| 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 | 44.2 | Very low | 44.4 | Very low | 242 Ų | 242 | 184.8 Ų | 184.8 | 100% | 1.192 | 87% | 0.873 | S | S | * | * | 0 | 113.2 | 0 | -75 | 174.4 | -170.4 | 0 | 0 | 109.1 | R3 | M1-R3 PolarHBondContact O-N 3.37Š| |||
| 2 | R | 45.6 | Very low | 44.9 | Very low | 252 Ų | 252 | 177.7 Ų | 177.7 | 95% | 0.951 | 84% | 0.843 | S | S | * | * | trans | -73.2 | 117.7 | 179.9 | -73.1 | 179.9 | -176.3 | 153.7 | 0.9 | 109.3 | M4 | R2-M4 PolarHBondContact O-N 3.36Š| ||
| 3 | R | 40.7 | Very low | 45 | Very low | 249 Ų | 249 | 170.7 Ų | 170.7 | 94% | 0.94 | 82% | 0.822 | S | S | * | * | trans | -76.8 | 109.5 | 168.5 | -63.4 | -174.5 | -152.6 | -173.7 | 6.6 | 107.9 | M1 A5 | M1-R3 PolarHBondContact O-N 3.37Å; R3-A5 PolarHBondContact O-N 3.4Å | ||
| 4 | M | 41.3 | Very low | 45.9 | Very low | 182 Ų | 182 | 171.3 Ų | 171.3 | 90% | 0.897 | 82% | 0.819 | S | S | * | * | trans | -80.9 | 109.6 | 164.9 | -71.6 | -123.9 | -109.7 | 0 | 0 | 108 | R2 L6 | R2-M4 PolarHBondContact O-N 3.36Å; M4-L6 PolarHBondContact O-N 3.36Å | ||
| 5 | A | 47.1 | Very low | 46.3 | Very low | 76 Ų | 76 | 171.1 Ų | 171.1 | 63% | 0.628 | 82% | 0.817 | S | S | * | * | trans | -76.7 | 107.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 108.8 | R3 K7 | R3-A5 PolarHBondContact O-N 3.4Å; A5-K7 HydrophobicContact CB-CG 4.22Å; A5-K7 PolarHBondContact O-N 3.08Å | ||
| 6 | L | 43.3 | Very low | 46.1 | Very low | 177 Ų | 177 | 162.6 Ų | 162.6 | 93% | 0.927 | 79% | 0.788 | S | S | * | * | trans | -66.1 | 81.4 | 164.2 | -81.1 | 153.7 | 0 | 0 | 0 | 108.5 | M4 | M4-L6 PolarHBondContact O-N 3.36Š| ||
| 7 | K | 46.6 | Very low | 46.3 | Very low | 180 Ų | 180 | 161.2 Ų | 161.2 | 78% | 0.783 | 77% | 0.774 | S | S | * | * | trans | -86.7 | 112.4 | 171 | -73.8 | -176.6 | 178.6 | -179.4 | 0 | 108.1 | A5 | A5-K7 HydrophobicContact CB-CG 4.22Å; A5-K7 PolarHBondContact O-N 3.08Å | ||
| 8 | K | 46 | Very low | 46.4 | Very low | 196 Ų | 196 | 160.8 Ų | 160.8 | 85% | 0.852 | 78% | 0.776 | S | S | * | * | trans | 79.9 | 75.5 | 162.1 | -49.6 | -167.6 | 179.5 | -172 | 0 | 116.1 | K10 | K8-K10 PolarHBondContact O-N 3.48Š| ||
| 9 | L | 38.8 | Very low | 46.5 | Very low | 161 Ų | 161 | 158.9 Ų | 158.9 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | trans | -69.8 | 103.3 | 147.2 | -150.6 | 81 | 0 | 0 | 0 | 106.3 | V11 | L9-V11 PolarHBondContact O-N 3.09Å; L9-V11 VanDerWaalsContact O-N 3.08Å | ||
| 10 | K | 48.6 | Very low | 46.5 | Very low | 193 Ų | 193 | 158.8 Ų | 158.8 | 84% | 0.839 | 77% | 0.771 | S | S | * | * | trans | -70 | 103.5 | 172.8 | -148.6 | 168.4 | -177.2 | 176.2 | 0 | 105.2 | K8 I12 | K8-K10 PolarHBondContact O-N 3.48Å; K10-I12 PolarHBondContact O-N 3.01Å | ||
| 11 | V | 46.8 | Very low | 46.6 | Very low | 125 Ų | 125 | 155.1 Ų | 155.1 | 76% | 0.758 | 76% | 0.755 | S | S | * | * | trans | -58.6 | 107.2 | 175.1 | 175.4 | 0 | 0 | 0 | 0 | 106.8 | L9 | L9-V11 PolarHBondContact O-N 3.09Å; L9-V11 VanDerWaalsContact O-N 3.08Å | ||
| 12 | I | 49.6 | Very low | 46.7 | Very low | 99 Ų | 99 | 149.4 Ų | 149.4 | 51% | 0.508 | 73% | 0.73 | S | S | . | * | trans | -78.6 | 121.7 | 172.4 | -59 | 170.9 | 0 | 0 | 0 | 105.9 | K10 Y17 | K10-I12 PolarHBondContact O-N 3.01Å; I12-Y17 HydrophobicContact CB-CE2 4.3Å; I12-Y17 WeakPolarHBondContact CB-OH 3.5Å; I12-Y17 WeakPolarHBondContact CD1-OH 3.46Å; I12-Y17 HydrophobicContact CG2-CE1 4.19Å; I12-Y17 HydrophobicContact CG2-CE2 3.65Å; I12-Y17 VanDerWaalsContact CG2-CZ 3.46Å; I12-Y17 WeakPolarHBondContact CG2-OH 3.36Å | ||
| 13 | P | 47.2 | Very low | 46.8 | Very low | 87 Ų | 87 | 145.4 Ų | 145.4 | 57% | 0.565 | 72% | 0.719 | S | S | * | * | trans | -58.2 | 137.6 | 178.2 | -20.2 | 31.3 | 0 | 0 | 0 | 111 | E15 G16 | P13-E15 PolarHBondContact O-N 3.5Å; P13-G16 PolarHBondContact O-N 3.31Å | ||
| 14 | K | 56.3 | Low | 47.1 | Very low | 179 Ų | 179 | 140.5 Ų | 140.5 | 78% | 0.778 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -63.4 | -24.2 | -179.8 | -72.9 | -173.4 | 173 | -173 | 0 | 112.8 | G16 | K14-G16 VanDerWaalsContact C-N 3.29Å; K14-G16 PolarHBondContact O-N 3.06Å |
| 15 | E | 52 | Low | 47.7 | Very low | 169 Ų | 169 | 138.5 Ų | 138.5 | 79% | 0.79 | 71% | 0.705 | S | S | * | * | G | 310 helix | trans | -75.6 | -5.1 | 173.3 | -83.7 | 65.3 | -146.4 | 0 | 0 | 115 | P13 | P13-E15 PolarHBondContact O-N 3.5Š|
| 16 | G | 43.5 | Very low | 47.9 | Very low | 35 Ų | 35 | 142 Ų | 142 | 36% | 0.361 | 71% | 0.708 | S | S | . | * | G | 310 helix | trans | -93.7 | -5.6 | -172.7 | 0 | 0 | 0 | 0 | 0 | 116.8 | P13 K14 L18 | P13-G16 PolarHBondContact O-N 3.31Å; K14-G16 VanDerWaalsContact C-N 3.29Å; K14-G16 PolarHBondContact O-N 3.06Å; G16-L18 PolarHBondContact O-N 3.41Å |
| 17 | Y | 50.4 | Low | 48.3 | Very low | 138 Ų | 138 | 140.3 Ų | 140.3 | 54% | 0.541 | 70% | 0.7 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.9 | -2.1 | -170.9 | -70.6 | -82.7 | 0 | 0 | 0 | 114.9 | I12 | I12-Y17 HydrophobicContact CB-CE2 4.3Å; I12-Y17 WeakPolarHBondContact CB-OH 3.5Å; I12-Y17 WeakPolarHBondContact CD1-OH 3.46Å; I12-Y17 HydrophobicContact CG2-CE1 4.19Å; I12-Y17 HydrophobicContact CG2-CE2 3.65Å; I12-Y17 VanDerWaalsContact CG2-CZ 3.46Å; I12-Y17 WeakPolarHBondContact CG2-OH 3.36Å |
| 18 | L | 47.7 | Very low | 48.4 | Very low | 155 Ų | 155 | 138.5 Ų | 138.5 | 81% | 0.812 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.6 | -4.2 | -179.9 | -80.1 | 165 | 0 | 0 | 0 | 114.6 | G16 | G16-L18 PolarHBondContact O-N 3.41Š|
| 19 | L | 47.6 | Very low | 48.6 | Very low | 125 Ų | 125 | 136.2 Ų | 136.2 | 65% | 0.654 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95 | 17.6 | -171.6 | -83.1 | 164.7 | 0 | 0 | 0 | 115.3 | ||
| 20 | L | 47.7 | Very low | 49 | Very low | 155 Ų | 155 | 135.5 Ų | 135.5 | 81% | 0.812 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.3 | 3.8 | -174.5 | -83.6 | 169.4 | 0 | 0 | 0 | 115.8 | ||
| 21 | L | 48.1 | Very low | 48.9 | Very low | 82 Ų | 82 | 135.3 Ų | 135.3 | 43% | 0.429 | 69% | 0.691 | S | S | . | * | trans | -143.2 | 27.8 | 178.1 | -67.9 | 172.2 | 0 | 0 | 0 | 114.2 | F23 N151 | L21-F23 HydrophobicContact CD2-CE2 3.94Å; L21-F23 PolarHBondContact O-N 3.3Å; L21-N151 WeakPolarHBondContact CD1-ND2 3.45Å; L21-N151 WeakPolarHBondContact CD1-OD1 3.39Å | ||
| 22 | D | 45.6 | Very low | 48.7 | Very low | 123 Ų | 123 | 135.2 Ų | 135.2 | 66% | 0.658 | 69% | 0.69 | S | S | * | * | trans | -76 | 87.1 | 156.7 | -60.9 | -23.3 | 0 | 0 | 0 | 105.7 | D24 | D22-D24 PolarHBondContact O-N 2.91Š| ||
| 23 | F | 48.2 | Very low | 48.4 | Very low | 167 Ų | 167 | 135.2 Ų | 135.2 | 73% | 0.732 | 70% | 0.699 | S | S | * | * | trans | -65.8 | 115.7 | 155.2 | -74.1 | -84.4 | 0 | 0 | 0 | 104.6 | L21 D25 | L21-F23 HydrophobicContact CD2-CE2 3.94Å; L21-F23 PolarHBondContact O-N 3.3Å; F23-D25 PolarHBondContact O-N 3.45Å | ||
| 24 | D | 47.5 | Very low | 48.3 | Very low | 147 Ų | 147 | 140.1 Ų | 140.1 | 79% | 0.786 | 71% | 0.714 | S | S | * | * | trans | -34.4 | 101.3 | 174.8 | -74.4 | -46.5 | 0 | 0 | 0 | 110.8 | D22 E26 | D22-D24 PolarHBondContact O-N 2.91Å; D24-E26 HydrophobicContact CB-CG 4.49Å; D24-E26 PolarHBondContact O-N 3.35Å | ||
| 25 | D | 52.7 | Low | 47.5 | Very low | 140 Ų | 140 | 140.3 Ų | 140.3 | 75% | 0.749 | 72% | 0.718 | S | S | * | * | trans | -74.5 | 61.7 | 152.7 | -83.7 | -24.4 | 0 | 0 | 0 | 105.6 | F23 D27 | F23-D25 PolarHBondContact O-N 3.45Å; D25-D27 PolarHBondContact O-N 3.3Å | ||
| 26 | E | 51.4 | Low | 46.8 | Very low | 150 Ų | 150 | 136.5 Ų | 136.5 | 70% | 0.701 | 72% | 0.715 | S | S | * | * | trans | -82 | 103.9 | 153.5 | -78.8 | -74 | 167.2 | 0 | 0 | 104.3 | D24 D28 | D24-E26 HydrophobicContact CB-CG 4.49Å; D24-E26 PolarHBondContact O-N 3.35Å; E26-D28 PolarHBondContact O-N 3.01Å | ||
| 27 | D | 53 | Low | 46.7 | Very low | 141 Ų | 141 | 143.6 Ų | 143.6 | 75% | 0.754 | 74% | 0.744 | S | S | * | * | trans | -55 | 74.8 | 162 | -70.5 | -53.6 | 0 | 0 | 0 | 108.9 | D25 D29 | D25-D27 PolarHBondContact O-N 3.3Å; D27-D29 PolarHBondContact O-N 2.95Å | ||
| 28 | D | 47 | Very low | 46.3 | Very low | 142 Ų | 142 | 142 Ų | 142 | 76% | 0.759 | 75% | 0.753 | S | S | * | * | trans | -69.1 | 85.9 | 156.4 | -90.3 | -22.3 | 0 | 0 | 0 | 105.5 | E26 I30 | E26-D28 PolarHBondContact O-N 3.01Å; D28-I30 PolarHBondContact O-N 3.19Å | ||
| 29 | D | 50.4 | Low | 46 | Very low | 148 Ų | 148 | 143.7 Ų | 143.7 | 79% | 0.791 | 76% | 0.757 | S | S | * | * | trans | -46.8 | 88.6 | 156.7 | -84.9 | -35.1 | 0 | 0 | 0 | 107.4 | D27 K31 | D27-D29 PolarHBondContact O-N 2.95Å; D29-K31 PolarHBondContact O-N 3.47Å | ||
| 30 | I | 48.3 | Very low | 45.7 | Very low | 146 Ų | 146 | 144.3 Ų | 144.3 | 75% | 0.749 | 77% | 0.765 | S | S | * | * | trans | -68.4 | 82.2 | 162.9 | -58 | 177.4 | 0 | 0 | 0 | 104.7 | D28 V32 | D28-I30 PolarHBondContact O-N 3.19Å; I30-V32 HydrophobicContact CG2-CG2 3.93Å; I30-V32 PolarHBondContact O-N 2.76Å | ||
| 31 | K | 45.3 | Very low | 45.6 | Very low | 189 Ų | 189 | 146.4 Ų | 146.4 | 82% | 0.822 | 77% | 0.768 | S | S | * | * | trans | -63 | 86 | 163.6 | -142 | -174.6 | -169.1 | -168.1 | 0 | 105.2 | D29 S33 | D29-K31 PolarHBondContact O-N 3.47Å; K31-S33 PolarHBondContact O-N 2.95Å | ||
| 32 | V | 43.1 | Very low | 45.5 | Very low | 122 Ų | 122 | 147.5 Ų | 147.5 | 74% | 0.739 | 78% | 0.782 | S | S | * | * | trans | -61.8 | 98.1 | 163.3 | 175.7 | 0 | 0 | 0 | 0 | 104.8 | I30 E34 | I30-V32 HydrophobicContact CG2-CG2 3.93Å; I30-V32 PolarHBondContact O-N 2.76Å; V32-E34 PolarHBondContact O-N 2.95Å | ||
| 33 | S | 42.7 | Very low | 45.3 | Very low | 100 Ų | 100 | 147.2 Ų | 147.2 | 70% | 0.699 | 79% | 0.787 | S | S | * | * | trans | -58.1 | 102 | 172.6 | 7.3 | 0 | 0 | 0 | 0 | 107.8 | K31 E35 | K31-S33 PolarHBondContact O-N 2.95Å; S33-E35 PolarHBondContact O-N 3.22Å | ||
| 34 | E | 46.4 | Very low | 44.8 | Very low | 189 Ų | 189 | 143.8 Ų | 143.8 | 88% | 0.883 | 79% | 0.79 | S | S | * | * | trans | -70.2 | 63.7 | 166.4 | -169.1 | 179.5 | 179.7 | 0 | 0 | 108.6 | V32 | V32-E34 PolarHBondContact O-N 2.95Š| ||
| 35 | E | 39.3 | Very low | 44.8 | Very low | 184 Ų | 184 | 147.1 Ų | 147.1 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | trans | -155.8 | 56.6 | -178.2 | -126.3 | 175.1 | -159 | 0 | 0 | 111.4 | S33 | S33-E35 PolarHBondContact O-N 3.22Š| ||
| 36 | A | 38 | Very low | 44.2 | Very low | 88 Ų | 88 | 147 Ų | 147 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | -159.5 | 57.8 | 165.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 37 | L | 39.9 | Very low | 44.1 | Very low | 185 Ų | 185 | 147.9 Ų | 147.9 | 97% | 0.969 | 80% | 0.799 | S | S | * | * | trans | -118.5 | 59.1 | 165.4 | -69.4 | 179.8 | 0 | 0 | 0 | 109.9 | ||||
| 38 | S | 42.9 | Very low | 43.4 | Very low | 103 Ų | 103 | 147.9 Ų | 147.9 | 72% | 0.72 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -144.2 | 127.3 | 160.9 | 59.7 | 0 | 0 | 0 | 0 | 108.6 | ||
| 39 | E | 40.6 | Very low | 43.3 | Very low | 192 Ų | 192 | 150.2 Ų | 150.2 | 90% | 0.897 | 81% | 0.805 | S | S | * | * | trans | 80.8 | 70 | 178.2 | -60.1 | -175.2 | 139.9 | 0 | 0 | 117.3 | ||||
| 40 | V | 42 | Very low | 43 | Very low | 138 Ų | 138 | 150.3 Ų | 150.3 | 84% | 0.836 | 81% | 0.806 | S | S | * | * | trans | -109.9 | 95.7 | 146.7 | 177.2 | 0 | 0 | 0 | 0 | 108.6 | S42 | V40-S42 PolarHBondContact O-N 3.37Š| ||
| 41 | K | 45 | Very low | 42.8 | Very low | 198 Ų | 198 | 151.1 Ų | 151.1 | 86% | 0.861 | 81% | 0.81 | S | S | * | * | trans | -78.3 | 103.2 | 160.8 | -170.7 | 173.7 | -173.9 | 176.5 | 0 | 106.5 | P43 | K41-P43 WeakPolarHBondContact O-CD 3.39Š| ||
| 42 | S | 47.2 | Very low | 42.5 | Very low | 105 Ų | 105 | 147.2 Ų | 147.2 | 73% | 0.734 | 81% | 0.806 | S | S | * | * | trans | -62 | 139.4 | 176.7 | -42.7 | 0 | 0 | 0 | 0 | 110.9 | V40 | V40-S42 PolarHBondContact O-N 3.37Š| ||
| 43 | P | 40.2 | Very low | 42.5 | Very low | 117 Ų | 117 | 147.4 Ų | 147.4 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | trans | -128.4 | 150.8 | 133 | 29.7 | -14.6 | 0 | 0 | 0 | 111.9 | K41 | K41-P43 WeakPolarHBondContact O-CD 3.39Š| ||
| 44 | A | 37.7 | Very low | 42.1 | Very low | 96 Ų | 96 | 151.7 Ų | 151.7 | 79% | 0.793 | 82% | 0.819 | S | S | * | * | trans | -42.8 | 138.7 | -172.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 45 | F | 47.2 | Very low | 41.7 | Very low | 216 Ų | 216 | 146.8 Ų | 146.8 | 95% | 0.947 | 81% | 0.81 | S | S | * | * | trans | -122.2 | 127.3 | 152.3 | -98.9 | -88.9 | 0 | 0 | 0 | 109.4 | ||||
