| 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 | 42.2 | Very low | 38.8 | Very low | 245 Ų | 245 | 177.7 Ų | 177.7 | 100% | 1.207 | 84% | 0.842 | S | S | * | * | 0 | 72.1 | 0 | -75.9 | -72.6 | -142.7 | 0 | 0 | 110.4 | |||||
| 2 | G | 37.3 | Very low | 38.6 | Very low | 74 Ų | 74 | 171.5 Ų | 171.5 | 76% | 0.763 | 83% | 0.832 | S | S | * | * | trans | -97.3 | 103.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | L4 | G2-L4 PolarHBondContact O-N 3.08Š| ||
| 3 | R | 42 | Very low | 38.2 | Very low | 229 Ų | 229 | 170.7 Ų | 170.7 | 86% | 0.864 | 83% | 0.834 | S | S | * | * | trans | -82.2 | 96.4 | 173.8 | -77.1 | -173.2 | -102.8 | -140 | -2.7 | 109.6 | F5 | R3-F5 HydrophobicContact CB-CD2 4.44Å; R3-F5 HydrophobicContact CB-CE2 4.47Å; R3-F5 PolarHBondContact O-N 3.06Å | ||
| 4 | L | 41.3 | Very low | 38.1 | Very low | 169 Ų | 169 | 167.3 Ų | 167.3 | 89% | 0.885 | 83% | 0.828 | S | S | * | * | trans | -75.5 | 96.3 | 169.1 | -110.2 | 90.8 | 0 | 0 | 0 | 109.7 | G2 R6 | G2-L4 PolarHBondContact O-N 3.08Å; L4-R6 PolarHBondContact O-N 3.28Å | ||
| 5 | F | 43.6 | Very low | 38 | Very low | 187 Ų | 187 | 162.7 Ų | 162.7 | 82% | 0.82 | 83% | 0.828 | S | S | * | * | trans | -74.5 | 109.3 | 166.3 | -89.7 | -90.1 | 0 | 0 | 0 | 109.5 | R3 R7 | R3-F5 HydrophobicContact CB-CD2 4.44Å; R3-F5 HydrophobicContact CB-CE2 4.47Å; R3-F5 PolarHBondContact O-N 3.06Å; F5-R7 PolarHBondContact O-N 3.35Å | ||
| 6 | R | 44.2 | Very low | 37.9 | Very low | 235 Ų | 235 | 161 Ų | 161 | 89% | 0.887 | 83% | 0.828 | S | S | * | * | trans | -71.4 | 108.7 | 167.5 | -87.2 | -176.6 | -112.5 | -145.2 | -2.6 | 109.2 | L4 V8 | L4-R6 PolarHBondContact O-N 3.28Å; R6-V8 PolarHBondContact O-N 3.14Å | ||
| 7 | R | 36.3 | Very low | 37.4 | Very low | 223 Ų | 223 | 155.5 Ų | 155.5 | 84% | 0.842 | 82% | 0.82 | S | S | * | * | trans | -77.2 | 112.9 | 174.2 | -161.5 | 176.3 | -145.4 | 149.4 | 4.3 | 109.3 | F5 H9 | F5-R7 PolarHBondContact O-N 3.35Å; R7-H9 PolarHBondContact O-N 3.23Å | ||
| 8 | V | 37.5 | Very low | 37.4 | Very low | 120 Ų | 120 | 156.5 Ų | 156.5 | 73% | 0.727 | 83% | 0.825 | S | S | * | * | trans | -77.4 | 112.5 | 173.3 | 177.8 | 0 | 0 | 0 | 0 | 108.2 | R6 C10 | R6-V8 PolarHBondContact O-N 3.14Å; V8-C10 PolarHBondContact O-N 2.55Å | ||
| 9 | H | 33.3 | Very low | 37.2 | Very low | 150 Ų | 150 | 156.9 Ų | 156.9 | 69% | 0.694 | 83% | 0.827 | S | S | * | * | trans | -82.6 | 98 | 170.8 | -86 | -85.3 | 0 | 0 | 0 | 109 | R7 Y11 | R7-H9 PolarHBondContact O-N 3.23Å; H9-Y11 PolarHBondContact O-N 2.7Å | ||
| 10 | C | 35.8 | Very low | 37.4 | Very low | 107 Ų | 107 | 154.5 Ų | 154.5 | 72% | 0.723 | 82% | 0.824 | S | S | * | * | trans | -73.5 | 114 | 163.5 | -63.8 | 0 | 0 | 0 | 0 | 108.2 | V8 S12 | V8-C10 PolarHBondContact O-N 2.55Å; C10-S12 PolarHBondContact O-N 3.14Å | ||
| 11 | Y | 33.9 | Very low | 37.3 | Very low | 216 Ų | 216 | 150.7 Ų | 150.7 | 85% | 0.847 | 82% | 0.822 | S | S | * | * | trans | -73 | 107.3 | 168.8 | -83.8 | -96.9 | 0 | 0 | 0 | 108.5 | H9 | H9-Y11 PolarHBondContact O-N 2.7Š| ||
| 12 | S | 36 | Very low | 37 | Very low | 103 Ų | 103 | 147.9 Ų | 147.9 | 72% | 0.72 | 80% | 0.803 | S | S | * | * | trans | -92.1 | 102.6 | 165.1 | -60.1 | 0 | 0 | 0 | 0 | 108.1 | C10 T14 | C10-S12 PolarHBondContact O-N 3.14Å; S12-T14 PolarHBondContact O-N 3.41Å; S12-T14 VanDerWaalsContact O-N 3.1Å | ||
| 13 | D | 33.4 | Very low | 36.9 | Very low | 161 Ų | 161 | 151.1 Ų | 151.1 | 86% | 0.861 | 80% | 0.803 | S | S | * | * | trans | -71.8 | 93 | 167.5 | -95.4 | -33.4 | 0 | 0 | 0 | 109.1 | ||||
| 14 | T | 36.2 | Very low | 36.9 | Very low | 123 Ų | 123 | 144.8 Ų | 144.8 | 76% | 0.755 | 79% | 0.794 | S | S | * | * | trans | -96 | 89 | 163.6 | 50 | 0 | 0 | 0 | 0 | 108.8 | S12 | S12-T14 PolarHBondContact O-N 3.41Å; S12-T14 VanDerWaalsContact O-N 3.1Å | ||
| 15 | A | 37 | Very low | 36.8 | Very low | 99 Ų | 99 | 142.1 Ų | 142.1 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | trans | -112.8 | 69.4 | 165.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 16 | T | 37 | Very low | 36.3 | Very low | 135 Ų | 135 | 145 Ų | 145 | 83% | 0.828 | 79% | 0.79 | S | S | * | * | trans | -76.8 | 116.4 | 165.3 | 38 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 17 | G | 29.8 | Very low | 35.7 | Very low | 67 Ų | 67 | 141.1 Ų | 141.1 | 69% | 0.691 | 79% | 0.787 | S | S | * | * | trans | 67.4 | 95.6 | 139.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 18 | L | 36.3 | Very low | 35.7 | Very low | 174 Ų | 174 | 136.4 Ų | 136.4 | 91% | 0.911 | 79% | 0.789 | S | S | * | * | trans | -135.5 | 105.3 | 139.8 | -74.8 | 178.7 | 0 | 0 | 0 | 108.7 | S20 | L18-S20 PolarHBondContact O-N 3.32Š| ||
| 19 | D | 33.9 | Very low | 35.7 | Very low | 164 Ų | 164 | 134.3 Ų | 134.3 | 88% | 0.877 | 78% | 0.784 | S | S | * | * | trans | -58.3 | 115.6 | 163.4 | 178.2 | 25.3 | 0 | 0 | 0 | 109.4 | ||||
| 20 | S | 41.7 | Very low | 35.7 | Very low | 108 Ų | 108 | 134.3 Ų | 134.3 | 76% | 0.755 | 79% | 0.789 | S | S | * | * | trans | -132.2 | 88.7 | 167.3 | 58.3 | 0 | 0 | 0 | 0 | 109 | L18 F22 | L18-S20 PolarHBondContact O-N 3.32Å; S20-F22 PolarHBondContact O-N 3.28Å | ||
| 21 | G | 34.2 | Very low | 35.6 | Very low | 76 Ų | 76 | 140.3 Ų | 140.3 | 78% | 0.784 | 80% | 0.798 | S | S | * | * | trans | -56.6 | 104.4 | 164.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 22 | F | 36.3 | Very low | 35.5 | Very low | 185 Ų | 185 | 138.8 Ų | 138.8 | 81% | 0.811 | 80% | 0.799 | S | S | * | * | trans | -95.3 | 93.4 | 171.3 | -167.4 | -100.2 | 0 | 0 | 0 | 108.9 | S20 S24 | S20-F22 PolarHBondContact O-N 3.28Å; F22-S24 PolarHBondContact O-N 2.93Å | ||
| 23 | D | 36.2 | Very low | 35.2 | Very low | 142 Ų | 142 | 138.7 Ų | 138.7 | 76% | 0.759 | 80% | 0.798 | S | S | * | * | trans | -66.5 | 113.1 | 177.4 | -157.4 | -13.6 | 0 | 0 | 0 | 110.1 | T25 | D23-T25 PolarHBondContact O-N 3.05Š| ||
| 24 | S | 41.6 | Very low | 35.2 | Very low | 97 Ų | 97 | 136.7 Ų | 136.7 | 68% | 0.678 | 79% | 0.792 | S | S | * | * | trans | -89 | 67.6 | -170.8 | -68.6 | 0 | 0 | 0 | 0 | 111.5 | F22 | F22-S24 PolarHBondContact O-N 2.93Š| ||
| 25 | T | 38 | Very low | 35.1 | Very low | 113 Ų | 113 | 137 Ų | 137 | 69% | 0.693 | 79% | 0.794 | S | S | * | * | trans | -155.9 | 91.7 | 165.7 | 48.9 | 0 | 0 | 0 | 0 | 113.3 | D23 | D23-T25 PolarHBondContact O-N 3.05Š| ||
| 26 | R | 33.3 | Very low | 35.1 | Very low | 246 Ų | 246 | 137.1 Ų | 137.1 | 93% | 0.928 | 79% | 0.794 | S | S | * | * | trans | -178.6 | 126.4 | 134.1 | -109.4 | 168.3 | 147.1 | 139.5 | -6.5 | 114.8 | ||||
| 27 | N | 33 | Very low | 35.2 | Very low | 154 Ų | 154 | 136.1 Ų | 136.1 | 82% | 0.824 | 79% | 0.793 | S | S | * | * | trans | 66.2 | 98.7 | 150.1 | -98.8 | 3.1 | 0 | 0 | 0 | 120.5 | A29 | N27-A29 PolarHBondContact O-N 3.01Š| ||
| 28 | S | 36.4 | Very low | 35.7 | Very low | 125 Ų | 125 | 138.5 Ų | 138.5 | 87% | 0.874 | 80% | 0.799 | S | S | * | * | trans | -47.3 | 112.7 | 141.2 | -58.5 | 0 | 0 | 0 | 0 | 112 | ||||
| 29 | A | 35.7 | Very low | 36 | Very low | 76 Ų | 76 | 135.6 Ų | 135.6 | 63% | 0.628 | 78% | 0.784 | S | S | * | * | trans | -165.3 | 119.9 | 144 | 0 | 0 | 0 | 0 | 0 | 108.8 | N27 | N27-A29 PolarHBondContact O-N 3.01Š| ||
| 30 | D | 34.8 | Very low | 36.9 | Very low | 150 Ų | 150 | 131 Ų | 131 | 80% | 0.802 | 77% | 0.765 | S | S | * | * | trans | 60.7 | 69.7 | 151.6 | -51.7 | -28.3 | 0 | 0 | 0 | 119.2 | ||||
| 31 | Y | 34.1 | Very low | 37.5 | Very low | 233 Ų | 233 | 130.6 Ų | 130.6 | 91% | 0.914 | 76% | 0.762 | S | S | * | * | trans | -114.3 | 78.6 | 145.7 | -86.5 | -84.5 | 0 | 0 | 0 | 109.9 | S33 | Y31-S33 PolarHBondContact O-N 2.91Š| ||
| 32 | Q | 30.2 | Very low | 38.5 | Very low | 184 Ų | 184 | 133.1 Ų | 133.1 | 86% | 0.86 | 75% | 0.753 | S | S | * | * | trans | -80.4 | 103.1 | 151.4 | -72.7 | -168.8 | 4.2 | 0 | 0 | 107.6 | ||||
| 33 | S | 30.5 | Very low | 39.6 | Very low | 101 Ų | 101 | 127.8 Ų | 127.8 | 71% | 0.706 | 73% | 0.733 | S | S | * | * | trans | 154.1 | 110.2 | 140.2 | -75.2 | 0 | 0 | 0 | 0 | 112.5 | Y31 | Y31-S33 PolarHBondContact O-N 2.91Š| ||
| 34 | T | 32.4 | Very low | 40.9 | Very low | 119 Ų | 119 | 130.3 Ų | 130.3 | 73% | 0.73 | 73% | 0.732 | S | S | * | * | trans | 86.5 | 103.4 | 132.4 | -35.3 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 35 | T | 35.3 | Very low | 42.3 | Very low | 129 Ų | 129 | 131.8 Ų | 131.8 | 79% | 0.791 | 72% | 0.723 | S | S | * | * | trans | 63.8 | 94.2 | 142.2 | 62.4 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 36 | A | 37.3 | Very low | 43.4 | Very low | 101 Ų | 101 | 129.6 Ų | 129.6 | 84% | 0.835 | 70% | 0.702 | S | S | * | * | -162.1 | 59.6 | 129.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | S38 | A36-S38 VanDerWaalsContact C-N 3.31Å; A36-S38 PolarHBondContact O-N 3.4Å | |||
| 37 | S | 37.8 | Very low | 44.9 | Very low | 115 Ų | 115 | 123.4 Ų | 123.4 | 80% | 0.804 | 68% | 0.684 | S | S | * | * | trans | -66.6 | 97 | 171.9 | -52.6 | 0 | 0 | 0 | 0 | 107.7 | L39 | S37-L39 PolarHBondContact O-N 3.35Å; S37-L39 VanDerWaalsContact O-N 3.13Å | ||
| 38 | S | 41.1 | Very low | 46.7 | Very low | 116 Ų | 116 | 118.9 Ų | 118.9 | 81% | 0.811 | 66% | 0.664 | S | S | * | * | trans | 11.7 | 90.7 | 154.5 | -50.8 | 0 | 0 | 0 | 0 | 113.6 | A36 S40 | A36-S38 VanDerWaalsContact C-N 3.31Å; A36-S38 PolarHBondContact O-N 3.4Å; S38-S40 PolarHBondContact O-N 2.88Å | ||
| 39 | L | 42.3 | Very low | 48 | Very low | 113 Ų | 113 | 115.3 Ų | 115.3 | 59% | 0.592 | 64% | 0.635 | S | S | * | * | trans | -50.8 | 114.9 | 172.1 | -72.3 | 167 | 0 | 0 | 0 | 107.8 | S37 D43 | S37-L39 PolarHBondContact O-N 3.35Å; S37-L39 VanDerWaalsContact O-N 3.13Å; L39-D43 HydrophobicContact CB-CB 4.43Å; L39-D43 HydrophobicContact CD2-CB 4.25Å | ||
| 40 | S | 53 | Low | 49.3 | Very low | 68 Ų | 68 | 117.5 Ų | 117.5 | 48% | 0.476 | 63% | 0.634 | S | S | . | * | trans | -51.9 | 145.1 | 176.8 | -178 | 0 | 0 | 0 | 0 | 109.1 | S38 E42 D43 | S38-S40 PolarHBondContact O-N 2.88Å; S40-E42 PolarHBondContact O-N 2.88Å; S40-D43 PolarHBondContact O-N 3.45Å | ||
| 41 | S | 53.9 | Low | 50.4 | Low | 99 Ų | 99 | 116 Ų | 116 | 69% | 0.692 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -51.2 | -26.3 | -177.8 | -166.4 | 0 | 0 | 0 | 0 | 113.2 | ||
