| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 48.4 | Very low | 45.3 | Very low | 242 Ų | 242 | 189.4 Ų | 189.4 | 100% | 1.192 | 89% | 0.893 | S | S | * | * | 0 | 109 | 0 | -85.5 | 168.9 | 166.7 | 0 | 0 | 109.1 | |||||
| 2 | R | 44.7 | Very low | 45.7 | Very low | 245 Ų | 245 | 185.5 Ų | 185.5 | 93% | 0.925 | 88% | 0.88 | S | S | * | * | trans | -77 | 119.2 | 178.1 | -76.4 | -179 | -172.8 | 137.4 | 1.5 | 109.4 | M4 | R2-M4 PolarHBondContact O-N 3.4Š| ||
| 3 | R | 43.3 | Very low | 45.9 | Very low | 251 Ų | 251 | 179.2 Ų | 179.2 | 95% | 0.947 | 86% | 0.864 | S | S | * | * | trans | -75.8 | 106.3 | 165.2 | -69.7 | -178.7 | -178 | 155.4 | -0.2 | 107.7 | S5 | R3-S5 PolarHBondContact O-N 3.47Š| ||
| 4 | M | 42.3 | Very low | 46.5 | Very low | 178 Ų | 178 | 177.5 Ų | 177.5 | 88% | 0.877 | 85% | 0.851 | S | S | * | * | trans | -73.3 | 120.1 | 169.1 | -75.3 | -89.3 | -86.2 | 0 | 0 | 108 | R2 | R2-M4 PolarHBondContact O-N 3.4Š| ||
| 5 | S | 47.7 | Very low | 46.7 | Very low | 95 Ų | 95 | 177.7 Ų | 177.7 | 66% | 0.664 | 85% | 0.85 | S | S | * | * | trans | -78.3 | 121.4 | 176.4 | 40.4 | 0 | 0 | 0 | 0 | 109.7 | R3 K7 | R3-S5 PolarHBondContact O-N 3.47Å; S5-K7 PolarHBondContact O-N 3.12Å | ||
| 6 | L | 45.3 | Very low | 46.4 | Very low | 185 Ų | 185 | 171.3 Ų | 171.3 | 97% | 0.969 | 85% | 0.845 | S | S | * | * | trans | -69.6 | 81.6 | 168.2 | -79.3 | 152.4 | 0 | 0 | 0 | 108.7 | ||||
| 7 | K | 49.3 | Very low | 46.4 | Very low | 181 Ų | 181 | 169.6 Ų | 169.6 | 79% | 0.787 | 83% | 0.829 | S | S | * | * | trans | -124.4 | 51.9 | 172.9 | -71.2 | -169.9 | 178.8 | -173.4 | 0 | 111.2 | S5 | S5-K7 PolarHBondContact O-N 3.12Š| ||
| 8 | K | 47.1 | Very low | 46.4 | Very low | 200 Ų | 200 | 168.3 Ų | 168.3 | 87% | 0.87 | 83% | 0.825 | S | S | * | * | trans | -152.4 | 67.4 | 165.4 | -66.5 | -162.6 | 179.9 | -175.7 | 0 | 110.7 | K10 | K8-K10 PolarHBondContact O-N 3.33Š| ||
| 9 | L | 37.9 | Very low | 46.2 | Very low | 179 Ų | 179 | 166.3 Ų | 166.3 | 94% | 0.937 | 82% | 0.817 | S | S | * | * | trans | -73.2 | 103.2 | 156.5 | -139.5 | 81.8 | 0 | 0 | 0 | 105.9 | V11 | L9-V11 PolarHBondContact O-N 3.37Š| ||
| 10 | K | 47.3 | Very low | 46.3 | Very low | 189 Ų | 189 | 160.1 Ų | 160.1 | 82% | 0.822 | 79% | 0.787 | S | S | * | * | trans | -67.8 | 116.6 | -179 | -149.1 | 165.7 | -178.7 | 173.4 | 0 | 106.6 | K8 I12 | K8-K10 PolarHBondContact O-N 3.33Å; K10-I12 PolarHBondContact O-N 3.37Å | ||
| 11 | V | 45.3 | Very low | 46.3 | Very low | 138 Ų | 138 | 158.6 Ų | 158.6 | 84% | 0.836 | 78% | 0.782 | S | S | * | * | trans | -48.3 | 110.5 | 173.2 | 174.5 | 0 | 0 | 0 | 0 | 108.3 | L9 | L9-V11 PolarHBondContact O-N 3.37Š| ||
| 12 | I | 50.4 | Low | 46.2 | Very low | 143 Ų | 143 | 150.4 Ų | 150.4 | 73% | 0.733 | 74% | 0.743 | S | S | * | * | trans | -76.8 | 128.5 | 174.6 | -61 | 174.1 | 0 | 0 | 0 | 106.7 | K10 | K10-I12 PolarHBondContact O-N 3.37Š| ||
| 13 | P | 47.7 | Very low | 46.2 | Very low | 104 Ų | 104 | 146.6 Ų | 146.6 | 68% | 0.675 | 73% | 0.734 | S | S | * | * | trans | -57.1 | 138.8 | 179.2 | -21.6 | 31.9 | 0 | 0 | 0 | 111.8 | E15 | P13-E15 VanDerWaalsContact C-N 3.25Å; P13-E15 PolarHBondContact O-N 3.43Å | ||
| 14 | K | 54.3 | Low | 46.4 | Very low | 155 Ų | 155 | 141.4 Ų | 141.4 | 67% | 0.674 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -78.9 | 4.5 | -175.3 | -71.7 | -165.3 | 165 | -179 | 0 | 114.8 | Y17 | K14-Y17 HydrophobicContact CB-CE2 3.8Å; K14-Y17 HydrophobicContact CG-CE2 4.04Å; K14-Y17 WeakPolarHBondContact CG-OH 3.35Å; K14-Y17 VanDerWaalsContact O-CD2 3.23Å; K14-Y17 WeakPolarHBondContact O-CD2 3.43Å; K14-Y17 WeakPolarHBondContact O-CE2 3.5Å |
| 15 | E | 49.9 | Very low | 46.8 | Very low | 180 Ų | 180 | 139.3 Ų | 139.3 | 84% | 0.841 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -100.8 | 97.3 | 176.4 | -101.2 | 66.6 | -144.5 | 0 | 0 | 109.4 | P13 | P13-E15 VanDerWaalsContact C-N 3.25Å; P13-E15 PolarHBondContact O-N 3.43Å |
| 16 | G | 42.3 | Very low | 46.8 | Very low | 75 Ų | 75 | 142.3 Ų | 142.3 | 77% | 0.773 | 72% | 0.721 | S | S | * | * | trans | 140.5 | 20.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 116.2 | L18 | G16-L18 PolarHBondContact O-N 3.49Š| ||
| 17 | Y | 45.3 | Very low | 47.1 | Very low | 144 Ų | 144 | 141 Ų | 141 | 57% | 0.565 | 71% | 0.714 | S | S | * | * | trans | -63.9 | 99.7 | 174.3 | -67.9 | -77.8 | 0 | 0 | 0 | 111.2 | K14 L19 | K14-Y17 HydrophobicContact CB-CE2 3.8Å; K14-Y17 HydrophobicContact CG-CE2 4.04Å; K14-Y17 WeakPolarHBondContact CG-OH 3.35Å; K14-Y17 VanDerWaalsContact O-CD2 3.23Å; K14-Y17 WeakPolarHBondContact O-CD2 3.43Å; K14-Y17 WeakPolarHBondContact O-CE2 3.5Å; Y17-L19 VanDerWaalsContact C-N 3.35Å; Y17-L19 HydrophobicContact CD1-CD1 3.85Å; Y17-L19 HydrophobicContact CD1-CG 3.95Å; Y17-L19 HydrophobicContact CE1-CD1 4.37Å; Y17-L19 HydrophobicContact CG-CD1 4.5Å | ||
| 18 | L | 46 | Very low | 47 | Very low | 146 Ų | 146 | 139.3 Ų | 139.3 | 76% | 0.764 | 71% | 0.714 | S | S | * | * | trans | -93.3 | 81.5 | 134.5 | -77.9 | 168.4 | 0 | 0 | 0 | 106.5 | G16 L20 | G16-L18 PolarHBondContact O-N 3.49Å; L18-L20 HydrophobicContact CD2-CD1 3.77Å; L18-L20 HydrophobicContact CD2-CG 4.13Å; L18-L20 PolarHBondContact O-N 3Å | ||
| 19 | L | 43.3 | Very low | 47.1 | Very low | 130 Ų | 130 | 137.3 Ų | 137.3 | 68% | 0.681 | 71% | 0.713 | S | S | * | * | trans | -66.8 | 90.2 | 151.6 | -84.6 | 159.8 | 0 | 0 | 0 | 105.6 | Y17 | Y17-L19 VanDerWaalsContact C-N 3.35Å; Y17-L19 HydrophobicContact CD1-CD1 3.85Å; Y17-L19 HydrophobicContact CD1-CG 3.95Å; Y17-L19 HydrophobicContact CE1-CD1 4.37Å; Y17-L19 HydrophobicContact CG-CD1 4.5Å | ||
| 20 | L | 47.9 | Very low | 47.6 | Very low | 41 Ų | 41 | 135.9 Ų | 135.9 | 22% | 0.215 | 71% | 0.705 | C | S | . | * | trans | -123.4 | 63.4 | 164.4 | -68.6 | 176.9 | 0 | 0 | 0 | 108 | L18 D22 | L18-L20 HydrophobicContact CD2-CD1 3.77Å; L18-L20 HydrophobicContact CD2-CG 4.13Å; L18-L20 PolarHBondContact O-N 3Å; L20-D22 WeakPolarHBondContact CD2-OD2 3.42Å; L20-D22 PolarHBondContact O-N 2.95Å | ||
| 21 | L | 47.3 | Very low | 47.4 | Very low | 129 Ų | 129 | 136 Ų | 136 | 68% | 0.675 | 71% | 0.705 | S | S | * | * | trans | -86.4 | 71.3 | 144.6 | -71.9 | 171.7 | 0 | 0 | 0 | 105.8 | F23 | L21-F23 HydrophobicContact CB-CD2 4.09Å; L21-F23 HydrophobicContact CB-CE2 3.98Å; L21-F23 HydrophobicContact CD1-CE2 4.31Å; L21-F23 HydrophobicContact CD2-CE2 4.02Å; L21-F23 HydrophobicContact CD2-CZ 4.41Å; L21-F23 HydrophobicContact CG-CE2 4.33Å; L21-F23 PolarHBondContact O-N 3.33Å; L21-F23 VanDerWaalsContact O-N 3.09Å | ||
| 22 | D | 46.4 | Very low | 47.3 | Very low | 71 Ų | 71 | 135.3 Ų | 135.3 | 38% | 0.38 | 70% | 0.701 | S | S | . | * | trans | -77.2 | 88.6 | 161.9 | -67.1 | -8.7 | 0 | 0 | 0 | 104.8 | L20 D24 R147 | L20-D22 WeakPolarHBondContact CD2-OD2 3.42Å; L20-D22 PolarHBondContact O-N 2.95Å; D22-D24 PolarHBondContact O-N 3.33Å; D22-R147 IonicContact OD2-CZ 3.51Å; D22-R147 IonicContact OD2-NH1 2.63Å; D22-R147 IonicContact OD2-NH2 2.64Å; D22-R147 PolarHBondContact OD2-NH2 2.9Å | ||
| 23 | F | 45.2 | Very low | 46.8 | Very low | 165 Ų | 165 | 132.9 Ų | 132.9 | 72% | 0.724 | 70% | 0.697 | S | S | * | * | trans | -71.2 | 83 | 155.5 | -71.2 | -86.7 | 0 | 0 | 0 | 105.5 | L21 D25 | L21-F23 HydrophobicContact CB-CD2 4.09Å; L21-F23 HydrophobicContact CB-CE2 3.98Å; L21-F23 HydrophobicContact CD1-CE2 4.31Å; L21-F23 HydrophobicContact CD2-CE2 4.02Å; L21-F23 HydrophobicContact CD2-CZ 4.41Å; L21-F23 HydrophobicContact CG-CE2 4.33Å; L21-F23 PolarHBondContact O-N 3.33Å; L21-F23 VanDerWaalsContact O-N 3.09Å; F23-D25 PolarHBondContact O-N 3.46Å | ||
| 24 | D | 47.4 | Very low | 46.6 | Very low | 142 Ų | 142 | 137.2 Ų | 137.2 | 76% | 0.759 | 71% | 0.708 | S | S | * | * | trans | -70.1 | 77.9 | 161 | -79.5 | -29 | 0 | 0 | 0 | 106.8 | D22 | D22-D24 PolarHBondContact O-N 3.33Š| ||
| 25 | D | 49 | Very low | 45.9 | Very low | 133 Ų | 133 | 138.3 Ų | 138.3 | 71% | 0.711 | 72% | 0.715 | S | S | * | * | trans | -96.8 | 131.4 | 155.3 | -93.5 | -26.6 | 0 | 0 | 0 | 106.6 | F23 | F23-D25 PolarHBondContact O-N 3.46Š| ||
| 26 | E | 49.5 | Very low | 45.3 | Very low | 159 Ų | 159 | 134.1 Ų | 134.1 | 74% | 0.743 | 71% | 0.712 | S | S | * | * | S | Bend | trans | 85.7 | 105.3 | 171.8 | -51.9 | -63.1 | 153.4 | 0 | 0 | 116.7 | D28 | E26-D28 VanDerWaalsContact C-N 3.28Å; E26-D28 PolarHBondContact O-N 3.06Å |
| 27 | D | 49.8 | Very low | 45.3 | Very low | 156 Ų | 156 | 139 Ų | 139 | 83% | 0.834 | 72% | 0.719 | S | S | * | * | trans | -31.5 | 75.9 | 150 | -59.7 | -61.1 | 0 | 0 | 0 | 114.7 | D29 | D27-D29 PolarHBondContact O-N 3.17Š| ||
| 28 | D | 49 | Very low | 45.2 | Very low | 146 Ų | 146 | 137.6 Ų | 137.6 | 78% | 0.781 | 73% | 0.73 | S | S | * | * | trans | -94.3 | 91.8 | 160 | -86.9 | -24.2 | 0 | 0 | 0 | 108.5 | E26 I30 | E26-D28 VanDerWaalsContact C-N 3.28Å; E26-D28 PolarHBondContact O-N 3.06Å; D28-I30 VanDerWaalsContact C-N 3.26Å; D28-I30 PolarHBondContact O-N 2.77Å | ||
| 29 | D | 48.4 | Very low | 44.8 | Very low | 159 Ų | 159 | 139.7 Ų | 139.7 | 85% | 0.85 | 74% | 0.736 | S | S | * | * | trans | -49.5 | 90.1 | 160.9 | -79.5 | -41.1 | 0 | 0 | 0 | 109.5 | D27 K31 | D27-D29 PolarHBondContact O-N 3.17Å; D29-K31 PolarHBondContact O-N 3.22Å | ||
| 30 | I | 48.6 | Very low | 44.9 | Very low | 148 Ų | 148 | 139.8 Ų | 139.8 | 76% | 0.759 | 74% | 0.742 | S | S | * | * | trans | -71.3 | 85.6 | 166.9 | -56 | 175.4 | 0 | 0 | 0 | 106.5 | D28 V32 | D28-I30 VanDerWaalsContact C-N 3.26Å; D28-I30 PolarHBondContact O-N 2.77Å; I30-V32 HydrophobicContact CG2-CG2 4.02Å; I30-V32 PolarHBondContact O-N 3.41Å | ||
| 31 | K | 43.1 | Very low | 44.4 | Very low | 191 Ų | 191 | 147.8 Ų | 147.8 | 83% | 0.83 | 78% | 0.775 | S | S | * | * | trans | -61.1 | 88.8 | 162.7 | -138.6 | -173 | -170.4 | -165 | 0 | 106.8 | D29 S33 | D29-K31 PolarHBondContact O-N 3.22Å; K31-S33 VanDerWaalsContact C-N 3.28Å; K31-S33 PolarHBondContact O-N 2.96Å | ||
| 32 | V | 42.7 | Very low | 44.6 | Very low | 125 Ų | 125 | 146.3 Ų | 146.3 | 76% | 0.758 | 78% | 0.776 | S | S | * | * | trans | -65.8 | 98.8 | 165.9 | 175.3 | 0 | 0 | 0 | 0 | 105.9 | I30 E34 | I30-V32 HydrophobicContact CG2-CG2 4.02Å; I30-V32 PolarHBondContact O-N 3.41Å; V32-E34 PolarHBondContact O-N 3.31Å; V32-E34 VanDerWaalsContact O-N 3.08Å | ||
| 33 | S | 39.9 | Very low | 44.3 | Very low | 92 Ų | 92 | 149 Ų | 149 | 64% | 0.643 | 80% | 0.797 | S | S | * | * | trans | -57.6 | 110.2 | 172.4 | -17.7 | 0 | 0 | 0 | 0 | 108.2 | K31 E35 | K31-S33 VanDerWaalsContact C-N 3.28Å; K31-S33 PolarHBondContact O-N 2.96Å; S33-E35 PolarHBondContact O-N 2.91Å | ||
| 34 | E | 44.1 | Very low | 43.9 | Very low | 194 Ų | 194 | 145.5 Ų | 145.5 | 91% | 0.907 | 80% | 0.798 | S | S | * | * | trans | -71.9 | 60.7 | 166.4 | -166.6 | 179.6 | 177.9 | 0 | 0 | 109.1 | V32 | V32-E34 PolarHBondContact O-N 3.31Å; V32-E34 VanDerWaalsContact O-N 3.08Å | ||
| 35 | E | 38.6 | Very low | 43.9 | Very low | 178 Ų | 178 | 148.8 Ų | 148.8 | 83% | 0.832 | 81% | 0.806 | S | S | * | * | trans | -142.5 | 69.9 | 178 | -83 | -170.2 | 154 | 0 | 0 | 109.2 | S33 | S33-E35 PolarHBondContact O-N 2.91Š| ||
| 36 | A | 38.4 | Very low | 43.9 | Very low | 92 Ų | 92 | 149.3 Ų | 149.3 | 76% | 0.76 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -152.5 | 12.7 | 170.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 37 | L | 41.4 | Very low | 43.7 | Very low | 177 Ų | 177 | 151 Ų | 151 | 93% | 0.927 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -117.7 | 22.6 | 179.6 | -67.5 | -178.7 | 0 | 0 | 0 | 114.9 | ||
| 38 | S | 42.4 | Very low | 43.5 | Very low | 115 Ų | 115 | 151 Ų | 151 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | -117.9 | 63.5 | 175.3 | 68.8 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 39 | E | 39.6 | Very low | 43.3 | Very low | 190 Ų | 190 | 152.7 Ų | 152.7 | 89% | 0.888 | 82% | 0.817 | S | S | * | * | trans | -143.3 | 55.2 | 166.2 | -137.9 | 173.2 | -163.4 | 0 | 0 | 111.5 | ||||
| 40 | V | 44.6 | Very low | 43.2 | Very low | 132 Ų | 132 | 151.6 Ų | 151.6 | 80% | 0.8 | 81% | 0.811 | S | S | * | * | trans | -119 | 93.5 | 156.3 | 177.9 | 0 | 0 | 0 | 0 | 108.3 | S42 | V40-S42 PolarHBondContact O-N 3.02Å; V40-S42 VanDerWaalsContact O-N 3.09Å; V40-S42 PolarHBondContact O-OG 3.16Å | ||
