| 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 | 35.6 | Very low | 33.2 | Very low | 249 Ų | 249 | 135.6 Ų | 135.6 | 100% | 1.227 | 81% | 0.814 | S | S | * | * | 0 | 116.7 | 0 | -82.6 | 164.1 | 122.1 | 0 | 0 | 107.3 | |||||
| 2 | A | 33.6 | Very low | 32.9 | Very low | 98 Ų | 98 | 131.5 Ų | 131.5 | 81% | 0.81 | 80% | 0.797 | S | S | * | * | trans | 16.1 | 111.7 | 171 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 3 | S | 45.4 | Very low | 32.4 | Very low | 112 Ų | 112 | 135.9 Ų | 135.9 | 78% | 0.783 | 80% | 0.803 | S | S | * | * | trans | -62.6 | 154 | 138 | -56.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 4 | P | 37.6 | Very low | 31.8 | Very low | 120 Ų | 120 | 134.3 Ų | 134.3 | 78% | 0.779 | 80% | 0.802 | S | S | * | * | -145.1 | 136.3 | 81.2 | 30.4 | -9.3 | 0 | 0 | 0 | 115 | |||||
| 5 | Q | 39.3 | Very low | 31.4 | Very low | 166 Ų | 166 | 136.3 Ų | 136.3 | 78% | 0.776 | 81% | 0.807 | S | S | * | * | trans | -51.1 | 147.9 | 145 | -72.3 | 166.4 | -72.8 | 0 | 0 | 110.4 | ||||
| 6 | S | 32.7 | Very low | 30.9 | Very low | 103 Ų | 103 | 138.9 Ų | 138.9 | 72% | 0.72 | 81% | 0.808 | S | S | * | * | trans | 175.5 | 93.2 | 134.3 | 51.7 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 7 | D | 28.4 | Very low | 30.4 | Very low | 132 Ų | 132 | 141.8 Ų | 141.8 | 71% | 0.706 | 82% | 0.819 | S | S | * | * | 61.6 | 110.7 | 89.9 | -70.5 | -28.1 | 0 | 0 | 0 | 111.7 | |||||
| 8 | S | 33.2 | Very low | 30.1 | Very low | 109 Ų | 109 | 138.7 Ų | 138.7 | 76% | 0.762 | 81% | 0.806 | S | S | * | * | trans | 48.4 | 121.4 | 139 | 67.6 | 0 | 0 | 0 | 0 | 118 | ||||
| 9 | S | 27.2 | Very low | 29.9 | Very low | 108 Ų | 108 | 139.9 Ų | 139.9 | 76% | 0.755 | 81% | 0.808 | S | S | * | * | -166.4 | 115 | 117.4 | 38.8 | 0 | 0 | 0 | 0 | 111.1 | L11 | S9-L11 PolarHBondContact O-N 3.43Š| |||
| 10 | V | 26.7 | Very low | 29.7 | Very low | 117 Ų | 117 | 138.9 Ų | 138.9 | 71% | 0.709 | 81% | 0.805 | S | S | * | * | 46.5 | 81.3 | 129.2 | -153.2 | 0 | 0 | 0 | 0 | 114.1 | S12 | V10-S12 WeakPolarHBondContact CG1-OG 3.45Å; V10-S12 PolarHBondContact O-N 2.94Å | |||
| 11 | L | 25.3 | Very low | 29.5 | Very low | 178 Ų | 178 | 139.3 Ų | 139.3 | 93% | 0.932 | 80% | 0.804 | S | S | * | * | trans | -58.1 | 85 | 141.4 | -102.5 | 152.2 | 0 | 0 | 0 | 105.6 | S9 E13 | S9-L11 PolarHBondContact O-N 3.43Å; L11-E13 PolarHBondContact O-N 3.06Å | ||
| 12 | S | 29.4 | Very low | 29.1 | Very low | 86 Ų | 86 | 133.5 Ų | 133.5 | 60% | 0.601 | 79% | 0.786 | S | S | * | * | trans | -67.6 | 90.5 | 165.8 | -53.1 | 0 | 0 | 0 | 0 | 103.8 | V10 S14 | V10-S12 WeakPolarHBondContact CG1-OG 3.45Å; V10-S12 PolarHBondContact O-N 2.94Å; S12-S14 PolarHBondContact O-N 2.74Å | ||
| 13 | E | 26.1 | Very low | 28.8 | Very low | 189 Ų | 189 | 133.7 Ų | 133.7 | 88% | 0.883 | 78% | 0.782 | S | S | * | * | trans | -46.6 | 90.7 | 161.7 | -161.6 | 175.4 | 153 | 0 | 0 | 107.9 | L11 | L11-E13 PolarHBondContact O-N 3.06Š| ||
| 14 | S | 24.6 | Very low | 28.1 | Very low | 113 Ų | 113 | 133 Ų | 133 | 79% | 0.79 | 78% | 0.777 | S | S | * | * | trans | -121.5 | 69.9 | 166.7 | 68.7 | 0 | 0 | 0 | 0 | 107.5 | S12 | S12-S14 PolarHBondContact O-N 2.74Š| ||
| 15 | L | 25.2 | Very low | 27.6 | Very low | 165 Ų | 165 | 134.5 Ų | 134.5 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | trans | -111.6 | 72 | 164 | -165.8 | 123.9 | 0 | 0 | 0 | 107.4 | ||||
| 16 | E | 23.6 | Very low | 27.3 | Very low | 177 Ų | 177 | 136.2 Ų | 136.2 | 83% | 0.827 | 79% | 0.787 | S | S | * | * | trans | -140.2 | 68.6 | 167.2 | -74 | -164.5 | 141.8 | 0 | 0 | 109.1 | S18 | E16-S18 PolarHBondContact O-N 2.94Å; E16-S18 VanDerWaalsContact O-N 3.09Å | ||
| 17 | L | 22.8 | Very low | 27.2 | Very low | 189 Ų | 189 | 139.8 Ų | 139.8 | 99% | 0.99 | 79% | 0.789 | S | S | * | * | trans | -77.5 | 76.6 | 148.7 | -103.9 | 142.8 | 0 | 0 | 0 | 106.6 | ||||
| 18 | S | 25.1 | Very low | 27.2 | Very low | 86 Ų | 86 | 141.4 Ų | 141.4 | 60% | 0.601 | 80% | 0.797 | S | S | * | * | trans | -82.8 | 121.7 | 158.3 | 73.8 | 0 | 0 | 0 | 0 | 107.6 | E16 | E16-S18 PolarHBondContact O-N 2.94Å; E16-S18 VanDerWaalsContact O-N 3.09Å | ||
| 19 | L | 26.1 | Very low | 26.9 | Very low | 161 Ų | 161 | 143 Ų | 143 | 84% | 0.843 | 80% | 0.795 | S | S | * | * | trans | -173.1 | 83.6 | 142.4 | -100.8 | 144.6 | 0 | 0 | 0 | 106.3 | ||||
| 20 | T | 25.1 | Very low | 27.1 | Very low | 120 Ų | 120 | 143.2 Ų | 143.2 | 74% | 0.736 | 79% | 0.792 | S | S | * | * | trans | -36.3 | 140.9 | 141.9 | 3.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 21 | D | 26.7 | Very low | 27.2 | Very low | 147 Ų | 147 | 145.4 Ų | 145.4 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | trans | 66.7 | 86.8 | 166.6 | -62.8 | -23 | 0 | 0 | 0 | 117.7 | ||||
| 22 | C | 26 | Very low | 27.3 | Very low | 127 Ų | 127 | 141.1 Ų | 141.1 | 86% | 0.858 | 79% | 0.785 | S | S | * | * | trans | -127.3 | 85 | 141.6 | -76.9 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 23 | S | 27.3 | Very low | 27.1 | Very low | 102 Ų | 102 | 144.5 Ų | 144.5 | 71% | 0.713 | 79% | 0.789 | S | S | * | * | trans | -48.5 | 144.1 | 152 | 56.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 24 | S | 30.9 | Very low | 26.9 | Very low | 98 Ų | 98 | 147.1 Ų | 147.1 | 69% | 0.685 | 79% | 0.791 | S | S | * | * | trans | 58.5 | 100.1 | 172.3 | 65.3 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 25 | D | 28 | Very low | 27 | Very low | 151 Ų | 151 | 152.1 Ų | 152.1 | 81% | 0.807 | 79% | 0.794 | S | S | * | * | -167.9 | 110.1 | 117.9 | -89 | -25.7 | 0 | 0 | 0 | 110.6 | K27 | D25-K27 PolarHBondContact O-N 2.82Š| |||
| 26 | E | 31.9 | Very low | 27.1 | Very low | 203 Ų | 203 | 153 Ų | 153 | 95% | 0.949 | 79% | 0.793 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.9 | 39.2 | -178.4 | -140.5 | 172.6 | -162.8 | 0 | 0 | 112.7 | ||
| 27 | K | 32.5 | Very low | 27.2 | Very low | 177 Ų | 177 | 153.3 Ų | 153.3 | 77% | 0.77 | 80% | 0.795 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.2 | 2 | -172 | -98.1 | -176.8 | 176.4 | 179.7 | 0 | 117 | D25 | D25-K27 PolarHBondContact O-N 2.82Š|
| 28 | L | 27.5 | Very low | 27.4 | Very low | 167 Ų | 167 | 151.7 Ų | 151.7 | 87% | 0.874 | 79% | 0.785 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.3 | 2.3 | -178.4 | -138.4 | 89.5 | 0 | 0 | 0 | 115.9 | ||
| 29 | I | 27.5 | Very low | 27.4 | Very low | 141 Ų | 141 | 157 Ų | 157 | 72% | 0.723 | 80% | 0.801 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.9 | -2.9 | 177.2 | -53.9 | -179.5 | 0 | 0 | 0 | 112.2 | ||
| 30 | V | 29.9 | Very low | 27.4 | Very low | 113 Ų | 113 | 152.5 Ų | 152.5 | 69% | 0.685 | 79% | 0.794 | S | S | * | * | G | 310 helix | trans | -85.7 | -16.1 | -178 | -176.4 | 0 | 0 | 0 | 0 | 113.5 | ||
| 31 | D | 29.6 | Very low | 27.5 | Very low | 163 Ų | 163 | 154.4 Ų | 154.4 | 87% | 0.872 | 80% | 0.798 | S | S | * | * | G | 310 helix | trans | -93.4 | 9.4 | -173.6 | -103.8 | 4.7 | 0 | 0 | 0 | 116 | ||
| 32 | S | 26.8 | Very low | 27.6 | Very low | 89 Ų | 89 | 151.9 Ų | 151.9 | 62% | 0.622 | 80% | 0.797 | S | S | * | * | G | 310 helix | trans | -99.1 | -6.5 | 178.6 | 68 | 0 | 0 | 0 | 0 | 115.6 | R34 | S32-R34 VanDerWaalsContact C-N 3.35Å; S32-R34 PolarHBondContact O-N 3.45Å; S32-R34 VanDerWaalsContact O-N 3.1Å |
| 33 | F | 25.3 | Very low | 27.8 | Very low | 157 Ų | 157 | 153.1 Ų | 153.1 | 69% | 0.689 | 80% | 0.795 | S | S | * | * | trans | -88.5 | 74.2 | 176 | -64.4 | -78.3 | 0 | 0 | 0 | 110.9 | Y35 | F33-Y35 HydrophobicContact CB-CE2 4.49Å; F33-Y35 PolarHBondContact O-N 3.01Å | ||
| 34 | R | 23.4 | Very low | 28 | Very low | 243 Ų | 243 | 155.3 Ų | 155.3 | 92% | 0.917 | 80% | 0.799 | S | S | * | * | trans | -68.3 | 105.3 | 157.4 | -85.1 | -173.4 | 173 | -156.5 | -2.6 | 107.5 | S32 E36 | S32-R34 VanDerWaalsContact C-N 3.35Å; S32-R34 PolarHBondContact O-N 3.45Å; S32-R34 VanDerWaalsContact O-N 3.1Å; R34-E36 PolarHBondContact O-N 3.29Å | ||
| 35 | Y | 26 | Very low | 28 | Very low | 218 Ų | 218 | 158 Ų | 158 | 86% | 0.855 | 81% | 0.806 | S | S | * | * | trans | -61.6 | 116.1 | 166.7 | -74.4 | -94.4 | 0 | 0 | 0 | 108.4 | F33 E37 | F33-Y35 HydrophobicContact CB-CE2 4.49Å; F33-Y35 PolarHBondContact O-N 3.01Å; Y35-E37 PolarHBondContact O-N 3.44Å | ||
| 36 | E | 27.3 | Very low | 28.2 | Very low | 184 Ų | 184 | 158 Ų | 158 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | trans | -77.9 | 104.7 | 168.1 | -161.3 | 165.6 | -159.1 | 0 | 0 | 106.4 | R34 I38 | R34-E36 PolarHBondContact O-N 3.29Å; E36-I38 PolarHBondContact O-N 3.02Å; E36-I38 VanDerWaalsContact O-N 3.12Å | ||
| 37 | E | 25.9 | Very low | 28 | Very low | 184 Ų | 184 | 156.1 Ų | 156.1 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | trans | -56.8 | 112 | 176.1 | -172.4 | 174.8 | -170.8 | 0 | 0 | 108.9 | Y35 Q39 | Y35-E37 PolarHBondContact O-N 3.44Å; E37-Q39 PolarHBondContact O-N 3.49Å | ||
| 38 | I | 26.7 | Very low | 28.1 | Very low | 154 Ų | 154 | 151.2 Ų | 151.2 | 79% | 0.79 | 79% | 0.793 | S | S | * | * | trans | -69.5 | 96.4 | 179.6 | -56.3 | 173.1 | 0 | 0 | 0 | 107.3 | E36 G40 | E36-I38 PolarHBondContact O-N 3.02Å; E36-I38 VanDerWaalsContact O-N 3.12Å; I38-G40 PolarHBondContact O-N 3.28Å; I38-G40 VanDerWaalsContact O-N 3.09Å | ||
| 39 | Q | 25 | Very low | 28.2 | Very low | 198 Ų | 198 | 151.2 Ų | 151.2 | 93% | 0.925 | 79% | 0.788 | S | S | * | * | trans | -61 | 107.3 | 164.1 | -102.9 | 177.1 | 8.2 | 0 | 0 | 108.7 | E37 | E37-Q39 PolarHBondContact O-N 3.49Š| ||
| 40 | G | 26.1 | Very low | 28.5 | Very low | 67 Ų | 67 | 149.9 Ų | 149.9 | 69% | 0.691 | 79% | 0.786 | S | S | * | * | trans | 146.3 | 47.8 | 166.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | I38 | I38-G40 PolarHBondContact O-N 3.28Å; I38-G40 VanDerWaalsContact O-N 3.09Å | ||
| 41 | I | 26.9 | Very low | 28.5 | Very low | 160 Ų | 160 | 148.2 Ų | 148.2 | 82% | 0.821 | 78% | 0.777 | S | S | * | * | trans | -129.2 | 109.6 | 150.9 | -56.7 | -180 | 0 | 0 | 0 | 105.3 | D43 | I41-D43 PolarHBondContact O-N 3.12Š| ||
| 42 | A | 29.5 | Very low | 28.8 | Very low | 94 Ų | 94 | 147.7 Ų | 147.7 | 78% | 0.777 | 77% | 0.769 | S | S | * | * | trans | -56.5 | 134 | 178.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | D44 | A42-D44 PolarHBondContact O-N 3.07Š| ||
| 43 | D | 30.4 | Very low | 29 | Very low | 152 Ų | 152 | 149.5 Ų | 149.5 | 81% | 0.813 | 77% | 0.772 | S | S | * | * | trans | -46.2 | 121 | 167.6 | -60.1 | -53.7 | 0 | 0 | 0 | 110.3 | I41 | I41-D43 PolarHBondContact O-N 3.12Š| ||
| 44 | D | 30.5 | Very low | 29.5 | Very low | 149 Ų | 149 | 144.7 Ų | 144.7 | 80% | 0.797 | 76% | 0.761 | S | S | * | * | trans | -168.6 | 104.8 | 137.5 | -88.1 | -24.4 | 0 | 0 | 0 | 108.1 | A42 | A42-D44 PolarHBondContact O-N 3.07Š| ||
| 45 | D | 31.9 | Very low | 29.9 | Very low | 154 Ų | 154 | 137.4 Ų | 137.4 | 82% | 0.824 | 74% | 0.739 | S | S | * | * | S | Bend | trans | 59.6 | 58.8 | 155.3 | -63.7 | -21.4 | 0 | 0 | 0 | 120.2 | ||
| 46 | I | 32.6 | Very low | 29.9 | Very low | 151 Ų | 151 | 130.9 Ų | 130.9 | 77% | 0.774 | 72% | 0.72 | S | S | * | * | trans | -129.2 | 62.4 | 156.5 | -46.5 | 177.9 | 0 | 0 | 0 | 110.6 | A48 | I46-A48 HydrophobicContact CG2-CB 3.74Å; I46-A48 PolarHBondContact O-N 3.45Å | ||
| 47 | D | 27.1 | Very low | 30 | Very low | 164 Ų | 164 | 125 Ų | 125 | 88% | 0.877 | 70% | 0.702 | S | S | * | * | trans | -73.8 | 61.3 | 152.6 | -72.2 | -30.5 | 0 | 0 | 0 | 108.9 | E49 | D47-E49 PolarHBondContact O-N 3.39Š| ||
| 48 | A | 34.7 | Very low | 30.2 | Very low | 73 Ų | 73 | 119.8 Ų | 119.8 | 60% | 0.603 | 69% | 0.69 | S | S | * | * | trans | -83.3 | 66.8 | 166.1 | 0 | 0 | 0 | 0 | 0 | 108 | I46 V50 | I46-A48 HydrophobicContact CG2-CB 3.74Å; I46-A48 PolarHBondContact O-N 3.45Å; A48-V50 PolarHBondContact O-N 3.17Å | ||
| 49 | E | 29.3 | Very low | 30.2 | Very low | 168 Ų | 168 | 118.3 Ų | 118.3 | 79% | 0.785 | 68% | 0.683 | S | S | * | * | trans | -58.3 | 103.8 | 167.9 | -161.3 | 175.7 | -158.7 | 0 | 0 | 106.8 | D47 T51 | D47-E49 PolarHBondContact O-N 3.39Å; E49-T51 PolarHBondContact O-N 3.22Å | ||
| 50 | V | 33.5 | Very low | 30.3 | Very low | 112 Ų | 112 | 116.3 Ų | 116.3 | 68% | 0.679 | 67% | 0.674 | S | S | * | * | trans | -64.8 | 85.5 | 178.6 | 179.1 | 0 | 0 | 0 | 0 | 107.2 | A48 E52 I55 | A48-V50 PolarHBondContact O-N 3.17Å; V50-E52 PolarHBondContact O-N 3.34Å; V50-I55 HydrophobicContact CG1-CD1 4.17Å; V50-I55 HydrophobicContact CG1-CG1 4.25Å | ||
| 51 | T | 30 | Very low | 30.5 | Very low | 79 Ų | 79 | 120.6 Ų | 120.6 | 49% | 0.485 | 68% | 0.68 | S | S | . | * | trans | -64.5 | 134.3 | -179.2 | 44.3 | 0 | 0 | 0 | 0 | 109.4 | E49 N53 A54 | E49-T51 PolarHBondContact O-N 3.22Å; T51-N53 PolarHBondContact O-N 2.82Å; T51-A54 WeakPolarHBondContact O-CB 3.39Å; T51-A54 PolarHBondContact O-N 3.2Å | ||
| 52 | E | 35.2 | Very low | 30.6 | Very low | 151 Ų | 151 | 116.1 Ų | 116.1 | 71% | 0.706 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -51.2 | -25.2 | -178.4 | -161.6 | 176.7 | -173.7 | 0 | 0 | 113.2 | V50 A54 I55 N56 | V50-E52 PolarHBondContact O-N 3.34Å; E52-A54 VanDerWaalsContact C-N 3.35Å; E52-A54 PolarHBondContact O-N 3.33Å; E52-I55 PolarHBondContact O-N 2.99Å; E52-N56 PolarHBondContact O-N 2.91Å |
| 53 | N | 32.5 | Very low | 30.4 | Very low | 127 Ų | 127 | 117.4 Ų | 117.4 | 68% | 0.679 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -62 | -35.3 | 172.7 | -73.6 | -16.6 | 0 | 0 | 0 | 113.7 | T51 N56 A57 | T51-N53 PolarHBondContact O-N 2.82Å; N53-N56 PolarHBondContact O-N 3.14Å; N53-A57 WeakPolarHBondContact O-CB 3.34Å; N53-A57 PolarHBondContact O-N 2.81Å |
| 54 | A | 34.8 | Very low | 30.3 | Very low | 57 Ų | 57 | 116.3 Ų | 116.3 | 47% | 0.471 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -68.5 | -36.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | T51 E52 A58 | T51-A54 WeakPolarHBondContact O-CB 3.39Å; T51-A54 PolarHBondContact O-N 3.2Å; E52-A54 VanDerWaalsContact C-N 3.35Å; E52-A54 PolarHBondContact O-N 3.33Å; A54-A58 PolarHBondContact O-N 3.09Å; A54-A58 VanDerWaalsContact O-N 3.12Å |
| 55 | I | 31.1 | Very low | 30.2 | Very low | 89 Ų | 89 | 116.6 Ų | 116.6 | 46% | 0.456 | 67% | 0.667 | S | S | . | * | H | α-helix | trans | -68.6 | -42.4 | 175.2 | -60.2 | 173.5 | 0 | 0 | 0 | 110.1 | V50 E52 A57 A58 L59 | V50-I55 HydrophobicContact CG1-CD1 4.17Å; V50-I55 HydrophobicContact CG1-CG1 4.25Å; E52-I55 PolarHBondContact O-N 2.99Å; I55-A57 PolarHBondContact O-N 3.09Å; I55-A58 PolarHBondContact O-N 3.18Å; I55-L59 HydrophobicContact CG2-CD1 4Å; I55-L59 PolarHBondContact O-N 3.49Å |
| 56 | N | 27.7 | Very low | 29.9 | Very low | 82 Ų | 82 | 116.1 Ų | 116.1 | 44% | 0.439 | 67% | 0.67 | S | S | . | * | H | α-helix | trans | -67.1 | -34.6 | 176.8 | -80.4 | -24.9 | 0 | 0 | 0 | 113.3 | E52 N53 L59 Q60 | E52-N56 PolarHBondContact O-N 2.91Å; N53-N56 PolarHBondContact O-N 3.14Å; N56-L59 PolarHBondContact O-N 3.09Å; N56-Q60 PolarHBondContact O-N 3.08Å; N56-Q60 VanDerWaalsContact O-N 3.07Å |
| 57 | A | 27.7 | Very low | 29.7 | Very low | 59 Ų | 59 | 115.5 Ų | 115.5 | 49% | 0.488 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -66.6 | -38.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112 | N53 I55 L59 | N53-A57 WeakPolarHBondContact O-CB 3.34Å; N53-A57 PolarHBondContact O-N 2.81Å; I55-A57 PolarHBondContact O-N 3.09Å; A57-L59 VanDerWaalsContact C-N 3.35Å |
| 58 | A | 31.1 | Very low | 29.6 | Very low | 75 Ų | 75 | 116.6 Ų | 116.6 | 62% | 0.62 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -67 | -35.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A54 I55 | A54-A58 PolarHBondContact O-N 3.09Å; A54-A58 VanDerWaalsContact O-N 3.12Å; I55-A58 PolarHBondContact O-N 3.18Å |
| 59 | L | 27.2 | Very low | 29 | Very low | 123 Ų | 123 | 124 Ų | 124 | 64% | 0.644 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -75.5 | -28 | 178.4 | -78.9 | 162.4 | 0 | 0 | 0 | 113.7 | I55 N56 A57 L61 | I55-L59 HydrophobicContact CG2-CD1 4Å; I55-L59 PolarHBondContact O-N 3.49Å; N56-L59 PolarHBondContact O-N 3.09Å; A57-L59 VanDerWaalsContact C-N 3.35Å; L59-L61 VanDerWaalsContact C-N 3.32Å; L59-L61 PolarHBondContact O-N 2.97Å |
| 60 | Q | 26.6 | Very low | 28.7 | Very low | 156 Ų | 156 | 121.6 Ų | 121.6 | 73% | 0.729 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -74.2 | -16.9 | 177.6 | -80.1 | -170.8 | 9.8 | 0 | 0 | 114.4 | N56 G62 | N56-Q60 PolarHBondContact O-N 3.08Å; N56-Q60 VanDerWaalsContact O-N 3.07Å; Q60-G62 PolarHBondContact O-N 3.17Å |
| 61 | L | 31 | Very low | 28.4 | Very low | 157 Ų | 157 | 124.2 Ų | 124.2 | 82% | 0.822 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.9 | -6.4 | 177.3 | -117.6 | 84.6 | 0 | 0 | 0 | 113.9 | L59 | L59-L61 VanDerWaalsContact C-N 3.32Å; L59-L61 PolarHBondContact O-N 2.97Å |
| 62 | G | 28.9 | Very low | 28.3 | Very low | 66 Ų | 66 | 127.8 Ų | 127.8 | 68% | 0.68 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | -9.6 | -174.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | Q60 V64 | Q60-G62 PolarHBondContact O-N 3.17Å; G62-V64 PolarHBondContact O-N 2.78Å |
| 63 | T | 23.7 | Very low | 27.9 | Very low | 122 Ų | 122 | 127 Ų | 127 | 75% | 0.748 | 71% | 0.71 | S | S | * | * | trans | -93.9 | 71.1 | -179.9 | 55 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 64 | V | 29.7 | Very low | 27.6 | Very low | 128 Ų | 128 | 129.6 Ų | 129.6 | 78% | 0.776 | 72% | 0.718 | S | S | * | * | trans | -80 | 116.3 | 163.1 | 176.7 | 0 | 0 | 0 | 0 | 107.2 | G62 T66 | G62-V64 PolarHBondContact O-N 2.78Å; V64-T66 PolarHBondContact O-N 3.12Å | ||