| 42 | E | 54.8 | Low | 51.5 | Low | 129 Ų | 129 | 111.3 Ų | 111.3 | 60% | 0.603 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -56.9 | -44.3 | 170.7 | -100.4 | 77.1 | -178.5 | 0 | 0 | 114.2 | S40 R44 W45 Y46 | S40-E42 PolarHBondContact O-N 2.88Å; E42-R44 PolarHBondContact O-N 3.06Å; E42-W45 PolarHBondContact O-N 2.9Å; E42-Y46 VanDerWaalsContact O-CD2 3.25Å; E42-Y46 WeakPolarHBondContact O-CD2 3.5Å; E42-Y46 PolarHBondContact O-N 2.84Å |
| 43 | D | 58.9 | Low | 52.5 | Low | 73 Ų | 73 | 106.1 Ų | 106.1 | 39% | 0.39 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -72 | -29.7 | -174.1 | -75.8 | -28.6 | 0 | 0 | 0 | 112.8 | L39 S40 W45 Y46 Q47 | L39-D43 HydrophobicContact CB-CB 4.43Å; L39-D43 HydrophobicContact CD2-CB 4.25Å; S40-D43 PolarHBondContact O-N 3.45Å; D43-W45 VanDerWaalsContact C-N 3.27Å; D43-W45 PolarHBondContact O-N 3.19Å; D43-Y46 WeakPolarHBondContact O-CB 3.47Å; D43-Y46 PolarHBondContact O-N 2.8Å; D43-Q47 PolarHBondContact O-N 2.71Å; D43-Q47 VanDerWaalsContact O-N 3.14Å |
| 44 | R | 64.7 | Low | 53.5 | Low | 195 Ų | 195 | 105.4 Ų | 105.4 | 74% | 0.736 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -62.4 | -36.3 | 172.5 | -92.2 | -178.6 | 139.1 | -161.8 | -4 | 112 | E42 Q47 S48 | E42-R44 PolarHBondContact O-N 3.06Å; R44-Q47 PolarHBondContact O-N 2.75Å; R44-S48 PolarHBondContact O-N 3.14Å |
| 45 | W | 70.2 | Confident | 54.4 | Low | 128 Ų | 128 | 103.5 Ų | 103.5 | 49% | 0.485 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -69.9 | -37.6 | 177.9 | -161.1 | 73.9 | 0 | 0 | 0 | 111.4 | E42 D43 Q47 S48 L49 | E42-W45 PolarHBondContact O-N 2.9Å; D43-W45 VanDerWaalsContact C-N 3.27Å; D43-W45 PolarHBondContact O-N 3.19Å; W45-Q47 PolarHBondContact O-N 3.33Å; W45-S48 PolarHBondContact O-N 3.41Å; W45-L49 HydrophobicContact CZ3-CD2 4.4Å; W45-L49 PolarHBondContact O-N 3.41Å |
| 46 | Y | 61.4 | Low | 55.2 | Low | 67 Ų | 67 | 105.8 Ų | 105.8 | 26% | 0.263 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -58.9 | -45.4 | 173 | -79.4 | -74.4 | 0 | 0 | 0 | 112.6 | E42 D43 M50 L202 | E42-Y46 VanDerWaalsContact O-CD2 3.25Å; E42-Y46 WeakPolarHBondContact O-CD2 3.5Å; E42-Y46 PolarHBondContact O-N 2.84Å; D43-Y46 WeakPolarHBondContact O-CB 3.47Å; D43-Y46 PolarHBondContact O-N 2.8Å; Y46-M50 WeakPolarHBondContact O-CG 3.44Å; Y46-M50 PolarHBondContact O-N 2.95Å; Y46-L202 HydrophobicContact CD1-CD1 4.22Å; Y46-L202 HydrophobicContact CE1-CD1 3.89Å |
| 47 | Q | 65.5 | Low | 55.3 | Low | 116 Ų | 116 | 104.4 Ų | 104.4 | 54% | 0.542 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -66 | -41 | 176.3 | -73.3 | -173.4 | 15.7 | 0 | 0 | 112.4 | D43 R44 W45 L49 M50 L51 | D43-Q47 PolarHBondContact O-N 2.71Å; D43-Q47 VanDerWaalsContact O-N 3.14Å; R44-Q47 PolarHBondContact O-N 2.75Å; W45-Q47 PolarHBondContact O-N 3.33Å; Q47-L49 VanDerWaalsContact C-N 3.35Å; Q47-L49 PolarHBondContact O-N 3.37Å; Q47-M50 PolarHBondContact O-N 2.91Å; Q47-L51 WeakPolarHBondContact O-CB 3.48Å; Q47-L51 WeakPolarHBondContact O-CD1 3.41Å; Q47-L51 WeakPolarHBondContact O-CG 3.25Å; Q47-L51 PolarHBondContact O-N 2.82Å |
| 48 | S | 70.6 | Confident | 55.5 | Low | 60 Ų | 60 | 107.2 Ų | 107.2 | 42% | 0.42 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61.9 | -42 | 179.6 | -168.5 | 0 | 0 | 0 | 0 | 112.1 | R44 W45 L51 Q52 | R44-S48 PolarHBondContact O-N 3.14Å; W45-S48 PolarHBondContact O-N 3.41Å; S48-L51 PolarHBondContact O-N 3.49Å; S48-Q52 PolarHBondContact O-N 3.47Å; S48-Q52 VanDerWaalsContact O-N 3.14Å |
| 49 | L | 62.7 | Low | 55.6 | Low | 50 Ų | 50 | 108.8 Ų | 108.8 | 26% | 0.262 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.7 | -43.3 | 178.5 | -161.9 | 73.5 | 0 | 0 | 0 | 111.7 | W45 Q47 L51 Q52 S53 L202 | W45-L49 HydrophobicContact CZ3-CD2 4.4Å; W45-L49 PolarHBondContact O-N 3.41Å; Q47-L49 VanDerWaalsContact C-N 3.35Å; Q47-L49 PolarHBondContact O-N 3.37Å; L49-L51 PolarHBondContact O-N 3.04Å; L49-Q52 PolarHBondContact O-N 3.24Å; L49-S53 PolarHBondContact O-N 3.31Å; L49-S53 PolarHBondContact O-OG 3.46Å; L49-L202 HydrophobicContact CD2-CB 4.37Å; L49-L202 HydrophobicContact CD2-CD1 4.26Å |
| 50 | M | 63.6 | Low | 55.7 | Low | 122 Ų | 122 | 110.5 Ų | 110.5 | 60% | 0.601 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -65.7 | -37.5 | 178.3 | -70.5 | -62.5 | -68.4 | 0 | 0 | 113 | Y46 Q47 T54 | Y46-M50 WeakPolarHBondContact O-CG 3.44Å; Y46-M50 PolarHBondContact O-N 2.95Å; Q47-M50 PolarHBondContact O-N 2.91Å; M50-T54 PolarHBondContact O-N 2.96Å; M50-T54 PolarHBondContact O-OG1 2.58Å |
| 51 | L | 58.5 | Low | 54.8 | Low | 118 Ų | 118 | 112.1 Ų | 112.1 | 62% | 0.618 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -69.7 | -36.3 | 179.1 | -75.2 | 162.3 | 0 | 0 | 0 | 112 | Q47 S48 L49 T54 A55 | Q47-L51 WeakPolarHBondContact O-CB 3.48Å; Q47-L51 WeakPolarHBondContact O-CD1 3.41Å; Q47-L51 WeakPolarHBondContact O-CG 3.25Å; Q47-L51 PolarHBondContact O-N 2.82Å; S48-L51 PolarHBondContact O-N 3.49Å; L49-L51 PolarHBondContact O-N 3.04Å; L51-T54 PolarHBondContact O-N 3.38Å; L51-A55 PolarHBondContact O-N 3.32Å; L51-A55 VanDerWaalsContact O-N 3.14Å |
| 52 | Q | 56.7 | Low | 53.8 | Low | 135 Ų | 135 | 112.8 Ų | 112.8 | 63% | 0.631 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -67 | -38.1 | 178.9 | -125.9 | 177.7 | 78.3 | 0 | 0 | 112.4 | S48 L49 T54 | S48-Q52 PolarHBondContact O-N 3.47Å; S48-Q52 VanDerWaalsContact O-N 3.14Å; L49-Q52 PolarHBondContact O-N 3.24Å; Q52-T54 VanDerWaalsContact C-N 3.32Å; Q52-T54 PolarHBondContact O-N 3.24Å |
| 53 | S | 50.4 | Low | 52.8 | Low | 75 Ų | 75 | 111.9 Ų | 111.9 | 52% | 0.524 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -62 | -40.1 | 173.9 | -45.5 | 0 | 0 | 0 | 0 | 112 | L49 | L49-S53 PolarHBondContact O-N 3.31Å; L49-S53 PolarHBondContact O-OG 3.46Å |
| 54 | T | 53 | Low | 51.7 | Low | 85 Ų | 85 | 113.4 Ų | 113.4 | 52% | 0.521 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -76.9 | -33.4 | -173 | -51.8 | 0 | 0 | 0 | 0 | 112.5 | M50 L51 Q52 R56 | M50-T54 PolarHBondContact O-N 2.96Å; M50-T54 PolarHBondContact O-OG1 2.58Å; L51-T54 PolarHBondContact O-N 3.38Å; Q52-T54 VanDerWaalsContact C-N 3.32Å; Q52-T54 PolarHBondContact O-N 3.24Å; T54-R56 VanDerWaalsContact C-N 3.34Å; T54-R56 PolarHBondContact O-N 2.8Å |
| 55 | A | 51.3 | Low | 50.3 | Low | 80 Ų | 80 | 110 Ų | 110 | 66% | 0.661 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -70.7 | -28 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | L51 | L51-A55 PolarHBondContact O-N 3.32Å; L51-A55 VanDerWaalsContact O-N 3.14Å |
| 56 | R | 51.2 | Low | 48.6 | Very low | 176 Ų | 176 | 107.9 Ų | 107.9 | 66% | 0.664 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -93.3 | -21 | -175.1 | -158.3 | 172.2 | 170.5 | 128.2 | -1 | 113.9 | T54 K58 E213 | T54-R56 VanDerWaalsContact C-N 3.34Å; T54-R56 PolarHBondContact O-N 2.8Å; R56-K58 PolarHBondContact O-N 2.96Å; R56-E213 IonicContact NE-OE1 2.89Å |
| 57 | A | 40.4 | Very low | 47.2 | Very low | 73 Ų | 73 | 108.2 Ų | 108.2 | 60% | 0.603 | 66% | 0.661 | S | S | * | * | G | 310 helix | trans | -66.6 | -15.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | N59 | A57-N59 VanDerWaalsContact C-N 3.33Å; A57-N59 PolarHBondContact O-N 3.42Å |
| 58 | K | 42.3 | Very low | 45.7 | Very low | 174 Ų | 174 | 107.4 Ų | 107.4 | 76% | 0.757 | 67% | 0.668 | S | S | * | * | G | 310 helix | trans | -83.3 | 3.2 | -178.1 | -70 | -174.1 | 178.3 | 179 | 0 | 115.5 | R56 | R56-K58 PolarHBondContact O-N 2.96Š|
| 59 | N | 43.1 | Very low | 44.3 | Very low | 148 Ų | 148 | 110.2 Ų | 110.2 | 79% | 0.791 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -117.8 | 8.2 | -177.6 | -107.7 | -42.8 | 0 | 0 | 0 | 115.5 | A57 | A57-N59 VanDerWaalsContact C-N 3.33Å; A57-N59 PolarHBondContact O-N 3.42Å |
| 60 | L | 42.7 | Very low | 43 | Very low | 149 Ų | 149 | 114.6 Ų | 114.6 | 78% | 0.78 | 71% | 0.711 | S | S | * | * | trans | -128.3 | 63.1 | -178.9 | -64.1 | 172.2 | 0 | 0 | 0 | 110.9 | ||||
| 61 | S | 34 | Very low | 41.9 | Very low | 103 Ų | 103 | 117 Ų | 117 | 72% | 0.72 | 73% | 0.726 | S | S | * | * | trans | -139.6 | 82.9 | 165.2 | 52 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 62 | S | 33 | Very low | 40.7 | Very low | 112 Ų | 112 | 117 Ų | 117 | 78% | 0.783 | 74% | 0.735 | S | S | * | * | trans | -173 | 121.5 | 159.8 | -71.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 63 | S | 35 | Very low | 39.8 | Very low | 110 Ų | 110 | 116.3 Ų | 116.3 | 77% | 0.769 | 75% | 0.746 | S | S | * | * | trans | 76.6 | 99.1 | 146.7 | -43.1 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 64 | S | 34.8 | Very low | 39 | Very low | 105 Ų | 105 | 122.1 Ų | 122.1 | 73% | 0.734 | 76% | 0.764 | S | S | * | * | 90.3 | 103.8 | 62.6 | 75.5 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 65 | S | 35.6 | Very low | 38.3 | Very low | 123 Ų | 123 | 122.8 Ų | 122.8 | 86% | 0.86 | 78% | 0.779 | S | S | * | * | trans | 42.7 | 122.3 | 134.4 | 64.9 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 66 | G | 34.5 | Very low | 37.4 | Very low | 84 Ų | 84 | 123.3 Ų | 123.3 | 87% | 0.866 | 78% | 0.783 | S | S | * | * | trans | 138.7 | 122.9 | 158.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 67 | G | 31.5 | Very low | 36.6 | Very low | 74 Ų | 74 | 120.3 Ų | 120.3 | 76% | 0.763 | 78% | 0.784 | S | S | * | * | cis | 152.9 | 124.3 | 16.3 | 0 | 0 | 0 | 0 | 0 | 104.6 | ||||
| 68 | S | 34.7 | Very low | 36.4 | Very low | 99 Ų | 99 | 126.2 Ų | 126.2 | 69% | 0.692 | 80% | 0.799 | S | S | * | * | trans | -48.1 | 142.8 | -175.2 | 167.9 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 69 | S | 40.3 | Very low | 35.8 | Very low | 119 Ų | 119 | 127 Ų | 127 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | trans | -155.6 | 103 | 142.5 | -69.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 70 | D | 35.5 | Very low | 35.2 | Very low | 143 Ų | 143 | 123.2 Ų | 123.2 | 77% | 0.765 | 80% | 0.801 | S | S | * | * | trans | -61.9 | 124.7 | 165.2 | -63.9 | -57.8 | 0 | 0 | 0 | 110.1 | ||||
| 71 | L | 41.1 | Very low | 34.7 | Very low | 173 Ų | 173 | 125.3 Ų | 125.3 | 91% | 0.906 | 80% | 0.804 | S | S | * | * | trans | -149.7 | 108.6 | 148.8 | -76.2 | -173.8 | 0 | 0 | 0 | 110.6 | ||||
| 72 | S | 34.5 | Very low | 34.7 | Very low | 116 Ų | 116 | 126.3 Ų | 126.3 | 81% | 0.811 | 81% | 0.806 | S | S | * | * | trans | -59.2 | 127.7 | 163.1 | 176.9 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 73 | S | 36.9 | Very low | 34.6 | Very low | 122 Ų | 122 | 127.1 Ų | 127.1 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | trans | -155 | 105 | 152.4 | -77.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 74 | E | 34.7 | Very low | 34.7 | Very low | 196 Ų | 196 | 127.8 Ų | 127.8 | 92% | 0.916 | 80% | 0.801 | S | S | * | * | trans | -57.8 | 123.1 | 165.7 | -179.4 | 175.9 | 122.3 | 0 | 0 | 110.9 | ||||