| 41 | K | 36.9 | Very low | 43 | Very low | 210 Ų | 210 | 152.4 Ų | 152.4 | 91% | 0.913 | 82% | 0.815 | S | S | * | * | trans | -52.9 | 102.4 | 174.8 | -164.4 | 171.4 | -172.1 | 172.7 | 0 | 110.4 | ||||
| 42 | S | 51.5 | Low | 43.3 | Very low | 98 Ų | 98 | 148.2 Ų | 148.2 | 69% | 0.685 | 81% | 0.81 | S | S | * | * | trans | -108.6 | 131.9 | 169.9 | -55.1 | 0 | 0 | 0 | 0 | 108.9 | V40 | V40-S42 PolarHBondContact O-N 3.02Å; V40-S42 VanDerWaalsContact O-N 3.09Å; V40-S42 PolarHBondContact O-OG 3.16Å | ||
| 43 | P | 40.5 | Very low | 43.1 | Very low | 128 Ų | 128 | 148.2 Ų | 148.2 | 83% | 0.831 | 81% | 0.812 | S | S | * | * | trans | -73.9 | 144.6 | -176.8 | 28.3 | -28.1 | 0 | 0 | 0 | 111.5 | ||||
| 44 | A | 35.6 | Very low | 43.2 | Very low | 90 Ų | 90 | 153.3 Ų | 153.3 | 74% | 0.744 | 83% | 0.826 | S | S | * | * | trans | -50.3 | 136.8 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 45 | F | 48 | Very low | 42.8 | Very low | 211 Ų | 211 | 148.2 Ų | 148.2 | 93% | 0.925 | 82% | 0.817 | S | S | * | * | trans | -143.4 | 141.4 | 148 | -100.1 | -80.5 | 0 | 0 | 0 | 110.6 | ||||
| 46 | D | 48.8 | Very low | 42.8 | Very low | 145 Ų | 145 | 149.2 Ų | 149.2 | 78% | 0.775 | 82% | 0.822 | S | S | * | * | trans | -70.2 | 137.8 | -158.8 | -83.9 | -55.8 | 0 | 0 | 0 | 116.7 | ||||
| 47 | K | 46.8 | Very low | 42.8 | Very low | 194 Ų | 194 | 148.5 Ų | 148.5 | 84% | 0.843 | 82% | 0.823 | S | S | * | * | trans | -0.2 | 120.2 | 145.3 | -56.2 | 172.9 | -176.5 | 175.3 | 0 | 117.9 | ||||
| 48 | N | 45.2 | Very low | 42.7 | Very low | 157 Ų | 157 | 148 Ų | 148 | 84% | 0.84 | 82% | 0.821 | S | S | * | * | -153.7 | 135.9 | 117.7 | 55 | 18 | 0 | 0 | 0 | 112.5 | |||||
| 49 | E | 44.9 | Very low | 43 | Very low | 181 Ų | 181 | 151 Ų | 151 | 85% | 0.846 | 82% | 0.823 | S | S | * | * | trans | -58.1 | 155.7 | 168.3 | -62.3 | 157.8 | 144.7 | 0 | 0 | 109 | ||||
| 50 | N | 45 | Very low | 43.1 | Very low | 135 Ų | 135 | 149.4 Ų | 149.4 | 72% | 0.722 | 82% | 0.82 | S | S | * | * | cis | 179.6 | 139.4 | 44.6 | -151.9 | -23 | 0 | 0 | 0 | 104 | ||||
| 51 | I | 44.9 | Very low | 43.4 | Very low | 166 Ų | 166 | 150.3 Ų | 150.3 | 85% | 0.851 | 82% | 0.818 | S | S | * | * | trans | 174.2 | 109.6 | 149.6 | -84.4 | 145.1 | 0 | 0 | 0 | 106.7 | ||||
| 52 | S | 49.4 | Very low | 43.5 | Very low | 102 Ų | 102 | 143 Ų | 143 | 71% | 0.713 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 144.4 | 170.4 | -61 | 0 | 0 | 0 | 0 | 111.3 | ||
| 53 | P | 39.4 | Very low | 43.2 | Very low | 125 Ų | 125 | 146.3 Ų | 146.3 | 81% | 0.812 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -89.6 | 132.5 | 175.2 | 32.7 | -27.9 | 0 | 0 | 0 | 111.2 | ||
| 54 | Q | 40.4 | Very low | 43.4 | Very low | 200 Ų | 200 | 147 Ų | 147 | 94% | 0.935 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 134.9 | 163.1 | -85.5 | -171.3 | -86.5 | 0 | 0 | 110.2 | ||
| 55 | A | 36 | Very low | 44 | Very low | 86 Ų | 86 | 149.2 Ų | 149.2 | 71% | 0.711 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 157.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 56 | E | 39.2 | Very low | 43.7 | Very low | 200 Ų | 200 | 147.2 Ų | 147.2 | 94% | 0.935 | 81% | 0.807 | S | S | * | * | trans | 139.7 | 128.6 | 137.1 | -76 | 177.9 | -160.2 | 0 | 0 | 111 | ||||
| 57 | G | 38.9 | Very low | 43.7 | Very low | 76 Ų | 76 | 144.3 Ų | 144.3 | 78% | 0.784 | 80% | 0.798 | S | S | * | * | trans | 139.7 | 82.9 | 166.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | E59 | G57-E59 PolarHBondContact O-N 2.93Š| ||
| 58 | D | 38.1 | Very low | 43.6 | Very low | 166 Ų | 166 | 144.1 Ų | 144.1 | 89% | 0.888 | 80% | 0.802 | S | S | * | * | trans | -56.3 | 110 | 158.9 | -66.6 | -49.7 | 0 | 0 | 0 | 109.4 | ||||
| 59 | E | 50.2 | Low | 43.4 | Very low | 180 Ų | 180 | 144.8 Ų | 144.8 | 84% | 0.841 | 81% | 0.805 | S | S | * | * | trans | -145.6 | 124.8 | 152.3 | -68.9 | -160.6 | 178 | 0 | 0 | 111.7 | G57 M61 | G57-E59 PolarHBondContact O-N 2.93Å; E59-M61 PolarHBondContact O-N 3.38Å | ||
| 60 | D | 40.9 | Very low | 43.1 | Very low | 156 Ų | 156 | 142.1 Ų | 142.1 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | trans | -38.1 | 110.7 | 164 | -175.9 | 25.6 | 0 | 0 | 0 | 113.4 | ||||
| 61 | M | 50.1 | Low | 42.9 | Very low | 151 Ų | 151 | 143.5 Ų | 143.5 | 74% | 0.744 | 80% | 0.796 | S | S | * | * | trans | -132.8 | 66 | 170.9 | -62.5 | -64.6 | -85 | 0 | 0 | 109.5 | E59 | E59-M61 PolarHBondContact O-N 3.38Š| ||
| 62 | G | 40.4 | Very low | 42.8 | Very low | 56 Ų | 56 | 141.6 Ų | 141.6 | 58% | 0.577 | 80% | 0.798 | S | S | * | * | trans | -69.9 | 136.1 | 146.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 63 | D | 44.1 | Very low | 42.3 | Very low | 168 Ų | 168 | 145 Ų | 145 | 90% | 0.898 | 80% | 0.802 | S | S | * | * | S | Bend | trans | 92.2 | 51.8 | 172.7 | -51.4 | -20.2 | 0 | 0 | 0 | 118.3 | ||
| 64 | E | 44.8 | Very low | 42.1 | Very low | 143 Ų | 143 | 144.4 Ų | 144.4 | 67% | 0.668 | 80% | 0.796 | S | S | * | * | trans | -159.8 | 66.8 | 154.6 | -143.6 | 172.5 | 179.7 | 0 | 0 | 115.6 | ||||
| 65 | V | 47.9 | Very low | 42.3 | Very low | 135 Ų | 135 | 142.4 Ų | 142.4 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -132.1 | 8.4 | 162.7 | -65.4 | 0 | 0 | 0 | 0 | 114.8 | ||
| 66 | D | 42.7 | Very low | 42.7 | Very low | 170 Ų | 170 | 145.4 Ų | 145.4 | 91% | 0.909 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -99.1 | 11.9 | -177.4 | -114.9 | 5.2 | 0 | 0 | 0 | 114.5 | ||
| 67 | S | 49.3 | Very low | 43 | Very low | 84 Ų | 84 | 141.4 Ų | 141.4 | 59% | 0.587 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -109.1 | 0.5 | -173.8 | 63.3 | 0 | 0 | 0 | 0 | 116.6 | ||
| 68 | M | 43.2 | Very low | 43 | Very low | 190 Ų | 190 | 142.7 Ų | 142.7 | 94% | 0.936 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -97.7 | 10.6 | 179.1 | -71.1 | -167.2 | 85.9 | 0 | 0 | 115.1 | ||
| 69 | L | 41.6 | Very low | 43.4 | Very low | 170 Ų | 170 | 142.5 Ų | 142.5 | 89% | 0.89 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -118.7 | 57.6 | -178.6 | -139.1 | 143.6 | 0 | 0 | 0 | 110.8 | ||
| 70 | D | 38.4 | Very low | 43.1 | Very low | 126 Ų | 126 | 137.2 Ų | 137.2 | 67% | 0.674 | 78% | 0.782 | S | S | * | * | trans | -147.6 | 132.7 | 169.7 | -156.4 | 9.1 | 0 | 0 | 0 | 111.7 | ||||
| 71 | K | 41.6 | Very low | 43.2 | Very low | 163 Ų | 163 | 140.1 Ų | 140.1 | 71% | 0.709 | 79% | 0.787 | S | S | * | * | trans | 72.6 | 76.9 | 163.8 | -39.2 | -169.9 | -169.9 | -177.4 | 0 | 119.1 | ||||
| 72 | S | 43 | Very low | 42.9 | Very low | 127 Ų | 127 | 140.6 Ų | 140.6 | 89% | 0.888 | 79% | 0.792 | S | S | * | * | trans | -109.4 | 71.9 | 133.4 | 56.7 | 0 | 0 | 0 | 0 | 109 | V74 | S72-V74 PolarHBondContact O-N 2.62Š| ||
| 73 | E | 38.2 | Very low | 43.1 | Very low | 172 Ų | 172 | 146.2 Ų | 146.2 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | trans | -70.6 | 124.5 | 170.6 | -160.2 | 169.5 | -163.1 | 0 | 0 | 109.2 | N75 | E73-N75 PolarHBondContact O-N 2.94Š| ||
| 74 | V | 35.6 | Very low | 43 | Very low | 114 Ų | 114 | 145.2 Ų | 145.2 | 69% | 0.691 | 80% | 0.798 | S | S | * | * | trans | -38.4 | 122.5 | 172.2 | 176.5 | 0 | 0 | 0 | 0 | 112.8 | S72 | S72-V74 PolarHBondContact O-N 2.62Š| ||
| 75 | N | 44.1 | Very low | 43.1 | Very low | 158 Ų | 158 | 145.4 Ų | 145.4 | 85% | 0.845 | 80% | 0.802 | S | S | * | * | trans | -134.5 | 87.6 | 157.2 | -95 | -37 | 0 | 0 | 0 | 109.4 | E73 | E73-N75 PolarHBondContact O-N 2.94Š| ||
| 76 | N | 43.9 | Very low | 42.7 | Very low | 148 Ų | 148 | 144.3 Ų | 144.3 | 79% | 0.791 | 80% | 0.801 | S | S | * | * | trans | -93.7 | 112 | 162.3 | -77 | -36.3 | 0 | 0 | 0 | 107.9 | A78 | N76-A78 PolarHBondContact O-N 3.37Š| ||
| 77 | P | 47.1 | Very low | 43 | Very low | 117 Ų | 117 | 141.5 Ų | 141.5 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | trans | -82.8 | 105.5 | 169.1 | 21.4 | -10.6 | 0 | 0 | 0 | 109.2 | I79 | P77-I79 PolarHBondContact O-N 3.38Š| ||
| 78 | A | 39 | Very low | 42.5 | Very low | 103 Ų | 103 | 145.6 Ų | 145.6 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | trans | -72.2 | 106.5 | 161.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | N76 | N76-A78 PolarHBondContact O-N 3.37Š| ||
| 79 | I | 46.2 | Very low | 42.3 | Very low | 162 Ų | 162 | 143.6 Ų | 143.6 | 83% | 0.831 | 80% | 0.8 | S | S | * | * | trans | -133.2 | 117.5 | 161.3 | -91.8 | 164.3 | 0 | 0 | 0 | 103.2 | P77 | P77-I79 PolarHBondContact O-N 3.38Š| ||
| 80 | G | 42.2 | Very low | 42.7 | Very low | 69 Ų | 69 | 143.7 Ų | 143.7 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | 116.3 | 100.2 | 52.6 | 0 | 0 | 0 | 0 | 0 | 104.2 | D82 | G80-D82 PolarHBondContact O-N 2.92Š| |||
| 81 | K | 43.7 | Very low | 43 | Very low | 216 Ų | 216 | 141 Ų | 141 | 94% | 0.939 | 79% | 0.794 | S | S | * | * | trans | -56.3 | 121.4 | -176.6 | -63.1 | 173.9 | 177.6 | 178.8 | 0 | 109.7 | ||||
| 82 | D | 43.3 | Very low | 43.7 | Very low | 161 Ų | 161 | 138.4 Ų | 138.4 | 86% | 0.861 | 79% | 0.788 | S | S | * | * | trans | -147.4 | 139.5 | 146 | -144.4 | -10.9 | 0 | 0 | 0 | 110.2 | G80 | G80-D82 PolarHBondContact O-N 2.92Š| ||
| 83 | E | 45.7 | Very low | 44.4 | Very low | 175 Ų | 175 | 140.8 Ų | 140.8 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | -82.6 | 157.2 | -167.2 | -66.5 | 175.6 | 159 | 0 | 0 | 111.4 | ||||
| 84 | N | 42.4 | Very low | 45.7 | Very low | 146 Ų | 146 | 138.6 Ų | 138.6 | 78% | 0.781 | 78% | 0.779 | S | S | * | * | trans | 81.6 | 97.4 | 151.7 | -144.5 | -18.7 | 0 | 0 | 0 | 116.3 | ||||
| 85 | I | 46 | Very low | 47.4 | Very low | 147 Ų | 147 | 138.3 Ų | 138.3 | 75% | 0.754 | 77% | 0.772 | S | S | * | * | -174.5 | 116.3 | 110.2 | -81.8 | 145.8 | 0 | 0 | 0 | 106 | P87 | I85-P87 WeakPolarHBondContact O-CD 3.37Š| |||
| 86 | S | 38.7 | Very low | 49 | Very low | 113 Ų | 113 | 133.2 Ų | 133.2 | 79% | 0.79 | 76% | 0.756 | S | S | * | * | trans | -84.7 | 119.5 | 168.5 | 173.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 87 | P | 49.3 | Very low | 50.9 | Low | 110 Ų | 110 | 132.9 Ų | 132.9 | 71% | 0.714 | 75% | 0.75 | S | S | * | * | trans | -99.7 | 105.7 | 158.5 | 14.8 | 5.7 | 0 | 0 | 0 | 108.3 | I85 | I85-P87 WeakPolarHBondContact O-CD 3.37Š| ||
| 88 | Q | 39.9 | Very low | 52.6 | Low | 170 Ų | 170 | 131.7 Ų | 131.7 | 79% | 0.794 | 73% | 0.734 | S | S | * | * | trans | 19 | 108.7 | 145.8 | -68.5 | -176.8 | -10.8 | 0 | 0 | 117.1 | K90 | Q88-K90 PolarHBondContact O-N 3.25Š| ||
| 89 | V | 39.6 | Very low | 54.9 | Low | 148 Ų | 148 | 130.6 Ų | 130.6 | 90% | 0.897 | 72% | 0.717 | S | S | * | * | trans | -45.6 | 96.2 | 158.6 | 177.6 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 90 | K | 48.4 | Very low | 56.9 | Low | 173 Ų | 173 | 124.1 Ų | 124.1 | 75% | 0.752 | 69% | 0.69 | S | S | * | * | trans | -97.1 | 127 | 150 | -81.6 | -177.4 | 175.2 | 179.5 | 0 | 105.4 | Q88 D92 | Q88-K90 PolarHBondContact O-N 3.25Å; K90-D92 PolarHBondContact O-N 3.36Å | ||
| 91 | G | 45.6 | Very low | 59.2 | Low | 68 Ų | 68 | 122.7 Ų | 122.7 | 70% | 0.701 | 67% | 0.669 | S | S | * | * | trans | -59.4 | 105.5 | -173.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | E93 | G91-E93 PolarHBondContact O-N 3.22Š| ||
| 92 | D | 56 | Low | 61.4 | Low | 109 Ų | 109 | 117.4 Ų | 117.4 | 58% | 0.583 | 65% | 0.649 | S | S | * | * | trans | -76.2 | 71.9 | 175.1 | -70.7 | -25.6 | 0 | 0 | 0 | 109.6 | K90 D94 M95 | K90-D92 PolarHBondContact O-N 3.36Å; D92-D94 PolarHBondContact O-N 3.02Å; D92-M95 HydrophobicContact CB-CB 3.78Å; D92-M95 HydrophobicContact CB-CG 3.61Å; D92-M95 PolarHBondContact O-N 3.4Å | ||
| 93 | E | 57.5 | Low | 63.9 | Low | 177 Ų | 177 | 115.1 Ų | 115.1 | 83% | 0.827 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -59.6 | -25.9 | 167.4 | -69.6 | -178.3 | 174.1 | 0 | 0 | 111 | G91 H97 | G91-E93 PolarHBondContact O-N 3.22Å; E93-H97 PolarHBondContact O-N 2.96Å |
| 94 | D | 65.8 | Low | 66.1 | Low | 126 Ų | 126 | 112.3 Ų | 112.3 | 67% | 0.674 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -72.9 | -41.1 | 179.7 | -161.4 | 23.2 | 0 | 0 | 0 | 113 | D92 G96 H97 E98 | D92-D94 PolarHBondContact O-N 3.02Å; D94-G96 VanDerWaalsContact C-N 3.28Å; D94-G96 PolarHBondContact O-N 3.02Å; D94-H97 PolarHBondContact O-N 3.01Å; D94-E98 PolarHBondContact O-N 3.48Å |