| 65 | E | 27.5 | Very low | 27.2 | Very low | 156 Ų | 156 | 132.6 Ų | 132.6 | 73% | 0.729 | 73% | 0.733 | S | S | * | * | trans | -47.2 | 125.9 | 178.5 | -70.2 | 175.5 | 149.3 | 0 | 0 | 111.4 | N67 | E65-N67 PolarHBondContact O-N 3.23Š| ||
| 66 | T | 25.9 | Very low | 27.2 | Very low | 144 Ų | 144 | 133.3 Ų | 133.3 | 88% | 0.883 | 75% | 0.746 | S | S | * | * | trans | -65.7 | 78.6 | 169.7 | 47 | 0 | 0 | 0 | 0 | 109.3 | V64 | V64-T66 PolarHBondContact O-N 3.12Š| ||
| 67 | N | 27.6 | Very low | 27.2 | Very low | 138 Ų | 138 | 134.6 Ų | 134.6 | 74% | 0.738 | 76% | 0.761 | S | S | * | * | trans | -77.6 | 132.2 | 172.8 | -85 | -33.5 | 0 | 0 | 0 | 110.3 | E65 | E65-N67 PolarHBondContact O-N 3.23Š| ||
| 68 | E | 25.3 | Very low | 27.3 | Very low | 186 Ų | 186 | 140.3 Ų | 140.3 | 87% | 0.869 | 78% | 0.775 | S | S | * | * | trans | -53.1 | 142.8 | -169.6 | -75.6 | 170.7 | 130 | 0 | 0 | 114.2 | S70 | E68-S70 PolarHBondContact O-N 3.31Š| ||
| 69 | Y | 21.8 | Very low | 27.1 | Very low | 230 Ų | 230 | 145.3 Ų | 145.3 | 90% | 0.902 | 79% | 0.785 | S | S | * | * | trans | -33.8 | 110.5 | 164.5 | -119.4 | -102.9 | 0 | 0 | 0 | 112.7 | ||||
| 70 | S | 25 | Very low | 27 | Very low | 116 Ų | 116 | 146.8 Ų | 146.8 | 81% | 0.811 | 79% | 0.794 | S | S | * | * | trans | -143.8 | 114.6 | 156.8 | -139.7 | 0 | 0 | 0 | 0 | 108.9 | E68 | E68-S70 PolarHBondContact O-N 3.31Š| ||
| 71 | E | 26.4 | Very low | 26.9 | Very low | 167 Ų | 167 | 144.4 Ų | 144.4 | 78% | 0.78 | 80% | 0.795 | S | S | * | * | trans | -56.6 | 153.9 | 172.1 | -73.6 | 174.9 | 140.2 | 0 | 0 | 110.9 | ||||
| 72 | D | 26.9 | Very low | 26.6 | Very low | 155 Ų | 155 | 142.4 Ų | 142.4 | 83% | 0.829 | 79% | 0.789 | S | S | * | * | trans | 75.7 | 63.5 | 173.1 | -57.6 | -26.5 | 0 | 0 | 0 | 117.5 | ||||
| 73 | T | 27.2 | Very low | 26.2 | Very low | 134 Ų | 134 | 144.9 Ų | 144.9 | 82% | 0.822 | 79% | 0.794 | S | S | * | * | trans | -145.3 | 114 | 138 | -36.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 74 | Q | 25.6 | Very low | 26.2 | Very low | 182 Ų | 182 | 146.6 Ų | 146.6 | 85% | 0.85 | 79% | 0.792 | S | S | * | * | trans | -46.6 | 116 | 173.4 | -165.7 | 171.5 | 9.8 | 0 | 0 | 110.5 | S76 | Q74-S76 PolarHBondContact O-N 3.25Š| ||
| 75 | P | 28.2 | Very low | 25.9 | Very low | 119 Ų | 119 | 147.9 Ų | 147.9 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | trans | -63.9 | 122.7 | -176.7 | 22.3 | -30.7 | 0 | 0 | 0 | 109.6 | S77 | P75-S77 PolarHBondContact O-N 2.92Å; P75-S77 VanDerWaalsContact O-N 3.09Å | ||
| 76 | S | 29.3 | Very low | 25.8 | Very low | 105 Ų | 105 | 147.3 Ų | 147.3 | 73% | 0.734 | 80% | 0.795 | S | S | * | * | trans | -59.5 | 112.6 | 174.5 | 58.2 | 0 | 0 | 0 | 0 | 109.2 | Q74 K78 | Q74-S76 PolarHBondContact O-N 3.25Å; S76-K78 PolarHBondContact O-N 3.24Å | ||
| 77 | S | 29.4 | Very low | 25.7 | Very low | 108 Ų | 108 | 144.9 Ų | 144.9 | 76% | 0.755 | 79% | 0.785 | S | S | * | * | trans | -65.4 | 78.9 | 172.8 | 60.6 | 0 | 0 | 0 | 0 | 110.4 | P75 | P75-S77 PolarHBondContact O-N 2.92Å; P75-S77 VanDerWaalsContact O-N 3.09Å | ||
| 78 | K | 28.4 | Very low | 25.7 | Very low | 180 Ų | 180 | 145 Ų | 145 | 78% | 0.783 | 78% | 0.784 | S | S | * | * | trans | -98.9 | 74.9 | 154.8 | -81.5 | -176.1 | 175.6 | 178.4 | 0 | 106.3 | S76 N80 | S76-K78 PolarHBondContact O-N 3.24Å; K78-N80 PolarHBondContact O-N 3.45Å; K78-N80 VanDerWaalsContact O-N 3.14Å | ||
| 79 | E | 27.9 | Very low | 25.9 | Very low | 179 Ų | 179 | 143.9 Ų | 143.9 | 84% | 0.836 | 78% | 0.779 | S | S | * | * | trans | -64.7 | 110.1 | 169.2 | -72.4 | 179.2 | 160.9 | 0 | 0 | 107.6 | S81 | E79-S81 PolarHBondContact O-N 3.08Å; E79-S81 VanDerWaalsContact O-N 3.09Å | ||
| 80 | N | 24.8 | Very low | 26.2 | Very low | 155 Ų | 155 | 140.5 Ų | 140.5 | 83% | 0.829 | 78% | 0.776 | S | S | * | * | trans | -68.8 | 99.4 | 171.5 | -74.8 | -16.5 | 0 | 0 | 0 | 108.1 | K78 | K78-N80 PolarHBondContact O-N 3.45Å; K78-N80 VanDerWaalsContact O-N 3.14Å | ||
| 81 | S | 25.2 | Very low | 26.5 | Very low | 106 Ų | 106 | 139.8 Ų | 139.8 | 74% | 0.741 | 77% | 0.767 | S | S | * | * | trans | -79.9 | 119.9 | 170.6 | 50.3 | 0 | 0 | 0 | 0 | 109.9 | E79 | E79-S81 PolarHBondContact O-N 3.08Å; E79-S81 VanDerWaalsContact O-N 3.09Å | ||
| 82 | V | 22.9 | Very low | 26.5 | Very low | 114 Ų | 114 | 139 Ų | 139 | 69% | 0.691 | 77% | 0.774 | S | S | * | * | trans | -89.7 | 113.4 | 171.9 | 179.1 | 0 | 0 | 0 | 0 | 107.9 | F84 | V82-F84 HydrophobicContact CG1-CE2 4.27Å; V82-F84 HydrophobicContact CG1-CZ 4.24Å | ||
| 83 | C | 21.7 | Very low | 26.8 | Very low | 118 Ų | 118 | 135.6 Ų | 135.6 | 80% | 0.797 | 76% | 0.759 | S | S | * | * | trans | -87.3 | 122.9 | 173.6 | -73.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 84 | F | 23.9 | Very low | 27 | Very low | 158 Ų | 158 | 132.9 Ų | 132.9 | 69% | 0.693 | 76% | 0.757 | S | S | * | * | trans | -87.1 | 117.3 | 170.7 | -66.4 | -86.1 | 0 | 0 | 0 | 109.7 | V82 L86 | V82-F84 HydrophobicContact CG1-CE2 4.27Å; V82-F84 HydrophobicContact CG1-CZ 4.24Å; F84-L86 HydrophobicContact CB-CD1 4.36Å | ||
| 85 | N | 23.4 | Very low | 27.4 | Very low | 156 Ų | 156 | 128.4 Ų | 128.4 | 83% | 0.834 | 75% | 0.746 | S | S | * | * | trans | -93.6 | 87.5 | 167.5 | -166.2 | 15.3 | 0 | 0 | 0 | 107.7 | S87 | N85-S87 VanDerWaalsContact C-N 3.35Å; N85-S87 PolarHBondContact O-N 3.33Å; N85-S87 VanDerWaalsContact O-N 3.08Å | ||
| 86 | L | 24.7 | Very low | 27.6 | Very low | 143 Ų | 143 | 131.8 Ų | 131.8 | 75% | 0.749 | 75% | 0.745 | S | S | * | * | trans | -75.4 | 93 | 169.7 | -88.4 | 122.7 | 0 | 0 | 0 | 107.9 | F84 L88 | F84-L86 HydrophobicContact CB-CD1 4.36Å; L86-L88 PolarHBondContact O-N 3Å | ||
| 87 | S | 24.1 | Very low | 27.9 | Very low | 94 Ų | 94 | 133.5 Ų | 133.5 | 66% | 0.657 | 74% | 0.741 | S | S | * | * | trans | -74 | 98.7 | 163.1 | -162.9 | 0 | 0 | 0 | 0 | 107.6 | N85 E89 | N85-S87 VanDerWaalsContact C-N 3.35Å; N85-S87 PolarHBondContact O-N 3.33Å; N85-S87 VanDerWaalsContact O-N 3.08Å; S87-E89 PolarHBondContact O-N 2.91Å | ||
| 88 | L | 27.4 | Very low | 28.2 | Very low | 139 Ų | 139 | 134.3 Ų | 134.3 | 73% | 0.728 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | 63.5 | -175.4 | -162.4 | 85.2 | 0 | 0 | 0 | 110.7 | L86 | L86-L88 PolarHBondContact O-N 3Š|
| 89 | E | 29.1 | Very low | 28.4 | Very low | 164 Ų | 164 | 128 Ų | 128 | 77% | 0.766 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.3 | -16.2 | 175.5 | -85.9 | -173.6 | 157.3 | 0 | 0 | 115.8 | S87 | S87-E89 PolarHBondContact O-N 2.91Š|
| 90 | D | 28.7 | Very low | 28.8 | Very low | 158 Ų | 158 | 124.1 Ų | 124.1 | 85% | 0.845 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -130 | 30 | -172.2 | -75.4 | -38.1 | 0 | 0 | 0 | 117.2 | ||
| 91 | T | 30.2 | Very low | 29.2 | Very low | 101 Ų | 101 | 122.1 Ų | 122.1 | 62% | 0.62 | 69% | 0.689 | S | S | * | * | trans | -125.1 | 102.8 | 162.7 | 37.6 | 0 | 0 | 0 | 0 | 110.3 | T93 | T91-T93 VanDerWaalsContact C-N 3.26Å; T91-T93 PolarHBondContact O-N 3.01Å; T91-T93 PolarHBondContact O-OG1 3.36Å | ||
| 92 | T | 28.2 | Very low | 29.8 | Very low | 151 Ų | 151 | 120 Ų | 120 | 93% | 0.926 | 68% | 0.677 | S | S | * | * | trans | -57.4 | 82.5 | 169.2 | 44.7 | 0 | 0 | 0 | 0 | 110.9 | G94 | T92-G94 VanDerWaalsContact C-N 3.32Š| ||
| 93 | T | 32.8 | Very low | 30.4 | Very low | 84 Ų | 84 | 121.4 Ų | 121.4 | 52% | 0.515 | 68% | 0.679 | S | S | . | * | trans | -95.1 | 30.5 | 172.1 | 42.3 | 0 | 0 | 0 | 0 | 112.2 | T91 S95 Y96 | T91-T93 VanDerWaalsContact C-N 3.26Å; T91-T93 PolarHBondContact O-N 3.01Å; T91-T93 PolarHBondContact O-OG1 3.36Å; T93-S95 PolarHBondContact O-N 3.2Å; T93-Y96 PolarHBondContact O-N 2.89Å | ||
| 94 | G | 31.9 | Very low | 31.2 | Very low | 76 Ų | 76 | 120.9 Ų | 120.9 | 78% | 0.784 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.4 | 25.6 | -173.9 | 0 | 0 | 0 | 0 | 0 | 116.9 | T92 | T92-G94 VanDerWaalsContact C-N 3.32Š|
| 95 | S | 33.5 | Very low | 31.6 | Very low | 88 Ų | 88 | 119.2 Ų | 119.2 | 62% | 0.615 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -146.5 | -8 | 173.5 | -175.5 | 0 | 0 | 0 | 0 | 115.4 | T93 A99 | T93-S95 PolarHBondContact O-N 3.2Å; S95-A99 WeakPolarHBondContact O-CB 3.29Å |
| 96 | Y | 31.7 | Very low | 31.9 | Very low | 190 Ų | 190 | 120.4 Ų | 120.4 | 75% | 0.745 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -85.4 | -31.5 | 179 | -97.7 | -85.8 | 0 | 0 | 0 | 113 | T93 I100 | T93-Y96 PolarHBondContact O-N 2.89Å; Y96-I100 WeakPolarHBondContact O-CG1 3.26Å; Y96-I100 PolarHBondContact O-N 3.42Å |
| 97 | E | 35.9 | Very low | 32.4 | Very low | 141 Ų | 141 | 121.9 Ų | 121.9 | 66% | 0.659 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -81.9 | -38.3 | -177.4 | -127.9 | 153.2 | 179.1 | 0 | 0 | 112.7 | A99 I100 H101 | E97-A99 PolarHBondContact O-N 3.43Å; E97-I100 PolarHBondContact O-N 2.77Å; E97-H101 PolarHBondContact O-N 3.31Å |
| 98 | D | 35.9 | Very low | 32.7 | Very low | 125 Ų | 125 | 125.5 Ų | 125.5 | 67% | 0.668 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -69.8 | -34.2 | 177.2 | -73.4 | -16 | 0 | 0 | 0 | 112.5 | A102 | D98-A102 WeakPolarHBondContact O-CB 3.2Å; D98-A102 PolarHBondContact O-N 3.12Å |
| 99 | A | 33.7 | Very low | 32.8 | Very low | 49 Ų | 49 | 126.8 Ų | 126.8 | 41% | 0.405 | 68% | 0.684 | S | S | . | * | H | α-helix | trans | -71.9 | -36.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | S95 E97 A102 I103 | S95-A99 WeakPolarHBondContact O-CB 3.29Å; E97-A99 PolarHBondContact O-N 3.43Å; A99-A102 PolarHBondContact O-N 2.69Å; A99-I103 VanDerWaalsContact O-CG1 3.32Å; A99-I103 WeakPolarHBondContact O-CG1 3.38Å; A99-I103 PolarHBondContact O-N 3.32Å |
| 100 | I | 34.6 | Very low | 32.7 | Very low | 97 Ų | 97 | 127.2 Ų | 127.2 | 50% | 0.497 | 69% | 0.685 | S | S | . | * | H | α-helix | trans | -71.7 | -35.8 | 176 | -65.4 | 176.8 | 0 | 0 | 0 | 110.4 | Y96 E97 I103 I104 | Y96-I100 WeakPolarHBondContact O-CG1 3.26Å; Y96-I100 PolarHBondContact O-N 3.42Å; E97-I100 PolarHBondContact O-N 2.77Å; I100-I103 PolarHBondContact O-N 3.24Å; I100-I104 HydrophobicContact CG2-CD1 4.08Å; I100-I104 WeakPolarHBondContact O-CG1 3.34Å; I100-I104 PolarHBondContact O-N 3.08Å |
| 101 | H | 34.9 | Very low | 32.7 | Very low | 113 Ų | 113 | 124.9 Ų | 124.9 | 52% | 0.523 | 68% | 0.681 | S | S | . | * | H | α-helix | trans | -69 | -31.1 | 173.5 | -96 | -57.9 | 0 | 0 | 0 | 114 | E97 N105 | E97-H101 PolarHBondContact O-N 3.31Å; H101-N105 PolarHBondContact O-N 2.94Å |
| 102 | A | 37.1 | Very low | 32.6 | Very low | 60 Ų | 60 | 125.6 Ų | 125.6 | 50% | 0.496 | 69% | 0.69 | S | S | . | * | H | α-helix | trans | -68.8 | -35.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | D98 A99 | D98-A102 WeakPolarHBondContact O-CB 3.2Å; D98-A102 PolarHBondContact O-N 3.12Å; A99-A102 PolarHBondContact O-N 2.69Å |
| 103 | I | 34.4 | Very low | 32.5 | Very low | 144 Ų | 144 | 124.7 Ų | 124.7 | 74% | 0.738 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -74.3 | -26 | 179.7 | -67 | 167.2 | 0 | 0 | 0 | 112.3 | A99 I100 | A99-I103 VanDerWaalsContact O-CG1 3.32Å; A99-I103 WeakPolarHBondContact O-CG1 3.38Å; A99-I103 PolarHBondContact O-N 3.32Å; I100-I103 PolarHBondContact O-N 3.24Å |
| 104 | I | 38.2 | Very low | 32.2 | Very low | 107 Ų | 107 | 129.7 Ų | 129.7 | 55% | 0.549 | 71% | 0.706 | S | S | . | * | H | α-helix | trans | -82.2 | -26.5 | 177.7 | -66 | 171.3 | 0 | 0 | 0 | 112.4 | I100 | I100-I104 HydrophobicContact CG2-CD1 4.08Å; I100-I104 WeakPolarHBondContact O-CG1 3.34Å; I100-I104 PolarHBondContact O-N 3.08Å |
| 105 | N | 32.5 | Very low | 32.1 | Very low | 123 Ų | 123 | 133.5 Ų | 133.5 | 66% | 0.658 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -111.1 | 2.9 | -167.1 | -76.7 | -23.1 | 0 | 0 | 0 | 116.8 | H101 | H101-N105 PolarHBondContact O-N 2.94Å |
| 106 | E | 31.1 | Very low | 31.8 | Very low | 181 Ų | 181 | 138.1 Ų | 138.1 | 85% | 0.846 | 72% | 0.72 | S | S | * | * | trans | -103.9 | 60.8 | 165.5 | -93.3 | -176.9 | 161.8 | 0 | 0 | 110.7 | Q108 | E106-Q108 PolarHBondContact O-N 3.09Š| ||
| 107 | E | 33.9 | Very low | 31.8 | Very low | 175 Ų | 175 | 135.6 Ų | 135.6 | 82% | 0.818 | 73% | 0.725 | S | S | * | * | trans | -64.1 | 111.5 | 158.5 | -87.2 | -173.1 | 152.2 | 0 | 0 | 109.3 | ||||
| 108 | Q | 32 | Very low | 31.6 | Very low | 170 Ų | 170 | 132.8 Ų | 132.8 | 79% | 0.794 | 72% | 0.721 | S | S | * | * | trans | 30.8 | 94.3 | 133.4 | -78.5 | 177.9 | -23.6 | 0 | 0 | 116.7 | E106 H110 | E106-Q108 PolarHBondContact O-N 3.09Å; Q108-H110 PolarHBondContact O-N 3.18Å | ||
| 109 | D | 28.8 | Very low | 31.7 | Very low | 166 Ų | 166 | 131.6 Ų | 131.6 | 89% | 0.888 | 72% | 0.723 | S | S | * | * | trans | -65.1 | 125.7 | 156.5 | -136.8 | -13 | 0 | 0 | 0 | 109.4 | ||||
| 110 | H | 27.1 | Very low | 31.7 | Very low | 172 Ų | 172 | 136.7 Ų | 136.7 | 80% | 0.796 | 74% | 0.738 | S | S | * | * | trans | -64.6 | 139.3 | -162.2 | -61.5 | -88.6 | 0 | 0 | 0 | 116.2 | Q108 | Q108-H110 PolarHBondContact O-N 3.18Š| ||
| 111 | S | 28.3 | Very low | 32 | Very low | 110 Ų | 110 | 136.7 Ų | 136.7 | 77% | 0.769 | 75% | 0.746 | S | S | * | * | -169.8 | 115.1 | 127.9 | 62.2 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 112 | S | 27.9 | Very low | 31.9 | Very low | 115 Ų | 115 | 138.5 Ų | 138.5 | 80% | 0.804 | 75% | 0.753 | S | S | * | * | trans | 52.1 | 101.7 | 151.1 | 71.9 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 113 | C | 26.1 | Very low | 31.7 | Very low | 133 Ų | 133 | 140.7 Ų | 140.7 | 90% | 0.899 | 75% | 0.753 | S | S | * | * | -155.6 | 108.4 | 125 | -122.4 | 0 | 0 | 0 | 0 | 107.6 | D115 | C113-D115 PolarHBondContact O-N 3.1Š| |||
| 114 | E | 27 | Very low | 31.6 | Very low | 189 Ų | 189 | 142 Ų | 142 | 88% | 0.883 | 75% | 0.754 | S | S | * | * | trans | -59.5 | 127.9 | 171.9 | -61.1 | 175.7 | 154.5 | 0 | 0 | 109.1 | ||||
| 115 | D | 28.6 | Very low | 31.5 | Very low | 155 Ų | 155 | 139.8 Ų | 139.8 | 83% | 0.829 | 75% | 0.751 | S | S | * | * | trans | -155.3 | 122.9 | 139.5 | -123.2 | -16.4 | 0 | 0 | 0 | 110.1 | C113 T117 | C113-D115 PolarHBondContact O-N 3.1Å; D115-T117 PolarHBondContact O-N 3.11Å; D115-T117 VanDerWaalsContact O-N 3.13Å | ||
| 116 | E | 28 | Very low | 31.6 | Very low | 185 Ų | 185 | 137 Ų | 137 | 86% | 0.864 | 74% | 0.738 | S | S | * | * | trans | -66.4 | 102.4 | -169.4 | -59.2 | -177.3 | 151.4 | 0 | 0 | 111.5 | ||||
| 117 | T | 31 | Very low | 31.7 | Very low | 138 Ų | 138 | 136.4 Ų | 136.4 | 85% | 0.847 | 73% | 0.728 | S | S | * | * | trans | -103 | 87.4 | 154.4 | 42.1 | 0 | 0 | 0 | 0 | 107.9 | D115 S119 | D115-T117 PolarHBondContact O-N 3.11Å; D115-T117 VanDerWaalsContact O-N 3.13Å; T117-S119 PolarHBondContact O-N 2.86Å; T117-S119 VanDerWaalsContact O-N 3.09Å | ||
| 118 | S | 32.5 | Very low | 31.4 | Very low | 82 Ų | 82 | 130.2 Ų | 130.2 | 57% | 0.573 | 71% | 0.711 | S | S | * | * | trans | -52.4 | 111.5 | -175.3 | 52.8 | 0 | 0 | 0 | 0 | 112.4 | E120 | S118-E120 PolarHBondContact O-N 3.29Š| ||
| 119 | S | 38.1 | Very low | 31.6 | Very low | 100 Ų | 100 | 128.7 Ų | 128.7 | 70% | 0.699 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.9 | -0.6 | 171.4 | 35.9 | 0 | 0 | 0 | 0 | 114.3 | T117 S121 F122 E123 | T117-S119 PolarHBondContact O-N 2.86Å; T117-S119 VanDerWaalsContact O-N 3.09Å; S119-S121 VanDerWaalsContact C-N 3.25Å; S119-S121 PolarHBondContact O-N 3.29Å; S119-F122 PolarHBondContact O-N 3.49Å; S119-E123 PolarHBondContact O-N 2.99Å |
| 120 | E | 33.9 | Very low | 31.7 | Very low | 156 Ų | 156 | 127.5 Ų | 127.5 | 73% | 0.729 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -64.6 | -25 | 175.7 | -77.9 | -164.6 | 144.6 | 0 | 0 | 113.4 | S118 K124 | S118-E120 PolarHBondContact O-N 3.29Å; E120-K124 WeakPolarHBondContact O-CB 3.37Å; E120-K124 PolarHBondContact O-N 2.88Å |
| 121 | S | 40.2 | Very low | 31.8 | Very low | 96 Ų | 96 | 123.4 Ų | 123.4 | 67% | 0.671 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -71.4 | -33.3 | 179.6 | 66.1 | 0 | 0 | 0 | 0 | 113 | S119 A125 | S119-S121 VanDerWaalsContact C-N 3.25Å; S119-S121 PolarHBondContact O-N 3.29Å; S121-A125 PolarHBondContact O-N 3.02Å |
| 122 | F | 34.2 | Very low | 31.9 | Very low | 151 Ų | 151 | 125.2 Ų | 125.2 | 66% | 0.662 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -79.7 | -42.1 | -179.3 | -170.1 | -102.7 | 0 | 0 | 0 | 111.9 | S119 K124 A125 V126 | S119-F122 PolarHBondContact O-N 3.49Å; F122-K124 VanDerWaalsContact C-N 3.3Å; F122-K124 PolarHBondContact O-N 3.37Å; F122-A125 PolarHBondContact O-N 3.11Å; F122-V126 HydrophobicContact CD1-CG2 4.29Å; F122-V126 HydrophobicContact CE1-CG2 3.95Å; F122-V126 HydrophobicContact CZ-CG2 4.13Å; F122-V126 WeakPolarHBondContact O-CG2 3.49Å; F122-V126 PolarHBondContact O-N 3.39Å; F122-V126 VanDerWaalsContact O-N 3.08Å |
| 123 | E | 32 | Very low | 32.2 | Very low | 106 Ų | 106 | 127.8 Ų | 127.8 | 50% | 0.495 | 69% | 0.689 | S | S | . | * | H | α-helix | trans | -66.8 | -33 | 179.6 | -156.1 | -170.3 | 157.2 | 0 | 0 | 112.1 | S119 V126 R127 | S119-E123 PolarHBondContact O-N 2.99Å; E123-V126 PolarHBondContact O-N 2.84Å; E123-R127 PolarHBondContact O-N 3.35Å; E123-R127 IonicContact OE1-CZ 3.62Å; E123-R127 VanDerWaalsContact OE1-CZ 3.28Å; E123-R127 IonicContact OE1-NE 2.77Å; E123-R127 PolarHBondContact OE1-NE 3.1Å; E123-R127 IonicContact OE1-NH2 3.53Å; E123-R127 PolarHBondContact OE1-NH2 2.89Å |
| 124 | K | 32.8 | Very low | 32.5 | Very low | 173 Ų | 173 | 130.9 Ų | 130.9 | 75% | 0.752 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -70 | -35.3 | 175.2 | -137.3 | 174.2 | -169.3 | 172.4 | 0 | 112.4 | E120 F122 G128 | E120-K124 WeakPolarHBondContact O-CB 3.37Å; E120-K124 PolarHBondContact O-N 2.88Å; F122-K124 VanDerWaalsContact C-N 3.3Å; F122-K124 PolarHBondContact O-N 3.37Å; K124-G128 PolarHBondContact O-N 3.34Å |
