBondContact O-N 2.95Å; S159-C161 PolarHBondContact O-N 3.4Å; S159-T162 PolarHBondContact O-N 3.47Å; S159-Q163 WeakPolarHBondContact O-CB 3.38Å; S159-Q163 PolarHBondContact O-N 2.9Å |
| 160 | K | 98.3 | Very high | 98.2 | Very high | 138 Ų | 138 | 102.4 Ų | 102.4 | 60% | 0.6 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -62.2 | -41 | 175.9 | -172.9 | 176.6 | -178.9 | 177.5 | 0 | 112.5 | L156 K157 L158 N164 | L156-K160 WeakPolarHBondContact O-CB 3.43Å; L156-K160 PolarHBondContact O-N 3.06Å; K157-K160 PolarHBondContact O-N 3.5Å; L158-K160 VanDerWaalsContact C-N 3.31Å; L158-K160 PolarHBondContact O-N 3.43Å; K160-N164 PolarHBondContact O-N 3.33Å; K160-N164 VanDerWaalsContact O-N 3.1Å; K160-N164 PolarHBondContact O-ND2 3.09Å |
| 161 | C | 98.2 | Very high | 98.2 | Very high | 63 Ų | 63 | 102.6 Ų | 102.6 | 43% | 0.426 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62 | -48.5 | 175.8 | -172.6 | 0 | 0 | 0 | 0 | 111.2 | K157 L158 S159 Q163 N164 Q165 | K157-C161 PolarHBondContact O-N 3.25Å; K157-C161 VanDerWaalsContact O-N 3.08Å; L158-C161 WeakPolarHBondContact O-CB 3.49Å; L158-C161 PolarHBondContact O-N 2.79Å; L158-C161 VanDerWaalsContact O-N 3.08Å; S159-C161 PolarHBondContact O-N 3.4Å; C161-Q163 PolarHBondContact O-N 2.89Å; C161-N164 PolarHBondContact O-N 3.46Å; C161-Q165 WeakPolarHBondContact O-CG 3.33Å; C161-Q165 PolarHBondContact O-N 3.15Å |
| 162 | T | 98.1 | Very high | 98.2 | Very high | 79 Ų | 79 | 102 Ų | 102 | 49% | 0.485 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.6 | -45.1 | 177.9 | -57.7 | 0 | 0 | 0 | 0 | 111.7 | L158 S159 N164 Q165 T166 | L158-T162 PolarHBondContact O-N 3.38Å; L158-T162 PolarHBondContact O-OG1 3.48Å; S159-T162 PolarHBondContact O-N 3.47Å; T162-N164 VanDerWaalsContact C-N 3.33Å; T162-N164 PolarHBondContact O-N 3.1Å; T162-Q165 PolarHBondContact O-N 2.96Å; T162-T166 PolarHBondContact O-N 3.44Å; T162-T166 PolarHBondContact O-OG1 2.76Å; T162-T166 VanDerWaalsContact O-OG1 3.09Å |
| 163 | Q | 98.1 | Very high | 98.1 | Very high | 135 Ų | 135 | 101.4 Ų | 101.4 | 63% | 0.631 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -58.5 | -44.1 | 177.2 | -173.3 | -178.6 | 15 | 0 | 0 | 112 | S159 C161 T166 L167 | S159-Q163 WeakPolarHBondContact O-CB 3.38Å; S159-Q163 PolarHBondContact O-N 2.9Å; C161-Q163 PolarHBondContact O-N 2.89Å; Q163-T166 PolarHBondContact O-N 3.3Å; Q163-L167 WeakPolarHBondContact O-CB 3.44Å; Q163-L167 PolarHBondContact O-N 2.95Å |
| 164 | N | 98.2 | Very high | 98.1 | Very high | 87 Ų | 87 | 102 Ų | 102 | 47% | 0.465 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63 | -43.2 | 176.4 | -73.5 | -17.3 | 0 | 0 | 0 | 111.7 | K160 C161 T162 L167 E168 | K160-N164 PolarHBondContact O-N 3.33Å; K160-N164 VanDerWaalsContact O-N 3.1Å; K160-N164 PolarHBondContact O-ND2 3.09Å; C161-N164 PolarHBondContact O-N 3.46Å; T162-N164 VanDerWaalsContact C-N 3.33Å; T162-N164 PolarHBondContact O-N 3.1Å; N164-L167 PolarHBondContact O-N 3.43Å; N164-E168 WeakPolarHBondContact O-CG 3.39Å; N164-E168 PolarHBondContact O-N 2.9Å |
