| 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 | 35.4 | Very low | 35 | Very low | 246 Ų | 246 | 181.1 Ų | 181.1 | 100% | 1.212 | 87% | 0.871 | S | S | * | * | 0 | 137.3 | 0 | -73.8 | -72.5 | -138.1 | 0 | 0 | 108.8 | |||||
| 2 | S | 31.9 | Very low | 34.6 | Very low | 120 Ų | 120 | 172.8 Ų | 172.8 | 84% | 0.839 | 87% | 0.868 | S | S | * | * | trans | -71.2 | 148.5 | -149.9 | -61.4 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 3 | Q | 34.3 | Very low | 34.9 | Very low | 182 Ų | 182 | 175.8 Ų | 175.8 | 85% | 0.85 | 87% | 0.872 | S | S | * | * | trans | 10.5 | 136.1 | 137.9 | -66.3 | -175.4 | -12.4 | 0 | 0 | 122.3 | ||||
| 4 | K | 41 | Very low | 35.2 | Very low | 193 Ų | 193 | 172.4 Ų | 172.4 | 84% | 0.839 | 87% | 0.873 | S | S | * | * | trans | 24.8 | 134.5 | 132.8 | -77.1 | 176.9 | 170.9 | 174.2 | 0 | 118.8 | ||||
| 5 | R | 35.7 | Very low | 35.1 | Very low | 244 Ų | 244 | 173.7 Ų | 173.7 | 92% | 0.921 | 87% | 0.871 | S | S | * | * | 179 | 149.1 | 105.1 | -96.3 | 168.5 | -173.5 | -173.7 | 2.7 | 113.4 | |||||
| 6 | Q | 42.1 | Very low | 35.1 | Very low | 189 Ų | 189 | 170.8 Ų | 170.8 | 88% | 0.883 | 87% | 0.865 | S | S | * | * | trans | -70.5 | 158.4 | 167.4 | -64 | 170.4 | -29.3 | 0 | 0 | 111.7 | ||||
| 7 | T | 35 | Very low | 34.8 | Very low | 141 Ų | 141 | 168.1 Ų | 168.1 | 87% | 0.865 | 87% | 0.865 | S | S | * | * | trans | -143.9 | 129.3 | 155.9 | -1.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 8 | K | 34.2 | Very low | 34.6 | Very low | 179 Ų | 179 | 167.4 Ų | 167.4 | 78% | 0.778 | 86% | 0.858 | S | S | * | * | trans | -81.2 | -179.8 | 167.7 | -86 | 176.5 | 170.7 | 176.4 | 0 | 110.8 | ||||
| 9 | F | 31.3 | Very low | 34.4 | Very low | 169 Ų | 169 | 165.9 Ų | 165.9 | 74% | 0.741 | 85% | 0.852 | S | S | * | * | trans | 117.5 | 104.7 | 151.8 | -65.7 | -72.7 | 0 | 0 | 0 | 112.9 | ||||
| 10 | Q | 32.4 | Very low | 34.4 | Very low | 167 Ų | 167 | 163.8 Ų | 163.8 | 78% | 0.78 | 85% | 0.852 | S | S | * | * | 88 | 121.1 | 69.1 | -87.3 | -162.2 | -4 | 0 | 0 | 114.3 | |||||
| 11 | N | 31.7 | Very low | 34.5 | Very low | 162 Ų | 162 | 161.6 Ų | 161.6 | 87% | 0.866 | 85% | 0.851 | S | S | * | * | trans | 14.9 | 123 | 141.4 | -78.4 | -17.7 | 0 | 0 | 0 | 119.2 | ||||
| 12 | G | 29.7 | Very low | 34.4 | Very low | 81 Ų | 81 | 154.7 Ų | 154.7 | 84% | 0.835 | 83% | 0.833 | S | S | * | * | trans | -129.4 | 109 | 152.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 13 | K | 38.5 | Very low | 34.6 | Very low | 213 Ų | 213 | 158.9 Ų | 158.9 | 93% | 0.926 | 84% | 0.836 | S | S | * | * | trans | -71.5 | 143.3 | 161.5 | -79.6 | 175.9 | 172.7 | 176.3 | 0 | 108.8 | ||||
| 14 | S | 39.2 | Very low | 34.5 | Very low | 127 Ų | 127 | 162.4 Ų | 162.4 | 89% | 0.888 | 84% | 0.842 | S | S | * | * | trans | -124.3 | 142.5 | 152.1 | 53.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 15 | K | 34.4 | Very low | 34.3 | Very low | 193 Ų | 193 | 162 Ų | 162 | 84% | 0.839 | 84% | 0.843 | S | S | * | * | trans | -94.5 | 145.5 | -166.1 | -85.9 | 176.8 | 173.3 | 179.7 | 0 | 111.7 | ||||
| 16 | T | 34.1 | Very low | 34.5 | Very low | 126 Ų | 126 | 160.4 Ų | 160.4 | 77% | 0.773 | 84% | 0.842 | S | S | * | * | trans | 40 | 126.2 | 143.9 | -8.5 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 17 | S | 29.8 | Very low | 33.8 | Very low | 125 Ų | 125 | 155 Ų | 155 | 87% | 0.874 | 84% | 0.837 | S | S | * | * | trans | -149 | 140.3 | 130.5 | -169.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 18 | E | 31.7 | Very low | 33.5 | Very low | 156 Ų | 156 | 156.6 Ų | 156.6 | 73% | 0.729 | 84% | 0.837 | S | S | * | * | trans | -84.3 | 161.9 | -166.9 | -113 | 172.8 | 169.3 | 0 | 0 | 113.4 | ||||
| 19 | N | 30.6 | Very low | 33.4 | Very low | 139 Ų | 139 | 154.1 Ų | 154.1 | 74% | 0.743 | 84% | 0.837 | S | S | * | * | trans | 84 | 106.5 | 153.8 | -55.4 | -23.8 | 0 | 0 | 0 | 119.3 | ||||
| 20 | S | 34.3 | Very low | 33.7 | Very low | 123 Ų | 123 | 151.9 Ų | 151.9 | 86% | 0.86 | 84% | 0.836 | S | S | * | * | -178.3 | 141.8 | 105.6 | 45.6 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 21 | S | 37.1 | Very low | 33.8 | Very low | 118 Ų | 118 | 150.8 Ų | 150.8 | 83% | 0.825 | 84% | 0.836 | S | S | * | * | trans | -74.7 | 135 | 179.4 | 50.8 | 0 | 0 | 0 | 0 | 113 | ||||
| 22 | A | 33.4 | Very low | 34.3 | Very low | 101 Ų | 101 | 146.1 Ų | 146.1 | 84% | 0.835 | 83% | 0.826 | S | S | * | * | trans | -169.4 | 136.2 | 142 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 23 | K | 35.7 | Very low | 34.8 | Very low | 208 Ų | 208 | 152 Ų | 152 | 90% | 0.904 | 83% | 0.828 | S | S | * | * | trans | -35.8 | 131.5 | 177.3 | -71.3 | 165.3 | 171.2 | 175.7 | 0 | 114.9 | ||||
| 24 | R | 33.5 | Very low | 35.2 | Very low | 257 Ų | 257 | 148.4 Ų | 148.4 | 97% | 0.97 | 82% | 0.815 | S | S | * | * | trans | -93.3 | 109.1 | 155.5 | -85.2 | -167.5 | 176 | -170.7 | -0.4 | 109.5 | ||||
| 25 | E | 35.3 | Very low | 35.4 | Very low | 185 Ų | 185 | 150 Ų | 150 | 86% | 0.864 | 81% | 0.812 | S | S | * | * | trans | -82 | 160.1 | 165 | -154.5 | 168.8 | -170.6 | 0 | 0 | 110.2 | ||||
| 26 | K | 40.8 | Very low | 35.8 | Very low | 209 Ų | 209 | 149.9 Ų | 149.9 | 91% | 0.909 | 81% | 0.808 | S | S | * | * | trans | -57.2 | 155.8 | -161.9 | -66.8 | 164.4 | 174.4 | 172.7 | 0 | 116.2 | ||||
| 27 | G | 27.4 | Very low | 36.3 | Very low | 75 Ų | 75 | 150.4 Ų | 150.4 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | trans | 126.6 | 96 | 140.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 28 | M | 28.5 | Very low | 37.3 | Very low | 176 Ų | 176 | 149.6 Ų | 149.6 | 87% | 0.867 | 81% | 0.807 | S | S | * | * | trans | -108.6 | 78.4 | 161.1 | -155 | 175.9 | 78.7 | 0 | 0 | 108.5 | V30 | M28-V30 HydrophobicContact CE-CG2 4.37Š| ||
| 29 | V | 31.8 | Very low | 38.1 | Very low | 126 Ų | 126 | 148 Ų | 148 | 76% | 0.764 | 81% | 0.807 | S | S | * | * | trans | -79.6 | 109.1 | 161.4 | 171.6 | 0 | 0 | 0 | 0 | 106 | N31 | V29-N31 PolarHBondContact O-N 3.18Š| ||
| 30 | V | 38 | Very low | 39.2 | Very low | 122 Ų | 122 | 144.6 Ų | 144.6 | 74% | 0.739 | 81% | 0.805 | S | S | * | * | trans | -70.9 | 98.9 | 172 | 171.8 | 0 | 0 | 0 | 0 | 107.1 | M28 G32 | M28-V30 HydrophobicContact CE-CG2 4.37Å; V30-G32 PolarHBondContact O-N 3.39Å | ||
| 31 | N | 34.8 | Very low | 40.2 | Very low | 145 Ų | 145 | 150.1 Ų | 150.1 | 78% | 0.775 | 81% | 0.807 | S | S | * | * | trans | -71.7 | 108.2 | -179.3 | -146.8 | 14.4 | 0 | 0 | 0 | 108.9 | V29 K33 | V29-N31 PolarHBondContact O-N 3.18Å; N31-K33 PolarHBondContact O-N 3.42Å | ||
| 32 | G | 41.8 | Very low | 41.5 | Very low | 63 Ų | 63 | 148.1 Ų | 148.1 | 65% | 0.649 | 79% | 0.793 | S | S | * | * | trans | -63.9 | 120.2 | 168.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | V30 E34 | V30-G32 PolarHBondContact O-N 3.39Å; G32-E34 PolarHBondContact O-N 3.33Å | ||
| 33 | K | 39.7 | Very low | 42.9 | Very low | 204 Ų | 204 | 153.1 Ų | 153.1 | 89% | 0.887 | 80% | 0.796 | S | S | * | * | trans | -63.9 | 99.4 | 175 | -75.3 | 179.2 | 176.4 | -178.3 | 0 | 109.3 | N31 I35 | N31-K33 PolarHBondContact O-N 3.42Å; K33-I35 PolarHBondContact O-N 3.4Å | ||
| 34 | E | 46.8 | Very low | 44.1 | Very low | 139 Ų | 139 | 152.3 Ų | 152.3 | 65% | 0.65 | 79% | 0.793 | S | S | * | * | trans | -64.4 | 119.9 | 157.6 | -80.4 | 178.2 | 156.6 | 0 | 0 | 108.1 | G32 Y36 | G32-E34 PolarHBondContact O-N 3.33Å; E34-Y36 HydrophobicContact CB-CD2 4.06Å; E34-Y36 HydrophobicContact CB-CE2 3.58Å; E34-Y36 PolarHBondContact O-N 3.01Å; E34-Y36 WeakPolarHBondContact OE2-CE2 3.03Å; E34-Y36 VanDerWaalsContact OE2-CZ 3.29Å; E34-Y36 PolarHBondContact OE2-OH 3.49Å | ||
| 35 | I | 44.7 | Very low | 45.4 | Very low | 160 Ų | 160 | 144.5 Ų | 144.5 | 82% | 0.821 | 77% | 0.774 | S | S | * | * | trans | -74 | 102.3 | 170.6 | -60.5 | 169.7 | 0 | 0 | 0 | 106.1 | K33 D37 | K33-I35 PolarHBondContact O-N 3.4Å; I35-D37 PolarHBondContact O-N 2.75Å | ||
| 36 | Y | 42.2 | Very low | 47 | Very low | 191 Ų | 191 | 140.7 Ų | 140.7 | 75% | 0.749 | 76% | 0.758 | S | S | * | * | trans | -84.5 | 101.4 | 166.8 | -73.6 | -88.1 | 0 | 0 | 0 | 107.9 | E34 A38 | E34-Y36 HydrophobicContact CB-CD2 4.06Å; E34-Y36 HydrophobicContact CB-CE2 3.58Å; E34-Y36 PolarHBondContact O-N 3.01Å; E34-Y36 WeakPolarHBondContact OE2-CE2 3.03Å; E34-Y36 VanDerWaalsContact OE2-CZ 3.29Å; E34-Y36 PolarHBondContact OE2-OH 3.49Å; Y36-A38 PolarHBondContact O-N 3.03Å | ||
| 37 | D | 44.1 | Very low | 48.3 | Very low | 137 Ų | 137 | 139.4 Ų | 139.4 | 73% | 0.733 | 76% | 0.756 | S | S | * | * | trans | -67.5 | 122 | 165.2 | -119.2 | -16.4 | 0 | 0 | 0 | 108.1 | I35 V39 | I35-D37 PolarHBondContact O-N 2.75Å; D37-V39 PolarHBondContact O-N 3.1Å | ||
| 38 | A | 50.4 | Low | 50.1 | Low | 108 Ų | 108 | 139.6 Ų | 139.6 | 89% | 0.893 | 74% | 0.739 | S | S | * | * | trans | -77.1 | 44.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y36 | Y36-A38 PolarHBondContact O-N 3.03Š| ||
| 39 | V | 49.1 | Very low | 52.1 | Low | 121 Ų | 121 | 135.5 Ų | 135.5 | 73% | 0.733 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -108.2 | 125.8 | 174.4 | -177.4 | 0 | 0 | 0 | 0 | 107.4 | D37 | D37-V39 PolarHBondContact O-N 3.1Š|
| 40 | G | 54.3 | Low | 53.9 | Low | 69 Ų | 69 | 139.6 Ų | 139.6 | 71% | 0.711 | 72% | 0.722 | S | S | * | * | trans | -43.9 | 139 | -169.7 | 0 | 0 | 0 | 0 | 0 | 114 | S42 | G40-S42 PolarHBondContact O-N 3.42Š| ||
| 41 | R | 55.6 | Low | 55.4 | Low | 239 Ų | 239 | 140.4 Ų | 140.4 | 90% | 0.902 | 72% | 0.717 | S | S | * | * | trans | -48.6 | 114.5 | 179.4 | -69.9 | -172.7 | -179.6 | -173.6 | 2.1 | 110 | ||||
| 42 | S | 64 | Low | 56.9 | Low | 75 Ų | 75 | 141 Ų | 141 | 52% | 0.524 | 71% | 0.71 | S | S | . | * | trans | -52.4 | 139.1 | 172.3 | 173.8 | 0 | 0 | 0 | 0 | 110 | G40 F44 V45 | G40-S42 PolarHBondContact O-N 3.42Å; S42-F44 PolarHBondContact O-N 2.97Å; S42-F44 PolarHBondContact OG-N 2.7Å; S42-V45 WeakPolarHBondContact O-CG2 3.42Å; S42-V45 PolarHBondContact O-N 3.04Å | ||
| 43 | K | 62.8 | Low | 58.1 | Low | 207 Ų | 207 | 141.4 Ų | 141.4 | 90% | 0.9 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.4 | -7.5 | 176.6 | -69.6 | 179.9 | 176.7 | 179 | 0 | 113.3 | ||
| 44 | F | 59.8 | Low | 59.7 | Low | 191 Ų | 191 | 137 Ų | 137 | 84% | 0.838 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.5 | 44.1 | 178.9 | -58.3 | -77 | 0 | 0 | 0 | 112 | S42 L46 | S42-F44 PolarHBondContact O-N 2.97Å; S42-F44 PolarHBondContact OG-N 2.7Å; F44-L46 PolarHBondContact O-N 2.8Å |
| 45 | V | 62.3 | Low | 60.8 | Low | 93 Ų | 93 | 137.7 Ų | 137.7 | 56% | 0.564 | 69% | 0.693 | S | S | * | * | trans | -75 | 111.6 | 167.3 | 172.9 | 0 | 0 | 0 | 0 | 107.5 | S42 E47 | S42-V45 WeakPolarHBondContact O-CG2 3.42Å; S42-V45 PolarHBondContact O-N 3.04Å; V45-E47 PolarHBondContact O-N 3.49Å; V45-E47 VanDerWaalsContact O-N 3.07Å | ||
| 46 | L | 67.3 | Low | 62.3 | Low | 104 Ų | 104 | 134.2 Ų | 134.2 | 55% | 0.545 | 68% | 0.68 | S | S | . | * | trans | -58.2 | 113.9 | 174.2 | -158.8 | 81.9 | 0 | 0 | 0 | 107.9 | F44 N48 L49 Y52 | F44-L46 PolarHBondContact O-N 2.8Å; L46-N48 PolarHBondContact O-N 2.93Å; L46-L49 HydrophobicContact CB-CB 4.19Å; L46-L49 WeakPolarHBondContact O-CB 3.41Å; L46-L49 PolarHBondContact O-N 3.39Å; L46-Y52 HydrophobicContact CD2-CD2 3.89Å; L46-Y52 HydrophobicContact CD2-CE2 4.15Å | ||
| 47 | E | 69.7 | Low | 63.9 | Low | 183 Ų | 183 | 129.6 Ų | 129.6 | 86% | 0.855 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.7 | -30.4 | -174.9 | -167.1 | 169.8 | -165.3 | 0 | 0 | 112.1 | V45 | V45-E47 PolarHBondContact O-N 3.49Å; V45-E47 VanDerWaalsContact O-N 3.07Å |
| 48 | N | 65.3 | Low | 65.5 | Low | 79 Ų | 79 | 127.6 Ų | 127.6 | 42% | 0.422 | 66% | 0.658 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -95.9 | 11.8 | 177.6 | -69 | -40.9 | 0 | 0 | 0 | 114.6 | L46 R50 H51 Y52 | L46-N48 PolarHBondContact O-N 2.93Å; N48-R50 PolarHBondContact O-N 3.15Å; N48-R50 VanDerWaalsContact O-N 3.12Å; N48-H51 WeakPolarHBondContact O-CA 3.31Å; N48-H51 WeakPolarHBondContact O-CB 3.41Å; N48-H51 PolarHBondContact O-N 3.26Å; N48-H51 PolarHBondContact OD1-ND1 3.26Å; N48-Y52 HydrophobicContact CB-CD2 4.13Å; N48-Y52 HydrophobicContact CB-CE2 3.59Å; N48-Y52 WeakPolarHBondContact O-CD2 3.44Å; N48-Y52 PolarHBondContact O-N 3.3Å |