| 95 | M | 71.4 | Confident | 68.6 | Low | 109 Ų | 109 | 111.7 Ų | 111.7 | 54% | 0.537 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -63.5 | -36 | 175.5 | -69.9 | -72.5 | -170.7 | 0 | 0 | 111.5 | D92 E98 V99 | D92-M95 HydrophobicContact CB-CB 3.78Å; D92-M95 HydrophobicContact CB-CG 3.61Å; D92-M95 PolarHBondContact O-N 3.4Å; M95-E98 PolarHBondContact O-N 3.47Å; M95-V99 WeakPolarHBondContact O-CB 3.35Å; M95-V99 VanDerWaalsContact O-CG2 3.28Å; M95-V99 WeakPolarHBondContact O-CG2 3.45Å; M95-V99 PolarHBondContact O-N 3.45Å |
| 96 | G | 78.2 | Confident | 70.9 | Confident | 50 Ų | 50 | 107.4 Ų | 107.4 | 52% | 0.515 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -64.2 | -40.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | D94 G100 | D94-G96 VanDerWaalsContact C-N 3.28Å; D94-G96 PolarHBondContact O-N 3.02Å; G96-G100 PolarHBondContact O-N 3.32Å |
| 97 | H | 82.2 | Confident | 73.5 | Confident | 141 Ų | 141 | 103.8 Ų | 103.8 | 65% | 0.653 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -69.1 | -41.3 | 176.8 | -175.6 | -90.5 | 0 | 0 | 0 | 112 | E93 D94 G100 S101 | E93-H97 PolarHBondContact O-N 2.96Å; D94-H97 PolarHBondContact O-N 3.01Å; H97-G100 PolarHBondContact O-N 3.01Å; H97-S101 WeakPolarHBondContact O-CB 3.43Å; H97-S101 PolarHBondContact O-N 3.49Å |
| 98 | E | 84.3 | Confident | 75.7 | Confident | 92 Ų | 92 | 103.1 Ų | 103.1 | 43% | 0.43 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61.1 | -51.3 | 175.3 | -177.2 | 173.8 | -173.2 | 0 | 0 | 111.7 | D94 M95 G100 S101 M102 | D94-E98 PolarHBondContact O-N 3.48Å; M95-E98 PolarHBondContact O-N 3.47Å; E98-G100 VanDerWaalsContact C-N 3.31Å; E98-G100 PolarHBondContact O-N 3.19Å; E98-S101 PolarHBondContact O-N 3.25Å; E98-S101 VanDerWaalsContact O-N 3.14Å; E98-S101 PolarHBondContact O-OG 2.96Å; E98-M102 HydrophobicContact CG-CE 3.65Å; E98-M102 HydrophobicContact CG-SD 4.39Å; E98-M102 WeakPolarHBondContact O-CG 3.48Å; E98-M102 PolarHBondContact O-N 3.35Å; E98-M102 WeakPolarHBondContact OE1-CE 3.34Å |
| 99 | V | 87 | Confident | 78.4 | Confident | 81 Ų | 81 | 99.3 Ų | 99.3 | 49% | 0.491 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -59.9 | -41.8 | 177.6 | 172.8 | 0 | 0 | 0 | 0 | 111.1 | M95 M102 L103 | M95-V99 WeakPolarHBondContact O-CB 3.35Å; M95-V99 VanDerWaalsContact O-CG2 3.28Å; M95-V99 WeakPolarHBondContact O-CG2 3.45Å; M95-V99 PolarHBondContact O-N 3.45Å; V99-M102 PolarHBondContact O-N 3.05Å; V99-L103 HydrophobicContact CG1-CD1 4.07Å; V99-L103 HydrophobicContact CG1-CG 4.39Å; V99-L103 VanDerWaalsContact O-CG 3.31Å; V99-L103 WeakPolarHBondContact O-CG 3.38Å; V99-L103 PolarHBondContact O-N 2.96Å |
| 100 | G | 88.1 | Confident | 81.2 | Confident | 26 Ų | 26 | 96.8 Ų | 96.8 | 27% | 0.268 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -57.4 | -49.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | G96 H97 E98 M102 L103 D104 | G96-G100 PolarHBondContact O-N 3.32Å; H97-G100 PolarHBondContact O-N 3.01Å; E98-G100 VanDerWaalsContact C-N 3.31Å; E98-G100 PolarHBondContact O-N 3.19Å; G100-M102 VanDerWaalsContact C-N 3.3Å; G100-M102 PolarHBondContact O-N 2.85Å; G100-L103 PolarHBondContact O-N 3.47Å; G100-D104 PolarHBondContact O-N 3.49Å |
| 101 | S | 89.3 | Confident | 83.5 | Confident | 38 Ų | 38 | 95.5 Ų | 95.5 | 27% | 0.266 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.7 | -33.2 | 178.5 | 81.1 | 0 | 0 | 0 | 0 | 113.5 | H97 E98 K105 | H97-S101 WeakPolarHBondContact O-CB 3.43Å; H97-S101 PolarHBondContact O-N 3.49Å; E98-S101 PolarHBondContact O-N 3.25Å; E98-S101 VanDerWaalsContact O-N 3.14Å; E98-S101 PolarHBondContact O-OG 2.96Å; S101-K105 WeakPolarHBondContact O-CD 3.48Å; S101-K105 VanDerWaalsContact O-CG 3.26Å; S101-K105 WeakPolarHBondContact O-CG 3.48Å; S101-K105 PolarHBondContact O-N 2.93Å |
| 102 | M | 91.4 | Very high | 86 | Confident | 105 Ų | 105 | 97.6 Ų | 97.6 | 52% | 0.517 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -71.2 | -39.3 | 174.9 | -71 | -177.8 | -179.3 | 0 | 0 | 111.6 | E98 V99 G100 S106 | E98-M102 HydrophobicContact CG-CE 3.65Å; E98-M102 HydrophobicContact CG-SD 4.39Å; E98-M102 WeakPolarHBondContact O-CG 3.48Å; E98-M102 PolarHBondContact O-N 3.35Å; E98-M102 WeakPolarHBondContact OE1-CE 3.34Å; V99-M102 PolarHBondContact O-N 3.05Å; G100-M102 VanDerWaalsContact C-N 3.3Å; G100-M102 PolarHBondContact O-N 2.85Å; M102-S106 WeakPolarHBondContact O-CB 3.37Å; M102-S106 PolarHBondContact O-N 3.35Å |
| 103 | L | 94.1 | Very high | 88 | Confident | 113 Ų | 113 | 96.8 Ų | 96.8 | 59% | 0.592 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -66.3 | -41.3 | 175.3 | -72.3 | 173.7 | 0 | 0 | 0 | 111.9 | V99 G100 S106 G107 | V99-L103 HydrophobicContact CG1-CD1 4.07Å; V99-L103 HydrophobicContact CG1-CG 4.39Å; V99-L103 VanDerWaalsContact O-CG 3.31Å; V99-L103 WeakPolarHBondContact O-CG 3.38Å; V99-L103 PolarHBondContact O-N 2.96Å; G100-L103 PolarHBondContact O-N 3.47Å; L103-S106 WeakPolarHBondContact O-CB 3.34Å; L103-S106 PolarHBondContact O-N 2.96Å; L103-G107 PolarHBondContact O-N 2.98Å |
| 104 | D | 92.8 | Very high | 89.9 | Confident | 117 Ų | 117 | 93 Ų | 93 | 63% | 0.626 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.9 | -46.5 | 176.3 | -73 | -17.2 | 0 | 0 | 0 | 111.1 | G100 S106 G107 D108 | G100-D104 PolarHBondContact O-N 3.49Å; D104-S106 VanDerWaalsContact C-N 3.35Å; D104-S106 PolarHBondContact O-N 2.99Å; D104-G107 PolarHBondContact O-N 2.74Å; D104-D108 PolarHBondContact O-N 3.01Å |
| 105 | K | 94.3 | Very high | 91.4 | Very high | 132 Ų | 132 | 90.7 Ų | 90.7 | 57% | 0.574 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -59.6 | -43.9 | 174.4 | -72.1 | 169.6 | -174.1 | 172.2 | 0 | 112.2 | S101 G107 D108 D109 | S101-K105 WeakPolarHBondContact O-CD 3.48Å; S101-K105 VanDerWaalsContact O-CG 3.26Å; S101-K105 WeakPolarHBondContact O-CG 3.48Å; S101-K105 PolarHBondContact O-N 2.93Å; K105-G107 VanDerWaalsContact C-N 3.34Å; K105-D108 PolarHBondContact O-N 3.34Å; K105-D109 PolarHBondContact O-N 3.38Å |
| 106 | S | 94.1 | Very high | 92.7 | Very high | 58 Ų | 58 | 91 Ų | 91 | 41% | 0.406 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.8 | -42.2 | 175.4 | -177.5 | 0 | 0 | 0 | 0 | 111.5 | M102 L103 D104 D109 I110 | M102-S106 WeakPolarHBondContact O-CB 3.37Å; M102-S106 PolarHBondContact O-N 3.35Å; L103-S106 WeakPolarHBondContact O-CB 3.34Å; L103-S106 PolarHBondContact O-N 2.96Å; D104-S106 VanDerWaalsContact C-N 3.35Å; D104-S106 PolarHBondContact O-N 2.99Å; S106-D109 PolarHBondContact O-N 3.45Å; S106-I110 WeakPolarHBondContact O-CB 3.48Å; S106-I110 WeakPolarHBondContact O-CD1 3.5Å; S106-I110 WeakPolarHBondContact O-CG1 3.47Å; S106-I110 PolarHBondContact O-N 3.41Å |
| 107 | G | 95.2 | Very high | 93.6 | Very high | 37 Ų | 37 | 94.6 Ų | 94.6 | 38% | 0.381 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59.9 | -45.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L103 D104 K105 I110 Y111 | L103-G107 PolarHBondContact O-N 2.98Å; D104-G107 PolarHBondContact O-N 2.74Å; K105-G107 VanDerWaalsContact C-N 3.34Å; G107-I110 PolarHBondContact O-N 3.25Å; G107-Y111 WeakPolarHBondContact O-CB 3.41Å; G107-Y111 PolarHBondContact O-N 3.09Å |
| 108 | D | 95.6 | Very high | 94.4 | Very high | 96 Ų | 96 | 94.3 Ų | 94.3 | 51% | 0.513 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.8 | -43.3 | 175.4 | -82.2 | -11.4 | 0 | 0 | 0 | 112.2 | D104 K105 Y111 K112 | D104-D108 PolarHBondContact O-N 3.01Å; K105-D108 PolarHBondContact O-N 3.34Å; D108-Y111 PolarHBondContact O-N 3.08Å; D108-K112 VanDerWaalsContact O-CG 3.27Å; D108-K112 WeakPolarHBondContact O-CG 3.47Å; D108-K112 PolarHBondContact O-N 3.43Å |
| 109 | D | 96.5 | Very high | 95.1 | Very high | 90 Ų | 90 | 94.9 Ų | 94.9 | 48% | 0.481 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -69 | -38 | 179.4 | -71.7 | -16.8 | 0 | 0 | 0 | 111.9 | K105 S106 K112 T113 | K105-D109 PolarHBondContact O-N 3.38Å; S106-D109 PolarHBondContact O-N 3.45Å; D109-K112 IonicContact OD1-NZ 3.63Å; D109-T113 VanDerWaalsContact O-CB 3.32Å; D109-T113 WeakPolarHBondContact O-CB 3.46Å; D109-T113 PolarHBondContact O-N 3.18Å; D109-T113 PolarHBondContact O-OG1 2.95Å |
| 110 | I | 96.9 | Very high | 95.6 | Very high | 94 Ų | 94 | 98.4 Ų | 98.4 | 48% | 0.482 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.1 | -47.3 | 170.6 | -69.6 | 164.3 | 0 | 0 | 0 | 110.1 | S106 G107 T113 L114 | S106-I110 WeakPolarHBondContact O-CB 3.48Å; S106-I110 WeakPolarHBondContact O-CD1 3.5Å; S106-I110 WeakPolarHBondContact O-CG1 3.47Å; S106-I110 PolarHBondContact O-N 3.41Å; G107-I110 PolarHBondContact O-N 3.25Å; I110-T113 PolarHBondContact O-N 3.31Å; I110-L114 HydrophobicContact CG2-CD1 3.93Å; I110-L114 HydrophobicContact CG2-CG 4.36Å; I110-L114 WeakPolarHBondContact O-CB 3.47Å; I110-L114 WeakPolarHBondContact O-CG 3.44Å; I110-L114 PolarHBondContact O-N 3.43Å |
| 111 | Y | 97.5 | Very high | 96.1 | Very high | 147 Ų | 147 | 101.7 Ų | 101.7 | 58% | 0.576 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.6 | -46.8 | 179.9 | 178.2 | -97.9 | 0 | 0 | 0 | 112 | G107 D108 T113 L114 H115 | G107-Y111 WeakPolarHBondContact O-CB 3.41Å; G107-Y111 PolarHBondContact O-N 3.09Å; D108-Y111 PolarHBondContact O-N 3.08Å; Y111-T113 PolarHBondContact O-N 3.48Å; Y111-L114 PolarHBondContact O-N 3.4Å; Y111-H115 WeakPolarHBondContact O-CB 3.39Å; Y111-H115 PolarHBondContact O-N 3.42Å |
| 112 | K | 97.8 | Very high | 96.5 | Very high | 112 Ų | 112 | 104.2 Ų | 104.2 | 49% | 0.487 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.2 | -46 | 175.6 | -71.5 | 167.9 | -167.2 | 160.8 | 0 | 111.5 | D108 D109 L114 H115 I116 | D108-K112 VanDerWaalsContact O-CG 3.27Å; D108-K112 WeakPolarHBondContact O-CG 3.47Å; D108-K112 PolarHBondContact O-N 3.43Å; D109-K112 IonicContact OD1-NZ 3.63Å; K112-L114 PolarHBondContact O-N 2.96Å; K112-H115 PolarHBondContact O-N 3.25Å; K112-I116 WeakPolarHBondContact O-CG1 3.39Å; K112-I116 PolarHBondContact O-N 3.39Å |
| 113 | T | 97.5 | Very high | 96.8 | Very high | 92 Ų | 92 | 102.5 Ų | 102.5 | 56% | 0.564 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.7 | -44.9 | 178.7 | -58.6 | 0 | 0 | 0 | 0 | 111.5 | D109 I110 Y111 H115 I116 K117 | D109-T113 VanDerWaalsContact O-CB 3.32Å; D109-T113 WeakPolarHBondContact O-CB 3.46Å; D109-T113 PolarHBondContact O-N 3.18Å; D109-T113 PolarHBondContact O-OG1 2.95Å; I110-T113 PolarHBondContact O-N 3.31Å; Y111-T113 PolarHBondContact O-N 3.48Å; T113-H115 VanDerWaalsContact C-N 3.34Å; T113-H115 PolarHBondContact O-N 2.97Å; T113-I116 PolarHBondContact O-N 2.91Å; T113-K117 WeakPolarHBondContact O-CB 3.47Å; T113-K117 PolarHBondContact O-N 3.4Å |
| 114 | L | 98.1 | Very high | 97 | Very high | 98 Ų | 98 | 103.5 Ų | 103.5 | 51% | 0.513 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.9 | -38.8 | 175.6 | -73.4 | 175.7 | 0 | 0 | 0 | 112.2 | I110 Y111 K112 K117 R118 | I110-L114 HydrophobicContact CG2-CD1 3.93Å; I110-L114 HydrophobicContact CG2-CG 4.36Å; I110-L114 WeakPolarHBondContact O-CB 3.47Å; I110-L114 WeakPolarHBondContact O-CG 3.44Å; I110-L114 PolarHBondContact O-N 3.43Å; Y111-L114 PolarHBondContact O-N 3.4Å; K112-L114 PolarHBondContact O-N 2.96Å; L114-K117 PolarHBondContact O-N 3.48Å; L114-R118 WeakPolarHBondContact O-CB 3.42Å; L114-R118 PolarHBondContact O-N 2.86Å |
| 115 | H | 97.5 | Very high | 97.3 | Very high | 77 Ų | 77 | 102.3 Ų | 102.3 | 36% | 0.356 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.4 | -46.2 | 177.1 | -170.3 | 84.1 | 0 | 0 | 0 | 111.7 | Y111 K112 T113 R118 K119 | Y111-H115 WeakPolarHBondContact O-CB 3.39Å; Y111-H115 PolarHBondContact O-N 3.42Å; K112-H115 PolarHBondContact O-N 3.25Å; T113-H115 VanDerWaalsContact C-N 3.34Å; T113-H115 PolarHBondContact O-N 2.97Å; H115-R118 PolarHBondContact O-N 2.86Å; H115-K119 PolarHBondContact O-N 3.24Å |
| 116 | I | 98 | Very high | 97.5 | Very high | 116 Ų | 116 | 103.8 Ų | 103.8 | 60% | 0.595 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60.5 | -47.9 | 175.6 | -67.8 | 165.5 | 0 | 0 | 0 | 110.3 | K112 T113 R118 K119 W120 | K112-I116 WeakPolarHBondContact O-CG1 3.39Å; K112-I116 PolarHBondContact O-N 3.39Å; T113-I116 PolarHBondContact O-N 2.91Å; I116-R118 VanDerWaalsContact C-N 3.32Å; I116-R118 PolarHBondContact O-N 3.04Å; I116-K119 PolarHBondContact O-N 3.23Å; I116-W120 WeakPolarHBondContact O-CB 3.48Å; I116-W120 PolarHBondContact O-N 3.16Å |