| 165 | Q | 97.9 | Very high | 98 | Very high | 124 Ų | 124 | 103.3 Ų | 103.3 | 58% | 0.579 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -62.5 | -43.5 | 176.6 | -71.6 | 174.1 | -19.8 | 0 | 0 | 112.1 | C161 T162 E168 A169 | C161-Q165 WeakPolarHBondContact O-CG 3.33Å; C161-Q165 PolarHBondContact O-N 3.15Å; T162-Q165 PolarHBondContact O-N 2.96Å; Q165-E168 PolarHBondContact O-N 3.46Å; Q165-A169 PolarHBondContact O-N 2.97Å |
| 166 | T | 98.2 | Very high | 98 | Very high | 81 Ų | 81 | 107.4 Ų | 107.4 | 50% | 0.497 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61.8 | -43.3 | 175.8 | -57.9 | 0 | 0 | 0 | 0 | 111.3 | T162 Q163 E168 A169 V170 | T162-T166 PolarHBondContact O-N 3.44Å; T162-T166 PolarHBondContact O-OG1 2.76Å; T162-T166 VanDerWaalsContact O-OG1 3.09Å; Q163-T166 PolarHBondContact O-N 3.3Å; T166-E168 PolarHBondContact O-N 2.82Å; T166-A169 PolarHBondContact O-N 3.23Å; T166-V170 WeakPolarHBondContact O-CG2 3.39Å; T166-V170 PolarHBondContact O-N 3.48Å |
| 167 | L | 98.1 | Very high | 97.9 | Very high | 88 Ų | 88 | 104.4 Ų | 104.4 | 46% | 0.461 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -59.2 | -45.4 | 176.1 | 179.6 | 65.8 | 0 | 0 | 0 | 111.7 | Q163 N164 A169 V170 K171 | Q163-L167 WeakPolarHBondContact O-CB 3.44Å; Q163-L167 PolarHBondContact O-N 2.95Å; N164-L167 PolarHBondContact O-N 3.43Å; L167-A169 VanDerWaalsContact C-N 3.35Å; L167-A169 PolarHBondContact O-N 3.37Å; L167-V170 PolarHBondContact O-N 2.96Å; L167-K171 WeakPolarHBondContact O-CG 3.41Å; L167-K171 PolarHBondContact O-N 2.91Å |
| 168 | E | 98.2 | Very high | 97.7 | Very high | 90 Ų | 90 | 101.9 Ų | 101.9 | 42% | 0.421 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.5 | -37.1 | 177 | -69.8 | -55.7 | 127.1 | 0 | 0 | 112.5 | N164 Q165 T166 K171 K172 | N164-E168 WeakPolarHBondContact O-CG 3.39Å; N164-E168 PolarHBondContact O-N 2.9Å; Q165-E168 PolarHBondContact O-N 3.46Å; T166-E168 PolarHBondContact O-N 2.82Å; E168-K171 PolarHBondContact O-N 3.14Å; E168-K171 IonicContact OE1-NZ 2.77Å; E168-K171 PolarHBondContact OE1-NZ 3.44Å; E168-K172 WeakPolarHBondContact O-CG 3.18Å; E168-K172 PolarHBondContact O-N 3.28Å; E168-K172 VanDerWaalsContact O-N 3.07Å |
| 169 | A | 98.1 | Very high | 97.6 | Very high | 59 Ų | 59 | 101.3 Ų | 101.3 | 49% | 0.488 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.6 | -42.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q165 T166 L167 K172 M173 | Q165-A169 PolarHBondContact O-N 2.97Å; T166-A169 PolarHBondContact O-N 3.23Å; L167-A169 VanDerWaalsContact C-N 3.35Å; L167-A169 PolarHBondContact O-N 3.37Å; A169-K172 PolarHBondContact O-N 2.91Å; A169-M173 PolarHBondContact O-N 2.94Å |
| 170 | V | 98.1 | Very high | 97.5 | Very high | 81 Ų | 81 | 101.4 Ų | 101.4 | 49% | 0.491 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63 | -43.6 | 175.7 | 171.5 | 0 | 0 | 0 | 0 | 111 | T166 L167 K172 M173 H174 | T166-V170 WeakPolarHBondContact O-CG2 3.39Å; T166-V170 PolarHBondContact O-N 3.48Å; L167-V170 PolarHBondContact O-N 2.96Å; V170-K172 PolarHBondContact O-N 3.35Å; V170-M173 PolarHBondContact O-N 3.42Å; V170-H174 PolarHBondContact O-N 3.32Å |