| 49 | L | 70.1 | Confident | 66.7 | Low | 89 Ų | 89 | 125.9 Ų | 125.9 | 47% | 0.466 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -51.7 | -40.6 | -178.9 | -173.2 | 65.9 | 0 | 0 | 0 | 111.5 | L46 H51 Y52 T53 | L46-L49 HydrophobicContact CB-CB 4.19Å; L46-L49 WeakPolarHBondContact O-CB 3.41Å; L46-L49 PolarHBondContact O-N 3.39Å; L49-H51 PolarHBondContact O-N 3.46Å; L49-Y52 CarbonylContact O-C 3.37Å; L49-Y52 PolarHBondContact O-N 2.75Å; L49-T53 HydrophobicContact CD1-CG2 4.06Å; L49-T53 HydrophobicContact CG-CG2 3.8Å; L49-T53 VanDerWaalsContact O-CG2 3.3Å; L49-T53 WeakPolarHBondContact O-CG2 3.44Å; L49-T53 PolarHBondContact O-N 3.47Å; L49-T53 PolarHBondContact O-OG1 2.87Å; L49-T53 VanDerWaalsContact O-OG1 3.06Å |
| 50 | R | 69.1 | Low | 67.8 | Low | 212 Ų | 212 | 127.2 Ų | 127.2 | 80% | 0.8 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -58.1 | -30.2 | 177.9 | -63.2 | -175.3 | 178.2 | -169.1 | -2.4 | 113.6 | N48 T53 | N48-R50 PolarHBondContact O-N 3.15Å; N48-R50 VanDerWaalsContact O-N 3.12Å; R50-T53 WeakPolarHBondContact CA-OG1 3.16Å; R50-T53 PolarHBondContact O-OG1 2.86Å |
| 51 | H | 68.6 | Low | 68.7 | Low | 139 Ų | 139 | 132.8 Ų | 132.8 | 64% | 0.644 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -80.4 | -22.7 | 177.9 | -57.9 | 106.6 | 0 | 0 | 0 | 112.5 | N48 L49 | N48-H51 WeakPolarHBondContact O-CA 3.31Å; N48-H51 WeakPolarHBondContact O-CB 3.41Å; N48-H51 PolarHBondContact O-N 3.26Å; N48-H51 PolarHBondContact OD1-ND1 3.26Å; L49-H51 PolarHBondContact O-N 3.46Å |
| 52 | Y | 67.1 | Low | 69.7 | Low | 157 Ų | 157 | 129.5 Ų | 129.5 | 62% | 0.616 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -101.9 | -14.7 | -179.9 | -58.8 | -66.9 | 0 | 0 | 0 | 113.7 | L46 N48 L49 V54 | L46-Y52 HydrophobicContact CD2-CD2 3.89Å; L46-Y52 HydrophobicContact CD2-CE2 4.15Å; N48-Y52 HydrophobicContact CB-CD2 4.13Å; N48-Y52 HydrophobicContact CB-CE2 3.59Å; N48-Y52 WeakPolarHBondContact O-CD2 3.44Å; N48-Y52 PolarHBondContact O-N 3.3Å; L49-Y52 CarbonylContact O-C 3.37Å; L49-Y52 PolarHBondContact O-N 2.75Å; Y52-V54 VanDerWaalsContact C-N 3.32Å |
| 53 | T | 66.6 | Low | 70.4 | Confident | 73 Ų | 73 | 135 Ų | 135 | 45% | 0.448 | 65% | 0.646 | S | S | . | * | S | Bend | trans | -78.5 | -15.1 | 176 | 45.3 | 0 | 0 | 0 | 0 | 113.5 | L49 R50 H55 | L49-T53 HydrophobicContact CD1-CG2 4.06Å; L49-T53 HydrophobicContact CG-CG2 3.8Å; L49-T53 VanDerWaalsContact O-CG2 3.3Å; L49-T53 WeakPolarHBondContact O-CG2 3.44Å; L49-T53 PolarHBondContact O-N 3.47Å; L49-T53 PolarHBondContact O-OG1 2.87Å; L49-T53 VanDerWaalsContact O-OG1 3.06Å; R50-T53 WeakPolarHBondContact CA-OG1 3.16Å; R50-T53 PolarHBondContact O-OG1 2.86Å; T53-H55 PolarHBondContact O-N 3.13Å |
| 54 | V | 72.9 | Confident | 70.8 | Confident | 112 Ų | 112 | 130.8 Ų | 130.8 | 68% | 0.679 | 64% | 0.639 | S | S | * | * | trans | -77.3 | 83.6 | 174.9 | -173.9 | 0 | 0 | 0 | 0 | 108.1 | Y52 P56 | Y52-V54 VanDerWaalsContact C-N 3.32Å; V54-P56 WeakPolarHBondContact O-CD 3.26Å | ||
| 55 | H | 70.4 | Confident | 71.6 | Confident | 153 Ų | 153 | 126.8 Ų | 126.8 | 71% | 0.708 | 63% | 0.626 | S | S | * | * | trans | -66.6 | 122.8 | 169.3 | -63.5 | -61.2 | 0 | 0 | 0 | 108.2 | T53 N57 | T53-H55 PolarHBondContact O-N 3.13Å; H55-N57 PolarHBondContact O-N 3.23Å | ||
| 56 | P | 76.9 | Confident | 72.6 | Confident | 86 Ų | 86 | 130.5 Ų | 130.5 | 56% | 0.558 | 64% | 0.635 | S | S | * | * | trans | -56.4 | 137.2 | 172.7 | 23.7 | -32 | 0 | 0 | 0 | 108 | V54 L58 | V54-P56 WeakPolarHBondContact O-CD 3.26Å; P56-L58 HydrophobicContact CB-CD2 4.26Å; P56-L58 HydrophobicContact CG-CD2 3.92Å; P56-L58 HydrophobicContact CG-CG 4.32Å; P56-L58 WeakPolarHBondContact O-CG 3.48Å; P56-L58 PolarHBondContact O-N 2.75Å | ||
| 57 | N | 75.7 | Confident | 73.2 | Confident | 95 Ų | 95 | 129.6 Ų | 129.6 | 51% | 0.508 | 64% | 0.642 | S | S | . | * | trans | -70 | 81.9 | 176.4 | -173.3 | -7 | 0 | 0 | 0 | 109.1 | H55 A59 Q60 | H55-N57 PolarHBondContact O-N 3.23Å; N57-A59 PolarHBondContact O-N 3.33Å; N57-A59 VanDerWaalsContact O-N 3.12Å; N57-A59 VanDerWaalsContact OD1-CB 3.26Å; N57-A59 WeakPolarHBondContact OD1-CB 3.47Å; N57-A59 PolarHBondContact OD1-N 3.05Å; N57-Q60 HydrophobicContact CB-CG 4.42Å; N57-Q60 PolarHBondContact O-N 3.02Å; N57-Q60 VanDerWaalsContact O-N 3.17Å | ||
| 58 | L | 77.4 | Confident | 73.8 | Confident | 95 Ų | 95 | 125.2 Ų | 125.2 | 50% | 0.497 | 63% | 0.628 | S | S | . | * | G | 310 helix | trans | -62.5 | -20.7 | -176.5 | -64.1 | 179.6 | 0 | 0 | 0 | 111.7 | P56 Q60 Y61 Y62 | P56-L58 HydrophobicContact CB-CD2 4.26Å; P56-L58 HydrophobicContact CG-CD2 3.92Å; P56-L58 HydrophobicContact CG-CG 4.32Å; P56-L58 WeakPolarHBondContact O-CG 3.48Å; P56-L58 PolarHBondContact O-N 2.75Å; L58-Q60 PolarHBondContact O-N 2.83Å; L58-Q60 VanDerWaalsContact O-N 3.13Å; L58-Y61 PolarHBondContact O-N 2.9Å; L58-Y62 HydrophobicContact CB-CD2 4.2Å; L58-Y62 HydrophobicContact CB-CE2 3.98Å; L58-Y62 WeakPolarHBondContact O-CD2 3.36Å; L58-Y62 PolarHBondContact O-N 3.27Å |
| 59 | A | 75.8 | Confident | 74.7 | Confident | 71 Ų | 71 | 123.3 Ų | 123.3 | 59% | 0.587 | 62% | 0.623 | S | S | * | * | G | 310 helix | trans | -59.3 | -24.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | N57 Y61 Y62 | N57-A59 PolarHBondContact O-N 3.33Å; N57-A59 VanDerWaalsContact O-N 3.12Å; N57-A59 VanDerWaalsContact OD1-CB 3.26Å; N57-A59 WeakPolarHBondContact OD1-CB 3.47Å; N57-A59 PolarHBondContact OD1-N 3.05Å; A59-Y61 VanDerWaalsContact C-N 3.26Å; A59-Y61 PolarHBondContact O-N 3.49Å; A59-Y62 PolarHBondContact O-N 3.39Å |
| 60 | Q | 72.5 | Confident | 75.6 | Confident | 149 Ų | 149 | 123 Ų | 123 | 70% | 0.696 | 62% | 0.622 | S | S | * | * | G | 310 helix | trans | -68.3 | -25.1 | 175.1 | -62.7 | -177.8 | 0.5 | 0 | 0 | 113 | N57 L58 | N57-Q60 HydrophobicContact CB-CG 4.42Å; N57-Q60 PolarHBondContact O-N 3.02Å; N57-Q60 VanDerWaalsContact O-N 3.17Å; L58-Q60 PolarHBondContact O-N 2.83Å; L58-Q60 VanDerWaalsContact O-N 3.13Å |
| 61 | Y | 73.8 | Confident | 76.5 | Confident | 187 Ų | 187 | 119.5 Ų | 119.5 | 73% | 0.733 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96 | -16 | 179.6 | -60.1 | -77.8 | 0 | 0 | 0 | 112.8 | L58 A59 K63 | L58-Y61 PolarHBondContact O-N 2.9Å; A59-Y61 VanDerWaalsContact C-N 3.26Å; A59-Y61 PolarHBondContact O-N 3.49Å; Y61-K63 PolarHBondContact O-N 3.44Å |
| 62 | Y | 76.4 | Confident | 77.5 | Confident | 170 Ų | 170 | 120.5 Ų | 120.5 | 67% | 0.667 | 62% | 0.617 | S | S | * | * | trans | -90.7 | 103 | 177.2 | -76 | -73.1 | 0 | 0 | 0 | 110.8 | L58 A59 P64 | L58-Y62 HydrophobicContact CB-CD2 4.2Å; L58-Y62 HydrophobicContact CB-CE2 3.98Å; L58-Y62 WeakPolarHBondContact O-CD2 3.36Å; L58-Y62 PolarHBondContact O-N 3.27Å; A59-Y62 PolarHBondContact O-N 3.39Å; Y62-P64 WeakPolarHBondContact O-CD 3.49Å | ||
| 63 | K | 76.9 | Confident | 78.6 | Confident | 191 Ų | 191 | 118.8 Ų | 118.8 | 83% | 0.83 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 120.9 | 162.7 | -168.3 | 170.7 | -174.5 | 170.1 | 0 | 108.5 | Y61 L65 | Y61-K63 PolarHBondContact O-N 3.44Å; K63-L65 PolarHBondContact O-N 3.08Å |
| 64 | P | 73 | Confident | 79.9 | Confident | 117 Ų | 117 | 119 Ų | 119 | 76% | 0.76 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 130.8 | 176.5 | -22.8 | 31.9 | 0 | 0 | 0 | 109.8 | Y62 K66 | Y62-P64 WeakPolarHBondContact O-CD 3.49Å; P64-K66 PolarHBondContact O-N 3.44Å |
| 65 | L | 74.9 | Confident | 80.9 | Confident | 108 Ų | 108 | 115.9 Ų | 115.9 | 57% | 0.565 | 60% | 0.597 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 138.3 | 172.2 | -81.3 | 97.1 | 0 | 0 | 0 | 108.5 | K63 A67 A69 L70 | K63-L65 PolarHBondContact O-N 3.08Å; L65-A67 PolarHBondContact O-N 3.28Å; L65-A69 HydrophobicContact CB-CB 4.44Å; L65-A69 HydrophobicContact CD2-CB 4.05Å; L65-L70 HydrophobicContact CB-CB 4.17Å |
| 66 | K | 84.1 | Confident | 82 | Confident | 171 Ų | 171 | 114.8 Ų | 114.8 | 74% | 0.743 | 59% | 0.592 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 138.4 | 169.9 | -67 | -177.4 | 178.4 | -178.9 | 0 | 108.4 | P64 T68 A69 L70 | P64-K66 PolarHBondContact O-N 3.44Å; K66-T68 PolarHBondContact O-N 3.41Å; K66-A69 HydrophobicContact CB-CB 4.45Å; K66-A69 WeakPolarHBondContact O-CA 3.31Å; K66-A69 WeakPolarHBondContact O-CB 3.42Å; K66-A69 PolarHBondContact O-N 3.13Å; K66-L70 PolarHBondContact O-N 2.91Å |
| 67 | A | 79.1 | Confident | 82.8 | Confident | 84 Ų | 84 | 114.4 Ų | 114.4 | 69% | 0.694 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -50.2 | -37.3 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113 | L65 Q71 | L65-A67 PolarHBondContact O-N 3.28Å; A67-Q71 WeakPolarHBondContact O-CB 3.39Å; A67-Q71 PolarHBondContact O-N 3.45Å |
| 68 | T | 83.7 | Confident | 83.7 | Confident | 91 Ų | 91 | 119 Ų | 119 | 56% | 0.558 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -68.2 | -35.9 | 175.1 | 37.6 | 0 | 0 | 0 | 0 | 114.4 | K66 K72 | K66-T68 PolarHBondContact O-N 3.41Å; T68-K72 VanDerWaalsContact O-CG 3.31Å; T68-K72 WeakPolarHBondContact O-CG 3.36Å; T68-K72 PolarHBondContact O-N 2.94Å; T68-K72 VanDerWaalsContact O-N 3.11Å |
| 69 | A | 84.3 | Confident | 84.6 | Confident | 40 Ų | 40 | 122 Ų | 122 | 33% | 0.331 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -72.6 | -39.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | L65 K66 K72 F73 | L65-A69 HydrophobicContact CB-CB 4.44Å; L65-A69 HydrophobicContact CD2-CB 4.05Å; K66-A69 HydrophobicContact CB-CB 4.45Å; K66-A69 WeakPolarHBondContact O-CA 3.31Å; K66-A69 WeakPolarHBondContact O-CB 3.42Å; K66-A69 PolarHBondContact O-N 3.13Å; A69-K72 PolarHBondContact O-N 3.17Å; A69-F73 WeakPolarHBondContact O-CB 3.42Å; A69-F73 PolarHBondContact O-N 3.11Å |
| 70 | L | 87.9 | Confident | 85.5 | Confident | 83 Ų | 83 | 122.1 Ų | 122.1 | 44% | 0.435 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -62.9 | -43.8 | 174.3 | -175.8 | 145.9 | 0 | 0 | 0 | 111.2 | L65 K66 K72 F73 L74 | L65-L70 HydrophobicContact CB-CB 4.17Å; K66-L70 PolarHBondContact O-N 2.91Å; L70-K72 PolarHBondContact O-N 3.37Å; L70-F73 PolarHBondContact O-N 3.02Å; L70-L74 HydrophobicContact CD2-CD1 3.53Å; L70-L74 HydrophobicContact CD2-CG 4.13Å; L70-L74 HydrophobicContact CG-CD1 4.47Å; L70-L74 WeakPolarHBondContact O-CG 3.3Å; L70-L74 PolarHBondContact O-N 3Å |
| 71 | Q | 88.4 | Confident | 86.5 | Confident | 138 Ų | 138 | 118.4 Ų | 118.4 | 65% | 0.645 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -63.2 | -41.6 | 176.9 | -169.3 | -179.3 | 9 | 0 | 0 | 112.2 | A67 L74 A75 | A67-Q71 WeakPolarHBondContact O-CB 3.39Å; A67-Q71 PolarHBondContact O-N 3.45Å; Q71-L74 PolarHBondContact O-N 2.98Å; Q71-A75 VanDerWaalsContact O-CB 3.31Å; Q71-A75 WeakPolarHBondContact O-CB 3.11Å; Q71-A75 PolarHBondContact O-N 3.37Å |
| 72 | K | 89.7 | Confident | 87.4 | Confident | 159 Ų | 159 | 112.5 Ų | 112.5 | 69% | 0.691 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -61.7 | -44.8 | 173.9 | -75.9 | 178.3 | -178.6 | -174.5 | 0 | 111.8 | T68 A69 L70 A75 Q76 | T68-K72 VanDerWaalsContact O-CG 3.31Å; T68-K72 WeakPolarHBondContact O-CG 3.36Å; T68-K72 PolarHBondContact O-N 2.94Å; T68-K72 VanDerWaalsContact O-N 3.11Å; A69-K72 PolarHBondContact O-N 3.17Å; L70-K72 PolarHBondContact O-N 3.37Å; K72-A75 PolarHBondContact O-N 2.99Å; K72-Q76 WeakPolarHBondContact O-CB 3.41Å; K72-Q76 PolarHBondContact O-N 3.26Å |
| 73 | F | 91 | Very high | 88.3 | Confident | 122 Ų | 122 | 111 Ų | 111 | 54% | 0.535 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -61.2 | -47.8 | 177.3 | 177.1 | -98.8 | 0 | 0 | 0 | 111.7 | A69 L70 A75 Q76 N77 | A69-F73 WeakPolarHBondContact O-CB 3.42Å; A69-F73 PolarHBondContact O-N 3.11Å; L70-F73 PolarHBondContact O-N 3.02Å; F73-A75 VanDerWaalsContact C-N 3.34Å; F73-A75 PolarHBondContact O-N 2.79Å; F73-Q76 PolarHBondContact O-N 3.42Å; F73-N77 WeakPolarHBondContact O-CB 3.34Å; F73-N77 PolarHBondContact O-N 2.88Å |
| 74 | L | 93.2 | Very high | 89.1 | Confident | 77 Ų | 77 | 107.5 Ų | 107.5 | 40% | 0.403 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62.7 | -40.8 | 177.2 | -70.3 | -179.4 | 0 | 0 | 0 | 112.2 | L70 Q71 N77 R78 | L70-L74 HydrophobicContact CD2-CD1 3.53Å; L70-L74 HydrophobicContact CD2-CG 4.13Å; L70-L74 HydrophobicContact CG-CD1 4.47Å; L70-L74 WeakPolarHBondContact O-CG 3.3Å; L70-L74 PolarHBondContact O-N 3Å; Q71-L74 PolarHBondContact O-N 2.98Å; L74-N77 PolarHBondContact O-N 3.04Å; L74-R78 WeakPolarHBondContact O-CB 3.37Å; L74-R78 VanDerWaalsContact O-CG 3.31Å; L74-R78 WeakPolarHBondContact O-CG 3.41Å; L74-R78 PolarHBondContact O-N 3.33Å |