| 46 | D | 40.8 | Very low | 41.8 | Very low | 137 Ų | 137 | 147 Ų | 147 | 73% | 0.733 | 81% | 0.811 | S | S | * | * | trans | -117.8 | 146.9 | -178.5 | -146.4 | 0.4 | 0 | 0 | 0 | 106.2 | ||||
| 47 | K | 49.3 | Very low | 41.9 | Very low | 170 Ų | 170 | 147.1 Ų | 147.1 | 74% | 0.739 | 81% | 0.812 | S | S | * | * | trans | 82.9 | 101.6 | 169.4 | -52.2 | 179.6 | -174.8 | 175.3 | 0 | 115.8 | ||||
| 48 | N | 38.8 | Very low | 42.2 | Very low | 141 Ų | 141 | 146.2 Ų | 146.2 | 75% | 0.754 | 81% | 0.809 | S | S | * | * | 81.2 | 114.9 | 87.9 | 84.5 | -9.1 | 0 | 0 | 0 | 113.6 | |||||
| 49 | E | 43.8 | Very low | 42.4 | Very low | 191 Ų | 191 | 150 Ų | 150 | 89% | 0.893 | 82% | 0.815 | S | S | * | * | trans | -176.8 | 114.7 | 131.7 | -106.4 | 177.4 | 170.7 | 0 | 0 | 110.3 | ||||
| 50 | N | 45 | Very low | 42.6 | Very low | 150 Ų | 150 | 147.2 Ų | 147.2 | 80% | 0.802 | 81% | 0.806 | S | S | * | * | trans | -22.8 | 128.3 | 157 | -150.9 | -0.2 | 0 | 0 | 0 | 115.6 | ||||
| 51 | I | 43.2 | Very low | 43 | Very low | 163 Ų | 163 | 147.9 Ų | 147.9 | 84% | 0.836 | 80% | 0.802 | S | S | * | * | trans | -166.1 | 114.8 | 136 | -82.2 | 134 | 0 | 0 | 0 | 106.8 | ||||
| 52 | S | 39.9 | Very low | 42.6 | Very low | 106 Ų | 106 | 141.7 Ų | 141.7 | 74% | 0.741 | 80% | 0.795 | S | S | * | * | trans | -97.4 | 159.1 | 153 | -68.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 53 | P | 41.8 | Very low | 42.6 | Very low | 126 Ų | 126 | 144.3 Ų | 144.3 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | -140.7 | 161.1 | 96.2 | 26.3 | -6.2 | 0 | 0 | 0 | 115.6 | |||||
| 54 | Q | 34.7 | Very low | 42.8 | Very low | 191 Ų | 191 | 147.2 Ų | 147.2 | 89% | 0.893 | 80% | 0.804 | S | S | * | * | trans | -64.6 | 171.1 | -177.5 | -70.4 | 169.6 | -95.2 | 0 | 0 | 116.7 | ||||
| 55 | A | 38 | Very low | 43 | Very low | 85 Ų | 85 | 149 Ų | 149 | 70% | 0.702 | 81% | 0.805 | S | S | * | * | trans | 104.6 | 125.4 | 159.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 56 | E | 42.6 | Very low | 42.5 | Very low | 188 Ų | 188 | 146.4 Ų | 146.4 | 88% | 0.879 | 80% | 0.801 | S | S | * | * | cis | -143.7 | 157.4 | 30.3 | -58.8 | -109.8 | 129.7 | 0 | 0 | 110.6 | ||||
| 57 | A | 39.6 | Very low | 42.6 | Very low | 91 Ų | 91 | 144.7 Ų | 144.7 | 75% | 0.752 | 80% | 0.799 | S | S | * | * | trans | -64.8 | 138.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 58 | D | 46 | Very low | 42.3 | Very low | 166 Ų | 166 | 145.7 Ų | 145.7 | 89% | 0.888 | 81% | 0.809 | S | S | * | * | trans | -152.6 | 141.2 | 141.8 | -96.2 | -26.1 | 0 | 0 | 0 | 109.3 | ||||
| 59 | E | 47.1 | Very low | 42.2 | Very low | 183 Ų | 183 | 147.8 Ų | 147.8 | 86% | 0.855 | 82% | 0.819 | S | S | * | * | trans | -74.7 | 172.7 | -160.7 | -54.6 | -178.7 | 153.8 | 0 | 0 | 113.1 | ||||
| 60 | D | 44.9 | Very low | 42.1 | Very low | 133 Ų | 133 | 144.3 Ų | 144.3 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | trans | 87.3 | 86.2 | 149.4 | -152.7 | 34.7 | 0 | 0 | 0 | 117.7 | ||||
| 61 | M | 50 | Low | 41.9 | Very low | 152 Ų | 152 | 145.5 Ų | 145.5 | 75% | 0.749 | 81% | 0.805 | S | S | * | * | 168.7 | 93.6 | 108.8 | -86.2 | -62.2 | -165.9 | 0 | 0 | 108.4 | |||||
| 62 | G | 37.3 | Very low | 42 | Very low | 69 Ų | 69 | 143.4 Ų | 143.4 | 71% | 0.711 | 80% | 0.804 | S | S | * | * | trans | -70.7 | 122.8 | 156 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 63 | D | 46.5 | Very low | 41.9 | Very low | 159 Ų | 159 | 145.6 Ų | 145.6 | 85% | 0.85 | 80% | 0.803 | S | S | * | * | trans | -164.2 | 135.9 | 146.7 | -94 | -26 | 0 | 0 | 0 | 108.6 | ||||
| 64 | E | 45.7 | Very low | 41.8 | Very low | 179 Ų | 179 | 145.6 Ų | 145.6 | 84% | 0.836 | 80% | 0.8 | S | S | * | * | trans | 83.9 | 55.1 | 159.4 | -135.8 | 168.7 | -164.1 | 0 | 0 | 118.5 | ||||
| 65 | V | 41.4 | Very low | 42.2 | Very low | 134 Ų | 134 | 142.2 Ų | 142.2 | 81% | 0.812 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -111 | 143.6 | 136.4 | -66.9 | 0 | 0 | 0 | 0 | 107.4 | ||
| 66 | D | 36.2 | Very low | 42.6 | Very low | 161 Ų | 161 | 144.8 Ų | 144.8 | 86% | 0.861 | 79% | 0.79 | S | S | * | * | S | Bend | trans | 86.3 | 82.3 | -177.8 | -65.4 | -20.6 | 0 | 0 | 0 | 117.4 | ||
| 67 | S | 43.5 | Very low | 42.8 | Very low | 100 Ų | 100 | 142 Ų | 142 | 70% | 0.699 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -170.3 | 40.5 | 144 | 58.4 | 0 | 0 | 0 | 0 | 116.1 | ||
| 68 | M | 41.5 | Very low | 42.7 | Very low | 191 Ų | 191 | 142 Ų | 142 | 94% | 0.941 | 79% | 0.788 | S | S | * | * | trans | -142 | 21.5 | 169.3 | -83.5 | -157.6 | 116.6 | 0 | 0 | 116.7 | D70 | M68-D70 PolarHBondContact O-N 2.94Š| ||
| 69 | L | 38.7 | Very low | 42.7 | Very low | 185 Ų | 185 | 142.5 Ų | 142.5 | 97% | 0.969 | 79% | 0.789 | S | S | * | * | trans | -94.7 | 58.1 | 162.8 | -132.7 | 146.5 | 0 | 0 | 0 | 109.4 | ||||
| 70 | D | 40.8 | Very low | 42.4 | Very low | 119 Ų | 119 | 137 Ų | 137 | 64% | 0.636 | 78% | 0.782 | S | S | * | * | trans | -89.8 | 104.9 | 174 | -160.9 | 31.9 | 0 | 0 | 0 | 109.2 | M68 | M68-D70 PolarHBondContact O-N 2.94Š| ||
| 71 | K | 40 | Very low | 42.4 | Very low | 175 Ų | 175 | 140.9 Ų | 140.9 | 76% | 0.761 | 79% | 0.792 | S | S | * | * | trans | 45.1 | 88.8 | 141.9 | -58.2 | 175.2 | -160.3 | 119.7 | 0 | 116.9 | ||||
| 72 | S | 45.1 | Very low | 42.1 | Very low | 118 Ų | 118 | 141.3 Ų | 141.3 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | trans | -104 | 102.3 | 135.5 | 55.9 | 0 | 0 | 0 | 0 | 108.6 | V74 | S72-V74 PolarHBondContact O-N 3.36Š| ||
| 73 | E | 38.6 | Very low | 42.5 | Very low | 153 Ų | 153 | 146.4 Ų | 146.4 | 72% | 0.715 | 80% | 0.803 | S | S | * | * | trans | -56 | 118.7 | 178.5 | -157.5 | 168.7 | -146.3 | 0 | 0 | 110.6 | N75 | E73-N75 VanDerWaalsContact C-N 3.3Å; E73-N75 PolarHBondContact O-N 3.22Å; E73-N75 PolarHBondContact OE2-ND2 3.23Å | ||
| 74 | V | 39.2 | Very low | 42.3 | Very low | 125 Ų | 125 | 145.7 Ų | 145.7 | 76% | 0.758 | 80% | 0.799 | S | S | * | * | trans | -72.2 | 88.2 | 166.5 | 176.9 | 0 | 0 | 0 | 0 | 107.3 | S72 N76 | S72-V74 PolarHBondContact O-N 3.36Å; V74-N76 PolarHBondContact O-N 3.01Å | ||
| 75 | N | 44.5 | Very low | 42.3 | Very low | 120 Ų | 120 | 144.4 Ų | 144.4 | 64% | 0.642 | 80% | 0.796 | S | S | * | * | trans | -85.2 | 86 | 168.4 | -83.1 | -39.9 | 0 | 0 | 0 | 109.5 | E73 | E73-N75 VanDerWaalsContact C-N 3.3Å; E73-N75 PolarHBondContact O-N 3.22Å; E73-N75 PolarHBondContact OE2-ND2 3.23Å | ||
| 76 | N | 44.7 | Very low | 42.3 | Very low | 140 Ų | 140 | 143.4 Ų | 143.4 | 75% | 0.749 | 80% | 0.795 | S | S | * | * | trans | -102.7 | 104.1 | 162.4 | -85.4 | -25.8 | 0 | 0 | 0 | 108.5 | V74 A78 | V74-N76 PolarHBondContact O-N 3.01Å; N76-A78 PolarHBondContact O-N 3.49Å; N76-A78 VanDerWaalsContact O-N 3.14Å | ||
| 77 | P | 47.9 | Very low | 42.9 | Very low | 129 Ų | 129 | 140.7 Ų | 140.7 | 84% | 0.838 | 79% | 0.786 | S | S | * | * | trans | -79.4 | 99.1 | 173.2 | 29.5 | -28 | 0 | 0 | 0 | 109.5 | ||||
| 78 | A | 38.1 | Very low | 42.8 | Very low | 90 Ų | 90 | 143.3 Ų | 143.3 | 74% | 0.744 | 79% | 0.787 | S | S | * | * | trans | -89.4 | 104.8 | 159.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | N76 | N76-A78 PolarHBondContact O-N 3.49Å; N76-A78 VanDerWaalsContact O-N 3.14Å | ||
| 79 | I | 45.4 | Very low | 42.7 | Very low | 177 Ų | 177 | 140.9 Ų | 140.9 | 91% | 0.908 | 78% | 0.783 | S | S | * | * | trans | 173 | 131.6 | 162.8 | -94.6 | 147.7 | 0 | 0 | 0 | 105 | ||||
| 80 | G | 40.8 | Very low | 43.2 | Very low | 68 Ų | 68 | 140.4 Ų | 140.4 | 70% | 0.701 | 77% | 0.773 | S | S | * | * | cis | -161.9 | 164.1 | 4.7 | 0 | 0 | 0 | 0 | 0 | 108 | D82 | G80-D82 PolarHBondContact O-N 3.44Š| ||
| 81 | K | 44.2 | Very low | 43.5 | Very low | 215 Ų | 215 | 137.7 Ų | 137.7 | 94% | 0.935 | 77% | 0.774 | S | S | * | * | trans | -61.9 | 122.3 | 175.2 | -61 | 171.6 | 178.4 | 178.2 | 0 | 109.2 | ||||
| 82 | D | 43.4 | Very low | 44.3 | Very low | 160 Ų | 160 | 135.6 Ų | 135.6 | 86% | 0.856 | 77% | 0.77 | S | S | * | * | trans | -150.1 | 146.1 | 143.7 | -140.3 | -14.4 | 0 | 0 | 0 | 110.5 | G80 | G80-D82 PolarHBondContact O-N 3.44Š| ||
| 83 | E | 45.4 | Very low | 44.8 | Very low | 177 Ų | 177 | 138.5 Ų | 138.5 | 83% | 0.827 | 77% | 0.771 | S | S | * | * | trans | -81 | 146.7 | -159.3 | -61.7 | 176.8 | 154.8 | 0 | 0 | 113 | ||||
| 84 | N | 42.7 | Very low | 46.1 | Very low | 143 Ų | 143 | 137.3 Ų | 137.3 | 77% | 0.765 | 77% | 0.769 | S | S | * | * | trans | 69 | 101 | 141.3 | -149.5 | -11.8 | 0 | 0 | 0 | 117.5 | ||||
| 85 | I | 46.8 | Very low | 47.5 | Very low | 153 Ų | 153 | 137.2 Ų | 137.2 | 79% | 0.785 | 76% | 0.762 | S | S | * | * | -165.1 | 111.5 | 123.4 | -82.5 | 136.5 | 0 | 0 | 0 | 106.4 | P87 | I85-P87 HydrophobicContact CG2-CG 4.41Š| |||
| 86 | S | 40.1 | Very low | 49.1 | Very low | 113 Ų | 113 | 133.8 Ų | 133.8 | 79% | 0.79 | 76% | 0.755 | S | S | * | * | trans | -82.2 | 132.2 | 163.6 | -179.8 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 87 | P | 48.5 | Very low | 50.8 | Low | 103 Ų | 103 | 134 Ų | 134 | 67% | 0.669 | 75% | 0.752 | S | S | * | * | trans | -129.2 | 115 | 146.3 | 24.9 | -6.4 | 0 | 0 | 0 | 111.2 | I85 | I85-P87 HydrophobicContact CG2-CG 4.41Š| ||
| 88 | Q | 42.5 | Very low | 52.5 | Low | 155 Ų | 155 | 132.3 Ų | 132.3 | 72% | 0.724 | 73% | 0.732 | S | S | * | * | trans | 59.7 | 100.1 | 139.1 | -64.6 | -173 | -5.9 | 0 | 0 | 118 | K90 | Q88-K90 PolarHBondContact O-N 3.46Š| ||
| 89 | V | 40.3 | Very low | 54.8 | Low | 141 Ų | 141 | 131.9 Ų | 131.9 | 86% | 0.855 | 72% | 0.72 | S | S | * | * | trans | -41.7 | 102.9 | 150.1 | 176.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 90 | K | 49.1 | Very low | 56.8 | Low | 175 Ų | 175 | 124.7 Ų | 124.7 | 76% | 0.761 | 69% | 0.69 | S | S | * | * | trans | -125.8 | 98.3 | 165.1 | -89.5 | -173.5 | 176.1 | 179.6 | 0 | 107.8 | Q88 | Q88-K90 PolarHBondContact O-N 3.46Š| ||
| 91 | G | 46.8 | Very low | 59.1 | Low | 62 Ų | 62 | 123.4 Ų | 123.4 | 64% | 0.639 | 67% | 0.67 | S | S | * | * | trans | 47.2 | 89.4 | 157.3 | 0 | 0 | 0 | 0 | 0 | 116.9 | E93 | G91-E93 PolarHBondContact O-N 3.03Š| ||
| 92 | D | 55.2 | Low | 61.3 | Low | 130 Ų | 130 | 118 Ų | 118 | 70% | 0.695 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.6 | 24.9 | 178.8 | -63.3 | -38.6 | 0 | 0 | 0 | 115.7 | ||
| 93 | E | 57.3 | Low | 63.6 | Low | 179 Ų | 179 | 115.9 Ų | 115.9 | 84% | 0.836 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -80.5 | -32.6 | -179.1 | -69.8 | -177.2 | 177.7 | 0 | 0 | 112.8 | G91 | G91-E93 PolarHBondContact O-N 3.03Å |
| 94 | D | 64.6 | Low | 65.9 | Low | 128 Ų | 128 | 113 Ų | 113 | 68% | 0.684 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -76.5 | -38 | -177.9 | -164.5 | 23 | 0 | 0 | 0 | 112.4 | G96 H97 E98 | D94-G96 PolarHBondContact O-N 2.62Å; D94-H97 PolarHBondContact O-N 2.97Å; D94-E98 PolarHBondContact O-N 3.05Å; D94-E98 VanDerWaalsContact O-N 3.11Å |
| 95 | M | 70 | Confident | 68.3 | Low | 124 Ų | 124 | 112.6 Ų | 112.6 | 61% | 0.611 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -60.4 | -35.7 | 174.8 | -70 | -69.1 | -172.5 | 0 | 0 | 111.9 | E98 V99 | M95-E98 PolarHBondContact O-N 3.37Å; M95-V99 WeakPolarHBondContact O-CB 3.43Å; M95-V99 VanDerWaalsContact O-CG2 3.25Å; M95-V99 WeakPolarHBondContact O-CG2 3.35Å; M95-V99 PolarHBondContact O-N 2.92Å |
| 96 | G | 77.2 | Confident | 70.5 | Confident | 48 Ų | 48 | 108.1 Ų | 108.1 | 50% | 0.495 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -65.4 | -39.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.9 | D94 G100 | D94-G96 PolarHBondContact O-N 2.62Å; G96-G100 PolarHBondContact O-N 3.01Å |
| 97 | H | 81.3 | Confident | 73.1 | Confident | 144 Ų | 144 | 104.4 Ų | 104.4 | 67% | 0.667 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -70.2 | -41 | 177.4 | -176.1 | -91.2 | 0 | 0 | 0 | 111.8 | D94 G100 S101 | D94-H97 PolarHBondContact O-N 2.97Å; H97-G100 PolarHBondContact O-N 3.13Å; H97-S101 WeakPolarHBondContact O-CB 3.48Å; H97-S101 PolarHBondContact O-N 2.97Å |