| 75 | A | 36.6 | Very low | 34.6 | Very low | 100 Ų | 100 | 128.8 Ų | 128.8 | 83% | 0.826 | 80% | 0.802 | S | S | * | * | trans | -149.7 | 120.2 | 161.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 76 | A | 33.9 | Very low | 34.3 | Very low | 91 Ų | 91 | 130.9 Ų | 130.9 | 75% | 0.752 | 80% | 0.803 | S | S | * | * | trans | -72.5 | 136.9 | -170.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 77 | V | 34 | Very low | 34.2 | Very low | 112 Ų | 112 | 134.4 Ų | 134.4 | 68% | 0.679 | 80% | 0.801 | S | S | * | * | trans | 41.1 | 104.4 | 130.1 | -172.6 | 0 | 0 | 0 | 0 | 117.4 | Q79 | V77-Q79 HydrophobicContact CG1-CG 4.48Š| ||
| 78 | H | 34.8 | Very low | 34.1 | Very low | 197 Ų | 197 | 139.5 Ų | 139.5 | 91% | 0.912 | 81% | 0.805 | S | S | * | * | trans | -129.3 | 119.6 | 142 | -82.9 | -17.6 | 0 | 0 | 0 | 110.8 | G80 | H78-G80 PolarHBondContact O-N 3.35Š| ||
| 79 | Q | 30.5 | Very low | 34.2 | Very low | 190 Ų | 190 | 139 Ų | 139 | 89% | 0.888 | 80% | 0.799 | S | S | * | * | trans | -65.2 | 110.6 | -179.2 | -73.7 | 166.8 | -25.3 | 0 | 0 | 110.8 | V77 | V77-Q79 HydrophobicContact CG1-CG 4.48Š| ||
| 80 | G | 31.3 | Very low | 33.8 | Very low | 69 Ų | 69 | 141.8 Ų | 141.8 | 71% | 0.711 | 80% | 0.799 | S | S | * | * | trans | -103.8 | 98.4 | 167 | 0 | 0 | 0 | 0 | 0 | 110 | H78 V82 | H78-G80 PolarHBondContact O-N 3.35Å; G80-V82 PolarHBondContact O-N 2.98Å | ||
| 81 | K | 30.7 | Very low | 33.9 | Very low | 193 Ų | 193 | 140.5 Ų | 140.5 | 84% | 0.839 | 80% | 0.796 | S | S | * | * | trans | -67.4 | 105.2 | 178.4 | -159.6 | 171.5 | -177.1 | -179.6 | 0 | 109 | ||||
| 82 | V | 34.9 | Very low | 33.7 | Very low | 125 Ų | 125 | 135.1 Ų | 135.1 | 76% | 0.758 | 78% | 0.783 | S | S | * | * | trans | -109.5 | 112.6 | 171.5 | -178.2 | 0 | 0 | 0 | 0 | 107.8 | G80 T84 | G80-V82 PolarHBondContact O-N 2.98Å; V82-T84 PolarHBondContact O-N 2.82Å; V82-T84 VanDerWaalsContact O-N 3.13Å | ||
| 83 | D | 30.5 | Very low | 34.1 | Very low | 129 Ų | 129 | 135.4 Ų | 135.4 | 69% | 0.69 | 78% | 0.779 | S | S | * | * | trans | -62.2 | 106.2 | -178.4 | -66.3 | -50.2 | 0 | 0 | 0 | 111.2 | T85 | D83-T85 VanDerWaalsContact C-N 3.27Å; D83-T85 PolarHBondContact O-N 2.72Å | ||
| 84 | T | 37.5 | Very low | 34.2 | Very low | 124 Ų | 124 | 131.3 Ų | 131.3 | 76% | 0.761 | 76% | 0.756 | S | S | * | * | trans | -90.1 | 52.6 | 171 | 39.9 | 0 | 0 | 0 | 0 | 111.2 | V82 L86 | V82-T84 PolarHBondContact O-N 2.82Å; V82-T84 VanDerWaalsContact O-N 3.13Å; T84-L86 PolarHBondContact O-N 3.38Å; T84-L86 VanDerWaalsContact O-N 3.09Å | ||
| 85 | T | 32 | Very low | 34.6 | Very low | 125 Ų | 125 | 127 Ų | 127 | 77% | 0.767 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | 60.3 | 168.7 | 52.8 | 0 | 0 | 0 | 0 | 110.8 | D83 | D83-T85 VanDerWaalsContact C-N 3.27Å; D83-T85 PolarHBondContact O-N 2.72Å |
| 86 | L | 31.1 | Very low | 35 | Very low | 168 Ų | 168 | 126 Ų | 126 | 88% | 0.88 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -151.1 | 30.8 | 166.6 | -98.2 | -173.7 | 0 | 0 | 0 | 113.4 | T84 | T84-L86 PolarHBondContact O-N 3.38Å; T84-L86 VanDerWaalsContact O-N 3.09Å |
| 87 | L | 30.9 | Very low | 35.6 | Very low | 158 Ų | 158 | 126.2 Ų | 126.2 | 83% | 0.827 | 71% | 0.711 | S | S | * | * | trans | -129.8 | 84.2 | 166.1 | -69.1 | 171.7 | 0 | 0 | 0 | 108.1 | P89 | L87-P89 WeakPolarHBondContact O-CD 3.27Š| ||
| 88 | H | 28.9 | Very low | 36.4 | Very low | 181 Ų | 181 | 126 Ų | 126 | 84% | 0.838 | 71% | 0.705 | S | S | * | * | trans | -86.2 | 100.3 | 160 | -158.8 | 93.1 | 0 | 0 | 0 | 106.1 | Q90 | H88-Q90 PolarHBondContact O-N 3.04Š| ||
| 89 | P | 37.1 | Very low | 37.7 | Very low | 87 Ų | 87 | 119.7 Ų | 119.7 | 57% | 0.565 | 69% | 0.693 | S | S | * | * | trans | -71.2 | 102.7 | 179.2 | 28 | -32.3 | 0 | 0 | 0 | 108.6 | L87 V91 | L87-P89 WeakPolarHBondContact O-CD 3.27Å; P89-V91 PolarHBondContact O-N 2.8Å | ||
| 90 | Q | 32.1 | Very low | 39 | Very low | 179 Ų | 179 | 116.9 Ų | 116.9 | 84% | 0.836 | 70% | 0.695 | S | S | * | * | trans | -64.2 | 119.8 | 163.8 | -96.1 | -163.2 | -22 | 0 | 0 | 108.4 | H88 G92 | H88-Q90 PolarHBondContact O-N 3.04Å; Q90-G92 VanDerWaalsContact C-N 3.33Å; Q90-G92 PolarHBondContact O-N 3.39Å | ||
| 91 | V | 38.3 | Very low | 39.6 | Very low | 115 Ų | 115 | 123 Ų | 123 | 70% | 0.697 | 70% | 0.696 | S | S | * | * | trans | -60.4 | 94.8 | 169 | 179.6 | 0 | 0 | 0 | 0 | 107.9 | P89 V93 | P89-V91 PolarHBondContact O-N 2.8Å; V91-V93 PolarHBondContact O-N 2.74Å | ||
| 92 | G | 37.9 | Very low | 40.3 | Very low | 61 Ų | 61 | 119 Ų | 119 | 63% | 0.629 | 68% | 0.684 | S | S | * | * | trans | -82.8 | 106.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | Q90 G94 | Q90-G92 VanDerWaalsContact C-N 3.33Å; Q90-G92 PolarHBondContact O-N 3.39Å; G92-G94 VanDerWaalsContact C-N 3.31Å; G92-G94 PolarHBondContact O-N 2.9Å | ||
| 93 | V | 41 | Very low | 41.1 | Very low | 122 Ų | 122 | 117.4 Ų | 117.4 | 74% | 0.739 | 67% | 0.671 | S | S | * | * | trans | -70.1 | 94.1 | 166.1 | -175.8 | 0 | 0 | 0 | 0 | 107.1 | V91 | V91-V93 PolarHBondContact O-N 2.74Š| ||
| 94 | G | 40.6 | Very low | 42.1 | Very low | 35 Ų | 35 | 116.2 Ų | 116.2 | 36% | 0.361 | 67% | 0.67 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -97.3 | 135.7 | 175 | 0 | 0 | 0 | 0 | 0 | 110.7 | G92 L105 | G92-G94 VanDerWaalsContact C-N 3.31Å; G92-G94 PolarHBondContact O-N 2.9Å; G94-L105 PolarHBondContact O-N 2.81Å |
| 95 | N | 43.3 | Very low | 42.7 | Very low | 106 Ų | 106 | 114 Ų | 114 | 57% | 0.567 | 65% | 0.653 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -89 | 124.3 | 167.8 | -69.1 | -13.3 | 0 | 0 | 0 | 108.4 | ||
| 96 | L | 43.8 | Very low | 43.2 | Very low | 80 Ų | 80 | 115.1 Ų | 115.1 | 42% | 0.419 | 65% | 0.654 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -90.7 | 113.3 | 168 | -175.2 | 64.6 | 0 | 0 | 0 | 108.2 | I98 L103 L105 | L96-I98 HydrophobicContact CD2-CD1 3.74Å; L96-I98 HydrophobicContact CD2-CG1 3.95Å; L96-I98 HydrophobicContact CG-CD1 4.21Å; L96-I98 HydrophobicContact CG-CG1 3.83Å; L96-I98 PolarHBondContact O-N 3.44Å; L96-L103 PolarHBondContact N-O 3.25Å; L96-L103 VanDerWaalsContact N-O 3.12Å; L96-L103 PolarHBondContact O-N 3.5Å; L96-L105 HydrophobicContact CB-CD1 3.6Å; L96-L105 HydrophobicContact CB-CG 3.86Å; L96-L105 HydrophobicContact CD2-CD1 4.16Å; L96-L105 HydrophobicContact CG-CD1 4.38Å |
| 97 | V | 46 | Very low | 43.9 | Very low | 95 Ų | 95 | 113 Ų | 113 | 58% | 0.576 | 64% | 0.642 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -82.8 | 106.1 | 174.1 | -173.7 | 0 | 0 | 0 | 0 | 107.7 | G99 N102 | V97-G99 WeakPolarHBondContact CG1-O 3.23Å; V97-N102 WeakPolarHBondContact CG2-OD1 3.32Å |
| 98 | I | 51.1 | Low | 44.3 | Very low | 108 Ų | 108 | 110 Ų | 110 | 55% | 0.554 | 64% | 0.635 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -111 | 104.5 | 168.6 | -53.1 | -177.2 | 0 | 0 | 0 | 107.6 | L96 R101 | L96-I98 HydrophobicContact CD2-CD1 3.74Å; L96-I98 HydrophobicContact CD2-CG1 3.95Å; L96-I98 HydrophobicContact CG-CD1 4.21Å; L96-I98 HydrophobicContact CG-CG1 3.83Å; L96-I98 PolarHBondContact O-N 3.44Å; I98-R101 PolarHBondContact N-O 2.87Å; I98-R101 PolarHBondContact O-N 3.44Å |
| 99 | G | 62.4 | Low | 44.8 | Very low | 64 Ų | 64 | 106.1 Ų | 106.1 | 66% | 0.66 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 63.1 | -134.7 | -173.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | V97 R101 | V97-G99 WeakPolarHBondContact CG1-O 3.23Å; G99-R101 VanDerWaalsContact C-N 3.3Å; G99-R101 PolarHBondContact O-N 3.37Å |
| 100 | S | 57.8 | Low | 45 | Very low | 131 Ų | 131 | 108.8 Ų | 108.8 | 92% | 0.916 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | 10.5 | -179.1 | -42.4 | 0 | 0 | 0 | 0 | 114.2 | ||
| 101 | R | 43.8 | Very low | 45 | Very low | 198 Ų | 198 | 103.4 Ų | 103.4 | 75% | 0.747 | 62% | 0.624 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -119.8 | 121.9 | -175.3 | -63.6 | -173.6 | 178.9 | -171.4 | 0.3 | 110.5 | I98 G99 | I98-R101 PolarHBondContact N-O 2.87Å; I98-R101 PolarHBondContact O-N 3.44Å; G99-R101 VanDerWaalsContact C-N 3.3Å; G99-R101 PolarHBondContact O-N 3.37Å |
| 102 | N | 46.1 | Very low | 44.7 | Very low | 108 Ų | 108 | 103.7 Ų | 103.7 | 58% | 0.578 | 63% | 0.631 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -78.9 | 117.2 | 169.8 | -69.4 | -41.8 | 0 | 0 | 0 | 108.4 | V97 | V97-N102 WeakPolarHBondContact CG2-OD1 3.32Å |
| 103 | L | 50.3 | Low | 44.5 | Very low | 92 Ų | 92 | 107.1 Ų | 107.1 | 48% | 0.482 | 64% | 0.635 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -107.1 | 125.1 | 172.3 | -65.7 | 171.4 | 0 | 0 | 0 | 108.8 | L96 L105 | L96-L103 PolarHBondContact N-O 3.25Å; L96-L103 VanDerWaalsContact N-O 3.12Å; L96-L103 PolarHBondContact O-N 3.5Å; L103-L105 PolarHBondContact O-N 3.34Å |
| 104 | P | 53 | Low | 44.3 | Very low | 103 Ų | 103 | 110 Ų | 110 | 67% | 0.669 | 64% | 0.638 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -70.3 | 123.7 | 174.6 | 27.3 | -30.9 | 0 | 0 | 0 | 109.4 | ||
| 105 | L | 48.5 | Very low | 43.7 | Very low | 77 Ų | 77 | 112 Ų | 112 | 40% | 0.403 | 66% | 0.659 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -93.4 | 118.7 | 170.2 | -70.4 | 178.8 | 0 | 0 | 0 | 109.2 | G94 L96 L103 | G94-L105 PolarHBondContact O-N 2.81Å; L96-L105 HydrophobicContact CB-CD1 3.6Å; L96-L105 HydrophobicContact CB-CG 3.86Å; L96-L105 HydrophobicContact CD2-CD1 4.16Å; L96-L105 HydrophobicContact CG-CD1 4.38Å; L103-L105 PolarHBondContact O-N 3.34Å |
| 106 | N | 43.3 | Very low | 43.3 | Very low | 150 Ų | 150 | 111.6 Ų | 111.6 | 80% | 0.802 | 67% | 0.669 | S | S | * | * | trans | -106.3 | 94.8 | 172.4 | -159.1 | -15 | 0 | 0 | 0 | 108.4 | S108 | N106-S108 PolarHBondContact O-N 3.06Š| ||
| 107 | I | 46.3 | Very low | 43.2 | Very low | 122 Ų | 122 | 114.1 Ų | 114.1 | 63% | 0.626 | 69% | 0.691 | S | S | * | * | trans | -90.3 | 94 | 177.9 | -55.1 | 174.7 | 0 | 0 | 0 | 107.3 | V109 | I107-V109 PolarHBondContact O-N 2.81Š| ||