| 117 | K | 98.4 | Very high | 97.7 | Very high | 125 Ų | 125 | 107 Ų | 107 | 54% | 0.543 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.5 | -41.8 | 178.2 | -172.6 | -178.4 | 179.9 | -170.2 | 0 | 112.1 | T113 L114 W120 M121 | T113-K117 WeakPolarHBondContact O-CB 3.47Å; T113-K117 PolarHBondContact O-N 3.4Å; L114-K117 PolarHBondContact O-N 3.48Å; K117-W120 PolarHBondContact O-N 3.19Å; K117-M121 HydrophobicContact CG-SD 4.46Å; K117-M121 WeakPolarHBondContact O-CG 3.44Å; K117-M121 PolarHBondContact O-N 2.94Å |
| 118 | R | 98.3 | Very high | 97.8 | Very high | 135 Ų | 135 | 107.5 Ų | 107.5 | 51% | 0.509 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.2 | -49.8 | 175.3 | -178.6 | -172.4 | -61.4 | 149.9 | 2.9 | 111.1 | L114 H115 I116 W120 M121 E122 | L114-R118 WeakPolarHBondContact O-CB 3.42Å; L114-R118 PolarHBondContact O-N 2.86Å; H115-R118 PolarHBondContact O-N 2.86Å; I116-R118 VanDerWaalsContact C-N 3.32Å; I116-R118 PolarHBondContact O-N 3.04Å; R118-W120 VanDerWaalsContact C-N 3.32Å; R118-W120 PolarHBondContact O-N 3.16Å; R118-M121 PolarHBondContact O-N 3.39Å; R118-E122 WeakPolarHBondContact CD-OE1 3.31Å; R118-E122 HydrophobicContact CG-CG 4.38Å; R118-E122 WeakPolarHBondContact CG-OE1 3.46Å; R118-E122 WeakPolarHBondContact O-CG 3.42Å; R118-E122 PolarHBondContact O-N 3.09Å |
| 119 | K | 98.3 | Very high | 97.9 | Very high | 103 Ų | 103 | 109 Ų | 109 | 45% | 0.448 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.2 | -42.6 | 179.5 | -77.9 | -73.5 | 162.9 | -145.3 | 0 | 112 | H115 I116 E122 T123 | H115-K119 PolarHBondContact O-N 3.24Å; I116-K119 PolarHBondContact O-N 3.23Å; K119-E122 IonicContact NZ-OE2 2.8Å; K119-E122 PolarHBondContact NZ-OE2 3.28Å; K119-E122 PolarHBondContact O-N 3.05Å; K119-T123 PolarHBondContact O-N 3.02Å; K119-T123 PolarHBondContact O-OG1 3.48Å; K119-T123 VanDerWaalsContact O-OG1 3.12Å |
| 120 | W | 98 | Very high | 98 | Very high | 155 Ų | 155 | 111.3 Ų | 111.3 | 59% | 0.587 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -60 | -47.6 | 174.4 | 176.5 | 82.6 | 0 | 0 | 0 | 112 | I116 K117 R118 T123 Y124 | I116-W120 WeakPolarHBondContact O-CB 3.48Å; I116-W120 PolarHBondContact O-N 3.16Å; K117-W120 PolarHBondContact O-N 3.19Å; R118-W120 VanDerWaalsContact C-N 3.32Å; R118-W120 PolarHBondContact O-N 3.16Å; W120-T123 PolarHBondContact O-N 3.38Å; W120-Y124 WeakPolarHBondContact O-CB 3.26Å; W120-Y124 PolarHBondContact O-N 3.26Å |
| 121 | M | 98.6 | Very high | 98 | Very high | 95 Ų | 95 | 108.5 Ų | 108.5 | 47% | 0.468 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.8 | -42.9 | 177.2 | -75.2 | 177.3 | 46.3 | 0 | 0 | 113 | K117 R118 T123 Y124 V125 | K117-M121 HydrophobicContact CG-SD 4.46Å; K117-M121 WeakPolarHBondContact O-CG 3.44Å; K117-M121 PolarHBondContact O-N 2.94Å; R118-M121 PolarHBondContact O-N 3.39Å; M121-T123 VanDerWaalsContact C-N 3.33Å; M121-T123 PolarHBondContact O-N 3.42Å; M121-Y124 PolarHBondContact O-N 3.44Å; M121-V125 WeakPolarHBondContact O-CB 3.32Å; M121-V125 WeakPolarHBondContact O-CG2 3.47Å; M121-V125 PolarHBondContact O-N 2.96Å |
| 122 | E | 98.3 | Very high | 98.1 | Very high | 91 Ų | 91 | 105 Ų | 105 | 43% | 0.425 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -57.7 | -47 | 176.7 | -76.4 | 171.3 | -172.4 | 0 | 0 | 110.9 | R118 K119 K126 | R118-E122 WeakPolarHBondContact CD-OE1 3.31Å; R118-E122 HydrophobicContact CG-CG 4.38Å; R118-E122 WeakPolarHBondContact CG-OE1 3.46Å; R118-E122 WeakPolarHBondContact O-CG 3.42Å; R118-E122 PolarHBondContact O-N 3.09Å; K119-E122 IonicContact NZ-OE2 2.8Å; K119-E122 PolarHBondContact NZ-OE2 3.28Å; K119-E122 PolarHBondContact O-N 3.05Å; E122-K126 WeakPolarHBondContact O-CB 3.37Å; E122-K126 PolarHBondContact O-N 3.29Å; E122-K126 VanDerWaalsContact O-N 3.1Å |
| 123 | T | 98.2 | Very high | 98.1 | Very high | 69 Ų | 69 | 103 Ų | 103 | 42% | 0.423 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.5 | -48.6 | 176.5 | -60.7 | 0 | 0 | 0 | 0 | 111.4 | K119 W120 M121 V125 K126 E127 | K119-T123 PolarHBondContact O-N 3.02Å; K119-T123 PolarHBondContact O-OG1 3.48Å; K119-T123 VanDerWaalsContact O-OG1 3.12Å; W120-T123 PolarHBondContact O-N 3.38Å; M121-T123 VanDerWaalsContact C-N 3.33Å; M121-T123 PolarHBondContact O-N 3.42Å; T123-V125 PolarHBondContact O-N 3.39Å; T123-K126 WeakPolarHBondContact O-CB 3.33Å; T123-K126 PolarHBondContact O-N 2.96Å; T123-K126 VanDerWaalsContact O-N 3.16Å; T123-E127 HydrophobicContact CG2-CG 4.32Å; T123-E127 WeakPolarHBondContact CG2-OE1 3.37Å; T123-E127 WeakPolarHBondContact O-CG 3.34Å; T123-E127 PolarHBondContact O-N 3.45Å |
| 124 | Y | 98.3 | Very high | 98.1 | Very high | 135 Ų | 135 | 103.2 Ų | 103.2 | 53% | 0.529 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -57.3 | -46.7 | 179.9 | 175.3 | -97.6 | 0 | 0 | 0 | 112.3 | W120 M121 E127 S128 | W120-Y124 WeakPolarHBondContact O-CB 3.26Å; W120-Y124 PolarHBondContact O-N 3.26Å; M121-Y124 PolarHBondContact O-N 3.44Å; Y124-E127 PolarHBondContact O-N 2.96Å; Y124-S128 WeakPolarHBondContact O-CB 3.48Å; Y124-S128 PolarHBondContact O-N 3.29Å; Y124-S128 PolarHBondContact O-OG 3.35Å |
| 125 | V | 98.5 | Very high | 98.1 | Very high | 92 Ų | 92 | 105.9 Ų | 105.9 | 56% | 0.558 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.2 | -43.2 | 177.9 | 171 | 0 | 0 | 0 | 0 | 110.8 | M121 T123 S128 F129 | M121-V125 WeakPolarHBondContact O-CB 3.32Å; M121-V125 WeakPolarHBondContact O-CG2 3.47Å; M121-V125 PolarHBondContact O-N 2.96Å; T123-V125 PolarHBondContact O-N 3.39Å; V125-S128 PolarHBondContact O-N 3.05Å; V125-F129 WeakPolarHBondContact O-CB 3.4Å; V125-F129 PolarHBondContact O-N 2.95Å |
| 126 | K | 98.2 | Very high | 98.1 | Very high | 163 Ų | 163 | 107 Ų | 107 | 71% | 0.709 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.2 | -46.4 | 178.7 | -176.4 | -179.2 | 179.7 | -178.7 | 0 | 111.9 | E122 T123 K130 | E122-K126 WeakPolarHBondContact O-CB 3.37Å; E122-K126 PolarHBondContact O-N 3.29Å; E122-K126 VanDerWaalsContact O-N 3.1Å; T123-K126 WeakPolarHBondContact O-CB 3.33Å; T123-K126 PolarHBondContact O-N 2.96Å; T123-K126 VanDerWaalsContact O-N 3.16Å; K126-K130 WeakPolarHBondContact O-CB 3.34Å; K126-K130 PolarHBondContact O-N 3.39Å |
| 127 | E | 98.1 | Very high | 98.1 | Very high | 126 Ų | 126 | 106.2 Ų | 106.2 | 59% | 0.589 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -68.3 | -42.5 | 178.9 | -71.6 | 173.1 | 174.7 | 0 | 0 | 111.7 | T123 Y124 F129 K130 G131 | T123-E127 HydrophobicContact CG2-CG 4.32Å; T123-E127 WeakPolarHBondContact CG2-OE1 3.37Å; T123-E127 WeakPolarHBondContact O-CG 3.34Å; T123-E127 PolarHBondContact O-N 3.45Å; Y124-E127 PolarHBondContact O-N 2.96Å; E127-F129 VanDerWaalsContact C-N 3.34Å; E127-F129 PolarHBondContact O-N 2.92Å; E127-K130 PolarHBondContact O-N 3.41Å; E127-G131 PolarHBondContact O-N 3.27Å |
| 128 | S | 97.4 | Very high | 98 | Very high | 46 Ų | 46 | 108 Ų | 108 | 32% | 0.322 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.3 | -44.6 | 175.6 | -64.3 | 0 | 0 | 0 | 0 | 111.9 | Y124 V125 S132 | Y124-S128 WeakPolarHBondContact O-CB 3.48Å; Y124-S128 PolarHBondContact O-N 3.29Å; Y124-S128 PolarHBondContact O-OG 3.35Å; V125-S128 PolarHBondContact O-N 3.05Å; S128-S132 VanDerWaalsContact O-CB 3.29Å; S128-S132 WeakPolarHBondContact O-CB 3.48Å; S128-S132 PolarHBondContact O-N 2.98Å; S128-S132 PolarHBondContact O-OG 3.44Å |
| 129 | F | 97.9 | Very high | 98 | Very high | 129 Ų | 129 | 108.2 Ų | 108.2 | 57% | 0.566 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -67.7 | -42.8 | 177.7 | -168.6 | -108.3 | 0 | 0 | 0 | 111.6 | V125 E127 G131 S132 N133 | V125-F129 WeakPolarHBondContact O-CB 3.4Å; V125-F129 PolarHBondContact O-N 2.95Å; E127-F129 VanDerWaalsContact C-N 3.34Å; E127-F129 PolarHBondContact O-N 2.92Å; F129-G131 PolarHBondContact O-N 2.93Å; F129-S132 PolarHBondContact O-N 3.32Å; F129-N133 WeakPolarHBondContact CD1-ND2 3.45Å; F129-N133 WeakPolarHBondContact CE1-ND2 3.38Å; F129-N133 WeakPolarHBondContact CZ-ND2 3.48Å; F129-N133 WeakPolarHBondContact O-CB 3.48Å; F129-N133 PolarHBondContact O-N 2.92Å |
| 130 | K | 98.1 | Very high | 97.9 | Very high | 137 Ų | 137 | 106.4 Ų | 106.4 | 60% | 0.596 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -58.2 | -49.3 | 175.3 | -176.9 | -177.5 | 176.9 | -172.3 | 0 | 111.6 | K126 E127 N133 Q134 | K126-K130 WeakPolarHBondContact O-CB 3.34Å; K126-K130 PolarHBondContact O-N 3.39Å; E127-K130 PolarHBondContact O-N 3.41Å; K130-N133 PolarHBondContact O-N 3.09Å; K130-Q134 WeakPolarHBondContact O-CG 3.41Å; K130-Q134 PolarHBondContact O-N 3.44Å |
| 131 | G | 98 | Very high | 97.9 | Very high | 35 Ų | 35 | 104 Ų | 104 | 36% | 0.361 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.6 | -41 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | E127 F129 Q134 K135 | E127-G131 PolarHBondContact O-N 3.27Å; F129-G131 PolarHBondContact O-N 2.93Å; G131-Q134 PolarHBondContact O-N 3.34Å; G131-K135 PolarHBondContact O-N 3.08Å |
| 132 | S | 98 | Very high | 97.8 | Very high | 74 Ų | 74 | 102.3 Ų | 102.3 | 52% | 0.517 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.9 | -45.3 | 176.8 | -61.9 | 0 | 0 | 0 | 0 | 112 | S128 F129 K135 L136 | S128-S132 VanDerWaalsContact O-CB 3.29Å; S128-S132 WeakPolarHBondContact O-CB 3.48Å; S128-S132 PolarHBondContact O-N 2.98Å; S128-S132 PolarHBondContact O-OG 3.44Å; F129-S132 PolarHBondContact O-N 3.32Å; S132-K135 WeakPolarHBondContact O-CB 3.48Å; S132-K135 PolarHBondContact O-N 3.05Å; S132-L136 PolarHBondContact O-N 3.42Å |
| 133 | N | 97.7 | Very high | 97.7 | Very high | 71 Ų | 71 | 101.6 Ų | 101.6 | 38% | 0.38 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.9 | -42.6 | 177.4 | -75.6 | -5.1 | 0 | 0 | 0 | 112 | F129 K130 K135 L136 E137 | F129-N133 WeakPolarHBondContact CD1-ND2 3.45Å; F129-N133 WeakPolarHBondContact CE1-ND2 3.38Å; F129-N133 WeakPolarHBondContact CZ-ND2 3.48Å; F129-N133 WeakPolarHBondContact O-CB 3.48Å; F129-N133 PolarHBondContact O-N 2.92Å; K130-N133 PolarHBondContact O-N 3.09Å; N133-K135 VanDerWaalsContact C-N 3.28Å; N133-K135 PolarHBondContact O-N 3.38Å; N133-L136 PolarHBondContact O-N 3.45Å; N133-E137 WeakPolarHBondContact O-CB 3.38Å; N133-E137 PolarHBondContact O-N 2.91Å |
| 134 | Q | 98.1 | Very high | 97.6 | Very high | 95 Ų | 95 | 103.7 Ų | 103.7 | 44% | 0.444 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.2 | -34.7 | 174.6 | -74.2 | 179.3 | -10.4 | 0 | 0 | 112.5 | K130 G131 R138 | K130-Q134 WeakPolarHBondContact O-CG 3.41Å; K130-Q134 PolarHBondContact O-N 3.44Å; G131-Q134 PolarHBondContact O-N 3.34Å; Q134-R138 WeakPolarHBondContact O-CB 3.35Å; Q134-R138 VanDerWaalsContact O-CG 3.31Å; Q134-R138 WeakPolarHBondContact O-CG 3.31Å; Q134-R138 PolarHBondContact O-N 3.3Å; Q134-R138 VanDerWaalsContact O-N 3.15Å; Q134-R138 PolarHBondContact O-NE 3.02Å |
| 135 | K | 97.9 | Very high | 97.6 | Very high | 154 Ų | 154 | 105 Ų | 105 | 67% | 0.67 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -69 | -43.4 | 174.6 | -171.2 | 175.8 | -178.9 | 177.9 | 0 | 111.3 | G131 S132 N133 R138 F139 | G131-K135 PolarHBondContact O-N 3.08Å; S132-K135 WeakPolarHBondContact O-CB 3.48Å; S132-K135 PolarHBondContact O-N 3.05Å; N133-K135 VanDerWaalsContact C-N 3.28Å; N133-K135 PolarHBondContact O-N 3.38Å; K135-R138 PolarHBondContact O-N 2.93Å; K135-F139 WeakPolarHBondContact O-CB 3.05Å; K135-F139 PolarHBondContact O-N 2.98Å |
| 136 | L | 97.7 | Very high | 97.6 | Very high | 102 Ų | 102 | 105.9 Ų | 105.9 | 53% | 0.534 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.1 | -46.6 | 176.3 | -179.3 | 59.9 | 0 | 0 | 0 | 111.5 | S132 N133 R138 F139 C140 | S132-L136 PolarHBondContact O-N 3.42Å; N133-L136 PolarHBondContact O-N 3.45Å; L136-R138 PolarHBondContact O-N 3.26Å; L136-F139 WeakPolarHBondContact O-CB 3.23Å; L136-F139 PolarHBondContact O-N 3.32Å; L136-F139 VanDerWaalsContact O-N 3.15Å; L136-C140 PolarHBondContact O-N 3.44Å; L136-C140 PolarHBondContact O-SG 3.37Å; L136-C140 VanDerWaalsContact O-SG 3.33Å |