| 98 | E | 83.5 | Confident | 75.4 | Confident | 93 Ų | 93 | 104.1 Ų | 104.1 | 44% | 0.435 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -61.2 | -51.2 | 175.1 | -177.4 | 173.3 | -172.1 | 0 | 0 | 111.6 | D94 M95 G100 S101 M102 | D94-E98 PolarHBondContact O-N 3.05Å; D94-E98 VanDerWaalsContact O-N 3.11Å; M95-E98 PolarHBondContact O-N 3.37Å; E98-G100 VanDerWaalsContact C-N 3.31Å; E98-G100 PolarHBondContact O-N 3.47Å; E98-S101 PolarHBondContact O-N 3.35Å; E98-S101 VanDerWaalsContact O-N 3.14Å; E98-S101 PolarHBondContact O-OG 3.4Å; E98-M102 HydrophobicContact CG-CE 3.64Å; E98-M102 HydrophobicContact CG-SD 4.39Å; E98-M102 WeakPolarHBondContact O-CG 3.49Å; E98-M102 PolarHBondContact O-N 2.93Å; E98-M102 WeakPolarHBondContact OE1-CE 3.39Å |
| 99 | V | 85.8 | Confident | 77.9 | Confident | 81 Ų | 81 | 100.9 Ų | 100.9 | 49% | 0.491 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -59.8 | -42.3 | 177.7 | 172.6 | 0 | 0 | 0 | 0 | 111 | M95 S101 M102 L103 | M95-V99 WeakPolarHBondContact O-CB 3.43Å; M95-V99 VanDerWaalsContact O-CG2 3.25Å; M95-V99 WeakPolarHBondContact O-CG2 3.35Å; M95-V99 PolarHBondContact O-N 2.92Å; V99-S101 PolarHBondContact O-N 2.97Å; V99-M102 PolarHBondContact O-N 3.19Å; V99-L103 HydrophobicContact CG1-CD1 4.04Å; V99-L103 HydrophobicContact CG1-CG 4.37Å; V99-L103 VanDerWaalsContact O-CG 3.31Å; V99-L103 WeakPolarHBondContact O-CG 3.37Å; V99-L103 PolarHBondContact O-N 3.4Å |
| 100 | G | 87.3 | Confident | 80.6 | Confident | 27 Ų | 27 | 98.7 Ų | 98.7 | 28% | 0.278 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -57 | -48.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | G96 H97 E98 M102 L103 D104 | G96-G100 PolarHBondContact O-N 3.01Å; H97-G100 PolarHBondContact O-N 3.13Å; E98-G100 VanDerWaalsContact C-N 3.31Å; E98-G100 PolarHBondContact O-N 3.47Å; G100-M102 VanDerWaalsContact C-N 3.31Å; G100-M102 PolarHBondContact O-N 3.27Å; G100-L103 PolarHBondContact O-N 2.99Å; G100-D104 PolarHBondContact O-N 3.01Å |
| 101 | S | 88.2 | Confident | 82.9 | Confident | 40 Ų | 40 | 97.6 Ų | 97.6 | 28% | 0.28 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64 | -33.3 | 178.5 | 81.5 | 0 | 0 | 0 | 0 | 113.5 | H97 E98 V99 K105 | H97-S101 WeakPolarHBondContact O-CB 3.48Å; H97-S101 PolarHBondContact O-N 2.97Å; E98-S101 PolarHBondContact O-N 3.35Å; E98-S101 VanDerWaalsContact O-N 3.14Å; E98-S101 PolarHBondContact O-OG 3.4Å; V99-S101 PolarHBondContact O-N 2.97Å; S101-K105 WeakPolarHBondContact O-CD 3.45Å; S101-K105 VanDerWaalsContact O-CG 3.26Å; S101-K105 WeakPolarHBondContact O-CG 3.33Å; S101-K105 PolarHBondContact O-N 3.35Å |
| 102 | M | 90.5 | Very high | 85.3 | Confident | 103 Ų | 103 | 99.8 Ų | 99.8 | 51% | 0.507 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -71.2 | -39.3 | 175 | -70.6 | -178.2 | -179.3 | 0 | 0 | 111.5 | E98 V99 G100 S106 | E98-M102 HydrophobicContact CG-CE 3.64Å; E98-M102 HydrophobicContact CG-SD 4.39Å; E98-M102 WeakPolarHBondContact O-CG 3.49Å; E98-M102 PolarHBondContact O-N 2.93Å; E98-M102 WeakPolarHBondContact OE1-CE 3.39Å; V99-M102 PolarHBondContact O-N 3.19Å; G100-M102 VanDerWaalsContact C-N 3.31Å; G100-M102 PolarHBondContact O-N 3.27Å; M102-S106 WeakPolarHBondContact O-CB 3.41Å; M102-S106 PolarHBondContact O-N 3.39Å |
| 103 | L | 93.6 | Very high | 87.3 | Confident | 115 Ų | 115 | 97.9 Ų | 97.9 | 60% | 0.602 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -66.2 | -41.1 | 175.5 | -72 | 173.7 | 0 | 0 | 0 | 111.8 | V99 G100 S106 G107 | V99-L103 HydrophobicContact CG1-CD1 4.04Å; V99-L103 HydrophobicContact CG1-CG 4.37Å; V99-L103 VanDerWaalsContact O-CG 3.31Å; V99-L103 WeakPolarHBondContact O-CG 3.37Å; V99-L103 PolarHBondContact O-N 3.4Å; G100-L103 PolarHBondContact O-N 2.99Å; L103-S106 WeakPolarHBondContact O-CB 3.21Å; L103-S106 PolarHBondContact O-N 3.11Å; L103-G107 PolarHBondContact O-N 3.19Å |
| 104 | D | 92.2 | Very high | 89.2 | Confident | 117 Ų | 117 | 94.1 Ų | 94.1 | 63% | 0.626 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62 | -46.2 | 176.1 | -73.7 | -17.7 | 0 | 0 | 0 | 111.3 | G100 S106 G107 D108 | G100-D104 PolarHBondContact O-N 3.01Å; D104-S106 VanDerWaalsContact C-N 3.35Å; D104-S106 PolarHBondContact O-N 3.28Å; D104-G107 PolarHBondContact O-N 3.44Å; D104-D108 PolarHBondContact O-N 3.3Å |
| 105 | K | 93.9 | Very high | 90.8 | Very high | 133 Ų | 133 | 92.6 Ų | 92.6 | 58% | 0.578 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -59.5 | -44.1 | 174.4 | -72.3 | 168.5 | -175.5 | 170.2 | 0 | 112.1 | S101 D108 D109 | S101-K105 WeakPolarHBondContact O-CD 3.45Å; S101-K105 VanDerWaalsContact O-CG 3.26Å; S101-K105 WeakPolarHBondContact O-CG 3.33Å; S101-K105 PolarHBondContact O-N 3.35Å; K105-D108 PolarHBondContact O-N 3.31Å; K105-D109 PolarHBondContact O-N 2.75Å |
| 106 | S | 93.1 | Very high | 92.1 | Very high | 59 Ų | 59 | 92.2 Ų | 92.2 | 41% | 0.413 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.4 | -43.5 | 175.4 | -179.2 | 0 | 0 | 0 | 0 | 111.5 | M102 L103 D104 D108 D109 I110 | M102-S106 WeakPolarHBondContact O-CB 3.41Å; M102-S106 PolarHBondContact O-N 3.39Å; L103-S106 WeakPolarHBondContact O-CB 3.21Å; L103-S106 PolarHBondContact O-N 3.11Å; D104-S106 VanDerWaalsContact C-N 3.35Å; D104-S106 PolarHBondContact O-N 3.28Å; S106-D108 PolarHBondContact O-N 2.91Å; S106-D109 PolarHBondContact O-N 3.5Å; S106-I110 WeakPolarHBondContact O-CB 3.42Å; S106-I110 WeakPolarHBondContact O-CD1 3.46Å; S106-I110 WeakPolarHBondContact O-CG1 3.47Å; S106-I110 PolarHBondContact O-N 2.94Å |
| 107 | G | 94.8 | Very high | 93.1 | Very high | 36 Ų | 36 | 95.7 Ų | 95.7 | 37% | 0.371 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.6 | -44.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L103 D104 I110 Y111 | L103-G107 PolarHBondContact O-N 3.19Å; D104-G107 PolarHBondContact O-N 3.44Å; G107-I110 PolarHBondContact O-N 3.02Å; G107-Y111 WeakPolarHBondContact O-CB 3.5Å; G107-Y111 PolarHBondContact O-N 3.42Å |
| 108 | D | 95.5 | Very high | 93.9 | Very high | 96 Ų | 96 | 96.6 Ų | 96.6 | 51% | 0.513 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.9 | -43.1 | 175.5 | -84.6 | -10.2 | 0 | 0 | 0 | 112.3 | D104 K105 S106 Y111 K112 | D104-D108 PolarHBondContact O-N 3.3Å; K105-D108 PolarHBondContact O-N 3.31Å; S106-D108 PolarHBondContact O-N 2.91Å; D108-Y111 PolarHBondContact O-N 3.5Å; D108-K112 VanDerWaalsContact O-CG 3.27Å; D108-K112 WeakPolarHBondContact O-CG 3.44Å; D108-K112 PolarHBondContact O-N 3.07Å |
| 109 | D | 96 | Very high | 94.7 | Very high | 87 Ų | 87 | 99 Ų | 99 | 47% | 0.465 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -71.4 | -36.2 | -179.6 | -71 | -16.3 | 0 | 0 | 0 | 112 | K105 S106 K112 T113 | K105-D109 PolarHBondContact O-N 2.75Å; S106-D109 PolarHBondContact O-N 3.5Å; D109-K112 IonicContact OD1-NZ 3.03Å; D109-K112 PolarHBondContact OD1-NZ 3.01Å; D109-T113 VanDerWaalsContact O-CB 3.3Å; D109-T113 WeakPolarHBondContact O-CB 3.44Å; D109-T113 PolarHBondContact O-N 3.19Å; D109-T113 PolarHBondContact O-OG1 3.08Å |
| 110 | I | 96.6 | Very high | 95.2 | Very high | 96 Ų | 96 | 102.7 Ų | 102.7 | 49% | 0.492 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.5 | -47.6 | 168.9 | -69.6 | 164.3 | 0 | 0 | 0 | 110 | S106 G107 T113 L114 | S106-I110 WeakPolarHBondContact O-CB 3.42Å; S106-I110 WeakPolarHBondContact O-CD1 3.46Å; S106-I110 WeakPolarHBondContact O-CG1 3.47Å; S106-I110 PolarHBondContact O-N 2.94Å; G107-I110 PolarHBondContact O-N 3.02Å; I110-T113 PolarHBondContact O-N 3.25Å; I110-L114 HydrophobicContact CG2-CD1 3.88Å; I110-L114 HydrophobicContact CG2-CG 4.35Å; I110-L114 WeakPolarHBondContact O-CB 3.49Å; I110-L114 WeakPolarHBondContact O-CG 3.46Å; I110-L114 PolarHBondContact O-N 3.47Å |
| 111 | Y | 97.2 | Very high | 95.8 | Very high | 151 Ų | 151 | 105.6 Ų | 105.6 | 59% | 0.592 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.6 | -46.7 | 180 | 178.1 | -97.6 | 0 | 0 | 0 | 112.1 | G107 D108 T113 L114 H115 | G107-Y111 WeakPolarHBondContact O-CB 3.5Å; G107-Y111 PolarHBondContact O-N 3.42Å; D108-Y111 PolarHBondContact O-N 3.5Å; Y111-T113 PolarHBondContact O-N 2.96Å; Y111-L114 PolarHBondContact O-N 3.24Å; Y111-H115 WeakPolarHBondContact O-CB 3.42Å; Y111-H115 PolarHBondContact O-N 3.41Å |
| 112 | K | 97.7 | Very high | 96.2 | Very high | 108 Ų | 108 | 108.1 Ų | 108.1 | 47% | 0.47 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -59.5 | -45.9 | 175.6 | -70.4 | 168.3 | -158.7 | 154.5 | 0 | 111.4 | D108 D109 H115 I116 | D108-K112 VanDerWaalsContact O-CG 3.27Å; D108-K112 WeakPolarHBondContact O-CG 3.44Å; D108-K112 PolarHBondContact O-N 3.07Å; D109-K112 IonicContact OD1-NZ 3.03Å; D109-K112 PolarHBondContact OD1-NZ 3.01Å; K112-H115 PolarHBondContact O-N 2.88Å; K112-I116 VanDerWaalsContact O-CG1 3.31Å; K112-I116 WeakPolarHBondContact O-CG1 3.4Å; K112-I116 PolarHBondContact O-N 3.38Å |
| 113 | T | 97.2 | Very high | 96.6 | Very high | 91 Ų | 91 | 106 Ų | 106 | 56% | 0.558 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.9 | -45.9 | 179.2 | -58.9 | 0 | 0 | 0 | 0 | 111.4 | D109 I110 Y111 H115 I116 K117 | D109-T113 VanDerWaalsContact O-CB 3.3Å; D109-T113 WeakPolarHBondContact O-CB 3.44Å; D109-T113 PolarHBondContact O-N 3.19Å; D109-T113 PolarHBondContact O-OG1 3.08Å; I110-T113 PolarHBondContact O-N 3.25Å; Y111-T113 PolarHBondContact O-N 2.96Å; T113-H115 VanDerWaalsContact C-N 3.34Å; T113-H115 PolarHBondContact O-N 2.91Å; T113-I116 PolarHBondContact O-N 3.3Å; T113-K117 WeakPolarHBondContact O-CB 3.47Å; T113-K117 PolarHBondContact O-N 2.87Å |
| 114 | L | 97.9 | Very high | 96.8 | Very high | 99 Ų | 99 | 106.8 Ų | 106.8 | 52% | 0.518 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63 | -39.5 | 175.3 | -74.6 | 175 | 0 | 0 | 0 | 112.2 | I110 Y111 K117 R118 | I110-L114 HydrophobicContact CG2-CD1 3.88Å; I110-L114 HydrophobicContact CG2-CG 4.35Å; I110-L114 WeakPolarHBondContact O-CB 3.49Å; I110-L114 WeakPolarHBondContact O-CG 3.46Å; I110-L114 PolarHBondContact O-N 3.47Å; Y111-L114 PolarHBondContact O-N 3.24Å; L114-K117 PolarHBondContact O-N 3.42Å; L114-R118 WeakPolarHBondContact O-CB 3.38Å; L114-R118 PolarHBondContact O-N 3.14Å |
| 115 | H | 97.4 | Very high | 97.1 | Very high | 96 Ų | 96 | 105.6 Ų | 105.6 | 44% | 0.444 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.1 | -44.5 | 177.2 | -171.6 | 80 | 0 | 0 | 0 | 111.8 | Y111 K112 T113 R118 K119 | Y111-H115 WeakPolarHBondContact O-CB 3.42Å; Y111-H115 PolarHBondContact O-N 3.41Å; K112-H115 PolarHBondContact O-N 2.88Å; T113-H115 VanDerWaalsContact C-N 3.34Å; T113-H115 PolarHBondContact O-N 2.91Å; H115-R118 PolarHBondContact O-N 3.48Å; H115-K119 WeakPolarHBondContact O-CB 3.3Å; H115-K119 PolarHBondContact O-N 3.42Å |
| 116 | I | 98.1 | Very high | 97.3 | Very high | 116 Ų | 116 | 106.6 Ų | 106.6 | 60% | 0.595 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.1 | -48.9 | 174.8 | -68.1 | 165.1 | 0 | 0 | 0 | 110.4 | K112 T113 R118 K119 W120 | K112-I116 VanDerWaalsContact O-CG1 3.31Å; K112-I116 WeakPolarHBondContact O-CG1 3.4Å; K112-I116 PolarHBondContact O-N 3.38Å; T113-I116 PolarHBondContact O-N 3.3Å; I116-R118 VanDerWaalsContact C-N 3.33Å; I116-R118 PolarHBondContact O-N 3.05Å; I116-K119 PolarHBondContact O-N 3.21Å; I116-W120 WeakPolarHBondContact O-CB 3.45Å; I116-W120 PolarHBondContact O-N 2.96Å |
| 117 | K | 98.3 | Very high | 97.6 | Very high | 122 Ų | 122 | 109.7 Ų | 109.7 | 53% | 0.53 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.1 | -42.6 | 178.3 | -171.8 | 173.9 | -167.2 | -79.2 | 0 | 111.9 | T113 L114 W120 M121 | T113-K117 WeakPolarHBondContact O-CB 3.47Å; T113-K117 PolarHBondContact O-N 2.87Å; L114-K117 PolarHBondContact O-N 3.42Å; K117-W120 PolarHBondContact O-N 3.15Å; K117-M121 HydrophobicContact CG-SD 4.38Å; K117-M121 WeakPolarHBondContact O-CG 3.44Å; K117-M121 PolarHBondContact O-N 3.46Å |
| 118 | R | 98.2 | Very high | 97.7 | Very high | 162 Ų | 162 | 109.9 Ų | 109.9 | 61% | 0.611 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -61.7 | -49.6 | 175.5 | -178.4 | -174.9 | -63.1 | 157.8 | 2.3 | 111.3 | L114 H115 I116 W120 M121 V122 | L114-R118 WeakPolarHBondContact O-CB 3.38Å; L114-R118 PolarHBondContact O-N 3.14Å; H115-R118 PolarHBondContact O-N 3.48Å; I116-R118 VanDerWaalsContact C-N 3.33Å; I116-R118 PolarHBondContact O-N 3.05Å; R118-W120 VanDerWaalsContact C-N 3.3Å; R118-W120 PolarHBondContact O-N 3.44Å; R118-M121 PolarHBondContact O-N 3.17Å; R118-V122 HydrophobicContact CG-CG2 4.42Å; R118-V122 WeakPolarHBondContact O-CG2 3.41Å; R118-V122 PolarHBondContact O-N 3.44Å |