| 125 | A | 36.6 | Very low | 32.7 | Very low | 59 Ų | 59 | 127.7 Ų | 127.7 | 49% | 0.488 | 68% | 0.681 | S | S | . | * | H | α-helix | trans | -67 | -38.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | S121 F122 | S121-A125 PolarHBondContact O-N 3.02Å; F122-A125 PolarHBondContact O-N 3.11Å |
| 126 | V | 34.3 | Very low | 32.6 | Very low | 66 Ų | 66 | 129.7 Ų | 129.7 | 40% | 0.4 | 69% | 0.685 | S | S | . | * | H | α-helix | trans | -75 | -38.5 | 178.9 | 178.8 | 0 | 0 | 0 | 0 | 112 | F122 E123 I129 | F122-V126 HydrophobicContact CD1-CG2 4.29Å; F122-V126 HydrophobicContact CE1-CG2 3.95Å; F122-V126 HydrophobicContact CZ-CG2 4.13Å; F122-V126 WeakPolarHBondContact O-CG2 3.49Å; F122-V126 PolarHBondContact O-N 3.39Å; F122-V126 VanDerWaalsContact O-N 3.08Å; E123-V126 PolarHBondContact O-N 2.84Å; V126-I129 PolarHBondContact O-N 3.44Å |
| 127 | R | 31.7 | Very low | 32.5 | Very low | 167 Ų | 167 | 130.1 Ų | 130.1 | 63% | 0.63 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -70.8 | -30.2 | 178.2 | -75.4 | -173.4 | -173 | -136.7 | 5.9 | 114.1 | E123 I129 M130 S131 | E123-R127 PolarHBondContact O-N 3.35Å; E123-R127 IonicContact OE1-CZ 3.62Å; E123-R127 VanDerWaalsContact OE1-CZ 3.28Å; E123-R127 IonicContact OE1-NE 2.77Å; E123-R127 PolarHBondContact OE1-NE 3.1Å; E123-R127 IonicContact OE1-NH2 3.53Å; E123-R127 PolarHBondContact OE1-NH2 2.89Å; R127-I129 PolarHBondContact O-N 3.31Å; R127-M130 PolarHBondContact O-N 2.84Å; R127-S131 PolarHBondContact O-N 3.01Å; R127-S131 VanDerWaalsContact O-N 3.15Å |
| 128 | G | 28.7 | Very low | 32.3 | Very low | 45 Ų | 45 | 127.9 Ų | 127.9 | 46% | 0.464 | 68% | 0.683 | S | S | . | * | H | α-helix | trans | -63.4 | -27.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | K124 | K124-G128 PolarHBondContact O-N 3.34Å |
| 129 | I | 36.7 | Very low | 32 | Very low | 139 Ų | 139 | 130.2 Ų | 130.2 | 71% | 0.713 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -80.1 | -37 | 178.7 | -62.1 | 171.2 | 0 | 0 | 0 | 110.9 | V126 R127 | V126-I129 PolarHBondContact O-N 3.44Å; R127-I129 PolarHBondContact O-N 3.31Å |
| 130 | M | 30.4 | Very low | 31.4 | Very low | 140 Ų | 140 | 129.6 Ų | 129.6 | 69% | 0.69 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -80.5 | -23.2 | -179.6 | -78.1 | -173.2 | 176.3 | 0 | 0 | 114.8 | R127 N132 | R127-M130 PolarHBondContact O-N 2.84Å; M130-N132 PolarHBondContact O-N 3.3Å |
| 131 | S | 29.8 | Very low | 31 | Very low | 86 Ų | 86 | 129.9 Ų | 129.9 | 60% | 0.601 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -77.9 | -16.7 | -176.2 | 72.6 | 0 | 0 | 0 | 0 | 114.7 | R127 E133 | R127-S131 PolarHBondContact O-N 3.01Å; R127-S131 VanDerWaalsContact O-N 3.15Å; S131-E133 VanDerWaalsContact C-N 3.29Å |
| 132 | N | 30.4 | Very low | 30.2 | Very low | 148 Ų | 148 | 132 Ų | 132 | 79% | 0.791 | 72% | 0.715 | S | S | * | * | G | 310 helix | trans | -81.4 | -7.2 | 176.4 | -97.8 | -4.1 | 0 | 0 | 0 | 113.7 | M130 | M130-N132 PolarHBondContact O-N 3.3Š|
| 133 | E | 33.8 | Very low | 30 | Very low | 169 Ų | 169 | 129.7 Ų | 129.7 | 79% | 0.79 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -86.6 | -8.4 | -174.8 | -144.1 | 177.4 | -175.9 | 0 | 0 | 113.8 | S131 | S131-E133 VanDerWaalsContact C-N 3.29Š|
| 134 | K | 31.4 | Very low | 29.7 | Very low | 198 Ų | 198 | 132.2 Ų | 132.2 | 86% | 0.861 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -100.8 | 2.5 | -172 | -116.3 | 177.9 | -174.7 | 174.1 | 0 | 117.5 | ||
| 135 | T | 30.7 | Very low | 29.5 | Very low | 123 Ų | 123 | 131.6 Ų | 131.6 | 76% | 0.755 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -136.5 | 56.4 | -180 | -31.7 | 0 | 0 | 0 | 0 | 112.8 | ||
| 136 | Q | 26.9 | Very low | 29.1 | Very low | 196 Ų | 196 | 134.9 Ų | 134.9 | 92% | 0.916 | 75% | 0.753 | S | S | * | * | trans | -151.8 | 58.1 | 160.9 | -114.7 | 163.8 | 42.8 | 0 | 0 | 110.7 | ||||
| 137 | Q | 26.9 | Very low | 28.8 | Very low | 194 Ų | 194 | 137.1 Ų | 137.1 | 91% | 0.907 | 77% | 0.772 | S | S | * | * | trans | -88.8 | 114.2 | 167.5 | -147.6 | 172.7 | 10.4 | 0 | 0 | 108.9 | ||||
| 138 | A | 27.1 | Very low | 28.6 | Very low | 91 Ų | 91 | 135.4 Ų | 135.4 | 75% | 0.752 | 78% | 0.78 | S | S | * | * | trans | 58.1 | 85.9 | 151.9 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 139 | S | 25.7 | Very low | 28.6 | Very low | 132 Ų | 132 | 140.3 Ų | 140.3 | 92% | 0.923 | 80% | 0.802 | S | S | * | * | trans | -120.6 | 99.6 | 138.8 | -82.5 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 140 | A | 24.4 | Very low | 28.1 | Very low | 86 Ų | 86 | 136.2 Ų | 136.2 | 71% | 0.711 | 79% | 0.794 | S | S | * | * | trans | -73.8 | 140.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 141 | L | 25.4 | Very low | 28 | Very low | 162 Ų | 162 | 137.7 Ų | 137.7 | 85% | 0.848 | 81% | 0.805 | S | S | * | * | trans | 54.6 | 107.9 | 159.4 | -80.9 | 90.5 | 0 | 0 | 0 | 118.4 | ||||
| 142 | T | 24.9 | Very low | 27.8 | Very low | 140 Ų | 140 | 138.7 Ų | 138.7 | 86% | 0.859 | 81% | 0.812 | S | S | * | * | -152.8 | 131.3 | 113.8 | 5.6 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 143 | S | 28.8 | Very low | 27.6 | Very low | 104 Ų | 104 | 136.7 Ų | 136.7 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | trans | -59.2 | 128.1 | 168.1 | 53 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 144 | D | 25.6 | Very low | 27.1 | Very low | 158 Ų | 158 | 138.1 Ų | 138.1 | 85% | 0.845 | 81% | 0.808 | S | S | * | * | trans | -146.1 | 121.8 | 147.7 | -93.6 | -33.7 | 0 | 0 | 0 | 109.7 | T146 | D144-T146 PolarHBondContact O-N 2.8Š| ||
| 145 | N | 29.3 | Very low | 26.8 | Very low | 160 Ų | 160 | 137.2 Ų | 137.2 | 86% | 0.856 | 80% | 0.804 | S | S | * | * | trans | -66.9 | 112.1 | 173.2 | -70.9 | -30.4 | 0 | 0 | 0 | 108.5 | ||||
| 146 | T | 27.2 | Very low | 26.5 | Very low | 128 Ų | 128 | 142.3 Ų | 142.3 | 79% | 0.785 | 81% | 0.81 | S | S | * | * | trans | -157.3 | 128.6 | 147 | -7.3 | 0 | 0 | 0 | 0 | 110.7 | D144 T148 | D144-T146 PolarHBondContact O-N 2.8Å; T146-T148 PolarHBondContact O-N 2.9Å | ||
| 147 | S | 28.4 | Very low | 26.6 | Very low | 114 Ų | 114 | 138.5 Ų | 138.5 | 80% | 0.797 | 80% | 0.802 | S | S | * | * | trans | -48.4 | 116.7 | 174.4 | 52 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 148 | T | 27.3 | Very low | 26.8 | Very low | 130 Ų | 130 | 136 Ų | 136 | 80% | 0.798 | 79% | 0.793 | S | S | * | * | trans | -140.9 | 106.6 | 146.3 | -42 | 0 | 0 | 0 | 0 | 107.9 | T146 G150 | T146-T148 PolarHBondContact O-N 2.9Å; T148-G150 PolarHBondContact O-N 3.3Å | ||
| 149 | T | 28.8 | Very low | 26.9 | Very low | 148 Ų | 148 | 139.1 Ų | 139.1 | 91% | 0.908 | 80% | 0.798 | S | S | * | * | trans | -42.2 | 102.7 | 163.8 | 30.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 150 | G | 27.1 | Very low | 27.4 | Very low | 53 Ų | 53 | 139.6 Ų | 139.6 | 55% | 0.546 | 79% | 0.789 | S | S | . | * | trans | -154.7 | 107.7 | 164.1 | 0 | 0 | 0 | 0 | 0 | 105.9 | T148 S152 | T148-G150 PolarHBondContact O-N 3.3Å; G150-S152 PolarHBondContact O-N 2.89Å | ||
| 151 | N | 27.4 | Very low | 27.7 | Very low | 172 Ų | 172 | 141.8 Ų | 141.8 | 92% | 0.92 | 79% | 0.789 | S | S | * | * | trans | -62 | 77.6 | 175.2 | -75.1 | -6.6 | 0 | 0 | 0 | 108.9 | V153 | N151-V153 PolarHBondContact O-N 3.09Š| ||
| 152 | S | 26.1 | Very low | 28.2 | Very low | 107 Ų | 107 | 145.6 Ų | 145.6 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | trans | -80.7 | 102.9 | 169.6 | 51.1 | 0 | 0 | 0 | 0 | 106.4 | G150 K154 | G150-S152 PolarHBondContact O-N 2.89Å; S152-K154 PolarHBondContact O-N 3.17Å | ||
| 153 | V | 25.6 | Very low | 28.7 | Very low | 106 Ų | 106 | 145.8 Ų | 145.8 | 64% | 0.642 | 79% | 0.787 | S | S | * | * | trans | -57.8 | 101 | 171.5 | 178.5 | 0 | 0 | 0 | 0 | 107.1 | N151 F155 | N151-V153 PolarHBondContact O-N 3.09Å; V153-F155 HydrophobicContact CB-CE2 4.07Å; V153-F155 HydrophobicContact CB-CZ 4.47Å; V153-F155 HydrophobicContact CG1-CD1 4.45Å; V153-F155 HydrophobicContact CG1-CD2 4.02Å; V153-F155 HydrophobicContact CG1-CE1 4.09Å; V153-F155 HydrophobicContact CG1-CE2 3.62Å; V153-F155 HydrophobicContact CG1-CG 4.42Å; V153-F155 HydrophobicContact CG1-CZ 3.66Å; V153-F155 WeakPolarHBondContact O-CD2 3.32Å; V153-F155 PolarHBondContact O-N 3.36Å; V153-F155 VanDerWaalsContact O-N 3.1Å | ||
| 154 | K | 23.8 | Very low | 29.1 | Very low | 198 Ų | 198 | 145 Ų | 145 | 86% | 0.861 | 79% | 0.787 | S | S | * | * | trans | -80.9 | 89.7 | 179.1 | -155.2 | 174.7 | -171.2 | 176 | 0 | 107.3 | S152 R156 | S152-K154 PolarHBondContact O-N 3.17Å; K154-R156 PolarHBondContact O-N 2.92Å; K154-R156 VanDerWaalsContact O-N 3.11Å | ||
| 155 | F | 25.4 | Very low | 29.5 | Very low | 180 Ų | 180 | 146 Ų | 146 | 79% | 0.789 | 79% | 0.787 | S | S | * | * | trans | -61.7 | 112 | 172.7 | -69 | -83.8 | 0 | 0 | 0 | 108.6 | V153 P157 | V153-F155 HydrophobicContact CB-CE2 4.07Å; V153-F155 HydrophobicContact CB-CZ 4.47Å; V153-F155 HydrophobicContact CG1-CD1 4.45Å; V153-F155 HydrophobicContact CG1-CD2 4.02Å; V153-F155 HydrophobicContact CG1-CE1 4.09Å; V153-F155 HydrophobicContact CG1-CE2 3.62Å; V153-F155 HydrophobicContact CG1-CG 4.42Å; V153-F155 HydrophobicContact CG1-CZ 3.66Å; V153-F155 WeakPolarHBondContact O-CD2 3.32Å; V153-F155 PolarHBondContact O-N 3.36Å; V153-F155 VanDerWaalsContact O-N 3.1Å; F155-P157 VanDerWaalsContact O-CD 3.29Å; F155-P157 WeakPolarHBondContact O-CD 3.38Å | ||
| 156 | R | 24 | Very low | 29.7 | Very low | 229 Ų | 229 | 142.8 Ų | 142.8 | 86% | 0.864 | 78% | 0.777 | S | S | * | * | trans | -77.3 | 115.8 | 165.3 | -86 | -172.2 | -177.3 | 176.1 | 2 | 107 | K154 I158 | K154-R156 PolarHBondContact O-N 2.92Å; K154-R156 VanDerWaalsContact O-N 3.11Å; R156-I158 PolarHBondContact O-N 3.15Å; R156-I158 VanDerWaalsContact O-N 3.09Å | ||
| 157 | P | 28.6 | Very low | 30 | Very low | 117 Ų | 117 | 142.6 Ų | 142.6 | 76% | 0.76 | 78% | 0.778 | S | S | * | * | trans | -61.8 | 116.5 | 163.2 | 25.9 | -29.8 | 0 | 0 | 0 | 106.5 | F155 D159 | F155-P157 VanDerWaalsContact O-CD 3.29Å; F155-P157 WeakPolarHBondContact O-CD 3.38Å; P157-D159 PolarHBondContact O-N 2.91Å | ||
| 158 | I | 31.4 | Very low | 30.4 | Very low | 141 Ų | 141 | 146 Ų | 146 | 72% | 0.723 | 78% | 0.779 | S | S | * | * | trans | -61.5 | 121.8 | 167.5 | -66.2 | 168.6 | 0 | 0 | 0 | 104.4 | R156 L160 | R156-I158 PolarHBondContact O-N 3.15Å; R156-I158 VanDerWaalsContact O-N 3.09Å; I158-L160 HydrophobicContact CB-CD1 4.39Å; I158-L160 HydrophobicContact CG2-CD1 4.43Å; I158-L160 PolarHBondContact O-N 3.43Å | ||
| 159 | D | 29.3 | Very low | 30.7 | Very low | 157 Ų | 157 | 145.8 Ų | 145.8 | 84% | 0.84 | 78% | 0.78 | S | S | * | * | trans | -57.1 | 88.9 | 167.8 | -79.2 | -43.9 | 0 | 0 | 0 | 106.9 | P157 N161 | P157-D159 PolarHBondContact O-N 2.91Å; D159-N161 PolarHBondContact O-N 3.46Å | ||
| 160 | L | 36.5 | Very low | 30.9 | Very low | 142 Ų | 142 | 148.2 Ų | 148.2 | 74% | 0.743 | 77% | 0.773 | S | S | * | * | trans | -64.7 | 91.8 | 170.3 | -100.7 | 88.6 | 0 | 0 | 0 | 105.2 | I158 R162 | I158-L160 HydrophobicContact CB-CD1 4.39Å; I158-L160 HydrophobicContact CG2-CD1 4.43Å; I158-L160 PolarHBondContact O-N 3.43Å; L160-R162 PolarHBondContact O-N 3.39Å; L160-R162 VanDerWaalsContact O-N 3.08Å | ||
| 161 | N | 30.2 | Very low | 31.2 | Very low | 131 Ų | 131 | 152.1 Ų | 152.1 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | trans | -46 | 118.7 | 169.9 | -170.8 | 1.4 | 0 | 0 | 0 | 107.5 | D159 N163 A164 | D159-N161 PolarHBondContact O-N 3.46Å; N161-N163 PolarHBondContact O-N 3.17Å; N161-A164 PolarHBondContact O-N 2.86Å | ||
| 162 | R | 37.2 | Very low | 31.6 | Very low | 243 Ų | 243 | 145.9 Ų | 145.9 | 92% | 0.917 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.2 | 12.8 | -158 | -139.7 | 177.6 | -173.5 | -177.6 | 1.5 | 115 | L160 | L160-R162 PolarHBondContact O-N 3.39Å; L160-R162 VanDerWaalsContact O-N 3.08Å |
| 163 | N | 33.8 | Very low | 32.2 | Very low | 143 Ų | 143 | 144.4 Ų | 144.4 | 77% | 0.765 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.9 | 7.9 | -172.7 | -64.4 | -8.4 | 0 | 0 | 0 | 113.5 | N161 | N161-N163 PolarHBondContact O-N 3.17Š|
| 164 | A | 38 | Very low | 32.8 | Very low | 88 Ų | 88 | 147.9 Ų | 147.9 | 73% | 0.727 | 74% | 0.743 | S | S | * | * | trans | -95.6 | 104.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | N161 S166 | N161-A164 PolarHBondContact O-N 2.86Å; A164-S166 PolarHBondContact O-N 2.89Å | ||
| 165 | E | 34.6 | Very low | 33.4 | Very low | 178 Ų | 178 | 148.7 Ų | 148.7 | 83% | 0.832 | 74% | 0.742 | S | S | * | * | trans | -44.2 | 126.8 | 169.7 | -71.1 | 162.9 | 139.2 | 0 | 0 | 112.1 | ||||
| 166 | S | 32.2 | Very low | 34.1 | Very low | 94 Ų | 94 | 141.7 Ų | 141.7 | 66% | 0.657 | 71% | 0.714 | S | S | * | * | S | Bend | trans | 51.8 | 123.7 | 165.2 | 59.7 | 0 | 0 | 0 | 0 | 117.7 | A164 K168 | A164-S166 PolarHBondContact O-N 2.89Å; S166-K168 PolarHBondContact O-N 2.96Å |
| 167 | P | 34.8 | Very low | 34.9 | Very low | 124 Ų | 124 | 135.4 Ų | 135.4 | 81% | 0.805 | 70% | 0.697 | S | S | * | * | trans | -62.9 | 105.6 | -178.5 | 26.7 | -33 | 0 | 0 | 0 | 110.4 | ||||
| 168 | K | 36.4 | Very low | 35.7 | Very low | 185 Ų | 185 | 137.1 Ų | 137.1 | 80% | 0.804 | 70% | 0.695 | S | S | * | * | trans | -59 | 130 | 171.2 | -68.1 | 177.8 | 179.3 | -179.4 | 0 | 108.2 | S166 Y170 | S166-K168 PolarHBondContact O-N 2.96Å; K168-Y170 PolarHBondContact O-N 3.48Å | ||
| 169 | P | 33.3 | Very low | 36 | Very low | 126 Ų | 126 | 139.5 Ų | 139.5 | 82% | 0.818 | 70% | 0.695 | S | S | * | * | trans | -63.3 | 103.6 | -175.4 | 24.1 | -32.5 | 0 | 0 | 0 | 110 | I171 | P169-I171 PolarHBondContact O-N 3.21Š| ||
| 170 | Y | 33.7 | Very low | 36.5 | Very low | 198 Ų | 198 | 135.8 Ų | 135.8 | 78% | 0.776 | 67% | 0.674 | S | S | * | * | trans | -82.3 | 98 | 173.2 | 178.3 | -100.3 | 0 | 0 | 0 | 108.2 | K168 S172 | K168-Y170 PolarHBondContact O-N 3.48Å; Y170-S172 VanDerWaalsContact CE1-CB 3.48Å; Y170-S172 PolarHBondContact O-N 2.8Å; Y170-S172 VanDerWaalsContact O-N 3.09Å | ||
| 171 | I | 32.5 | Very low | 36.8 | Very low | 136 Ų | 136 | 134.7 Ų | 134.7 | 70% | 0.697 | 66% | 0.66 | S | S | * | * | trans | -74 | 99.1 | 164.9 | -62.6 | 171.8 | 0 | 0 | 0 | 106.2 | P169 L173 | P169-I171 PolarHBondContact O-N 3.21Å; I171-L173 PolarHBondContact O-N 3.25Å | ||
| 172 | S | 36.4 | Very low | 37.5 | Very low | 41 Ų | 41 | 135 Ų | 135 | 29% | 0.287 | 66% | 0.662 | S | S | . | * | trans | -57.3 | 123.1 | 173.5 | 71.1 | 0 | 0 | 0 | 0 | 109.2 | Y170 H174 Y175 | Y170-S172 VanDerWaalsContact CE1-CB 3.48Å; Y170-S172 PolarHBondContact O-N 2.8Å; Y170-S172 VanDerWaalsContact O-N 3.09Å; S172-H174 PolarHBondContact O-N 3.31Å; S172-Y175 PolarHBondContact O-N 3.25Å; S172-Y175 VanDerWaalsContact O-N 3.17Å | ||
| 173 | L | 38.3 | Very low | 37.6 | Very low | 76 Ų | 76 | 127.9 Ų | 127.9 | 40% | 0.398 | 64% | 0.641 | S | S | . | * | G | 310 helix | trans | -56.5 | -11.7 | -178.3 | -121.7 | 98.5 | 0 | 0 | 0 | 113.7 | I171 Y175 | I171-L173 PolarHBondContact O-N 3.25Å; L173-Y175 PolarHBondContact O-N 2.95Å |
| 174 | H | 39.2 | Very low | 37.9 | Very low | 179 Ų | 179 | 123 Ų | 123 | 83% | 0.829 | 61% | 0.614 | S | S | * | * | G | 310 helix | trans | -69.2 | -17.3 | 178.1 | -78.2 | -57.5 | 0 | 0 | 0 | 114.2 | S172 | S172-H174 PolarHBondContact O-N 3.31Š|
| 175 | Y | 36.3 | Very low | 38.2 | Very low | 214 Ų | 214 | 124.5 Ų | 124.5 | 84% | 0.839 | 61% | 0.606 | S | S | * | * | G | 310 helix | trans | -97.6 | 0.5 | 179 | -98.5 | -84.2 | 0 | 0 | 0 | 114.9 | S172 L173 D177 | S172-Y175 PolarHBondContact O-N 3.25Å; S172-Y175 VanDerWaalsContact O-N 3.17Å; L173-Y175 PolarHBondContact O-N 2.95Å; Y175-D177 PolarHBondContact O-N 2.68Å |
| 176 | V | 39.7 | Very low | 38.6 | Very low | 34 Ų | 34 | 122.2 Ų | 122.2 | 21% | 0.206 | 59% | 0.59 | C | S | . | * | S | Bend | trans | -79.5 | 109.5 | 174.4 | -177.9 | 0 | 0 | 0 | 0 | 107.8 | Q178 I180 | V176-Q178 PolarHBondContact O-N 3.41Å; V176-I180 HydrophobicContact CG1-CB 3.66Å; V176-I180 HydrophobicContact CG1-CG2 3.63Å |
| 177 | D | 40.3 | Very low | 39.5 | Very low | 96 Ų | 96 | 127.2 Ų | 127.2 | 51% | 0.513 | 60% | 0.603 | S | S | . | * | trans | -41.8 | 130.3 | 173.9 | -170.9 | -17.6 | 0 | 0 | 0 | 109.6 | Y175 R179 I180 R181 | Y175-D177 PolarHBondContact O-N 2.68Å; D177-R179 PolarHBondContact O-N 3.46Å; D177-R179 PolarHBondContact OD1-N 2.78Å; D177-I180 HydrophobicContact CB-CD1 4.26Å; D177-I180 HydrophobicContact CB-CG1 4.39Å; D177-I180 WeakPolarHBondContact O-CA 3.44Å; D177-I180 WeakPolarHBondContact O-CB 3.4Å; D177-I180 PolarHBondContact O-N 2.89Å; D177-R181 PolarHBondContact O-N 2.76Å | ||
| 178 | Q | 45.6 | Very low | 39.9 | Very low | 153 Ų | 153 | 125.3 Ų | 125.3 | 72% | 0.715 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -56.8 | -23.5 | -172.4 | -163.5 | 160.3 | -6.4 | 0 | 0 | 112.2 | V176 R181 N182 | V176-Q178 PolarHBondContact O-N 3.41Å; Q178-R181 PolarHBondContact O-N 2.89Å; Q178-N182 PolarHBondContact O-N 3.18Å |
| 179 | R | 38.9 | Very low | 40.4 | Very low | 192 Ų | 192 | 119.6 Ų | 119.6 | 73% | 0.725 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -63.5 | -43.8 | 170.9 | -62 | -178.3 | -176.1 | -128 | 0.8 | 112.9 | D177 R181 N182 I183 | D177-R179 PolarHBondContact O-N 3.46Å; D177-R179 PolarHBondContact OD1-N 2.78Å; R179-R181 VanDerWaalsContact C-N 3.33Å; R179-N182 PolarHBondContact O-N 3.44Å; R179-I183 WeakPolarHBondContact O-CG1 3.41Å; R179-I183 PolarHBondContact O-N 3.25Å |