| 137 | E | 97.6 | Very high | 97.5 | Very high | 98 Ų | 98 | 102.6 Ų | 102.6 | 46% | 0.458 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.8 | -45.4 | 178.2 | -170.6 | -169.2 | 165.6 | 0 | 0 | 111.8 | N133 F139 C140 K141 | N133-E137 WeakPolarHBondContact O-CB 3.38Å; N133-E137 PolarHBondContact O-N 2.91Å; E137-F139 VanDerWaalsContact C-N 3.32Å; E137-F139 PolarHBondContact O-N 2.95Å; E137-C140 PolarHBondContact O-N 3.31Å; E137-K141 HydrophobicContact CG-CD 4.26Å; E137-K141 WeakPolarHBondContact O-CB 3.38Å; E137-K141 WeakPolarHBondContact O-CG 3.5Å; E137-K141 PolarHBondContact O-N 3.12Å; E137-K141 WeakPolarHBondContact OE1-CE 3.43Å; E137-K141 IonicContact OE1-NZ 3.59Å; E137-K141 PolarHBondContact OE1-NZ 2.79Å |
| 138 | R | 98 | Very high | 97.5 | Very high | 164 Ų | 164 | 103.1 Ų | 103.1 | 62% | 0.619 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60.4 | -41.4 | 174.9 | -77.4 | -174.6 | -69.9 | 171.3 | -5 | 112.1 | Q134 K135 L136 T142 | Q134-R138 WeakPolarHBondContact O-CB 3.35Å; Q134-R138 VanDerWaalsContact O-CG 3.31Å; Q134-R138 WeakPolarHBondContact O-CG 3.31Å; Q134-R138 PolarHBondContact O-N 3.3Å; Q134-R138 VanDerWaalsContact O-N 3.15Å; Q134-R138 PolarHBondContact O-NE 3.02Å; K135-R138 PolarHBondContact O-N 2.93Å; L136-R138 PolarHBondContact O-N 3.26Å; R138-T142 WeakPolarHBondContact O-CB 3.38Å; R138-T142 PolarHBondContact O-N 3.08Å; R138-T142 PolarHBondContact O-OG1 3.34Å |
| 139 | F | 96.8 | Very high | 97.5 | Very high | 139 Ų | 139 | 104.7 Ų | 104.7 | 61% | 0.61 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.9 | -49.3 | 176.3 | 177.5 | -97.7 | 0 | 0 | 0 | 111.2 | K135 L136 E137 K141 T142 N143 | K135-F139 WeakPolarHBondContact O-CB 3.05Å; K135-F139 PolarHBondContact O-N 2.98Å; L136-F139 WeakPolarHBondContact O-CB 3.23Å; L136-F139 PolarHBondContact O-N 3.32Å; L136-F139 VanDerWaalsContact O-N 3.15Å; E137-F139 VanDerWaalsContact C-N 3.32Å; E137-F139 PolarHBondContact O-N 2.95Å; F139-K141 PolarHBondContact O-N 3.1Å; F139-T142 PolarHBondContact O-N 3.35Å; F139-N143 WeakPolarHBondContact O-CB 3.18Å; F139-N143 PolarHBondContact O-N 3.46Å |
| 140 | C | 95.7 | Very high | 97.4 | Very high | 65 Ų | 65 | 103 Ų | 103 | 44% | 0.439 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57.7 | -49.9 | 177.6 | -68.8 | 0 | 0 | 0 | 0 | 111.9 | L136 E137 T142 N143 E144 | L136-C140 PolarHBondContact O-N 3.44Å; L136-C140 PolarHBondContact O-SG 3.37Å; L136-C140 VanDerWaalsContact O-SG 3.33Å; E137-C140 PolarHBondContact O-N 3.31Å; C140-T142 VanDerWaalsContact C-N 3.27Å; C140-T142 PolarHBondContact O-N 3.37Å; C140-N143 PolarHBondContact O-N 2.79Å; C140-E144 WeakPolarHBondContact O-CB 3.34Å; C140-E144 PolarHBondContact O-N 3.41Å |
| 141 | K | 98 | Very high | 97.3 | Very high | 104 Ų | 104 | 99 Ų | 99 | 45% | 0.452 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60 | -35.6 | 177.5 | -75.5 | 176.4 | 170.9 | 172.5 | 0 | 112.9 | E137 F139 R145 | E137-K141 HydrophobicContact CG-CD 4.26Å; E137-K141 WeakPolarHBondContact O-CB 3.38Å; E137-K141 WeakPolarHBondContact O-CG 3.5Å; E137-K141 PolarHBondContact O-N 3.12Å; E137-K141 WeakPolarHBondContact OE1-CE 3.43Å; E137-K141 IonicContact OE1-NZ 3.59Å; E137-K141 PolarHBondContact OE1-NZ 2.79Å; F139-K141 PolarHBondContact O-N 3.1Å; K141-R145 WeakPolarHBondContact O-CB 3.39Å; K141-R145 PolarHBondContact O-N 2.96Å |
| 142 | T | 97.5 | Very high | 97.3 | Very high | 60 Ų | 60 | 101 Ų | 101 | 37% | 0.368 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -69.4 | -48.3 | 177.2 | -58.8 | 0 | 0 | 0 | 0 | 110.6 | R138 F139 C140 E144 R145 E146 | R138-T142 WeakPolarHBondContact O-CB 3.38Å; R138-T142 PolarHBondContact O-N 3.08Å; R138-T142 PolarHBondContact O-OG1 3.34Å; F139-T142 PolarHBondContact O-N 3.35Å; C140-T142 VanDerWaalsContact C-N 3.27Å; C140-T142 PolarHBondContact O-N 3.37Å; T142-E144 PolarHBondContact O-N 2.9Å; T142-R145 WeakPolarHBondContact O-CB 3.48Å; T142-R145 PolarHBondContact O-N 2.85Å; T142-E146 WeakPolarHBondContact O-CG 3.35Å; T142-E146 PolarHBondContact O-N 2.88Å |
| 143 | N | 96.4 | Very high | 97.3 | Very high | 76 Ų | 76 | 102.9 Ų | 102.9 | 41% | 0.406 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.2 | -42.1 | 177.8 | -177.4 | 70.2 | 0 | 0 | 0 | 112.2 | F139 C140 R145 E146 R147 | F139-N143 WeakPolarHBondContact O-CB 3.18Å; F139-N143 PolarHBondContact O-N 3.46Å; C140-N143 PolarHBondContact O-N 2.79Å; N143-R145 PolarHBondContact O-N 3.17Å; N143-E146 PolarHBondContact O-N 3.17Å; N143-R147 WeakPolarHBondContact O-CG 3.36Å; N143-R147 PolarHBondContact O-N 3.23Å |
| 144 | E | 96.7 | Very high | 97.1 | Very high | 112 Ų | 112 | 104.5 Ų | 104.5 | 52% | 0.523 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.6 | -45.9 | 175.3 | -170.7 | -167.8 | 154.9 | 0 | 0 | 111.8 | C140 T142 E146 R147 K148 | C140-E144 WeakPolarHBondContact O-CB 3.34Å; C140-E144 PolarHBondContact O-N 3.41Å; T142-E144 PolarHBondContact O-N 2.9Å; E144-E146 VanDerWaalsContact C-N 3.32Å; E144-E146 PolarHBondContact O-N 3.39Å; E144-R147 PolarHBondContact O-N 2.93Å; E144-K148 PolarHBondContact O-N 3.28Å |
| 145 | R | 97.5 | Very high | 97.1 | Very high | 162 Ų | 162 | 102.5 Ų | 102.5 | 61% | 0.611 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -61.4 | -40.3 | 176.5 | -168 | -173.2 | -57 | 123.6 | 3.6 | 112 | K141 T142 N143 K148 N149 | K141-R145 WeakPolarHBondContact O-CB 3.39Å; K141-R145 PolarHBondContact O-N 2.96Å; T142-R145 WeakPolarHBondContact O-CB 3.48Å; T142-R145 PolarHBondContact O-N 2.85Å; N143-R145 PolarHBondContact O-N 3.17Å; R145-K148 PolarHBondContact O-N 2.99Å; R145-N149 WeakPolarHBondContact O-CB 3.49Å; R145-N149 PolarHBondContact O-N 3.42Å |
| 146 | E | 97.6 | Very high | 97.1 | Very high | 111 Ų | 111 | 101.1 Ų | 101.1 | 52% | 0.519 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64.7 | -45.3 | 176.4 | -73.8 | -179.2 | 177.8 | 0 | 0 | 111.9 | T142 N143 E144 K148 N149 I150 | T142-E146 WeakPolarHBondContact O-CG 3.35Å; T142-E146 PolarHBondContact O-N 2.88Å; N143-E146 PolarHBondContact O-N 3.17Å; E144-E146 VanDerWaalsContact C-N 3.32Å; E144-E146 PolarHBondContact O-N 3.39Å; E146-K148 PolarHBondContact O-N 3.27Å; E146-N149 PolarHBondContact O-N 2.85Å; E146-I150 WeakPolarHBondContact O-CG1 3.43Å; E146-I150 PolarHBondContact O-N 2.85Å |
| 147 | R | 96.8 | Very high | 97 | Very high | 94 Ų | 94 | 102.1 Ų | 102.1 | 36% | 0.355 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -57.9 | -47.2 | 174.2 | -70.5 | -175 | -11.7 | 138.8 | 12.2 | 111.5 | D22 N143 E144 N149 I150 N151 | D22-R147 IonicContact OD2-CZ 3.51Å; D22-R147 IonicContact OD2-NH1 2.63Å; D22-R147 IonicContact OD2-NH2 2.64Å; D22-R147 PolarHBondContact OD2-NH2 2.9Å; N143-R147 WeakPolarHBondContact O-CG 3.36Å; N143-R147 PolarHBondContact O-N 3.23Å; E144-R147 PolarHBondContact O-N 2.93Å; R147-N149 VanDerWaalsContact C-N 3.35Å; R147-N149 PolarHBondContact O-N 3.17Å; R147-I150 PolarHBondContact O-N 3.18Å; R147-N151 PolarHBondContact O-N 2.9Å |
| 148 | K | 97.2 | Very high | 96.9 | Very high | 138 Ų | 138 | 104.2 Ų | 104.2 | 60% | 0.6 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -60.9 | -42.8 | 177.8 | -172.2 | 169 | -175 | 163.5 | 0 | 111.9 | E144 R145 E146 I150 N151 N152 | E144-K148 PolarHBondContact O-N 3.28Å; R145-K148 PolarHBondContact O-N 2.99Å; E146-K148 PolarHBondContact O-N 3.27Å; K148-I150 PolarHBondContact O-N 3.33Å; K148-N151 PolarHBondContact O-N 3.08Å; K148-N152 WeakPolarHBondContact O-CB 3.49Å; K148-N152 PolarHBondContact O-N 3.37Å; K148-N152 PolarHBondContact O-OD1 2.82Å |
| 149 | N | 97.4 | Very high | 96.9 | Very high | 79 Ų | 79 | 101 Ų | 101 | 42% | 0.422 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.3 | -42.2 | 176.5 | -178.7 | 46.5 | 0 | 0 | 0 | 112.4 | R145 E146 R147 K153 | R145-N149 WeakPolarHBondContact O-CB 3.49Å; R145-N149 PolarHBondContact O-N 3.42Å; E146-N149 PolarHBondContact O-N 2.85Å; R147-N149 VanDerWaalsContact C-N 3.35Å; R147-N149 PolarHBondContact O-N 3.17Å; N149-K153 WeakPolarHBondContact O-CG 3.38Å; N149-K153 PolarHBondContact O-N 3.42Å; N149-K153 WeakPolarHBondContact OD1-CE 3.39Å |
| 150 | I | 96.5 | Very high | 97 | Very high | 92 Ų | 92 | 98.5 Ų | 98.5 | 47% | 0.472 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64 | -48.3 | 175.7 | -68.5 | 166.1 | 0 | 0 | 0 | 110.1 | E146 R147 K148 N152 K153 F154 | E146-I150 WeakPolarHBondContact O-CG1 3.43Å; E146-I150 PolarHBondContact O-N 2.85Å; R147-I150 PolarHBondContact O-N 3.18Å; K148-I150 PolarHBondContact O-N 3.33Å; I150-N152 PolarHBondContact O-N 3.27Å; I150-K153 PolarHBondContact O-N 3.08Å; I150-F154 HydrophobicContact CG2-CD2 3.8Å; I150-F154 HydrophobicContact CG2-CE2 3.84Å; I150-F154 WeakPolarHBondContact O-CD2 3.41Å; I150-F154 PolarHBondContact O-N 3.45Å; I150-F154 VanDerWaalsContact O-N 3.08Å |
| 151 | N | 96.6 | Very high | 97.1 | Very high | 53 Ų | 53 | 99.7 Ų | 99.7 | 28% | 0.283 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -58.9 | -47.6 | 179.6 | -168 | 24.5 | 0 | 0 | 0 | 111.5 | R147 K148 K153 F154 C155 | R147-N151 PolarHBondContact O-N 2.9Å; K148-N151 PolarHBondContact O-N 3.08Å; N151-K153 VanDerWaalsContact C-N 3.34Å; N151-K153 PolarHBondContact O-N 3.36Å; N151-F154 PolarHBondContact O-N 3.27Å; N151-F154 VanDerWaalsContact O-N 3.08Å; N151-C155 PolarHBondContact O-N 2.97Å; N151-C155 PolarHBondContact O-SG 3.27Å; N151-C155 VanDerWaalsContact O-SG 3.37Å |
| 152 | N | 97.2 | Very high | 97.1 | Very high | 78 Ų | 78 | 100.8 Ų | 100.8 | 42% | 0.417 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -56.5 | -45.5 | 178 | -72.1 | -5 | 0 | 0 | 0 | 112.2 | K148 I150 F154 C155 E156 | K148-N152 WeakPolarHBondContact O-CB 3.49Å; K148-N152 PolarHBondContact O-N 3.37Å; K148-N152 PolarHBondContact O-OD1 2.82Å; I150-N152 PolarHBondContact O-N 3.27Å; N152-F154 VanDerWaalsContact C-N 3.33Å; N152-F154 PolarHBondContact O-N 3.03Å; N152-C155 PolarHBondContact O-N 3.29Å; N152-E156 WeakPolarHBondContact O-CG 3.43Å; N152-E156 PolarHBondContact O-N 3.46Å |
| 153 | K | 97.2 | Very high | 97.1 | Very high | 113 Ų | 113 | 103.4 Ų | 103.4 | 49% | 0.491 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.7 | -40.1 | 176.8 | -72.5 | 174.5 | -179 | -178.8 | 0 | 112.4 | N149 I150 N151 Q157 | N149-K153 WeakPolarHBondContact O-CG 3.38Å; N149-K153 PolarHBondContact O-N 3.42Å; N149-K153 WeakPolarHBondContact OD1-CE 3.39Å; I150-K153 PolarHBondContact O-N 3.08Å; N151-K153 VanDerWaalsContact C-N 3.34Å; N151-K153 PolarHBondContact O-N 3.36Å; K153-Q157 WeakPolarHBondContact O-CG 3.48Å; K153-Q157 PolarHBondContact O-N 3.35Å |
| 154 | F | 95.3 | Very high | 97.2 | Very high | 105 Ų | 105 | 106.2 Ų | 106.2 | 46% | 0.461 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.5 | -46.1 | 174.8 | -88.8 | -75 | 0 | 0 | 0 | 111.5 | I150 N151 N152 E156 Q157 Y158 | I150-F154 HydrophobicContact CG2-CD2 3.8Å; I150-F154 HydrophobicContact CG2-CE2 3.84Å; I150-F154 WeakPolarHBondContact O-CD2 3.41Å; I150-F154 PolarHBondContact O-N 3.45Å; I150-F154 VanDerWaalsContact O-N 3.08Å; N151-F154 PolarHBondContact O-N 3.27Å; N151-F154 VanDerWaalsContact O-N 3.08Å; N152-F154 VanDerWaalsContact C-N 3.33Å; N152-F154 PolarHBondContact O-N 3.03Å; F154-E156 VanDerWaalsContact C-N 3.34Å; F154-E156 PolarHBondContact O-N 2.95Å; F154-Q157 WeakPolarHBondContact O-CB 3.49Å; F154-Q157 PolarHBondContact O-N 3.26Å; F154-Y158 HydrophobicContact CD1-CE2 4.35Å; F154-Y158 WeakPolarHBondContact O-CD2 3.48Å; F154-Y158 PolarHBondContact O-N 3.46Å |
| 155 | C | 97 | Very high | 97.3 | Very high | 54 Ų | 54 | 103.7 Ų | 103.7 | 37% | 0.365 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -56.5 | -46.1 | 175.9 | -71.1 | 0 | 0 | 0 | 0 | 111.7 | N151 N152 Q157 Y158 I159 | N151-C155 PolarHBondContact O-N 2.97Å; N151-C155 PolarHBondContact O-SG 3.27Å; N151-C155 VanDerWaalsContact O-SG 3.37Å; N152-C155 PolarHBondContact O-N 3.29Å; C155-Q157 VanDerWaalsContact C-N 3.33Å; C155-Q157 PolarHBondContact O-N 3.49Å; C155-Y158 PolarHBondContact O-N 3.42Å; C155-I159 WeakPolarHBondContact O-CB 3.21Å; C155-I159 VanDerWaalsContact O-CG1 3.23Å; C155-I159 WeakPolarHBondContact O-CG1 3.23Å; C155-I159 PolarHBondContact O-N 2.94Å |
| 156 | E | 97.1 | Very high | 97.3 | Very high | 125 Ų | 125 | 100.7 Ų | 100.7 | 58% | 0.584 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -57.7 | -43.9 | 175.8 | -75.9 | 174 | -175.7 | 0 | 0 | 112.2 | N152 F154 T160 | N152-E156 WeakPolarHBondContact O-CG 3.43Å; N152-E156 PolarHBondContact O-N 3.46Å; F154-E156 VanDerWaalsContact C-N 3.34Å; F154-E156 PolarHBondContact O-N 2.95Å; E156-T160 WeakPolarHBondContact O-CB 3.41Å; E156-T160 PolarHBondContact O-N 2.91Å; E156-T160 PolarHBondContact O-OG1 2.96Å |