| 119 | K | 98.3 | Very high | 97.8 | Very high | 145 Ų | 145 | 111.6 Ų | 111.6 | 63% | 0.63 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -59 | -43.8 | 179.4 | -173.7 | 179.1 | 176.2 | -178.4 | 0 | 111.1 | H115 I116 V122 T123 | H115-K119 WeakPolarHBondContact O-CB 3.3Å; H115-K119 PolarHBondContact O-N 3.42Å; I116-K119 PolarHBondContact O-N 3.21Å; K119-V122 PolarHBondContact O-N 3.3Å; K119-T123 PolarHBondContact O-N 2.94Å; K119-T123 PolarHBondContact O-OG1 3.35Å; K119-T123 VanDerWaalsContact O-OG1 3.12Å |
| 120 | W | 98.2 | Very high | 98 | Very high | 157 Ų | 157 | 113.9 Ų | 113.9 | 60% | 0.595 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -60.4 | -49.7 | 175.2 | 176.3 | 83 | 0 | 0 | 0 | 112.2 | I116 K117 R118 V122 T123 Y124 | I116-W120 WeakPolarHBondContact O-CB 3.45Å; I116-W120 PolarHBondContact O-N 2.96Å; K117-W120 PolarHBondContact O-N 3.15Å; R118-W120 VanDerWaalsContact C-N 3.3Å; R118-W120 PolarHBondContact O-N 3.44Å; W120-V122 PolarHBondContact O-N 3.25Å; W120-T123 PolarHBondContact O-N 3.01Å; W120-Y124 HydrophobicContact CZ2-CD2 4.44Å; W120-Y124 WeakPolarHBondContact O-CB 3.3Å; W120-Y124 PolarHBondContact O-N 2.91Å |
| 121 | M | 98.5 | Very high | 98 | Very high | 88 Ų | 88 | 111.9 Ų | 111.9 | 43% | 0.433 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.4 | -42.7 | 178.7 | -72.4 | 179.9 | 64.1 | 0 | 0 | 112.4 | K117 R118 Y124 V125 | K117-M121 HydrophobicContact CG-SD 4.38Å; K117-M121 WeakPolarHBondContact O-CG 3.44Å; K117-M121 PolarHBondContact O-N 3.46Å; R118-M121 PolarHBondContact O-N 3.17Å; M121-Y124 PolarHBondContact O-N 3.41Å; M121-V125 WeakPolarHBondContact O-CG2 3.37Å; M121-V125 PolarHBondContact O-N 3.31Å |
| 122 | V | 97.8 | Very high | 98.1 | Very high | 94 Ų | 94 | 108 Ų | 108 | 57% | 0.57 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.9 | -45.3 | 178 | 170.2 | 0 | 0 | 0 | 0 | 110.9 | R118 K119 W120 K126 | R118-V122 HydrophobicContact CG-CG2 4.42Å; R118-V122 WeakPolarHBondContact O-CG2 3.41Å; R118-V122 PolarHBondContact O-N 3.44Å; K119-V122 PolarHBondContact O-N 3.3Å; W120-V122 PolarHBondContact O-N 3.25Å; V122-K126 WeakPolarHBondContact O-CB 3.34Å; V122-K126 PolarHBondContact O-N 3.4Å; V122-K126 VanDerWaalsContact O-N 3.09Å |
| 123 | T | 98.3 | Very high | 98.1 | Very high | 59 Ų | 59 | 106.1 Ų | 106.1 | 36% | 0.362 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.6 | -47.6 | 176 | -60.4 | 0 | 0 | 0 | 0 | 111.5 | K119 W120 V125 K126 E127 | K119-T123 PolarHBondContact O-N 2.94Å; K119-T123 PolarHBondContact O-OG1 3.35Å; K119-T123 VanDerWaalsContact O-OG1 3.12Å; W120-T123 PolarHBondContact O-N 3.01Å; T123-V125 PolarHBondContact O-N 2.93Å; T123-K126 WeakPolarHBondContact O-CB 3.5Å; T123-K126 PolarHBondContact O-N 3.31Å; T123-E127 HydrophobicContact CG2-CG 4.31Å; T123-E127 WeakPolarHBondContact CG2-OE1 3.47Å; T123-E127 WeakPolarHBondContact O-CG 3.27Å; T123-E127 PolarHBondContact O-N 3.3Å |
| 124 | Y | 98.3 | Very high | 98.1 | Very high | 131 Ų | 131 | 106.1 Ų | 106.1 | 51% | 0.514 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -57.7 | -47.8 | -179.9 | 175.3 | -96.7 | 0 | 0 | 0 | 112.2 | W120 M121 K126 E127 S128 | W120-Y124 HydrophobicContact CZ2-CD2 4.44Å; W120-Y124 WeakPolarHBondContact O-CB 3.3Å; W120-Y124 PolarHBondContact O-N 2.91Å; M121-Y124 PolarHBondContact O-N 3.41Å; Y124-K126 PolarHBondContact O-N 3.06Å; Y124-E127 PolarHBondContact O-N 3.39Å; Y124-S128 VanDerWaalsContact O-CB 3.25Å; Y124-S128 WeakPolarHBondContact O-CB 3.49Å; Y124-S128 PolarHBondContact O-N 3.3Å; Y124-S128 PolarHBondContact O-OG 2.97Å |
| 125 | V | 98.5 | Very high | 98.1 | Very high | 92 Ų | 92 | 107.5 Ų | 107.5 | 56% | 0.558 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.7 | -42.2 | 177.9 | 171.4 | 0 | 0 | 0 | 0 | 110.8 | M121 T123 S128 F129 | M121-V125 WeakPolarHBondContact O-CG2 3.37Å; M121-V125 PolarHBondContact O-N 3.31Å; T123-V125 PolarHBondContact O-N 2.93Å; V125-S128 PolarHBondContact O-N 3.45Å; V125-F129 WeakPolarHBondContact O-CB 3.33Å; V125-F129 PolarHBondContact O-N 3.05Å |
| 126 | K | 98.3 | Very high | 98.2 | Very high | 154 Ų | 154 | 107.8 Ų | 107.8 | 67% | 0.67 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.3 | -46 | 178.1 | -178.1 | 175.2 | -178.4 | 171.3 | 0 | 112.1 | V122 T123 Y124 K130 | V122-K126 WeakPolarHBondContact O-CB 3.34Å; V122-K126 PolarHBondContact O-N 3.4Å; V122-K126 VanDerWaalsContact O-N 3.09Å; T123-K126 WeakPolarHBondContact O-CB 3.5Å; T123-K126 PolarHBondContact O-N 3.31Å; Y124-K126 PolarHBondContact O-N 3.06Å; K126-K130 WeakPolarHBondContact O-CB 3.49Å; K126-K130 PolarHBondContact O-N 3.45Å |
| 127 | E | 98.3 | Very high | 98.2 | Very high | 123 Ų | 123 | 107 Ų | 107 | 58% | 0.575 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -68.4 | -41 | 178.7 | -72 | 175 | 176.1 | 0 | 0 | 111.9 | T123 Y124 K130 C131 | T123-E127 HydrophobicContact CG2-CG 4.31Å; T123-E127 WeakPolarHBondContact CG2-OE1 3.47Å; T123-E127 WeakPolarHBondContact O-CG 3.27Å; T123-E127 PolarHBondContact O-N 3.3Å; Y124-E127 PolarHBondContact O-N 3.39Å; E127-K130 PolarHBondContact O-N 3.38Å; E127-C131 WeakPolarHBondContact O-CB 3.46Å; E127-C131 PolarHBondContact O-N 3.47Å |
| 128 | S | 97.8 | Very high | 98.2 | Very high | 41 Ų | 41 | 108.2 Ų | 108.2 | 29% | 0.287 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.6 | -48.4 | 175.2 | -62.2 | 0 | 0 | 0 | 0 | 111.3 | Y124 V125 C131 S132 | Y124-S128 VanDerWaalsContact O-CB 3.25Å; Y124-S128 WeakPolarHBondContact O-CB 3.49Å; Y124-S128 PolarHBondContact O-N 3.3Å; Y124-S128 PolarHBondContact O-OG 2.97Å; V125-S128 PolarHBondContact O-N 3.45Å; S128-C131 PolarHBondContact O-N 2.98Å; S128-S132 WeakPolarHBondContact O-CB 3.38Å; S128-S132 PolarHBondContact O-N 3.06Å; S128-S132 PolarHBondContact O-OG 2.95Å; S128-S132 VanDerWaalsContact O-OG 3.1Å |
| 129 | F | 98 | Very high | 98.1 | Very high | 132 Ų | 132 | 107.1 Ų | 107.1 | 58% | 0.579 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.1 | -42.3 | 178.3 | -169.2 | -108.1 | 0 | 0 | 0 | 111.8 | V125 C131 S132 N133 | V125-F129 WeakPolarHBondContact O-CB 3.33Å; V125-F129 PolarHBondContact O-N 3.05Å; F129-C131 PolarHBondContact O-N 2.91Å; F129-S132 PolarHBondContact O-N 3.45Å; F129-N133 WeakPolarHBondContact CD1-ND2 3.46Å; F129-N133 WeakPolarHBondContact CE1-ND2 3.49Å; F129-N133 WeakPolarHBondContact CZ-ND2 3.4Å; F129-N133 WeakPolarHBondContact O-CB 3.41Å; F129-N133 VanDerWaalsContact O-CG 3.29Å; F129-N133 PolarHBondContact O-N 3.36Å |
| 130 | K | 98.3 | Very high | 98 | Very high | 134 Ų | 134 | 103.3 Ų | 103.3 | 58% | 0.583 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.3 | -46.9 | 175.3 | -176.4 | -177.9 | 177.5 | -175 | 0 | 111.8 | K126 E127 N133 Q134 | K126-K130 WeakPolarHBondContact O-CB 3.49Å; K126-K130 PolarHBondContact O-N 3.45Å; E127-K130 PolarHBondContact O-N 3.38Å; K130-N133 PolarHBondContact O-N 3.34Å; K130-Q134 WeakPolarHBondContact O-CG 3.5Å; K130-Q134 PolarHBondContact O-N 3.06Å |
| 131 | C | 98.1 | Very high | 98 | Very high | 54 Ų | 54 | 101 Ų | 101 | 37% | 0.365 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.1 | -46 | 178.3 | -176.6 | 0 | 0 | 0 | 0 | 111.5 | E127 S128 F129 Q134 K135 | E127-C131 WeakPolarHBondContact O-CB 3.46Å; E127-C131 PolarHBondContact O-N 3.47Å; S128-C131 PolarHBondContact O-N 2.98Å; F129-C131 PolarHBondContact O-N 2.91Å; C131-Q134 PolarHBondContact O-N 2.9Å; C131-K135 WeakPolarHBondContact O-CG 3.29Å; C131-K135 PolarHBondContact O-N 3.4Å |
| 132 | S | 98.1 | Very high | 98 | Very high | 69 Ų | 69 | 99.5 Ų | 99.5 | 48% | 0.483 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.6 | -45.2 | 177.3 | -67.5 | 0 | 0 | 0 | 0 | 112.2 | S128 F129 Q134 K135 L136 | S128-S132 WeakPolarHBondContact O-CB 3.38Å; S128-S132 PolarHBondContact O-N 3.06Å; S128-S132 PolarHBondContact O-OG 2.95Å; S128-S132 VanDerWaalsContact O-OG 3.1Å; F129-S132 PolarHBondContact O-N 3.45Å; S132-Q134 PolarHBondContact O-N 3.09Å; S132-K135 WeakPolarHBondContact O-CB 3.4Å; S132-K135 PolarHBondContact O-N 3.24Å; S132-K135 VanDerWaalsContact O-N 3.14Å; S132-L136 PolarHBondContact O-N 3.42Å |
| 133 | N | 98 | Very high | 97.9 | Very high | 70 Ų | 70 | 98.4 Ų | 98.4 | 37% | 0.374 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.3 | -41.3 | 177 | -72.9 | -4.2 | 0 | 0 | 0 | 112.1 | F129 K130 K135 L136 E137 | F129-N133 WeakPolarHBondContact CD1-ND2 3.46Å; F129-N133 WeakPolarHBondContact CE1-ND2 3.49Å; F129-N133 WeakPolarHBondContact CZ-ND2 3.4Å; F129-N133 WeakPolarHBondContact O-CB 3.41Å; F129-N133 VanDerWaalsContact O-CG 3.29Å; F129-N133 PolarHBondContact O-N 3.36Å; K130-N133 PolarHBondContact O-N 3.34Å; N133-K135 VanDerWaalsContact C-N 3.29Å; N133-K135 PolarHBondContact O-N 3.4Å; N133-L136 PolarHBondContact O-N 3.31Å; N133-E137 WeakPolarHBondContact O-CB 3.4Å; N133-E137 PolarHBondContact O-N 2.94Å |
| 134 | Q | 98.3 | Very high | 97.9 | Very high | 91 Ų | 91 | 98.9 Ų | 98.9 | 43% | 0.425 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.3 | -32.1 | 174.4 | -74.5 | -179.8 | -10.6 | 0 | 0 | 113 | K130 C131 S132 R138 | K130-Q134 WeakPolarHBondContact O-CG 3.5Å; K130-Q134 PolarHBondContact O-N 3.06Å; C131-Q134 PolarHBondContact O-N 2.9Å; S132-Q134 PolarHBondContact O-N 3.09Å; Q134-R138 WeakPolarHBondContact O-CB 3.24Å; Q134-R138 VanDerWaalsContact O-CG 3.3Å; Q134-R138 WeakPolarHBondContact O-CG 3.38Å; Q134-R138 PolarHBondContact O-N 2.98Å; Q134-R138 PolarHBondContact O-NE 3.41Å |
| 135 | K | 98.1 | Very high | 97.8 | Very high | 128 Ų | 128 | 100.1 Ų | 100.1 | 56% | 0.557 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -69.2 | -46.5 | 173.2 | -74.1 | 178.5 | 179.9 | -175.7 | 0 | 110.8 | C131 S132 N133 R138 F139 | C131-K135 WeakPolarHBondContact O-CG 3.29Å; C131-K135 PolarHBondContact O-N 3.4Å; S132-K135 WeakPolarHBondContact O-CB 3.4Å; S132-K135 PolarHBondContact O-N 3.24Å; S132-K135 VanDerWaalsContact O-N 3.14Å; N133-K135 VanDerWaalsContact C-N 3.29Å; N133-K135 PolarHBondContact O-N 3.4Å; K135-R138 PolarHBondContact O-N 3.37Å; K135-F139 PolarHBondContact O-N 3.05Å |
| 136 | L | 97.9 | Very high | 97.8 | Very high | 102 Ų | 102 | 101 Ų | 101 | 53% | 0.534 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -60.6 | -46.3 | 177.7 | -179.5 | 60.8 | 0 | 0 | 0 | 111.7 | S132 N133 R138 F139 C140 | S132-L136 PolarHBondContact O-N 3.42Å; N133-L136 PolarHBondContact O-N 3.31Å; L136-R138 VanDerWaalsContact C-N 3.35Å; L136-R138 PolarHBondContact O-N 3.45Å; L136-F139 WeakPolarHBondContact O-CB 3.48Å; L136-F139 PolarHBondContact O-N 3.4Å; L136-C140 PolarHBondContact O-N 3.25Å; L136-C140 PolarHBondContact O-SG 3.43Å; L136-C140 VanDerWaalsContact O-SG 3.34Å |
| 137 | E | 97.9 | Very high | 97.8 | Very high | 99 Ų | 99 | 100.5 Ų | 100.5 | 46% | 0.463 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -59.8 | -44.4 | 177.9 | -172.7 | -171.9 | 174.4 | 0 | 0 | 111.8 | N133 F139 C140 K141 | N133-E137 WeakPolarHBondContact O-CB 3.4Å; N133-E137 PolarHBondContact O-N 2.94Å; E137-F139 VanDerWaalsContact C-N 3.35Å; E137-F139 PolarHBondContact O-N 2.91Å; E137-C140 PolarHBondContact O-N 3.02Å; E137-K141 HydrophobicContact CG-CD 4.33Å; E137-K141 WeakPolarHBondContact O-CB 3.44Å; E137-K141 WeakPolarHBondContact O-CG 3.08Å; E137-K141 PolarHBondContact O-N 3.36Å; E137-K141 VanDerWaalsContact OE1-CE 3.23Å; E137-K141 WeakPolarHBondContact OE1-CE 3.25Å; E137-K141 IonicContact OE1-NZ 2.67Å; E137-K141 PolarHBondContact OE1-NZ 3.18Å |
| 138 | R | 98.2 | Very high | 97.7 | Very high | 147 Ų | 147 | 99.6 Ų | 99.6 | 56% | 0.555 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -62.1 | -42.1 | 175.6 | -78.6 | -177.5 | -74.6 | 158.4 | -10.9 | 112.2 | Q134 K135 L136 T142 | Q134-R138 WeakPolarHBondContact O-CB 3.24Å; Q134-R138 VanDerWaalsContact O-CG 3.3Å; Q134-R138 WeakPolarHBondContact O-CG 3.38Å; Q134-R138 PolarHBondContact O-N 2.98Å; Q134-R138 PolarHBondContact O-NE 3.41Å; K135-R138 PolarHBondContact O-N 3.37Å; L136-R138 VanDerWaalsContact C-N 3.35Å; L136-R138 PolarHBondContact O-N 3.45Å; R138-T142 WeakPolarHBondContact O-CB 3.48Å; R138-T142 PolarHBondContact O-N 2.94Å; R138-T142 PolarHBondContact O-OG1 3.3Å |
| 139 | F | 97 | Very high | 97.7 | Very high | 140 Ų | 140 | 101.4 Ų | 101.4 | 61% | 0.614 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -61.5 | -50.5 | 176 | 177.7 | -98 | 0 | 0 | 0 | 111 | K135 L136 E137 K141 T142 N143 | K135-F139 PolarHBondContact O-N 3.05Å; L136-F139 WeakPolarHBondContact O-CB 3.48Å; L136-F139 PolarHBondContact O-N 3.4Å; E137-F139 VanDerWaalsContact C-N 3.35Å; E137-F139 PolarHBondContact O-N 2.91Å; F139-K141 PolarHBondContact O-N 2.86Å; F139-T142 PolarHBondContact O-N 3.01Å; F139-T142 VanDerWaalsContact O-N 3.15Å; F139-N143 WeakPolarHBondContact O-CB 3.37Å; F139-N143 PolarHBondContact O-N 2.79Å |