| 171 | K | 98 | Very high | 97.2 | Very high | 105 Ų | 105 | 100.1 Ų | 100.1 | 46% | 0.457 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -58.3 | -48.2 | 175.6 | -73.8 | 176.6 | -175 | 169.4 | 0 | 112.1 | L167 E168 M173 H174 E175 | L167-K171 WeakPolarHBondContact O-CG 3.41Å; L167-K171 PolarHBondContact O-N 2.91Å; E168-K171 PolarHBondContact O-N 3.14Å; E168-K171 IonicContact OE1-NZ 2.77Å; E168-K171 PolarHBondContact OE1-NZ 3.44Å; K171-M173 VanDerWaalsContact C-N 3.34Å; K171-M173 PolarHBondContact O-N 3.43Å; K171-H174 WeakPolarHBondContact O-CB 3.45Å; K171-H174 PolarHBondContact O-N 3.01Å; K171-E175 PolarHBondContact O-N 2.9Å |
| 172 | K | 97.8 | Very high | 96.9 | Very high | 141 Ų | 141 | 102.8 Ų | 102.8 | 61% | 0.613 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -61.7 | -40.1 | 177.6 | -73.1 | 178.9 | 179.6 | -178.2 | 0 | 112.7 | E168 A169 V170 K176 | E168-K172 WeakPolarHBondContact O-CG 3.18Å; E168-K172 PolarHBondContact O-N 3.28Å; E168-K172 VanDerWaalsContact O-N 3.07Å; A169-K172 PolarHBondContact O-N 2.91Å; V170-K172 PolarHBondContact O-N 3.35Å; K172-K176 WeakPolarHBondContact O-CB 3.38Å; K172-K176 PolarHBondContact O-N 3.15Å |
| 173 | M | 97.5 | Very high | 96.6 | Very high | 128 Ų | 128 | 103 Ų | 103 | 63% | 0.631 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.8 | -43.5 | 175.5 | -174.2 | -155 | -60.6 | 0 | 0 | 111.3 | A169 V170 K171 S177 | A169-M173 PolarHBondContact O-N 2.94Å; V170-M173 PolarHBondContact O-N 3.42Å; K171-M173 VanDerWaalsContact C-N 3.34Å; K171-M173 PolarHBondContact O-N 3.43Å; M173-S177 WeakPolarHBondContact O-CB 3.39Å; M173-S177 PolarHBondContact O-N 3.48Å; M173-S177 PolarHBondContact O-OG 2.98Å |
| 174 | H | 97.7 | Very high | 96.2 | Very high | 120 Ų | 120 | 101.6 Ų | 101.6 | 56% | 0.556 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.2 | -48.6 | 177.2 | 177.2 | 66.8 | 0 | 0 | 0 | 111.6 | V170 K171 K176 S177 M178 | V170-H174 PolarHBondContact O-N 3.32Å; K171-H174 WeakPolarHBondContact O-CB 3.45Å; K171-H174 PolarHBondContact O-N 3.01Å; H174-K176 PolarHBondContact O-N 2.92Å; H174-S177 WeakPolarHBondContact O-CB 3.27Å; H174-S177 PolarHBondContact O-N 2.66Å; H174-S177 VanDerWaalsContact O-N 3.14Å; H174-M178 WeakPolarHBondContact O-CG 3.46Å; H174-M178 PolarHBondContact O-N 3.12Å |
| 175 | E | 97.1 | Very high | 95.5 | Very high | 136 Ų | 136 | 100.1 Ų | 100.1 | 64% | 0.636 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -56.4 | -49.1 | 176.8 | -175 | 176 | -164.6 | 0 | 0 | 111.8 | K171 S177 M178 E179 | K171-E175 PolarHBondContact O-N 2.9Å; E175-S177 VanDerWaalsContact C-N 3.31Å; E175-S177 PolarHBondContact O-N 2.87Å; E175-M178 PolarHBondContact O-N 3.45Å; E175-E179 PolarHBondContact O-N 3.39Å |
| 176 | K | 96.8 | Very high | 94.5 | Very high | 143 Ų | 143 | 99.4 Ų | 99.4 | 62% | 0.622 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -61.2 | -37.9 | 176.2 | -173.4 | 175.2 | -177.8 | 176.6 | 0 | 112.7 | K172 H174 E179 V180 | K172-K176 WeakPolarHBondContact O-CB 3.38Å; K172-K176 PolarHBondContact O-N 3.15Å; H174-K176 PolarHBondContact O-N 2.92Å; K176-E179 PolarHBondContact O-N 3.01Å; K176-V180 WeakPolarHBondContact O-CG2 3.34Å; K176-V180 PolarHBondContact O-N 2.96Å |