| 180 | I | 38.9 | Very low | 41.3 | Very low | 79 Ų | 79 | 116.8 Ų | 116.8 | 41% | 0.405 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -69.7 | -36.9 | 178.9 | -60.1 | 173.7 | 0 | 0 | 0 | 109.8 | V176 D177 N182 I183 I184 | V176-I180 HydrophobicContact CG1-CB 3.66Å; V176-I180 HydrophobicContact CG1-CG2 3.63Å; D177-I180 HydrophobicContact CB-CD1 4.26Å; D177-I180 HydrophobicContact CB-CG1 4.39Å; D177-I180 WeakPolarHBondContact O-CA 3.44Å; D177-I180 WeakPolarHBondContact O-CB 3.4Å; D177-I180 PolarHBondContact O-N 2.89Å; I180-N182 PolarHBondContact O-N 3.42Å; I180-I183 PolarHBondContact O-N 2.95Å; I180-I183 VanDerWaalsContact O-N 3.11Å; I180-I184 HydrophobicContact CG2-CD1 3.65Å; I180-I184 HydrophobicContact CG2-CG1 4.24Å; I180-I184 PolarHBondContact O-N 3.42Å |
| 181 | R | 42 | Very low | 42 | Very low | 119 Ų | 119 | 111.5 Ų | 111.5 | 45% | 0.449 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.3 | -31.4 | 176 | -127.5 | -176.3 | -165 | -143.7 | 4.3 | 113.2 | D177 Q178 R179 | D177-R181 PolarHBondContact O-N 2.76Å; Q178-R181 PolarHBondContact O-N 2.89Å; R179-R181 VanDerWaalsContact C-N 3.33Å |
| 182 | N | 44.8 | Very low | 42.5 | Very low | 137 Ų | 137 | 105.3 Ų | 105.3 | 73% | 0.733 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -81.2 | -25.8 | 177 | -74 | 1 | 0 | 0 | 0 | 113.6 | Q178 R179 I180 | Q178-N182 PolarHBondContact O-N 3.18Å; R179-N182 PolarHBondContact O-N 3.44Å; I180-N182 PolarHBondContact O-N 3.42Å |
| 183 | I | 39.3 | Very low | 43.3 | Very low | 94 Ų | 94 | 108.9 Ų | 108.9 | 48% | 0.482 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -80.9 | -37.5 | 179.7 | -64.5 | 165.5 | 0 | 0 | 0 | 110.1 | R179 I180 Q185 L196 | R179-I183 WeakPolarHBondContact O-CG1 3.41Å; R179-I183 PolarHBondContact O-N 3.25Å; I180-I183 PolarHBondContact O-N 2.95Å; I180-I183 VanDerWaalsContact O-N 3.11Å; I183-Q185 PolarHBondContact O-N 3.49Å; I183-L196 HydrophobicContact CG2-CD2 3.93Å |
| 184 | I | 40 | Very low | 44 | Very low | 40 Ų | 40 | 112.5 Ų | 112.5 | 21% | 0.205 | 54% | 0.536 | C | S | . | . | S | Bend | trans | -87.7 | 104.6 | 180 | -58.4 | 177.1 | 0 | 0 | 0 | 108.6 | I180 W186 S192 | I180-I184 HydrophobicContact CG2-CD1 3.65Å; I180-I184 HydrophobicContact CG2-CG1 4.24Å; I180-I184 PolarHBondContact O-N 3.42Å; I184-W186 VanDerWaalsContact C-N 3.25Å; I184-W186 HydrophobicContact CB-CZ2 4.3Å; I184-W186 HydrophobicContact CD1-CZ2 4.1Å; I184-W186 HydrophobicContact CG2-CD2 3.75Å; I184-W186 HydrophobicContact CG2-CE3 4.23Å; I184-W186 HydrophobicContact CG2-CG 4.06Å; I184-W186 HydrophobicContact CG2-CH2 4.45Å; I184-W186 HydrophobicContact CG2-CZ2 3.99Å; I184-W186 PolarHBondContact O-N 2.95Å; I184-W186 PolarHBondContact O-NE1 3.45Å; I184-S192 WeakPolarHBondContact CA-OG 3.45Å; I184-S192 WeakPolarHBondContact CG2-OG 3.49Å |
| 185 | Q | 44.6 | Very low | 44.6 | Very low | 119 Ų | 119 | 108.1 Ų | 108.1 | 56% | 0.556 | 52% | 0.522 | S | S | * | . | trans | -68.4 | 88.7 | 165.9 | -71.9 | -175.6 | -0.9 | 0 | 0 | 108.5 | I183 E187 N188 | I183-Q185 PolarHBondContact O-N 3.49Å; Q185-E187 PolarHBondContact O-N 3.33Å; Q185-N188 CarbonylContact O-C 3.27Å; Q185-N188 VanDerWaalsContact O-C 3.27Å; Q185-N188 PolarHBondContact O-N 3.3Å | ||
| 186 | W | 44.7 | Very low | 45.6 | Very low | 131 Ų | 131 | 102.1 Ų | 102.1 | 50% | 0.496 | 50% | 0.504 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62 | -23.3 | -178.4 | -66.9 | 92 | 0 | 0 | 0 | 113.3 | I184 N188 | I184-W186 VanDerWaalsContact C-N 3.25Å; I184-W186 HydrophobicContact CB-CZ2 4.3Å; I184-W186 HydrophobicContact CD1-CZ2 4.1Å; I184-W186 HydrophobicContact CG2-CD2 3.75Å; I184-W186 HydrophobicContact CG2-CE3 4.23Å; I184-W186 HydrophobicContact CG2-CG 4.06Å; I184-W186 HydrophobicContact CG2-CH2 4.45Å; I184-W186 HydrophobicContact CG2-CZ2 3.99Å; I184-W186 PolarHBondContact O-N 2.95Å; I184-W186 PolarHBondContact O-NE1 3.45Å; W186-N188 PolarHBondContact O-N 3.12Å |
| 187 | E | 50.4 | Low | 46.5 | Very low | 199 Ų | 199 | 106.9 Ų | 106.9 | 93% | 0.93 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67 | -22.5 | 174.5 | -74.6 | -178.2 | 167.1 | 0 | 0 | 112.6 | Q185 | Q185-E187 PolarHBondContact O-N 3.33Š|
| 188 | N | 42.1 | Very low | 47.1 | Very low | 84 Ų | 84 | 107.4 Ų | 107.4 | 45% | 0.449 | 53% | 0.525 | S | S | . | . | trans | -146.5 | 83.4 | 178.6 | -143.8 | -18.7 | 0 | 0 | 0 | 111.2 | Q185 W186 A190 L191 S192 | Q185-N188 CarbonylContact O-C 3.27Å; Q185-N188 VanDerWaalsContact O-C 3.27Å; Q185-N188 PolarHBondContact O-N 3.3Å; W186-N188 PolarHBondContact O-N 3.12Å; N188-A190 PolarHBondContact O-N 2.88Å; N188-A190 VanDerWaalsContact O-N 3.12Å; N188-L191 HydrophobicContact CB-CB 4.35Å; N188-L191 HydrophobicContact CB-CD1 4.44Å; N188-L191 PolarHBondContact O-N 3.43Å; N188-L191 VanDerWaalsContact O-N 3.08Å; N188-S192 PolarHBondContact O-N 3.46Å | ||
| 189 | P | 48.4 | Very low | 47.2 | Very low | 65 Ų | 65 | 101.7 Ų | 101.7 | 42% | 0.422 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60 | -28.6 | -172.7 | 23.2 | -33.4 | 0 | 0 | 0 | 113 | S192 I193 | P189-S192 PolarHBondContact O-N 3.19Å; P189-I193 VanDerWaalsContact O-CG1 3.26Å; P189-I193 WeakPolarHBondContact O-CG1 3.3Å; P189-I193 PolarHBondContact O-N 2.96Å |
| 190 | A | 52.1 | Low | 47.9 | Very low | 66 Ų | 66 | 97.4 Ų | 97.4 | 55% | 0.545 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.7 | -44 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | N188 I193 F194 | N188-A190 PolarHBondContact O-N 2.88Å; N188-A190 VanDerWaalsContact O-N 3.12Å; A190-I193 PolarHBondContact O-N 3.09Å; A190-F194 PolarHBondContact O-N 3.49Å |
| 191 | L | 47.3 | Very low | 48.6 | Very low | 88 Ų | 88 | 96.6 Ų | 96.6 | 46% | 0.461 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.5 | -40.6 | 175.7 | -102.6 | 163.9 | 0 | 0 | 0 | 111.2 | N188 I193 F194 V195 | N188-L191 HydrophobicContact CB-CB 4.35Å; N188-L191 HydrophobicContact CB-CD1 4.44Å; N188-L191 PolarHBondContact O-N 3.43Å; N188-L191 VanDerWaalsContact O-N 3.08Å; L191-I193 VanDerWaalsContact C-N 3.33Å; L191-I193 PolarHBondContact O-N 3.5Å; L191-F194 PolarHBondContact O-N 3.07Å; L191-V195 WeakPolarHBondContact O-CG2 3.31Å; L191-V195 PolarHBondContact O-N 3.34Å |
| 192 | S | 42.9 | Very low | 49.1 | Very low | 6 Ų | 6 | 97.5 Ų | 97.5 | 4% | 0.042 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -61.8 | -41 | 175.4 | -178.2 | 0 | 0 | 0 | 0 | 112.3 | I184 N188 P189 F194 L196 | I184-S192 WeakPolarHBondContact CA-OG 3.45Å; I184-S192 WeakPolarHBondContact CG2-OG 3.49Å; N188-S192 PolarHBondContact O-N 3.46Å; P189-S192 PolarHBondContact O-N 3.19Å; S192-F194 VanDerWaalsContact C-N 3.34Å; S192-L196 WeakPolarHBondContact O-CB 3.44Å; S192-L196 WeakPolarHBondContact O-CG 3.42Å; S192-L196 PolarHBondContact O-N 3.41Å |
| 193 | I | 54.2 | Low | 49.4 | Very low | 115 Ų | 115 | 95.7 Ų | 95.7 | 59% | 0.59 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64.6 | -42.7 | 176.6 | -68.9 | 162.8 | 0 | 0 | 0 | 109.8 | P189 A190 L191 L196 F197 | P189-I193 VanDerWaalsContact O-CG1 3.26Å; P189-I193 WeakPolarHBondContact O-CG1 3.3Å; P189-I193 PolarHBondContact O-N 2.96Å; A190-I193 PolarHBondContact O-N 3.09Å; L191-I193 VanDerWaalsContact C-N 3.33Å; L191-I193 PolarHBondContact O-N 3.5Å; I193-L196 PolarHBondContact O-N 3.4Å; I193-F197 WeakPolarHBondContact O-CB 3.49Å; I193-F197 PolarHBondContact O-N 3.48Å |
| 194 | F | 52.9 | Low | 49.9 | Very low | 153 Ų | 153 | 95.3 Ų | 95.3 | 67% | 0.671 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.4 | -44.4 | 179.4 | -146.4 | -86.1 | 0 | 0 | 0 | 112.1 | A190 L191 S192 L196 F197 D198 | A190-F194 PolarHBondContact O-N 3.49Å; L191-F194 PolarHBondContact O-N 3.07Å; S192-F194 VanDerWaalsContact C-N 3.34Å; F194-L196 VanDerWaalsContact C-N 3.35Å; F194-L196 PolarHBondContact O-N 2.9Å; F194-F197 PolarHBondContact O-N 3.47Å; F194-D198 WeakPolarHBondContact O-CB 3.35Å; F194-D198 PolarHBondContact O-N 3.4Å |
| 195 | V | 52.3 | Low | 50.4 | Low | 86 Ų | 86 | 96 Ų | 96 | 52% | 0.521 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65 | -38.4 | 175.9 | 173 | 0 | 0 | 0 | 0 | 111.6 | L191 G199 | L191-V195 WeakPolarHBondContact O-CG2 3.31Å; L191-V195 PolarHBondContact O-N 3.34Å; V195-G199 PolarHBondContact O-N 2.76Å |
| 196 | L | 56.5 | Low | 50.7 | Low | 88 Ų | 88 | 94.3 Ų | 94.3 | 46% | 0.461 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67 | -40 | 175.2 | -74.6 | 170.2 | 0 | 0 | 0 | 111.7 | I183 S192 I193 F194 L200 | I183-L196 HydrophobicContact CG2-CD2 3.93Å; S192-L196 WeakPolarHBondContact O-CB 3.44Å; S192-L196 WeakPolarHBondContact O-CG 3.42Å; S192-L196 PolarHBondContact O-N 3.41Å; I193-L196 PolarHBondContact O-N 3.4Å; F194-L196 VanDerWaalsContact C-N 3.35Å; F194-L196 PolarHBondContact O-N 2.9Å; L196-L200 WeakPolarHBondContact O-CB 3.42Å; L196-L200 PolarHBondContact O-N 2.89Å |
| 197 | F | 57.4 | Low | 50.6 | Low | 135 Ų | 135 | 93.7 Ų | 93.7 | 59% | 0.592 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -67 | -46.2 | 177 | -169.4 | -94.6 | 0 | 0 | 0 | 111.4 | I193 F194 G199 L200 V201 | I193-F197 WeakPolarHBondContact O-CB 3.49Å; I193-F197 PolarHBondContact O-N 3.48Å; F194-F197 PolarHBondContact O-N 3.47Å; F197-G199 VanDerWaalsContact C-N 3.33Å; F197-G199 PolarHBondContact O-N 2.82Å; F197-L200 WeakPolarHBondContact O-CB 3.42Å; F197-L200 PolarHBondContact O-N 2.91Å; F197-L200 VanDerWaalsContact O-N 3.15Å; F197-V201 HydrophobicContact CD1-CG2 4.05Å; F197-V201 HydrophobicContact CE1-CG2 3.75Å; F197-V201 HydrophobicContact CZ-CG2 4.21Å; F197-V201 WeakPolarHBondContact O-CG2 3.33Å; F197-V201 PolarHBondContact O-N 3.2Å |
| 198 | D | 54.5 | Low | 50.7 | Low | 106 Ų | 106 | 88.7 Ų | 88.7 | 57% | 0.567 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -62.1 | -42.3 | 176.3 | -164 | 40.8 | 0 | 0 | 0 | 111.1 | F194 L200 V201 F202 | F194-D198 WeakPolarHBondContact O-CB 3.35Å; F194-D198 PolarHBondContact O-N 3.4Å; D198-L200 PolarHBondContact O-N 2.87Å; D198-V201 PolarHBondContact O-N 3.46Å; D198-F202 VanDerWaalsContact O-CB 3.31Å; D198-F202 WeakPolarHBondContact O-CB 3.34Å; D198-F202 PolarHBondContact O-N 3.33Å |
| 199 | G | 47.4 | Very low | 51 | Low | 34 Ų | 34 | 89.9 Ų | 89.9 | 35% | 0.351 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.5 | -39.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | V195 F197 L203 | V195-G199 PolarHBondContact O-N 2.76Å; F197-G199 VanDerWaalsContact C-N 3.33Å; F197-G199 PolarHBondContact O-N 2.82Å; G199-L203 WeakPolarHBondContact O-CB 3.29Å; G199-L203 PolarHBondContact O-N 3.17Å |
| 200 | L | 54.2 | Low | 51.2 | Low | 102 Ų | 102 | 89.6 Ų | 89.6 | 53% | 0.534 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -66.5 | -47 | 176.3 | -169.4 | 92.7 | 0 | 0 | 0 | 111.3 | L196 F197 D198 F202 L203 I204 | L196-L200 WeakPolarHBondContact O-CB 3.42Å; L196-L200 PolarHBondContact O-N 2.89Å; F197-L200 WeakPolarHBondContact O-CB 3.42Å; F197-L200 PolarHBondContact O-N 2.91Å; F197-L200 VanDerWaalsContact O-N 3.15Å; D198-L200 PolarHBondContact O-N 2.87Å; L200-F202 VanDerWaalsContact C-N 3.3Å; L200-F202 PolarHBondContact O-N 2.84Å; L200-L203 WeakPolarHBondContact O-CB 3.09Å; L200-L203 PolarHBondContact O-N 2.91Å; L200-I204 HydrophobicContact CD2-CD1 4.06Å; L200-I204 HydrophobicContact CG-CD1 4.05Å; L200-I204 VanDerWaalsContact O-CG1 3.3Å; L200-I204 WeakPolarHBondContact O-CG1 3.39Å; L200-I204 PolarHBondContact O-N 3.35Å |
| 201 | V | 53.7 | Low | 51.2 | Low | 61 Ų | 61 | 91.3 Ų | 91.3 | 37% | 0.37 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.6 | -41.3 | 177.9 | 173 | 0 | 0 | 0 | 0 | 110.6 | F197 D198 I204 S205 | F197-V201 HydrophobicContact CD1-CG2 4.05Å; F197-V201 HydrophobicContact CE1-CG2 3.75Å; F197-V201 HydrophobicContact CZ-CG2 4.21Å; F197-V201 WeakPolarHBondContact O-CG2 3.33Å; F197-V201 PolarHBondContact O-N 3.2Å; D198-V201 PolarHBondContact O-N 3.46Å; V201-I204 PolarHBondContact O-N 2.98Å; V201-S205 WeakPolarHBondContact O-CB 3.46Å; V201-S205 PolarHBondContact O-N 3.22Å; V201-S205 PolarHBondContact O-OG 3.39Å |
| 202 | F | 51.5 | Low | 51.6 | Low | 138 Ų | 138 | 91.7 Ų | 91.7 | 61% | 0.605 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -62.8 | -42.7 | 174.6 | -170.2 | -104.9 | 0 | 0 | 0 | 111.9 | D198 L200 S205 I206 | D198-F202 VanDerWaalsContact O-CB 3.31Å; D198-F202 WeakPolarHBondContact O-CB 3.34Å; D198-F202 PolarHBondContact O-N 3.33Å; L200-F202 VanDerWaalsContact C-N 3.3Å; L200-F202 PolarHBondContact O-N 2.84Å; F202-S205 PolarHBondContact O-N 3.41Å; F202-I206 HydrophobicContact CD1-CD1 3.61Å; F202-I206 HydrophobicContact CD1-CG1 4.47Å; F202-I206 HydrophobicContact CE1-CD1 3.25Å; F202-I206 HydrophobicContact CE1-CG1 4.25Å; F202-I206 HydrophobicContact CG-CD1 4.46Å; F202-I206 HydrophobicContact CZ-CD1 3.83Å; F202-I206 HydrophobicContact CZ-CG1 4.47Å; F202-I206 WeakPolarHBondContact O-CG1 3.31Å; F202-I206 PolarHBondContact O-N 2.98Å |
| 203 | L | 50.5 | Low | 52.2 | Low | 100 Ų | 100 | 95 Ų | 95 | 52% | 0.524 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.3 | -45.4 | 176.7 | -135.1 | 108.6 | 0 | 0 | 0 | 111.8 | G199 L200 S205 I206 H207 | G199-L203 WeakPolarHBondContact O-CB 3.29Å; G199-L203 PolarHBondContact O-N 3.17Å; L200-L203 WeakPolarHBondContact O-CB 3.09Å; L200-L203 PolarHBondContact O-N 2.91Å; L203-S205 VanDerWaalsContact C-N 3.3Å; L203-S205 PolarHBondContact O-N 2.88Å; L203-I206 PolarHBondContact O-N 2.88Å; L203-H207 PolarHBondContact O-CD2 3Å; L203-H207 PolarHBondContact O-N 3.15Å |
| 204 | I | 50.9 | Low | 52.3 | Low | 86 Ų | 86 | 93.2 Ų | 93.2 | 44% | 0.441 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.2 | -43.8 | 176.1 | -68.3 | 165.6 | 0 | 0 | 0 | 109.9 | L200 V201 I206 H207 I208 | L200-I204 HydrophobicContact CD2-CD1 4.06Å; L200-I204 HydrophobicContact CG-CD1 4.05Å; L200-I204 VanDerWaalsContact O-CG1 3.3Å; L200-I204 WeakPolarHBondContact O-CG1 3.39Å; L200-I204 PolarHBondContact O-N 3.35Å; V201-I204 PolarHBondContact O-N 2.98Å; I204-I206 PolarHBondContact O-N 3.36Å; I204-H207 PolarHBondContact O-N 3.08Å; I204-I208 HydrophobicContact CG2-CD1 3.72Å; I204-I208 HydrophobicContact CG2-CG1 4.37Å; I204-I208 WeakPolarHBondContact O-CG1 3.46Å; I204-I208 PolarHBondContact O-N 3.19Å |
| 205 | S | 49.5 | Very low | 52.8 | Low | 54 Ų | 54 | 91 Ų | 91 | 38% | 0.378 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.1 | -43.8 | 178.8 | -59.9 | 0 | 0 | 0 | 0 | 112 | V201 F202 L203 H207 I208 L209 | V201-S205 WeakPolarHBondContact O-CB 3.46Å; V201-S205 PolarHBondContact O-N 3.22Å; V201-S205 PolarHBondContact O-OG 3.39Å; F202-S205 PolarHBondContact O-N 3.41Å; L203-S205 VanDerWaalsContact C-N 3.3Å; L203-S205 PolarHBondContact O-N 2.88Å; S205-H207 VanDerWaalsContact C-N 3.35Å; S205-H207 PolarHBondContact O-N 3.44Å; S205-I208 PolarHBondContact O-N 2.97Å; S205-L209 WeakPolarHBondContact O-CB 3.24Å; S205-L209 VanDerWaalsContact O-CG 3.29Å; S205-L209 WeakPolarHBondContact O-CG 3.32Å; S205-L209 PolarHBondContact O-N 2.75Å |
| 206 | I | 51.6 | Low | 53.2 | Low | 83 Ų | 83 | 89.5 Ų | 89.5 | 43% | 0.426 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.2 | -42.7 | 174.4 | -70.7 | 169.6 | 0 | 0 | 0 | 110.9 | F202 L203 I204 L209 S210 | F202-I206 HydrophobicContact CD1-CD1 3.61Å; F202-I206 HydrophobicContact CD1-CG1 4.47Å; F202-I206 HydrophobicContact CE1-CD1 3.25Å; F202-I206 HydrophobicContact CE1-CG1 4.25Å; F202-I206 HydrophobicContact CG-CD1 4.46Å; F202-I206 HydrophobicContact CZ-CD1 3.83Å; F202-I206 HydrophobicContact CZ-CG1 4.47Å; F202-I206 WeakPolarHBondContact O-CG1 3.31Å; F202-I206 PolarHBondContact O-N 2.98Å; L203-I206 PolarHBondContact O-N 2.88Å; I204-I206 PolarHBondContact O-N 3.36Å; I206-L209 PolarHBondContact O-N 2.96Å; I206-S210 VanDerWaalsContact O-CB 3.24Å; I206-S210 WeakPolarHBondContact O-CB 3.27Å; I206-S210 PolarHBondContact O-N 2.82Å |
| 207 | H | 41.4 | Very low | 53.3 | Low | 119 Ų | 119 | 90 Ų | 90 | 55% | 0.551 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.9 | -41.3 | 179.4 | -81.5 | -60.6 | 0 | 0 | 0 | 112.5 | L203 I204 S205 S210 L211 | L203-H207 PolarHBondContact O-CD2 3Å; L203-H207 PolarHBondContact O-N 3.15Å; I204-H207 PolarHBondContact O-N 3.08Å; S205-H207 VanDerWaalsContact C-N 3.35Å; S205-H207 PolarHBondContact O-N 3.44Å; H207-S210 PolarHBondContact O-N 3.46Å; H207-L211 WeakPolarHBondContact O-CB 3.41Å; H207-L211 PolarHBondContact O-N 3.31Å |
| 208 | I | 53 | Low | 53.7 | Low | 93 Ų | 93 | 88 Ų | 88 | 48% | 0.477 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.9 | -46.2 | 175.5 | -66.8 | 168.6 | 0 | 0 | 0 | 110.3 | I204 S205 S210 L211 I212 | I204-I208 HydrophobicContact CG2-CD1 3.72Å; I204-I208 HydrophobicContact CG2-CG1 4.37Å; I204-I208 WeakPolarHBondContact O-CG1 3.46Å; I204-I208 PolarHBondContact O-N 3.19Å; S205-I208 PolarHBondContact O-N 2.97Å; I208-S210 VanDerWaalsContact C-N 3.31Å; I208-S210 PolarHBondContact O-N 3.05Å; I208-L211 PolarHBondContact O-N 3.48Å; I208-I212 HydrophobicContact CG2-CD1 3.75Å; I208-I212 HydrophobicContact CG2-CG1 4.4Å; I208-I212 VanDerWaalsContact O-CG1 3.31Å; I208-I212 WeakPolarHBondContact O-CG1 3.49Å; I208-I212 PolarHBondContact O-N 2.92Å |