| 140 | C | 96.1 | Very high | 97.7 | Very high | 65 Ų | 65 | 100.7 Ų | 100.7 | 44% | 0.439 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -57.5 | -48.4 | 178.1 | -70 | 0 | 0 | 0 | 0 | 112.1 | L136 E137 T142 N143 E144 | L136-C140 PolarHBondContact O-N 3.25Å; L136-C140 PolarHBondContact O-SG 3.43Å; L136-C140 VanDerWaalsContact O-SG 3.34Å; E137-C140 PolarHBondContact O-N 3.02Å; C140-T142 VanDerWaalsContact C-N 3.29Å; C140-T142 PolarHBondContact O-N 3.21Å; C140-N143 PolarHBondContact O-N 2.79Å; C140-E144 WeakPolarHBondContact O-CB 3.5Å; C140-E144 PolarHBondContact O-N 3.34Å |
| 141 | K | 98.1 | Very high | 97.6 | Very high | 107 Ų | 107 | 96.7 Ų | 96.7 | 47% | 0.465 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -61.7 | -35.9 | 177.4 | -73.6 | 179.5 | -176.8 | 175.2 | 0 | 112.8 | E137 F139 R145 | E137-K141 HydrophobicContact CG-CD 4.33Å; E137-K141 WeakPolarHBondContact O-CB 3.44Å; E137-K141 WeakPolarHBondContact O-CG 3.08Å; E137-K141 PolarHBondContact O-N 3.36Å; E137-K141 VanDerWaalsContact OE1-CE 3.23Å; E137-K141 WeakPolarHBondContact OE1-CE 3.25Å; E137-K141 IonicContact OE1-NZ 2.67Å; E137-K141 PolarHBondContact OE1-NZ 3.18Å; F139-K141 PolarHBondContact O-N 2.86Å; K141-R145 WeakPolarHBondContact O-CB 3.37Å; K141-R145 PolarHBondContact O-N 3.41Å; K141-R145 VanDerWaalsContact O-N 3.11Å |
| 142 | T | 97.9 | Very high | 97.6 | Very high | 58 Ų | 58 | 98.5 Ų | 98.5 | 36% | 0.356 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -68.9 | -49.3 | 177.7 | -59 | 0 | 0 | 0 | 0 | 110.5 | R138 F139 C140 E144 R145 E146 | R138-T142 WeakPolarHBondContact O-CB 3.48Å; R138-T142 PolarHBondContact O-N 2.94Å; R138-T142 PolarHBondContact O-OG1 3.3Å; F139-T142 PolarHBondContact O-N 3.01Å; F139-T142 VanDerWaalsContact O-N 3.15Å; C140-T142 VanDerWaalsContact C-N 3.29Å; C140-T142 PolarHBondContact O-N 3.21Å; T142-E144 VanDerWaalsContact C-N 3.34Å; T142-E144 PolarHBondContact O-N 3.44Å; T142-R145 WeakPolarHBondContact O-CB 3.49Å; T142-R145 PolarHBondContact O-N 3.26Å; T142-E146 WeakPolarHBondContact O-CG 3.32Å; T142-E146 PolarHBondContact O-N 2.9Å |
| 143 | N | 97 | Very high | 97.6 | Very high | 70 Ų | 70 | 100.8 Ų | 100.8 | 37% | 0.374 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.4 | -40.9 | 176.7 | -177.9 | 53.9 | 0 | 0 | 0 | 112.3 | F139 C140 E146 R147 | F139-N143 WeakPolarHBondContact O-CB 3.37Å; F139-N143 PolarHBondContact O-N 2.79Å; C140-N143 PolarHBondContact O-N 2.79Å; N143-E146 PolarHBondContact O-N 3Å; N143-R147 WeakPolarHBondContact O-CG 3.48Å; N143-R147 PolarHBondContact O-N 3.09Å |
| 144 | E | 96.9 | Very high | 97.5 | Very high | 69 Ų | 69 | 102.2 Ų | 102.2 | 32% | 0.322 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.3 | -43.8 | 174.5 | -167.6 | -161.1 | 147.8 | 0 | 0 | 112.4 | C140 T142 E146 R147 K148 | C140-E144 WeakPolarHBondContact O-CB 3.5Å; C140-E144 PolarHBondContact O-N 3.34Å; T142-E144 VanDerWaalsContact C-N 3.34Å; T142-E144 PolarHBondContact O-N 3.44Å; E144-E146 VanDerWaalsContact C-N 3.33Å; E144-E146 PolarHBondContact O-N 3.33Å; E144-R147 PolarHBondContact O-N 2.85Å; E144-K148 PolarHBondContact O-N 3.28Å; E144-K148 WeakPolarHBondContact OE1-CE 3.34Å; E144-K148 IonicContact OE1-NZ 2.62Å; E144-K148 PolarHBondContact OE1-NZ 2.99Å |
| 145 | R | 97.8 | Very high | 97.4 | Very high | 157 Ų | 157 | 99.9 Ų | 99.9 | 59% | 0.592 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -62.4 | -40.6 | 176.4 | -167.9 | -173.1 | -56.6 | 116.7 | 3.7 | 111.8 | K141 T142 K148 N149 | K141-R145 WeakPolarHBondContact O-CB 3.37Å; K141-R145 PolarHBondContact O-N 3.41Å; K141-R145 VanDerWaalsContact O-N 3.11Å; T142-R145 WeakPolarHBondContact O-CB 3.49Å; T142-R145 PolarHBondContact O-N 3.26Å; R145-K148 PolarHBondContact O-N 3.15Å; R145-N149 WeakPolarHBondContact O-CB 3.09Å; R145-N149 PolarHBondContact O-N 3.49Å |
| 146 | E | 98.1 | Very high | 97.4 | Very high | 110 Ų | 110 | 99.8 Ų | 99.8 | 51% | 0.514 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64.4 | -45.5 | 176.3 | -73 | 179.7 | 178.7 | 0 | 0 | 111.9 | T142 N143 E144 K148 N149 I150 | T142-E146 WeakPolarHBondContact O-CG 3.32Å; T142-E146 PolarHBondContact O-N 2.9Å; N143-E146 PolarHBondContact O-N 3Å; E144-E146 VanDerWaalsContact C-N 3.33Å; E144-E146 PolarHBondContact O-N 3.33Å; E146-K148 PolarHBondContact O-N 2.83Å; E146-N149 WeakPolarHBondContact O-CB 3.4Å; E146-N149 PolarHBondContact O-N 3.41Å; E146-I150 WeakPolarHBondContact O-CG1 3.42Å; E146-I150 PolarHBondContact O-N 3.39Å |
| 147 | R | 97.3 | Very high | 97.4 | Very high | 145 Ų | 145 | 101 Ų | 101 | 55% | 0.547 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -58 | -47.6 | 174 | -71.5 | -172.9 | -62.9 | 136.7 | -0.5 | 111.7 | N143 E144 N149 I150 N151 | N143-R147 WeakPolarHBondContact O-CG 3.48Å; N143-R147 PolarHBondContact O-N 3.09Å; E144-R147 PolarHBondContact O-N 2.85Å; R147-N149 VanDerWaalsContact C-N 3.34Å; R147-N149 PolarHBondContact O-N 2.86Å; R147-I150 PolarHBondContact O-N 3.36Å; R147-N151 WeakPolarHBondContact O-CB 3.4Å; R147-N151 PolarHBondContact O-N 2.86Å |
| 148 | K | 97.6 | Very high | 97.3 | Very high | 104 Ų | 104 | 101.9 Ų | 101.9 | 45% | 0.452 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -58.9 | -43.6 | 175.7 | -78.1 | 176.7 | 170.9 | 168.7 | 0 | 111.6 | E144 R145 E146 N151 N152 | E144-K148 PolarHBondContact O-N 3.28Å; E144-K148 WeakPolarHBondContact OE1-CE 3.34Å; E144-K148 IonicContact OE1-NZ 2.62Å; E144-K148 PolarHBondContact OE1-NZ 2.99Å; R145-K148 PolarHBondContact O-N 3.15Å; E146-K148 PolarHBondContact O-N 2.83Å; K148-N151 PolarHBondContact O-N 3.21Å; K148-N152 WeakPolarHBondContact O-CB 3.33Å; K148-N152 PolarHBondContact O-N 3.48Å; K148-N152 PolarHBondContact O-ND2 3.11Å; K148-N152 PolarHBondContact O-OD1 3.35Å |
| 149 | N | 97.7 | Very high | 97.3 | Very high | 79 Ų | 79 | 99.2 Ų | 99.2 | 42% | 0.422 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.7 | -44.1 | 178.1 | -178 | 45.3 | 0 | 0 | 0 | 113 | R145 E146 R147 N151 N152 K153 | R145-N149 WeakPolarHBondContact O-CB 3.09Å; R145-N149 PolarHBondContact O-N 3.49Å; E146-N149 WeakPolarHBondContact O-CB 3.4Å; E146-N149 PolarHBondContact O-N 3.41Å; R147-N149 VanDerWaalsContact C-N 3.34Å; R147-N149 PolarHBondContact O-N 2.86Å; N149-N151 VanDerWaalsContact C-N 3.34Å; N149-N152 PolarHBondContact O-N 3.11Å; N149-K153 WeakPolarHBondContact O-CG 3.45Å; N149-K153 PolarHBondContact O-N 2.9Å; N149-K153 VanDerWaalsContact O-N 3.14Å |
| 150 | I | 96.9 | Very high | 97.3 | Very high | 116 Ų | 116 | 96.8 Ų | 96.8 | 60% | 0.595 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -61.7 | -46.5 | 176.1 | -68.8 | 166.4 | 0 | 0 | 0 | 110.1 | E146 R147 N152 K153 F154 | E146-I150 WeakPolarHBondContact O-CG1 3.42Å; E146-I150 PolarHBondContact O-N 3.39Å; R147-I150 PolarHBondContact O-N 3.36Å; I150-N152 PolarHBondContact O-N 3.14Å; I150-K153 PolarHBondContact O-N 3.2Å; I150-F154 PolarHBondContact O-N 3Å; I150-F154 VanDerWaalsContact O-N 3.11Å |
| 151 | N | 97.2 | Very high | 97.4 | Very high | 50 Ų | 50 | 97.9 Ų | 97.9 | 27% | 0.267 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -60.6 | -46.7 | 179.3 | -171.8 | 37.9 | 0 | 0 | 0 | 112 | L21 R147 K148 N149 K153 F154 C155 | L21-N151 WeakPolarHBondContact CD1-ND2 3.45Å; L21-N151 WeakPolarHBondContact CD1-OD1 3.39Å; R147-N151 WeakPolarHBondContact O-CB 3.4Å; R147-N151 PolarHBondContact O-N 2.86Å; K148-N151 PolarHBondContact O-N 3.21Å; N149-N151 VanDerWaalsContact C-N 3.34Å; N151-K153 VanDerWaalsContact C-N 3.35Å; N151-K153 PolarHBondContact O-N 3.08Å; N151-F154 WeakPolarHBondContact O-CB 3.42Å; N151-F154 PolarHBondContact O-N 2.97Å; N151-F154 VanDerWaalsContact O-N 3.11Å; N151-C155 PolarHBondContact O-N 3.49Å; N151-C155 PolarHBondContact O-SG 3.01Å; N151-C155 VanDerWaalsContact O-SG 3.38Å |
| 152 | N | 97.6 | Very high | 97.4 | Very high | 93 Ų | 93 | 98.2 Ų | 98.2 | 50% | 0.497 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -58.4 | -45.6 | 178.6 | -71.5 | -8.5 | 0 | 0 | 0 | 112 | K148 N149 I150 F154 C155 E156 | K148-N152 WeakPolarHBondContact O-CB 3.33Å; K148-N152 PolarHBondContact O-N 3.48Å; K148-N152 PolarHBondContact O-ND2 3.11Å; K148-N152 PolarHBondContact O-OD1 3.35Å; N149-N152 PolarHBondContact O-N 3.11Å; I150-N152 PolarHBondContact O-N 3.14Å; N152-F154 VanDerWaalsContact C-N 3.28Å; N152-F154 PolarHBondContact O-N 3.38Å; N152-C155 PolarHBondContact O-N 2.93Å; N152-E156 WeakPolarHBondContact O-CG 3.49Å; N152-E156 PolarHBondContact O-N 3.36Å |
| 153 | K | 97.5 | Very high | 97.4 | Very high | 116 Ų | 116 | 101 Ų | 101 | 50% | 0.504 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59.6 | -39.4 | 176.4 | -72.1 | 174.9 | -179.8 | -178.7 | 0 | 112.3 | N149 I150 N151 Q157 | N149-K153 WeakPolarHBondContact O-CG 3.45Å; N149-K153 PolarHBondContact O-N 2.9Å; N149-K153 VanDerWaalsContact O-N 3.14Å; I150-K153 PolarHBondContact O-N 3.2Å; N151-K153 VanDerWaalsContact C-N 3.35Å; N151-K153 PolarHBondContact O-N 3.08Å; K153-Q157 WeakPolarHBondContact O-CG 3.48Å; K153-Q157 PolarHBondContact O-N 3.22Å; K153-Q157 VanDerWaalsContact O-N 3.15Å |
| 154 | F | 96 | Very high | 97.5 | Very high | 100 Ų | 100 | 104 Ų | 104 | 44% | 0.439 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -70.6 | -42.3 | 178.5 | -169.1 | -123.1 | 0 | 0 | 0 | 112 | I150 N151 N152 E156 Q157 Y158 | I150-F154 PolarHBondContact O-N 3Å; I150-F154 VanDerWaalsContact O-N 3.11Å; N151-F154 WeakPolarHBondContact O-CB 3.42Å; N151-F154 PolarHBondContact O-N 2.97Å; N151-F154 VanDerWaalsContact O-N 3.11Å; N152-F154 VanDerWaalsContact C-N 3.28Å; N152-F154 PolarHBondContact O-N 3.38Å; F154-E156 PolarHBondContact O-N 3.47Å; F154-Q157 WeakPolarHBondContact O-CB 3.47Å; F154-Q157 PolarHBondContact O-N 2.9Å; F154-Y158 AromaticContact CD1-CD2 3.93Å; F154-Y158 HydrophobicContact CD1-CD2 3.93Å; F154-Y158 AromaticContact CD1-CE2 3.6Å; F154-Y158 HydrophobicContact CD1-CE2 3.6Å; F154-Y158 HydrophobicContact CD2-CE2 4.32Å; F154-Y158 AromaticContact CE1-CD2 3.9Å; F154-Y158 HydrophobicContact CE1-CD2 3.9Å; F154-Y158 AromaticContact CE1-CE2 3.08Å; F154-Y158 HydrophobicContact CE1-CE2 3.08Å; F154-Y158 AromaticContact CE1-CZ 3.87Å; F154-Y158 HydrophobicContact CE2-CD2 4.47Å; F154-Y158 AromaticContact CE2-CE2 3.82Å; F154-Y158 HydrophobicContact CE2-CE2 3.82Å; F154-Y158 HydrophobicContact CG-CD2 4.33Å; F154-Y158 HydrophobicContact CG-CE2 4.22Å; F154-Y158 HydrophobicContact CZ-CD2 4.14Å; F154-Y158 AromaticContact CZ-CE2 3.17Å; F154-Y158 HydrophobicContact CZ-CE2 3.17Å; F154-Y158 AromaticContact CZ-CZ 3.49Å; F154-Y158 VanDerWaalsContact CZ-CZ 3.49Å; F154-Y158 VanDerWaalsContact CZ-OH 3.24Å; F154-Y158 WeakPolarHBondContact CZ-OH 3.37Å; F154-Y158 PolarHBondContact O-N 2.91Å |
| 155 | C | 97.3 | Very high | 97.5 | Very high | 43 Ų | 43 | 103.5 Ų | 103.5 | 29% | 0.291 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -58.9 | -45.3 | 172.7 | -71.7 | 0 | 0 | 0 | 0 | 111.7 | N151 N152 Q157 Y158 I159 | N151-C155 PolarHBondContact O-N 3.49Å; N151-C155 PolarHBondContact O-SG 3.01Å; N151-C155 VanDerWaalsContact O-SG 3.38Å; N152-C155 PolarHBondContact O-N 2.93Å; C155-Q157 VanDerWaalsContact C-N 3.33Å; C155-Q157 PolarHBondContact O-N 3.38Å; C155-Y158 PolarHBondContact O-N 3.37Å; C155-I159 WeakPolarHBondContact O-CB 3.37Å; C155-I159 VanDerWaalsContact O-CG1 3.25Å; C155-I159 WeakPolarHBondContact O-CG1 3.45Å; C155-I159 PolarHBondContact O-N 3.49Å |
| 156 | E | 97.3 | Very high | 97.6 | Very high | 125 Ų | 125 | 100.6 Ų | 100.6 | 58% | 0.584 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -58.3 | -43 | 175.9 | -76 | 175.2 | -177.7 | 0 | 0 | 112.3 | N152 F154 I159 T160 | N152-E156 WeakPolarHBondContact O-CG 3.49Å; N152-E156 PolarHBondContact O-N 3.36Å; F154-E156 PolarHBondContact O-N 3.47Å; E156-I159 PolarHBondContact O-N 3.47Å; E156-T160 WeakPolarHBondContact O-CB 3.46Å; E156-T160 PolarHBondContact O-N 3.41Å; E156-T160 PolarHBondContact O-OG1 3.26Å |
| 157 | Q | 97.3 | Very high | 97.6 | Very high | 129 Ų | 129 | 101.3 Ų | 101.3 | 60% | 0.603 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -62.2 | -44.1 | 175.4 | -74.6 | -179.3 | -8.5 | 0 | 0 | 112.1 | K153 F154 C155 T161 | K153-Q157 WeakPolarHBondContact O-CG 3.48Å; K153-Q157 PolarHBondContact O-N 3.22Å; K153-Q157 VanDerWaalsContact O-N 3.15Å; F154-Q157 WeakPolarHBondContact O-CB 3.47Å; F154-Q157 PolarHBondContact O-N 2.9Å; C155-Q157 VanDerWaalsContact C-N 3.33Å; C155-Q157 PolarHBondContact O-N 3.38Å; Q157-T161 WeakPolarHBondContact O-CB 3.46Å; Q157-T161 PolarHBondContact O-N 3.45Å; Q157-T161 PolarHBondContact O-OG1 3.35Å |