| 177 | S | 96.2 | Very high | 92.8 | Very high | 61 Ų | 61 | 104.1 Ų | 104.1 | 43% | 0.427 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65.8 | -43 | 177.6 | -58.1 | 0 | 0 | 0 | 0 | 111.3 | M173 H174 E175 V180 L181 | M173-S177 WeakPolarHBondContact O-CB 3.39Å; M173-S177 PolarHBondContact O-N 3.48Å; M173-S177 PolarHBondContact O-OG 2.98Å; H174-S177 WeakPolarHBondContact O-CB 3.27Å; H174-S177 PolarHBondContact O-N 2.66Å; H174-S177 VanDerWaalsContact O-N 3.14Å; E175-S177 VanDerWaalsContact C-N 3.31Å; E175-S177 PolarHBondContact O-N 2.87Å; S177-V180 PolarHBondContact O-N 3.23Å; S177-L181 WeakPolarHBondContact O-CG 3.17Å; S177-L181 PolarHBondContact O-N 2.96Å |
| 178 | M | 95.5 | Very high | 90.5 | Very high | 85 Ų | 85 | 109.7 Ų | 109.7 | 42% | 0.419 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -62.8 | -41.3 | 175.2 | -69.1 | -60.2 | -63.9 | 0 | 0 | 111.7 | H174 E175 L181 M182 | H174-M178 WeakPolarHBondContact O-CG 3.46Å; H174-M178 PolarHBondContact O-N 3.12Å; E175-M178 PolarHBondContact O-N 3.45Å; M178-L181 PolarHBondContact O-N 3.36Å; M178-L181 HydrophobicContact SD-CD1 4.47Å; M178-M182 WeakPolarHBondContact O-CG 3.25Å; M178-M182 PolarHBondContact O-N 3.43Å |
| 179 | E | 95.3 | Very high | 90.1 | Very high | 109 Ų | 109 | 110.7 Ų | 110.7 | 51% | 0.509 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -59.8 | -46.1 | 175.1 | -172.5 | -174.7 | -179.7 | 0 | 0 | 112.2 | E175 K176 L181 M182 N183 | E175-E179 PolarHBondContact O-N 3.39Å; K176-E179 PolarHBondContact O-N 3.01Å; E179-L181 VanDerWaalsContact C-N 3.35Å; E179-L181 PolarHBondContact O-N 2.89Å; E179-M182 PolarHBondContact O-N 3.4Å; E179-N183 WeakPolarHBondContact O-CB 3.38Å; E179-N183 VanDerWaalsContact O-CG 3.29Å; E179-N183 PolarHBondContact O-N 3.39Å; E179-N183 PolarHBondContact O-ND2 3.22Å; E179-N183 VanDerWaalsContact O-ND2 3.16Å |
| 180 | V | 95 | Very high | 89.7 | Confident | 76 Ų | 76 | 113.4 Ų | 113.4 | 46% | 0.461 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -60.6 | -44 | 175.9 | 171.4 | 0 | 0 | 0 | 0 | 111.3 | K176 S177 N183 L184 | K176-V180 WeakPolarHBondContact O-CG2 3.34Å; K176-V180 PolarHBondContact O-N 2.96Å; S177-V180 PolarHBondContact O-N 3.23Å; V180-N183 PolarHBondContact O-N 2.98Å; V180-L184 HydrophobicContact CG1-CD1 4.04Å; V180-L184 WeakPolarHBondContact O-CG 3.48Å; V180-L184 PolarHBondContact O-N 2.9Å |
| 181 | L | 93.7 | Very high | 89.2 | Confident | 111 Ų | 111 | 115.2 Ų | 115.2 | 58% | 0.581 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -63.5 | -43 | 177.8 | -70.9 | 173.6 | 0 | 0 | 0 | 112.2 | S177 M178 E179 L184 G185 | S177-L181 WeakPolarHBondContact O-CG 3.17Å; S177-L181 PolarHBondContact O-N 2.96Å; M178-L181 PolarHBondContact O-N 3.36Å; M178-L181 HydrophobicContact SD-CD1 4.47Å; E179-L181 VanDerWaalsContact C-N 3.35Å; E179-L181 PolarHBondContact O-N 2.89Å; L181-L184 PolarHBondContact O-N 3.27Å; L181-G185 PolarHBondContact O-N 2.94Å; L181-G185 VanDerWaalsContact O-N 3.12Å |