| 108 | S | 39.2 | Very low | 42.7 | Very low | 97 Ų | 97 | 113.5 Ų | 113.5 | 68% | 0.678 | 70% | 0.696 | S | S | * | * | trans | -76.1 | 111.9 | 166.9 | 177 | 0 | 0 | 0 | 0 | 108.6 | N106 I110 | N106-S108 PolarHBondContact O-N 3.06Å; S108-I110 PolarHBondContact O-N 3.03Å | ||
| 109 | V | 39.5 | Very low | 41.8 | Very low | 99 Ų | 99 | 116.9 Ų | 116.9 | 60% | 0.6 | 71% | 0.711 | S | S | * | * | trans | -66.7 | 114.2 | 172 | 169.3 | 0 | 0 | 0 | 0 | 108.4 | I107 G111 | I107-V109 PolarHBondContact O-N 2.81Å; V109-G111 PolarHBondContact O-N 3.44Å | ||
| 110 | I | 40.9 | Very low | 40.6 | Very low | 143 Ų | 143 | 121.5 Ų | 121.5 | 73% | 0.733 | 72% | 0.716 | S | S | * | * | trans | -70.6 | 96.8 | 174.5 | -60.1 | 169.4 | 0 | 0 | 0 | 107.2 | S108 | S108-I110 PolarHBondContact O-N 3.03Š| ||
| 111 | G | 32.2 | Very low | 39.3 | Very low | 65 Ų | 65 | 120.9 Ų | 120.9 | 67% | 0.67 | 71% | 0.706 | S | S | * | * | trans | -74.6 | 122.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | V109 D113 | V109-G111 PolarHBondContact O-N 3.44Å; G111-D113 PolarHBondContact O-N 3.47Å | ||
| 112 | S | 31.4 | Very low | 39 | Very low | 121 Ų | 121 | 118.7 Ų | 118.7 | 85% | 0.846 | 71% | 0.708 | S | S | * | * | trans | -46.1 | 124.1 | 169.5 | -61 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 113 | D | 34.7 | Very low | 38.1 | Very low | 134 Ų | 134 | 118.5 Ų | 118.5 | 72% | 0.717 | 72% | 0.715 | S | S | * | * | -166.2 | 133.5 | 121.1 | -131.3 | -9.1 | 0 | 0 | 0 | 112.2 | G111 | G111-D113 PolarHBondContact O-N 3.47Š| |||
| 114 | K | 36.3 | Very low | 37.3 | Very low | 183 Ų | 183 | 121 Ų | 121 | 80% | 0.796 | 73% | 0.729 | S | S | * | * | trans | 50.9 | 106 | 156.7 | -46.3 | -164.7 | -177 | 175.7 | 0 | 120 | ||||
| 115 | G | 28.1 | Very low | 36.5 | Very low | 77 Ų | 77 | 120 Ų | 120 | 79% | 0.794 | 73% | 0.729 | S | S | * | * | 92.9 | 126.7 | 126.4 | 0 | 0 | 0 | 0 | 0 | 116.4 | |||||
| 116 | A | 34.1 | Very low | 35.6 | Very low | 96 Ų | 96 | 122.8 Ų | 122.8 | 79% | 0.793 | 74% | 0.744 | S | S | * | * | trans | 83.8 | 131.6 | 171.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | A118 | A116-A118 PolarHBondContact O-N 3.34Å; A116-A118 VanDerWaalsContact O-N 3.12Å | ||
| 117 | P | 42.2 | Very low | 35.4 | Very low | 134 Ų | 134 | 121.9 Ų | 121.9 | 87% | 0.87 | 74% | 0.744 | S | S | * | * | trans | -85 | 90.6 | -174.2 | 34.7 | -30.2 | 0 | 0 | 0 | 109.1 | M119 | P117-M119 PolarHBondContact O-N 3.09Š| ||
| 118 | A | 35.1 | Very low | 34.7 | Very low | 82 Ų | 82 | 122 Ų | 122 | 68% | 0.678 | 75% | 0.746 | S | S | * | * | trans | -79.7 | 114.8 | 161.2 | 0 | 0 | 0 | 0 | 0 | 107.3 | A116 E120 | A116-A118 PolarHBondContact O-N 3.34Å; A116-A118 VanDerWaalsContact O-N 3.12Å; A118-E120 VanDerWaalsContact C-N 3.26Å; A118-E120 PolarHBondContact O-N 3.39Å | ||
| 119 | M | 33.3 | Very low | 34.5 | Very low | 178 Ų | 178 | 122.5 Ų | 122.5 | 88% | 0.877 | 75% | 0.75 | S | S | * | * | trans | -54.9 | 95.7 | 161.3 | -80.2 | -147.8 | -173.9 | 0 | 0 | 108.3 | P117 T121 | P117-M119 PolarHBondContact O-N 3.09Å; M119-T121 PolarHBondContact O-N 2.73Å; M119-T121 PolarHBondContact O-OG1 2.83Å | ||
| 120 | E | 35.4 | Very low | 34.1 | Very low | 162 Ų | 162 | 122 Ų | 122 | 76% | 0.757 | 76% | 0.756 | S | S | * | * | trans | -73.2 | 87.2 | 167.8 | -75.6 | -168.1 | 162.9 | 0 | 0 | 107.7 | A118 I122 | A118-E120 VanDerWaalsContact C-N 3.26Å; A118-E120 PolarHBondContact O-N 3.39Å; E120-I122 PolarHBondContact O-N 3.27Å; E120-I122 VanDerWaalsContact O-N 3.09Å | ||
| 121 | T | 31.7 | Very low | 33.6 | Very low | 117 Ų | 117 | 125.8 Ų | 125.8 | 72% | 0.718 | 76% | 0.761 | S | S | * | * | trans | -49.2 | 110.3 | 165.7 | -55.7 | 0 | 0 | 0 | 0 | 106.9 | M119 S123 | M119-T121 PolarHBondContact O-N 2.73Å; M119-T121 PolarHBondContact O-OG1 2.83Å; T121-S123 PolarHBondContact O-N 2.83Å | ||
| 122 | I | 36.5 | Very low | 33.7 | Very low | 152 Ų | 152 | 128 Ų | 128 | 78% | 0.779 | 76% | 0.764 | S | S | * | * | trans | -60.5 | 97.1 | 168.4 | -58.2 | 169.1 | 0 | 0 | 0 | 105.3 | E120 L124 | E120-I122 PolarHBondContact O-N 3.27Å; E120-I122 VanDerWaalsContact O-N 3.09Å; I122-L124 VanDerWaalsContact C-N 3.28Å; I122-L124 HydrophobicContact CG2-CD1 4.38Å; I122-L124 PolarHBondContact O-N 2.94Å | ||
| 123 | S | 28.2 | Very low | 33.9 | Very low | 105 Ų | 105 | 131.9 Ų | 131.9 | 73% | 0.734 | 77% | 0.765 | S | S | * | * | trans | -66.1 | 96.1 | 170.4 | -177.5 | 0 | 0 | 0 | 0 | 106 | T121 A125 | T121-S123 PolarHBondContact O-N 2.83Å; S123-A125 VanDerWaalsContact C-N 3.34Å; S123-A125 PolarHBondContact O-N 2.66Å | ||
| 124 | L | 33.2 | Very low | 33.7 | Very low | 145 Ų | 145 | 131.7 Ų | 131.7 | 76% | 0.759 | 77% | 0.765 | S | S | * | * | trans | -55 | 109.8 | 156.3 | -107.4 | 71.4 | 0 | 0 | 0 | 104.8 | I122 D126 | I122-L124 VanDerWaalsContact C-N 3.28Å; I122-L124 HydrophobicContact CG2-CD1 4.38Å; I122-L124 PolarHBondContact O-N 2.94Å; L124-D126 VanDerWaalsContact C-N 3.31Å; L124-D126 PolarHBondContact O-N 2.89Å | ||
| 125 | A | 35.2 | Very low | 34.1 | Very low | 82 Ų | 82 | 129 Ų | 129 | 68% | 0.678 | 77% | 0.765 | S | S | * | * | trans | -54.9 | 104.2 | 170.3 | 0 | 0 | 0 | 0 | 0 | 107.2 | S123 T127 | S123-A125 VanDerWaalsContact C-N 3.34Å; S123-A125 PolarHBondContact O-N 2.66Å; A125-T127 PolarHBondContact O-N 3.47Å | ||
| 126 | D | 30.2 | Very low | 34.4 | Very low | 135 Ų | 135 | 130.1 Ų | 130.1 | 72% | 0.722 | 76% | 0.76 | S | S | * | * | trans | -54.3 | 88.6 | 164.3 | -88.2 | -43.3 | 0 | 0 | 0 | 107.3 | L124 N128 | L124-D126 VanDerWaalsContact C-N 3.31Å; L124-D126 PolarHBondContact O-N 2.89Å; D126-N128 HydrophobicContact CB-CB 4.45Å; D126-N128 PolarHBondContact O-N 3.06Å; D126-N128 PolarHBondContact OD1-ND2 2.77Å | ||
| 127 | T | 38.6 | Very low | 35 | Very low | 131 Ų | 131 | 130.2 Ų | 130.2 | 80% | 0.804 | 76% | 0.755 | S | S | * | * | trans | -81.5 | 53.1 | 153.9 | 54.2 | 0 | 0 | 0 | 0 | 108 | A125 S129 | A125-T127 PolarHBondContact O-N 3.47Å; T127-S129 PolarHBondContact O-N 2.81Å | ||
| 128 | N | 31.6 | Very low | 34.9 | Very low | 125 Ų | 125 | 125.9 Ų | 125.9 | 67% | 0.668 | 74% | 0.735 | S | S | * | * | trans | -66.8 | 68.9 | 151.8 | -85.8 | -37.9 | 0 | 0 | 0 | 107.2 | D126 A130 | D126-N128 HydrophobicContact CB-CB 4.45Å; D126-N128 PolarHBondContact O-N 3.06Å; D126-N128 PolarHBondContact OD1-ND2 2.77Å; N128-A130 PolarHBondContact O-N 2.7Å | ||
| 129 | S | 35.1 | Very low | 35.4 | Very low | 107 Ų | 107 | 126.1 Ų | 126.1 | 75% | 0.748 | 74% | 0.737 | S | S | * | * | trans | -67.8 | 82.5 | 153.8 | 168.2 | 0 | 0 | 0 | 0 | 105.6 | T127 R131 | T127-S129 PolarHBondContact O-N 2.81Å; S129-R131 PolarHBondContact O-N 3.48Å | ||
| 130 | A | 32.3 | Very low | 36.1 | Very low | 89 Ų | 89 | 125.8 Ų | 125.8 | 74% | 0.736 | 73% | 0.73 | S | S | * | * | trans | -55 | 82.3 | 169 | 0 | 0 | 0 | 0 | 0 | 108.9 | N128 P132 | N128-A130 PolarHBondContact O-N 2.7Å; A130-P132 WeakPolarHBondContact O-CD 3.47Å | ||
| 131 | R | 29.5 | Very low | 36.7 | Very low | 221 Ų | 221 | 125.4 Ų | 125.4 | 83% | 0.834 | 72% | 0.723 | S | S | * | * | trans | -75.3 | 115.5 | 157.9 | -137.9 | 177.3 | -164.5 | -133.9 | 2.8 | 104.3 | S129 F133 | S129-R131 PolarHBondContact O-N 3.48Å; R131-F133 PolarHBondContact O-N 3.35Å | ||
| 132 | P | 34 | Very low | 37.2 | Very low | 112 Ų | 112 | 128.9 Ų | 128.9 | 73% | 0.727 | 72% | 0.723 | S | S | * | * | trans | -54.8 | 123.3 | -177.6 | 20.5 | -29.8 | 0 | 0 | 0 | 107.4 | A130 N134 | A130-P132 WeakPolarHBondContact O-CD 3.47Å; P132-N134 PolarHBondContact O-N 3.28Å | ||
| 133 | F | 36.4 | Very low | 37.7 | Very low | 202 Ų | 202 | 125.6 Ų | 125.6 | 89% | 0.886 | 71% | 0.713 | S | S | * | * | trans | -53.5 | 95.8 | 164.4 | -81.6 | -89.2 | 0 | 0 | 0 | 106 | R131 P135 | R131-F133 PolarHBondContact O-N 3.35Å; F133-P135 WeakPolarHBondContact O-CD 3.21Å | ||
| 134 | N | 31.1 | Very low | 38.9 | Very low | 131 Ų | 131 | 123.8 Ų | 123.8 | 70% | 0.701 | 70% | 0.701 | S | S | * | * | trans | -73.9 | 104 | 168 | -173.8 | 1.7 | 0 | 0 | 0 | 105 | P132 C136 | P132-N134 PolarHBondContact O-N 3.28Å; N134-C136 PolarHBondContact O-N 2.93Å; N134-C136 WeakPolarHBondContact OD1-CB 3.43Å | ||
| 135 | P | 43.1 | Very low | 39.7 | Very low | 125 Ų | 125 | 124.7 Ų | 124.7 | 81% | 0.812 | 69% | 0.694 | S | S | * | * | trans | -83.6 | 67 | -178.3 | 32.9 | -21.2 | 0 | 0 | 0 | 107 | F133 | F133-P135 WeakPolarHBondContact O-CD 3.21Š| ||
| 136 | C | 36.1 | Very low | 40.3 | Very low | 102 Ų | 102 | 127.8 Ų | 127.8 | 69% | 0.689 | 69% | 0.693 | S | S | * | * | trans | -148.2 | 41.8 | -177.4 | -139.8 | 0 | 0 | 0 | 0 | 113.5 | N134 | N134-C136 PolarHBondContact O-N 2.93Å; N134-C136 WeakPolarHBondContact OD1-CB 3.43Å | ||
| 137 | S | 46.1 | Very low | 41.3 | Very low | 98 Ų | 98 | 124.8 Ų | 124.8 | 69% | 0.685 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -132.3 | -6.8 | 159.3 | -63.5 | 0 | 0 | 0 | 0 | 113.5 | A139 K140 Y141 | S137-A139 PolarHBondContact O-N 2.92Å; S137-K140 PolarHBondContact O-N 2.97Å; S137-Y141 PolarHBondContact O-N 2.96Å |
| 138 | G | 41 | Very low | 41.5 | Very low | 43 Ų | 43 | 124.9 Ų | 124.9 | 44% | 0.443 | 68% | 0.682 | S | S | . | * | H | α-helix | trans | -63.4 | -42.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113 | K140 Y141 W142 | G138-K140 PolarHBondContact O-N 2.9Å; G138-K140 VanDerWaalsContact O-N 3.14Å; G138-Y141 PolarHBondContact O-N 3.28Å; G138-W142 VanDerWaalsContact O-CD1 3.27Å; G138-W142 PolarHBondContact O-N 3.06Å |
| 139 | A | 45.4 | Very low | 41.9 | Very low | 86 Ų | 86 | 121.8 Ų | 121.8 | 71% | 0.711 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -62 | -27.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | S137 S143 | S137-A139 PolarHBondContact O-N 2.92Å; A139-S143 PolarHBondContact O-N 2.81Å |
| 140 | K | 47.6 | Very low | 42.2 | Very low | 172 Ų | 172 | 120.8 Ų | 120.8 | 75% | 0.748 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -82.9 | -26.4 | 175.5 | -71.8 | -175.4 | 178 | -178.9 | 0 | 113.4 | S137 G138 W142 S143 S144 | S137-K140 PolarHBondContact O-N 2.97Å; G138-K140 PolarHBondContact O-N 2.9Å; G138-K140 VanDerWaalsContact O-N 3.14Å; K140-W142 VanDerWaalsContact C-N 3.34Å; K140-S143 PolarHBondContact O-N 3Å; K140-S144 PolarHBondContact O-N 2.83Å |
| 141 | Y | 48.2 | Very low | 42.6 | Very low | 154 Ų | 154 | 121.9 Ų | 121.9 | 60% | 0.604 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -70.5 | -32.6 | 178.3 | -156.5 | -96.2 | 0 | 0 | 0 | 112.1 | S137 G138 | S137-Y141 PolarHBondContact O-N 2.96Å; G138-Y141 PolarHBondContact O-N 3.28Å |