| 158 | Y | 96.5 | Very high | 97.6 | Very high | 117 Ų | 117 | 98.5 Ų | 98.5 | 46% | 0.459 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.5 | -48.3 | 176.9 | -85.9 | -54.8 | 0 | 0 | 0 | 112.3 | F154 C155 T160 T161 F162 | F154-Y158 AromaticContact CD1-CD2 3.93Å; F154-Y158 HydrophobicContact CD1-CD2 3.93Å; F154-Y158 AromaticContact CD1-CE2 3.6Å; F154-Y158 HydrophobicContact CD1-CE2 3.6Å; F154-Y158 HydrophobicContact CD2-CE2 4.32Å; F154-Y158 AromaticContact CE1-CD2 3.9Å; F154-Y158 HydrophobicContact CE1-CD2 3.9Å; F154-Y158 AromaticContact CE1-CE2 3.08Å; F154-Y158 HydrophobicContact CE1-CE2 3.08Å; F154-Y158 AromaticContact CE1-CZ 3.87Å; F154-Y158 HydrophobicContact CE2-CD2 4.47Å; F154-Y158 AromaticContact CE2-CE2 3.82Å; F154-Y158 HydrophobicContact CE2-CE2 3.82Å; F154-Y158 HydrophobicContact CG-CD2 4.33Å; F154-Y158 HydrophobicContact CG-CE2 4.22Å; F154-Y158 HydrophobicContact CZ-CD2 4.14Å; F154-Y158 AromaticContact CZ-CE2 3.17Å; F154-Y158 HydrophobicContact CZ-CE2 3.17Å; F154-Y158 AromaticContact CZ-CZ 3.49Å; F154-Y158 VanDerWaalsContact CZ-CZ 3.49Å; F154-Y158 VanDerWaalsContact CZ-OH 3.24Å; F154-Y158 WeakPolarHBondContact CZ-OH 3.37Å; F154-Y158 PolarHBondContact O-N 2.91Å; C155-Y158 PolarHBondContact O-N 3.37Å; Y158-T160 VanDerWaalsContact C-N 3.27Å; Y158-T160 PolarHBondContact O-N 3.05Å; Y158-T161 PolarHBondContact O-N 2.99Å; Y158-T161 VanDerWaalsContact O-N 3.09Å; Y158-F162 AromaticContact CD1-CE2 3.89Å; Y158-F162 HydrophobicContact CD1-CE2 3.89Å; Y158-F162 HydrophobicContact CG-CE2 4.28Å; Y158-F162 WeakPolarHBondContact O-CD2 3.37Å; Y158-F162 PolarHBondContact O-N 3.45Å |
| 159 | I | 97.7 | Very high | 97.7 | Very high | 91 Ų | 91 | 97.1 Ų | 97.1 | 47% | 0.467 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -55.4 | -47.8 | 178.8 | -70.2 | 164.7 | 0 | 0 | 0 | 109.8 | C155 E156 T161 F162 Q163 | C155-I159 WeakPolarHBondContact O-CB 3.37Å; C155-I159 VanDerWaalsContact O-CG1 3.25Å; C155-I159 WeakPolarHBondContact O-CG1 3.45Å; C155-I159 PolarHBondContact O-N 3.49Å; E156-I159 PolarHBondContact O-N 3.47Å; I159-T161 VanDerWaalsContact C-N 3.33Å; I159-T161 PolarHBondContact O-N 3.34Å; I159-F162 PolarHBondContact O-N 3.47Å; I159-Q163 HydrophobicContact CG2-CG 4.43Å; I159-Q163 WeakPolarHBondContact O-CB 3.3Å; I159-Q163 VanDerWaalsContact O-CG 3.29Å; I159-Q163 WeakPolarHBondContact O-CG 3.23Å; I159-Q163 PolarHBondContact O-N 2.92Å |
| 160 | T | 97.8 | Very high | 97.7 | Very high | 88 Ų | 88 | 99.3 Ų | 99.3 | 54% | 0.54 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.9 | -42.9 | 178.3 | -55.9 | 0 | 0 | 0 | 0 | 111.8 | E156 Y158 K164 | E156-T160 WeakPolarHBondContact O-CB 3.46Å; E156-T160 PolarHBondContact O-N 3.41Å; E156-T160 PolarHBondContact O-OG1 3.26Å; Y158-T160 VanDerWaalsContact C-N 3.27Å; Y158-T160 PolarHBondContact O-N 3.05Å; T160-K164 WeakPolarHBondContact O-CB 3.34Å; T160-K164 PolarHBondContact O-N 3.33Å |
| 161 | T | 98 | Very high | 97.8 | Very high | 89 Ų | 89 | 100.3 Ų | 100.3 | 55% | 0.546 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.9 | -42.8 | 179.4 | -58.5 | 0 | 0 | 0 | 0 | 111.7 | Q157 Y158 I159 K164 S165 | Q157-T161 WeakPolarHBondContact O-CB 3.46Å; Q157-T161 PolarHBondContact O-N 3.45Å; Q157-T161 PolarHBondContact O-OG1 3.35Å; Y158-T161 PolarHBondContact O-N 2.99Å; Y158-T161 VanDerWaalsContact O-N 3.09Å; I159-T161 VanDerWaalsContact C-N 3.33Å; I159-T161 PolarHBondContact O-N 3.34Å; T161-K164 PolarHBondContact O-N 2.78Å; T161-S165 WeakPolarHBondContact O-CB 3.41Å; T161-S165 PolarHBondContact O-N 3.46Å |
| 162 | F | 98 | Very high | 97.8 | Very high | 113 Ų | 113 | 104 Ų | 104 | 50% | 0.496 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67.9 | -42.3 | 177.9 | -75.6 | -60.7 | 0 | 0 | 0 | 112 | Y158 I159 K164 S165 D166 | Y158-F162 AromaticContact CD1-CE2 3.89Å; Y158-F162 HydrophobicContact CD1-CE2 3.89Å; Y158-F162 HydrophobicContact CG-CE2 4.28Å; Y158-F162 WeakPolarHBondContact O-CD2 3.37Å; Y158-F162 PolarHBondContact O-N 3.45Å; I159-F162 PolarHBondContact O-N 3.47Å; F162-K164 VanDerWaalsContact C-N 3.31Å; F162-K164 PolarHBondContact O-N 2.99Å; F162-S165 WeakPolarHBondContact O-CB 3.38Å; F162-S165 PolarHBondContact O-N 3.17Å; F162-D166 PolarHBondContact O-N 2.94Å |
| 163 | Q | 98.2 | Very high | 97.8 | Very high | 116 Ų | 116 | 103.4 Ų | 103.4 | 54% | 0.542 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.2 | -43.9 | 173.9 | -75.3 | 175.7 | -14.8 | 0 | 0 | 111.8 | I159 D166 M167 | I159-Q163 HydrophobicContact CG2-CG 4.43Å; I159-Q163 WeakPolarHBondContact O-CB 3.3Å; I159-Q163 VanDerWaalsContact O-CG 3.29Å; I159-Q163 WeakPolarHBondContact O-CG 3.23Å; I159-Q163 PolarHBondContact O-N 2.92Å; Q163-D166 PolarHBondContact O-N 3.05Å; Q163-M167 WeakPolarHBondContact O-CG 3.38Å; Q163-M167 PolarHBondContact O-N 3.02Å |
| 164 | K | 98.2 | Very high | 97.9 | Very high | 134 Ų | 134 | 103 Ų | 103 | 58% | 0.583 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.5 | -45.2 | 175.1 | -176.3 | -179.4 | 177 | -176.5 | 0 | 111.8 | T160 T161 F162 D166 M167 D168 | T160-K164 WeakPolarHBondContact O-CB 3.34Å; T160-K164 PolarHBondContact O-N 3.33Å; T161-K164 PolarHBondContact O-N 2.78Å; F162-K164 VanDerWaalsContact C-N 3.31Å; F162-K164 PolarHBondContact O-N 2.99Å; K164-D166 VanDerWaalsContact C-N 3.31Å; K164-D166 PolarHBondContact O-N 3.15Å; K164-M167 WeakPolarHBondContact O-CB 3.36Å; K164-M167 PolarHBondContact O-N 3.36Å; K164-D168 PolarHBondContact O-N 2.96Å |
| 165 | S | 98.4 | Very high | 98 | Very high | 59 Ų | 59 | 104.3 Ų | 104.3 | 41% | 0.413 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.2 | -42.6 | 176.5 | -176.5 | 0 | 0 | 0 | 0 | 111.8 | T161 F162 D168 V169 | T161-S165 WeakPolarHBondContact O-CB 3.41Å; T161-S165 PolarHBondContact O-N 3.46Å; F162-S165 WeakPolarHBondContact O-CB 3.38Å; F162-S165 PolarHBondContact O-N 3.17Å; S165-D168 PolarHBondContact O-N 3.11Å; S165-V169 WeakPolarHBondContact O-CG2 2.95Å; S165-V169 PolarHBondContact O-N 3.41Å |
| 166 | D | 98.4 | Very high | 98 | Very high | 95 Ų | 95 | 108 Ų | 108 | 51% | 0.508 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.6 | -42 | 177.3 | -81 | -11.6 | 0 | 0 | 0 | 111.7 | F162 Q163 K164 V169 Q170 | F162-D166 PolarHBondContact O-N 2.94Å; Q163-D166 PolarHBondContact O-N 3.05Å; K164-D166 VanDerWaalsContact C-N 3.31Å; K164-D166 PolarHBondContact O-N 3.15Å; D166-V169 PolarHBondContact O-N 2.87Å; D166-Q170 WeakPolarHBondContact O-CG 3.41Å; D166-Q170 PolarHBondContact O-N 2.96Å |
| 167 | M | 98.3 | Very high | 98.1 | Very high | 125 Ų | 125 | 108 Ų | 108 | 62% | 0.616 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.7 | -43.7 | 173.5 | -73.4 | 173.4 | 48.4 | 0 | 0 | 112.2 | Q163 K164 V169 Q170 K171 | Q163-M167 WeakPolarHBondContact O-CG 3.38Å; Q163-M167 PolarHBondContact O-N 3.02Å; K164-M167 WeakPolarHBondContact O-CB 3.36Å; K164-M167 PolarHBondContact O-N 3.36Å; M167-V169 VanDerWaalsContact C-N 3.31Å; M167-V169 PolarHBondContact O-N 3.49Å; M167-Q170 PolarHBondContact O-N 3.42Å; M167-K171 WeakPolarHBondContact O-CB 3.37Å; M167-K171 PolarHBondContact O-N 3.33Å |
| 168 | D | 98.4 | Very high | 98.1 | Very high | 87 Ų | 87 | 108.7 Ų | 108.7 | 47% | 0.465 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.6 | -38.3 | 178.6 | -73.4 | -25.1 | 0 | 0 | 0 | 111.2 | K164 S165 K171 F172 | K164-D168 PolarHBondContact O-N 2.96Å; S165-D168 PolarHBondContact O-N 3.11Å; D168-K171 PolarHBondContact O-N 3.4Å; D168-F172 WeakPolarHBondContact O-CB 3.25Å; D168-F172 PolarHBondContact O-N 2.87Å |
| 169 | V | 98.3 | Very high | 98.2 | Very high | 75 Ų | 75 | 106.8 Ų | 106.8 | 46% | 0.455 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.8 | -42.3 | 173.9 | 169.9 | 0 | 0 | 0 | 0 | 111.7 | S165 D166 M167 F172 N173 | S165-V169 WeakPolarHBondContact O-CG2 2.95Å; S165-V169 PolarHBondContact O-N 3.41Å; D166-V169 PolarHBondContact O-N 2.87Å; M167-V169 VanDerWaalsContact C-N 3.31Å; M167-V169 PolarHBondContact O-N 3.49Å; V169-F172 PolarHBondContact O-N 2.67Å; V169-N173 PolarHBondContact O-N 3.28Å; V169-N173 PolarHBondContact O-ND2 3.19Å |
| 170 | Q | 98.2 | Very high | 98.2 | Very high | 124 Ų | 124 | 106.4 Ų | 106.4 | 58% | 0.579 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -61.2 | -49.6 | 175.5 | -73.2 | 177.8 | 2.8 | 0 | 0 | 111.1 | D166 M167 F172 N173 E174 | D166-Q170 WeakPolarHBondContact O-CG 3.41Å; D166-Q170 PolarHBondContact O-N 2.96Å; M167-Q170 PolarHBondContact O-N 3.42Å; Q170-F172 VanDerWaalsContact C-N 3.33Å; Q170-F172 PolarHBondContact O-N 2.85Å; Q170-N173 WeakPolarHBondContact O-CB 3.41Å; Q170-N173 PolarHBondContact O-N 3.04Å; Q170-N173 VanDerWaalsContact O-N 3.09Å; Q170-E174 PolarHBondContact O-N 3.42Å |
| 171 | K | 98.5 | Very high | 98.2 | Very high | 137 Ų | 137 | 105.7 Ų | 105.7 | 60% | 0.596 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -59.2 | -42.5 | 177.9 | -174.1 | -179.3 | 177.2 | -174.1 | 0 | 112.2 | M167 D168 N173 E174 E175 | M167-K171 WeakPolarHBondContact O-CB 3.37Å; M167-K171 PolarHBondContact O-N 3.33Å; D168-K171 PolarHBondContact O-N 3.4Å; K171-N173 VanDerWaalsContact C-N 3.32Å; K171-N173 PolarHBondContact O-N 2.62Å; K171-E174 PolarHBondContact O-N 3.25Å; K171-E175 PolarHBondContact O-N 2.97Å |
| 172 | F | 98.3 | Very high | 98.2 | Very high | 129 Ų | 129 | 105 Ų | 105 | 57% | 0.566 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.1 | -41.7 | 175.1 | 173.8 | -98.2 | 0 | 0 | 0 | 112.1 | D168 V169 Q170 E175 K176 | D168-F172 WeakPolarHBondContact O-CB 3.25Å; D168-F172 PolarHBondContact O-N 2.87Å; V169-F172 PolarHBondContact O-N 2.67Å; Q170-F172 VanDerWaalsContact C-N 3.33Å; Q170-F172 PolarHBondContact O-N 2.85Å; F172-E175 PolarHBondContact O-N 3.29Å; F172-K176 HydrophobicContact CE1-CD 4.38Å; F172-K176 VanDerWaalsContact O-CB 3.27Å; F172-K176 WeakPolarHBondContact O-CB 3.38Å; F172-K176 PolarHBondContact O-N 2.86Å |
| 173 | N | 98.3 | Very high | 98.2 | Very high | 79 Ų | 79 | 103.3 Ų | 103.3 | 42% | 0.422 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66 | -40 | 178.4 | -75.4 | -35.3 | 0 | 0 | 0 | 112.3 | V169 Q170 K171 K176 E177 | V169-N173 PolarHBondContact O-N 3.28Å; V169-N173 PolarHBondContact O-ND2 3.19Å; Q170-N173 WeakPolarHBondContact O-CB 3.41Å; Q170-N173 PolarHBondContact O-N 3.04Å; Q170-N173 VanDerWaalsContact O-N 3.09Å; K171-N173 VanDerWaalsContact C-N 3.32Å; K171-N173 PolarHBondContact O-N 2.62Å; N173-K176 PolarHBondContact O-N 3.46Å; N173-E177 PolarHBondContact O-N 3.34Å |
| 174 | E | 98.3 | Very high | 98.2 | Very high | 107 Ų | 107 | 102.4 Ų | 102.4 | 50% | 0.5 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.1 | -43.9 | 174.4 | -68.4 | 178.1 | -170.3 | 0 | 0 | 112.3 | Q170 K171 E177 K178 | Q170-E174 PolarHBondContact O-N 3.42Å; K171-E174 PolarHBondContact O-N 3.25Å; E174-E177 PolarHBondContact O-N 3.04Å; E174-K178 WeakPolarHBondContact O-CG 3.49Å; E174-K178 PolarHBondContact O-N 3.3Å |
| 175 | E | 98.2 | Very high | 98.2 | Very high | 129 Ų | 129 | 103.3 Ų | 103.3 | 60% | 0.603 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.6 | -41.9 | 177.6 | -173.9 | 174.6 | 179.4 | 0 | 0 | 111.5 | K171 F172 E177 K178 S179 | K171-E175 PolarHBondContact O-N 2.97Å; F172-E175 PolarHBondContact O-N 3.29Å; E175-E177 VanDerWaalsContact C-N 3.33Å; E175-E177 PolarHBondContact O-N 2.92Å; E175-K178 PolarHBondContact O-N 3.4Å; E175-S179 WeakPolarHBondContact O-CB 3.36Å; E175-S179 PolarHBondContact O-N 3.14Å |
| 176 | K | 98.1 | Very high | 98.2 | Very high | 119 Ų | 119 | 107 Ų | 107 | 52% | 0.517 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -58.2 | -45 | 173.8 | 178.5 | -172.8 | 171.7 | -172 | 0 | 111.4 | F172 N173 S179 V180 | F172-K176 HydrophobicContact CE1-CD 4.38Å; F172-K176 VanDerWaalsContact O-CB 3.27Å; F172-K176 WeakPolarHBondContact O-CB 3.38Å; F172-K176 PolarHBondContact O-N 2.86Å; N173-K176 PolarHBondContact O-N 3.46Å; K176-S179 WeakPolarHBondContact O-CB 3.33Å; K176-S179 PolarHBondContact O-N 2.93Å; K176-V180 VanDerWaalsContact O-CG2 3.3Å; K176-V180 WeakPolarHBondContact O-CG2 3.44Å; K176-V180 PolarHBondContact O-N 2.88Å |