| 209 | L | 48.7 | Very low | 54.1 | Low | 110 Ų | 110 | 84.3 Ų | 84.3 | 58% | 0.576 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -61.7 | -39.4 | 176.6 | -72.7 | 169.5 | 0 | 0 | 0 | 112 | S205 I206 I212 T213 | S205-L209 WeakPolarHBondContact O-CB 3.24Å; S205-L209 VanDerWaalsContact O-CG 3.29Å; S205-L209 WeakPolarHBondContact O-CG 3.32Å; S205-L209 PolarHBondContact O-N 2.75Å; I206-L209 PolarHBondContact O-N 2.96Å; L209-I212 PolarHBondContact O-N 3.42Å; L209-T213 WeakPolarHBondContact O-CB 3.44Å; L209-T213 VanDerWaalsContact O-CG2 3.27Å; L209-T213 WeakPolarHBondContact O-CG2 3.33Å; L209-T213 PolarHBondContact O-N 2.98Å; L209-T213 PolarHBondContact O-OG1 2.77Å |
| 210 | S | 52 | Low | 54.8 | Low | 59 Ų | 59 | 86.5 Ų | 86.5 | 41% | 0.413 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.5 | -41.2 | 174.3 | -175.8 | 0 | 0 | 0 | 0 | 111.9 | I206 H207 I208 T213 T214 | I206-S210 VanDerWaalsContact O-CB 3.24Å; I206-S210 WeakPolarHBondContact O-CB 3.27Å; I206-S210 PolarHBondContact O-N 2.82Å; H207-S210 PolarHBondContact O-N 3.46Å; I208-S210 VanDerWaalsContact C-N 3.31Å; I208-S210 PolarHBondContact O-N 3.05Å; S210-T213 WeakPolarHBondContact CA-OG1 3.4Å; S210-T213 PolarHBondContact O-N 3Å; S210-T213 PolarHBondContact O-OG1 3.37Å; S210-T214 WeakPolarHBondContact O-CB 3.45Å; S210-T214 WeakPolarHBondContact O-CG2 3.36Å; S210-T214 PolarHBondContact O-N 3.32Å; S210-T214 PolarHBondContact O-OG1 3.31Å |
| 211 | L | 52.5 | Low | 55.3 | Low | 102 Ų | 102 | 84.9 Ų | 84.9 | 53% | 0.534 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -66.8 | -41.9 | 177 | -172.2 | 141.7 | 0 | 0 | 0 | 111.9 | H207 I208 T214 L215 | H207-L211 WeakPolarHBondContact O-CB 3.41Å; H207-L211 PolarHBondContact O-N 3.31Å; I208-L211 PolarHBondContact O-N 3.48Å; L211-T214 WeakPolarHBondContact CA-OG1 3.43Å; L211-T214 PolarHBondContact O-OG1 3.08Å; L211-L215 HydrophobicContact CD2-CD1 3.52Å; L211-L215 HydrophobicContact CG-CD1 4.29Å; L211-L215 WeakPolarHBondContact O-CB 3.37Å; L211-L215 WeakPolarHBondContact O-CG 3.48Å; L211-L215 PolarHBondContact O-N 3.22Å |
| 212 | I | 56.8 | Low | 56.1 | Low | 95 Ų | 95 | 85.5 Ų | 85.5 | 49% | 0.487 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.1 | -45.5 | 176.6 | -66.9 | 166.9 | 0 | 0 | 0 | 110.7 | I208 L209 L215 A216 | I208-I212 HydrophobicContact CG2-CD1 3.75Å; I208-I212 HydrophobicContact CG2-CG1 4.4Å; I208-I212 VanDerWaalsContact O-CG1 3.31Å; I208-I212 WeakPolarHBondContact O-CG1 3.49Å; I208-I212 PolarHBondContact O-N 2.92Å; L209-I212 PolarHBondContact O-N 3.42Å; I212-L215 PolarHBondContact O-N 3.45Å; I212-A216 WeakPolarHBondContact O-CB 3.39Å; I212-A216 PolarHBondContact O-N 3.46Å |
| 213 | T | 54.2 | Low | 56.6 | Low | 75 Ų | 75 | 83.9 Ų | 83.9 | 46% | 0.46 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -65.8 | -41 | 179.5 | 50.5 | 0 | 0 | 0 | 0 | 111.9 | L209 S210 A216 I217 | L209-T213 WeakPolarHBondContact O-CB 3.44Å; L209-T213 VanDerWaalsContact O-CG2 3.27Å; L209-T213 WeakPolarHBondContact O-CG2 3.33Å; L209-T213 PolarHBondContact O-N 2.98Å; L209-T213 PolarHBondContact O-OG1 2.77Å; S210-T213 WeakPolarHBondContact CA-OG1 3.4Å; S210-T213 PolarHBondContact O-N 3Å; S210-T213 PolarHBondContact O-OG1 3.37Å; T213-A216 PolarHBondContact O-N 3.21Å; T213-I217 WeakPolarHBondContact O-CB 3.22Å; T213-I217 WeakPolarHBondContact O-CD1 3.34Å; T213-I217 VanDerWaalsContact O-CG1 3.22Å; T213-I217 WeakPolarHBondContact O-CG1 3.49Å; T213-I217 PolarHBondContact O-N 3.38Å |
| 214 | T | 55.9 | Low | 57.1 | Low | 78 Ų | 78 | 82.9 Ų | 82.9 | 48% | 0.479 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -65.4 | -40.8 | 175.4 | 47.9 | 0 | 0 | 0 | 0 | 112.5 | S210 L211 I217 L218 | S210-T214 WeakPolarHBondContact O-CB 3.45Å; S210-T214 WeakPolarHBondContact O-CG2 3.36Å; S210-T214 PolarHBondContact O-N 3.32Å; S210-T214 PolarHBondContact O-OG1 3.31Å; L211-T214 WeakPolarHBondContact CA-OG1 3.43Å; L211-T214 PolarHBondContact O-OG1 3.08Å; T214-I217 PolarHBondContact O-N 3.45Å; T214-L218 WeakPolarHBondContact O-CB 3.37Å; T214-L218 PolarHBondContact O-N 3.32Å |
| 215 | L | 65.2 | Low | 57.8 | Low | 106 Ų | 106 | 81.7 Ų | 81.7 | 56% | 0.555 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -63.6 | -39.9 | 172.4 | -82.7 | 163.4 | 0 | 0 | 0 | 112.4 | L211 I212 L218 G219 | L211-L215 HydrophobicContact CD2-CD1 3.52Å; L211-L215 HydrophobicContact CG-CD1 4.29Å; L211-L215 WeakPolarHBondContact O-CB 3.37Å; L211-L215 WeakPolarHBondContact O-CG 3.48Å; L211-L215 PolarHBondContact O-N 3.22Å; I212-L215 PolarHBondContact O-N 3.45Å; L215-L218 PolarHBondContact O-N 2.8Å; L215-G219 PolarHBondContact O-N 3.34Å |
| 216 | A | 59 | Low | 58.5 | Low | 56 Ų | 56 | 81.4 Ų | 81.4 | 46% | 0.463 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -65.3 | -42.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | I212 T213 G219 T220 | I212-A216 WeakPolarHBondContact O-CB 3.39Å; I212-A216 PolarHBondContact O-N 3.46Å; T213-A216 PolarHBondContact O-N 3.21Å; A216-G219 PolarHBondContact O-N 2.89Å; A216-T220 WeakPolarHBondContact O-CG2 3.46Å; A216-T220 PolarHBondContact O-N 3.33Å; A216-T220 PolarHBondContact O-OG1 3.27Å; A216-T220 VanDerWaalsContact O-OG1 3.1Å |
| 217 | I | 60.1 | Low | 59 | Low | 99 Ų | 99 | 82.6 Ų | 82.6 | 51% | 0.508 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63 | -44.3 | 174.4 | -67.4 | 164 | 0 | 0 | 0 | 110.2 | T213 T214 G219 T220 I221 | T213-I217 WeakPolarHBondContact O-CB 3.22Å; T213-I217 WeakPolarHBondContact O-CD1 3.34Å; T213-I217 VanDerWaalsContact O-CG1 3.22Å; T213-I217 WeakPolarHBondContact O-CG1 3.49Å; T213-I217 PolarHBondContact O-N 3.38Å; T214-I217 PolarHBondContact O-N 3.45Å; I217-G219 PolarHBondContact O-N 3.49Å; I217-T220 WeakPolarHBondContact CA-OG1 3.41Å; I217-T220 PolarHBondContact O-N 3.36Å; I217-T220 PolarHBondContact O-OG1 3.37Å; I217-I221 HydrophobicContact CG2-CD1 3.75Å; I217-I221 HydrophobicContact CG2-CG1 4.42Å; I217-I221 VanDerWaalsContact O-CG1 3.24Å; I217-I221 WeakPolarHBondContact O-CG1 3.36Å; I217-I221 PolarHBondContact O-N 2.84Å |
| 218 | L | 65.1 | Low | 60 | Low | 92 Ų | 92 | 81.3 Ų | 81.3 | 48% | 0.482 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62.1 | -44.2 | 176.6 | -168.9 | 70.4 | 0 | 0 | 0 | 111.5 | T214 L215 T220 I221 V222 | T214-L218 WeakPolarHBondContact O-CB 3.37Å; T214-L218 PolarHBondContact O-N 3.32Å; L215-L218 PolarHBondContact O-N 2.8Å; L218-T220 PolarHBondContact O-N 3.46Å; L218-I221 PolarHBondContact O-N 3.1Å; L218-V222 WeakPolarHBondContact O-CG2 3.18Å; L218-V222 PolarHBondContact O-N 3.4Å |
| 219 | G | 62.4 | Low | 60.4 | Low | 29 Ų | 29 | 84.2 Ų | 84.2 | 30% | 0.299 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.9 | -44.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L215 A216 I217 V222 I223 | L215-G219 PolarHBondContact O-N 3.34Å; A216-G219 PolarHBondContact O-N 2.89Å; I217-G219 PolarHBondContact O-N 3.49Å; G219-V222 PolarHBondContact O-N 3.22Å; G219-I223 VanDerWaalsContact O-CG1 3.29Å; G219-I223 WeakPolarHBondContact O-CG1 3.44Å; G219-I223 PolarHBondContact O-N 3.37Å |
| 220 | T | 62.9 | Low | 60.5 | Low | 79 Ų | 79 | 85 Ų | 85 | 49% | 0.485 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.6 | -40 | 175.9 | 52.8 | 0 | 0 | 0 | 0 | 112.4 | A216 I217 L218 V222 I223 V224 | A216-T220 WeakPolarHBondContact O-CG2 3.46Å; A216-T220 PolarHBondContact O-N 3.33Å; A216-T220 PolarHBondContact O-OG1 3.27Å; A216-T220 VanDerWaalsContact O-OG1 3.1Å; I217-T220 WeakPolarHBondContact CA-OG1 3.41Å; I217-T220 PolarHBondContact O-N 3.36Å; I217-T220 PolarHBondContact O-OG1 3.37Å; L218-T220 PolarHBondContact O-N 3.46Å; T220-V222 VanDerWaalsContact C-N 3.34Å; T220-V222 PolarHBondContact O-N 3.15Å; T220-I223 PolarHBondContact O-N 2.94Å; T220-V224 WeakPolarHBondContact O-CB 3.39Å; T220-V224 VanDerWaalsContact O-CG2 3.27Å; T220-V224 WeakPolarHBondContact O-CG2 3.3Å; T220-V224 PolarHBondContact O-N 3.27Å |
| 221 | I | 64.5 | Low | 60.3 | Low | 69 Ų | 69 | 88 Ų | 88 | 35% | 0.354 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.1 | -41.8 | 174.7 | -68.4 | 165 | 0 | 0 | 0 | 111 | I217 L218 V224 S225 L302 | I217-I221 HydrophobicContact CG2-CD1 3.75Å; I217-I221 HydrophobicContact CG2-CG1 4.42Å; I217-I221 VanDerWaalsContact O-CG1 3.24Å; I217-I221 WeakPolarHBondContact O-CG1 3.36Å; I217-I221 PolarHBondContact O-N 2.84Å; L218-I221 PolarHBondContact O-N 3.1Å; I221-V224 PolarHBondContact O-N 2.88Å; I221-S225 VanDerWaalsContact O-CB 3.28Å; I221-S225 WeakPolarHBondContact O-CB 3.2Å; I221-S225 PolarHBondContact O-N 2.93Å; I221-S225 PolarHBondContact O-OG 2.82Å; I221-L302 HydrophobicContact CD1-CD1 3.93Å |
| 222 | V | 70 | Confident | 60.2 | Low | 73 Ų | 73 | 86.7 Ų | 86.7 | 44% | 0.442 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.7 | -41.5 | 176.2 | 172.4 | 0 | 0 | 0 | 0 | 111.2 | L218 G219 T220 S225 A226 | L218-V222 WeakPolarHBondContact O-CG2 3.18Å; L218-V222 PolarHBondContact O-N 3.4Å; G219-V222 PolarHBondContact O-N 3.22Å; T220-V222 VanDerWaalsContact C-N 3.34Å; T220-V222 PolarHBondContact O-N 3.15Å; V222-S225 WeakPolarHBondContact CA-OG 3.24Å; V222-S225 PolarHBondContact O-OG 3.49Å; V222-A226 VanDerWaalsContact O-CB 3.3Å; V222-A226 WeakPolarHBondContact O-CB 3.38Å; V222-A226 PolarHBondContact O-N 3.39Å |
| 223 | I | 63.4 | Low | 59.8 | Low | 104 Ų | 104 | 84.3 Ų | 84.3 | 53% | 0.533 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -65.6 | -47.9 | 176.9 | -67.6 | 165.2 | 0 | 0 | 0 | 110.9 | G219 T220 S225 A226 I227 | G219-I223 VanDerWaalsContact O-CG1 3.29Å; G219-I223 WeakPolarHBondContact O-CG1 3.44Å; G219-I223 PolarHBondContact O-N 3.37Å; T220-I223 PolarHBondContact O-N 2.94Å; I223-S225 PolarHBondContact O-N 3.46Å; I223-A226 PolarHBondContact O-N 3.43Å; I223-I227 HydrophobicContact CG2-CD1 3.95Å; I223-I227 WeakPolarHBondContact O-CG1 3.4Å; I223-I227 PolarHBondContact O-N 3.01Å |
| 224 | V | 60 | Low | 59.1 | Low | 79 Ų | 79 | 81.2 Ų | 81.2 | 48% | 0.479 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -62.5 | -45.2 | 179.8 | 171.3 | 0 | 0 | 0 | 0 | 110.8 | T220 I221 A226 I227 I228 | T220-V224 WeakPolarHBondContact O-CB 3.39Å; T220-V224 VanDerWaalsContact O-CG2 3.27Å; T220-V224 WeakPolarHBondContact O-CG2 3.3Å; T220-V224 PolarHBondContact O-N 3.27Å; I221-V224 PolarHBondContact O-N 2.88Å; V224-A226 VanDerWaalsContact C-N 3.33Å; V224-A226 PolarHBondContact O-N 3.3Å; V224-I227 PolarHBondContact O-N 3.02Å; V224-I228 HydrophobicContact CG1-CD1 3.83Å; V224-I228 HydrophobicContact CG1-CG1 4.48Å; V224-I228 WeakPolarHBondContact O-CG1 3.49Å; V224-I228 PolarHBondContact O-N 2.79Å |
| 225 | S | 65 | Low | 58.5 | Low | 62 Ų | 62 | 81.6 Ų | 81.6 | 43% | 0.434 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63.3 | -37.8 | 176.6 | 58.3 | 0 | 0 | 0 | 0 | 112.3 | I221 V222 I223 I228 F229 | I221-S225 VanDerWaalsContact O-CB 3.28Å; I221-S225 WeakPolarHBondContact O-CB 3.2Å; I221-S225 PolarHBondContact O-N 2.93Å; I221-S225 PolarHBondContact O-OG 2.82Å; V222-S225 WeakPolarHBondContact CA-OG 3.24Å; V222-S225 PolarHBondContact O-OG 3.49Å; I223-S225 PolarHBondContact O-N 3.46Å; S225-I228 PolarHBondContact O-N 3.21Å; S225-F229 VanDerWaalsContact O-CB 3.31Å; S225-F229 WeakPolarHBondContact O-CB 3.42Å; S225-F229 PolarHBondContact O-N 3.15Å |
| 226 | A | 64.8 | Low | 57.6 | Low | 47 Ų | 47 | 82.9 Ų | 82.9 | 39% | 0.388 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -64.9 | -39.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V222 I223 V224 R230 | V222-A226 VanDerWaalsContact O-CB 3.3Å; V222-A226 WeakPolarHBondContact O-CB 3.38Å; V222-A226 PolarHBondContact O-N 3.39Å; I223-A226 PolarHBondContact O-N 3.43Å; V224-A226 VanDerWaalsContact C-N 3.33Å; V224-A226 PolarHBondContact O-N 3.3Å; A226-R230 WeakPolarHBondContact O-CG 3.24Å; A226-R230 PolarHBondContact O-N 3.09Å |
| 227 | I | 61.2 | Low | 56.6 | Low | 108 Ų | 108 | 82.4 Ų | 82.4 | 55% | 0.554 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -64.5 | -48 | 175.5 | -67.7 | 165.8 | 0 | 0 | 0 | 110.2 | I223 V224 F229 R230 F231 | I223-I227 HydrophobicContact CG2-CD1 3.95Å; I223-I227 WeakPolarHBondContact O-CG1 3.4Å; I223-I227 PolarHBondContact O-N 3.01Å; V224-I227 PolarHBondContact O-N 3.02Å; I227-F229 VanDerWaalsContact C-N 3.33Å; I227-F229 PolarHBondContact O-N 3.46Å; I227-R230 PolarHBondContact O-N 2.81Å; I227-F231 PolarHBondContact O-N 3.39Å |
| 228 | I | 62.5 | Low | 56 | Low | 92 Ų | 92 | 83.6 Ų | 83.6 | 47% | 0.472 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -61.1 | -44.3 | 178.2 | -66.4 | 168.4 | 0 | 0 | 0 | 110.4 | V224 S225 R230 F231 M232 | V224-I228 HydrophobicContact CG1-CD1 3.83Å; V224-I228 HydrophobicContact CG1-CG1 4.48Å; V224-I228 WeakPolarHBondContact O-CG1 3.49Å; V224-I228 PolarHBondContact O-N 2.79Å; S225-I228 PolarHBondContact O-N 3.21Å; I228-R230 VanDerWaalsContact C-N 3.34Å; I228-R230 PolarHBondContact O-N 3.49Å; I228-F231 PolarHBondContact O-N 3.26Å; I228-M232 HydrophobicContact CG2-CG 4.24Å; I228-M232 WeakPolarHBondContact O-CB 3.37Å; I228-M232 WeakPolarHBondContact O-CG 3.42Å; I228-M232 PolarHBondContact O-N 3.4Å |
| 229 | F | 62.8 | Low | 54.9 | Low | 154 Ų | 154 | 84 Ų | 84 | 68% | 0.675 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -59.1 | -44.7 | 176.5 | 179.7 | -97.9 | 0 | 0 | 0 | 111.8 | S225 I227 F231 M232 A233 | S225-F229 VanDerWaalsContact O-CB 3.31Å; S225-F229 WeakPolarHBondContact O-CB 3.42Å; S225-F229 PolarHBondContact O-N 3.15Å; I227-F229 VanDerWaalsContact C-N 3.33Å; I227-F229 PolarHBondContact O-N 3.46Å; F229-F231 VanDerWaalsContact C-N 3.33Å; F229-F231 PolarHBondContact O-N 2.83Å; F229-M232 PolarHBondContact O-N 3.44Å; F229-A233 VanDerWaalsContact O-CB 3.28Å; F229-A233 WeakPolarHBondContact O-CB 3.32Å; F229-A233 PolarHBondContact O-N 2.8Å |
| 230 | R | 49.7 | Very low | 54.3 | Low | 126 Ų | 126 | 85.1 Ų | 85.1 | 48% | 0.475 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -63.3 | -40 | 175.9 | -75.9 | -175.6 | -175.9 | -174.1 | 6.1 | 112.1 | A226 I227 I228 A233 S234 | A226-R230 WeakPolarHBondContact O-CG 3.24Å; A226-R230 PolarHBondContact O-N 3.09Å; I227-R230 PolarHBondContact O-N 2.81Å; I228-R230 VanDerWaalsContact C-N 3.34Å; I228-R230 PolarHBondContact O-N 3.49Å; R230-A233 PolarHBondContact O-N 2.82Å; R230-S234 PolarHBondContact O-N 3.26Å |
| 231 | F | 49.1 | Very low | 53.7 | Low | 124 Ų | 124 | 90.1 Ų | 90.1 | 54% | 0.544 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.6 | -46.9 | 176.9 | -168.7 | -104.8 | 0 | 0 | 0 | 111.1 | I227 I228 F229 A233 S234 L235 | I227-F231 PolarHBondContact O-N 3.39Å; I228-F231 PolarHBondContact O-N 3.26Å; F229-F231 VanDerWaalsContact C-N 3.33Å; F229-F231 PolarHBondContact O-N 2.83Å; F231-A233 PolarHBondContact O-N 2.87Å; F231-S234 WeakPolarHBondContact O-CB 3.4Å; F231-S234 PolarHBondContact O-N 2.78Å; F231-S234 VanDerWaalsContact O-N 3.11Å; F231-S234 PolarHBondContact O-OG 3.29Å; F231-L235 HydrophobicContact CD1-CD1 3.71Å; F231-L235 HydrophobicContact CD1-CG 4.34Å; F231-L235 HydrophobicContact CE1-CD1 3.42Å; F231-L235 VanDerWaalsContact CE1-CD1 3.42Å; F231-L235 HydrophobicContact CE1-CG 4.14Å; F231-L235 HydrophobicContact CZ-CD1 4.15Å; F231-L235 WeakPolarHBondContact O-CG 3.44Å; F231-L235 PolarHBondContact O-N 3.48Å |
| 232 | M | 50.2 | Low | 53 | Low | 73 Ų | 73 | 92.3 Ų | 92.3 | 36% | 0.36 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.2 | -41.5 | 175.7 | -70 | -62.5 | -75.1 | 0 | 0 | 112.4 | I228 F229 S234 L235 M236 | I228-M232 HydrophobicContact CG2-CG 4.24Å; I228-M232 WeakPolarHBondContact O-CB 3.37Å; I228-M232 WeakPolarHBondContact O-CG 3.42Å; I228-M232 PolarHBondContact O-N 3.4Å; F229-M232 PolarHBondContact O-N 3.44Å; M232-S234 VanDerWaalsContact C-N 3.28Å; M232-S234 PolarHBondContact O-N 2.82Å; M232-L235 PolarHBondContact O-N 2.82Å; M232-L235 VanDerWaalsContact O-N 3.17Å; M232-L235 HydrophobicContact SD-CD1 4.47Å; M232-M236 WeakPolarHBondContact O-CB 3.48Å; M232-M236 PolarHBondContact O-N 3.36Å |
| 233 | A | 48.4 | Very low | 51.4 | Low | 45 Ų | 45 | 93.4 Ų | 93.4 | 37% | 0.372 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.3 | -37.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | F229 R230 F231 I237 | F229-A233 VanDerWaalsContact O-CB 3.28Å; F229-A233 WeakPolarHBondContact O-CB 3.32Å; F229-A233 PolarHBondContact O-N 2.8Å; R230-A233 PolarHBondContact O-N 2.82Å; F231-A233 PolarHBondContact O-N 2.87Å; A233-I237 WeakPolarHBondContact O-CG1 3.36Å |
| 234 | S | 38.7 | Very low | 50.7 | Low | 10 Ų | 10 | 93 Ų | 93 | 7% | 0.07 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -68.3 | -35.6 | 174.8 | 84 | 0 | 0 | 0 | 0 | 112.8 | R230 F231 M232 | R230-S234 PolarHBondContact O-N 3.26Å; F231-S234 WeakPolarHBondContact O-CB 3.4Å; F231-S234 PolarHBondContact O-N 2.78Å; F231-S234 VanDerWaalsContact O-N 3.11Å; F231-S234 PolarHBondContact O-OG 3.29Å; M232-S234 VanDerWaalsContact C-N 3.28Å; M232-S234 PolarHBondContact O-N 2.82Å |
| 235 | L | 44.5 | Very low | 50.1 | Low | 87 Ų | 87 | 94.7 Ų | 94.7 | 46% | 0.455 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -76.3 | -32.7 | 178.7 | -71.9 | 177.1 | 0 | 0 | 0 | 112.9 | F231 M232 I237 | F231-L235 HydrophobicContact CD1-CD1 3.71Å; F231-L235 HydrophobicContact CD1-CG 4.34Å; F231-L235 HydrophobicContact CE1-CD1 3.42Å; F231-L235 VanDerWaalsContact CE1-CD1 3.42Å; F231-L235 HydrophobicContact CE1-CG 4.14Å; F231-L235 HydrophobicContact CZ-CD1 4.15Å; F231-L235 WeakPolarHBondContact O-CG 3.44Å; F231-L235 PolarHBondContact O-N 3.48Å; M232-L235 PolarHBondContact O-N 2.82Å; M232-L235 VanDerWaalsContact O-N 3.17Å; M232-L235 HydrophobicContact SD-CD1 4.47Å; L235-I237 PolarHBondContact O-N 3.45Å |
| 236 | M | 45.1 | Very low | 49.2 | Very low | 133 Ų | 133 | 94.4 Ų | 94.4 | 66% | 0.655 | 49% | 0.488 | S | S | * | . | S | Bend | trans | -72.1 | -11.4 | 178.2 | -82.5 | -162.5 | 166.2 | 0 | 0 | 114 | M232 S238 L312 | M232-M236 WeakPolarHBondContact O-CB 3.48Å; M232-M236 PolarHBondContact O-N 3.36Å; M236-S238 PolarHBondContact O-N 2.98Å; M236-L312 HydrophobicContact CE-CD2 3.95Å |