| 142 | W | 41.2 | Very low | 43.3 | Very low | 190 Ų | 190 | 116.1 Ų | 116.1 | 72% | 0.72 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -73.3 | -41.4 | 172.1 | -67.6 | 73.7 | 0 | 0 | 0 | 111.3 | G138 K140 S144 F146 | G138-W142 VanDerWaalsContact O-CD1 3.27Å; G138-W142 PolarHBondContact O-N 3.06Å; K140-W142 VanDerWaalsContact C-N 3.34Å; W142-S144 PolarHBondContact O-N 3.09Å; W142-F146 WeakPolarHBondContact O-CD2 3.39Å |
| 143 | S | 48.3 | Very low | 43.8 | Very low | 82 Ų | 82 | 116.2 Ų | 116.2 | 57% | 0.573 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -64.4 | -37.7 | 176.7 | -78 | 0 | 0 | 0 | 0 | 113.5 | A139 K140 F146 A147 | A139-S143 PolarHBondContact O-N 2.81Å; K140-S143 PolarHBondContact O-N 3Å; S143-F146 PolarHBondContact O-N 3.48Å; S143-A147 WeakPolarHBondContact O-CB 3.19Å; S143-A147 PolarHBondContact O-N 2.79Å |
| 144 | S | 52.5 | Low | 44.4 | Very low | 67 Ų | 67 | 111 Ų | 111 | 47% | 0.469 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -72.5 | -31.2 | -177.1 | -145.5 | 0 | 0 | 0 | 0 | 113.1 | K140 W142 F146 A147 D148 | K140-S144 PolarHBondContact O-N 2.83Å; W142-S144 PolarHBondContact O-N 3.09Å; S144-F146 PolarHBondContact O-N 3.41Å; S144-A147 PolarHBondContact O-N 3.29Å; S144-D148 PolarHBondContact O-N 3.06Å |
| 145 | R | 49.9 | Very low | 45.5 | Very low | 165 Ų | 165 | 107.5 Ų | 107.5 | 62% | 0.623 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -69.1 | -18.6 | 174.1 | -72.7 | -127.6 | -99.5 | -155.4 | -4.2 | 113.4 | ||
| 146 | F | 48.8 | Very low | 46.1 | Very low | 147 Ų | 147 | 106.7 Ų | 106.7 | 65% | 0.645 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -99.7 | -15.6 | 171.1 | -64.4 | -68.7 | 0 | 0 | 0 | 114 | W142 S143 S144 V149 | W142-F146 WeakPolarHBondContact O-CD2 3.39Å; S143-F146 PolarHBondContact O-N 3.48Å; S144-F146 PolarHBondContact O-N 3.41Å; F146-V149 HydrophobicContact CB-CG2 4.3Å; F146-V149 HydrophobicContact CD1-CG2 3.91Å; F146-V149 WeakPolarHBondContact O-CB 3.47Å; F146-V149 WeakPolarHBondContact O-CG2 3.48Å; F146-V149 PolarHBondContact O-N 3.03Å |
| 147 | A | 50.4 | Low | 47.4 | Very low | 72 Ų | 72 | 107.7 Ų | 107.7 | 60% | 0.595 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -70.8 | -36.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | S143 S144 V149 | S143-A147 WeakPolarHBondContact O-CB 3.19Å; S143-A147 PolarHBondContact O-N 2.79Å; S144-A147 PolarHBondContact O-N 3.29Å; A147-V149 VanDerWaalsContact C-N 3.3Å |
| 148 | D | 42.5 | Very low | 48.4 | Very low | 132 Ų | 132 | 109.8 Ų | 109.8 | 71% | 0.706 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97 | 26.6 | 172.9 | -57.6 | -42.1 | 0 | 0 | 0 | 111.7 | S144 P150 | S144-D148 PolarHBondContact O-N 3.06Å; D148-P150 WeakPolarHBondContact O-CD 3.42Å |
| 149 | V | 39.6 | Very low | 49.6 | Very low | 60 Ų | 60 | 108.8 Ų | 108.8 | 36% | 0.364 | 59% | 0.594 | S | S | . | * | trans | -58.7 | 111.1 | 157.2 | 164.2 | 0 | 0 | 0 | 0 | 104.1 | F146 A147 S151 | F146-V149 HydrophobicContact CB-CG2 4.3Å; F146-V149 HydrophobicContact CD1-CG2 3.91Å; F146-V149 WeakPolarHBondContact O-CB 3.47Å; F146-V149 WeakPolarHBondContact O-CG2 3.48Å; F146-V149 PolarHBondContact O-N 3.03Å; A147-V149 VanDerWaalsContact C-N 3.3Å; V149-S151 PolarHBondContact O-N 3.45Å | ||
| 150 | P | 41.6 | Very low | 51.2 | Low | 86 Ų | 86 | 110.5 Ų | 110.5 | 56% | 0.558 | 60% | 0.601 | S | S | * | * | trans | -53.1 | 124.2 | 164.3 | -9.7 | 24.9 | 0 | 0 | 0 | 102.5 | D148 T152 | D148-P150 WeakPolarHBondContact O-CD 3.42Å; P150-T152 HydrophobicContact CB-CG2 4.16Å; P150-T152 PolarHBondContact O-N 3.36Å | ||
| 151 | S | 42.1 | Very low | 53 | Low | 112 Ų | 112 | 104.6 Ų | 104.6 | 78% | 0.783 | 58% | 0.581 | S | S | * | * | trans | -60.4 | 77.4 | 163.9 | -65.6 | 0 | 0 | 0 | 0 | 105.2 | V149 S153 | V149-S151 PolarHBondContact O-N 3.45Å; S151-S153 PolarHBondContact O-N 3.39Å | ||
| 152 | T | 43.3 | Very low | 55 | Low | 101 Ų | 101 | 104 Ų | 104 | 62% | 0.62 | 59% | 0.588 | S | S | * | * | trans | -62.1 | 99 | 165.6 | 49.8 | 0 | 0 | 0 | 0 | 100.6 | P150 T154 | P150-T152 HydrophobicContact CB-CG2 4.16Å; P150-T152 PolarHBondContact O-N 3.36Å; T152-T154 PolarHBondContact O-N 2.85Å | ||
| 153 | S | 43.7 | Very low | 57.4 | Low | 114 Ų | 114 | 99.6 Ų | 99.6 | 80% | 0.797 | 58% | 0.581 | S | S | * | * | trans | -71.6 | 34.9 | -168.7 | 58.5 | 0 | 0 | 0 | 0 | 110.9 | S151 D155 | S151-S153 PolarHBondContact O-N 3.39Å; S153-D155 PolarHBondContact O-N 3.35Å | ||
| 154 | T | 50.2 | Low | 59.2 | Low | 91 Ų | 91 | 98.9 Ų | 98.9 | 56% | 0.558 | 57% | 0.571 | S | S | * | * | trans | -83 | 51.8 | 165.1 | 26.4 | 0 | 0 | 0 | 0 | 109.5 | T152 L156 R168 | T152-T154 PolarHBondContact O-N 2.85Å; T154-L156 PolarHBondContact O-N 2.87Å; T154-R168 PolarHBondContact O-NH1 3.23Å | ||
| 155 | D | 53.2 | Low | 61 | Low | 58 Ų | 58 | 98.8 Ų | 98.8 | 31% | 0.31 | 57% | 0.565 | S | S | . | * | trans | 28.6 | 73.1 | 145.7 | -147 | -0.4 | 0 | 0 | 0 | 113.7 | S153 T157 K158 R168 | S153-D155 PolarHBondContact O-N 3.35Å; D155-T157 PolarHBondContact O-N 3.45Å; D155-T157 WeakPolarHBondContact OD1-CB 3.35Å; D155-T157 PolarHBondContact OD1-OG1 3.26Å; D155-K158 HydrophobicContact CB-CD 4.1Å; D155-K158 HydrophobicContact CB-CG 4.09Å; D155-K158 WeakPolarHBondContact O-CB 3.39Å; D155-K158 PolarHBondContact O-N 3.38Å; D155-K158 VanDerWaalsContact OD2-CE 3.25Å; D155-K158 WeakPolarHBondContact OD2-CE 3.32Å; D155-K158 IonicContact OD2-NZ 3.26Å; D155-K158 PolarHBondContact OD2-NZ 3.36Å; D155-R168 PolarHBondContact O-NH1 3.12Å; D155-R168 VanDerWaalsContact O-NH1 3.14Å | ||
| 156 | L | 56.5 | Low | 62.8 | Low | 109 Ų | 109 | 93.2 Ų | 93.2 | 57% | 0.571 | 55% | 0.554 | S | S | * | * | G | 310 helix | trans | -57.1 | -18.6 | 173.4 | -69.8 | 154.1 | 0 | 0 | 0 | 110.7 | T154 K158 C159 L165 | T154-L156 PolarHBondContact O-N 2.87Å; L156-K158 PolarHBondContact O-N 2.92Å; L156-C159 PolarHBondContact O-N 3.12Å; L156-L165 HydrophobicContact CB-CD1 4.11Å; L156-L165 HydrophobicContact CD2-CD1 3.36Å; L156-L165 HydrophobicContact CG-CD1 4.31Å |
| 157 | T | 62.7 | Low | 64.6 | Low | 122 Ų | 122 | 89.2 Ų | 89.2 | 75% | 0.748 | 54% | 0.542 | S | S | * | . | G | 310 helix | trans | -67.9 | -14.1 | 173.8 | 82.2 | 0 | 0 | 0 | 0 | 113.7 | D155 | D155-T157 PolarHBondContact O-N 3.45Å; D155-T157 WeakPolarHBondContact OD1-CB 3.35Å; D155-T157 PolarHBondContact OD1-OG1 3.26Å |
| 158 | K | 67.1 | Low | 66.2 | Low | 143 Ų | 143 | 89.7 Ų | 89.7 | 62% | 0.622 | 53% | 0.528 | S | S | * | . | G | 310 helix | trans | -89.3 | -1.8 | 176.1 | -71.1 | -175.6 | 172.2 | 114.2 | 0 | 114.5 | D155 L156 S160 | D155-K158 HydrophobicContact CB-CD 4.1Å; D155-K158 HydrophobicContact CB-CG 4.09Å; D155-K158 WeakPolarHBondContact O-CB 3.39Å; D155-K158 PolarHBondContact O-N 3.38Å; D155-K158 VanDerWaalsContact OD2-CE 3.25Å; D155-K158 WeakPolarHBondContact OD2-CE 3.32Å; D155-K158 IonicContact OD2-NZ 3.26Å; D155-K158 PolarHBondContact OD2-NZ 3.36Å; L156-K158 PolarHBondContact O-N 2.92Å; K158-S160 PolarHBondContact O-N 2.83Å; K158-S160 VanDerWaalsContact O-N 3.14Å |
| 159 | C | 67.1 | Low | 68.1 | Low | 22 Ų | 22 | 85.8 Ų | 85.8 | 15% | 0.149 | 52% | 0.515 | C | S | . | . | trans | -76.7 | 100.8 | 173.7 | -63.7 | 0 | 0 | 0 | 0 | 108.6 | L156 S161 D164 L165 | L156-C159 PolarHBondContact O-N 3.12Å; C159-S161 PolarHBondContact O-N 3.46Å; C159-D164 HydrophobicContact CB-CB 4.07Å; C159-L165 HydrophobicContact CB-CB 3.89Å; C159-L165 HydrophobicContact CB-CD1 4.39Å | ||
| 160 | S | 79.3 | Confident | 70.2 | Confident | 122 Ų | 122 | 88.2 Ų | 88.2 | 85% | 0.853 | 52% | 0.524 | S | S | * | . | S | Bend | trans | -72.7 | -10.7 | 175.6 | 52 | 0 | 0 | 0 | 0 | 112.7 | K158 | K158-S160 PolarHBondContact O-N 2.83Å; K158-S160 VanDerWaalsContact O-N 3.14Å |
| 161 | S | 85.3 | Confident | 72 | Confident | 48 Ų | 48 | 88.8 Ų | 88.8 | 34% | 0.336 | 52% | 0.519 | S | S | . | . | S | Bend | trans | -129.7 | 143.5 | 177.6 | 176.8 | 0 | 0 | 0 | 0 | 111.7 | C159 V163 D164 L165 | C159-S161 PolarHBondContact O-N 3.46Å; S161-V163 PolarHBondContact O-N 2.82Å; S161-V163 PolarHBondContact OG-N 2.89Å; S161-D164 WeakPolarHBondContact CB-OD2 3.45Å; S161-D164 WeakPolarHBondContact O-CB 3.17Å; S161-D164 PolarHBondContact O-N 2.93Å; S161-L165 PolarHBondContact O-N 3.27Å; S161-L165 VanDerWaalsContact O-N 3.08Å |
| 162 | L | 89.5 | Confident | 73.7 | Confident | 142 Ų | 142 | 84.9 Ų | 84.9 | 74% | 0.743 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -58.3 | -32.4 | 171.7 | -175.6 | 68.2 | 0 | 0 | 0 | 111.6 | L165 A166 | L162-L165 HydrophobicContact CD1-CD2 4.47Å; L162-L165 PolarHBondContact O-N 3.46Å; L162-A166 WeakPolarHBondContact O-CB 3.08Å; L162-A166 PolarHBondContact O-N 3.35Å |
| 163 | V | 91.1 | Very high | 74.9 | Confident | 96 Ų | 96 | 84.8 Ų | 84.8 | 58% | 0.582 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -65.2 | -41.1 | 175.7 | -179.8 | 0 | 0 | 0 | 0 | 110.5 | S161 L165 A166 T167 | S161-V163 PolarHBondContact O-N 2.82Å; S161-V163 PolarHBondContact OG-N 2.89Å; V163-L165 VanDerWaalsContact C-N 3.34Å; V163-A166 PolarHBondContact O-N 3.45Å; V163-T167 WeakPolarHBondContact O-CB 3.36Å; V163-T167 PolarHBondContact O-N 2.93Å; V163-T167 PolarHBondContact O-OG1 3.5Å |
| 164 | D | 87.2 | Confident | 76 | Confident | 68 Ų | 68 | 82.8 Ų | 82.8 | 36% | 0.364 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -68.3 | -37.5 | 178.3 | -60.7 | -22.6 | 0 | 0 | 0 | 111.2 | C159 S161 R168 | C159-D164 HydrophobicContact CB-CB 4.07Å; S161-D164 WeakPolarHBondContact CB-OD2 3.45Å; S161-D164 WeakPolarHBondContact O-CB 3.17Å; S161-D164 PolarHBondContact O-N 2.93Å; D164-R168 VanDerWaalsContact O-CB 3.23Å; D164-R168 WeakPolarHBondContact O-CB 3.3Å; D164-R168 PolarHBondContact O-N 3.04Å |
| 165 | L | 89.4 | Confident | 76.5 | Confident | 65 Ų | 65 | 84.9 Ų | 84.9 | 34% | 0.34 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63 | -47.6 | 173.8 | -176.1 | 64.6 | 0 | 0 | 0 | 111.3 | L156 C159 S161 L162 V163 R168 A169 | L156-L165 HydrophobicContact CB-CD1 4.11Å; L156-L165 HydrophobicContact CD2-CD1 3.36Å; L156-L165 HydrophobicContact CG-CD1 4.31Å; C159-L165 HydrophobicContact CB-CB 3.89Å; C159-L165 HydrophobicContact CB-CD1 4.39Å; S161-L165 PolarHBondContact O-N 3.27Å; S161-L165 VanDerWaalsContact O-N 3.08Å; L162-L165 HydrophobicContact CD1-CD2 4.47Å; L162-L165 PolarHBondContact O-N 3.46Å; V163-L165 VanDerWaalsContact C-N 3.34Å; L165-R168 PolarHBondContact O-N 3.18Å; L165-A169 VanDerWaalsContact O-CB 3.27Å; L165-A169 WeakPolarHBondContact O-CB 3.11Å; L165-A169 PolarHBondContact O-N 3.32Å |