| 157 | Q | 97 | Very high | 97.4 | Very high | 123 Ų | 123 | 101.3 Ų | 101.3 | 58% | 0.575 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.5 | -44.5 | 176.3 | -73.6 | -178.9 | -7 | 0 | 0 | 112.1 | K153 F154 C155 T161 | K153-Q157 WeakPolarHBondContact O-CG 3.48Å; K153-Q157 PolarHBondContact O-N 3.35Å; F154-Q157 WeakPolarHBondContact O-CB 3.49Å; F154-Q157 PolarHBondContact O-N 3.26Å; C155-Q157 VanDerWaalsContact C-N 3.33Å; C155-Q157 PolarHBondContact O-N 3.49Å; Q157-T161 WeakPolarHBondContact O-CB 3.31Å; Q157-T161 PolarHBondContact O-N 3.04Å; Q157-T161 PolarHBondContact O-OG1 3.28Å |
| 158 | Y | 96 | Very high | 97.5 | Very high | 142 Ų | 142 | 101.1 Ų | 101.1 | 56% | 0.557 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.9 | -49 | 177.1 | -82.4 | -66.8 | 0 | 0 | 0 | 111.5 | F154 C155 T160 T161 F162 | F154-Y158 HydrophobicContact CD1-CE2 4.35Å; F154-Y158 WeakPolarHBondContact O-CD2 3.48Å; F154-Y158 PolarHBondContact O-N 3.46Å; C155-Y158 PolarHBondContact O-N 3.42Å; Y158-T160 VanDerWaalsContact C-N 3.33Å; Y158-T160 PolarHBondContact O-N 2.95Å; Y158-T161 PolarHBondContact O-N 2.94Å; Y158-T161 VanDerWaalsContact O-N 3.12Å; Y158-F162 AromaticContact CD1-CE2 3.97Å; Y158-F162 HydrophobicContact CD1-CE2 3.97Å; Y158-F162 HydrophobicContact CG-CE2 4.46Å; Y158-F162 WeakPolarHBondContact O-CD2 3.42Å; Y158-F162 PolarHBondContact O-N 3.01Å |
| 159 | I | 97.5 | Very high | 97.5 | Very high | 96 Ų | 96 | 98.2 Ų | 98.2 | 49% | 0.492 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -56.3 | -49.2 | 178.6 | -70 | 164.7 | 0 | 0 | 0 | 110.1 | C155 T161 F162 Q163 | C155-I159 WeakPolarHBondContact O-CB 3.21Å; C155-I159 VanDerWaalsContact O-CG1 3.23Å; C155-I159 WeakPolarHBondContact O-CG1 3.23Å; C155-I159 PolarHBondContact O-N 2.94Å; I159-T161 VanDerWaalsContact C-N 3.31Å; I159-T161 PolarHBondContact O-N 3.23Å; I159-F162 PolarHBondContact O-N 3.46Å; I159-Q163 HydrophobicContact CG2-CG 4.39Å; I159-Q163 WeakPolarHBondContact O-CB 3.39Å; I159-Q163 VanDerWaalsContact O-CG 3.31Å; I159-Q163 WeakPolarHBondContact O-CG 3.47Å; I159-Q163 PolarHBondContact O-N 3.47Å |
| 160 | T | 97.9 | Very high | 97.6 | Very high | 87 Ų | 87 | 100.5 Ų | 100.5 | 53% | 0.534 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.7 | -42.1 | 178.1 | -56.6 | 0 | 0 | 0 | 0 | 111.8 | E156 Y158 K164 | E156-T160 WeakPolarHBondContact O-CB 3.41Å; E156-T160 PolarHBondContact O-N 2.91Å; E156-T160 PolarHBondContact O-OG1 2.96Å; Y158-T160 VanDerWaalsContact C-N 3.33Å; Y158-T160 PolarHBondContact O-N 2.95Å; T160-K164 WeakPolarHBondContact O-CB 3.46Å; T160-K164 PolarHBondContact O-N 3.33Å; T160-K164 VanDerWaalsContact O-N 3.08Å |
| 161 | T | 98.1 | Very high | 97.7 | Very high | 89 Ų | 89 | 101.8 Ų | 101.8 | 55% | 0.546 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.4 | -42.5 | 178.8 | -58.6 | 0 | 0 | 0 | 0 | 111.8 | Q157 Y158 I159 K164 S165 | Q157-T161 WeakPolarHBondContact O-CB 3.31Å; Q157-T161 PolarHBondContact O-N 3.04Å; Q157-T161 PolarHBondContact O-OG1 3.28Å; Y158-T161 PolarHBondContact O-N 2.94Å; Y158-T161 VanDerWaalsContact O-N 3.12Å; I159-T161 VanDerWaalsContact C-N 3.31Å; I159-T161 PolarHBondContact O-N 3.23Å; T161-K164 PolarHBondContact O-N 3.49Å; T161-S165 WeakPolarHBondContact O-CB 3.34Å; T161-S165 PolarHBondContact O-N 3.04Å |
| 162 | F | 98.1 | Very high | 97.7 | Very high | 127 Ų | 127 | 105.2 Ų | 105.2 | 56% | 0.557 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -67.4 | -44 | 177.9 | -75.2 | -59.9 | 0 | 0 | 0 | 112 | Y158 I159 K164 S165 D166 | Y158-F162 AromaticContact CD1-CE2 3.97Å; Y158-F162 HydrophobicContact CD1-CE2 3.97Å; Y158-F162 HydrophobicContact CG-CE2 4.46Å; Y158-F162 WeakPolarHBondContact O-CD2 3.42Å; Y158-F162 PolarHBondContact O-N 3.01Å; I159-F162 PolarHBondContact O-N 3.46Å; F162-K164 VanDerWaalsContact C-N 3.3Å; F162-K164 PolarHBondContact O-N 2.76Å; F162-S165 WeakPolarHBondContact O-CB 3.2Å; F162-S165 PolarHBondContact O-N 3.31Å; F162-S165 VanDerWaalsContact O-N 3.1Å; F162-D166 PolarHBondContact O-N 2.64Å |
| 163 | Q | 98.3 | Very high | 97.8 | Very high | 116 Ų | 116 | 105.4 Ų | 105.4 | 54% | 0.542 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -57.1 | -43.8 | 174.5 | -74.7 | 175.7 | -17.9 | 0 | 0 | 111.9 | I159 D166 M167 | I159-Q163 HydrophobicContact CG2-CG 4.39Å; I159-Q163 WeakPolarHBondContact O-CB 3.39Å; I159-Q163 VanDerWaalsContact O-CG 3.31Å; I159-Q163 WeakPolarHBondContact O-CG 3.47Å; I159-Q163 PolarHBondContact O-N 3.47Å; Q163-D166 PolarHBondContact O-N 3.09Å; Q163-M167 WeakPolarHBondContact O-CG 3.43Å; Q163-M167 PolarHBondContact O-N 3.47Å |
| 164 | K | 98.2 | Very high | 97.9 | Very high | 135 Ų | 135 | 105.1 Ų | 105.1 | 59% | 0.587 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63 | -44.3 | 175 | -175.3 | -178.4 | 177.4 | -176.6 | 0 | 111.8 | T160 T161 F162 D166 M167 D168 | T160-K164 WeakPolarHBondContact O-CB 3.46Å; T160-K164 PolarHBondContact O-N 3.33Å; T160-K164 VanDerWaalsContact O-N 3.08Å; T161-K164 PolarHBondContact O-N 3.49Å; F162-K164 VanDerWaalsContact C-N 3.3Å; F162-K164 PolarHBondContact O-N 2.76Å; K164-D166 VanDerWaalsContact C-N 3.32Å; K164-D166 PolarHBondContact O-N 3.25Å; K164-M167 WeakPolarHBondContact O-CB 3.35Å; K164-M167 PolarHBondContact O-N 3.45Å; K164-D168 PolarHBondContact O-N 3.19Å |
| 165 | S | 98.4 | Very high | 98 | Very high | 59 Ų | 59 | 105.1 Ų | 105.1 | 41% | 0.413 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.9 | -42.2 | 176.8 | -176.4 | 0 | 0 | 0 | 0 | 111.8 | T161 F162 D168 V169 | T161-S165 WeakPolarHBondContact O-CB 3.34Å; T161-S165 PolarHBondContact O-N 3.04Å; F162-S165 WeakPolarHBondContact O-CB 3.2Å; F162-S165 PolarHBondContact O-N 3.31Å; F162-S165 VanDerWaalsContact O-N 3.1Å; S165-D168 PolarHBondContact O-N 3.18Å; S165-V169 WeakPolarHBondContact O-CG2 3.29Å; S165-V169 PolarHBondContact O-N 3.44Å |
| 166 | D | 98.5 | Very high | 98.1 | Very high | 98 Ų | 98 | 108.2 Ų | 108.2 | 52% | 0.524 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.9 | -42 | 177.8 | -72.8 | -20.2 | 0 | 0 | 0 | 111.5 | F162 Q163 K164 V169 Q170 | F162-D166 PolarHBondContact O-N 2.64Å; Q163-D166 PolarHBondContact O-N 3.09Å; K164-D166 VanDerWaalsContact C-N 3.32Å; K164-D166 PolarHBondContact O-N 3.25Å; D166-V169 PolarHBondContact O-N 3.15Å; D166-Q170 WeakPolarHBondContact O-CG 3.34Å; D166-Q170 PolarHBondContact O-N 3.44Å |
| 167 | M | 98.4 | Very high | 98.1 | Very high | 125 Ų | 125 | 108.4 Ų | 108.4 | 62% | 0.616 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -60.4 | -44.3 | 172.7 | -73.5 | 175.1 | 51.7 | 0 | 0 | 112.2 | Q163 K164 V169 Q170 K171 | Q163-M167 WeakPolarHBondContact O-CG 3.43Å; Q163-M167 PolarHBondContact O-N 3.47Å; K164-M167 WeakPolarHBondContact O-CB 3.35Å; K164-M167 PolarHBondContact O-N 3.45Å; M167-V169 VanDerWaalsContact C-N 3.31Å; M167-V169 PolarHBondContact O-N 3.47Å; M167-Q170 PolarHBondContact O-N 2.88Å; M167-K171 WeakPolarHBondContact O-CB 2.95Å; M167-K171 PolarHBondContact O-N 3.06Å |
| 168 | D | 98.5 | Very high | 98.2 | Very high | 90 Ų | 90 | 109.2 Ų | 109.2 | 48% | 0.481 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.3 | -37.9 | 178.6 | -73.6 | -23.9 | 0 | 0 | 0 | 111.2 | K164 S165 F172 | K164-D168 PolarHBondContact O-N 3.19Å; S165-D168 PolarHBondContact O-N 3.18Å; D168-F172 WeakPolarHBondContact O-CB 3.35Å; D168-F172 PolarHBondContact O-N 3.01Å |
| 169 | V | 98.5 | Very high | 98.3 | Very high | 77 Ų | 77 | 106.2 Ų | 106.2 | 47% | 0.467 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.7 | -43 | 174.3 | 169.5 | 0 | 0 | 0 | 0 | 111.8 | S165 D166 M167 F172 N173 | S165-V169 WeakPolarHBondContact O-CG2 3.29Å; S165-V169 PolarHBondContact O-N 3.44Å; D166-V169 PolarHBondContact O-N 3.15Å; M167-V169 VanDerWaalsContact C-N 3.31Å; M167-V169 PolarHBondContact O-N 3.47Å; V169-F172 PolarHBondContact O-N 2.87Å; V169-N173 PolarHBondContact O-N 3.31Å; V169-N173 PolarHBondContact O-ND2 3.15Å |
| 170 | Q | 98.3 | Very high | 98.3 | Very high | 126 Ų | 126 | 105.6 Ų | 105.6 | 59% | 0.589 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -60.7 | -49.5 | 175.6 | -73 | 177.8 | 1.4 | 0 | 0 | 111 | D166 M167 F172 N173 E174 | D166-Q170 WeakPolarHBondContact O-CG 3.34Å; D166-Q170 PolarHBondContact O-N 3.44Å; M167-Q170 PolarHBondContact O-N 2.88Å; Q170-F172 VanDerWaalsContact C-N 3.33Å; Q170-F172 PolarHBondContact O-N 2.93Å; Q170-N173 WeakPolarHBondContact O-CB 3.4Å; Q170-N173 PolarHBondContact O-N 2.63Å; Q170-N173 VanDerWaalsContact O-N 3.09Å; Q170-E174 PolarHBondContact O-N 3.27Å; Q170-E174 VanDerWaalsContact O-N 3.08Å |
| 171 | K | 98.6 | Very high | 98.3 | Very high | 119 Ų | 119 | 105 Ų | 105 | 52% | 0.517 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59 | -43.3 | 177.6 | -172.8 | -176.7 | 176.6 | -171.2 | 0 | 112.2 | M167 N173 E174 E175 | M167-K171 WeakPolarHBondContact O-CB 2.95Å; M167-K171 PolarHBondContact O-N 3.06Å; K171-N173 VanDerWaalsContact C-N 3.3Å; K171-N173 PolarHBondContact O-N 2.94Å; K171-E174 PolarHBondContact O-N 3.33Å; K171-E175 WeakPolarHBondContact CE-OE1 3.37Å; K171-E175 PolarHBondContact O-N 3.34Å |
| 172 | F | 98.4 | Very high | 98.3 | Very high | 126 Ų | 126 | 104.1 Ų | 104.1 | 55% | 0.553 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.4 | -41 | 175.5 | 173.5 | -98.2 | 0 | 0 | 0 | 112.2 | D168 V169 Q170 E175 K176 | D168-F172 WeakPolarHBondContact O-CB 3.35Å; D168-F172 PolarHBondContact O-N 3.01Å; V169-F172 PolarHBondContact O-N 2.87Å; Q170-F172 VanDerWaalsContact C-N 3.33Å; Q170-F172 PolarHBondContact O-N 2.93Å; F172-E175 PolarHBondContact O-N 2.8Å; F172-K176 HydrophobicContact CE1-CD 4.37Å; F172-K176 VanDerWaalsContact O-CB 3.26Å; F172-K176 WeakPolarHBondContact O-CB 3.32Å; F172-K176 PolarHBondContact O-N 2.97Å |
| 173 | N | 98.4 | Very high | 98.3 | Very high | 81 Ų | 81 | 101.7 Ų | 101.7 | 43% | 0.433 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66 | -40 | 178 | -76.3 | -33 | 0 | 0 | 0 | 112.3 | V169 Q170 K171 K176 E177 | V169-N173 PolarHBondContact O-N 3.31Å; V169-N173 PolarHBondContact O-ND2 3.15Å; Q170-N173 WeakPolarHBondContact O-CB 3.4Å; Q170-N173 PolarHBondContact O-N 2.63Å; Q170-N173 VanDerWaalsContact O-N 3.09Å; K171-N173 VanDerWaalsContact C-N 3.3Å; K171-N173 PolarHBondContact O-N 2.94Å; N173-K176 PolarHBondContact O-N 3.33Å; N173-E177 PolarHBondContact O-N 3.46Å |
| 174 | E | 98.4 | Very high | 98.3 | Very high | 108 Ų | 108 | 101.1 Ų | 101.1 | 51% | 0.505 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.5 | -45 | 174.6 | -67.7 | 179.1 | -169.6 | 0 | 0 | 112.3 | Q170 K171 K176 E177 K178 | Q170-E174 PolarHBondContact O-N 3.27Å; Q170-E174 VanDerWaalsContact O-N 3.08Å; K171-E174 PolarHBondContact O-N 3.33Å; E174-K176 VanDerWaalsContact C-N 3.34Å; E174-E177 PolarHBondContact O-N 3.03Å; E174-K178 WeakPolarHBondContact O-CG 3.34Å; E174-K178 PolarHBondContact O-N 3.22Å |
| 175 | E | 98.3 | Very high | 98.3 | Very high | 105 Ų | 105 | 102.1 Ų | 102.1 | 49% | 0.491 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64 | -41 | 177.2 | -73.2 | -180 | -174.6 | 0 | 0 | 111.6 | K171 F172 K178 S179 | K171-E175 WeakPolarHBondContact CE-OE1 3.37Å; K171-E175 PolarHBondContact O-N 3.34Å; F172-E175 PolarHBondContact O-N 2.8Å; E175-K178 PolarHBondContact O-N 2.92Å; E175-S179 WeakPolarHBondContact O-CB 3.49Å; E175-S179 PolarHBondContact O-N 3.36Å |
| 176 | K | 98.2 | Very high | 98.3 | Very high | 119 Ų | 119 | 105.9 Ų | 105.9 | 52% | 0.517 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.9 | -45.8 | 174.4 | 177.7 | -172.3 | 170.7 | -170 | 0 | 111.4 | F172 N173 E174 S179 V180 | F172-K176 HydrophobicContact CE1-CD 4.37Å; F172-K176 VanDerWaalsContact O-CB 3.26Å; F172-K176 WeakPolarHBondContact O-CB 3.32Å; F172-K176 PolarHBondContact O-N 2.97Å; N173-K176 PolarHBondContact O-N 3.33Å; E174-K176 VanDerWaalsContact C-N 3.34Å; K176-S179 PolarHBondContact O-N 3.19Å; K176-V180 VanDerWaalsContact O-CG2 3.32Å; K176-V180 WeakPolarHBondContact O-CG2 3.36Å; K176-V180 PolarHBondContact O-N 3.43Å |