| 75 | A | 92.8 | Very high | 90 | Very high | 47 Ų | 47 | 106.4 Ų | 106.4 | 39% | 0.388 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -64.2 | -40.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q71 K72 F73 K79 | Q71-A75 VanDerWaalsContact O-CB 3.31Å; Q71-A75 WeakPolarHBondContact O-CB 3.11Å; Q71-A75 PolarHBondContact O-N 3.37Å; K72-A75 PolarHBondContact O-N 2.99Å; F73-A75 VanDerWaalsContact C-N 3.34Å; F73-A75 PolarHBondContact O-N 2.79Å; A75-K79 WeakPolarHBondContact O-CG 3.49Å; A75-K79 PolarHBondContact O-N 3.32Å |
| 76 | Q | 93.7 | Very high | 90.7 | Very high | 129 Ų | 129 | 107.7 Ų | 107.7 | 60% | 0.603 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -65.8 | -45.1 | 174.7 | -176.2 | 169.8 | 4.8 | 0 | 0 | 111.4 | K72 F73 R78 K79 T80 | K72-Q76 WeakPolarHBondContact O-CB 3.41Å; K72-Q76 PolarHBondContact O-N 3.26Å; F73-Q76 PolarHBondContact O-N 3.42Å; Q76-R78 VanDerWaalsContact C-N 3.35Å; Q76-R78 PolarHBondContact O-N 2.72Å; Q76-K79 WeakPolarHBondContact O-CB 3.41Å; Q76-K79 PolarHBondContact O-N 3.29Å; Q76-K79 VanDerWaalsContact O-N 3.11Å; Q76-T80 PolarHBondContact O-N 3.26Å; Q76-T80 PolarHBondContact O-OG1 3.47Å |
| 77 | N | 94.8 | Very high | 90.8 | Very high | 78 Ų | 78 | 102 Ų | 102 | 42% | 0.417 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -59.7 | -46.7 | 178.8 | -164.4 | 22.8 | 0 | 0 | 0 | 110.9 | F73 L74 K79 T80 T81 | F73-N77 WeakPolarHBondContact O-CB 3.34Å; F73-N77 PolarHBondContact O-N 2.88Å; L74-N77 PolarHBondContact O-N 3.04Å; N77-K79 VanDerWaalsContact C-N 3.28Å; N77-K79 PolarHBondContact O-N 3.46Å; N77-T80 PolarHBondContact O-N 2.9Å; N77-T80 VanDerWaalsContact O-N 3.1Å; N77-T81 PolarHBondContact O-N 2.88Å; N77-T81 PolarHBondContact O-OG1 3.12Å |
| 78 | R | 95.1 | Very high | 90.9 | Very high | 192 Ų | 192 | 101.5 Ų | 101.5 | 73% | 0.725 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -55.6 | -40.4 | 174.6 | -74.3 | 176.4 | -178.1 | -174.4 | 0.7 | 112.9 | L74 Q76 S82 | L74-R78 WeakPolarHBondContact O-CB 3.37Å; L74-R78 VanDerWaalsContact O-CG 3.31Å; L74-R78 WeakPolarHBondContact O-CG 3.41Å; L74-R78 PolarHBondContact O-N 3.33Å; Q76-R78 VanDerWaalsContact C-N 3.35Å; Q76-R78 PolarHBondContact O-N 2.72Å; R78-S82 WeakPolarHBondContact O-CB 3.41Å; R78-S82 PolarHBondContact O-N 3.48Å |
| 79 | K | 94.8 | Very high | 91 | Very high | 159 Ų | 159 | 102.1 Ų | 102.1 | 69% | 0.691 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.9 | -46.4 | 175.8 | -71.6 | 174.8 | -179.6 | -175 | 0 | 111.5 | A75 Q76 N77 S82 F83 | A75-K79 WeakPolarHBondContact O-CG 3.49Å; A75-K79 PolarHBondContact O-N 3.32Å; Q76-K79 WeakPolarHBondContact O-CB 3.41Å; Q76-K79 PolarHBondContact O-N 3.29Å; Q76-K79 VanDerWaalsContact O-N 3.11Å; N77-K79 VanDerWaalsContact C-N 3.28Å; N77-K79 PolarHBondContact O-N 3.46Å; K79-S82 PolarHBondContact O-N 2.82Å; K79-F83 WeakPolarHBondContact O-CB 3.34Å; K79-F83 PolarHBondContact O-N 3.39Å |
| 80 | T | 94.7 | Very high | 90.9 | Very high | 72 Ų | 72 | 107 Ų | 107 | 44% | 0.442 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.4 | -46.4 | 178.3 | -54.5 | 0 | 0 | 0 | 0 | 111.4 | Q76 N77 S82 F83 M84 | Q76-T80 PolarHBondContact O-N 3.26Å; Q76-T80 PolarHBondContact O-OG1 3.47Å; N77-T80 PolarHBondContact O-N 2.9Å; N77-T80 VanDerWaalsContact O-N 3.1Å; T80-S82 PolarHBondContact O-N 3.44Å; T80-F83 PolarHBondContact O-N 3.36Å; T80-M84 WeakPolarHBondContact O-CG 3.31Å; T80-M84 PolarHBondContact O-N 2.93Å |
| 81 | T | 94.3 | Very high | 90.4 | Very high | 72 Ų | 72 | 106.2 Ų | 106.2 | 44% | 0.442 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.2 | -44 | 178 | -43.4 | 0 | 0 | 0 | 0 | 111.3 | N77 F83 M84 L85 | N77-T81 PolarHBondContact O-N 2.88Å; N77-T81 PolarHBondContact O-OG1 3.12Å; T81-F83 VanDerWaalsContact C-N 3.3Å; T81-F83 PolarHBondContact O-N 2.93Å; T81-M84 PolarHBondContact O-N 2.9Å; T81-L85 WeakPolarHBondContact O-CB 3.19Å; T81-L85 PolarHBondContact O-N 3.28Å |
| 82 | S | 93.5 | Very high | 89.8 | Confident | 63 Ų | 63 | 105.6 Ų | 105.6 | 44% | 0.441 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59 | -41.6 | 174.7 | 163.1 | 0 | 0 | 0 | 0 | 112.2 | R78 K79 T80 K86 | R78-S82 WeakPolarHBondContact O-CB 3.41Å; R78-S82 PolarHBondContact O-N 3.48Å; K79-S82 PolarHBondContact O-N 2.82Å; T80-S82 PolarHBondContact O-N 3.44Å; S82-K86 WeakPolarHBondContact O-CG 3.09Å; S82-K86 PolarHBondContact O-N 3.35Å |
| 83 | F | 94.5 | Very high | 89 | Confident | 137 Ų | 137 | 103.1 Ų | 103.1 | 60% | 0.601 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -65.9 | -49.4 | 177.6 | 175.6 | -99.1 | 0 | 0 | 0 | 111.2 | K79 T80 T81 L85 K86 V87 | K79-F83 WeakPolarHBondContact O-CB 3.34Å; K79-F83 PolarHBondContact O-N 3.39Å; T80-F83 PolarHBondContact O-N 3.36Å; T81-F83 VanDerWaalsContact C-N 3.3Å; T81-F83 PolarHBondContact O-N 2.93Å; F83-L85 VanDerWaalsContact C-N 3.28Å; F83-L85 PolarHBondContact O-N 3.03Å; F83-K86 PolarHBondContact O-N 3.38Å; F83-V87 HydrophobicContact CD1-CG2 4.17Å; F83-V87 HydrophobicContact CE1-CG2 3.7Å; F83-V87 HydrophobicContact CE2-CG2 4.13Å; F83-V87 HydrophobicContact CZ-CG2 3.68Å; F83-V87 WeakPolarHBondContact O-CG2 3.21Å; F83-V87 PolarHBondContact O-N 3.41Å |
| 84 | M | 92.8 | Very high | 88.3 | Confident | 118 Ų | 118 | 101.7 Ų | 101.7 | 58% | 0.581 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -57.7 | -42.1 | 177.4 | -69.5 | -137.8 | -51 | 0 | 0 | 111.9 | T80 T81 K86 V87 T88 | T80-M84 WeakPolarHBondContact O-CG 3.31Å; T80-M84 PolarHBondContact O-N 2.93Å; T81-M84 PolarHBondContact O-N 2.9Å; M84-K86 VanDerWaalsContact C-N 3.32Å; M84-K86 PolarHBondContact O-N 2.87Å; M84-V87 PolarHBondContact O-N 3.19Å; M84-V87 VanDerWaalsContact O-N 3.14Å; M84-T88 WeakPolarHBondContact O-CG2 3.33Å; M84-T88 PolarHBondContact O-N 3.29Å; M84-T88 PolarHBondContact O-OG1 3.32Å |
| 85 | L | 91.9 | Very high | 87.5 | Confident | 94 Ų | 94 | 101.9 Ų | 101.9 | 49% | 0.492 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62 | -40.5 | -179.6 | -163.4 | 137.5 | 0 | 0 | 0 | 111.9 | T81 F83 T88 E89 | T81-L85 WeakPolarHBondContact O-CB 3.19Å; T81-L85 PolarHBondContact O-N 3.28Å; F83-L85 VanDerWaalsContact C-N 3.28Å; F83-L85 PolarHBondContact O-N 3.03Å; L85-T88 WeakPolarHBondContact CA-OG1 3.38Å; L85-T88 PolarHBondContact O-N 3.02Å; L85-T88 PolarHBondContact O-OG1 3.14Å; L85-E89 WeakPolarHBondContact CD2-OE1 3.49Å; L85-E89 WeakPolarHBondContact O-CG 3.42Å; L85-E89 PolarHBondContact O-N 3.06Å |
| 86 | K | 90 | Very high | 86.8 | Confident | 136 Ų | 136 | 104.9 Ų | 104.9 | 59% | 0.591 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -66.8 | -38.4 | 173.4 | -72.1 | -178.7 | 177.3 | -174.5 | 0 | 113.1 | S82 F83 M84 T88 E89 Y90 | S82-K86 WeakPolarHBondContact O-CG 3.09Å; S82-K86 PolarHBondContact O-N 3.35Å; F83-K86 PolarHBondContact O-N 3.38Å; M84-K86 VanDerWaalsContact C-N 3.32Å; M84-K86 PolarHBondContact O-N 2.87Å; K86-T88 VanDerWaalsContact C-N 3.33Å; K86-E89 PolarHBondContact O-N 2.97Å; K86-Y90 PolarHBondContact O-N 3.21Å |
| 87 | V | 85.9 | Confident | 85.9 | Confident | 52 Ų | 52 | 103.8 Ų | 103.8 | 32% | 0.315 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.3 | -43.4 | 175.1 | 172.5 | 0 | 0 | 0 | 0 | 109.9 | F83 M84 E89 Y90 D91 | F83-V87 HydrophobicContact CD1-CG2 4.17Å; F83-V87 HydrophobicContact CE1-CG2 3.7Å; F83-V87 HydrophobicContact CE2-CG2 4.13Å; F83-V87 HydrophobicContact CZ-CG2 3.68Å; F83-V87 WeakPolarHBondContact O-CG2 3.21Å; F83-V87 PolarHBondContact O-N 3.41Å; M84-V87 PolarHBondContact O-N 3.19Å; M84-V87 VanDerWaalsContact O-N 3.14Å; V87-E89 PolarHBondContact O-N 2.87Å; V87-Y90 PolarHBondContact O-N 2.82Å; V87-D91 WeakPolarHBondContact O-CB 3.45Å; V87-D91 PolarHBondContact O-N 2.83Å |
| 88 | T | 82.8 | Confident | 85 | Confident | 73 Ų | 73 | 105 Ų | 105 | 45% | 0.448 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.7 | -37.5 | 177.4 | 52.7 | 0 | 0 | 0 | 0 | 112.9 | M84 L85 K86 D91 Q92 | M84-T88 WeakPolarHBondContact O-CG2 3.33Å; M84-T88 PolarHBondContact O-N 3.29Å; M84-T88 PolarHBondContact O-OG1 3.32Å; L85-T88 WeakPolarHBondContact CA-OG1 3.38Å; L85-T88 PolarHBondContact O-N 3.02Å; L85-T88 PolarHBondContact O-OG1 3.14Å; K86-T88 VanDerWaalsContact C-N 3.33Å; T88-D91 PolarHBondContact O-N 3.16Å; T88-Q92 WeakPolarHBondContact O-CB 3.39Å; T88-Q92 VanDerWaalsContact O-CG 3.23Å; T88-Q92 WeakPolarHBondContact O-CG 3.45Å; T88-Q92 PolarHBondContact O-N 3.12Å |
| 89 | E | 85.8 | Confident | 84 | Confident | 103 Ų | 103 | 100.3 Ų | 100.3 | 48% | 0.481 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.1 | -42.2 | 173.2 | -75.4 | 172.6 | 176.3 | 0 | 0 | 111.6 | L85 K86 V87 Q92 D93 | L85-E89 WeakPolarHBondContact CD2-OE1 3.49Å; L85-E89 WeakPolarHBondContact O-CG 3.42Å; L85-E89 PolarHBondContact O-N 3.06Å; K86-E89 PolarHBondContact O-N 2.97Å; V87-E89 PolarHBondContact O-N 2.87Å; E89-Q92 WeakPolarHBondContact O-CB 3.2Å; E89-Q92 PolarHBondContact O-N 2.84Å; E89-D93 PolarHBondContact O-N 3.05Å |
| 90 | Y | 81 | Confident | 82.9 | Confident | 142 Ų | 142 | 97.4 Ų | 97.4 | 56% | 0.557 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -68.2 | -38.2 | 176.8 | 178.9 | -110.1 | 0 | 0 | 0 | 112.9 | K86 V87 Q92 D93 K94 | K86-Y90 PolarHBondContact O-N 3.21Å; V87-Y90 PolarHBondContact O-N 2.82Å; Y90-Q92 VanDerWaalsContact C-N 3.32Å; Y90-D93 PolarHBondContact O-N 2.75Å; Y90-K94 HydrophobicContact CE1-CD 4.25Å; Y90-K94 VanDerWaalsContact CZ-CE 3.46Å; Y90-K94 PolarHBondContact O-N 3.42Å; Y90-K94 WeakPolarHBondContact OH-CE 3.41Å |
| 91 | D | 77.6 | Confident | 82 | Confident | 68 Ų | 68 | 99.1 Ų | 99.1 | 36% | 0.364 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -74.7 | -22.9 | 176.7 | -74.2 | -19.5 | 0 | 0 | 0 | 112.3 | V87 T88 K94 T95 | V87-D91 WeakPolarHBondContact O-CB 3.45Å; V87-D91 PolarHBondContact O-N 2.83Å; T88-D91 PolarHBondContact O-N 3.16Å; D91-K94 PolarHBondContact O-N 3.23Å; D91-K94 IonicContact OD1-NZ 3.89Å; D91-T95 WeakPolarHBondContact O-CB 3.42Å; D91-T95 PolarHBondContact O-N 3.5Å; D91-T95 PolarHBondContact O-OG1 2.89Å |
| 92 | Q | 75.7 | Confident | 81.1 | Confident | 124 Ų | 124 | 101.2 Ų | 101.2 | 58% | 0.579 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.9 | -44.4 | 168.5 | -81.7 | 170 | 1.7 | 0 | 0 | 111.1 | T88 E89 Y90 K94 T95 L96 | T88-Q92 WeakPolarHBondContact O-CB 3.39Å; T88-Q92 VanDerWaalsContact O-CG 3.23Å; T88-Q92 WeakPolarHBondContact O-CG 3.45Å; T88-Q92 PolarHBondContact O-N 3.12Å; E89-Q92 WeakPolarHBondContact O-CB 3.2Å; E89-Q92 PolarHBondContact O-N 2.84Å; Y90-Q92 VanDerWaalsContact C-N 3.32Å; Q92-K94 VanDerWaalsContact C-N 3.29Å; Q92-K94 PolarHBondContact O-N 2.96Å; Q92-T95 PolarHBondContact O-N 3.26Å; Q92-L96 VanDerWaalsContact O-CB 3.25Å; Q92-L96 WeakPolarHBondContact O-CB 3.49Å; Q92-L96 PolarHBondContact O-N 3.2Å |
| 93 | D | 73.3 | Confident | 80 | Confident | 108 Ų | 108 | 101.1 Ų | 101.1 | 58% | 0.578 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.8 | -39.2 | 177 | -76.5 | -14.3 | 0 | 0 | 0 | 111.8 | E89 Y90 L97 | E89-D93 PolarHBondContact O-N 3.05Å; Y90-D93 PolarHBondContact O-N 2.75Å; D93-L97 WeakPolarHBondContact O-CB 3.41Å; D93-L97 PolarHBondContact O-N 3.1Å |
| 94 | K | 76 | Confident | 78.6 | Confident | 92 Ų | 92 | 98.2 Ų | 98.2 | 40% | 0.4 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -68.7 | -42.3 | 175.5 | -68.9 | -180 | 177.4 | 172.1 | 0 | 112.4 | Y90 D91 Q92 L96 L97 I98 | Y90-K94 HydrophobicContact CE1-CD 4.25Å; Y90-K94 VanDerWaalsContact CZ-CE 3.46Å; Y90-K94 PolarHBondContact O-N 3.42Å; Y90-K94 WeakPolarHBondContact OH-CE 3.41Å; D91-K94 PolarHBondContact O-N 3.23Å; D91-K94 IonicContact OD1-NZ 3.89Å; Q92-K94 VanDerWaalsContact C-N 3.29Å; Q92-K94 PolarHBondContact O-N 2.96Å; K94-L96 VanDerWaalsContact C-N 3.32Å; K94-L97 WeakPolarHBondContact O-CB 3.33Å; K94-L97 PolarHBondContact O-N 2.92Å; K94-I98 VanDerWaalsContact O-CG1 3.27Å; K94-I98 WeakPolarHBondContact O-CG1 3.3Å; K94-I98 PolarHBondContact O-N 3.41Å |