| 166 | A | 87.7 | Confident | 76.7 | Confident | 48 Ų | 48 | 86.9 Ų | 86.9 | 40% | 0.397 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.7 | -42.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L162 V163 A169 I170 | L162-A166 WeakPolarHBondContact O-CB 3.08Å; L162-A166 PolarHBondContact O-N 3.35Å; V163-A166 PolarHBondContact O-N 3.45Å; A166-A169 PolarHBondContact O-N 3.34Å; A166-I170 WeakPolarHBondContact O-CD1 3.38Å; A166-I170 WeakPolarHBondContact O-CG1 3.39Å; A166-I170 PolarHBondContact O-N 3.43Å |
| 167 | T | 87.4 | Confident | 76.8 | Confident | 62 Ų | 62 | 84.7 Ų | 84.7 | 38% | 0.38 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.3 | -48.1 | 177.8 | -55.2 | 0 | 0 | 0 | 0 | 110.4 | V163 A169 I170 E171 | V163-T167 WeakPolarHBondContact O-CB 3.36Å; V163-T167 PolarHBondContact O-N 2.93Å; V163-T167 PolarHBondContact O-OG1 3.5Å; T167-A169 VanDerWaalsContact C-N 3.32Å; T167-A169 PolarHBondContact O-N 3.18Å; T167-I170 PolarHBondContact O-N 3.42Å; T167-E171 WeakPolarHBondContact O-CB 3.22Å; T167-E171 WeakPolarHBondContact O-CG 3.41Å; T167-E171 PolarHBondContact O-N 3.25Å |
| 168 | R | 82.8 | Confident | 76.6 | Confident | 82 Ų | 82 | 83.3 Ų | 83.3 | 31% | 0.309 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -67.5 | -32.3 | 179.3 | -156.4 | 179.9 | -67 | 171.3 | 4.7 | 112.4 | T154 D155 D164 L165 G172 | T154-R168 PolarHBondContact O-NH1 3.23Å; D155-R168 PolarHBondContact O-NH1 3.12Å; D155-R168 VanDerWaalsContact O-NH1 3.14Å; D164-R168 VanDerWaalsContact O-CB 3.23Å; D164-R168 WeakPolarHBondContact O-CB 3.3Å; D164-R168 PolarHBondContact O-N 3.04Å; L165-R168 PolarHBondContact O-N 3.18Å; R168-G172 PolarHBondContact O-N 3.39Å |
| 169 | A | 83.7 | Confident | 76 | Confident | 51 Ų | 51 | 81.7 Ų | 81.7 | 42% | 0.421 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.8 | -43.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | L165 A166 T167 G172 V173 | L165-A169 VanDerWaalsContact O-CB 3.27Å; L165-A169 WeakPolarHBondContact O-CB 3.11Å; L165-A169 PolarHBondContact O-N 3.32Å; A166-A169 PolarHBondContact O-N 3.34Å; T167-A169 VanDerWaalsContact C-N 3.32Å; T167-A169 PolarHBondContact O-N 3.18Å; A169-G172 PolarHBondContact O-N 3.33Å; A169-V173 VanDerWaalsContact O-CG2 3.32Å; A169-V173 WeakPolarHBondContact O-CG2 3.4Å; A169-V173 PolarHBondContact O-N 3.37Å |
| 170 | I | 82.7 | Confident | 75.3 | Confident | 110 Ų | 110 | 85.6 Ų | 85.6 | 56% | 0.564 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.3 | -42.3 | 175 | -66.5 | 163.2 | 0 | 0 | 0 | 110.5 | A166 T167 V173 T174 | A166-I170 WeakPolarHBondContact O-CD1 3.38Å; A166-I170 WeakPolarHBondContact O-CG1 3.39Å; A166-I170 PolarHBondContact O-N 3.43Å; T167-I170 PolarHBondContact O-N 3.42Å; I170-V173 PolarHBondContact O-N 3.38Å; I170-T174 WeakPolarHBondContact O-CB 3.43Å; I170-T174 PolarHBondContact O-N 3.38Å; I170-T174 PolarHBondContact O-OG1 2.88Å |
| 171 | E | 80.6 | Confident | 74 | Confident | 98 Ų | 98 | 87.7 Ų | 87.7 | 46% | 0.458 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.3 | -41.6 | 174.6 | -77.5 | 175.7 | 173 | 0 | 0 | 112 | T167 T174 Q175 | T167-E171 WeakPolarHBondContact O-CB 3.22Å; T167-E171 WeakPolarHBondContact O-CG 3.41Å; T167-E171 PolarHBondContact O-N 3.25Å; E171-T174 WeakPolarHBondContact CA-OG1 3.5Å; E171-T174 PolarHBondContact O-N 3.27Å; E171-T174 PolarHBondContact O-OG1 3.36Å; E171-T174 VanDerWaalsContact O-OG1 3.04Å; E171-Q175 WeakPolarHBondContact O-CB 3.49Å; E171-Q175 VanDerWaalsContact O-CG 3.3Å; E171-Q175 WeakPolarHBondContact O-CG 3.43Å; E171-Q175 PolarHBondContact O-N 3.17Å |
| 172 | G | 76.3 | Confident | 72.7 | Confident | 30 Ų | 30 | 88.2 Ų | 88.2 | 31% | 0.309 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.4 | -44.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | R168 A169 Q175 M176 | R168-G172 PolarHBondContact O-N 3.39Å; A169-G172 PolarHBondContact O-N 3.33Å; G172-Q175 PolarHBondContact O-N 2.98Å; G172-M176 WeakPolarHBondContact O-CG 3.01Å; G172-M176 PolarHBondContact O-N 3.45Å |
| 173 | V | 70.1 | Confident | 71.2 | Confident | 100 Ų | 100 | 82.7 Ų | 82.7 | 61% | 0.606 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -66.1 | -40.2 | 176.6 | 172.5 | 0 | 0 | 0 | 0 | 111.4 | A169 I170 M176 A177 | A169-V173 VanDerWaalsContact O-CG2 3.32Å; A169-V173 WeakPolarHBondContact O-CG2 3.4Å; A169-V173 PolarHBondContact O-N 3.37Å; I170-V173 PolarHBondContact O-N 3.38Å; V173-M176 PolarHBondContact O-N 3.32Å; V173-A177 WeakPolarHBondContact O-CB 3.42Å; V173-A177 PolarHBondContact O-N 3.43Å |
| 174 | T | 65.4 | Low | 70.2 | Confident | 72 Ų | 72 | 82.4 Ų | 82.4 | 44% | 0.442 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -69.6 | -37.5 | 176.7 | 41.2 | 0 | 0 | 0 | 0 | 112 | I170 E171 M176 A177 V178 | I170-T174 WeakPolarHBondContact O-CB 3.43Å; I170-T174 PolarHBondContact O-N 3.38Å; I170-T174 PolarHBondContact O-OG1 2.88Å; E171-T174 WeakPolarHBondContact CA-OG1 3.5Å; E171-T174 PolarHBondContact O-N 3.27Å; E171-T174 PolarHBondContact O-OG1 3.36Å; E171-T174 VanDerWaalsContact O-OG1 3.04Å; T174-M176 VanDerWaalsContact C-N 3.35Å; T174-A177 PolarHBondContact O-N 3.39Å; T174-V178 WeakPolarHBondContact O-CB 3.44Å; T174-V178 WeakPolarHBondContact O-CG2 3.39Å; T174-V178 PolarHBondContact O-N 3.12Å |
| 175 | Q | 61.4 | Low | 69.6 | Low | 135 Ų | 135 | 84.9 Ų | 84.9 | 63% | 0.631 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -62.7 | -41.6 | 171.4 | -77.2 | -179.3 | 23.8 | 0 | 0 | 111.6 | E171 G172 A177 V178 S179 | E171-Q175 WeakPolarHBondContact O-CB 3.49Å; E171-Q175 VanDerWaalsContact O-CG 3.3Å; E171-Q175 WeakPolarHBondContact O-CG 3.43Å; E171-Q175 PolarHBondContact O-N 3.17Å; G172-Q175 PolarHBondContact O-N 2.98Å; Q175-A177 PolarHBondContact O-N 3.38Å; Q175-V178 PolarHBondContact O-N 2.94Å; Q175-S179 WeakPolarHBondContact O-CB 3.3Å; Q175-S179 PolarHBondContact O-N 3.18Å; Q175-S179 PolarHBondContact O-OG 3.22Å |
| 176 | M | 57.6 | Low | 69.1 | Low | 99 Ų | 99 | 86.6 Ų | 86.6 | 49% | 0.488 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.6 | -39.4 | 174.1 | -72.3 | -173.7 | 70.4 | 0 | 0 | 112.2 | G172 V173 T174 Q180 | G172-M176 WeakPolarHBondContact O-CG 3.01Å; G172-M176 PolarHBondContact O-N 3.45Å; V173-M176 PolarHBondContact O-N 3.32Å; T174-M176 VanDerWaalsContact C-N 3.35Å; M176-Q180 WeakPolarHBondContact O-CB 3.28Å; M176-Q180 WeakPolarHBondContact O-CG 3.49Å; M176-Q180 PolarHBondContact O-N 2.97Å |
| 177 | A | 58.5 | Low | 68.9 | Low | 64 Ų | 64 | 88.7 Ų | 88.7 | 53% | 0.529 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67 | -37.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | V173 T174 Q175 Q180 Q181 | V173-A177 WeakPolarHBondContact O-CB 3.42Å; V173-A177 PolarHBondContact O-N 3.43Å; T174-A177 PolarHBondContact O-N 3.39Å; Q175-A177 PolarHBondContact O-N 3.38Å; A177-Q180 PolarHBondContact O-N 2.92Å; A177-Q181 PolarHBondContact O-N 2.88Å |
| 178 | V | 58 | Low | 68.7 | Low | 93 Ų | 93 | 88.9 Ų | 88.9 | 56% | 0.564 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -74.4 | -36.6 | 176.9 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | T174 Q175 Q180 Q181 | T174-V178 WeakPolarHBondContact O-CB 3.44Å; T174-V178 WeakPolarHBondContact O-CG2 3.39Å; T174-V178 PolarHBondContact O-N 3.12Å; Q175-V178 PolarHBondContact O-N 2.94Å; V178-Q180 VanDerWaalsContact C-N 3.29Å; V178-Q180 PolarHBondContact O-N 2.86Å; V178-Q181 WeakPolarHBondContact O-CB 3.34Å; V178-Q181 PolarHBondContact O-N 3.5Å; V178-Q181 VanDerWaalsContact O-N 3.09Å |
| 179 | S | 54.6 | Low | 69 | Low | 108 Ų | 108 | 92.1 Ų | 92.1 | 76% | 0.755 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -70.4 | -25.3 | 172.9 | -71.3 | 0 | 0 | 0 | 0 | 112.9 | Q175 Q181 | Q175-S179 WeakPolarHBondContact O-CB 3.3Å; Q175-S179 PolarHBondContact O-N 3.18Å; Q175-S179 PolarHBondContact O-OG 3.22Å; S179-Q181 PolarHBondContact O-N 3.04Å |
| 180 | Q | 53.2 | Low | 69.4 | Low | 105 Ų | 105 | 94.3 Ų | 94.3 | 49% | 0.491 | 53% | 0.533 | S | S | . | . | G | 310 helix | trans | -82 | 4.9 | 169.4 | -71.8 | -165 | 22.9 | 0 | 0 | 114.1 | M176 A177 V178 G182 S183 | M176-Q180 WeakPolarHBondContact O-CB 3.28Å; M176-Q180 WeakPolarHBondContact O-CG 3.49Å; M176-Q180 PolarHBondContact O-N 2.97Å; A177-Q180 PolarHBondContact O-N 2.92Å; V178-Q180 VanDerWaalsContact C-N 3.29Å; V178-Q180 PolarHBondContact O-N 2.86Å; Q180-G182 PolarHBondContact O-N 2.97Å; Q180-S183 PolarHBondContact O-N 3.13Å |
| 181 | Q | 52.4 | Low | 69.9 | Low | 166 Ų | 166 | 94.2 Ų | 94.2 | 78% | 0.776 | 53% | 0.534 | S | S | * | . | G | 310 helix | trans | -61 | -5.6 | 177 | -159.5 | -172.5 | -0.1 | 0 | 0 | 113.4 | A177 V178 S179 | A177-Q181 PolarHBondContact O-N 2.88Å; V178-Q181 WeakPolarHBondContact O-CB 3.34Å; V178-Q181 PolarHBondContact O-N 3.5Å; V178-Q181 VanDerWaalsContact O-N 3.09Å; S179-Q181 PolarHBondContact O-N 3.04Å |
| 182 | G | 56.2 | Low | 70.5 | Confident | 58 Ų | 58 | 94.3 Ų | 94.3 | 60% | 0.598 | 54% | 0.541 | S | S | * | . | G | 310 helix | trans | -120.7 | 27.2 | 170.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | Q180 P184 | Q180-G182 PolarHBondContact O-N 2.97Å; G182-P184 WeakPolarHBondContact O-CD 3.49Å; G182-P184 VanDerWaalsContact O-N 3.08Å |
| 183 | S | 58.1 | Low | 71.4 | Confident | 26 Ų | 26 | 95.1 Ų | 95.1 | 18% | 0.182 | 54% | 0.538 | C | S | . | . | trans | -52.9 | 119.1 | -179.6 | -153.2 | 0 | 0 | 0 | 0 | 109.9 | Q180 E185 L186 T187 | Q180-S183 PolarHBondContact O-N 3.13Å; S183-E185 PolarHBondContact O-N 3.28Å; S183-E185 PolarHBondContact OG-OE2 3.2Å; S183-L186 WeakPolarHBondContact O-CB 3.34Å; S183-L186 PolarHBondContact O-N 3.44Å; S183-T187 PolarHBondContact O-N 3.48Å | ||
| 184 | P | 70.1 | Confident | 72.6 | Confident | 91 Ų | 91 | 94.8 Ų | 94.8 | 59% | 0.591 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -57.2 | -26.5 | -178.8 | 20.7 | -30.8 | 0 | 0 | 0 | 112.2 | G182 T187 S188 | G182-P184 WeakPolarHBondContact O-CD 3.49Å; G182-P184 VanDerWaalsContact O-N 3.08Å; P184-T187 PolarHBondContact O-N 3.42Å; P184-S188 PolarHBondContact O-N 3.42Å |