| 237 | I | 37.8 | Very low | 48.2 | Very low | 45 Ų | 45 | 96 Ų | 96 | 23% | 0.231 | 49% | 0.489 | C | S | . | . | trans | -73.1 | 100.8 | 172 | -67.2 | 166 | 0 | 0 | 0 | 107.9 | A233 L235 D239 M242 R243 I246 | A233-I237 WeakPolarHBondContact O-CG1 3.36Å; L235-I237 PolarHBondContact O-N 3.45Å; I237-D239 HydrophobicContact CG2-CB 4.39Å; I237-D239 PolarHBondContact O-N 3.42Å; I237-M242 HydrophobicContact CG2-CB 3.87Å; I237-M242 HydrophobicContact CG2-CG 4.37Å; I237-M242 HydrophobicContact CG2-SD 4.42Å; I237-R243 HydrophobicContact CG2-CB 4.43Å; I237-I246 HydrophobicContact CD1-CD1 3.43Å; I237-I246 VanDerWaalsContact CD1-CD1 3.43Å | ||
| 238 | S | 48.2 | Very low | 47.6 | Very low | 124 Ų | 124 | 100.4 Ų | 100.4 | 87% | 0.867 | 50% | 0.499 | S | S | * | . | trans | -63.3 | -18.3 | 179.3 | 53.4 | 0 | 0 | 0 | 0 | 113.5 | M236 A240 | M236-S238 PolarHBondContact O-N 2.98Å; S238-A240 PolarHBondContact O-N 2.83Å | ||
| 239 | D | 42.7 | Very low | 46.9 | Very low | 101 Ų | 101 | 102.8 Ų | 102.8 | 54% | 0.54 | 51% | 0.506 | S | S | . | . | trans | -90 | 100.4 | -176.4 | -145.2 | -22.8 | 0 | 0 | 0 | 110.6 | I237 K241 M242 R243 | I237-D239 HydrophobicContact CG2-CB 4.39Å; I237-D239 PolarHBondContact O-N 3.42Å; D239-K241 PolarHBondContact O-N 3.3Å; D239-M242 HydrophobicContact CB-CB 4.07Å; D239-M242 PolarHBondContact O-N 2.82Å; D239-R243 PolarHBondContact O-N 3.21Å | ||
| 240 | A | 48.6 | Very low | 45.9 | Very low | 53 Ų | 53 | 99.9 Ų | 99.9 | 44% | 0.438 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -55.8 | -30.2 | -173.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | S238 N244 | S238-A240 PolarHBondContact O-N 2.83Å; A240-N244 WeakPolarHBondContact O-CB 3.38Å; A240-N244 PolarHBondContact O-N 2.87Å |
| 241 | K | 50.8 | Low | 45.7 | Very low | 183 Ų | 183 | 101.9 Ų | 101.9 | 80% | 0.796 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -70.7 | -36.3 | 177.2 | -149.1 | 175.9 | -173.4 | 179.7 | 0 | 111.7 | D239 N245 | D239-K241 PolarHBondContact O-N 3.3Å; K241-N245 WeakPolarHBondContact O-CB 3.36Å; K241-N245 PolarHBondContact O-N 2.85Å |
| 242 | M | 48.7 | Very low | 45.1 | Very low | 116 Ų | 116 | 101.3 Ų | 101.3 | 57% | 0.571 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -77.6 | -38.4 | 178.5 | -154.2 | 177.9 | -158 | 0 | 0 | 111.2 | I237 D239 N245 I246 | I237-M242 HydrophobicContact CG2-CB 3.87Å; I237-M242 HydrophobicContact CG2-CG 4.37Å; I237-M242 HydrophobicContact CG2-SD 4.42Å; D239-M242 HydrophobicContact CB-CB 4.07Å; D239-M242 PolarHBondContact O-N 2.82Å; M242-N245 PolarHBondContact O-N 3.02Å; M242-I246 WeakPolarHBondContact O-CG1 3.38Å; M242-I246 PolarHBondContact O-N 3.44Å |
| 243 | R | 36.6 | Very low | 44.5 | Very low | 95 Ų | 95 | 101.4 Ų | 101.4 | 36% | 0.358 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.7 | -47.9 | 173.5 | -171 | 179.1 | 72.9 | -160.2 | 3.3 | 112.4 | I237 D239 N245 I246 L247 | I237-R243 HydrophobicContact CG2-CB 4.43Å; D239-R243 PolarHBondContact O-N 3.21Å; R243-N245 VanDerWaalsContact C-N 3.34Å; R243-N245 PolarHBondContact O-N 3.34Å; R243-I246 PolarHBondContact O-N 2.87Å; R243-L247 HydrophobicContact CG-CD1 4.16Å; R243-L247 WeakPolarHBondContact O-CG 3.38Å; R243-L247 PolarHBondContact O-N 3.44Å |
| 244 | N | 48.7 | Very low | 43.9 | Very low | 95 Ų | 95 | 107.6 Ų | 107.6 | 51% | 0.508 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67.5 | -34.2 | 177.1 | -79.2 | 1.3 | 0 | 0 | 0 | 112.5 | A240 I246 L247 R248 | A240-N244 WeakPolarHBondContact O-CB 3.38Å; A240-N244 PolarHBondContact O-N 2.87Å; N244-I246 VanDerWaalsContact C-N 3.35Å; N244-L247 PolarHBondContact O-N 3.33Å; N244-R248 WeakPolarHBondContact O-CB 3.19Å; N244-R248 PolarHBondContact O-N 2.78Å |
| 245 | N | 48.7 | Very low | 43.8 | Very low | 115 Ų | 115 | 111.3 Ų | 111.3 | 62% | 0.615 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -69.7 | -34.9 | 176.8 | -148.5 | 12.6 | 0 | 0 | 0 | 111.4 | K241 M242 R243 K249 | K241-N245 WeakPolarHBondContact O-CB 3.36Å; K241-N245 PolarHBondContact O-N 2.85Å; M242-N245 PolarHBondContact O-N 3.02Å; R243-N245 VanDerWaalsContact C-N 3.34Å; R243-N245 PolarHBondContact O-N 3.34Å; N245-K249 VanDerWaalsContact O-CB 3.28Å; N245-K249 WeakPolarHBondContact O-CB 3.43Å; N245-K249 PolarHBondContact O-N 2.66Å |
| 246 | I | 45.1 | Very low | 43.5 | Very low | 57 Ų | 57 | 110.5 Ų | 110.5 | 29% | 0.292 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -69.9 | -45.9 | 173 | -68.6 | 165.7 | 0 | 0 | 0 | 111 | I237 M242 R243 N244 R248 K249 M250 | I237-I246 HydrophobicContact CD1-CD1 3.43Å; I237-I246 VanDerWaalsContact CD1-CD1 3.43Å; M242-I246 WeakPolarHBondContact O-CG1 3.38Å; M242-I246 PolarHBondContact O-N 3.44Å; R243-I246 PolarHBondContact O-N 2.87Å; N244-I246 VanDerWaalsContact C-N 3.35Å; I246-R248 VanDerWaalsContact C-N 3.35Å; I246-R248 PolarHBondContact O-N 3.3Å; I246-K249 CarbonylContact O-C 3.49Å; I246-K249 PolarHBondContact O-N 2.84Å; I246-K249 VanDerWaalsContact O-N 3.17Å; I246-M250 HydrophobicContact CG2-CE 3.82Å; I246-M250 HydrophobicContact CG2-CG 4.34Å; I246-M250 HydrophobicContact CG2-SD 4.38Å; I246-M250 WeakPolarHBondContact O-CG 3.25Å; I246-M250 PolarHBondContact O-N 2.88Å |
| 247 | L | 43.9 | Very low | 43.4 | Very low | 81 Ų | 81 | 114.2 Ų | 114.2 | 42% | 0.424 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61 | -42.2 | 176.6 | -76.5 | 166.5 | 0 | 0 | 0 | 112 | R243 N244 K249 M250 E251 | R243-L247 HydrophobicContact CG-CD1 4.16Å; R243-L247 WeakPolarHBondContact O-CG 3.38Å; R243-L247 PolarHBondContact O-N 3.44Å; N244-L247 PolarHBondContact O-N 3.33Å; L247-K249 VanDerWaalsContact C-N 3.31Å; L247-K249 PolarHBondContact O-N 2.87Å; L247-M250 HydrophobicContact CD2-SD 4.14Å; L247-M250 WeakPolarHBondContact O-CB 3.46Å; L247-M250 PolarHBondContact O-N 3.34Å; L247-M250 VanDerWaalsContact O-N 3.09Å; L247-E251 PolarHBondContact O-N 3.28Å |
| 248 | R | 49.1 | Very low | 43.7 | Very low | 200 Ų | 200 | 117.7 Ų | 117.7 | 76% | 0.755 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -69.7 | -29.4 | 176.3 | -169.4 | 173.9 | 165.2 | 170.1 | -3.3 | 112.4 | N244 I246 | N244-R248 WeakPolarHBondContact O-CB 3.19Å; N244-R248 PolarHBondContact O-N 2.78Å; I246-R248 VanDerWaalsContact C-N 3.35Å; I246-R248 PolarHBondContact O-N 3.3Å |
| 249 | K | 47.7 | Very low | 43.3 | Very low | 142 Ų | 142 | 121 Ų | 121 | 62% | 0.617 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -73 | -35 | 168.8 | -143.7 | 170.2 | -175.3 | 177.5 | 0 | 110.4 | N245 I246 L247 E251 T252 I253 | N245-K249 VanDerWaalsContact O-CB 3.28Å; N245-K249 WeakPolarHBondContact O-CB 3.43Å; N245-K249 PolarHBondContact O-N 2.66Å; I246-K249 CarbonylContact O-C 3.49Å; I246-K249 PolarHBondContact O-N 2.84Å; I246-K249 VanDerWaalsContact O-N 3.17Å; L247-K249 VanDerWaalsContact C-N 3.31Å; L247-K249 PolarHBondContact O-N 2.87Å; K249-E251 VanDerWaalsContact C-N 3.25Å; K249-E251 PolarHBondContact O-N 3.4Å; K249-T252 CarbonylContact O-C 3.35Å; K249-T252 PolarHBondContact O-N 3.01Å; K249-I253 HydrophobicContact CB-CD1 3.83Å; K249-I253 HydrophobicContact CB-CG1 4.2Å; K249-I253 HydrophobicContact CG-CD1 3.94Å; K249-I253 HydrophobicContact CG-CG1 3.87Å; K249-I253 WeakPolarHBondContact O-CD1 3.26Å; K249-I253 WeakPolarHBondContact O-CG1 3.49Å; K249-I253 PolarHBondContact O-N 2.83Å |
| 250 | M | 42.5 | Very low | 43.1 | Very low | 92 Ų | 92 | 120.3 Ų | 120.3 | 45% | 0.453 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -60.2 | -30.7 | 178.1 | -79.7 | 179.7 | 175.5 | 0 | 0 | 113.4 | I246 L247 T252 I253 | I246-M250 HydrophobicContact CG2-CE 3.82Å; I246-M250 HydrophobicContact CG2-CG 4.34Å; I246-M250 HydrophobicContact CG2-SD 4.38Å; I246-M250 WeakPolarHBondContact O-CG 3.25Å; I246-M250 PolarHBondContact O-N 2.88Å; L247-M250 HydrophobicContact CD2-SD 4.14Å; L247-M250 WeakPolarHBondContact O-CB 3.46Å; L247-M250 PolarHBondContact O-N 3.34Å; L247-M250 VanDerWaalsContact O-N 3.09Å; M250-T252 PolarHBondContact O-N 3.36Å; M250-I253 HydrophobicContact CG-CD1 4.4Å |
| 251 | E | 44.3 | Very low | 43.2 | Very low | 168 Ų | 168 | 122 Ų | 122 | 79% | 0.785 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.7 | -17.1 | 176.1 | -151.1 | 169.2 | -158.2 | 0 | 0 | 112.8 | L247 K249 | L247-E251 PolarHBondContact O-N 3.28Å; K249-E251 VanDerWaalsContact C-N 3.25Å; K249-E251 PolarHBondContact O-N 3.4Å |
| 252 | T | 35.9 | Very low | 43.1 | Very low | 112 Ų | 112 | 116.2 Ų | 116.2 | 69% | 0.687 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -142.3 | 25.1 | 178.7 | 41.9 | 0 | 0 | 0 | 0 | 114.5 | K249 M250 H254 | K249-T252 CarbonylContact O-C 3.35Å; K249-T252 PolarHBondContact O-N 3.01Å; M250-T252 PolarHBondContact O-N 3.36Å; T252-H254 VanDerWaalsContact C-N 3.28Å; T252-H254 PolarHBondContact O-N 3.43Å |
| 253 | I | 38.5 | Very low | 42.9 | Very low | 76 Ų | 76 | 116.1 Ų | 116.1 | 39% | 0.39 | 56% | 0.556 | S | S | . | * | trans | -76.3 | 90.3 | 169.4 | -74.8 | 154.3 | 0 | 0 | 0 | 107.4 | K249 M250 L255 | K249-I253 HydrophobicContact CB-CD1 3.83Å; K249-I253 HydrophobicContact CB-CG1 4.2Å; K249-I253 HydrophobicContact CG-CD1 3.94Å; K249-I253 HydrophobicContact CG-CG1 3.87Å; K249-I253 WeakPolarHBondContact O-CD1 3.26Å; K249-I253 WeakPolarHBondContact O-CG1 3.49Å; K249-I253 PolarHBondContact O-N 2.83Å; M250-I253 HydrophobicContact CG-CD1 4.4Å; I253-L255 PolarHBondContact O-N 2.88Å | ||
| 254 | H | 34.8 | Very low | 43.4 | Very low | 174 Ų | 174 | 118.6 Ų | 118.6 | 81% | 0.806 | 57% | 0.566 | S | S | * | * | trans | -47.2 | 110 | 146.4 | -81.9 | 45.9 | 0 | 0 | 0 | 106.5 | T252 P256 | T252-H254 VanDerWaalsContact C-N 3.28Å; T252-H254 PolarHBondContact O-N 3.43Å; H254-P256 WeakPolarHBondContact O-CD 3.14Å | ||
| 255 | L | 37.7 | Very low | 43.5 | Very low | 89 Ų | 89 | 121 Ų | 121 | 47% | 0.466 | 57% | 0.568 | S | S | . | * | trans | -59.1 | 113.4 | 171.2 | -84.6 | 85.1 | 0 | 0 | 0 | 105.9 | I253 R257 L260 | I253-L255 PolarHBondContact O-N 2.88Å; L255-R257 PolarHBondContact O-N 2.9Å; L255-L260 HydrophobicContact CB-CD1 3.84Å; L255-L260 HydrophobicContact CB-CG 4.33Å; L255-L260 HydrophobicContact CD2-CD1 3.88Å; L255-L260 HydrophobicContact CD2-CD2 3.95Å; L255-L260 HydrophobicContact CD2-CG 3.84Å | ||
| 256 | P | 37.9 | Very low | 43.5 | Very low | 70 Ų | 70 | 118.2 Ų | 118.2 | 46% | 0.455 | 56% | 0.561 | S | S | . | * | trans | -60.1 | 121.3 | 176.9 | 23.6 | -30.4 | 0 | 0 | 0 | 106.7 | H254 D258 R259 | H254-P256 WeakPolarHBondContact O-CD 3.14Å; P256-D258 PolarHBondContact O-N 2.97Å; P256-R259 PolarHBondContact O-N 3.25Å | ||
| 257 | R | 43.9 | Very low | 43.6 | Very low | 210 Ų | 210 | 121.9 Ų | 121.9 | 79% | 0.792 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -45.8 | -33.3 | -175 | -166.4 | 175.8 | -178.4 | 178.6 | -0.1 | 112 | L255 R259 L260 Q261 | L255-R257 PolarHBondContact O-N 2.9Å; R257-R259 PolarHBondContact O-N 3.25Å; R257-L260 PolarHBondContact O-N 2.98Å; R257-Q261 WeakPolarHBondContact O-CB 3.24Å; R257-Q261 PolarHBondContact O-N 3.5Å |
| 258 | D | 42.8 | Very low | 43.8 | Very low | 118 Ų | 118 | 124.6 Ų | 124.6 | 63% | 0.631 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -62.3 | -38.4 | 179.6 | -54.1 | -20.4 | 0 | 0 | 0 | 113.7 | P256 Q261 A262 | P256-D258 PolarHBondContact O-N 2.97Å; D258-Q261 PolarHBondContact O-N 3.46Å; D258-A262 WeakPolarHBondContact O-CB 3.32Å; D258-A262 PolarHBondContact O-N 3.45Å |
| 259 | R | 40.3 | Very low | 44.1 | Very low | 194 Ų | 194 | 121.3 Ų | 121.3 | 73% | 0.732 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -74.5 | -36.5 | 178.2 | -83.1 | -167 | 171.7 | 176.6 | -1.8 | 112.3 | P256 R257 Q261 A262 Q263 | P256-R259 PolarHBondContact O-N 3.25Å; R257-R259 PolarHBondContact O-N 3.25Å; R259-Q261 VanDerWaalsContact C-N 3.32Å; R259-A262 PolarHBondContact O-N 3.29Å; R259-Q263 WeakPolarHBondContact O-CG 3.3Å; R259-Q263 PolarHBondContact O-N 2.93Å |
| 260 | L | 38 | Very low | 44.2 | Very low | 87 Ų | 87 | 117.5 Ų | 117.5 | 46% | 0.455 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -63.9 | -42.2 | 171.2 | -83.9 | 168.6 | 0 | 0 | 0 | 110.5 | L255 R257 A262 Q263 Y264 | L255-L260 HydrophobicContact CB-CD1 3.84Å; L255-L260 HydrophobicContact CB-CG 4.33Å; L255-L260 HydrophobicContact CD2-CD1 3.88Å; L255-L260 HydrophobicContact CD2-CD2 3.95Å; L255-L260 HydrophobicContact CD2-CG 3.84Å; R257-L260 PolarHBondContact O-N 2.98Å; L260-A262 PolarHBondContact O-N 2.8Å; L260-Q263 PolarHBondContact O-N 3.3Å; L260-Y264 VanDerWaalsContact O-CB 3.24Å; L260-Y264 WeakPolarHBondContact O-CB 3.27Å; L260-Y264 PolarHBondContact O-N 2.95Å |
| 261 | Q | 50.7 | Low | 44.4 | Very low | 89 Ų | 89 | 115.5 Ų | 115.5 | 42% | 0.416 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -66.4 | -37.3 | 177.7 | -166.8 | 173.4 | 6.5 | 0 | 0 | 112 | R257 D258 R259 Y264 R265 | R257-Q261 WeakPolarHBondContact O-CB 3.24Å; R257-Q261 PolarHBondContact O-N 3.5Å; D258-Q261 PolarHBondContact O-N 3.46Å; R259-Q261 VanDerWaalsContact C-N 3.32Å; Q261-Y264 PolarHBondContact O-N 2.82Å; Q261-R265 WeakPolarHBondContact O-CB 3.29Å; Q261-R265 WeakPolarHBondContact O-CG 3.2Å; Q261-R265 PolarHBondContact O-N 2.86Å |
| 262 | A | 48.4 | Very low | 44.7 | Very low | 61 Ų | 61 | 110.8 Ų | 110.8 | 50% | 0.504 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -65.7 | -42.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | D258 R259 L260 R265 A266 | D258-A262 WeakPolarHBondContact O-CB 3.32Å; D258-A262 PolarHBondContact O-N 3.45Å; R259-A262 PolarHBondContact O-N 3.29Å; L260-A262 PolarHBondContact O-N 2.8Å; A262-R265 PolarHBondContact O-N 2.85Å; A262-A266 WeakPolarHBondContact O-CB 3.34Å; A262-A266 PolarHBondContact O-N 2.88Å |
| 263 | Q | 46 | Very low | 45.4 | Very low | 113 Ų | 113 | 112.3 Ų | 112.3 | 53% | 0.528 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.8 | -41.2 | 174.7 | -73.9 | -174.7 | -14 | 0 | 0 | 111.8 | R259 L260 A266 F267 | R259-Q263 WeakPolarHBondContact O-CG 3.3Å; R259-Q263 PolarHBondContact O-N 2.93Å; L260-Q263 PolarHBondContact O-N 3.3Å; Q263-A266 PolarHBondContact O-N 2.91Å; Q263-F267 VanDerWaalsContact O-CB 3.29Å; Q263-F267 WeakPolarHBondContact O-CB 3.34Å; Q263-F267 PolarHBondContact O-N 3.41Å |
| 264 | Y | 45.9 | Very low | 45.7 | Very low | 147 Ų | 147 | 110.4 Ų | 110.4 | 58% | 0.576 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -64.2 | -40.7 | 175.2 | -178.4 | -97.9 | 0 | 0 | 0 | 111.7 | L260 Q261 F267 R268 | L260-Y264 VanDerWaalsContact O-CB 3.24Å; L260-Y264 WeakPolarHBondContact O-CB 3.27Å; L260-Y264 PolarHBondContact O-N 2.95Å; Q261-Y264 PolarHBondContact O-N 2.82Å; Y264-F267 PolarHBondContact O-N 2.97Å; Y264-R268 WeakPolarHBondContact O-CB 3.32Å; Y264-R268 PolarHBondContact O-N 3.5Å |
| 265 | R | 51.9 | Low | 46.3 | Very low | 146 Ų | 146 | 108 Ų | 108 | 55% | 0.551 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.9 | -47.3 | 173.7 | -79.9 | -173.2 | -167.2 | 177.9 | 5.9 | 111.9 | Q261 A262 F267 R268 E269 | Q261-R265 WeakPolarHBondContact O-CB 3.29Å; Q261-R265 WeakPolarHBondContact O-CG 3.2Å; Q261-R265 PolarHBondContact O-N 2.86Å; A262-R265 PolarHBondContact O-N 2.85Å; R265-F267 VanDerWaalsContact C-N 3.28Å; R265-F267 PolarHBondContact O-N 3.41Å; R265-R268 PolarHBondContact O-N 3.43Å; R265-E269 WeakPolarHBondContact O-CB 3.44Å; R265-E269 WeakPolarHBondContact O-CG 3.28Å; R265-E269 PolarHBondContact O-N 3.49Å |
| 266 | A | 49 | Very low | 46.9 | Very low | 57 Ų | 57 | 111.8 Ų | 111.8 | 47% | 0.471 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -61.5 | -39.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | A262 Q263 A270 | A262-A266 WeakPolarHBondContact O-CB 3.34Å; A262-A266 PolarHBondContact O-N 2.88Å; Q263-A266 PolarHBondContact O-N 2.91Å; A266-A270 VanDerWaalsContact O-CB 3.3Å; A266-A270 WeakPolarHBondContact O-CB 3.29Å; A266-A270 PolarHBondContact O-N 2.94Å |
| 267 | F | 46.1 | Very low | 47.5 | Very low | 134 Ų | 134 | 116.9 Ų | 116.9 | 59% | 0.588 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -67.2 | -42.8 | 175.2 | -174.3 | -96.9 | 0 | 0 | 0 | 111.9 | Q263 Y264 R265 A270 A271 | Q263-F267 VanDerWaalsContact O-CB 3.29Å; Q263-F267 WeakPolarHBondContact O-CB 3.34Å; Q263-F267 PolarHBondContact O-N 3.41Å; Y264-F267 PolarHBondContact O-N 2.97Å; R265-F267 VanDerWaalsContact C-N 3.28Å; R265-F267 PolarHBondContact O-N 3.41Å; F267-A270 PolarHBondContact O-N 2.98Å; F267-A271 VanDerWaalsContact O-CB 3.32Å; F267-A271 WeakPolarHBondContact O-CB 3.32Å; F267-A271 PolarHBondContact O-N 2.86Å |
| 268 | R | 49 | Very low | 47.7 | Very low | 137 Ų | 137 | 109.9 Ų | 109.9 | 52% | 0.517 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.2 | -44.9 | 176.4 | -179.1 | 175.7 | 175.2 | 156.6 | 2.6 | 111.5 | Y264 R265 A270 A271 E272 | Y264-R268 WeakPolarHBondContact O-CB 3.32Å; Y264-R268 PolarHBondContact O-N 3.5Å; R265-R268 PolarHBondContact O-N 3.43Å; R268-A270 VanDerWaalsContact C-N 3.34Å; R268-A270 PolarHBondContact O-N 2.95Å; R268-A271 PolarHBondContact O-N 3.32Å; R268-E272 HydrophobicContact CG-CG 4.38Å; R268-E272 WeakPolarHBondContact CG-OE1 3.44Å; R268-E272 IonicContact CZ-OE1 2.98Å; R268-E272 IonicContact NE-OE1 2.82Å; R268-E272 PolarHBondContact NE-OE1 2.85Å; R268-E272 IonicContact NH2-OE1 3.28Å; R268-E272 WeakPolarHBondContact O-CB 3.48Å; R268-E272 VanDerWaalsContact O-CG 3.32Å; R268-E272 WeakPolarHBondContact O-CG 3.27Å; R268-E272 PolarHBondContact O-N 2.91Å |