| 95 | T | 76 | Confident | 77.2 | Confident | 81 Ų | 81 | 95 Ų | 95 | 50% | 0.497 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.1 | -42.4 | 177 | -55.7 | 0 | 0 | 0 | 0 | 109.9 | D91 Q92 I98 M99 | D91-T95 WeakPolarHBondContact O-CB 3.42Å; D91-T95 PolarHBondContact O-N 3.5Å; D91-T95 PolarHBondContact O-OG1 2.89Å; Q92-T95 PolarHBondContact O-N 3.26Å; T95-I98 PolarHBondContact O-N 2.88Å; T95-M99 HydrophobicContact CG2-CG 4.27Å; T95-M99 VanDerWaalsContact O-CB 3.32Å; T95-M99 WeakPolarHBondContact O-CB 3.44Å; T95-M99 WeakPolarHBondContact O-CG 3.38Å; T95-M99 PolarHBondContact O-N 3.11Å |
| 96 | L | 77.9 | Confident | 75.6 | Confident | 109 Ų | 109 | 94.3 Ų | 94.3 | 57% | 0.571 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.5 | -43.9 | 174.3 | -177.1 | 61.7 | 0 | 0 | 0 | 111.4 | Q92 K94 I98 M99 T100 | Q92-L96 VanDerWaalsContact O-CB 3.25Å; Q92-L96 WeakPolarHBondContact O-CB 3.49Å; Q92-L96 PolarHBondContact O-N 3.2Å; K94-L96 VanDerWaalsContact C-N 3.32Å; L96-I98 PolarHBondContact O-N 3.22Å; L96-M99 PolarHBondContact O-N 3.25Å; L96-T100 WeakPolarHBondContact O-CB 3.34Å; L96-T100 PolarHBondContact O-N 2.93Å; L96-T100 PolarHBondContact O-OG1 3.4Å |
| 97 | L | 74.8 | Confident | 73.8 | Confident | 107 Ų | 107 | 93.1 Ų | 93.1 | 56% | 0.56 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -60.7 | -43.7 | 174.7 | -176.7 | 66.4 | 0 | 0 | 0 | 112 | D93 K94 T100 N101 | D93-L97 WeakPolarHBondContact O-CB 3.41Å; D93-L97 PolarHBondContact O-N 3.1Å; K94-L97 WeakPolarHBondContact O-CB 3.33Å; K94-L97 PolarHBondContact O-N 2.92Å; L97-T100 PolarHBondContact O-N 3.42Å; L97-N101 VanDerWaalsContact CD1-ND2 3.35Å; L97-N101 WeakPolarHBondContact CD1-ND2 3.37Å; L97-N101 WeakPolarHBondContact O-CB 3.35Å; L97-N101 PolarHBondContact O-N 2.95Å; L97-N101 VanDerWaalsContact O-N 3.08Å; L97-N101 PolarHBondContact O-ND2 2.6Å |
| 98 | I | 76.4 | Confident | 72.3 | Confident | 104 Ų | 104 | 94.8 Ų | 94.8 | 53% | 0.533 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.6 | -45.1 | 177.4 | -69.1 | 164.7 | 0 | 0 | 0 | 110.5 | K94 T95 L96 T100 N101 N102 | K94-I98 VanDerWaalsContact O-CG1 3.27Å; K94-I98 WeakPolarHBondContact O-CG1 3.3Å; K94-I98 PolarHBondContact O-N 3.41Å; T95-I98 PolarHBondContact O-N 2.88Å; L96-I98 PolarHBondContact O-N 3.22Å; I98-T100 VanDerWaalsContact C-N 3.34Å; I98-T100 PolarHBondContact O-N 3.31Å; I98-N101 PolarHBondContact O-N 2.95Å; I98-N102 WeakPolarHBondContact O-CA 3.43Å; I98-N102 WeakPolarHBondContact O-CB 3.23Å; I98-N102 PolarHBondContact O-N 3.07Å |
| 99 | M | 75.4 | Confident | 70.9 | Confident | 92 Ų | 92 | 96.3 Ų | 96.3 | 45% | 0.453 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67.9 | -31.1 | -180 | -70.5 | -70.6 | -66 | 0 | 0 | 112.8 | T95 L96 N102 P103 P104 | T95-M99 HydrophobicContact CG2-CG 4.27Å; T95-M99 VanDerWaalsContact O-CB 3.32Å; T95-M99 WeakPolarHBondContact O-CB 3.44Å; T95-M99 WeakPolarHBondContact O-CG 3.38Å; T95-M99 PolarHBondContact O-N 3.11Å; L96-M99 PolarHBondContact O-N 3.25Å; M99-N102 CarbonylContact O-C 3.57Å; M99-P103 WeakPolarHBondContact O-CA 3.48Å; M99-P103 VanDerWaalsContact O-N 3.12Å; M99-P104 VanDerWaalsContact CE-CD 3.49Å; M99-P104 HydrophobicContact CE-CG 3.67Å |
| 100 | T | 71.4 | Confident | 69.3 | Low | 98 Ų | 98 | 100 Ų | 100 | 60% | 0.601 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -77.5 | -36.7 | 177.9 | -47.3 | 0 | 0 | 0 | 0 | 111.4 | L96 L97 I98 | L96-T100 WeakPolarHBondContact O-CB 3.34Å; L96-T100 PolarHBondContact O-N 2.93Å; L96-T100 PolarHBondContact O-OG1 3.4Å; L97-T100 PolarHBondContact O-N 3.42Å; I98-T100 VanDerWaalsContact C-N 3.34Å; I98-T100 PolarHBondContact O-N 3.31Å |
| 101 | N | 75.1 | Confident | 68 | Low | 109 Ų | 109 | 101.9 Ų | 101.9 | 58% | 0.583 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -80.7 | -26.6 | 177.1 | -70.5 | -49.3 | 0 | 0 | 0 | 113 | L97 I98 | L97-N101 VanDerWaalsContact CD1-ND2 3.35Å; L97-N101 WeakPolarHBondContact CD1-ND2 3.37Å; L97-N101 WeakPolarHBondContact O-CB 3.35Å; L97-N101 PolarHBondContact O-N 2.95Å; L97-N101 VanDerWaalsContact O-N 3.08Å; L97-N101 PolarHBondContact O-ND2 2.6Å; I98-N101 PolarHBondContact O-N 2.95Å |
| 102 | N | 76.4 | Confident | 66.7 | Low | 116 Ų | 116 | 102 Ų | 102 | 62% | 0.62 | 56% | 0.555 | S | S | * | * | S | Bend | trans | -132.2 | 71 | 178 | -56.9 | -73.7 | 0 | 0 | 0 | 109.1 | I98 M99 | I98-N102 WeakPolarHBondContact O-CA 3.43Å; I98-N102 WeakPolarHBondContact O-CB 3.23Å; I98-N102 PolarHBondContact O-N 3.07Å; M99-N102 CarbonylContact O-C 3.57Å |
| 103 | P | 68.9 | Low | 65.6 | Low | 60 Ų | 60 | 105 Ų | 105 | 39% | 0.39 | 57% | 0.566 | S | S | . | * | P | Polyproline II helix | trans | -59.2 | 129 | 177 | 24.8 | -32.7 | 0 | 0 | 0 | 108.5 | M99 | M99-P103 WeakPolarHBondContact O-CA 3.48Å; M99-P103 VanDerWaalsContact O-N 3.12Å |
| 104 | P | 65.4 | Low | 64.6 | Low | 77 Ų | 77 | 109.1 Ų | 109.1 | 50% | 0.5 | 58% | 0.582 | S | S | . | * | P | Polyproline II helix | trans | -59.7 | 145.6 | 172.8 | 27.4 | -34.3 | 0 | 0 | 0 | 108.2 | M99 C106 | M99-P104 VanDerWaalsContact CE-CD 3.49Å; M99-P104 HydrophobicContact CE-CG 3.67Å; P104-C106 PolarHBondContact O-N 3.28Å |
| 105 | P | 63.6 | Low | 63.6 | Low | 49 Ų | 49 | 106.5 Ų | 106.5 | 32% | 0.318 | 58% | 0.575 | S | S | . | * | P | Polyproline II helix | trans | -56.6 | 137.5 | 174.9 | 23.6 | -31.9 | 0 | 0 | 0 | 109.5 | S107 P117 Y119 | P105-S107 PolarHBondContact O-N 3.27Å; P105-P117 HydrophobicContact CB-CB 3.35Å; P105-P117 HydrophobicContact CG-CB 3.72Å; P105-Y119 HydrophobicContact CB-CD1 4.41Å; P105-Y119 HydrophobicContact CB-CE1 4.35Å |
| 106 | C | 57.4 | Low | 62.7 | Low | 80 Ų | 80 | 106.2 Ų | 106.2 | 54% | 0.541 | 58% | 0.581 | S | S | . | * | P | Polyproline II helix | trans | -52.5 | 129.9 | -178.4 | -66.3 | 0 | 0 | 0 | 0 | 109.4 | P104 I108 K118 | P104-C106 PolarHBondContact O-N 3.28Å; C106-I108 PolarHBondContact O-N 2.79Å; C106-K118 PolarHBondContact N-O 3.27Å |
| 107 | S | 53.7 | Low | 61.6 | Low | 111 Ų | 111 | 104.2 Ų | 104.2 | 78% | 0.776 | 58% | 0.575 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 118.7 | 177.7 | 53.5 | 0 | 0 | 0 | 0 | 108.6 | P105 T109 | P105-S107 PolarHBondContact O-N 3.27Å; S107-T109 PolarHBondContact O-N 3.5Å |
| 108 | I | 54 | Low | 60.9 | Low | 88 Ų | 88 | 103.6 Ų | 103.6 | 45% | 0.451 | 57% | 0.567 | S | S | . | * | trans | -45.8 | 106.4 | 173.3 | -68.8 | 156.9 | 0 | 0 | 0 | 108 | C106 H110 D112 | C106-I108 PolarHBondContact O-N 2.79Å; I108-H110 PolarHBondContact O-N 2.94Å; I108-D112 WeakPolarHBondContact CG2-O 3.41Å | ||
| 109 | T | 53.4 | Low | 59.9 | Low | 105 Ų | 105 | 105.3 Ų | 105.3 | 64% | 0.644 | 57% | 0.568 | S | S | * | * | trans | -53.7 | 128.9 | 162.8 | 32.1 | 0 | 0 | 0 | 0 | 106.9 | S107 Q111 D112 | S107-T109 PolarHBondContact O-N 3.5Å; T109-Q111 PolarHBondContact O-N 3.22Å; T109-D112 PolarHBondContact O-N 2.79Å | ||
| 110 | H | 52.5 | Low | 59.1 | Low | 179 Ų | 179 | 107.1 Ų | 107.1 | 83% | 0.829 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54 | 2.2 | -172.3 | -78.2 | -79.6 | 0 | 0 | 0 | 116.7 | I108 | I108-H110 PolarHBondContact O-N 2.94Š|
| 111 | Q | 52.2 | Low | 58.7 | Low | 183 Ų | 183 | 104.8 Ų | 104.8 | 86% | 0.855 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.5 | -29.9 | 169.7 | -95.1 | -175.1 | -10.3 | 0 | 0 | 114.4 | T109 K113 | T109-Q111 PolarHBondContact O-N 3.22Å; Q111-K113 PolarHBondContact O-N 2.8Å |
| 112 | D | 51.6 | Low | 58.2 | Low | 70 Ų | 70 | 106 Ų | 106 | 37% | 0.374 | 56% | 0.562 | S | S | . | * | trans | -101.8 | 70.7 | -174.8 | -86.9 | -9.1 | 0 | 0 | 0 | 110.8 | I108 T109 E114 | I108-D112 WeakPolarHBondContact CG2-O 3.41Å; T109-D112 PolarHBondContact O-N 2.79Å; D112-E114 PolarHBondContact O-N 2.77Å; D112-E114 VanDerWaalsContact O-N 3.11Å | ||
| 113 | K | 52.5 | Low | 57.7 | Low | 187 Ų | 187 | 107.9 Ų | 107.9 | 81% | 0.813 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.6 | -4.7 | -179 | -74.2 | -177 | 178.3 | 179.5 | 0 | 115.2 | Q111 | Q111-K113 PolarHBondContact O-N 2.8Š|
| 114 | E | 51.4 | Low | 57.3 | Low | 195 Ų | 195 | 109.8 Ų | 109.8 | 91% | 0.911 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.6 | 3.7 | -178.7 | -71.1 | -177.8 | 171.7 | 0 | 0 | 114.4 | D112 | D112-E114 PolarHBondContact O-N 2.77Å; D112-E114 VanDerWaalsContact O-N 3.11Å |
| 115 | S | 55.6 | Low | 57.2 | Low | 37 Ų | 37 | 110.5 Ų | 110.5 | 26% | 0.259 | 57% | 0.572 | S | S | . | * | trans | -89.5 | 126 | -179.4 | -147.6 | 0 | 0 | 0 | 0 | 111 | K118 | S115-K118 VanDerWaalsContact OG-CE 3.29Å; S115-K118 WeakPolarHBondContact OG-CE 3.4Å; S115-K118 PolarHBondContact OG-NZ 3.33Å; S115-K118 VanDerWaalsContact OG-NZ 3.15Å | ||
| 116 | A | 56.7 | Low | 57.2 | Low | 75 Ų | 75 | 113 Ų | 113 | 62% | 0.62 | 58% | 0.582 | S | S | * | * | trans | -51.9 | 145.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | K118 | A116-K118 PolarHBondContact O-N 2.95Š| ||
| 117 | P | 55 | Low | 57.4 | Low | 67 Ų | 67 | 116.4 Ų | 116.4 | 44% | 0.435 | 59% | 0.588 | S | S | . | * | trans | -51.8 | 114.8 | 178.5 | 12.8 | -24.6 | 0 | 0 | 0 | 110.9 | P105 | P105-P117 HydrophobicContact CB-CB 3.35Å; P105-P117 HydrophobicContact CG-CB 3.72Å | ||
| 118 | K | 60.8 | Low | 57.7 | Low | 93 Ų | 93 | 113.2 Ų | 113.2 | 40% | 0.404 | 57% | 0.568 | S | S | . | * | trans | -88.9 | 120.7 | -180 | -73 | 173 | -174.9 | 162.6 | 0 | 109.2 | C106 S115 A116 F120 | C106-K118 PolarHBondContact N-O 3.27Å; S115-K118 VanDerWaalsContact OG-CE 3.29Å; S115-K118 WeakPolarHBondContact OG-CE 3.4Å; S115-K118 PolarHBondContact OG-NZ 3.33Å; S115-K118 VanDerWaalsContact OG-NZ 3.15Å; A116-K118 PolarHBondContact O-N 2.95Å; K118-F120 PolarHBondContact O-N 3.1Å | ||
| 119 | Y | 55.7 | Low | 58 | Low | 141 Ų | 141 | 114.1 Ų | 114.1 | 55% | 0.553 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -72.2 | -15.9 | 176.6 | -71.3 | -85.6 | 0 | 0 | 0 | 113.3 | P105 | P105-Y119 HydrophobicContact CB-CD1 4.41Å; P105-Y119 HydrophobicContact CB-CE1 4.35Å |
| 120 | F | 58.8 | Low | 58 | Low | 129 Ų | 129 | 116 Ų | 116 | 57% | 0.566 | 57% | 0.573 | S | S | * | * | S | Bend | trans | -134.3 | 144.6 | -176.1 | -60.8 | -75.7 | 0 | 0 | 0 | 111.4 | K118 L125 | K118-F120 PolarHBondContact O-N 3.1Å; F120-L125 HydrophobicContact CB-CD2 4.5Å; F120-L125 HydrophobicContact CB-CG 4.27Å |
| 121 | S | 61.3 | Low | 58.3 | Low | 50 Ų | 50 | 111.3 Ų | 111.3 | 35% | 0.35 | 56% | 0.561 | S | S | . | * | trans | -65.8 | 149.5 | 174.2 | 63.7 | 0 | 0 | 0 | 0 | 110.7 | E123 L124 L125 | S121-E123 PolarHBondContact O-N 2.98Å; S121-E123 VanDerWaalsContact O-N 3.16Å; S121-L124 PolarHBondContact O-N 2.74Å; S121-L124 VanDerWaalsContact O-N 3.12Å; S121-L124 PolarHBondContact OG-N 2.99Å; S121-L125 PolarHBondContact O-N 3.2Å | ||
| 122 | K | 65.6 | Low | 58.2 | Low | 134 Ų | 134 | 109.3 Ų | 109.3 | 58% | 0.583 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -55.7 | -32.7 | 176.4 | -65 | 178.8 | -176 | 174 | 0 | 111.2 | L125 L126 | K122-L125 PolarHBondContact O-N 3.33Å; K122-L126 WeakPolarHBondContact O-CB 3.5Å; K122-L126 WeakPolarHBondContact O-CD1 3.27Å; K122-L126 VanDerWaalsContact O-CG 3.23Å; K122-L126 WeakPolarHBondContact O-CG 3.33Å; K122-L126 PolarHBondContact O-N 2.84Å |
| 123 | E | 64.8 | Low | 58.1 | Low | 155 Ų | 155 | 111.9 Ų | 111.9 | 72% | 0.724 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -67 | -40.7 | 177.4 | -66.2 | 173.8 | -175 | 0 | 0 | 113.7 | S121 L126 K127 | S121-E123 PolarHBondContact O-N 2.98Å; S121-E123 VanDerWaalsContact O-N 3.16Å; E123-L126 PolarHBondContact O-N 2.93Å; E123-K127 WeakPolarHBondContact O-CB 3.32Å; E123-K127 PolarHBondContact O-N 3.41Å |
| 124 | L | 61.8 | Low | 57.8 | Low | 101 Ų | 101 | 111.6 Ų | 111.6 | 53% | 0.529 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -68.6 | -37.4 | 175.9 | -79.8 | 171.3 | 0 | 0 | 0 | 111.7 | S121 K127 A128 | S121-L124 PolarHBondContact O-N 2.74Å; S121-L124 VanDerWaalsContact O-N 3.12Å; S121-L124 PolarHBondContact OG-N 2.99Å; L124-K127 PolarHBondContact O-N 3.14Å; L124-A128 WeakPolarHBondContact O-CB 3.35Å; L124-A128 PolarHBondContact O-N 3.35Å |
| 125 | L | 63.2 | Low | 57.4 | Low | 92 Ų | 92 | 110.1 Ų | 110.1 | 48% | 0.482 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -66 | -41.4 | 174.4 | -70.2 | 170.6 | 0 | 0 | 0 | 111.7 | F120 S121 K122 A128 M129 | F120-L125 HydrophobicContact CB-CD2 4.5Å; F120-L125 HydrophobicContact CB-CG 4.27Å; S121-L125 PolarHBondContact O-N 3.2Å; K122-L125 PolarHBondContact O-N 3.33Å; L125-A128 PolarHBondContact O-N 3.25Å; L125-M129 WeakPolarHBondContact O-CB 3.25Å; L125-M129 PolarHBondContact O-N 2.94Å |