| 185 | E | 75.7 | Confident | 74 | Confident | 119 Ų | 119 | 93.1 Ų | 93.1 | 56% | 0.556 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -62.7 | -44.4 | 173.1 | -64.3 | 75 | -165 | 0 | 0 | 112.2 | S183 T187 S188 Y189 | S183-E185 PolarHBondContact O-N 3.28Å; S183-E185 PolarHBondContact OG-OE2 3.2Å; E185-T187 VanDerWaalsContact C-N 3.32Å; E185-T187 PolarHBondContact O-N 2.85Å; E185-S188 PolarHBondContact O-N 3.36Å; E185-S188 PolarHBondContact O-OG 3.47Å; E185-Y189 PolarHBondContact O-N 3.41Å |
| 186 | L | 77.8 | Confident | 75.7 | Confident | 101 Ų | 101 | 89.5 Ų | 89.5 | 53% | 0.529 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.1 | -39.5 | 176 | -86.9 | 154.5 | 0 | 0 | 0 | 110.9 | S183 Y189 N190 | S183-L186 WeakPolarHBondContact O-CB 3.34Å; S183-L186 PolarHBondContact O-N 3.44Å; L186-Y189 PolarHBondContact O-N 3.31Å; L186-N190 WeakPolarHBondContact O-CB 3.4Å; L186-N190 PolarHBondContact O-N 3.14Å; L186-N190 PolarHBondContact O-ND2 3.38Å |
| 187 | T | 83.8 | Confident | 77.6 | Confident | 92 Ų | 92 | 93 Ų | 93 | 56% | 0.564 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63 | -44.2 | 175.2 | -54.4 | 0 | 0 | 0 | 0 | 111.2 | S183 P184 E185 Y189 N190 L191 | S183-T187 PolarHBondContact O-N 3.48Å; P184-T187 PolarHBondContact O-N 3.42Å; E185-T187 VanDerWaalsContact C-N 3.32Å; E185-T187 PolarHBondContact O-N 2.85Å; T187-Y189 PolarHBondContact O-N 2.96Å; T187-N190 PolarHBondContact O-N 2.89Å; T187-L191 PolarHBondContact O-N 3.34Å |
| 188 | S | 83.8 | Confident | 79.4 | Confident | 67 Ų | 67 | 96 Ų | 96 | 47% | 0.469 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.4 | -42.5 | 177.3 | 77.6 | 0 | 0 | 0 | 0 | 112.2 | P184 E185 L191 V192 | P184-S188 PolarHBondContact O-N 3.42Å; E185-S188 PolarHBondContact O-N 3.36Å; E185-S188 PolarHBondContact O-OG 3.47Å; S188-L191 PolarHBondContact O-N 3.29Å; S188-V192 WeakPolarHBondContact O-CG2 3.48Å; S188-V192 PolarHBondContact O-N 2.93Å |
| 189 | Y | 89.6 | Confident | 81.3 | Confident | 149 Ų | 149 | 96.6 Ų | 96.6 | 58% | 0.584 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -64 | -44.9 | 177.4 | -178.9 | -103.9 | 0 | 0 | 0 | 111.4 | E185 L186 T187 L191 V192 L193 | E185-Y189 PolarHBondContact O-N 3.41Å; L186-Y189 PolarHBondContact O-N 3.31Å; T187-Y189 PolarHBondContact O-N 2.96Å; Y189-L191 VanDerWaalsContact C-N 3.3Å; Y189-L191 PolarHBondContact O-N 3.26Å; Y189-V192 PolarHBondContact O-N 2.93Å; Y189-L193 HydrophobicContact CD1-CD1 4Å; Y189-L193 HydrophobicContact CE1-CD1 3.22Å; Y189-L193 HydrophobicContact CE2-CD1 4.27Å; Y189-L193 WeakPolarHBondContact O-CB 3.45Å; Y189-L193 PolarHBondContact O-N 2.95Å; Y189-L193 WeakPolarHBondContact OH-CD1 3.49Å |
| 190 | N | 91 | Very high | 83.4 | Confident | 97 Ų | 97 | 95.4 Ų | 95.4 | 52% | 0.519 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.8 | -38.5 | 176.4 | -81.8 | -67.8 | 0 | 0 | 0 | 112.3 | L186 T187 L193 Q194 | L186-N190 WeakPolarHBondContact O-CB 3.4Å; L186-N190 PolarHBondContact O-N 3.14Å; L186-N190 PolarHBondContact O-ND2 3.38Å; T187-N190 PolarHBondContact O-N 2.89Å; N190-L193 PolarHBondContact O-N 3.32Å; N190-Q194 VanDerWaalsContact O-CB 3.3Å; N190-Q194 WeakPolarHBondContact O-CB 3.3Å; N190-Q194 PolarHBondContact O-N 3.02Å |
| 191 | L | 93.4 | Very high | 85.6 | Confident | 109 Ų | 109 | 93.8 Ų | 93.8 | 57% | 0.571 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.6 | -46.6 | 176.1 | -174.4 | 66.4 | 0 | 0 | 0 | 111.5 | T187 S188 Y189 L193 Q194 A195 | T187-L191 PolarHBondContact O-N 3.34Å; S188-L191 PolarHBondContact O-N 3.29Å; Y189-L191 VanDerWaalsContact C-N 3.3Å; Y189-L191 PolarHBondContact O-N 3.26Å; L191-L193 VanDerWaalsContact C-N 3.31Å; L191-L193 PolarHBondContact O-N 2.9Å; L191-Q194 PolarHBondContact O-N 3.29Å; L191-A195 WeakPolarHBondContact O-CB 3.48Å; L191-A195 PolarHBondContact O-N 3.07Å |
| 192 | V | 93.4 | Very high | 87.7 | Confident | 99 Ų | 99 | 88 Ų | 88 | 60% | 0.6 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -61.4 | -41.9 | 175.8 | 173.5 | 0 | 0 | 0 | 0 | 110.9 | S188 Y189 A195 S196 | S188-V192 WeakPolarHBondContact O-CG2 3.48Å; S188-V192 PolarHBondContact O-N 2.93Å; Y189-V192 PolarHBondContact O-N 2.93Å; V192-A195 PolarHBondContact O-N 3.01Å; V192-S196 WeakPolarHBondContact O-CB 3.43Å; V192-S196 PolarHBondContact O-N 3.26Å |
| 193 | L | 95.4 | Very high | 89.8 | Confident | 48 Ų | 48 | 89.4 Ų | 89.4 | 25% | 0.251 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -67.7 | -39.6 | -179.7 | -142.4 | 145.4 | 0 | 0 | 0 | 111.4 | Y189 N190 L191 S196 R197 | Y189-L193 HydrophobicContact CD1-CD1 4Å; Y189-L193 HydrophobicContact CE1-CD1 3.22Å; Y189-L193 HydrophobicContact CE2-CD1 4.27Å; Y189-L193 WeakPolarHBondContact O-CB 3.45Å; Y189-L193 PolarHBondContact O-N 2.95Å; Y189-L193 WeakPolarHBondContact OH-CD1 3.49Å; N190-L193 PolarHBondContact O-N 3.32Å; L191-L193 VanDerWaalsContact C-N 3.31Å; L191-L193 PolarHBondContact O-N 2.9Å; L193-S196 PolarHBondContact O-N 3.43Å; L193-R197 HydrophobicContact CD2-CG 4.43Å; L193-R197 VanDerWaalsContact CD2-NE 3.29Å; L193-R197 WeakPolarHBondContact O-CB 3.32Å; L193-R197 VanDerWaalsContact O-CG 3.28Å; L193-R197 WeakPolarHBondContact O-CG 3.49Å; L193-R197 PolarHBondContact O-N 3.24Å |
| 194 | Q | 95.4 | Very high | 91.7 | Very high | 92 Ų | 92 | 93 Ų | 93 | 43% | 0.43 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.5 | -43.4 | 173.7 | -170 | -177.6 | 25.4 | 0 | 0 | 111.7 | N190 L191 R197 R198 | N190-Q194 VanDerWaalsContact O-CB 3.3Å; N190-Q194 WeakPolarHBondContact O-CB 3.3Å; N190-Q194 PolarHBondContact O-N 3.02Å; L191-Q194 PolarHBondContact O-N 3.29Å; Q194-R197 PolarHBondContact O-N 3.39Å; Q194-R198 WeakPolarHBondContact O-CG 3.34Å; Q194-R198 PolarHBondContact O-N 3.03Å |
| 195 | A | 94.4 | Very high | 93 | Very high | 37 Ų | 37 | 94 Ų | 94 | 31% | 0.306 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.1 | -44.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | L191 V192 R197 R198 K199 | L191-A195 WeakPolarHBondContact O-CB 3.48Å; L191-A195 PolarHBondContact O-N 3.07Å; V192-A195 PolarHBondContact O-N 3.01Å; A195-R197 PolarHBondContact O-N 3.49Å; A195-R198 PolarHBondContact O-N 3.48Å; A195-K199 WeakPolarHBondContact O-CB 3.48Å; A195-K199 PolarHBondContact O-N 3.36Å |
| 196 | S | 96.8 | Very high | 94.1 | Very high | 60 Ų | 60 | 93 Ų | 93 | 42% | 0.42 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -60.3 | -43.7 | 175.5 | -172.8 | 0 | 0 | 0 | 0 | 111.7 | V192 L193 R198 K199 I200 | V192-S196 WeakPolarHBondContact O-CB 3.43Å; V192-S196 PolarHBondContact O-N 3.26Å; L193-S196 PolarHBondContact O-N 3.43Å; S196-R198 PolarHBondContact O-N 3.1Å; S196-K199 PolarHBondContact O-N 3.49Å; S196-I200 VanDerWaalsContact O-CG1 3.3Å; S196-I200 WeakPolarHBondContact O-CG1 3.25Å; S196-I200 PolarHBondContact O-N 3.03Å |
| 197 | R | 97.8 | Very high | 95.1 | Very high | 172 Ų | 172 | 92.1 Ų | 92.1 | 65% | 0.649 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -60 | -46 | 175.9 | -76.1 | 174.3 | -177.5 | -174.2 | 4.2 | 111.8 | L193 Q194 A195 K199 I200 V201 | L193-R197 HydrophobicContact CD2-CG 4.43Å; L193-R197 VanDerWaalsContact CD2-NE 3.29Å; L193-R197 WeakPolarHBondContact O-CB 3.32Å; L193-R197 VanDerWaalsContact O-CG 3.28Å; L193-R197 WeakPolarHBondContact O-CG 3.49Å; L193-R197 PolarHBondContact O-N 3.24Å; Q194-R197 PolarHBondContact O-N 3.39Å; A195-R197 PolarHBondContact O-N 3.49Å; R197-K199 VanDerWaalsContact C-N 3.33Å; R197-K199 PolarHBondContact O-N 3.45Å; R197-I200 PolarHBondContact O-N 3.14Å; R197-V201 WeakPolarHBondContact O-CG2 3.48Å; R197-V201 PolarHBondContact O-N 3.42Å |
| 198 | R | 97.6 | Very high | 95.8 | Very high | 126 Ų | 126 | 94.3 Ų | 94.3 | 48% | 0.475 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -60.6 | -42.6 | 175.7 | -70.1 | 177.3 | -178.4 | 131.9 | -2.7 | 111.8 | Q194 A195 S196 V201 L202 | Q194-R198 WeakPolarHBondContact O-CG 3.34Å; Q194-R198 PolarHBondContact O-N 3.03Å; A195-R198 PolarHBondContact O-N 3.48Å; S196-R198 PolarHBondContact O-N 3.1Å; R198-V201 PolarHBondContact O-N 2.86Å; R198-L202 WeakPolarHBondContact O-CG 3.33Å; R198-L202 PolarHBondContact O-N 3.44Å; R198-L202 VanDerWaalsContact O-N 3.12Å |
| 199 | K | 97.8 | Very high | 96.5 | Very high | 106 Ų | 106 | 95.6 Ų | 95.6 | 46% | 0.461 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.6 | -41.8 | 178.1 | -175.2 | 176.2 | -178.7 | 176.6 | 0 | 112 | A195 S196 R197 L202 L203 | A195-K199 WeakPolarHBondContact O-CB 3.48Å; A195-K199 PolarHBondContact O-N 3.36Å; S196-K199 PolarHBondContact O-N 3.49Å; R197-K199 VanDerWaalsContact C-N 3.33Å; R197-K199 PolarHBondContact O-N 3.45Å; K199-L202 PolarHBondContact O-N 3Å; K199-L203 HydrophobicContact CG-CD1 4.06Å; K199-L203 HydrophobicContact CG-CG 4.46Å; K199-L203 WeakPolarHBondContact O-CB 3.45Å; K199-L203 VanDerWaalsContact O-CG 3.32Å; K199-L203 WeakPolarHBondContact O-CG 3.45Å; K199-L203 PolarHBondContact O-N 3.14Å |
| 200 | I | 98.2 | Very high | 96.9 | Very high | 84 Ų | 84 | 92.1 Ų | 92.1 | 43% | 0.431 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -58.9 | -49.3 | 176.4 | -70.7 | 163.3 | 0 | 0 | 0 | 110.2 | S196 R197 L202 L203 E204 | S196-I200 VanDerWaalsContact O-CG1 3.3Å; S196-I200 WeakPolarHBondContact O-CG1 3.25Å; S196-I200 PolarHBondContact O-N 3.03Å; R197-I200 PolarHBondContact O-N 3.14Å; I200-L202 PolarHBondContact O-N 3.48Å; I200-L203 PolarHBondContact O-N 3.11Å; I200-E204 HydrophobicContact CG2-CG 4.33Å; I200-E204 WeakPolarHBondContact CG2-OE1 3.26Å; I200-E204 WeakPolarHBondContact O-CG 3.48Å; I200-E204 PolarHBondContact O-N 3.38Å |
| 201 | V | 98.2 | Very high | 97.3 | Very high | 70 Ų | 70 | 92.6 Ų | 92.6 | 42% | 0.424 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -58.1 | -45.4 | 178.9 | 174.9 | 0 | 0 | 0 | 0 | 111.9 | R197 R198 L203 E204 E205 | R197-V201 WeakPolarHBondContact O-CG2 3.48Å; R197-V201 PolarHBondContact O-N 3.42Å; R198-V201 PolarHBondContact O-N 2.86Å; V201-L203 VanDerWaalsContact C-N 3.35Å; V201-L203 PolarHBondContact O-N 2.94Å; V201-E204 WeakPolarHBondContact O-CB 3.31Å; V201-E204 PolarHBondContact O-N 3.34Å; V201-E205 WeakPolarHBondContact O-CG 3.34Å; V201-E205 PolarHBondContact O-N 3.44Å |