| 177 | E | 98.3 | Very high | 98.3 | Very high | 128 Ų | 128 | 106.4 Ų | 106.4 | 60% | 0.598 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.6 | -44.9 | 178.6 | -172.5 | 179.5 | 173.2 | 0 | 0 | 111.7 | N173 E174 S179 V180 N181 | N173-E177 PolarHBondContact O-N 3.46Å; E174-E177 PolarHBondContact O-N 3.03Å; E177-S179 VanDerWaalsContact C-N 3.31Å; E177-S179 PolarHBondContact O-N 2.87Å; E177-V180 PolarHBondContact O-N 3.38Å; E177-N181 PolarHBondContact O-N 3.49Å; E177-N181 PolarHBondContact O-ND2 2.84Å |
| 178 | K | 98.3 | Very high | 98.3 | Very high | 140 Ų | 140 | 105.6 Ų | 105.6 | 61% | 0.609 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -56.8 | -45.1 | 174.1 | -72 | 169.6 | -175.3 | 165 | 0 | 111.7 | E174 E175 N181 S182 | E174-K178 WeakPolarHBondContact O-CG 3.34Å; E174-K178 PolarHBondContact O-N 3.22Å; E175-K178 PolarHBondContact O-N 2.92Å; K178-N181 PolarHBondContact O-N 2.88Å; K178-S182 PolarHBondContact O-N 2.77Å |
| 179 | S | 97.8 | Very high | 98.3 | Very high | 80 Ų | 80 | 104.1 Ų | 104.1 | 56% | 0.559 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.2 | -43.6 | 178.3 | -179.1 | 0 | 0 | 0 | 0 | 112.4 | E175 K176 E177 N181 S182 C183 | E175-S179 WeakPolarHBondContact O-CB 3.49Å; E175-S179 PolarHBondContact O-N 3.36Å; K176-S179 PolarHBondContact O-N 3.19Å; E177-S179 VanDerWaalsContact C-N 3.31Å; E177-S179 PolarHBondContact O-N 2.87Å; S179-N181 PolarHBondContact O-N 3.01Å; S179-S182 PolarHBondContact O-N 3.5Å; S179-C183 WeakPolarHBondContact O-CB 3.34Å; S179-C183 PolarHBondContact O-N 2.91Å |
| 180 | V | 98.4 | Very high | 98.3 | Very high | 82 Ų | 82 | 106.4 Ų | 106.4 | 50% | 0.497 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -60.2 | -46.6 | 176.1 | 169.3 | 0 | 0 | 0 | 0 | 111 | K176 E177 S182 C183 Q184 | K176-V180 VanDerWaalsContact O-CG2 3.32Å; K176-V180 WeakPolarHBondContact O-CG2 3.36Å; K176-V180 PolarHBondContact O-N 3.43Å; E177-V180 PolarHBondContact O-N 3.38Å; V180-S182 VanDerWaalsContact C-N 3.33Å; V180-S182 PolarHBondContact O-N 2.74Å; V180-C183 PolarHBondContact O-N 3.43Å; V180-Q184 PolarHBondContact O-N 2.89Å |
| 181 | N | 98.3 | Very high | 98.3 | Very high | 74 Ų | 74 | 107 Ų | 107 | 40% | 0.396 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.5 | -40.4 | 177.9 | -72.8 | -26.5 | 0 | 0 | 0 | 112.2 | E177 K178 S179 Q184 K185 | E177-N181 PolarHBondContact O-N 3.49Å; E177-N181 PolarHBondContact O-ND2 2.84Å; K178-N181 PolarHBondContact O-N 2.88Å; S179-N181 PolarHBondContact O-N 3.01Å; N181-Q184 PolarHBondContact O-N 3.44Å; N181-K185 WeakPolarHBondContact O-CG 3.32Å; N181-K185 PolarHBondContact O-N 3.28Å; N181-K185 VanDerWaalsContact O-N 3.16Å |
| 182 | S | 98.2 | Very high | 98.2 | Very high | 71 Ų | 71 | 107.4 Ų | 107.4 | 50% | 0.497 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.8 | -44.9 | 175.8 | -166.9 | 0 | 0 | 0 | 0 | 111.7 | K178 S179 V180 Q184 K185 E186 | K178-S182 PolarHBondContact O-N 2.77Å; S179-S182 PolarHBondContact O-N 3.5Å; V180-S182 VanDerWaalsContact C-N 3.33Å; V180-S182 PolarHBondContact O-N 2.74Å; S182-Q184 VanDerWaalsContact C-N 3.29Å; S182-Q184 PolarHBondContact O-N 2.78Å; S182-K185 PolarHBondContact O-N 3.49Å; S182-E186 PolarHBondContact O-N 2.89Å |
| 183 | C | 98.1 | Very high | 98.2 | Very high | 77 Ų | 77 | 105 Ų | 105 | 52% | 0.52 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -60.4 | -39.8 | 177.9 | -178.2 | 0 | 0 | 0 | 0 | 111.5 | S179 V180 E186 Q187 | S179-C183 WeakPolarHBondContact O-CB 3.34Å; S179-C183 PolarHBondContact O-N 2.91Å; V180-C183 PolarHBondContact O-N 3.43Å; C183-E186 PolarHBondContact O-N 2.97Å; C183-Q187 VanDerWaalsContact O-CB 3.31Å; C183-Q187 WeakPolarHBondContact O-CB 3.47Å; C183-Q187 PolarHBondContact O-N 3.08Å |
| 184 | Q | 98.4 | Very high | 98.2 | Very high | 103 Ų | 103 | 107.8 Ų | 107.8 | 48% | 0.481 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -63.5 | -42.9 | 175.8 | -176.2 | 178.4 | -15.9 | 0 | 0 | 112.4 | V180 N181 S182 Q187 Q188 | V180-Q184 PolarHBondContact O-N 2.89Å; N181-Q184 PolarHBondContact O-N 3.44Å; S182-Q184 VanDerWaalsContact C-N 3.29Å; S182-Q184 PolarHBondContact O-N 2.78Å; Q184-Q187 PolarHBondContact O-N 2.85Å; Q184-Q188 WeakPolarHBondContact O-CG 3.49Å; Q184-Q188 PolarHBondContact O-N 2.86Å |
| 185 | K | 98.3 | Very high | 98.2 | Very high | 156 Ų | 156 | 105.7 Ų | 105.7 | 68% | 0.678 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -62 | -46 | 175.6 | -72.7 | 177.4 | 179.9 | 179.7 | 0 | 111.5 | N181 S182 Q187 Q188 A189 | N181-K185 WeakPolarHBondContact O-CG 3.32Å; N181-K185 PolarHBondContact O-N 3.28Å; N181-K185 VanDerWaalsContact O-N 3.16Å; S182-K185 PolarHBondContact O-N 3.49Å; K185-Q187 VanDerWaalsContact C-N 3.34Å; K185-Q187 PolarHBondContact O-N 2.9Å; K185-Q188 PolarHBondContact O-N 3.36Å; K185-A189 PolarHBondContact O-N 3.1Å |
| 186 | E | 97.9 | Very high | 98.2 | Very high | 139 Ų | 139 | 103.7 Ų | 103.7 | 65% | 0.65 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63 | -41.2 | 177.6 | -171.1 | 175.6 | -178 | 0 | 0 | 111.6 | S182 C183 Q188 A189 L190 | S182-E186 PolarHBondContact O-N 2.89Å; C183-E186 PolarHBondContact O-N 2.97Å; E186-Q188 VanDerWaalsContact C-N 3.32Å; E186-Q188 PolarHBondContact O-N 3.16Å; E186-A189 PolarHBondContact O-N 3.39Å; E186-L190 WeakPolarHBondContact O-CB 3.39Å; E186-L190 PolarHBondContact O-N 3.05Å |
| 187 | Q | 98.2 | Very high | 98.2 | Very high | 108 Ų | 108 | 104.5 Ų | 104.5 | 51% | 0.505 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -61.2 | -39.2 | 175.1 | -169.4 | -174.5 | 25.9 | 0 | 0 | 112.2 | C183 Q184 K185 K191 | C183-Q187 VanDerWaalsContact O-CB 3.31Å; C183-Q187 WeakPolarHBondContact O-CB 3.47Å; C183-Q187 PolarHBondContact O-N 3.08Å; Q184-Q187 PolarHBondContact O-N 2.85Å; K185-Q187 VanDerWaalsContact C-N 3.34Å; K185-Q187 PolarHBondContact O-N 2.9Å; Q187-K191 WeakPolarHBondContact O-CG 3.4Å; Q187-K191 PolarHBondContact O-N 2.78Å; Q187-K191 VanDerWaalsContact O-N 3.16Å |
| 188 | Q | 98.3 | Very high | 98.2 | Very high | 108 Ų | 108 | 102.4 Ų | 102.4 | 51% | 0.505 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -66.9 | -45.2 | 174.8 | -72.7 | 178.6 | -2.2 | 0 | 0 | 111.7 | Q184 K185 E186 L190 K191 L192 | Q184-Q188 WeakPolarHBondContact O-CG 3.49Å; Q184-Q188 PolarHBondContact O-N 2.86Å; K185-Q188 PolarHBondContact O-N 3.36Å; E186-Q188 VanDerWaalsContact C-N 3.32Å; E186-Q188 PolarHBondContact O-N 3.16Å; Q188-L190 VanDerWaalsContact C-N 3.32Å; Q188-L190 PolarHBondContact O-N 3.12Å; Q188-K191 PolarHBondContact O-N 3.37Å; Q188-L192 PolarHBondContact O-N 2.9Å; Q188-L192 VanDerWaalsContact O-N 3.09Å |
| 189 | A | 98.3 | Very high | 98.2 | Very high | 60 Ų | 60 | 101.8 Ų | 101.8 | 50% | 0.496 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -59.6 | -42.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | K185 E186 K191 L192 S193 | K185-A189 PolarHBondContact O-N 3.1Å; E186-A189 PolarHBondContact O-N 3.39Å; A189-K191 PolarHBondContact O-N 2.94Å; A189-L192 PolarHBondContact O-N 3.37Å; A189-S193 WeakPolarHBondContact O-CB 3.42Å; A189-S193 PolarHBondContact O-N 3.48Å |
| 190 | L | 98.3 | Very high | 98.2 | Very high | 125 Ų | 125 | 102 Ų | 102 | 65% | 0.654 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -61.5 | -43.3 | 176.5 | -172.2 | 75.7 | 0 | 0 | 0 | 112.1 | E186 Q188 S193 K194 | E186-L190 WeakPolarHBondContact O-CB 3.39Å; E186-L190 PolarHBondContact O-N 3.05Å; Q188-L190 VanDerWaalsContact C-N 3.32Å; Q188-L190 PolarHBondContact O-N 3.12Å; L190-S193 PolarHBondContact O-N 2.88Å; L190-K194 WeakPolarHBondContact O-CB 3.43Å; L190-K194 PolarHBondContact O-N 2.99Å |
| 191 | K | 98.3 | Very high | 98.2 | Very high | 138 Ų | 138 | 102.4 Ų | 102.4 | 60% | 0.6 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -61.2 | -44.6 | 176.4 | -75.2 | 176.6 | -177.7 | 179.4 | 0 | 111.7 | Q187 Q188 A189 K194 C195 | Q187-K191 WeakPolarHBondContact O-CG 3.4Å; Q187-K191 PolarHBondContact O-N 2.78Å; Q187-K191 VanDerWaalsContact O-N 3.16Å; Q188-K191 PolarHBondContact O-N 3.37Å; A189-K191 PolarHBondContact O-N 2.94Å; K191-K194 PolarHBondContact O-N 3.43Å; K191-C195 PolarHBondContact O-N 2.98Å; K191-C195 VanDerWaalsContact O-N 3.08Å |
| 192 | L | 98.3 | Very high | 98.2 | Very high | 127 Ų | 127 | 103.9 Ų | 103.9 | 67% | 0.665 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.6 | -45.2 | 177.8 | -70.9 | 173.7 | 0 | 0 | 0 | 111.7 | Q188 A189 K194 C195 S196 | Q188-L192 PolarHBondContact O-N 2.9Å; Q188-L192 VanDerWaalsContact O-N 3.09Å; A189-L192 PolarHBondContact O-N 3.37Å; L192-K194 VanDerWaalsContact C-N 3.31Å; L192-K194 PolarHBondContact O-N 3.49Å; L192-C195 WeakPolarHBondContact O-CB 3.32Å; L192-C195 PolarHBondContact O-N 2.89Å; L192-S196 PolarHBondContact O-N 3.21Å |
| 193 | S | 98 | Very high | 98.2 | Very high | 76 Ų | 76 | 103 Ų | 103 | 53% | 0.531 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -58.2 | -43.1 | 176.5 | -173.8 | 0 | 0 | 0 | 0 | 111.8 | A189 L190 S196 Q197 | A189-S193 WeakPolarHBondContact O-CB 3.42Å; A189-S193 PolarHBondContact O-N 3.48Å; L190-S193 PolarHBondContact O-N 2.88Å; S193-S196 PolarHBondContact O-N 3.22Å; S193-Q197 WeakPolarHBondContact O-CB 3.4Å; S193-Q197 PolarHBondContact O-N 3.49Å |
| 194 | K | 98.3 | Very high | 98.2 | Very high | 139 Ų | 139 | 103.2 Ų | 103.2 | 60% | 0.604 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -64.3 | -40.7 | 177.3 | -170.8 | 177.8 | -177.9 | 178.4 | 0 | 112 | L190 K191 L192 N198 | L190-K194 WeakPolarHBondContact O-CB 3.43Å; L190-K194 PolarHBondContact O-N 2.99Å; K191-K194 PolarHBondContact O-N 3.43Å; L192-K194 VanDerWaalsContact C-N 3.31Å; L192-K194 PolarHBondContact O-N 3.49Å; K194-N198 PolarHBondContact O-N 3.32Å; K194-N198 VanDerWaalsContact O-N 3.09Å |
| 195 | C | 98.2 | Very high | 98.1 | Very high | 64 Ų | 64 | 103.2 Ų | 103.2 | 43% | 0.432 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.8 | -48 | 175.7 | -171.7 | 0 | 0 | 0 | 0 | 111.5 | K191 L192 Q197 N198 Q199 | K191-C195 PolarHBondContact O-N 2.98Å; K191-C195 VanDerWaalsContact O-N 3.08Å; L192-C195 WeakPolarHBondContact O-CB 3.32Å; L192-C195 PolarHBondContact O-N 2.89Å; C195-Q197 PolarHBondContact O-N 2.75Å; C195-N198 PolarHBondContact O-N 3.47Å; C195-Q199 WeakPolarHBondContact O-CG 3.33Å; C195-Q199 PolarHBondContact O-N 3.48Å |
| 196 | S | 97.8 | Very high | 98.1 | Very high | 64 Ų | 64 | 100.6 Ų | 100.6 | 45% | 0.448 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.4 | -41 | 178.4 | 175.9 | 0 | 0 | 0 | 0 | 112.7 | L192 S193 N198 Q199 T200 | L192-S196 PolarHBondContact O-N 3.21Å; S193-S196 PolarHBondContact O-N 3.22Å; S196-N198 PolarHBondContact O-N 3.42Å; S196-Q199 PolarHBondContact O-N 2.8Å; S196-T200 WeakPolarHBondContact O-CB 3.39Å; S196-T200 PolarHBondContact O-N 3.46Å; S196-T200 PolarHBondContact O-OG1 2.88Å |
| 197 | Q | 98.1 | Very high | 98.1 | Very high | 135 Ų | 135 | 99.9 Ų | 99.9 | 63% | 0.631 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.6 | -44 | 175.3 | -172.8 | -179.7 | 19.3 | 0 | 0 | 111.6 | S193 C195 T200 L201 | S193-Q197 WeakPolarHBondContact O-CB 3.4Å; S193-Q197 PolarHBondContact O-N 3.49Å; C195-Q197 PolarHBondContact O-N 2.75Å; Q197-T200 PolarHBondContact O-N 2.96Å; Q197-L201 PolarHBondContact O-N 3.23Å |
| 198 | N | 98.2 | Very high | 98.1 | Very high | 85 Ų | 85 | 100.6 Ų | 100.6 | 46% | 0.455 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63 | -44.1 | 176.7 | -73.5 | -15 | 0 | 0 | 0 | 111.8 | K194 C195 S196 T200 L201 E202 | K194-N198 PolarHBondContact O-N 3.32Å; K194-N198 VanDerWaalsContact O-N 3.09Å; C195-N198 PolarHBondContact O-N 3.47Å; S196-N198 PolarHBondContact O-N 3.42Å; N198-T200 VanDerWaalsContact C-N 3.33Å; N198-T200 PolarHBondContact O-N 2.95Å; N198-L201 WeakPolarHBondContact O-CB 3.19Å; N198-L201 PolarHBondContact O-N 2.93Å; N198-E202 WeakPolarHBondContact O-CG 3.34Å; N198-E202 PolarHBondContact O-N 3.34Å |
| 199 | Q | 97.9 | Very high | 98 | Very high | 127 Ų | 127 | 102 Ų | 102 | 59% | 0.593 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -60.5 | -42.6 | 176 | -72.5 | 174.1 | -19.2 | 0 | 0 | 112.1 | C195 S196 L201 E202 A203 | C195-Q199 WeakPolarHBondContact O-CG 3.33Å; C195-Q199 PolarHBondContact O-N 3.48Å; S196-Q199 PolarHBondContact O-N 2.8Å; Q199-L201 VanDerWaalsContact C-N 3.34Å; Q199-L201 PolarHBondContact O-N 2.89Å; Q199-E202 PolarHBondContact O-N 3.49Å; Q199-A203 PolarHBondContact O-N 3.44Å |