| 177 | E | 98.1 | Very high | 98.2 | Very high | 127 Ų | 127 | 107.6 Ų | 107.6 | 59% | 0.593 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63 | -44.7 | 178.1 | -173.1 | 177.9 | 176.7 | 0 | 0 | 111.7 | N173 E174 E175 S179 V180 N181 | N173-E177 PolarHBondContact O-N 3.34Å; E174-E177 PolarHBondContact O-N 3.04Å; E175-E177 VanDerWaalsContact C-N 3.33Å; E175-E177 PolarHBondContact O-N 2.92Å; E177-S179 VanDerWaalsContact C-N 3.32Å; E177-S179 PolarHBondContact O-N 3.37Å; E177-V180 PolarHBondContact O-N 3.49Å; E177-N181 PolarHBondContact O-N 3.04Å; E177-N181 PolarHBondContact O-ND2 3.45Å |
| 178 | K | 98.2 | Very high | 98.2 | Very high | 142 Ų | 142 | 106.8 Ų | 106.8 | 62% | 0.617 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -57.4 | -44.8 | 173.7 | -71.5 | 169.7 | -175.6 | 166.8 | 0 | 111.7 | E174 E175 N181 S182 | E174-K178 WeakPolarHBondContact O-CG 3.49Å; E174-K178 PolarHBondContact O-N 3.3Å; E175-K178 PolarHBondContact O-N 3.4Å; K178-N181 PolarHBondContact O-N 3.1Å; K178-S182 PolarHBondContact O-N 2.89Å |
| 179 | S | 97.7 | Very high | 98.2 | Very high | 78 Ų | 78 | 105.4 Ų | 105.4 | 55% | 0.545 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.8 | -45.5 | 178.4 | -171.4 | 0 | 0 | 0 | 0 | 112.2 | E175 K176 E177 N181 S182 C183 | E175-S179 WeakPolarHBondContact O-CB 3.36Å; E175-S179 PolarHBondContact O-N 3.14Å; K176-S179 WeakPolarHBondContact O-CB 3.33Å; K176-S179 PolarHBondContact O-N 2.93Å; E177-S179 VanDerWaalsContact C-N 3.32Å; E177-S179 PolarHBondContact O-N 3.37Å; S179-N181 PolarHBondContact O-N 3.35Å; S179-S182 PolarHBondContact O-N 2.9Å; S179-C183 WeakPolarHBondContact O-CB 3.36Å; S179-C183 PolarHBondContact O-N 3.34Å |
| 180 | V | 98.4 | Very high | 98.2 | Very high | 82 Ų | 82 | 107.2 Ų | 107.2 | 50% | 0.497 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -59.6 | -45.7 | 176.3 | 169 | 0 | 0 | 0 | 0 | 111.1 | K176 E177 S182 C183 Q184 | K176-V180 VanDerWaalsContact O-CG2 3.3Å; K176-V180 WeakPolarHBondContact O-CG2 3.44Å; K176-V180 PolarHBondContact O-N 2.88Å; E177-V180 PolarHBondContact O-N 3.49Å; V180-S182 VanDerWaalsContact C-N 3.34Å; V180-S182 PolarHBondContact O-N 3.34Å; V180-C183 PolarHBondContact O-N 2.75Å; V180-Q184 PolarHBondContact O-N 3.43Å |
| 181 | N | 98.2 | Very high | 98.2 | Very high | 74 Ų | 74 | 107.6 Ų | 107.6 | 40% | 0.396 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.5 | -40 | 177.8 | -72.8 | -27.6 | 0 | 0 | 0 | 112.3 | E177 K178 S179 Q184 K185 | E177-N181 PolarHBondContact O-N 3.04Å; E177-N181 PolarHBondContact O-ND2 3.45Å; K178-N181 PolarHBondContact O-N 3.1Å; S179-N181 PolarHBondContact O-N 3.35Å; N181-Q184 PolarHBondContact O-N 3.48Å; N181-K185 WeakPolarHBondContact O-CG 3.33Å; N181-K185 PolarHBondContact O-N 2.72Å |
| 182 | S | 98 | Very high | 98.1 | Very high | 73 Ų | 73 | 107 Ų | 107 | 51% | 0.51 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.8 | -47 | 175.3 | -167.9 | 0 | 0 | 0 | 0 | 111.7 | K178 S179 V180 Q184 K185 E186 | K178-S182 PolarHBondContact O-N 2.89Å; S179-S182 PolarHBondContact O-N 2.9Å; V180-S182 VanDerWaalsContact C-N 3.34Å; V180-S182 PolarHBondContact O-N 3.34Å; S182-Q184 VanDerWaalsContact C-N 3.29Å; S182-Q184 PolarHBondContact O-N 3.01Å; S182-K185 PolarHBondContact O-N 2.86Å; S182-K185 VanDerWaalsContact O-N 3.15Å; S182-E186 PolarHBondContact O-N 2.7Å |
| 183 | C | 97.8 | Very high | 98.1 | Very high | 78 Ų | 78 | 104.6 Ų | 104.6 | 53% | 0.527 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.2 | -39.9 | 177.7 | -177.4 | 0 | 0 | 0 | 0 | 111.7 | S179 V180 E186 Q187 | S179-C183 WeakPolarHBondContact O-CB 3.36Å; S179-C183 PolarHBondContact O-N 3.34Å; V180-C183 PolarHBondContact O-N 2.75Å; C183-E186 PolarHBondContact O-N 2.96Å; C183-Q187 VanDerWaalsContact O-CB 3.3Å; C183-Q187 WeakPolarHBondContact O-CB 3.5Å; C183-Q187 PolarHBondContact O-N 2.91Å |
| 184 | Q | 98.3 | Very high | 98.1 | Very high | 98 Ų | 98 | 107.1 Ų | 107.1 | 46% | 0.458 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.6 | -42.5 | 175.7 | -176.3 | 177.9 | -16.7 | 0 | 0 | 112.4 | V180 N181 S182 Q187 Q188 | V180-Q184 PolarHBondContact O-N 3.43Å; N181-Q184 PolarHBondContact O-N 3.48Å; S182-Q184 VanDerWaalsContact C-N 3.29Å; S182-Q184 PolarHBondContact O-N 3.01Å; Q184-Q187 PolarHBondContact O-N 3.42Å; Q184-Q188 WeakPolarHBondContact O-CG 3.33Å; Q184-Q188 PolarHBondContact O-N 2.9Å |
| 185 | K | 98.3 | Very high | 98.1 | Very high | 152 Ų | 152 | 105.1 Ų | 105.1 | 66% | 0.661 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63.1 | -45.7 | 176.2 | -71.4 | 178.1 | -179.6 | 179.5 | 0 | 111.4 | N181 S182 Q187 Q188 A189 | N181-K185 WeakPolarHBondContact O-CG 3.33Å; N181-K185 PolarHBondContact O-N 2.72Å; S182-K185 PolarHBondContact O-N 2.86Å; S182-K185 VanDerWaalsContact O-N 3.15Å; K185-Q187 VanDerWaalsContact C-N 3.34Å; K185-Q187 PolarHBondContact O-N 3.44Å; K185-Q188 PolarHBondContact O-N 3.49Å; K185-A189 PolarHBondContact O-N 2.84Å |
| 186 | E | 97.7 | Very high | 98.1 | Very high | 136 Ų | 136 | 102 Ų | 102 | 64% | 0.636 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.9 | -41.3 | 177.6 | -171.1 | 175.8 | -178.5 | 0 | 0 | 111.5 | S182 C183 Q188 A189 L190 | S182-E186 PolarHBondContact O-N 2.7Å; C183-E186 PolarHBondContact O-N 2.96Å; E186-Q188 VanDerWaalsContact C-N 3.31Å; E186-Q188 PolarHBondContact O-N 3.4Å; E186-A189 PolarHBondContact O-N 3.18Å; E186-L190 WeakPolarHBondContact O-CB 3.3Å; E186-L190 PolarHBondContact O-N 3.09Å |
| 187 | Q | 98.1 | Very high | 98.1 | Very high | 108 Ų | 108 | 102.6 Ų | 102.6 | 51% | 0.505 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.7 | -39.5 | 174.9 | -169.8 | -175.1 | 24.9 | 0 | 0 | 112.2 | C183 Q184 K185 K191 | C183-Q187 VanDerWaalsContact O-CB 3.3Å; C183-Q187 WeakPolarHBondContact O-CB 3.5Å; C183-Q187 PolarHBondContact O-N 2.91Å; Q184-Q187 PolarHBondContact O-N 3.42Å; K185-Q187 VanDerWaalsContact C-N 3.34Å; K185-Q187 PolarHBondContact O-N 3.44Å; Q187-K191 WeakPolarHBondContact O-CG 3.36Å; Q187-K191 PolarHBondContact O-N 3.41Å; Q187-K191 VanDerWaalsContact O-N 3.14Å |
| 188 | Q | 98.3 | Very high | 98.1 | Very high | 108 Ų | 108 | 100.5 Ų | 100.5 | 51% | 0.505 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.9 | -45.2 | 175.2 | -72.8 | 178.5 | -1.1 | 0 | 0 | 111.7 | Q184 K185 E186 L190 K191 L192 | Q184-Q188 WeakPolarHBondContact O-CG 3.33Å; Q184-Q188 PolarHBondContact O-N 2.9Å; K185-Q188 PolarHBondContact O-N 3.49Å; E186-Q188 VanDerWaalsContact C-N 3.31Å; E186-Q188 PolarHBondContact O-N 3.4Å; Q188-L190 VanDerWaalsContact C-N 3.31Å; Q188-L190 PolarHBondContact O-N 2.8Å; Q188-K191 PolarHBondContact O-N 3.27Å; Q188-L192 PolarHBondContact O-N 2.96Å; Q188-L192 VanDerWaalsContact O-N 3.08Å |
| 189 | A | 98.3 | Very high | 98.1 | Very high | 58 Ų | 58 | 99.9 Ų | 99.9 | 48% | 0.479 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -59.4 | -42 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | K185 E186 L192 S193 | K185-A189 PolarHBondContact O-N 2.84Å; E186-A189 PolarHBondContact O-N 3.18Å; A189-L192 PolarHBondContact O-N 3.26Å; A189-S193 WeakPolarHBondContact O-CB 3.49Å; A189-S193 PolarHBondContact O-N 3.4Å |
| 190 | L | 98.2 | Very high | 98.1 | Very high | 113 Ų | 113 | 100.1 Ų | 100.1 | 59% | 0.592 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.6 | -40 | 177.4 | -174.7 | 140.1 | 0 | 0 | 0 | 112.4 | E186 Q188 S193 K194 | E186-L190 WeakPolarHBondContact O-CB 3.3Å; E186-L190 PolarHBondContact O-N 3.09Å; Q188-L190 VanDerWaalsContact C-N 3.31Å; Q188-L190 PolarHBondContact O-N 2.8Å; L190-S193 PolarHBondContact O-N 2.71Å; L190-K194 WeakPolarHBondContact O-CB 3.44Å; L190-K194 PolarHBondContact O-N 2.91Å |
| 191 | K | 98.2 | Very high | 98 | Very high | 133 Ų | 133 | 100.6 Ų | 100.6 | 58% | 0.578 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.6 | -44.5 | 174 | -75.5 | 176 | -178.9 | 178.6 | 0 | 111.9 | Q187 Q188 K194 C195 | Q187-K191 WeakPolarHBondContact O-CG 3.36Å; Q187-K191 PolarHBondContact O-N 3.41Å; Q187-K191 VanDerWaalsContact O-N 3.14Å; Q188-K191 PolarHBondContact O-N 3.27Å; K191-K194 PolarHBondContact O-N 3.12Å; K191-C195 PolarHBondContact O-N 3.47Å; K191-C195 VanDerWaalsContact O-N 3.07Å |
| 192 | L | 98.2 | Very high | 98 | Very high | 125 Ų | 125 | 102 Ų | 102 | 65% | 0.654 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65 | -45.1 | 178.3 | -71.2 | 173.7 | 0 | 0 | 0 | 111.8 | Q188 A189 K194 C195 S196 | Q188-L192 PolarHBondContact O-N 2.96Å; Q188-L192 VanDerWaalsContact O-N 3.08Å; A189-L192 PolarHBondContact O-N 3.26Å; L192-K194 VanDerWaalsContact C-N 3.34Å; L192-K194 PolarHBondContact O-N 3.05Å; L192-C195 WeakPolarHBondContact O-CB 3.33Å; L192-C195 PolarHBondContact O-N 2.95Å; L192-S196 PolarHBondContact O-N 2.93Å |
| 193 | S | 97.9 | Very high | 98 | Very high | 78 Ų | 78 | 101.1 Ų | 101.1 | 55% | 0.545 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -57.8 | -45.4 | 176.3 | 177.1 | 0 | 0 | 0 | 0 | 111.8 | A189 L190 C195 S196 Q197 | A189-S193 WeakPolarHBondContact O-CB 3.49Å; A189-S193 PolarHBondContact O-N 3.4Å; L190-S193 PolarHBondContact O-N 2.71Å; S193-C195 PolarHBondContact O-N 3.42Å; S193-S196 PolarHBondContact O-N 3.46Å; S193-Q197 PolarHBondContact O-N 2.84Å |
| 194 | K | 98.2 | Very high | 98 | Very high | 132 Ų | 132 | 101.1 Ų | 101.1 | 57% | 0.574 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.3 | -40.6 | 176.4 | -172.3 | 175.4 | -179.6 | 176.1 | 0 | 112.6 | L190 K191 L192 N198 | L190-K194 WeakPolarHBondContact O-CB 3.44Å; L190-K194 PolarHBondContact O-N 2.91Å; K191-K194 PolarHBondContact O-N 3.12Å; L192-K194 VanDerWaalsContact C-N 3.34Å; L192-K194 PolarHBondContact O-N 3.05Å; K194-N198 PolarHBondContact O-N 3.43Å; K194-N198 VanDerWaalsContact O-N 3.11Å |
| 195 | C | 98 | Very high | 98 | Very high | 65 Ų | 65 | 101.4 Ų | 101.4 | 44% | 0.439 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.1 | -47.5 | 175.7 | -171.8 | 0 | 0 | 0 | 0 | 111.4 | K191 L192 S193 Q197 N198 Q199 | K191-C195 PolarHBondContact O-N 3.47Å; K191-C195 VanDerWaalsContact O-N 3.07Å; L192-C195 WeakPolarHBondContact O-CB 3.33Å; L192-C195 PolarHBondContact O-N 2.95Å; S193-C195 PolarHBondContact O-N 3.42Å; C195-Q197 PolarHBondContact O-N 3.29Å; C195-N198 PolarHBondContact O-N 3Å; C195-Q199 WeakPolarHBondContact O-CG 3.31Å; C195-Q199 PolarHBondContact O-N 3.44Å |
| 196 | S | 97.6 | Very high | 98 | Very high | 63 Ų | 63 | 99 Ų | 99 | 44% | 0.441 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.1 | -44.9 | 177.8 | 175.2 | 0 | 0 | 0 | 0 | 112.1 | L192 S193 N198 Q199 T200 | L192-S196 PolarHBondContact O-N 2.93Å; S193-S196 PolarHBondContact O-N 3.46Å; S196-N198 VanDerWaalsContact C-N 3.32Å; S196-N198 PolarHBondContact O-N 2.75Å; S196-Q199 PolarHBondContact O-N 2.87Å; S196-T200 PolarHBondContact O-N 3.22Å; S196-T200 PolarHBondContact O-OG1 3.47Å; S196-T200 VanDerWaalsContact O-OG1 3.13Å |
| 197 | Q | 97.9 | Very high | 98 | Very high | 132 Ų | 132 | 98.2 Ų | 98.2 | 62% | 0.617 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -59.3 | -43 | 176.8 | -173 | -178.8 | 20.6 | 0 | 0 | 112 | S193 C195 T200 L201 | S193-Q197 PolarHBondContact O-N 2.84Å; C195-Q197 PolarHBondContact O-N 3.29Å; Q197-T200 PolarHBondContact O-N 3.39Å; Q197-L201 WeakPolarHBondContact O-CB 3.43Å; Q197-L201 PolarHBondContact O-N 3.38Å |
| 198 | N | 98 | Very high | 98 | Very high | 83 Ų | 83 | 99 Ų | 99 | 44% | 0.444 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.4 | -43 | 176.4 | -73.9 | -15.2 | 0 | 0 | 0 | 111.7 | K194 C195 S196 L201 E202 | K194-N198 PolarHBondContact O-N 3.43Å; K194-N198 VanDerWaalsContact O-N 3.11Å; C195-N198 PolarHBondContact O-N 3Å; S196-N198 VanDerWaalsContact C-N 3.32Å; S196-N198 PolarHBondContact O-N 2.75Å; N198-L201 WeakPolarHBondContact O-CB 3.34Å; N198-L201 PolarHBondContact O-N 2.96Å; N198-E202 WeakPolarHBondContact O-CG 3.36Å; N198-E202 PolarHBondContact O-N 3.47Å |
| 199 | Q | 97.8 | Very high | 97.9 | Very high | 128 Ų | 128 | 100.4 Ų | 100.4 | 60% | 0.598 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.9 | -43.5 | 176.4 | -71.9 | 174 | -17.8 | 0 | 0 | 112 | C195 S196 L201 E202 A203 | C195-Q199 WeakPolarHBondContact O-CG 3.31Å; C195-Q199 PolarHBondContact O-N 3.44Å; S196-Q199 PolarHBondContact O-N 2.87Å; Q199-L201 VanDerWaalsContact C-N 3.32Å; Q199-L201 PolarHBondContact O-N 3.4Å; Q199-E202 PolarHBondContact O-N 3.32Å; Q199-A203 PolarHBondContact O-N 2.93Å |