| 126 | L | 63.5 | Low | 56.8 | Low | 102 Ų | 102 | 117.7 Ų | 117.7 | 53% | 0.534 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -64.1 | -42.6 | 175.4 | -76.2 | 165.7 | 0 | 0 | 0 | 111.6 | K122 E123 A128 M129 E130 | K122-L126 WeakPolarHBondContact O-CB 3.5Å; K122-L126 WeakPolarHBondContact O-CD1 3.27Å; K122-L126 VanDerWaalsContact O-CG 3.23Å; K122-L126 WeakPolarHBondContact O-CG 3.33Å; K122-L126 PolarHBondContact O-N 2.84Å; E123-L126 PolarHBondContact O-N 2.93Å; L126-A128 VanDerWaalsContact C-N 3.35Å; L126-A128 PolarHBondContact O-N 2.95Å; L126-M129 PolarHBondContact O-N 3.45Å; L126-E130 WeakPolarHBondContact O-CB 3.12Å; L126-E130 PolarHBondContact O-N 3.11Å |
| 127 | K | 61.7 | Low | 56.3 | Low | 151 Ų | 151 | 120 Ų | 120 | 66% | 0.657 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -66.3 | -36.3 | 176.5 | -163.8 | 170.9 | -174.8 | 174.9 | 0 | 112.5 | E123 L124 S131 | E123-K127 WeakPolarHBondContact O-CB 3.32Å; E123-K127 PolarHBondContact O-N 3.41Å; L124-K127 PolarHBondContact O-N 3.14Å; K127-S131 PolarHBondContact O-N 3.17Å |
| 128 | A | 59.6 | Low | 55.7 | Low | 44 Ų | 44 | 123.2 Ų | 123.2 | 36% | 0.364 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -67.2 | -42.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | L124 L125 L126 S131 H132 | L124-A128 WeakPolarHBondContact O-CB 3.35Å; L124-A128 PolarHBondContact O-N 3.35Å; L125-A128 PolarHBondContact O-N 3.25Å; L126-A128 VanDerWaalsContact C-N 3.35Å; L126-A128 PolarHBondContact O-N 2.95Å; A128-S131 PolarHBondContact O-N 3.42Å; A128-S131 PolarHBondContact O-OG 3.04Å; A128-H132 PolarHBondContact O-CD2 3.41Å; A128-H132 PolarHBondContact O-N 3.36Å |
| 129 | M | 59.7 | Low | 55.3 | Low | 106 Ų | 106 | 127 Ų | 127 | 52% | 0.522 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -62.5 | -45.8 | 172.8 | -98.7 | 176.2 | 67.8 | 0 | 0 | 112.4 | L125 L126 S131 H132 H133 | L125-M129 WeakPolarHBondContact O-CB 3.25Å; L125-M129 PolarHBondContact O-N 2.94Å; L126-M129 PolarHBondContact O-N 3.45Å; M129-S131 VanDerWaalsContact C-N 3.29Å; M129-S131 PolarHBondContact O-N 3.4Å; M129-H132 CarbonylContact O-C 3.51Å; M129-H132 WeakPolarHBondContact O-CA 3.36Å; M129-H132 PolarHBondContact O-N 3.34Å; M129-H133 PolarHBondContact O-CD2 3.22Å; M129-H133 VanDerWaalsContact O-CG 3.23Å; M129-H133 PolarHBondContact O-N 2.89Å; M129-H133 VanDerWaalsContact O-N 3.12Å; M129-H133 PolarHBondContact O-NE2 2.85Å |
| 130 | E | 54.9 | Low | 54.6 | Low | 145 Ų | 145 | 127.3 Ų | 127.3 | 68% | 0.678 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -58.6 | -38.6 | 174.9 | -96.5 | 178.8 | 155.9 | 0 | 0 | 112.4 | L126 H132 H133 | L126-E130 WeakPolarHBondContact O-CB 3.12Å; L126-E130 PolarHBondContact O-N 3.11Å; E130-H132 PolarHBondContact O-N 3.07Å; E130-H133 PolarHBondContact O-N 3.03Å |
| 131 | S | 57.5 | Low | 54.3 | Low | 81 Ų | 81 | 129.2 Ų | 129.2 | 57% | 0.566 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -68 | -24.3 | 174.5 | 76.5 | 0 | 0 | 0 | 0 | 113.5 | K127 A128 M129 | K127-S131 PolarHBondContact O-N 3.17Å; A128-S131 PolarHBondContact O-N 3.42Å; A128-S131 PolarHBondContact O-OG 3.04Å; M129-S131 VanDerWaalsContact C-N 3.29Å; M129-S131 PolarHBondContact O-N 3.4Å |
| 132 | H | 51.4 | Low | 53.3 | Low | 140 Ų | 140 | 137.7 Ų | 137.7 | 65% | 0.648 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -88.3 | -9.8 | 176.3 | -72.8 | -51.8 | 0 | 0 | 0 | 113.8 | A128 M129 E130 Q134 H135 | A128-H132 PolarHBondContact O-CD2 3.41Å; A128-H132 PolarHBondContact O-N 3.36Å; M129-H132 CarbonylContact O-C 3.51Å; M129-H132 WeakPolarHBondContact O-CA 3.36Å; M129-H132 PolarHBondContact O-N 3.34Å; E130-H132 PolarHBondContact O-N 3.07Å; H132-Q134 PolarHBondContact O-N 2.98Å; H132-H135 PolarHBondContact O-N 3.12Å |
| 133 | H | 48.4 | Very low | 52.6 | Low | 125 Ų | 125 | 139 Ų | 139 | 58% | 0.579 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.2 | 6.4 | -178.3 | -68.4 | -37 | 0 | 0 | 0 | 115.2 | M129 E130 H135 | M129-H133 PolarHBondContact O-CD2 3.22Å; M129-H133 VanDerWaalsContact O-CG 3.23Å; M129-H133 PolarHBondContact O-N 2.89Å; M129-H133 VanDerWaalsContact O-N 3.12Å; M129-H133 PolarHBondContact O-NE2 2.85Å; E130-H133 PolarHBondContact O-N 3.03Å; H133-H135 VanDerWaalsContact C-N 3.29Å |
| 134 | Q | 46 | Very low | 51.6 | Low | 181 Ų | 181 | 137.1 Ų | 137.1 | 85% | 0.846 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.7 | -4.6 | 167.7 | -73.5 | -161.4 | -9.3 | 0 | 0 | 114.2 | H132 | H132-Q134 PolarHBondContact O-N 2.98Š|
| 135 | H | 44 | Very low | 50.9 | Low | 164 Ų | 164 | 143.7 Ų | 143.7 | 76% | 0.759 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -110.2 | 122.5 | 171.7 | -69.9 | -66.6 | 0 | 0 | 0 | 110.8 | H132 H133 | H132-H135 PolarHBondContact O-N 3.12Å; H133-H135 VanDerWaalsContact C-N 3.29Å |
| 136 | K | 42.7 | Very low | 50 | Low | 195 Ų | 195 | 146.5 Ų | 146.5 | 85% | 0.848 | 73% | 0.725 | S | S | * | * | trans | -48.1 | 139.1 | 176.6 | -73.7 | 177.1 | 173.4 | 179.7 | 0 | 111.1 | T138 | K136-T138 PolarHBondContact O-N 2.92Š| ||
| 137 | P | 45.7 | Very low | 49 | Very low | 123 Ų | 123 | 146.7 Ų | 146.7 | 80% | 0.799 | 73% | 0.732 | S | S | * | * | trans | -79.9 | 111.6 | 169.3 | 32.4 | -26.8 | 0 | 0 | 0 | 107.7 | ||||
| 138 | T | 43.7 | Very low | 48.5 | Very low | 136 Ų | 136 | 148.7 Ų | 148.7 | 83% | 0.834 | 74% | 0.743 | S | S | * | * | trans | -85.9 | 113.3 | 155.1 | -64 | 0 | 0 | 0 | 0 | 105.9 | K136 D140 | K136-T138 PolarHBondContact O-N 2.92Å; T138-D140 PolarHBondContact O-N 3.04Å | ||
| 139 | E | 50.8 | Low | 48.1 | Very low | 173 Ų | 173 | 154.3 Ų | 154.3 | 81% | 0.808 | 76% | 0.76 | S | S | * | * | trans | -52.4 | 117.1 | 171.5 | -64 | 176.2 | 162.9 | 0 | 0 | 109.5 | ||||
| 140 | D | 41.4 | Very low | 48 | Very low | 146 Ų | 146 | 159.5 Ų | 159.5 | 78% | 0.781 | 78% | 0.779 | S | S | * | * | trans | -170.1 | 111.9 | 130.1 | -96 | -26.6 | 0 | 0 | 0 | 110.6 | T138 W142 | T138-D140 PolarHBondContact O-N 3.04Å; D140-W142 VanDerWaalsContact C-N 3.35Å; D140-W142 PolarHBondContact O-N 2.97Å | ||
| 141 | L | 53.5 | Low | 47.6 | Very low | 169 Ų | 169 | 160.9 Ų | 160.9 | 89% | 0.885 | 78% | 0.783 | S | S | * | * | trans | -72.9 | 76.1 | 174 | -80.7 | 159.5 | 0 | 0 | 0 | 110.9 | ||||
| 142 | W | 40.3 | Very low | 47.1 | Very low | 228 Ų | 228 | 164.8 Ų | 164.8 | 86% | 0.864 | 80% | 0.797 | S | S | * | * | trans | -144.1 | 112.1 | 163.6 | -62.8 | 90.4 | 0 | 0 | 0 | 110.8 | D140 | D140-W142 VanDerWaalsContact C-N 3.35Å; D140-W142 PolarHBondContact O-N 2.97Å | ||
| 143 | L | 49.8 | Very low | 47 | Very low | 161 Ų | 161 | 170.2 Ų | 170.2 | 84% | 0.843 | 81% | 0.812 | S | S | * | * | trans | -47.3 | 140.1 | 160.1 | -71.4 | 164.1 | 0 | 0 | 0 | 108.6 | R145 | L143-R145 PolarHBondContact O-N 3.45Š| ||
| 144 | P | 43.9 | Very low | 47 | Very low | 116 Ų | 116 | 169 Ų | 169 | 75% | 0.753 | 82% | 0.817 | S | S | * | * | trans | -63.4 | 99.3 | 176.8 | -14.1 | 26.7 | 0 | 0 | 0 | 108.9 | M146 | P144-M146 VanDerWaalsContact C-N 3.32Å; P144-M146 PolarHBondContact O-N 3.44Å | ||
| 145 | R | 46.5 | Very low | 47.3 | Very low | 240 Ų | 240 | 170.4 Ų | 170.4 | 91% | 0.906 | 82% | 0.82 | S | S | * | * | trans | -71.2 | 95.5 | 171.3 | -173.6 | 176.8 | 176.9 | -173.2 | -0.6 | 106.8 | L143 | L143-R145 PolarHBondContact O-N 3.45Š| ||
| 146 | M | 44.6 | Very low | 47.5 | Very low | 151 Ų | 151 | 170.4 Ų | 170.4 | 74% | 0.744 | 83% | 0.825 | S | S | * | * | trans | -52 | 130.5 | 176.7 | -69.3 | -68.6 | -80.1 | 0 | 0 | 109.8 | P144 Q148 | P144-M146 VanDerWaalsContact C-N 3.32Å; P144-M146 PolarHBondContact O-N 3.44Å; M146-Q148 PolarHBondContact O-N 3.28Å | ||
| 147 | P | 42.2 | Very low | 48.2 | Very low | 106 Ų | 106 | 169.8 Ų | 169.8 | 69% | 0.688 | 82% | 0.822 | S | S | * | * | trans | -68.4 | 111.4 | 178.5 | 25.4 | -30.7 | 0 | 0 | 0 | 108.9 | K149 | P147-K149 PolarHBondContact O-N 3.48Š| ||
| 148 | Q | 53 | Low | 48.2 | Very low | 192 Ų | 192 | 169.4 Ų | 169.4 | 90% | 0.897 | 82% | 0.82 | S | S | * | * | trans | -69.6 | 78.4 | 166.5 | -75.4 | -169.6 | -7.7 | 0 | 0 | 109.2 | M146 K150 | M146-Q148 PolarHBondContact O-N 3.28Å; Q148-K150 PolarHBondContact O-N 2.91Å; Q148-K150 VanDerWaalsContact O-N 3.13Å | ||
| 149 | K | 50.2 | Low | 48.5 | Very low | 162 Ų | 162 | 170 Ų | 170 | 70% | 0.704 | 82% | 0.817 | S | S | * | * | trans | -67.7 | 107.2 | 160.3 | -77.2 | -174.5 | 176.3 | 179.2 | 0 | 106.9 | P147 K151 | P147-K149 PolarHBondContact O-N 3.48Å; K149-K151 HydrophobicContact CB-CG 4.29Å; K149-K151 PolarHBondContact O-N 3.48Å | ||
| 150 | K | 57 | Low | 48.2 | Very low | 216 Ų | 216 | 169.8 Ų | 169.8 | 94% | 0.939 | 81% | 0.813 | S | S | * | * | trans | -56.4 | 89.8 | 161 | -74 | 178.1 | 178.3 | 177.6 | 0 | 107.8 | Q148 | Q148-K150 PolarHBondContact O-N 2.91Å; Q148-K150 VanDerWaalsContact O-N 3.13Å | ||
| 151 | K | 46.2 | Very low | 48.3 | Very low | 173 Ų | 173 | 168.6 Ų | 168.6 | 75% | 0.752 | 81% | 0.813 | S | S | * | * | trans | -93.5 | 122.1 | 167.5 | -69.5 | -155.5 | 176.7 | -171.9 | 0 | 107.6 | K149 | K149-K151 HydrophobicContact CB-CG 4.29Å; K149-K151 PolarHBondContact O-N 3.48Å | ||
| 152 | L | 46.8 | Very low | 47.9 | Very low | 163 Ų | 163 | 166.6 Ų | 166.6 | 85% | 0.853 | 80% | 0.803 | S | S | * | * | trans | -36.9 | 138.5 | 166 | -110 | 81.6 | 0 | 0 | 0 | 110.2 | S154 | L152-S154 PolarHBondContact O-N 3.45Š| ||
| 153 | R | 50.5 | Low | 48 | Very low | 255 Ų | 255 | 161.7 Ų | 161.7 | 96% | 0.962 | 80% | 0.798 | S | S | * | * | trans | -47.2 | 98.3 | 171.6 | -81.4 | -179.4 | 173.6 | 178.4 | -1.7 | 109.8 | ||||
| 154 | S | 47.9 | Very low | 47.9 | Very low | 98 Ų | 98 | 160.2 Ų | 160.2 | 69% | 0.685 | 79% | 0.79 | S | S | * | * | trans | -86.4 | 128.7 | 158.7 | 53.8 | 0 | 0 | 0 | 0 | 106.2 | L152 L156 | L152-S154 PolarHBondContact O-N 3.45Å; S154-L156 PolarHBondContact O-N 2.98Å | ||
| 155 | K | 53.3 | Low | 48 | Very low | 211 Ų | 211 | 158.9 Ų | 158.9 | 92% | 0.917 | 78% | 0.784 | S | S | * | * | trans | -46.5 | 108.7 | 178.4 | -74.1 | 173.3 | 174.3 | 178.4 | 0 | 109 | K157 | K155-K157 PolarHBondContact O-N 3.35Å; K155-K157 VanDerWaalsContact O-N 3.15Å | ||
| 156 | L | 47.9 | Very low | 47.8 | Very low | 164 Ų | 164 | 154.1 Ų | 154.1 | 86% | 0.859 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 117.3 | 172.1 | -74.1 | 164.6 | 0 | 0 | 0 | 107.2 | S154 | S154-L156 PolarHBondContact O-N 2.98Š|
| 157 | K | 56.3 | Low | 48.1 | Very low | 183 Ų | 183 | 152.2 Ų | 152.2 | 80% | 0.796 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 134.6 | 161.7 | -72.4 | -175.7 | 175.9 | -177 | 0 | 107.2 | K155 I159 | K155-K157 PolarHBondContact O-N 3.35Å; K155-K157 VanDerWaalsContact O-N 3.15Å; K157-I159 PolarHBondContact O-N 3.01Å; K157-I159 VanDerWaalsContact O-N 3.15Å |
| 158 | P | 47.5 | Very low | 48.4 | Very low | 115 Ų | 115 | 153.4 Ų | 153.4 | 75% | 0.747 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 120.7 | 172.8 | 26.8 | -29.9 | 0 | 0 | 0 | 107.5 | F160 | P158-F160 PolarHBondContact O-N 3.47Å; P158-F160 VanDerWaalsContact O-N 3.11Å |
| 159 | I | 49.6 | Very low | 48.3 | Very low | 149 Ų | 149 | 150.2 Ų | 150.2 | 76% | 0.764 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -73.8 | 5.2 | -177.6 | -71.7 | 170.6 | 0 | 0 | 0 | 111.9 | K157 | K157-I159 PolarHBondContact O-N 3.01Å; K157-I159 VanDerWaalsContact O-N 3.15Å |
| 160 | F | 43.2 | Very low | 48.4 | Very low | 167 Ų | 167 | 147.2 Ų | 147.2 | 73% | 0.732 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -141.7 | 128.4 | 172.1 | -77.1 | -86 | 0 | 0 | 0 | 110.4 | P158 L162 | P158-F160 PolarHBondContact O-N 3.47Å; P158-F160 VanDerWaalsContact O-N 3.11Å; F160-L162 PolarHBondContact O-N 3.17Å |
| 161 | P | 43.9 | Very low | 48.3 | Very low | 122 Ų | 122 | 146.5 Ų | 146.5 | 79% | 0.792 | 77% | 0.767 | S | S | * | * | trans | -70.7 | 91.1 | 162.4 | 29.1 | -28.2 | 0 | 0 | 0 | 107.1 | T163 | P161-T163 VanDerWaalsContact C-N 3.33Å; P161-T163 PolarHBondContact O-N 3.21Å | ||
| 162 | L | 44.3 | Very low | 48.3 | Very low | 126 Ų | 126 | 148.1 Ų | 148.1 | 66% | 0.66 | 77% | 0.769 | S | S | * | * | trans | -77.4 | 95 | 159 | -163.2 | 82.2 | 0 | 0 | 0 | 105.5 | F160 L164 | F160-L162 PolarHBondContact O-N 3.17Å; L162-L164 VanDerWaalsContact C-N 3.26Å; L162-L164 PolarHBondContact O-N 3.42Å | ||