| 200 | T | 98.1 | Very high | 97.9 | Very high | 83 Ų | 83 | 104.4 Ų | 104.4 | 51% | 0.509 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.5 | -42.4 | 176.8 | -55.2 | 0 | 0 | 0 | 0 | 111.1 | S196 Q197 N198 A203 V204 | S196-T200 WeakPolarHBondContact O-CB 3.39Å; S196-T200 PolarHBondContact O-N 3.46Å; S196-T200 PolarHBondContact O-OG1 2.88Å; Q197-T200 PolarHBondContact O-N 2.96Å; N198-T200 VanDerWaalsContact C-N 3.33Å; N198-T200 PolarHBondContact O-N 2.95Å; T200-A203 PolarHBondContact O-N 3.49Å; T200-V204 WeakPolarHBondContact O-CG2 3.34Å; T200-V204 PolarHBondContact O-N 3.33Å |
| 201 | L | 98.1 | Very high | 97.8 | Very high | 92 Ų | 92 | 101.4 Ų | 101.4 | 48% | 0.482 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.1 | -44.2 | 176.3 | 179.4 | 63.4 | 0 | 0 | 0 | 112 | Q197 N198 Q199 V204 K205 | Q197-L201 PolarHBondContact O-N 3.23Å; N198-L201 WeakPolarHBondContact O-CB 3.19Å; N198-L201 PolarHBondContact O-N 2.93Å; Q199-L201 VanDerWaalsContact C-N 3.34Å; Q199-L201 PolarHBondContact O-N 2.89Å; L201-V204 PolarHBondContact O-N 2.93Å; L201-K205 WeakPolarHBondContact O-CG 3.45Å; L201-K205 PolarHBondContact O-N 2.9Å |
| 202 | E | 98.2 | Very high | 97.6 | Very high | 104 Ų | 104 | 98.9 Ų | 98.9 | 49% | 0.486 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.2 | -41.5 | 176.7 | -67 | -53 | 129.7 | 0 | 0 | 112 | N198 Q199 V204 K205 E206 | N198-E202 WeakPolarHBondContact O-CG 3.34Å; N198-E202 PolarHBondContact O-N 3.34Å; Q199-E202 PolarHBondContact O-N 3.49Å; E202-V204 VanDerWaalsContact C-N 3.33Å; E202-V204 PolarHBondContact O-N 3.3Å; E202-K205 WeakPolarHBondContact O-CB 3.45Å; E202-K205 PolarHBondContact O-N 3.32Å; E202-K205 IonicContact OE1-NZ 2.74Å; E202-K205 PolarHBondContact OE1-NZ 3.42Å; E202-K205 IonicContact OE2-NZ 3.87Å; E202-E206 PolarHBondContact O-N 2.89Å |
| 203 | A | 98.1 | Very high | 97.5 | Very high | 54 Ų | 54 | 97.9 Ų | 97.9 | 45% | 0.446 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.1 | -38.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q199 T200 M207 | Q199-A203 PolarHBondContact O-N 3.44Å; T200-A203 PolarHBondContact O-N 3.49Å; A203-M207 WeakPolarHBondContact O-CB 3.27Å; A203-M207 PolarHBondContact O-N 3.49Å |
| 204 | V | 98.1 | Very high | 97.3 | Very high | 81 Ų | 81 | 98.4 Ų | 98.4 | 49% | 0.491 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.5 | -41.1 | 175 | 171.1 | 0 | 0 | 0 | 0 | 111.1 | T200 L201 E202 M207 H208 | T200-V204 WeakPolarHBondContact O-CG2 3.34Å; T200-V204 PolarHBondContact O-N 3.33Å; L201-V204 PolarHBondContact O-N 2.93Å; E202-V204 VanDerWaalsContact C-N 3.33Å; E202-V204 PolarHBondContact O-N 3.3Å; V204-M207 PolarHBondContact O-N 3.09Å; V204-H208 WeakPolarHBondContact O-CB 3.37Å; V204-H208 PolarHBondContact O-N 3.34Å |
| 205 | K | 98 | Very high | 97.1 | Very high | 103 Ų | 103 | 97.2 Ų | 97.2 | 45% | 0.448 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.9 | -46.6 | 175.6 | -71.9 | 173.7 | -176.4 | 169.9 | 0 | 111.8 | L201 E202 M207 H208 E209 | L201-K205 WeakPolarHBondContact O-CG 3.45Å; L201-K205 PolarHBondContact O-N 2.9Å; E202-K205 WeakPolarHBondContact O-CB 3.45Å; E202-K205 PolarHBondContact O-N 3.32Å; E202-K205 IonicContact OE1-NZ 2.74Å; E202-K205 PolarHBondContact OE1-NZ 3.42Å; E202-K205 IonicContact OE2-NZ 3.87Å; K205-M207 PolarHBondContact O-N 2.98Å; K205-H208 WeakPolarHBondContact O-CB 3.49Å; K205-H208 PolarHBondContact O-N 2.96Å; K205-E209 PolarHBondContact O-N 3.32Å |
| 206 | E | 97.9 | Very high | 96.8 | Very high | 101 Ų | 101 | 99.8 Ų | 99.8 | 47% | 0.472 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.2 | -42.2 | 178.8 | -170.9 | -169.7 | 158.4 | 0 | 0 | 111.6 | E202 H208 E209 K210 | E202-E206 PolarHBondContact O-N 2.89Å; E206-H208 VanDerWaalsContact C-N 3.34Å; E206-H208 PolarHBondContact O-N 3.18Å; E206-E209 PolarHBondContact O-N 3.44Å; E206-K210 HydrophobicContact CG-CD 4.37Å; E206-K210 WeakPolarHBondContact O-CB 3.46Å; E206-K210 WeakPolarHBondContact O-CG 3.44Å; E206-K210 PolarHBondContact O-N 3.17Å; E206-K210 WeakPolarHBondContact OE1-CE 3.5Å; E206-K210 IonicContact OE1-NZ 2.62Å; E206-K210 PolarHBondContact OE1-NZ 2.91Å |
| 207 | M | 97.3 | Very high | 96.5 | Very high | 123 Ų | 123 | 100.8 Ų | 100.8 | 61% | 0.606 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.2 | -43.1 | 175 | -173.9 | -147.2 | -60.5 | 0 | 0 | 111.7 | A203 V204 K205 S211 | A203-M207 WeakPolarHBondContact O-CB 3.27Å; A203-M207 PolarHBondContact O-N 3.49Å; V204-M207 PolarHBondContact O-N 3.09Å; K205-M207 PolarHBondContact O-N 2.98Å; M207-S211 WeakPolarHBondContact O-CB 3.26Å; M207-S211 PolarHBondContact O-N 2.91Å; M207-S211 PolarHBondContact O-OG 3.29Å |
| 208 | H | 97.6 | Very high | 96 | Very high | 123 Ų | 123 | 99.5 Ų | 99.5 | 57% | 0.569 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63 | -45.9 | 177.1 | 174 | -89.3 | 0 | 0 | 0 | 111.4 | V204 K205 E206 S211 M212 | V204-H208 WeakPolarHBondContact O-CB 3.37Å; V204-H208 PolarHBondContact O-N 3.34Å; K205-H208 WeakPolarHBondContact O-CB 3.49Å; K205-H208 PolarHBondContact O-N 2.96Å; E206-H208 VanDerWaalsContact C-N 3.34Å; E206-H208 PolarHBondContact O-N 3.18Å; H208-S211 PolarHBondContact O-N 2.8Å; H208-M212 WeakPolarHBondContact O-CG 3.31Å; H208-M212 PolarHBondContact O-N 2.93Å |
| 209 | E | 96.9 | Very high | 95.2 | Very high | 137 Ų | 137 | 98.2 Ų | 98.2 | 64% | 0.64 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.5 | -48.9 | 177 | -173.9 | 171.7 | -168.5 | 0 | 0 | 111.9 | K205 E206 S211 M212 E213 | K205-E209 PolarHBondContact O-N 3.32Å; E206-E209 PolarHBondContact O-N 3.44Å; E209-S211 VanDerWaalsContact C-N 3.31Å; E209-S211 PolarHBondContact O-N 3.35Å; E209-M212 PolarHBondContact O-N 3.29Å; E209-E213 PolarHBondContact O-N 3.17Å |
| 210 | K | 96.5 | Very high | 94.1 | Very high | 112 Ų | 112 | 97.2 Ų | 97.2 | 49% | 0.487 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -58.8 | -40.8 | 174.6 | -76.4 | 173.1 | 172.3 | 168.5 | 0 | 112.7 | E206 E213 V214 | E206-K210 HydrophobicContact CG-CD 4.37Å; E206-K210 WeakPolarHBondContact O-CB 3.46Å; E206-K210 WeakPolarHBondContact O-CG 3.44Å; E206-K210 PolarHBondContact O-N 3.17Å; E206-K210 WeakPolarHBondContact OE1-CE 3.5Å; E206-K210 IonicContact OE1-NZ 2.62Å; E206-K210 PolarHBondContact OE1-NZ 2.91Å; K210-E213 PolarHBondContact O-N 2.94Å; K210-V214 WeakPolarHBondContact O-CG2 3.08Å; K210-V214 PolarHBondContact O-N 2.74Å |
| 211 | S | 95.9 | Very high | 92.3 | Very high | 61 Ų | 61 | 101.9 Ų | 101.9 | 43% | 0.427 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -64.3 | -43.4 | 178.2 | -60 | 0 | 0 | 0 | 0 | 111.4 | M207 H208 E209 V214 L215 | M207-S211 WeakPolarHBondContact O-CB 3.26Å; M207-S211 PolarHBondContact O-N 2.91Å; M207-S211 PolarHBondContact O-OG 3.29Å; H208-S211 PolarHBondContact O-N 2.8Å; E209-S211 VanDerWaalsContact C-N 3.31Å; E209-S211 PolarHBondContact O-N 3.35Å; S211-V214 PolarHBondContact O-N 3.29Å; S211-L215 WeakPolarHBondContact O-CG 3.4Å; S211-L215 PolarHBondContact O-N 3.14Å |
| 212 | M | 95.2 | Very high | 89.9 | Confident | 85 Ų | 85 | 107.3 Ų | 107.3 | 42% | 0.419 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.1 | -40.6 | 175.7 | -70.8 | -62 | -65.2 | 0 | 0 | 111.9 | H208 E209 L215 M216 | H208-M212 WeakPolarHBondContact O-CG 3.31Å; H208-M212 PolarHBondContact O-N 2.93Å; E209-M212 PolarHBondContact O-N 3.29Å; M212-L215 PolarHBondContact O-N 2.92Å; M212-L215 HydrophobicContact SD-CD1 4.45Å; M212-M216 HydrophobicContact CB-CE 4.36Å; M212-M216 WeakPolarHBondContact O-CG 3.48Å; M212-M216 PolarHBondContact O-N 3Å |
| 213 | E | 95 | Very high | 89.5 | Confident | 107 Ų | 107 | 107.5 Ų | 107.5 | 50% | 0.5 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -60.4 | -46.1 | 175.1 | -174.4 | -178.4 | -176.9 | 0 | 0 | 112.2 | E209 K210 L215 M216 N217 | E209-E213 PolarHBondContact O-N 3.17Å; K210-E213 PolarHBondContact O-N 2.94Å; E213-L215 PolarHBondContact O-N 3.39Å; E213-M216 PolarHBondContact O-N 3.46Å; E213-N217 WeakPolarHBondContact O-CB 3.28Å; E213-N217 VanDerWaalsContact O-CG 3.3Å; E213-N217 PolarHBondContact O-N 3.42Å; E213-N217 PolarHBondContact O-ND2 3.34Å; E213-N217 VanDerWaalsContact O-ND2 3.16Å |
| 214 | V | 94.8 | Very high | 89.1 | Confident | 86 Ų | 86 | 110.3 Ų | 110.3 | 52% | 0.521 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -59.8 | -45 | 175.6 | 170 | 0 | 0 | 0 | 0 | 111.2 | K210 S211 N217 L218 | K210-V214 WeakPolarHBondContact O-CG2 3.08Å; K210-V214 PolarHBondContact O-N 2.74Å; S211-V214 PolarHBondContact O-N 3.29Å; V214-N217 PolarHBondContact O-N 2.97Å; V214-L218 HydrophobicContact CG1-CD1 3.75Å; V214-L218 WeakPolarHBondContact O-CD1 3.38Å; V214-L218 WeakPolarHBondContact O-CG 3.47Å; V214-L218 PolarHBondContact O-N 3.37Å |
| 215 | L | 93.3 | Very high | 88.6 | Confident | 115 Ų | 115 | 111.9 Ų | 111.9 | 60% | 0.602 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -62.8 | -42.1 | 177.4 | -71 | 173.5 | 0 | 0 | 0 | 112.4 | S211 M212 E213 L218 G219 | S211-L215 WeakPolarHBondContact O-CG 3.4Å; S211-L215 PolarHBondContact O-N 3.14Å; M212-L215 PolarHBondContact O-N 2.92Å; M212-L215 HydrophobicContact SD-CD1 4.45Å; E213-L215 PolarHBondContact O-N 3.39Å; L215-L218 PolarHBondContact O-N 2.92Å; L215-G219 PolarHBondContact O-N 3.28Å; L215-G219 VanDerWaalsContact O-N 3.12Å |
| 216 | M | 91.7 | Very high | 88 | Confident | 118 Ų | 118 | 112.5 Ų | 112.5 | 58% | 0.581 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -63 | -41.7 | 175.5 | -73.9 | -173.7 | -77 | 0 | 0 | 111.9 | M212 E213 L218 G219 T220 | M212-M216 HydrophobicContact CB-CE 4.36Å; M212-M216 WeakPolarHBondContact O-CG 3.48Å; M212-M216 PolarHBondContact O-N 3Å; E213-M216 PolarHBondContact O-N 3.46Å; M216-L218 VanDerWaalsContact C-N 3.35Å; M216-L218 PolarHBondContact O-N 3.02Å; M216-G219 PolarHBondContact O-N 3.36Å; M216-T220 PolarHBondContact O-N 2.93Å; M216-T220 PolarHBondContact O-OG1 3.23Å |
| 217 | N | 91.2 | Very high | 87.4 | Confident | 84 Ų | 84 | 113.2 Ų | 113.2 | 45% | 0.449 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -70.5 | -26.4 | 178.4 | -73.1 | -33.6 | 0 | 0 | 0 | 113.9 | E213 V214 T220 | E213-N217 WeakPolarHBondContact O-CB 3.28Å; E213-N217 VanDerWaalsContact O-CG 3.3Å; E213-N217 PolarHBondContact O-N 3.42Å; E213-N217 PolarHBondContact O-ND2 3.34Å; E213-N217 VanDerWaalsContact O-ND2 3.16Å; V214-N217 PolarHBondContact O-N 2.97Å; N217-T220 PolarHBondContact O-OG1 2.9Å |
| 218 | L | 88.2 | Confident | 86.8 | Confident | 109 Ų | 109 | 112.5 Ų | 112.5 | 57% | 0.571 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -74.4 | -37.3 | 172.2 | -82.4 | 153.4 | 0 | 0 | 0 | 111.6 | V214 L215 M216 T220 K221 | V214-L218 HydrophobicContact CG1-CD1 3.75Å; V214-L218 WeakPolarHBondContact O-CD1 3.38Å; V214-L218 WeakPolarHBondContact O-CG 3.47Å; V214-L218 PolarHBondContact O-N 3.37Å; L215-L218 PolarHBondContact O-N 2.92Å; M216-L218 VanDerWaalsContact C-N 3.35Å; M216-L218 PolarHBondContact O-N 3.02Å; L218-T220 VanDerWaalsContact C-N 3.29Å; L218-T220 PolarHBondContact O-N 3.44Å; L218-K221 PolarHBondContact O-N 2.96Å |
| 219 | G | 80.9 | Confident | 86 | Confident | 57 Ų | 57 | 111.8 Ų | 111.8 | 59% | 0.588 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -69.5 | -20.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | L215 M216 | L215-G219 PolarHBondContact O-N 3.28Å; L215-G219 VanDerWaalsContact O-N 3.12Å; M216-G219 PolarHBondContact O-N 3.36Å |
| 220 | T | 74.7 | Confident | 85.2 | Confident | 106 Ų | 106 | 109.8 Ų | 109.8 | 65% | 0.65 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.1 | -6.1 | 179.4 | 52.2 | 0 | 0 | 0 | 0 | 114.3 | M216 N217 L218 | M216-T220 PolarHBondContact O-N 2.93Å; M216-T220 PolarHBondContact O-OG1 3.23Å; N217-T220 PolarHBondContact O-OG1 2.9Å; L218-T220 VanDerWaalsContact C-N 3.29Å; L218-T220 PolarHBondContact O-N 3.44Å |
| 221 | K | 60.8 | Low | 84.2 | Confident | 181 Ų | 181 | 109.7 Ų | 109.7 | 79% | 0.787 | 60% | 0.6 | S | S | * | * | trans | -99.9 | 5.8 | -178.9 | -78.3 | -177.2 | 178.1 | 175 | 0 | 114.8 | L218 | L218-K221 PolarHBondContact O-N 2.96Š| ||
| 222 | N | 48.8 | Very low | 83.2 | Confident | 207 Ų | 207 | 114.1 Ų | 114.1 | 100% | 1.107 | 62% | 0.616 | S | S | * | * | trans | -114.3 | 0 | 170.1 | -71.8 | -25.2 | 0 | 0 | 0 | 110 |
Retrieved 222 of 222 residues in 304.5 ms
(Link to these results)