| 200 | T | 98 | Very high | 97.8 | Very high | 84 Ų | 84 | 102.9 Ų | 102.9 | 52% | 0.515 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.4 | -41.8 | 175.4 | -57 | 0 | 0 | 0 | 0 | 111.4 | S196 Q197 A203 V204 | S196-T200 PolarHBondContact O-N 3.22Å; S196-T200 PolarHBondContact O-OG1 3.47Å; S196-T200 VanDerWaalsContact O-OG1 3.13Å; Q197-T200 PolarHBondContact O-N 3.39Å; T200-A203 PolarHBondContact O-N 2.89Å; T200-V204 WeakPolarHBondContact O-CG2 3.38Å; T200-V204 PolarHBondContact O-N 2.97Å |
| 201 | L | 98 | Very high | 97.7 | Very high | 91 Ų | 91 | 100.3 Ų | 100.3 | 48% | 0.476 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.2 | -44.4 | 176.6 | 179.4 | 63.3 | 0 | 0 | 0 | 111.9 | Q197 N198 Q199 V204 K205 | Q197-L201 WeakPolarHBondContact O-CB 3.43Å; Q197-L201 PolarHBondContact O-N 3.38Å; N198-L201 WeakPolarHBondContact O-CB 3.34Å; N198-L201 PolarHBondContact O-N 2.96Å; Q199-L201 VanDerWaalsContact C-N 3.32Å; Q199-L201 PolarHBondContact O-N 3.4Å; L201-V204 PolarHBondContact O-N 2.92Å; L201-K205 WeakPolarHBondContact O-CG 3.27Å; L201-K205 PolarHBondContact O-N 3.14Å |
| 202 | E | 98.1 | Very high | 97.5 | Very high | 104 Ų | 104 | 98 Ų | 98 | 49% | 0.486 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.1 | -41.5 | 176.7 | -67.6 | -52.9 | 130 | 0 | 0 | 112 | N198 Q199 V204 K205 E206 | N198-E202 WeakPolarHBondContact O-CG 3.36Å; N198-E202 PolarHBondContact O-N 3.47Å; Q199-E202 PolarHBondContact O-N 3.32Å; E202-V204 VanDerWaalsContact C-N 3.33Å; E202-V204 PolarHBondContact O-N 3.48Å; E202-K205 WeakPolarHBondContact O-CB 3.48Å; E202-K205 PolarHBondContact O-N 2.9Å; E202-K205 IonicContact OE1-NZ 2.75Å; E202-K205 PolarHBondContact OE1-NZ 3.32Å; E202-K205 IonicContact OE2-NZ 3.9Å; E202-E206 PolarHBondContact O-N 2.89Å |
| 203 | A | 98 | Very high | 97.4 | Very high | 55 Ų | 55 | 97.2 Ų | 97.2 | 46% | 0.455 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.4 | -38.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q199 T200 M207 | Q199-A203 PolarHBondContact O-N 2.93Å; T200-A203 PolarHBondContact O-N 2.89Å; A203-M207 WeakPolarHBondContact O-CB 3.21Å; A203-M207 PolarHBondContact O-N 3.45Å |
| 204 | V | 98 | Very high | 97.2 | Very high | 78 Ų | 78 | 97.5 Ų | 97.5 | 47% | 0.473 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.7 | -41.2 | 174.9 | 171 | 0 | 0 | 0 | 0 | 111.1 | T200 L201 E202 M207 H208 | T200-V204 WeakPolarHBondContact O-CG2 3.38Å; T200-V204 PolarHBondContact O-N 2.97Å; L201-V204 PolarHBondContact O-N 2.92Å; E202-V204 VanDerWaalsContact C-N 3.33Å; E202-V204 PolarHBondContact O-N 3.48Å; V204-M207 PolarHBondContact O-N 2.89Å; V204-H208 WeakPolarHBondContact O-CB 3.45Å; V204-H208 PolarHBondContact O-N 3.24Å |
| 205 | K | 97.9 | Very high | 97 | Very high | 104 Ų | 104 | 96.4 Ų | 96.4 | 45% | 0.452 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.8 | -46.8 | 175.6 | -71.6 | 174 | -176.2 | 169.2 | 0 | 111.9 | L201 E202 M207 H208 E209 | L201-K205 WeakPolarHBondContact O-CG 3.27Å; L201-K205 PolarHBondContact O-N 3.14Å; E202-K205 WeakPolarHBondContact O-CB 3.48Å; E202-K205 PolarHBondContact O-N 2.9Å; E202-K205 IonicContact OE1-NZ 2.75Å; E202-K205 PolarHBondContact OE1-NZ 3.32Å; E202-K205 IonicContact OE2-NZ 3.9Å; K205-M207 VanDerWaalsContact C-N 3.35Å; K205-M207 PolarHBondContact O-N 2.88Å; K205-H208 WeakPolarHBondContact O-CB 3.48Å; K205-H208 PolarHBondContact O-N 3.39Å; K205-E209 PolarHBondContact O-N 3.36Å |
| 206 | E | 97.8 | Very high | 96.6 | Very high | 101 Ų | 101 | 99 Ų | 99 | 47% | 0.472 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62 | -42 | 178.6 | -172.5 | -171.8 | 166.2 | 0 | 0 | 111.5 | E202 H208 E209 K210 | E202-E206 PolarHBondContact O-N 2.89Å; E206-H208 VanDerWaalsContact C-N 3.35Å; E206-H208 PolarHBondContact O-N 3.03Å; E206-E209 PolarHBondContact O-N 2.81Å; E206-K210 HydrophobicContact CG-CD 4.47Å; E206-K210 WeakPolarHBondContact O-CG 3.42Å; E206-K210 PolarHBondContact O-N 3.5Å; E206-K210 WeakPolarHBondContact OE1-CE 3.47Å; E206-K210 IonicContact OE1-NZ 2.62Å; E206-K210 PolarHBondContact OE1-NZ 3.29Å |
| 207 | M | 97.3 | Very high | 96.3 | Very high | 120 Ų | 120 | 100.4 Ų | 100.4 | 59% | 0.591 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.9 | -42.8 | 175.4 | -173 | -140.9 | -61.9 | 0 | 0 | 111.7 | A203 V204 K205 S211 | A203-M207 WeakPolarHBondContact O-CB 3.21Å; A203-M207 PolarHBondContact O-N 3.45Å; V204-M207 PolarHBondContact O-N 2.89Å; K205-M207 VanDerWaalsContact C-N 3.35Å; K205-M207 PolarHBondContact O-N 2.88Å; M207-S211 WeakPolarHBondContact O-CB 3.26Å; M207-S211 PolarHBondContact O-N 2.96Å; M207-S211 PolarHBondContact O-OG 3.36Å |
| 208 | H | 97.6 | Very high | 95.9 | Very high | 123 Ų | 123 | 98.9 Ų | 98.9 | 57% | 0.569 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.6 | -45.7 | 176.5 | 173.7 | -88.1 | 0 | 0 | 0 | 111.4 | V204 K205 E206 S211 M212 | V204-H208 WeakPolarHBondContact O-CB 3.45Å; V204-H208 PolarHBondContact O-N 3.24Å; K205-H208 WeakPolarHBondContact O-CB 3.48Å; K205-H208 PolarHBondContact O-N 3.39Å; E206-H208 VanDerWaalsContact C-N 3.35Å; E206-H208 PolarHBondContact O-N 3.03Å; H208-S211 PolarHBondContact O-N 2.9Å; H208-M212 WeakPolarHBondContact O-CG 3.09Å; H208-M212 PolarHBondContact O-N 2.91Å |
| 209 | E | 96.8 | Very high | 95.1 | Very high | 139 Ų | 139 | 97.6 Ų | 97.6 | 65% | 0.65 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.2 | -49.1 | 177.1 | -173.7 | 171.6 | -167.6 | 0 | 0 | 111.9 | K205 E206 S211 M212 E213 | K205-E209 PolarHBondContact O-N 3.36Å; E206-E209 PolarHBondContact O-N 2.81Å; E209-S211 VanDerWaalsContact C-N 3.31Å; E209-S211 PolarHBondContact O-N 3.2Å; E209-M212 PolarHBondContact O-N 3.49Å; E209-E213 PolarHBondContact O-N 3.3Å |
| 210 | K | 96.6 | Very high | 93.9 | Very high | 110 Ų | 110 | 96.7 Ų | 96.7 | 48% | 0.478 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.4 | -40.1 | 174.7 | -72.6 | 176.5 | -175.4 | 168.7 | 0 | 112.6 | E206 E213 V214 | E206-K210 HydrophobicContact CG-CD 4.47Å; E206-K210 WeakPolarHBondContact O-CG 3.42Å; E206-K210 PolarHBondContact O-N 3.5Å; E206-K210 WeakPolarHBondContact OE1-CE 3.47Å; E206-K210 IonicContact OE1-NZ 2.62Å; E206-K210 PolarHBondContact OE1-NZ 3.29Å; K210-E213 PolarHBondContact O-N 3.27Å; K210-V214 WeakPolarHBondContact O-CG2 3.37Å; K210-V214 PolarHBondContact O-N 3.18Å |
| 211 | S | 95.7 | Very high | 92.1 | Very high | 58 Ų | 58 | 101 Ų | 101 | 41% | 0.406 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.2 | -43.2 | 178.2 | -59.7 | 0 | 0 | 0 | 0 | 111.4 | M207 H208 E209 V214 L215 | M207-S211 WeakPolarHBondContact O-CB 3.26Å; M207-S211 PolarHBondContact O-N 2.96Å; M207-S211 PolarHBondContact O-OG 3.36Å; H208-S211 PolarHBondContact O-N 2.9Å; E209-S211 VanDerWaalsContact C-N 3.31Å; E209-S211 PolarHBondContact O-N 3.2Å; S211-V214 PolarHBondContact O-N 3.45Å; S211-L215 WeakPolarHBondContact O-CG 3.31Å; S211-L215 PolarHBondContact O-N 2.99Å |
| 212 | M | 94.8 | Very high | 89.7 | Confident | 84 Ų | 84 | 109.6 Ų | 109.6 | 41% | 0.414 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.2 | -40.8 | 175.5 | -70.8 | -62 | -65.1 | 0 | 0 | 111.8 | H208 E209 L215 M216 | H208-M212 WeakPolarHBondContact O-CG 3.09Å; H208-M212 PolarHBondContact O-N 2.91Å; E209-M212 PolarHBondContact O-N 3.49Å; M212-L215 PolarHBondContact O-N 2.96Å; M212-L215 HydrophobicContact SD-CD1 4.44Å; M212-M216 HydrophobicContact CB-CE 4.41Å; M212-M216 WeakPolarHBondContact O-CG 3.5Å; M212-M216 PolarHBondContact O-N 3.5Å |
| 213 | E | 94.8 | Very high | 89.2 | Confident | 109 Ų | 109 | 109.9 Ų | 109.9 | 51% | 0.509 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -60 | -46.2 | 175.2 | -173.4 | -177.9 | -178.1 | 0 | 0 | 112.2 | E209 K210 L215 M216 N217 | E209-E213 PolarHBondContact O-N 3.3Å; K210-E213 PolarHBondContact O-N 3.27Å; E213-L215 VanDerWaalsContact C-N 3.34Å; E213-L215 PolarHBondContact O-N 2.74Å; E213-M216 PolarHBondContact O-N 3.01Å; E213-N217 WeakPolarHBondContact O-CB 3.41Å; E213-N217 VanDerWaalsContact O-CG 3.29Å; E213-N217 PolarHBondContact O-N 2.93Å; E213-N217 PolarHBondContact O-ND2 2.92Å |
| 214 | V | 94.5 | Very high | 88.8 | Confident | 84 Ų | 84 | 112.8 Ų | 112.8 | 51% | 0.509 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -59.5 | -44.6 | 175.6 | 169.5 | 0 | 0 | 0 | 0 | 111.3 | K210 S211 N217 L218 | K210-V214 WeakPolarHBondContact O-CG2 3.37Å; K210-V214 PolarHBondContact O-N 3.18Å; S211-V214 PolarHBondContact O-N 3.45Å; V214-N217 PolarHBondContact O-N 3.35Å; V214-L218 HydrophobicContact CG1-CD1 3.81Å; V214-L218 WeakPolarHBondContact O-CD1 3.45Å; V214-L218 WeakPolarHBondContact O-CG 3.25Å; V214-L218 PolarHBondContact O-N 3.42Å |
| 215 | L | 92.9 | Very high | 88.3 | Confident | 110 Ų | 110 | 114.7 Ų | 114.7 | 58% | 0.576 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -63.5 | -42.5 | 177.5 | -71 | 173.4 | 0 | 0 | 0 | 112.3 | S211 M212 E213 N217 L218 G219 | S211-L215 WeakPolarHBondContact O-CG 3.31Å; S211-L215 PolarHBondContact O-N 2.99Å; M212-L215 PolarHBondContact O-N 2.96Å; M212-L215 HydrophobicContact SD-CD1 4.44Å; E213-L215 VanDerWaalsContact C-N 3.34Å; E213-L215 PolarHBondContact O-N 2.74Å; L215-N217 PolarHBondContact O-N 3.19Å; L215-L218 PolarHBondContact O-N 3.14Å; L215-G219 PolarHBondContact O-N 3.11Å; L215-G219 VanDerWaalsContact O-N 3.08Å |
| 216 | M | 91.4 | Very high | 87.7 | Confident | 120 Ų | 120 | 115.4 Ų | 115.4 | 59% | 0.591 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -62.5 | -41.3 | 175.6 | -73.1 | -174.4 | -73.8 | 0 | 0 | 111.8 | M212 E213 L218 G219 T220 | M212-M216 HydrophobicContact CB-CE 4.41Å; M212-M216 WeakPolarHBondContact O-CG 3.5Å; M212-M216 PolarHBondContact O-N 3.5Å; E213-M216 PolarHBondContact O-N 3.01Å; M216-L218 VanDerWaalsContact C-N 3.34Å; M216-L218 PolarHBondContact O-N 3.4Å; M216-G219 PolarHBondContact O-N 3.2Å; M216-T220 PolarHBondContact O-N 2.94Å; M216-T220 PolarHBondContact O-OG1 3.3Å |
| 217 | N | 91.2 | Very high | 87.1 | Confident | 91 Ų | 91 | 116.3 Ų | 116.3 | 49% | 0.487 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -70.7 | -25.5 | 178 | -72 | -30.8 | 0 | 0 | 0 | 113.8 | E213 V214 L215 T220 | E213-N217 WeakPolarHBondContact O-CB 3.41Å; E213-N217 VanDerWaalsContact O-CG 3.29Å; E213-N217 PolarHBondContact O-N 2.93Å; E213-N217 PolarHBondContact O-ND2 2.92Å; V214-N217 PolarHBondContact O-N 3.35Å; L215-N217 PolarHBondContact O-N 3.19Å; N217-T220 PolarHBondContact O-OG1 2.97Å; N217-T220 VanDerWaalsContact O-OG1 3.09Å |
| 218 | L | 88.2 | Confident | 86.4 | Confident | 100 Ų | 100 | 116 Ų | 116 | 52% | 0.524 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -76.4 | -37.5 | 172.7 | -82.6 | 155.2 | 0 | 0 | 0 | 111.8 | V214 L215 M216 T220 K221 | V214-L218 HydrophobicContact CG1-CD1 3.81Å; V214-L218 WeakPolarHBondContact O-CD1 3.45Å; V214-L218 WeakPolarHBondContact O-CG 3.25Å; V214-L218 PolarHBondContact O-N 3.42Å; L215-L218 PolarHBondContact O-N 3.14Å; M216-L218 VanDerWaalsContact C-N 3.34Å; M216-L218 PolarHBondContact O-N 3.4Å; L218-T220 VanDerWaalsContact C-N 3.25Å; L218-T220 PolarHBondContact O-N 3Å; L218-K221 PolarHBondContact O-N 2.85Å |
| 219 | G | 81.1 | Confident | 85.6 | Confident | 57 Ų | 57 | 115.5 Ų | 115.5 | 59% | 0.588 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -68.6 | -18.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | L215 M216 | L215-G219 PolarHBondContact O-N 3.11Å; L215-G219 VanDerWaalsContact O-N 3.08Å; M216-G219 PolarHBondContact O-N 3.2Å |
| 220 | T | 72.2 | Confident | 84.7 | Confident | 109 Ų | 109 | 113.7 Ų | 113.7 | 67% | 0.669 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.1 | -3.4 | 178.1 | 51 | 0 | 0 | 0 | 0 | 114.2 | M216 N217 L218 | M216-T220 PolarHBondContact O-N 2.94Å; M216-T220 PolarHBondContact O-OG1 3.3Å; N217-T220 PolarHBondContact O-OG1 2.97Å; N217-T220 VanDerWaalsContact O-OG1 3.09Å; L218-T220 VanDerWaalsContact C-N 3.25Å; L218-T220 PolarHBondContact O-N 3Å |
| 221 | K | 60.8 | Low | 83.8 | Confident | 173 Ų | 173 | 114 Ų | 114 | 75% | 0.752 | 59% | 0.591 | S | S | * | * | trans | -95.8 | 9.6 | -178.8 | -80.7 | -172.7 | 176.5 | 179.5 | 0 | 115.1 | L218 | L218-K221 PolarHBondContact O-N 2.85Š| ||
| 222 | Y | 47.3 | Very low | 82.7 | Confident | 273 Ų | 273 | 119.1 Ų | 119.1 | 100% | 1.071 | 61% | 0.608 | S | S | * | * | trans | -133.4 | 0 | 173.5 | -66.5 | -81.2 | 0 | 0 | 0 | 110 |
Retrieved 222 of 222 residues in 356.7 ms
(Link to these results)