| 269 | E | 55.4 | Low | 48.2 | Very low | 132 Ų | 132 | 110.3 Ų | 110.3 | 62% | 0.617 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.4 | -41.3 | 175 | -76.3 | 174.4 | -166.9 | 0 | 0 | 111.4 | R265 F273 | R265-E269 WeakPolarHBondContact O-CB 3.44Å; R265-E269 WeakPolarHBondContact O-CG 3.28Å; R265-E269 PolarHBondContact O-N 3.49Å; E269-F273 VanDerWaalsContact O-CB 3.25Å; E269-F273 WeakPolarHBondContact O-CB 3.36Å; E269-F273 PolarHBondContact O-N 3.26Å |
| 270 | A | 48.8 | Very low | 48.6 | Very low | 62 Ų | 62 | 106.2 Ų | 106.2 | 51% | 0.512 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66 | -37.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | A266 F267 R268 G274 | A266-A270 VanDerWaalsContact O-CB 3.3Å; A266-A270 WeakPolarHBondContact O-CB 3.29Å; A266-A270 PolarHBondContact O-N 2.94Å; F267-A270 PolarHBondContact O-N 2.98Å; R268-A270 VanDerWaalsContact C-N 3.34Å; R268-A270 PolarHBondContact O-N 2.95Å; A270-G274 PolarHBondContact O-N 2.99Å |
| 271 | A | 47.2 | Very low | 48.7 | Very low | 50 Ų | 50 | 102.9 Ų | 102.9 | 41% | 0.413 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -68.5 | -45.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | F267 R268 F273 G274 E275 | F267-A271 VanDerWaalsContact O-CB 3.32Å; F267-A271 WeakPolarHBondContact O-CB 3.32Å; F267-A271 PolarHBondContact O-N 2.86Å; R268-A271 PolarHBondContact O-N 3.32Å; A271-F273 VanDerWaalsContact C-N 3.34Å; A271-F273 PolarHBondContact O-N 3.01Å; A271-G274 PolarHBondContact O-N 3.43Å; A271-E275 WeakPolarHBondContact O-CB 3.39Å; A271-E275 PolarHBondContact O-N 2.83Å |
| 272 | E | 50.5 | Low | 48.4 | Very low | 69 Ų | 69 | 100.4 Ų | 100.4 | 32% | 0.322 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.4 | -38.4 | 176.3 | -72.7 | 176.3 | -167 | 0 | 0 | 111.4 | R268 R276 | R268-E272 HydrophobicContact CG-CG 4.38Å; R268-E272 WeakPolarHBondContact CG-OE1 3.44Å; R268-E272 IonicContact CZ-OE1 2.98Å; R268-E272 IonicContact NE-OE1 2.82Å; R268-E272 PolarHBondContact NE-OE1 2.85Å; R268-E272 IonicContact NH2-OE1 3.28Å; R268-E272 WeakPolarHBondContact O-CB 3.48Å; R268-E272 VanDerWaalsContact O-CG 3.32Å; R268-E272 WeakPolarHBondContact O-CG 3.27Å; R268-E272 PolarHBondContact O-N 2.91Å; E272-R276 WeakPolarHBondContact O-CG 3.43Å; E272-R276 PolarHBondContact O-N 3.45Å; E272-R276 VanDerWaalsContact O-N 3.15Å |
| 273 | F | 50.7 | Low | 48.4 | Very low | 143 Ų | 143 | 107.3 Ų | 107.3 | 63% | 0.627 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -69.2 | -40.5 | 174.4 | -163 | -90.1 | 0 | 0 | 0 | 111.6 | E269 A271 R276 W277 | E269-F273 VanDerWaalsContact O-CB 3.25Å; E269-F273 WeakPolarHBondContact O-CB 3.36Å; E269-F273 PolarHBondContact O-N 3.26Å; A271-F273 VanDerWaalsContact C-N 3.34Å; A271-F273 PolarHBondContact O-N 3.01Å; F273-R276 PolarHBondContact O-N 2.93Å; F273-W277 WeakPolarHBondContact O-CB 3.42Å; F273-W277 PolarHBondContact O-N 3.25Å |
| 274 | G | 45.9 | Very low | 48.5 | Very low | 37 Ų | 37 | 106.6 Ų | 106.6 | 38% | 0.381 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.8 | -40.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | A270 A271 W277 L278 | A270-G274 PolarHBondContact O-N 2.99Å; A271-G274 PolarHBondContact O-N 3.43Å; G274-W277 PolarHBondContact O-N 2.88Å; G274-L278 VanDerWaalsContact O-CB 3.26Å; G274-L278 WeakPolarHBondContact O-CB 3.25Å; G274-L278 PolarHBondContact O-N 2.8Å |
| 275 | E | 47.4 | Very low | 48.5 | Very low | 124 Ų | 124 | 102.9 Ų | 102.9 | 58% | 0.579 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.1 | -47.2 | 175.6 | -173.7 | -174.2 | 167.4 | 0 | 0 | 110.9 | A271 W277 L278 H279 | A271-E275 WeakPolarHBondContact O-CB 3.39Å; A271-E275 PolarHBondContact O-N 2.83Å; E275-W277 VanDerWaalsContact C-N 3.35Å; E275-W277 PolarHBondContact O-N 3.38Å; E275-L278 PolarHBondContact O-N 3.42Å; E275-H279 WeakPolarHBondContact O-CB 3.3Å; E275-H279 PolarHBondContact O-N 2.97Å |
| 276 | R | 50.2 | Low | 48.2 | Very low | 168 Ų | 168 | 97.5 Ų | 97.5 | 63% | 0.634 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -60.7 | -43.9 | 176 | -70.6 | 177 | -162.3 | 162.6 | 9.3 | 112 | E272 F273 H279 E280 | E272-R276 WeakPolarHBondContact O-CG 3.43Å; E272-R276 PolarHBondContact O-N 3.45Å; E272-R276 VanDerWaalsContact O-N 3.15Å; F273-R276 PolarHBondContact O-N 2.93Å; R276-H279 PolarHBondContact O-N 2.97Å; R276-E280 WeakPolarHBondContact O-CB 3.42Å; R276-E280 PolarHBondContact O-N 3.49Å |
| 277 | W | 49.6 | Very low | 48.1 | Very low | 176 Ų | 176 | 101.4 Ų | 101.4 | 67% | 0.667 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -67.4 | -38.1 | 179 | -162.7 | 80.5 | 0 | 0 | 0 | 111.9 | F273 G274 E275 E280 A281 | F273-W277 WeakPolarHBondContact O-CB 3.42Å; F273-W277 PolarHBondContact O-N 3.25Å; G274-W277 PolarHBondContact O-N 2.88Å; E275-W277 VanDerWaalsContact C-N 3.35Å; E275-W277 PolarHBondContact O-N 3.38Å; W277-E280 PolarHBondContact O-N 3.48Å; W277-A281 VanDerWaalsContact O-CB 3.25Å; W277-A281 WeakPolarHBondContact O-CB 3.11Å; W277-A281 PolarHBondContact O-N 3.09Å |
| 278 | L | 47.5 | Very low | 48.1 | Very low | 63 Ų | 63 | 103.2 Ų | 103.2 | 33% | 0.33 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.4 | -44.5 | 174.1 | -166.4 | 100.2 | 0 | 0 | 0 | 110.8 | G274 E275 E280 A281 I282 T294 | G274-L278 VanDerWaalsContact O-CB 3.26Å; G274-L278 WeakPolarHBondContact O-CB 3.25Å; G274-L278 PolarHBondContact O-N 2.8Å; E275-L278 PolarHBondContact O-N 3.42Å; L278-E280 VanDerWaalsContact C-N 3.32Å; L278-E280 PolarHBondContact O-N 3.4Å; L278-A281 PolarHBondContact O-N 2.73Å; L278-I282 HydrophobicContact CD2-CD1 3.72Å; L278-I282 HydrophobicContact CG-CD1 3.91Å; L278-I282 HydrophobicContact CG-CG1 4.5Å; L278-I282 WeakPolarHBondContact O-CB 3.47Å; L278-I282 WeakPolarHBondContact O-CD1 3.44Å; L278-I282 WeakPolarHBondContact O-CG1 3.3Å; L278-I282 PolarHBondContact O-N 2.95Å; L278-T294 HydrophobicContact CD1-CG2 3.8Å |
| 279 | H | 53.2 | Low | 47.9 | Very low | 127 Ų | 127 | 103.1 Ų | 103.1 | 59% | 0.588 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.7 | -43.1 | 176.8 | -121.9 | -67.3 | 0 | 0 | 0 | 111.7 | E275 R276 I282 R283 | E275-H279 WeakPolarHBondContact O-CB 3.3Å; E275-H279 PolarHBondContact O-N 2.97Å; R276-H279 PolarHBondContact O-N 2.97Å; H279-I282 PolarHBondContact O-N 3.3Å; H279-R283 WeakPolarHBondContact O-CB 3.41Å; H279-R283 PolarHBondContact O-N 2.86Å |
| 280 | E | 50 | Low | 47.4 | Very low | 109 Ų | 109 | 97.3 Ų | 97.3 | 51% | 0.509 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67.1 | -41.9 | 176.9 | -164.3 | 62 | -155.3 | 0 | 0 | 111.5 | R276 W277 L278 I282 R283 T284 | R276-E280 WeakPolarHBondContact O-CB 3.42Å; R276-E280 PolarHBondContact O-N 3.49Å; W277-E280 PolarHBondContact O-N 3.48Å; L278-E280 VanDerWaalsContact C-N 3.32Å; L278-E280 PolarHBondContact O-N 3.4Å; E280-I282 PolarHBondContact O-N 3.18Å; E280-R283 WeakPolarHBondContact O-CB 3.43Å; E280-R283 PolarHBondContact O-N 3.45Å; E280-T284 WeakPolarHBondContact O-CG2 3.47Å; E280-T284 PolarHBondContact O-N 2.96Å; E280-T284 PolarHBondContact O-OG1 3.27Å |
| 281 | A | 39.9 | Very low | 47.4 | Very low | 16 Ų | 16 | 98 Ų | 98 | 13% | 0.132 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -65.1 | -40 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | W277 L278 R283 T284 C285 T290 | W277-A281 VanDerWaalsContact O-CB 3.25Å; W277-A281 WeakPolarHBondContact O-CB 3.11Å; W277-A281 PolarHBondContact O-N 3.09Å; L278-A281 PolarHBondContact O-N 2.73Å; A281-R283 PolarHBondContact O-N 3.43Å; A281-T284 WeakPolarHBondContact CA-OG1 3.32Å; A281-T284 PolarHBondContact O-N 3.22Å; A281-T284 PolarHBondContact O-OG1 2.86Å; A281-C285 PolarHBondContact O-N 2.9Å; A281-T290 HydrophobicContact CB-CG2 3.51Å; A281-T290 WeakPolarHBondContact O-CG2 3.12Å |
| 282 | I | 44 | Very low | 47.3 | Very low | 38 Ų | 38 | 99.4 Ų | 99.4 | 20% | 0.195 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -63 | -38 | 176.7 | -73.5 | 162.8 | 0 | 0 | 0 | 109.4 | L278 H279 E280 G286 F287 T290 | L278-I282 HydrophobicContact CD2-CD1 3.72Å; L278-I282 HydrophobicContact CG-CD1 3.91Å; L278-I282 HydrophobicContact CG-CG1 4.5Å; L278-I282 WeakPolarHBondContact O-CB 3.47Å; L278-I282 WeakPolarHBondContact O-CD1 3.44Å; L278-I282 WeakPolarHBondContact O-CG1 3.3Å; L278-I282 PolarHBondContact O-N 2.95Å; H279-I282 PolarHBondContact O-N 3.3Å; E280-I282 PolarHBondContact O-N 3.18Å; I282-G286 CarbonylContact O-C 3.54Å; I282-G286 WeakPolarHBondContact O-CA 3.37Å; I282-G286 PolarHBondContact O-N 3.22Å; I282-F287 HydrophobicContact CD1-CD2 3.98Å; I282-F287 HydrophobicContact CD1-CE2 4.28Å; I282-F287 HydrophobicContact CG1-CD2 4.21Å; I282-F287 HydrophobicContact CG2-CB 4.14Å; I282-F287 HydrophobicContact CG2-CD2 3.97Å; I282-T290 HydrophobicContact CG1-CG2 4.28Å; I282-T290 VanDerWaalsContact CG1-OG1 3.24Å; I282-T290 WeakPolarHBondContact CG1-OG1 3.31Å |
| 283 | R | 49 | Very low | 47.1 | Very low | 205 Ų | 205 | 99 Ų | 99 | 77% | 0.774 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.3 | -37.9 | 176.9 | -173.1 | -178.8 | -179.9 | 133.7 | 3.5 | 112.4 | H279 E280 A281 | H279-R283 WeakPolarHBondContact O-CB 3.41Å; H279-R283 PolarHBondContact O-N 2.86Å; E280-R283 WeakPolarHBondContact O-CB 3.43Å; E280-R283 PolarHBondContact O-N 3.45Å; A281-R283 PolarHBondContact O-N 3.43Å |
| 284 | T | 48 | Very low | 47.3 | Very low | 98 Ų | 98 | 95 Ų | 95 | 60% | 0.601 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -88.8 | -38.4 | -175.6 | 53.7 | 0 | 0 | 0 | 0 | 114.2 | E280 A281 | E280-T284 WeakPolarHBondContact O-CG2 3.47Å; E280-T284 PolarHBondContact O-N 2.96Å; E280-T284 PolarHBondContact O-OG1 3.27Å; A281-T284 WeakPolarHBondContact CA-OG1 3.32Å; A281-T284 PolarHBondContact O-N 3.22Å; A281-T284 PolarHBondContact O-OG1 2.86Å |
| 285 | C | 46.1 | Very low | 47.3 | Very low | 70 Ų | 70 | 95.8 Ų | 95.8 | 47% | 0.473 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -110.2 | -5 | -174.6 | -62.8 | 0 | 0 | 0 | 0 | 113.5 | A281 T290 | A281-C285 PolarHBondContact O-N 2.9Å; C285-T290 HydrophobicContact CB-CG2 4.2Å |
| 286 | G | 44.9 | Very low | 47.4 | Very low | 33 Ų | 33 | 94.3 Ų | 94.3 | 34% | 0.34 | 47% | 0.474 | S | S | . | . | trans | 82.3 | 152.3 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | I282 K288 E289 T290 | I282-G286 CarbonylContact O-C 3.54Å; I282-G286 WeakPolarHBondContact O-CA 3.37Å; I282-G286 PolarHBondContact O-N 3.22Å; G286-K288 VanDerWaalsContact C-N 3.35Å; G286-K288 PolarHBondContact O-N 3.43Å; G286-E289 PolarHBondContact O-N 2.94Å; G286-T290 PolarHBondContact O-N 2.86Å; G286-T290 PolarHBondContact O-OG1 3.46Å | ||
| 287 | F | 46.4 | Very low | 47.2 | Very low | 138 Ų | 138 | 87.7 Ų | 87.7 | 61% | 0.605 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -61.2 | -38 | -171.2 | -172.4 | -102.4 | 0 | 0 | 0 | 113.9 | I282 T290 I291 | I282-F287 HydrophobicContact CD1-CD2 3.98Å; I282-F287 HydrophobicContact CD1-CE2 4.28Å; I282-F287 HydrophobicContact CG1-CD2 4.21Å; I282-F287 HydrophobicContact CG2-CB 4.14Å; I282-F287 HydrophobicContact CG2-CD2 3.97Å; F287-T290 WeakPolarHBondContact CA-OG1 3.31Å; F287-T290 PolarHBondContact O-OG1 3.17Å; F287-T290 VanDerWaalsContact O-OG1 3.08Å; F287-I291 HydrophobicContact CD1-CD1 3.71Å; F287-I291 HydrophobicContact CD2-CD1 4.26Å; F287-I291 HydrophobicContact CE1-CD1 3.25Å; F287-I291 HydrophobicContact CE2-CD1 3.86Å; F287-I291 HydrophobicContact CG-CD1 4.21Å; F287-I291 HydrophobicContact CZ-CD1 3.36Å; F287-I291 WeakPolarHBondContact O-CG1 3.27Å; F287-I291 PolarHBondContact O-N 2.98Å |
| 288 | K | 45.6 | Very low | 47.4 | Very low | 173 Ų | 173 | 81.5 Ų | 81.5 | 75% | 0.752 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -70.6 | -42.9 | -176.5 | -170.3 | 179.3 | 176.5 | -175.1 | 0 | 111.9 | G286 V292 | G286-K288 VanDerWaalsContact C-N 3.35Å; G286-K288 PolarHBondContact O-N 3.43Å; K288-V292 VanDerWaalsContact O-CG2 3.3Å; K288-V292 WeakPolarHBondContact O-CG2 3.28Å; K288-V292 PolarHBondContact O-N 3.46Å |
| 289 | E | 44.8 | Very low | 47.3 | Very low | 134 Ų | 134 | 82.5 Ų | 82.5 | 63% | 0.626 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -71.5 | -38.6 | -176.7 | -63.2 | -174.5 | 175.9 | 0 | 0 | 111.5 | G286 V292 A293 | G286-E289 PolarHBondContact O-N 2.94Å; E289-V292 PolarHBondContact O-N 2.93Å; E289-A293 WeakPolarHBondContact O-CB 3.32Å; E289-A293 PolarHBondContact O-N 3.49Å |
| 290 | T | 45.9 | Very low | 46.9 | Very low | 11 Ų | 11 | 83.1 Ų | 83.1 | 7% | 0.067 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -66.9 | -42.5 | 179 | 37.6 | 0 | 0 | 0 | 0 | 114 | A281 I282 C285 G286 F287 V292 A293 T294 | A281-T290 HydrophobicContact CB-CG2 3.51Å; A281-T290 WeakPolarHBondContact O-CG2 3.12Å; I282-T290 HydrophobicContact CG1-CG2 4.28Å; I282-T290 VanDerWaalsContact CG1-OG1 3.24Å; I282-T290 WeakPolarHBondContact CG1-OG1 3.31Å; C285-T290 HydrophobicContact CB-CG2 4.2Å; G286-T290 PolarHBondContact O-N 2.86Å; G286-T290 PolarHBondContact O-OG1 3.46Å; F287-T290 WeakPolarHBondContact CA-OG1 3.31Å; F287-T290 PolarHBondContact O-OG1 3.17Å; F287-T290 VanDerWaalsContact O-OG1 3.08Å; T290-V292 VanDerWaalsContact C-N 3.33Å; T290-A293 PolarHBondContact O-N 3.13Å; T290-T294 PolarHBondContact O-N 2.83Å; T290-T294 PolarHBondContact O-OG1 3.37Å |
| 291 | I | 49.2 | Very low | 46.9 | Very low | 77 Ų | 77 | 84 Ų | 84 | 40% | 0.395 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -63.4 | -42.2 | 175.8 | -69.8 | 175.4 | 0 | 0 | 0 | 110.7 | F287 T294 A295 | F287-I291 HydrophobicContact CD1-CD1 3.71Å; F287-I291 HydrophobicContact CD2-CD1 4.26Å; F287-I291 HydrophobicContact CE1-CD1 3.25Å; F287-I291 HydrophobicContact CE2-CD1 3.86Å; F287-I291 HydrophobicContact CG-CD1 4.21Å; F287-I291 HydrophobicContact CZ-CD1 3.36Å; F287-I291 WeakPolarHBondContact O-CG1 3.27Å; F287-I291 PolarHBondContact O-N 2.98Å; I291-T294 WeakPolarHBondContact CA-OG1 3.34Å; I291-T294 PolarHBondContact O-N 3.5Å; I291-T294 PolarHBondContact O-OG1 2.97Å; I291-A295 VanDerWaalsContact O-CB 3.27Å; I291-A295 WeakPolarHBondContact O-CB 3.38Å; I291-A295 PolarHBondContact O-N 3.46Å |
| 292 | V | 44.2 | Very low | 47.3 | Very low | 78 Ų | 78 | 86.8 Ų | 86.8 | 47% | 0.473 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.5 | -44.4 | 176.3 | 173 | 0 | 0 | 0 | 0 | 110.3 | K288 E289 T290 A295 I296 | K288-V292 VanDerWaalsContact O-CG2 3.3Å; K288-V292 WeakPolarHBondContact O-CG2 3.28Å; K288-V292 PolarHBondContact O-N 3.46Å; E289-V292 PolarHBondContact O-N 2.93Å; T290-V292 VanDerWaalsContact C-N 3.33Å; V292-A295 PolarHBondContact O-N 3.42Å; V292-I296 HydrophobicContact CG1-CD1 3.63Å; V292-I296 HydrophobicContact CG1-CG1 4.35Å; V292-I296 WeakPolarHBondContact O-CB 3.48Å; V292-I296 WeakPolarHBondContact O-CG1 3.34Å; V292-I296 PolarHBondContact O-N 2.86Å |
| 293 | A | 47.2 | Very low | 47.5 | Very low | 61 Ų | 61 | 88.9 Ų | 88.9 | 50% | 0.504 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.9 | -41.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | E289 T290 I296 G297 | E289-A293 WeakPolarHBondContact O-CB 3.32Å; E289-A293 PolarHBondContact O-N 3.49Å; T290-A293 PolarHBondContact O-N 3.13Å; A293-I296 PolarHBondContact O-N 2.91Å; A293-G297 PolarHBondContact O-N 2.83Å |
| 294 | T | 53.8 | Low | 47.3 | Very low | 60 Ų | 60 | 80.6 Ų | 80.6 | 37% | 0.368 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -68.2 | -38.3 | 175.6 | 25 | 0 | 0 | 0 | 0 | 112 | L278 T290 I291 G297 A298 | L278-T294 HydrophobicContact CD1-CG2 3.8Å; T290-T294 PolarHBondContact O-N 2.83Å; T290-T294 PolarHBondContact O-OG1 3.37Å; I291-T294 WeakPolarHBondContact CA-OG1 3.34Å; I291-T294 PolarHBondContact O-N 3.5Å; I291-T294 PolarHBondContact O-OG1 2.97Å; T294-G297 PolarHBondContact O-N 3.47Å; T294-A298 VanDerWaalsContact O-CB 3.3Å; T294-A298 WeakPolarHBondContact O-CB 3.19Å; T294-A298 PolarHBondContact O-N 3.18Å |
| 295 | A | 47 | Very low | 47.5 | Very low | 53 Ų | 53 | 78.6 Ų | 78.6 | 44% | 0.438 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.6 | -42.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | I291 V292 A298 T299 | I291-A295 VanDerWaalsContact O-CB 3.27Å; I291-A295 WeakPolarHBondContact O-CB 3.38Å; I291-A295 PolarHBondContact O-N 3.46Å; V292-A295 PolarHBondContact O-N 3.42Å; A295-A298 PolarHBondContact O-N 2.83Å; A295-T299 WeakPolarHBondContact O-CB 3.32Å; A295-T299 WeakPolarHBondContact O-CG2 3.45Å; A295-T299 PolarHBondContact O-N 3.39Å; A295-T299 PolarHBondContact O-OG1 2.9Å |
| 296 | I | 49.2 | Very low | 47.4 | Very low | 92 Ų | 92 | 79 Ų | 79 | 47% | 0.472 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.6 | -43.2 | 174.2 | -67.4 | 166.9 | 0 | 0 | 0 | 110.5 | V292 A293 T299 M300 | V292-I296 HydrophobicContact CG1-CD1 3.63Å; V292-I296 HydrophobicContact CG1-CG1 4.35Å; V292-I296 WeakPolarHBondContact O-CB 3.48Å; V292-I296 WeakPolarHBondContact O-CG1 3.34Å; V292-I296 PolarHBondContact O-N 2.86Å; A293-I296 PolarHBondContact O-N 2.91Å; I296-T299 VanDerWaalsContact CA-OG1 3.32Å; I296-T299 WeakPolarHBondContact CA-OG1 3.46Å; I296-T299 PolarHBondContact O-N 3.31Å; I296-T299 PolarHBondContact O-OG1 3.5Å; I296-M300 WeakPolarHBondContact O-CB 3.2Å; I296-M300 PolarHBondContact O-N 3.24Å |
| 297 | G | 46.9 | Very low | 47.6 | Very low | 29 Ų | 29 | 82.7 Ų | 82.7 | 30% | 0.299 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62 | -46.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | A293 T294 T299 M300 I301 | A293-G297 PolarHBondContact O-N 2.83Å; T294-G297 PolarHBondContact O-N 3.47Å; G297-T299 PolarHBondContact O-N 2.75Å; G297-M300 PolarHBondContact O-N 2.82Å; G297-I301 VanDerWaalsContact O-CG1 3.31Å; G297-I301 WeakPolarHBondContact O-CG1 3.46Å; G297-I301 PolarHBondContact O-N 2.98Å |