| 163 | T | 44.3 | Very low | 48.6 | Very low | 125 Ų | 125 | 148.3 Ų | 148.3 | 77% | 0.767 | 77% | 0.765 | S | S | * | * | trans | -65.3 | 96.8 | 163.3 | 46.3 | 0 | 0 | 0 | 0 | 106.5 | P161 S165 | P161-T163 VanDerWaalsContact C-N 3.33Å; P161-T163 PolarHBondContact O-N 3.21Å; T163-S165 VanDerWaalsContact C-N 3.27Å; T163-S165 PolarHBondContact O-N 3.38Å | ||
| 164 | L | 46.5 | Very low | 48.7 | Very low | 130 Ų | 130 | 144.7 Ų | 144.7 | 68% | 0.681 | 76% | 0.759 | S | S | * | * | trans | -66.4 | 98.5 | 160 | -165.3 | 82.5 | 0 | 0 | 0 | 104.9 | L162 D166 | L162-L164 VanDerWaalsContact C-N 3.26Å; L162-L164 PolarHBondContact O-N 3.42Å; L164-D166 PolarHBondContact O-N 3.43Å | ||
| 165 | S | 46 | Very low | 48.9 | Very low | 89 Ų | 89 | 149.1 Ų | 149.1 | 62% | 0.622 | 76% | 0.761 | S | S | * | * | trans | -75.7 | 115.9 | 170 | -162.1 | 0 | 0 | 0 | 0 | 106.5 | T163 D167 | T163-S165 VanDerWaalsContact C-N 3.27Å; T163-S165 PolarHBondContact O-N 3.38Å; S165-D167 PolarHBondContact O-N 3.26Å | ||
| 166 | D | 42.7 | Very low | 48.8 | Very low | 140 Ų | 140 | 147.5 Ų | 147.5 | 75% | 0.749 | 75% | 0.754 | S | S | * | * | trans | -74.2 | 52.6 | -179.4 | -70.8 | -39.2 | 0 | 0 | 0 | 112 | L164 | L164-D166 PolarHBondContact O-N 3.43Š| ||
| 167 | D | 51.4 | Low | 49.5 | Very low | 110 Ų | 110 | 150.6 Ų | 150.6 | 59% | 0.588 | 75% | 0.754 | S | S | * | * | trans | -114.9 | 115.7 | 173.4 | -86.5 | -38.6 | 0 | 0 | 0 | 110.9 | S165 T169 | S165-D167 PolarHBondContact O-N 3.26Å; D167-T169 PolarHBondContact O-N 3.04Å; D167-T169 VanDerWaalsContact O-N 3.08Å | ||
| 168 | P | 48.8 | Very low | 49.6 | Very low | 132 Ų | 132 | 150.9 Ų | 150.9 | 86% | 0.857 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | 12.3 | -173.7 | 29.9 | -33.9 | 0 | 0 | 0 | 114.7 | ||
| 169 | T | 49.4 | Very low | 50.1 | Low | 125 Ų | 125 | 148 Ų | 148 | 77% | 0.767 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.1 | -9.6 | -170.7 | 45.4 | 0 | 0 | 0 | 0 | 116.4 | D167 K171 | D167-T169 PolarHBondContact O-N 3.04Å; D167-T169 VanDerWaalsContact O-N 3.08Å; T169-K171 PolarHBondContact O-N 3.43Å |
| 170 | S | 52.6 | Low | 51 | Low | 98 Ų | 98 | 143.9 Ų | 143.9 | 69% | 0.685 | 72% | 0.721 | S | S | * | * | trans | -91.4 | 109.4 | 178.5 | 69.9 | 0 | 0 | 0 | 0 | 111.8 | R172 | S170-R172 PolarHBondContact O-N 3.4Š| ||
| 171 | K | 54.5 | Low | 52 | Low | 201 Ų | 201 | 142 Ų | 142 | 87% | 0.874 | 72% | 0.718 | S | S | * | * | trans | -57 | 109.5 | 167.7 | -69.6 | 179.4 | 179.9 | 176.8 | 0 | 108.8 | T169 E173 | T169-K171 PolarHBondContact O-N 3.43Å; K171-E173 PolarHBondContact O-N 2.98Å | ||
| 172 | R | 46.4 | Very low | 53 | Low | 207 Ų | 207 | 141.3 Ų | 141.3 | 78% | 0.781 | 71% | 0.708 | S | S | * | * | trans | -74.5 | 93 | -178.6 | -163.6 | 178.6 | -170.1 | -177.1 | 4.5 | 109.2 | S170 Q174 | S170-R172 PolarHBondContact O-N 3.4Å; R172-Q174 PolarHBondContact O-N 3.36Å | ||
| 173 | E | 53.7 | Low | 53.9 | Low | 167 Ų | 167 | 139.9 Ų | 139.9 | 78% | 0.78 | 70% | 0.701 | S | S | * | * | trans | -61.2 | 127.3 | 165.7 | -76.8 | 178.1 | 168.8 | 0 | 0 | 109 | K171 W175 | K171-E173 PolarHBondContact O-N 2.98Å; E173-W175 VanDerWaalsContact O-CD1 3.25Å; E173-W175 PolarHBondContact O-N 2.73Å | ||
| 174 | Q | 52.2 | Low | 54.6 | Low | 179 Ų | 179 | 141.4 Ų | 141.4 | 84% | 0.836 | 70% | 0.697 | S | S | * | * | trans | -74.6 | 115.7 | -175.9 | -177.1 | 174.9 | -17.4 | 0 | 0 | 109 | R172 F176 | R172-Q174 PolarHBondContact O-N 3.36Å; Q174-F176 PolarHBondContact O-N 3.35Å | ||
| 175 | W | 51.5 | Low | 55.1 | Low | 191 Ų | 191 | 142.2 Ų | 142.2 | 72% | 0.723 | 70% | 0.695 | S | S | * | * | trans | -68.8 | 118 | -179.8 | -68.5 | 62.1 | 0 | 0 | 0 | 109.6 | E173 R177 T180 | E173-W175 VanDerWaalsContact O-CD1 3.25Å; E173-W175 PolarHBondContact O-N 2.73Å; W175-R177 PolarHBondContact O-N 2.83Å; W175-T180 HydrophobicContact CZ3-CG2 4.45Å | ||
| 176 | F | 52.5 | Low | 55.5 | Low | 177 Ų | 177 | 142.7 Ų | 142.7 | 78% | 0.776 | 70% | 0.699 | S | S | * | * | trans | -57.7 | 125.6 | 162.3 | -74.1 | -88.3 | 0 | 0 | 0 | 107.6 | Q174 F178 S179 | Q174-F176 PolarHBondContact O-N 3.35Å; F176-F178 PolarHBondContact O-N 2.76Å; F176-S179 PolarHBondContact O-N 3.43Å | ||
| 177 | R | 61.4 | Low | 56.2 | Low | 229 Ų | 229 | 144.1 Ų | 144.1 | 86% | 0.864 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | -5.2 | -168 | -72.1 | -168.2 | 169.1 | -133.4 | -0.5 | 115.7 | W175 | W175-R177 PolarHBondContact O-N 2.83Š|
| 178 | F | 58.4 | Low | 56.5 | Low | 190 Ų | 190 | 140.7 Ų | 140.7 | 83% | 0.833 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.7 | 10.7 | -171.8 | -59.1 | -71.8 | 0 | 0 | 0 | 114.5 | F176 | F176-F178 PolarHBondContact O-N 2.76Š|
| 179 | S | 58.9 | Low | 56.8 | Low | 54 Ų | 54 | 143.4 Ų | 143.4 | 38% | 0.378 | 69% | 0.69 | S | S | . | * | trans | -140.9 | 122.4 | 176.5 | -56.1 | 0 | 0 | 0 | 0 | 110.2 | F176 D183 | F176-S179 PolarHBondContact O-N 3.43Å; S179-D183 WeakPolarHBondContact CA-OD2 3.17Å | ||
| 180 | T | 68 | Low | 57.4 | Low | 63 Ų | 63 | 147.1 Ų | 147.1 | 39% | 0.387 | 69% | 0.691 | S | S | . | * | trans | -91.4 | 156.2 | 169.9 | 44.3 | 0 | 0 | 0 | 0 | 110.1 | W175 N182 D183 | W175-T180 HydrophobicContact CZ3-CG2 4.45Å; T180-N182 PolarHBondContact O-N 2.87Å; T180-D183 PolarHBondContact N-OD2 3.15Å; T180-D183 WeakPolarHBondContact O-CB 3.43Å; T180-D183 PolarHBondContact O-N 3.49Å; T180-D183 PolarHBondContact OG1-OD2 2.86Å | ||
| 181 | D | 64.9 | Low | 58.3 | Low | 127 Ų | 127 | 145.6 Ų | 145.6 | 68% | 0.679 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.8 | -21.5 | 174.7 | -73.2 | -17.3 | 0 | 0 | 0 | 113.2 | ||
| 182 | N | 64.4 | Low | 59.4 | Low | 108 Ų | 108 | 145 Ų | 145 | 58% | 0.578 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | -23.6 | 174.9 | -67 | -34.5 | 0 | 0 | 0 | 113.5 | T180 F184 K185 | T180-N182 PolarHBondContact O-N 2.87Å; N182-F184 PolarHBondContact O-N 3.15Å; N182-K185 PolarHBondContact O-N 2.94Å; N182-K185 VanDerWaalsContact O-N 3.1Å; N182-K185 PolarHBondContact OD1-NZ 3.38Å |
| 183 | D | 62.5 | Low | 60.9 | Low | 95 Ų | 95 | 140.3 Ų | 140.3 | 51% | 0.508 | 67% | 0.672 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -68.4 | -22.9 | 176 | -63.5 | -42.2 | 0 | 0 | 0 | 111.6 | S179 T180 | S179-D183 WeakPolarHBondContact CA-OD2 3.17Å; T180-D183 PolarHBondContact N-OD2 3.15Å; T180-D183 WeakPolarHBondContact O-CB 3.43Å; T180-D183 PolarHBondContact O-N 3.49Å; T180-D183 PolarHBondContact OG1-OD2 2.86Å |
| 184 | F | 59.3 | Low | 62.1 | Low | 157 Ų | 157 | 139.3 Ų | 139.3 | 69% | 0.689 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.8 | -4 | 174.8 | -59.4 | -78 | 0 | 0 | 0 | 113.4 | N182 S186 | N182-F184 PolarHBondContact O-N 3.15Å; F184-S186 PolarHBondContact O-N 3Å |
| 185 | K | 57.9 | Low | 63.4 | Low | 148 Ų | 148 | 133.4 Ų | 133.4 | 64% | 0.643 | 64% | 0.644 | S | S | * | * | trans | -88.7 | 32.1 | 176.5 | -66.4 | -174.6 | -174.6 | 171.4 | 0 | 113.2 | N182 E187 | N182-K185 PolarHBondContact O-N 2.94Å; N182-K185 VanDerWaalsContact O-N 3.1Å; N182-K185 PolarHBondContact OD1-NZ 3.38Å; K185-E187 VanDerWaalsContact C-N 3.33Å; K185-E187 PolarHBondContact O-N 2.88Å | ||
| 186 | S | 54.3 | Low | 64.8 | Low | 99 Ų | 99 | 128.3 Ų | 128.3 | 69% | 0.692 | 63% | 0.631 | S | S | * | * | trans | -72.1 | 95.9 | 165.5 | 58.9 | 0 | 0 | 0 | 0 | 108.1 | F184 G188 | F184-S186 PolarHBondContact O-N 3Å; S186-G188 PolarHBondContact O-N 2.93Å | ||
| 187 | E | 56.4 | Low | 66.1 | Low | 169 Ų | 169 | 128.5 Ų | 128.5 | 79% | 0.79 | 63% | 0.626 | S | S | * | * | trans | -59.2 | 93.6 | 154.5 | -82.5 | -172.9 | 167.5 | 0 | 0 | 106.2 | K185 K189 | K185-E187 VanDerWaalsContact C-N 3.33Å; K185-E187 PolarHBondContact O-N 2.88Å; E187-K189 VanDerWaalsContact C-N 3.3Å; E187-K189 PolarHBondContact O-N 3.39Å | ||
| 188 | G | 57.6 | Low | 67.1 | Low | 39 Ų | 39 | 121 Ų | 121 | 40% | 0.402 | 60% | 0.602 | S | S | . | * | trans | -58.1 | 97 | 175.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | S186 Y190 | S186-G188 PolarHBondContact O-N 2.93Å; G188-Y190 WeakPolarHBondContact O-CD2 3.42Å; G188-Y190 PolarHBondContact O-N 3.28Å | ||
| 189 | K | 55.6 | Low | 68.2 | Low | 188 Ų | 188 | 116.3 Ų | 116.3 | 82% | 0.817 | 58% | 0.582 | S | S | * | * | trans | -72.6 | 76.5 | 170.2 | -71 | -173.6 | -177.9 | 178.3 | 0 | 107.5 | E187 S191 | E187-K189 VanDerWaalsContact C-N 3.3Å; E187-K189 PolarHBondContact O-N 3.39Å; K189-S191 PolarHBondContact O-N 3.05Å | ||
| 190 | Y | 62.3 | Low | 69.4 | Low | 203 Ų | 203 | 119.1 Ų | 119.1 | 80% | 0.796 | 59% | 0.588 | S | S | * | * | trans | -65.7 | 109.5 | 173.3 | -61.7 | -75.1 | 0 | 0 | 0 | 107.8 | G188 K192 | G188-Y190 WeakPolarHBondContact O-CD2 3.42Å; G188-Y190 PolarHBondContact O-N 3.28Å; Y190-K192 PolarHBondContact O-N 2.91Å | ||
| 191 | S | 71.4 | Confident | 70.2 | Confident | 67 Ų | 67 | 124.1 Ų | 124.1 | 47% | 0.469 | 60% | 0.604 | S | S | . | * | trans | -59.3 | 111.2 | 172.6 | 172.8 | 0 | 0 | 0 | 0 | 108.3 | K189 V193 Y194 A195 | K189-S191 PolarHBondContact O-N 3.05Å; S191-V193 PolarHBondContact O-N 2.96Å; S191-V193 VanDerWaalsContact O-N 3.12Å; S191-Y194 WeakPolarHBondContact O-CA 3.48Å; S191-Y194 WeakPolarHBondContact O-CB 3.21Å; S191-Y194 PolarHBondContact O-N 3.24Å; S191-Y194 PolarHBondContact OG-N 3.44Å; S191-A195 PolarHBondContact O-N 3.45Å | ||
| 192 | K | 77.7 | Confident | 71.1 | Confident | 187 Ų | 187 | 123.8 Ų | 123.8 | 81% | 0.813 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -51.8 | -34.9 | 175.4 | -69.9 | 179.4 | 179.4 | 176 | 0 | 111.2 | Y190 A195 L196 | Y190-K192 PolarHBondContact O-N 2.91Å; K192-A195 PolarHBondContact O-N 3.36Å; K192-L196 VanDerWaalsContact O-CB 3.3Å; K192-L196 WeakPolarHBondContact O-CB 3.48Å; K192-L196 PolarHBondContact O-N 2.89Å |
| 193 | V | 77.9 | Confident | 72 | Confident | 109 Ų | 109 | 124.6 Ų | 124.6 | 66% | 0.661 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -65.6 | -42.5 | 177.2 | -177 | 0 | 0 | 0 | 0 | 111.3 | S191 L196 R197 | S191-V193 PolarHBondContact O-N 2.96Å; S191-V193 VanDerWaalsContact O-N 3.12Å; V193-L196 PolarHBondContact O-N 3.38Å; V193-R197 WeakPolarHBondContact O-CB 3.42Å; V193-R197 PolarHBondContact O-N 2.85Å |
| 194 | Y | 77.9 | Confident | 72.7 | Confident | 147 Ų | 147 | 125 Ų | 125 | 58% | 0.576 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -66.3 | -43.6 | 177.2 | -175.4 | -98.4 | 0 | 0 | 0 | 111.6 | S191 L196 R197 M198 | S191-Y194 WeakPolarHBondContact O-CA 3.48Å; S191-Y194 WeakPolarHBondContact O-CB 3.21Å; S191-Y194 PolarHBondContact O-N 3.24Å; S191-Y194 PolarHBondContact OG-N 3.44Å; Y194-L196 VanDerWaalsContact C-N 3.34Å; Y194-L196 PolarHBondContact O-N 2.88Å; Y194-R197 PolarHBondContact O-N 2.78Å; Y194-M198 HydrophobicContact CD1-CG 4.21Å; Y194-M198 HydrophobicContact CE1-CG 3.81Å; Y194-M198 HydrophobicContact CE2-CG 4.49Å; Y194-M198 WeakPolarHBondContact O-CG 3.29Å; Y194-M198 PolarHBondContact O-N 2.88Å |
| 195 | A | 81.2 | Confident | 73.7 | Confident | 54 Ų | 54 | 125.9 Ų | 125.9 | 45% | 0.446 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -59.4 | -45.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | S191 K192 R197 M198 Q199 | S191-A195 PolarHBondContact O-N 3.45Å; K192-A195 PolarHBondContact O-N 3.36Å; A195-R197 PolarHBondContact O-N 2.77Å; A195-M198 PolarHBondContact O-N 3.24Å; A195-Q199 WeakPolarHBondContact O-CB 3.35Å; A195-Q199 PolarHBondContact O-N 3.3Å |
| 196 | L | 79.6 | Confident | 74.3 | Confident | 85 Ų | 85 | 123.2 Ų | 123.2 | 45% | 0.445 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -66.5 | -37.2 | 179 | -162.9 | 147.9 | 0 | 0 | 0 | 112 | K192 V193 Y194 Q199 K200 | K192-L196 VanDerWaalsContact O-CB 3.3Å; K192-L196 WeakPolarHBondContact O-CB 3.48Å; K192-L196 PolarHBondContact O-N 2.89Å; V193-L196 PolarHBondContact O-N 3.38Å; Y194-L196 VanDerWaalsContact C-N 3.34Å; Y194-L196 PolarHBondContact O-N 2.88Å; L196-Q199 PolarHBondContact O-N 3.48Å; L196-K200 HydrophobicContact CD2-CD 3.92Å; L196-K200 HydrophobicContact CD2-CG 4.37Å; L196-K200 WeakPolarHBondContact O-CG 3.23Å; L196-K200 PolarHBondContact O-N 3.27Å |