| 182 | M | 92.2 | Very high | 88.7 | Confident | 120 Ų | 120 | 115.8 Ų | 115.8 | 59% | 0.591 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -62.1 | -42.8 | 175.7 | -73.2 | -173.5 | -72.1 | 0 | 0 | 111.8 | M178 E179 L184 G185 T186 | M178-M182 WeakPolarHBondContact O-CG 3.25Å; M178-M182 PolarHBondContact O-N 3.43Å; E179-M182 PolarHBondContact O-N 3.4Å; M182-L184 VanDerWaalsContact C-N 3.31Å; M182-L184 PolarHBondContact O-N 3.02Å; M182-G185 PolarHBondContact O-N 3.09Å; M182-T186 PolarHBondContact O-N 3.07Å; M182-T186 PolarHBondContact O-OG1 2.91Å |
| 183 | N | 91.6 | Very high | 88.1 | Confident | 82 Ų | 82 | 114.3 Ų | 114.3 | 44% | 0.439 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -69.1 | -24.8 | 178.5 | -73.2 | -32.7 | 0 | 0 | 0 | 114 | E179 V180 T186 | E179-N183 WeakPolarHBondContact O-CB 3.38Å; E179-N183 VanDerWaalsContact O-CG 3.29Å; E179-N183 PolarHBondContact O-N 3.39Å; E179-N183 PolarHBondContact O-ND2 3.22Å; E179-N183 VanDerWaalsContact O-ND2 3.16Å; V180-N183 PolarHBondContact O-N 2.98Å; N183-T186 PolarHBondContact O-OG1 3.17Å |
| 184 | L | 89.2 | Confident | 87.5 | Confident | 107 Ų | 107 | 113.3 Ų | 113.3 | 56% | 0.56 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -77.2 | -35.9 | 172.3 | -75.4 | 167.4 | 0 | 0 | 0 | 111.7 | V180 L181 M182 T186 K187 | V180-L184 HydrophobicContact CG1-CD1 4.04Å; V180-L184 WeakPolarHBondContact O-CG 3.48Å; V180-L184 PolarHBondContact O-N 2.9Å; L181-L184 PolarHBondContact O-N 3.27Å; M182-L184 VanDerWaalsContact C-N 3.31Å; M182-L184 PolarHBondContact O-N 3.02Å; L184-T186 VanDerWaalsContact C-N 3.3Å; L184-T186 PolarHBondContact O-N 3.1Å; L184-K187 PolarHBondContact O-N 2.96Å |
| 185 | G | 82.3 | Confident | 86.8 | Confident | 55 Ų | 55 | 112.9 Ų | 112.9 | 57% | 0.567 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -69.4 | -22.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | L181 M182 | L181-G185 PolarHBondContact O-N 2.94Å; L181-G185 VanDerWaalsContact O-N 3.12Å; M182-G185 PolarHBondContact O-N 3.09Å |
| 186 | T | 77.6 | Confident | 86 | Confident | 109 Ų | 109 | 111.1 Ų | 111.1 | 67% | 0.669 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | -7.3 | 178.6 | 52.9 | 0 | 0 | 0 | 0 | 114.3 | M182 N183 L184 | M182-T186 PolarHBondContact O-N 3.07Å; M182-T186 PolarHBondContact O-OG1 2.91Å; N183-T186 PolarHBondContact O-OG1 3.17Å; L184-T186 VanDerWaalsContact C-N 3.3Å; L184-T186 PolarHBondContact O-N 3.1Å |
| 187 | K | 62.6 | Low | 85.1 | Confident | 180 Ų | 180 | 108.4 Ų | 108.4 | 78% | 0.783 | 59% | 0.592 | S | S | * | * | trans | -98.9 | 5.4 | -178.7 | -76.8 | -176.2 | 177.7 | 179.3 | 0 | 114.6 | L184 | L184-K187 PolarHBondContact O-N 2.96Š| ||
| 188 | N | 49.7 | Very low | 84.1 | Confident | 206 Ų | 206 | 112.7 Ų | 112.7 | 100% | 1.102 | 61% | 0.607 | S | S | * | * | trans | -115.3 | 0 | 170.6 | -72.9 | -21.4 | 0 | 0 | 0 | 109.9 |
Retrieved 188 of 188 residues in 136 ms
(Link to these results)