| 298 | A | 52.1 | Low | 47.6 | Very low | 47 Ų | 47 | 80.9 Ų | 80.9 | 39% | 0.388 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.8 | -42.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | T294 A295 I301 L302 | T294-A298 VanDerWaalsContact O-CB 3.3Å; T294-A298 WeakPolarHBondContact O-CB 3.19Å; T294-A298 PolarHBondContact O-N 3.18Å; A295-A298 PolarHBondContact O-N 2.83Å; A298-I301 PolarHBondContact O-N 2.61Å; A298-L302 WeakPolarHBondContact O-CB 3.28Å; A298-L302 PolarHBondContact O-N 2.89Å |
| 299 | T | 46.8 | Very low | 47.8 | Very low | 83 Ų | 83 | 76.5 Ų | 76.5 | 51% | 0.509 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -68 | -38.3 | 175.7 | 47.1 | 0 | 0 | 0 | 0 | 112.2 | A295 I296 G297 L302 V303 | A295-T299 WeakPolarHBondContact O-CB 3.32Å; A295-T299 WeakPolarHBondContact O-CG2 3.45Å; A295-T299 PolarHBondContact O-N 3.39Å; A295-T299 PolarHBondContact O-OG1 2.9Å; I296-T299 VanDerWaalsContact CA-OG1 3.32Å; I296-T299 WeakPolarHBondContact CA-OG1 3.46Å; I296-T299 PolarHBondContact O-N 3.31Å; I296-T299 PolarHBondContact O-OG1 3.5Å; G297-T299 PolarHBondContact O-N 2.75Å; T299-L302 WeakPolarHBondContact O-CB 3.3Å; T299-L302 PolarHBondContact O-N 3.48Å; T299-V303 WeakPolarHBondContact O-CG2 3.31Å; T299-V303 PolarHBondContact O-N 3.33Å |
| 300 | M | 44.9 | Very low | 47.8 | Very low | 141 Ų | 141 | 73.1 Ų | 73.1 | 70% | 0.695 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -63.1 | -41.4 | 173 | -84.9 | -176 | 94.1 | 0 | 0 | 112.5 | I296 G297 L302 V303 G304 | I296-M300 WeakPolarHBondContact O-CB 3.2Å; I296-M300 PolarHBondContact O-N 3.24Å; G297-M300 PolarHBondContact O-N 2.82Å; M300-L302 VanDerWaalsContact C-N 3.3Å; M300-L302 PolarHBondContact O-N 3.18Å; M300-V303 PolarHBondContact O-N 2.82Å; M300-G304 PolarHBondContact O-N 2.67Å |
| 301 | I | 48.3 | Very low | 47.3 | Very low | 126 Ų | 126 | 78.9 Ų | 78.9 | 65% | 0.646 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -64.1 | -39.5 | 175.2 | -67.1 | 166.4 | 0 | 0 | 0 | 110.4 | G297 A298 G304 S305 | G297-I301 VanDerWaalsContact O-CG1 3.31Å; G297-I301 WeakPolarHBondContact O-CG1 3.46Å; G297-I301 PolarHBondContact O-N 2.98Å; A298-I301 PolarHBondContact O-N 2.61Å; I301-G304 PolarHBondContact O-N 2.83Å; I301-S305 WeakPolarHBondContact O-CB 3.33Å; I301-S305 PolarHBondContact O-N 3.48Å; I301-S305 PolarHBondContact O-OG 3.29Å |
| 302 | L | 48.2 | Very low | 46.9 | Very low | 76 Ų | 76 | 79.3 Ų | 79.3 | 40% | 0.398 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -64.4 | -44.6 | 176.2 | -165.2 | 121.5 | 0 | 0 | 0 | 111.7 | I221 A298 T299 M300 S305 V306 | I221-L302 HydrophobicContact CD1-CD1 3.93Å; A298-L302 WeakPolarHBondContact O-CB 3.28Å; A298-L302 PolarHBondContact O-N 2.89Å; T299-L302 WeakPolarHBondContact O-CB 3.3Å; T299-L302 PolarHBondContact O-N 3.48Å; M300-L302 VanDerWaalsContact C-N 3.3Å; M300-L302 PolarHBondContact O-N 3.18Å; L302-S305 WeakPolarHBondContact CA-OG 3.33Å; L302-S305 PolarHBondContact O-N 2.96Å; L302-S305 PolarHBondContact O-OG 2.86Å; L302-V306 VanDerWaalsContact O-CG2 3.27Å; L302-V306 WeakPolarHBondContact O-CG2 3.43Å; L302-V306 PolarHBondContact O-N 3.32Å |
| 303 | V | 49.5 | Very low | 46.7 | Very low | 82 Ų | 82 | 80.8 Ų | 80.8 | 50% | 0.497 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -64.4 | -42.3 | 175.1 | 173.6 | 0 | 0 | 0 | 0 | 110.9 | T299 M300 S305 V306 L307 | T299-V303 WeakPolarHBondContact O-CG2 3.31Å; T299-V303 PolarHBondContact O-N 3.33Å; M300-V303 PolarHBondContact O-N 2.82Å; V303-S305 PolarHBondContact O-N 3.11Å; V303-V306 PolarHBondContact O-N 3.34Å; V303-L307 HydrophobicContact CG1-CD1 3.92Å; V303-L307 HydrophobicContact CG1-CG 4.3Å; V303-L307 WeakPolarHBondContact O-CB 3.44Å; V303-L307 VanDerWaalsContact O-CG 3.3Å; V303-L307 WeakPolarHBondContact O-CG 3.48Å; V303-L307 PolarHBondContact O-N 3.48Å |
| 304 | G | 44.9 | Very low | 46.5 | Very low | 30 Ų | 30 | 82.4 Ų | 82.4 | 31% | 0.309 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61 | -44.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | M300 I301 L307 D308 | M300-G304 PolarHBondContact O-N 2.67Å; I301-G304 PolarHBondContact O-N 2.83Å; G304-L307 PolarHBondContact O-N 2.97Å; G304-D308 WeakPolarHBondContact O-CB 3.3Å; G304-D308 PolarHBondContact O-N 3.4Å |
| 305 | S | 50.7 | Low | 45.9 | Very low | 57 Ų | 57 | 83.8 Ų | 83.8 | 40% | 0.399 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -68.2 | -35.9 | 176.6 | 49 | 0 | 0 | 0 | 0 | 112.6 | I301 L302 V303 T309 | I301-S305 WeakPolarHBondContact O-CB 3.33Å; I301-S305 PolarHBondContact O-N 3.48Å; I301-S305 PolarHBondContact O-OG 3.29Å; L302-S305 WeakPolarHBondContact CA-OG 3.33Å; L302-S305 PolarHBondContact O-N 2.96Å; L302-S305 PolarHBondContact O-OG 2.86Å; V303-S305 PolarHBondContact O-N 3.11Å; S305-T309 WeakPolarHBondContact O-CB 3.36Å; S305-T309 WeakPolarHBondContact O-CG2 3.46Å; S305-T309 PolarHBondContact O-N 3.46Å; S305-T309 PolarHBondContact O-OG1 3.07Å |
| 306 | V | 45.4 | Very low | 45.5 | Very low | 79 Ų | 79 | 82.9 Ų | 82.9 | 48% | 0.479 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.2 | -42.9 | 170 | 172.7 | 0 | 0 | 0 | 0 | 111 | L302 V303 T309 T310 | L302-V306 VanDerWaalsContact O-CG2 3.27Å; L302-V306 WeakPolarHBondContact O-CG2 3.43Å; L302-V306 PolarHBondContact O-N 3.32Å; V303-V306 PolarHBondContact O-N 3.34Å; V306-T309 VanDerWaalsContact CA-OG1 3.3Å; V306-T309 WeakPolarHBondContact CA-OG1 3.43Å; V306-T309 PolarHBondContact O-N 3.17Å; V306-T309 PolarHBondContact O-OG1 3.2Å; V306-T310 VanDerWaalsContact O-CB 3.31Å; V306-T310 WeakPolarHBondContact O-CB 3.25Å; V306-T310 PolarHBondContact O-N 3.5Å; V306-T310 PolarHBondContact O-OG1 3.42Å |
| 307 | L | 48.2 | Very low | 45 | Very low | 109 Ų | 109 | 82.8 Ų | 82.8 | 57% | 0.571 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -66.7 | -42.3 | 178.1 | -73.4 | 172.8 | 0 | 0 | 0 | 112.3 | V303 G304 T310 K311 | V303-L307 HydrophobicContact CG1-CD1 3.92Å; V303-L307 HydrophobicContact CG1-CG 4.3Å; V303-L307 WeakPolarHBondContact O-CB 3.44Å; V303-L307 VanDerWaalsContact O-CG 3.3Å; V303-L307 WeakPolarHBondContact O-CG 3.48Å; V303-L307 PolarHBondContact O-N 3.48Å; G304-L307 PolarHBondContact O-N 2.97Å; L307-T310 PolarHBondContact O-N 2.81Å; L307-K311 WeakPolarHBondContact O-CB 3.49Å; L307-K311 PolarHBondContact O-N 3.4Å |
| 308 | D | 47.8 | Very low | 44.6 | Very low | 101 Ų | 101 | 86.4 Ų | 86.4 | 54% | 0.54 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.4 | -42.2 | 176.6 | -88.5 | -18.1 | 0 | 0 | 0 | 111.4 | G304 T310 K311 L312 | G304-D308 WeakPolarHBondContact O-CB 3.3Å; G304-D308 PolarHBondContact O-N 3.4Å; D308-T310 VanDerWaalsContact C-N 3.32Å; D308-T310 PolarHBondContact O-N 2.76Å; D308-K311 PolarHBondContact O-N 2.84Å; D308-L312 WeakPolarHBondContact O-CB 3.35Å; D308-L312 PolarHBondContact O-N 3.32Å |
| 309 | T | 48.7 | Very low | 43.9 | Very low | 80 Ų | 80 | 92.8 Ų | 92.8 | 49% | 0.491 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.6 | -38 | 173.8 | 51.8 | 0 | 0 | 0 | 0 | 111.4 | S305 V306 L312 L313 | S305-T309 WeakPolarHBondContact O-CB 3.36Å; S305-T309 WeakPolarHBondContact O-CG2 3.46Å; S305-T309 PolarHBondContact O-N 3.46Å; S305-T309 PolarHBondContact O-OG1 3.07Å; V306-T309 VanDerWaalsContact CA-OG1 3.3Å; V306-T309 WeakPolarHBondContact CA-OG1 3.43Å; V306-T309 PolarHBondContact O-N 3.17Å; V306-T309 PolarHBondContact O-OG1 3.2Å; T309-L312 PolarHBondContact O-N 2.8Å; T309-L313 VanDerWaalsContact O-CB 3.26Å; T309-L313 WeakPolarHBondContact O-CB 3.47Å; T309-L313 PolarHBondContact O-N 3.39Å |
| 310 | T | 45.5 | Very low | 43.3 | Very low | 63 Ų | 63 | 94 Ų | 94 | 39% | 0.387 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.8 | -42.6 | 174.9 | -51 | 0 | 0 | 0 | 0 | 111.2 | V306 L307 D308 L313 I314 | V306-T310 VanDerWaalsContact O-CB 3.31Å; V306-T310 WeakPolarHBondContact O-CB 3.25Å; V306-T310 PolarHBondContact O-N 3.5Å; V306-T310 PolarHBondContact O-OG1 3.42Å; L307-T310 PolarHBondContact O-N 2.81Å; D308-T310 VanDerWaalsContact C-N 3.32Å; D308-T310 PolarHBondContact O-N 2.76Å; T310-L313 PolarHBondContact O-N 2.83Å; T310-I314 HydrophobicContact CG2-CD1 4.17Å; T310-I314 VanDerWaalsContact O-CG1 3.3Å; T310-I314 WeakPolarHBondContact O-CG1 3.35Å; T310-I314 PolarHBondContact O-N 3.39Å |
| 311 | K | 34.2 | Very low | 43 | Very low | 133 Ų | 133 | 91.4 Ų | 91.4 | 58% | 0.578 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.6 | -42.9 | 175.7 | -172.6 | 180 | 178.5 | -178 | 0 | 111.3 | L307 D308 L313 I314 I315 | L307-K311 WeakPolarHBondContact O-CB 3.49Å; L307-K311 PolarHBondContact O-N 3.4Å; D308-K311 PolarHBondContact O-N 2.84Å; K311-L313 VanDerWaalsContact C-N 3.32Å; K311-L313 PolarHBondContact O-N 2.91Å; K311-I314 PolarHBondContact O-N 3.38Å; K311-I315 HydrophobicContact CG-CD1 4.07Å; K311-I315 WeakPolarHBondContact O-CB 3.38Å; K311-I315 VanDerWaalsContact O-CG1 3.25Å; K311-I315 WeakPolarHBondContact O-CG1 3.26Å; K311-I315 PolarHBondContact O-N 2.91Å |
| 312 | L | 41.8 | Very low | 42.2 | Very low | 85 Ų | 85 | 93.8 Ų | 93.8 | 45% | 0.445 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.6 | -37.6 | 173.2 | -104.1 | 115.1 | 0 | 0 | 0 | 112 | M236 D308 T309 I315 G316 | M236-L312 HydrophobicContact CE-CD2 3.95Å; D308-L312 WeakPolarHBondContact O-CB 3.35Å; D308-L312 PolarHBondContact O-N 3.32Å; T309-L312 PolarHBondContact O-N 2.8Å; L312-I315 PolarHBondContact O-N 2.8Å; L312-G316 PolarHBondContact O-N 3.41Å |
| 313 | L | 39.9 | Very low | 41.8 | Very low | 110 Ų | 110 | 95 Ų | 95 | 58% | 0.576 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -69.2 | -38.4 | 177.5 | -163.6 | 123.8 | 0 | 0 | 0 | 111.4 | T309 T310 K311 G316 N317 | T309-L313 VanDerWaalsContact O-CB 3.26Å; T309-L313 WeakPolarHBondContact O-CB 3.47Å; T309-L313 PolarHBondContact O-N 3.39Å; T310-L313 PolarHBondContact O-N 2.83Å; K311-L313 VanDerWaalsContact C-N 3.32Å; K311-L313 PolarHBondContact O-N 2.91Å; L313-G316 PolarHBondContact O-N 3.07Å; L313-N317 WeakPolarHBondContact O-CB 3.3Å; L313-N317 PolarHBondContact O-N 2.96Å |
| 314 | I | 42.1 | Very low | 41.5 | Very low | 95 Ų | 95 | 94.8 Ų | 94.8 | 49% | 0.487 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.6 | -46.1 | 172.4 | -69.1 | 166.6 | 0 | 0 | 0 | 110.3 | T310 K311 G316 N317 L318 | T310-I314 HydrophobicContact CG2-CD1 4.17Å; T310-I314 VanDerWaalsContact O-CG1 3.3Å; T310-I314 WeakPolarHBondContact O-CG1 3.35Å; T310-I314 PolarHBondContact O-N 3.39Å; K311-I314 PolarHBondContact O-N 3.38Å; I314-G316 VanDerWaalsContact C-N 3.31Å; I314-G316 PolarHBondContact O-N 3.02Å; I314-N317 PolarHBondContact O-N 3.39Å; I314-L318 HydrophobicContact CG2-CD1 3.84Å; I314-L318 WeakPolarHBondContact O-CB 3.46Å; I314-L318 PolarHBondContact O-N 3.22Å |
| 315 | I | 42.1 | Very low | 40.9 | Very low | 88 Ų | 88 | 98.7 Ų | 98.7 | 45% | 0.451 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.9 | -38.9 | 176.4 | -67.7 | 165.4 | 0 | 0 | 0 | 110.9 | K311 L312 R319 | K311-I315 HydrophobicContact CG-CD1 4.07Å; K311-I315 WeakPolarHBondContact O-CB 3.38Å; K311-I315 VanDerWaalsContact O-CG1 3.25Å; K311-I315 WeakPolarHBondContact O-CG1 3.26Å; K311-I315 PolarHBondContact O-N 2.91Å; L312-I315 PolarHBondContact O-N 2.8Å; I315-R319 PolarHBondContact O-N 2.82Å |
| 316 | G | 38.3 | Very low | 40.4 | Very low | 35 Ų | 35 | 100.5 Ų | 100.5 | 36% | 0.361 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.8 | -46 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | L312 L313 I314 R319 L320 | L312-G316 PolarHBondContact O-N 3.41Å; L313-G316 PolarHBondContact O-N 3.07Å; I314-G316 VanDerWaalsContact C-N 3.31Å; I314-G316 PolarHBondContact O-N 3.02Å; G316-R319 PolarHBondContact O-N 2.87Å; G316-L320 PolarHBondContact O-N 3.33Å |
| 317 | N | 38.5 | Very low | 40.2 | Very low | 89 Ų | 89 | 105.3 Ų | 105.3 | 48% | 0.476 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -67.3 | -40.4 | 174.8 | -90.8 | -20.9 | 0 | 0 | 0 | 112 | L313 I314 R319 L320 T321 | L313-N317 WeakPolarHBondContact O-CB 3.3Å; L313-N317 PolarHBondContact O-N 2.96Å; I314-N317 PolarHBondContact O-N 3.39Å; N317-R319 VanDerWaalsContact C-N 3.28Å; N317-R319 PolarHBondContact O-N 2.81Å; N317-L320 WeakPolarHBondContact O-CB 3.23Å; N317-L320 PolarHBondContact O-N 2.88Å; N317-L320 VanDerWaalsContact O-N 3.08Å; N317-T321 PolarHBondContact O-N 2.97Å; N317-T321 PolarHBondContact O-OG1 2.93Å |
| 318 | L | 38.1 | Very low | 39.7 | Very low | 105 Ų | 105 | 109.9 Ų | 109.9 | 55% | 0.55 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -60.5 | -39.4 | 173.8 | -102.7 | 141.1 | 0 | 0 | 0 | 111.6 | I314 Y322 | I314-L318 HydrophobicContact CG2-CD1 3.84Å; I314-L318 WeakPolarHBondContact O-CB 3.46Å; I314-L318 PolarHBondContact O-N 3.22Å; L318-Y322 WeakPolarHBondContact O-CB 3.33Å; L318-Y322 PolarHBondContact O-N 3.46Å |
| 319 | R | 37 | Very low | 39.1 | Very low | 181 Ų | 181 | 116.9 Ų | 116.9 | 68% | 0.683 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -66.3 | -39.8 | 171.6 | -83.1 | -168.5 | 173.7 | -171.2 | -0.1 | 112.3 | I315 G316 N317 Y322 I323 | I315-R319 PolarHBondContact O-N 2.82Å; G316-R319 PolarHBondContact O-N 2.87Å; N317-R319 VanDerWaalsContact C-N 3.28Å; N317-R319 PolarHBondContact O-N 2.81Å; R319-Y322 PolarHBondContact O-N 3.24Å; R319-I323 VanDerWaalsContact O-CG1 3.23Å; R319-I323 WeakPolarHBondContact O-CG1 3.48Å; R319-I323 PolarHBondContact O-N 2.97Å |
| 320 | L | 35.9 | Very low | 38.7 | Very low | 110 Ų | 110 | 118.7 Ų | 118.7 | 58% | 0.576 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -63.1 | -43.6 | 176.7 | -145.3 | 90.4 | 0 | 0 | 0 | 111 | G316 N317 I323 T324 | G316-L320 PolarHBondContact O-N 3.33Å; N317-L320 WeakPolarHBondContact O-CB 3.23Å; N317-L320 PolarHBondContact O-N 2.88Å; N317-L320 VanDerWaalsContact O-N 3.08Å; L320-I323 PolarHBondContact O-N 3.08Å; L320-T324 PolarHBondContact O-N 2.92Å; L320-T324 PolarHBondContact O-OG1 3.31Å |
| 321 | T | 37 | Very low | 38.3 | Very low | 85 Ų | 85 | 121.6 Ų | 121.6 | 52% | 0.521 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -65.2 | -37.8 | 175.8 | -49.7 | 0 | 0 | 0 | 0 | 111.8 | N317 T324 N325 | N317-T321 PolarHBondContact O-N 2.97Å; N317-T321 PolarHBondContact O-OG1 2.93Å; T321-T324 WeakPolarHBondContact CA-OG1 3.48Å; T321-T324 PolarHBondContact O-N 3.03Å; T321-T324 PolarHBondContact O-OG1 3.35Å; T321-N325 WeakPolarHBondContact O-CB 3.41Å; T321-N325 PolarHBondContact O-N 3.25Å |
| 322 | Y | 33.4 | Very low | 38.5 | Very low | 176 Ų | 176 | 121 Ų | 121 | 69% | 0.69 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -65.6 | -39.6 | 173.8 | -120.9 | -86.4 | 0 | 0 | 0 | 111.9 | L318 R319 T326 | L318-Y322 WeakPolarHBondContact O-CB 3.33Å; L318-Y322 PolarHBondContact O-N 3.46Å; R319-Y322 PolarHBondContact O-N 3.24Å; Y322-T326 WeakPolarHBondContact O-CB 3.48Å; Y322-T326 PolarHBondContact O-N 3.18Å; Y322-T326 PolarHBondContact O-OG1 3.48Å |
| 323 | I | 39.7 | Very low | 38.3 | Very low | 102 Ų | 102 | 123.1 Ų | 123.1 | 52% | 0.523 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -68.1 | -41.9 | 177.4 | -67.6 | 165.1 | 0 | 0 | 0 | 110.4 | R319 L320 T326 F327 | R319-I323 VanDerWaalsContact O-CG1 3.23Å; R319-I323 WeakPolarHBondContact O-CG1 3.48Å; R319-I323 PolarHBondContact O-N 2.97Å; L320-I323 PolarHBondContact O-N 3.08Å; I323-T326 PolarHBondContact O-N 2.66Å; I323-F327 HydrophobicContact CG2-CD2 4.36Å; I323-F327 PolarHBondContact O-N 3.4Å |
| 324 | T | 42 | Very low | 38.2 | Very low | 78 Ų | 78 | 123.9 Ų | 123.9 | 48% | 0.479 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -69.4 | -35.2 | 176.9 | 42.8 | 0 | 0 | 0 | 0 | 112.9 | L320 T321 T326 F327 | L320-T324 PolarHBondContact O-N 2.92Å; L320-T324 PolarHBondContact O-OG1 3.31Å; T321-T324 WeakPolarHBondContact CA-OG1 3.48Å; T321-T324 PolarHBondContact O-N 3.03Å; T321-T324 PolarHBondContact O-OG1 3.35Å; T324-T326 VanDerWaalsContact C-N 3.35Å; T324-F327 PolarHBondContact O-N 2.92Å |
| 325 | N | 32.2 | Very low | 38 | Very low | 112 Ų | 112 | 125.9 Ų | 125.9 | 60% | 0.599 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -73.4 | -26 | 175.7 | -118.5 | -0.3 | 0 | 0 | 0 | 113.3 | T321 F327 | T321-N325 WeakPolarHBondContact O-CB 3.41Å; T321-N325 PolarHBondContact O-N 3.25Å; N325-F327 VanDerWaalsContact C-N 3.31Å |
| 326 | T | 41.1 | Very low | 37.7 | Very low | 95 Ų | 95 | 128.6 Ų | 128.6 | 58% | 0.583 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -76.7 | -21.9 | 174.8 | -44.9 | 0 | 0 | 0 | 0 | 111.9 | Y322 I323 T324 | Y322-T326 WeakPolarHBondContact O-CB 3.48Å; Y322-T326 PolarHBondContact O-N 3.18Å; Y322-T326 PolarHBondContact O-OG1 3.48Å; I323-T326 PolarHBondContact O-N 2.66Å; T324-T326 VanDerWaalsContact C-N 3.35Å |
| 327 | F | 41.6 | Very low | 37.6 | Very low | 179 Ų | 179 | 135.8 Ų | 135.8 | 79% | 0.785 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.4 | -0.4 | 177.3 | -97.8 | -83 | 0 | 0 | 0 | 114.7 | I323 T324 N325 | I323-F327 HydrophobicContact CG2-CD2 4.36Å; I323-F327 PolarHBondContact O-N 3.4Å; T324-F327 PolarHBondContact O-N 2.92Å; N325-F327 VanDerWaalsContact C-N 3.31Å |
| 328 | Y | 37 | Very low | 37.6 | Very low | 206 Ų | 206 | 139.7 Ų | 139.7 | 81% | 0.808 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.4 | 10.5 | 177.8 | -100.7 | -80.7 | 0 | 0 | 0 | 114.8 | ||
| 329 | F | 35.9 | Very low | 37.5 | Very low | 247 Ų | 247 | 142.8 Ų | 142.8 | 100% | 1.083 | 67% | 0.666 | S | S | * | * | trans | -119.2 | 0 | 166.5 | -85.8 | -82.3 | 0 | 0 | 0 | 110.4 |
Retrieved 329 of 329 residues in 214.9 ms
(Link to these results)