| 197 | R | 81.3 | Confident | 75.1 | Confident | 180 Ų | 180 | 125.4 Ų | 125.4 | 68% | 0.679 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -62.9 | -45.4 | 172.8 | -179.2 | -177.5 | -86.2 | -173.6 | -5.2 | 111.5 | V193 Y194 A195 K200 K201 | V193-R197 WeakPolarHBondContact O-CB 3.42Å; V193-R197 PolarHBondContact O-N 2.85Å; Y194-R197 PolarHBondContact O-N 2.78Å; A195-R197 PolarHBondContact O-N 2.77Å; R197-K200 PolarHBondContact O-N 3.44Å; R197-K201 PolarHBondContact O-N 3.48Å |
| 198 | M | 82.6 | Confident | 75.4 | Confident | 73 Ų | 73 | 121.4 Ų | 121.4 | 36% | 0.36 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -65.4 | -39.2 | 178 | -73 | -63.6 | -75.7 | 0 | 0 | 112.1 | Y194 A195 K201 M202 | Y194-M198 HydrophobicContact CD1-CG 4.21Å; Y194-M198 HydrophobicContact CE1-CG 3.81Å; Y194-M198 HydrophobicContact CE2-CG 4.49Å; Y194-M198 WeakPolarHBondContact O-CG 3.29Å; Y194-M198 PolarHBondContact O-N 2.88Å; A195-M198 PolarHBondContact O-N 3.24Å; M198-K201 PolarHBondContact O-N 2.85Å; M198-M202 PolarHBondContact O-N 3.08Å |
| 199 | Q | 80.9 | Confident | 75.5 | Confident | 90 Ų | 90 | 123.4 Ų | 123.4 | 42% | 0.421 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -66.1 | -42 | 177.6 | -167.5 | 177.4 | -8.9 | 0 | 0 | 112 | A195 L196 K201 M202 Y203 F208 | A195-Q199 WeakPolarHBondContact O-CB 3.35Å; A195-Q199 PolarHBondContact O-N 3.3Å; L196-Q199 PolarHBondContact O-N 3.48Å; Q199-K201 VanDerWaalsContact C-N 3.31Å; Q199-K201 PolarHBondContact O-N 3.48Å; Q199-M202 PolarHBondContact O-N 2.63Å; Q199-Y203 HydrophobicContact CG-CD2 4.32Å; Q199-Y203 PolarHBondContact O-N 2.81Å; Q199-F208 HydrophobicContact CG-CZ 3.97Å |
| 200 | K | 82.8 | Confident | 75.8 | Confident | 113 Ų | 113 | 119.2 Ų | 119.2 | 49% | 0.491 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -61.8 | -37.4 | 172.3 | -77 | -178.1 | 173.7 | -179.6 | 0 | 112.4 | L196 R197 Y203 F208 | L196-K200 HydrophobicContact CD2-CD 3.92Å; L196-K200 HydrophobicContact CD2-CG 4.37Å; L196-K200 WeakPolarHBondContact O-CG 3.23Å; L196-K200 PolarHBondContact O-N 3.27Å; R197-K200 PolarHBondContact O-N 3.44Å; K200-Y203 CarbonylContact O-C 3.56Å; K200-F208 HydrophobicContact CG-CD2 4.03Å; K200-F208 HydrophobicContact CG-CE2 4.06Å |
| 201 | K | 85 | Confident | 75.4 | Confident | 169 Ų | 169 | 115.8 Ų | 115.8 | 74% | 0.735 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -67 | -41.2 | 176.6 | -173.2 | 178.7 | 178 | -177 | 0 | 112.2 | R197 M198 Q199 | R197-K201 PolarHBondContact O-N 3.48Å; M198-K201 PolarHBondContact O-N 2.85Å; Q199-K201 VanDerWaalsContact C-N 3.31Å; Q199-K201 PolarHBondContact O-N 3.48Å |
| 202 | M | 85.4 | Confident | 74.3 | Confident | 119 Ų | 119 | 120 Ų | 120 | 59% | 0.586 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -74 | -31.8 | 179.2 | -75.7 | -170.3 | -73.2 | 0 | 0 | 113.1 | M198 Q199 | M198-M202 PolarHBondContact O-N 3.08Å; Q199-M202 PolarHBondContact O-N 2.63Å |
| 203 | Y | 82.4 | Confident | 72.9 | Confident | 126 Ų | 126 | 119.1 Ų | 119.1 | 49% | 0.494 | 61% | 0.607 | S | S | . | * | trans | -131.1 | 70 | -174.3 | -54.6 | -74.6 | 0 | 0 | 0 | 111.9 | Q199 K200 Q205 L206 | Q199-Y203 HydrophobicContact CG-CD2 4.32Å; Q199-Y203 PolarHBondContact O-N 2.81Å; K200-Y203 CarbonylContact O-C 3.56Å; Y203-Q205 PolarHBondContact O-N 3.35Å; Y203-L206 HydrophobicContact CG-CD1 3.97Å; Y203-L206 PolarHBondContact O-N 2.8Å; Y203-L206 VanDerWaalsContact O-N 3.17Å | ||
| 204 | P | 76.6 | Confident | 71.5 | Confident | 102 Ų | 102 | 126.1 Ų | 126.1 | 66% | 0.662 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.8 | -21.8 | -179 | 27 | -34.8 | 0 | 0 | 0 | 113 | L206 | P204-L206 VanDerWaalsContact C-N 3.25Å; P204-L206 PolarHBondContact O-N 3.13Å |
| 205 | Q | 79.8 | Confident | 69.9 | Low | 177 Ų | 177 | 121.9 Ų | 121.9 | 83% | 0.827 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.2 | -19.6 | 178.6 | -35.1 | -83.1 | 7.4 | 0 | 0 | 112.5 | Y203 T207 | Y203-Q205 PolarHBondContact O-N 3.35Å; Q205-T207 PolarHBondContact O-N 3.23Å |
| 206 | L | 72.3 | Confident | 67.9 | Low | 91 Ų | 91 | 127 Ų | 127 | 48% | 0.476 | 64% | 0.639 | S | S | . | * | trans | -85.6 | 109 | -176.5 | -69 | 177.6 | 0 | 0 | 0 | 109.6 | Y203 P204 F208 | Y203-L206 HydrophobicContact CG-CD1 3.97Å; Y203-L206 PolarHBondContact O-N 2.8Å; Y203-L206 VanDerWaalsContact O-N 3.17Å; P204-L206 VanDerWaalsContact C-N 3.25Å; P204-L206 PolarHBondContact O-N 3.13Å; L206-F208 HydrophobicContact CB-CD2 4.4Å; L206-F208 HydrophobicContact CB-CE1 4.43Å; L206-F208 HydrophobicContact CB-CE2 3.78Å; L206-F208 HydrophobicContact CB-CZ 3.79Å; L206-F208 HydrophobicContact CD1-CZ 4Å; L206-F208 WeakPolarHBondContact O-CD2 3.39Å; L206-F208 WeakPolarHBondContact O-CE2 3.45Å; L206-F208 PolarHBondContact O-N 3.44Å; L206-F208 VanDerWaalsContact O-N 3.07Å | ||
| 207 | T | 70.2 | Confident | 66.4 | Low | 145 Ų | 145 | 134.6 Ų | 134.6 | 89% | 0.89 | 66% | 0.662 | S | S | * | * | trans | -73.9 | 97.8 | 170.8 | -37 | 0 | 0 | 0 | 0 | 108.9 | Q205 A209 | Q205-T207 PolarHBondContact O-N 3.23Å; T207-A209 PolarHBondContact O-N 3.34Å | ||
| 208 | F | 62.9 | Low | 64.5 | Low | 85 Ų | 85 | 135.1 Ų | 135.1 | 37% | 0.373 | 67% | 0.669 | S | S | . | * | trans | -75.1 | 115.2 | 174.7 | -63.5 | -81.4 | 0 | 0 | 0 | 109.4 | Q199 K200 L206 | Q199-F208 HydrophobicContact CG-CZ 3.97Å; K200-F208 HydrophobicContact CG-CD2 4.03Å; K200-F208 HydrophobicContact CG-CE2 4.06Å; L206-F208 HydrophobicContact CB-CD2 4.4Å; L206-F208 HydrophobicContact CB-CE1 4.43Å; L206-F208 HydrophobicContact CB-CE2 3.78Å; L206-F208 HydrophobicContact CB-CZ 3.79Å; L206-F208 HydrophobicContact CD1-CZ 4Å; L206-F208 WeakPolarHBondContact O-CD2 3.39Å; L206-F208 WeakPolarHBondContact O-CE2 3.45Å; L206-F208 PolarHBondContact O-N 3.44Å; L206-F208 VanDerWaalsContact O-N 3.07Å | ||
| 209 | A | 59.9 | Low | 62.7 | Low | 81 Ų | 81 | 139.5 Ų | 139.5 | 67% | 0.669 | 69% | 0.694 | S | S | * | * | trans | -60.1 | 134.7 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109 | T207 V211 | T207-A209 PolarHBondContact O-N 3.34Å; A209-V211 PolarHBondContact O-N 3.24Å | ||
| 210 | P | 62.3 | Low | 60.5 | Low | 100 Ų | 100 | 139.8 Ų | 139.8 | 65% | 0.649 | 71% | 0.712 | S | S | * | * | trans | -57.7 | 129.2 | 176.7 | 22.5 | -30.4 | 0 | 0 | 0 | 108.7 | H212 | P210-H212 PolarHBondContact O-CE1 3.02Å; P210-H212 PolarHBondContact O-N 2.8Å; P210-H212 PolarHBondContact O-ND1 3.07Å | ||
| 211 | V | 54.1 | Low | 58.8 | Low | 131 Ų | 131 | 139.4 Ų | 139.4 | 79% | 0.794 | 72% | 0.723 | S | S | * | * | trans | -61.9 | 105.9 | 175.9 | 177.5 | 0 | 0 | 0 | 0 | 106.8 | A209 E213 | A209-V211 PolarHBondContact O-N 3.24Å; V211-E213 PolarHBondContact O-N 3.05Å | ||
| 212 | H | 47.3 | Very low | 56.7 | Low | 156 Ų | 156 | 141 Ų | 141 | 72% | 0.722 | 73% | 0.73 | S | S | * | * | trans | -68.8 | 120.8 | 169.3 | -63.8 | 33.4 | 0 | 0 | 0 | 105.3 | P210 R214 | P210-H212 PolarHBondContact O-CE1 3.02Å; P210-H212 PolarHBondContact O-N 2.8Å; P210-H212 PolarHBondContact O-ND1 3.07Å; H212-R214 VanDerWaalsContact C-N 3.26Å; H212-R214 PolarHBondContact O-N 2.94Å | ||
| 213 | E | 49 | Very low | 54.6 | Low | 169 Ų | 169 | 145.3 Ų | 145.3 | 79% | 0.79 | 75% | 0.746 | S | S | * | * | trans | -58.6 | 92.8 | 174.4 | -73.3 | -176.2 | 160.5 | 0 | 0 | 108.8 | V211 G215 | V211-E213 PolarHBondContact O-N 3.05Å; E213-G215 PolarHBondContact O-N 3.11Å | ||
| 214 | R | 47.1 | Very low | 52.5 | Low | 255 Ų | 255 | 144.8 Ų | 144.8 | 96% | 0.962 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | 69.2 | 170.5 | -170 | -173.4 | -67.6 | -155.9 | -1.2 | 107.4 | H212 | H212-R214 VanDerWaalsContact C-N 3.26Å; H212-R214 PolarHBondContact O-N 2.94Å |
| 215 | G | 45.2 | Very low | 50.6 | Low | 59 Ų | 59 | 144.6 Ų | 144.6 | 61% | 0.608 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -157.6 | 10.7 | -169.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | E213 | E213-G215 PolarHBondContact O-N 3.11Š|
| 216 | M | 39.2 | Very low | 48.7 | Very low | 160 Ų | 160 | 142.1 Ų | 142.1 | 79% | 0.788 | 77% | 0.77 | S | S | * | * | trans | -121.5 | 95.3 | 170.4 | -70.6 | -80.6 | 152.2 | 0 | 0 | 108.3 | K218 | M216-K218 PolarHBondContact O-N 3.29Š| ||
| 217 | R | 47.8 | Very low | 47.1 | Very low | 245 Ų | 245 | 146.7 Ų | 146.7 | 93% | 0.925 | 79% | 0.789 | S | S | * | * | trans | -61.8 | 114.7 | 163 | -72.6 | -169.3 | -177.6 | -160.8 | 3.1 | 107.3 | ||||
| 218 | K | 41.7 | Very low | 45.8 | Very low | 192 Ų | 192 | 151.2 Ų | 151.2 | 84% | 0.835 | 79% | 0.789 | S | S | * | * | trans | -131.2 | 117.6 | 153.6 | -78.2 | -170.2 | 177 | -179.4 | 0 | 107.7 | M216 A220 | M216-K218 PolarHBondContact O-N 3.29Å; K218-A220 PolarHBondContact O-N 2.93Å | ||
| 219 | D | 44.1 | Very low | 44.8 | Very low | 164 Ų | 164 | 152.7 Ų | 152.7 | 88% | 0.877 | 81% | 0.808 | S | S | * | * | trans | -56.1 | 127.3 | 172 | -60.2 | -61.9 | 0 | 0 | 0 | 110.2 | ||||
| 220 | A | 36.1 | Very low | 44 | Very low | 96 Ų | 96 | 156 Ų | 156 | 79% | 0.793 | 81% | 0.813 | S | S | * | * | trans | -158.9 | 106.7 | 156.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | K218 | K218-A220 PolarHBondContact O-N 2.93Š| ||
| 221 | S | 46.8 | Very low | 43.4 | Very low | 105 Ų | 105 | 156.6 Ų | 156.6 | 73% | 0.734 | 82% | 0.819 | S | S | * | * | trans | -54.2 | 144.6 | 165.6 | 67.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 222 | K | 40.7 | Very low | 43.1 | Very low | 203 Ų | 203 | 159 Ų | 159 | 88% | 0.883 | 82% | 0.819 | S | S | * | * | -178.7 | 144.8 | 116.5 | -95.2 | 168.9 | -170.3 | -172.3 | 0 | 110.7 | |||||
| 223 | K | 42 | Very low | 43.4 | Very low | 210 Ų | 210 | 157.4 Ų | 157.4 | 91% | 0.913 | 82% | 0.82 | S | S | * | * | trans | -68 | 144.4 | -176 | -66.8 | 166.6 | 170.5 | 175.3 | 0 | 112.9 | ||||
| 224 | S | 37 | Very low | 43.5 | Very low | 115 Ų | 115 | 156 Ų | 156 | 80% | 0.804 | 82% | 0.817 | S | S | * | * | trans | -157.1 | 105 | 136.8 | 51.1 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 225 | A | 36.4 | Very low | 43.7 | Very low | 98 Ų | 98 | 154.7 Ų | 154.7 | 81% | 0.81 | 81% | 0.811 | S | S | * | * | 70.9 | 93.8 | 93.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 226 | S | 40.2 | Very low | 44.3 | Very low | 124 Ų | 124 | 159.4 Ų | 159.4 | 87% | 0.867 | 82% | 0.818 | S | S | * | * | trans | 57.9 | 94.2 | 140.3 | 172.5 | 0 | 0 | 0 | 0 | 119 | ||||
| 227 | E | 38.8 | Very low | 45.1 | Very low | 188 Ų | 188 | 156.9 Ų | 156.9 | 88% | 0.879 | 81% | 0.813 | S | S | * | * | trans | -142.2 | 130.3 | 143.8 | -154.1 | 170 | -165.8 | 0 | 0 | 109.9 | ||||
| 228 | R | 43.1 | Very low | 45.6 | Very low | 239 Ų | 239 | 152.1 Ų | 152.1 | 90% | 0.902 | 81% | 0.805 | S | S | * | * | trans | -56.8 | 131.6 | -174.7 | -75.4 | 172.7 | 171.4 | 171.8 | -3.4 | 111.4 | I230 | R228-I230 PolarHBondContact O-N 2.76Š| ||
| 229 | P | 41.8 | Very low | 46.7 | Very low | 117 Ų | 117 | 147 Ų | 147 | 76% | 0.76 | 79% | 0.791 | S | S | * | * | trans | -82 | 112.6 | 171 | 30.7 | -28.2 | 0 | 0 | 0 | 109.8 | S231 | P229-S231 PolarHBondContact O-N 3.03Š| ||
| 230 | I | 43.4 | Very low | 47.5 | Very low | 151 Ų | 151 | 146.2 Ų | 146.2 | 77% | 0.774 | 79% | 0.785 | S | S | * | * | trans | -49.5 | 133.9 | 150.6 | -64.1 | 164.7 | 0 | 0 | 0 | 106.8 | R228 K232 | R228-I230 PolarHBondContact O-N 2.76Å; I230-K232 PolarHBondContact O-N 3.15Å | ||
| 231 | S | 49.9 | Very low | 48.6 | Very low | 112 Ų | 112 | 144.9 Ų | 144.9 | 78% | 0.783 | 77% | 0.774 | S | S | * | * | trans | -54 | 96.3 | -178.1 | 59.4 | 0 | 0 | 0 | 0 | 110.5 | P229 V233 | P229-S231 PolarHBondContact O-N 3.03Å; S231-V233 PolarHBondContact O-N 2.68Å; S231-V233 VanDerWaalsContact O-N 3.13Å | ||
| 232 | K | 48.3 | Very low | 49.3 | Very low | 180 Ų | 180 | 141.9 Ų | 141.9 | 78% | 0.783 | 75% | 0.754 | S | S | * | * | trans | -68.3 | 110 | 168.4 | -68.8 | 177.9 | -178.2 | 175.9 | 0 | 105.2 | I230 I234 | I230-K232 PolarHBondContact O-N 3.15Å; K232-I234 VanDerWaalsContact C-N 3.28Å; K232-I234 PolarHBondContact O-N 3.46Å | ||
| 233 | V | 52.6 | Low | 50.1 | Low | 124 Ų | 124 | 137.3 Ų | 137.3 | 75% | 0.752 | 74% | 0.738 | S | S | * | * | trans | -56.1 | 104.1 | 159.8 | 174.2 | 0 | 0 | 0 | 0 | 105.1 | S231 R235 | S231-V233 PolarHBondContact O-N 2.68Å; S231-V233 VanDerWaalsContact O-N 3.13Å; V233-R235 VanDerWaalsContact C-N 3.27Å; V233-R235 PolarHBondContact O-N 3.41Å | ||
| 234 | I | 51.5 | Low | 50.9 | Low | 140 Ų | 140 | 133.4 Ų | 133.4 | 72% | 0.718 | 73% | 0.726 | S | S | * | * | trans | -66 | 96.7 | 175.9 | -59.8 | 170.1 | 0 | 0 | 0 | 104.5 | K232 E236 | K232-I234 VanDerWaalsContact C-N 3.28Å; K232-I234 PolarHBondContact O-N 3.46Å; I234-E236 HydrophobicContact CG2-CG 3.94Å; I234-E236 PolarHBondContact O-N 3.22Å | ||
| 235 | R | 50.8 | Low | 52 | Low | 226 Ų | 226 | 136.1 Ų | 136.1 | 85% | 0.853 | 73% | 0.726 | S | S | * | * | trans | -73.4 | 92 | 163.2 | -71.3 | -172.5 | 176 | -176.8 | -0.9 | 105.3 | V233 | V233-R235 VanDerWaalsContact C-N 3.27Å; V233-R235 PolarHBondContact O-N 3.41Å | ||
| 236 | E | 58.6 | Low | 53 | Low | 159 Ų | 159 | 139.2 Ų | 139.2 | 74% | 0.743 | 72% | 0.724 | S | S | * | * | trans | -55 | 137.5 | 168.2 | -68.9 | -174.8 | 158.8 | 0 | 0 | 108.4 | I234 L238 | I234-E236 HydrophobicContact CG2-CG 3.94Å; I234-E236 PolarHBondContact O-N 3.22Å; E236-L238 PolarHBondContact O-N 2.93Å | ||
| 237 | P | 55.4 | Low | 53.9 | Low | 106 Ų | 106 | 140.4 Ų | 140.4 | 69% | 0.688 | 72% | 0.718 | S | S | * | * | trans | -59.9 | 131.6 | 174.3 | 25.5 | -31.6 | 0 | 0 | 0 | 108.1 | T239 | P237-T239 VanDerWaalsContact C-N 3.27Å; P237-T239 PolarHBondContact O-N 3.46Å; P237-T239 PolarHBondContact O-OG1 3.35Å | ||
| 238 | L | 58.3 | Low | 54.6 | Low | 146 Ų | 146 | 136.2 Ų | 136.2 | 76% | 0.764 | 71% | 0.707 | S | S | * | * | trans | -62.1 | 90.4 | 176.5 | -164.8 | 84.7 | 0 | 0 | 0 | 109 | E236 L243 | E236-L238 PolarHBondContact O-N 2.93Å; L238-L243 HydrophobicContact CD2-CD1 4.47Å | ||
| 239 | T | 65.8 | Low | 55.3 | Low | 85 Ų | 85 | 131.1 Ų | 131.1 | 52% | 0.521 | 70% | 0.702 | S | S | . | * | trans | -79.4 | 148.5 | 176.5 | 8.2 | 0 | 0 | 0 | 0 | 109.7 | P237 A241 S242 | P237-T239 VanDerWaalsContact C-N 3.27Å; P237-T239 PolarHBondContact O-N 3.46Å; P237-T239 PolarHBondContact O-OG1 3.35Å; T239-A241 PolarHBondContact O-N 3.16Å; T239-S242 PolarHBondContact O-N 3.36Å; T239-S242 PolarHBondContact O-OG 3.03Å | ||
| 240 | L | 59.3 | Low | 56 | Low | 146 Ų | 146 | 136.3 Ų | 136.3 | 76% | 0.764 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -52.9 | -29.4 | 175.8 | -81.6 | 165.5 | 0 | 0 | 0 | 112.8 | S242 L243 L244 | L240-S242 PolarHBondContact O-N 3.36Å; L240-L243 PolarHBondContact O-N 3.12Å; L240-L244 WeakPolarHBondContact O-CG 3.43Å; L240-L244 PolarHBondContact O-N 3.06Å |
| 241 | A | 60.8 | Low | 56.4 | Low | 68 Ų | 68 | 136.3 Ų | 136.3 | 56% | 0.562 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -60.3 | -40.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | T239 L243 L244 E245 | T239-A241 PolarHBondContact O-N 3.16Å; A241-L243 VanDerWaalsContact C-N 3.27Å; A241-L243 PolarHBondContact O-N 2.94Å; A241-L244 PolarHBondContact O-N 3.05Å; A241-E245 PolarHBondContact O-N 2.72Å; A241-E245 VanDerWaalsContact O-N 3.15Å |
| 242 | S | 60.7 | Low | 56.5 | Low | 43 Ų | 43 | 134.9 Ų | 134.9 | 30% | 0.301 | 70% | 0.704 | S | S | . | * | H | α-helix | trans | -72.4 | -22.6 | 179.3 | 66.8 | 0 | 0 | 0 | 0 | 112.6 | T239 L240 | T239-S242 PolarHBondContact O-N 3.36Å; T239-S242 PolarHBondContact O-OG 3.03Å; L240-S242 PolarHBondContact O-N 3.36Å |
| 243 | L | 56.8 | Low | 56.8 | Low | 107 Ų | 107 | 131.9 Ų | 131.9 | 56% | 0.56 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -78.6 | -27.1 | 175.1 | -157.1 | 117.8 | 0 | 0 | 0 | 112.2 | L238 L240 A241 | L238-L243 HydrophobicContact CD2-CD1 4.47Å; L240-L243 PolarHBondContact O-N 3.12Å; A241-L243 VanDerWaalsContact C-N 3.27Å; A241-L243 PolarHBondContact O-N 2.94Å |
| 244 | L | 59.8 | Low | 56.5 | Low | 127 Ų | 127 | 128.5 Ų | 128.5 | 67% | 0.665 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -83.3 | -26.9 | 177.6 | -67.9 | 171.5 | 0 | 0 | 0 | 112.3 | L240 A241 E246 | L240-L244 WeakPolarHBondContact O-CG 3.43Å; L240-L244 PolarHBondContact O-N 3.06Å; A241-L244 PolarHBondContact O-N 3.05Å; L244-E246 VanDerWaalsContact C-N 3.26Å; L244-E246 PolarHBondContact O-N 2.97Å |
| 245 | E | 60 | Low | 56.6 | Low | 172 Ų | 172 | 131.1 Ų | 131.1 | 80% | 0.804 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -68.1 | -27.2 | 176.2 | -133 | 174.6 | -173.8 | 0 | 0 | 112.2 | A241 M247 | A241-E245 PolarHBondContact O-N 2.72Å; A241-E245 VanDerWaalsContact O-N 3.15Å; E245-M247 PolarHBondContact O-N 3.2Å |
| 246 | E | 57.4 | Low | 56.6 | Low | 164 Ų | 164 | 125.4 Ų | 125.4 | 77% | 0.766 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | 37.5 | -178.8 | -149.2 | -175.7 | -163.2 | 0 | 0 | 113.1 | L244 P248 | L244-E246 VanDerWaalsContact C-N 3.26Å; L244-E246 PolarHBondContact O-N 2.97Å; E246-P248 WeakPolarHBondContact O-CD 3.45Å |
| 247 | M | 59 | Low | 56.1 | Low | 148 Ų | 148 | 121.1 Ų | 121.1 | 73% | 0.729 | 69% | 0.688 | S | S | * | * | trans | -97.4 | 85.9 | 161.6 | -73.1 | -126 | 119.4 | 0 | 0 | 109.6 | E245 T249 | E245-M247 PolarHBondContact O-N 3.2Å; M247-T249 PolarHBondContact O-N 3.38Å | ||
| 248 | P | 52.8 | Low | 55.8 | Low | 100 Ų | 100 | 125.8 Ų | 125.8 | 65% | 0.649 | 70% | 0.698 | S | S | * | * | trans | -65.5 | 108.8 | 161.3 | 28.3 | -29.8 | 0 | 0 | 0 | 105.8 | E246 R250 | E246-P248 WeakPolarHBondContact O-CD 3.45Å; P248-R250 PolarHBondContact O-N 3.14Å | ||
| 249 | T | 57.5 | Low | 55.4 | Low | 132 Ų | 132 | 128.4 Ų | 128.4 | 81% | 0.81 | 70% | 0.698 | S | S | * | * | trans | -59.3 | 88.7 | 167.2 | -46.7 | 0 | 0 | 0 | 0 | 107.5 | M247 N251 | M247-T249 PolarHBondContact O-N 3.38Å; T249-N251 PolarHBondContact O-N 2.78Å | ||
| 250 | R | 57.4 | Low | 54.5 | Low | 227 Ų | 227 | 130.6 Ų | 130.6 | 86% | 0.857 | 71% | 0.707 | S | S | * | * | trans | -79.8 | 112.4 | 170.9 | -97.5 | -174.1 | 164.5 | 172.8 | -2.4 | 106.7 | P248 A252 | P248-R250 PolarHBondContact O-N 3.14Å; R250-A252 PolarHBondContact O-N 3.12Å | ||
| 251 | N | 51.8 | Low | 54.2 | Low | 150 Ų | 150 | 128 Ų | 128 | 80% | 0.802 | 72% | 0.715 | S | S | * | * | trans | -55.8 | 112.3 | 169.6 | -67.4 | -24.2 | 0 | 0 | 0 | 108.6 | T249 | T249-N251 PolarHBondContact O-N 2.78Š| ||
| 252 | A | 51.9 | Low | 53.7 | Low | 83 Ų | 83 | 135 Ų | 135 | 69% | 0.686 | 73% | 0.727 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 138.9 | 171.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | R250 G254 | R250-A252 PolarHBondContact O-N 3.12Å; A252-G254 PolarHBondContact O-N 3.43Å |
| 253 | P | 53.6 | Low | 53.3 | Low | 117 Ų | 117 | 137 Ų | 137 | 76% | 0.76 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -58 | 132.8 | 173.6 | 23.2 | -30.2 | 0 | 0 | 0 | 109.3 | ||
| 254 | G | 47.3 | Very low | 53.1 | Low | 53 Ų | 53 | 137.1 Ų | 137.1 | 55% | 0.546 | 75% | 0.753 | S | S | . | * | P | Polyproline II helix | trans | -58.3 | 173.9 | -160.6 | 0 | 0 | 0 | 0 | 0 | 117.4 | A252 S256 A257 | A252-G254 PolarHBondContact O-N 3.43Å; G254-S256 PolarHBondContact O-N 2.85Å; G254-A257 PolarHBondContact O-N 3.25Å |
| 255 | E | 53.4 | Low | 52.7 | Low | 194 Ų | 194 | 139.5 Ų | 139.5 | 91% | 0.907 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -48.5 | -6.9 | -172.5 | -143 | 165.2 | -176.2 | 0 | 0 | 116.7 | ||
| 256 | S | 50.9 | Low | 51.9 | Low | 107 Ų | 107 | 142.5 Ų | 142.5 | 75% | 0.748 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97 | -7.8 | 176.8 | 70.3 | 0 | 0 | 0 | 0 | 115 | G254 F258 | G254-S256 PolarHBondContact O-N 2.85Å; S256-F258 VanDerWaalsContact C-N 3.34Å; S256-F258 PolarHBondContact O-N 3.49Å |
| 257 | A | 49.1 | Very low | 51.7 | Low | 68 Ų | 68 | 141.4 Ų | 141.4 | 56% | 0.562 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | -11.5 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | G254 | G254-A257 PolarHBondContact O-N 3.25Š|
| 258 | F | 47.7 | Very low | 51.3 | Low | 204 Ų | 204 | 141.9 Ų | 141.9 | 90% | 0.895 | 77% | 0.767 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.8 | 17.6 | -175.1 | -98.6 | -84.4 | 0 | 0 | 0 | 114.7 | S256 | S256-F258 VanDerWaalsContact C-N 3.34Å; S256-F258 PolarHBondContact O-N 3.49Å |
| 259 | R | 50.9 | Low | 51 | Low | 201 Ų | 201 | 145.6 Ų | 145.6 | 76% | 0.758 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -116.4 | 113.6 | 173.1 | -66.6 | -168.8 | 179.6 | -117.3 | 2.7 | 109.3 | ||
| 260 | N | 47.4 | Very low | 50.5 | Low | 132 Ų | 132 | 148.2 Ų | 148.2 | 71% | 0.706 | 77% | 0.773 | S | S | * | * | trans | 93.2 | 90.3 | 176.5 | -44.3 | -27 | 0 | 0 | 0 | 112.9 | R262 | N260-R262 VanDerWaalsContact C-N 3.31Å; N260-R262 PolarHBondContact O-N 3.38Å | ||
| 261 | G | 51.6 | Low | 49.9 | Very low | 91 Ų | 91 | 142 Ų | 142 | 94% | 0.938 | 77% | 0.77 | S | S | * | * | trans | -52.6 | 97.5 | 161.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 262 | R | 50.4 | Low | 49.7 | Very low | 215 Ų | 215 | 140.5 Ų | 140.5 | 81% | 0.811 | 77% | 0.766 | S | S | * | * | trans | -117.6 | 102.8 | 166.1 | -67.7 | -168.3 | -171 | -146.6 | 4.3 | 105.8 | N260 | N260-R262 VanDerWaalsContact C-N 3.31Å; N260-R262 PolarHBondContact O-N 3.38Å | ||
| 263 | A | 53 | Low | 49.2 | Very low | 84 Ų | 84 | 142.7 Ų | 142.7 | 69% | 0.694 | 77% | 0.771 | S | S | * | * | trans | -56.8 | 136.3 | 163.5 | 0 | 0 | 0 | 0 | 0 | 107.9 | Q265 | A263-Q265 PolarHBondContact O-N 2.94Š| ||
| 264 | P | 52.2 | Low | 48.6 | Very low | 111 Ų | 111 | 145 Ų | 145 | 72% | 0.721 | 78% | 0.775 | S | S | * | * | trans | -61.7 | 108.2 | 174 | 23.4 | -29.6 | 0 | 0 | 0 | 108 | W266 | P264-W266 PolarHBondContact O-N 3.42Š| ||
| 265 | Q | 51.5 | Low | 48.1 | Very low | 176 Ų | 176 | 149.1 Ų | 149.1 | 82% | 0.822 | 82% | 0.817 | S | S | * | * | trans | -69.3 | 127 | 166.8 | -76.2 | -179.7 | -23.1 | 0 | 0 | 107.6 | A263 I267 | A263-Q265 PolarHBondContact O-N 2.94Å; Q265-I267 PolarHBondContact O-N 3.46Å | ||
| 266 | W | 43.7 | Very low | 47.8 | Very low | 236 Ų | 236 | 146.9 Ų | 146.9 | 89% | 0.894 | 81% | 0.813 | S | S | * | * | trans | -75.4 | 99.1 | 178.5 | -66 | 29.1 | 0 | 0 | 0 | 107.1 | P264 I268 | P264-W266 PolarHBondContact O-N 3.42Å; W266-I268 PolarHBondContact O-N 3.23Å; W266-I268 VanDerWaalsContact O-N 3.1Å | ||
| 267 | I | 52.7 | Low | 47.7 | Very low | 140 Ų | 140 | 148.9 Ų | 148.9 | 72% | 0.718 | 82% | 0.816 | S | S | * | * | trans | -74.1 | 99.8 | 174.5 | -58.5 | 173.1 | 0 | 0 | 0 | 107.3 | Q265 K269 | Q265-I267 PolarHBondContact O-N 3.46Å; I267-K269 HydrophobicContact CG2-CG 4.2Å; I267-K269 PolarHBondContact O-N 3.32Å | ||
| 268 | I | 50.4 | Low | 47.6 | Very low | 159 Ų | 159 | 153.4 Ų | 153.4 | 82% | 0.815 | 83% | 0.83 | S | S | * | * | trans | -71.7 | 107.1 | 169.3 | -60.2 | 174.7 | 0 | 0 | 0 | 107.3 | W266 K270 | W266-I268 PolarHBondContact O-N 3.23Å; W266-I268 VanDerWaalsContact O-N 3.1Å; I268-K270 PolarHBondContact O-N 3.28Å | ||
| 269 | K | 45.8 | Very low | 47.6 | Very low | 177 Ų | 177 | 150.5 Ų | 150.5 | 77% | 0.77 | 83% | 0.827 | S | S | * | * | trans | -81.9 | 111.7 | 172.9 | -73.3 | -175.6 | 179.3 | 178.3 | 0 | 109.9 | I267 | I267-K269 HydrophobicContact CG2-CG 4.2Å; I267-K269 PolarHBondContact O-N 3.32Å | ||
| 270 | K | 47.4 | Very low | 47.4 | Very low | 187 Ų | 187 | 147.3 Ų | 147.3 | 81% | 0.813 | 83% | 0.831 | S | S | * | * | trans | 77.8 | 123.9 | 150.9 | -55.3 | -170 | 178.4 | -171.2 | 0 | 119.1 | I268 | I268-K270 PolarHBondContact O-N 3.28Š| ||
| 271 | A | 46.1 | Very low | 47.4 | Very low | 97 Ų | 97 | 148.3 Ų | 148.3 | 80% | 0.802 | 84% | 0.839 | S | S | * | * | trans | -117.6 | 110.3 | 135.7 | 0 | 0 | 0 | 0 | 0 | 107.3 | V273 | A271-V273 PolarHBondContact O-N 3.23Š| ||
| 272 | T | 47.5 | Very low | 47.1 | Very low | 118 Ų | 118 | 152.4 Ų | 152.4 | 72% | 0.724 | 83% | 0.832 | S | S | * | * | trans | -66.2 | 117.1 | 168.2 | -15.2 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 273 | V | 39.8 | Very low | 46.8 | Very low | 129 Ų | 129 | 147.6 Ų | 147.6 | 78% | 0.782 | 83% | 0.834 | S | S | * | * | trans | -87.9 | 111.9 | 165 | 176.9 | 0 | 0 | 0 | 0 | 106.7 | A271 | A271-V273 PolarHBondContact O-N 3.23Š| ||
| 274 | I | 41.7 | Very low | 46.3 | Very low | 166 Ų | 166 | 152.9 Ų | 152.9 | 85% | 0.851 | 85% | 0.845 | S | S | * | * | trans | -105 | 123.4 | 158.1 | -64.8 | 169.7 | 0 | 0 | 0 | 104.1 | ||||
| 275 | G | 37.1 | Very low | 45.8 | Very low | 139 Ų | 139 | 156.7 Ų | 156.7 | 100% | 1.433 | 86% | 0.857 | S | S | * | * | trans | 142 | 0 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.6 |
Retrieved 275 of 275 residues in 1150.8 ms
(Link to these results)