| 202 | L | 97.9 | Very high | 97.5 | Very high | 46 Ų | 46 | 91.9 Ų | 91.9 | 24% | 0.241 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -64.6 | -38.6 | 178.3 | -70.7 | 172.8 | 0 | 0 | 0 | 112.8 | Y46 L49 R198 K199 I200 E205 R206 | Y46-L202 HydrophobicContact CD1-CD1 4.22Å; Y46-L202 HydrophobicContact CE1-CD1 3.89Å; L49-L202 HydrophobicContact CD2-CB 4.37Å; L49-L202 HydrophobicContact CD2-CD1 4.26Å; R198-L202 WeakPolarHBondContact O-CG 3.33Å; R198-L202 PolarHBondContact O-N 3.44Å; R198-L202 VanDerWaalsContact O-N 3.12Å; K199-L202 PolarHBondContact O-N 3Å; I200-L202 PolarHBondContact O-N 3.48Å; L202-E205 PolarHBondContact O-N 2.9Å; L202-R206 WeakPolarHBondContact O-CB 3.13Å; L202-R206 PolarHBondContact O-N 2.67Å |
| 203 | L | 98.6 | Very high | 97.7 | Very high | 86 Ų | 86 | 89.6 Ų | 89.6 | 45% | 0.45 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -67 | -40.8 | 175.7 | -72.5 | 173.1 | 0 | 0 | 0 | 111 | K199 I200 V201 R206 V207 | K199-L203 HydrophobicContact CG-CD1 4.06Å; K199-L203 HydrophobicContact CG-CG 4.46Å; K199-L203 WeakPolarHBondContact O-CB 3.45Å; K199-L203 VanDerWaalsContact O-CG 3.32Å; K199-L203 WeakPolarHBondContact O-CG 3.45Å; K199-L203 PolarHBondContact O-N 3.14Å; I200-L203 PolarHBondContact O-N 3.11Å; V201-L203 VanDerWaalsContact C-N 3.35Å; V201-L203 PolarHBondContact O-N 2.94Å; L203-R206 PolarHBondContact O-N 3.19Å; L203-V207 WeakPolarHBondContact O-CB 3.44Å; L203-V207 VanDerWaalsContact O-CG2 3.26Å; L203-V207 WeakPolarHBondContact O-CG2 3.42Å; L203-V207 PolarHBondContact O-N 3.14Å |
| 204 | E | 98.2 | Very high | 97.8 | Very high | 103 Ų | 103 | 90.9 Ų | 90.9 | 48% | 0.481 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -61 | -43.6 | 174.5 | -72.5 | 174.6 | 172.6 | 0 | 0 | 111.8 | I200 V201 V207 K208 | I200-E204 HydrophobicContact CG2-CG 4.33Å; I200-E204 WeakPolarHBondContact CG2-OE1 3.26Å; I200-E204 WeakPolarHBondContact O-CG 3.48Å; I200-E204 PolarHBondContact O-N 3.38Å; V201-E204 WeakPolarHBondContact O-CB 3.31Å; V201-E204 PolarHBondContact O-N 3.34Å; E204-V207 PolarHBondContact O-N 3.28Å; E204-K208 WeakPolarHBondContact O-CG 3.34Å; E204-K208 PolarHBondContact O-N 3.33Å |
| 205 | E | 98.3 | Very high | 98 | Very high | 110 Ų | 110 | 89.7 Ų | 89.7 | 51% | 0.514 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -62.3 | -44.4 | 174.1 | -73.8 | 176.5 | 178.8 | 0 | 0 | 112 | V201 L202 V207 K208 H209 | V201-E205 WeakPolarHBondContact O-CG 3.34Å; V201-E205 PolarHBondContact O-N 3.44Å; L202-E205 PolarHBondContact O-N 2.9Å; E205-V207 PolarHBondContact O-N 3.47Å; E205-K208 PolarHBondContact O-N 2.57Å; E205-H209 PolarHBondContact O-N 3.2Å |
| 206 | R | 98.1 | Very high | 98.2 | Very high | 100 Ų | 100 | 90 Ų | 90 | 38% | 0.377 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 177.4 | -178 | 57.5 | 177.7 | 156.3 | 6.4 | 111.8 | L202 L203 H209 L210 E213 | L202-R206 WeakPolarHBondContact O-CB 3.13Å; L202-R206 PolarHBondContact O-N 2.67Å; L203-R206 PolarHBondContact O-N 3.19Å; R206-H209 PolarHBondContact NH1-CD2 3.47Å; R206-H209 PolarHBondContact O-N 3.02Å; R206-L210 HydrophobicContact CG-CD1 4.13Å; R206-L210 HydrophobicContact CG-CG 4.46Å; R206-L210 WeakPolarHBondContact O-CB 3.47Å; R206-L210 WeakPolarHBondContact O-CG 3.33Å; R206-L210 PolarHBondContact O-N 3.47Å; R206-E213 IonicContact NH1-OE2 2.7Å |
| 207 | V | 98.7 | Very high | 98.2 | Very high | 81 Ų | 81 | 93.5 Ų | 93.5 | 49% | 0.491 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -62.4 | -46.6 | 175.4 | 168.3 | 0 | 0 | 0 | 0 | 110.4 | L203 E204 E205 H209 L210 L211 | L203-V207 WeakPolarHBondContact O-CB 3.44Å; L203-V207 VanDerWaalsContact O-CG2 3.26Å; L203-V207 WeakPolarHBondContact O-CG2 3.42Å; L203-V207 PolarHBondContact O-N 3.14Å; E204-V207 PolarHBondContact O-N 3.28Å; E205-V207 PolarHBondContact O-N 3.47Å; V207-H209 VanDerWaalsContact C-N 3.31Å; V207-H209 PolarHBondContact O-N 3.37Å; V207-L210 PolarHBondContact O-N 3.48Å; V207-L211 HydrophobicContact CG1-CD1 4.05Å; V207-L211 HydrophobicContact CG1-CG 4.44Å; V207-L211 VanDerWaalsContact O-CG 3.31Å; V207-L211 WeakPolarHBondContact O-CG 3.23Å; V207-L211 PolarHBondContact O-N 2.89Å |
| 208 | K | 98.6 | Very high | 98.3 | Very high | 139 Ų | 139 | 92.8 Ų | 92.8 | 60% | 0.604 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -56.5 | -45.9 | 175 | -74.1 | 171.3 | -176.6 | 171.9 | 0 | 111.6 | E204 E205 L211 T212 | E204-K208 WeakPolarHBondContact O-CG 3.34Å; E204-K208 PolarHBondContact O-N 3.33Å; E205-K208 PolarHBondContact O-N 2.57Å; K208-L211 PolarHBondContact O-N 3.37Å; K208-T212 PolarHBondContact O-N 2.89Å; K208-T212 VanDerWaalsContact O-N 3.11Å; K208-T212 PolarHBondContact O-OG1 3.39Å |
| 209 | H | 98.5 | Very high | 98.3 | Very high | 93 Ų | 93 | 91.4 Ų | 91.4 | 43% | 0.431 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -62.7 | -46.2 | 177.9 | -178 | 87.2 | 0 | 0 | 0 | 112.6 | E205 R206 V207 L211 T212 E213 | E205-H209 PolarHBondContact O-N 3.2Å; R206-H209 PolarHBondContact NH1-CD2 3.47Å; R206-H209 PolarHBondContact O-N 3.02Å; V207-H209 VanDerWaalsContact C-N 3.31Å; V207-H209 PolarHBondContact O-N 3.37Å; H209-L211 VanDerWaalsContact C-N 3.28Å; H209-L211 PolarHBondContact O-N 3.48Å; H209-T212 WeakPolarHBondContact O-CB 3.25Å; H209-T212 PolarHBondContact O-N 3.18Å; H209-T212 VanDerWaalsContact O-N 3.14Å; H209-E213 IonicContact CD2-OE2 3.43Å; H209-E213 PolarHBondContact CD2-OE2 3.02Å; H209-E213 IonicContact NE2-OE1 3.89Å; H209-E213 PolarHBondContact NE2-OE1 2.94Å; H209-E213 IonicContact NE2-OE2 2.59Å; H209-E213 PolarHBondContact NE2-OE2 2.59Å; H209-E213 PolarHBondContact O-N 3.36Å |
| 210 | L | 98.7 | Very high | 98.3 | Very high | 77 Ų | 77 | 89 Ų | 89 | 40% | 0.403 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -61.6 | -36 | 177.4 | -76.5 | 171.9 | 0 | 0 | 0 | 112.3 | R206 V207 E213 L214 | R206-L210 HydrophobicContact CG-CD1 4.13Å; R206-L210 HydrophobicContact CG-CG 4.46Å; R206-L210 WeakPolarHBondContact O-CB 3.47Å; R206-L210 WeakPolarHBondContact O-CG 3.33Å; R206-L210 PolarHBondContact O-N 3.47Å; V207-L210 PolarHBondContact O-N 3.48Å; L210-E213 PolarHBondContact O-N 3.06Å; L210-L214 VanDerWaalsContact O-CB 3.23Å; L210-L214 WeakPolarHBondContact O-CB 3.45Å; L210-L214 PolarHBondContact O-N 3.43Å |
| 211 | L | 98.6 | Very high | 98.4 | Very high | 106 Ų | 106 | 90.5 Ų | 90.5 | 56% | 0.555 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -65 | -40.8 | 174.4 | -71.8 | 171.4 | 0 | 0 | 0 | 111.6 | V207 K208 H209 L214 S215 | V207-L211 HydrophobicContact CG1-CD1 4.05Å; V207-L211 HydrophobicContact CG1-CG 4.44Å; V207-L211 VanDerWaalsContact O-CG 3.31Å; V207-L211 WeakPolarHBondContact O-CG 3.23Å; V207-L211 PolarHBondContact O-N 2.89Å; K208-L211 PolarHBondContact O-N 3.37Å; H209-L211 VanDerWaalsContact C-N 3.28Å; H209-L211 PolarHBondContact O-N 3.48Å; L211-L214 PolarHBondContact O-N 3.09Å; L211-S215 WeakPolarHBondContact O-CB 3.44Å; L211-S215 PolarHBondContact O-N 2.87Å |
| 212 | T | 98.2 | Very high | 98.4 | Very high | 94 Ų | 94 | 94.7 Ų | 94.7 | 58% | 0.577 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -63 | -48.4 | 173.2 | -56.3 | 0 | 0 | 0 | 0 | 111.3 | K208 H209 L214 S215 G216 | K208-T212 PolarHBondContact O-N 2.89Å; K208-T212 VanDerWaalsContact O-N 3.11Å; K208-T212 PolarHBondContact O-OG1 3.39Å; H209-T212 WeakPolarHBondContact O-CB 3.25Å; H209-T212 PolarHBondContact O-N 3.18Å; H209-T212 VanDerWaalsContact O-N 3.14Å; T212-L214 VanDerWaalsContact C-N 3.35Å; T212-L214 PolarHBondContact O-N 3.3Å; T212-S215 PolarHBondContact O-N 3.25Å; T212-S215 PolarHBondContact O-OG 3.33Å; T212-G216 PolarHBondContact O-N 3.2Å |
| 213 | E | 97.8 | Very high | 98.4 | Very high | 52 Ų | 52 | 98.4 Ų | 98.4 | 24% | 0.243 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -58 | -46.7 | 176.3 | -71.9 | -172.3 | 122 | 0 | 0 | 111.2 | R56 R206 H209 L210 S215 G216 E217 | R56-E213 IonicContact NE-OE1 2.89Å; R206-E213 IonicContact NH1-OE2 2.7Å; H209-E213 IonicContact CD2-OE2 3.43Å; H209-E213 PolarHBondContact CD2-OE2 3.02Å; H209-E213 IonicContact NE2-OE1 3.89Å; H209-E213 PolarHBondContact NE2-OE1 2.94Å; H209-E213 IonicContact NE2-OE2 2.59Å; H209-E213 PolarHBondContact NE2-OE2 2.59Å; H209-E213 PolarHBondContact O-N 3.36Å; L210-E213 PolarHBondContact O-N 3.06Å; E213-S215 VanDerWaalsContact C-N 3.29Å; E213-S215 PolarHBondContact O-N 3.27Å; E213-G216 PolarHBondContact O-N 3.05Å; E213-E217 PolarHBondContact O-N 3.34Å |
| 214 | L | 98.2 | Very high | 98.4 | Very high | 75 Ų | 75 | 98.5 Ų | 98.5 | 39% | 0.393 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.2 | -37.9 | 177.8 | -179.2 | 64 | 0 | 0 | 0 | 112.2 | L210 L211 T212 R218 | L210-L214 VanDerWaalsContact O-CB 3.23Å; L210-L214 WeakPolarHBondContact O-CB 3.45Å; L210-L214 PolarHBondContact O-N 3.43Å; L211-L214 PolarHBondContact O-N 3.09Å; T212-L214 VanDerWaalsContact C-N 3.35Å; T212-L214 PolarHBondContact O-N 3.3Å; L214-R218 WeakPolarHBondContact O-CB 3.42Å; L214-R218 VanDerWaalsContact O-CG 3.25Å; L214-R218 WeakPolarHBondContact O-CG 3.43Å; L214-R218 PolarHBondContact O-N 3.13Å |
| 215 | S | 98.3 | Very high | 98.4 | Very high | 67 Ų | 67 | 98.4 Ų | 98.4 | 47% | 0.469 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.9 | -41.9 | 175.9 | 74.6 | 0 | 0 | 0 | 0 | 112 | L211 T212 E213 R218 E219 | L211-S215 WeakPolarHBondContact O-CB 3.44Å; L211-S215 PolarHBondContact O-N 2.87Å; T212-S215 PolarHBondContact O-N 3.25Å; T212-S215 PolarHBondContact O-OG 3.33Å; E213-S215 VanDerWaalsContact C-N 3.29Å; E213-S215 PolarHBondContact O-N 3.27Å; S215-R218 PolarHBondContact O-N 3.2Å; S215-E219 PolarHBondContact O-N 2.97Å |
| 216 | G | 98.4 | Very high | 98.4 | Very high | 42 Ų | 42 | 96 Ų | 96 | 43% | 0.433 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.8 | -40.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | T212 E213 E219 S220 | T212-G216 PolarHBondContact O-N 3.2Å; E213-G216 PolarHBondContact O-N 3.05Å; G216-E219 WeakPolarHBondContact O-CB 3.46Å; G216-E219 PolarHBondContact O-N 3.42Å; G216-S220 PolarHBondContact O-N 3.46Å |
| 217 | E | 98.1 | Very high | 98.5 | Very high | 134 Ų | 134 | 95.7 Ų | 95.7 | 63% | 0.626 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -65.4 | -39.8 | 176.5 | -164.8 | 66.7 | -150.2 | 0 | 0 | 111.6 | E213 E219 S220 K221 | E213-E217 PolarHBondContact O-N 3.34Å; E217-E219 VanDerWaalsContact C-N 3.33Å; E217-E219 PolarHBondContact O-N 3.49Å; E217-S220 PolarHBondContact O-N 3.41Å; E217-K221 WeakPolarHBondContact O-CB 3.4Å; E217-K221 PolarHBondContact O-N 3.01Å |
| 218 | R | 98.5 | Very high | 98.4 | Very high | 157 Ų | 157 | 96.5 Ų | 96.5 | 59% | 0.592 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.3 | -38.9 | 174.2 | -76.8 | 171.8 | 176.6 | 164.6 | -1.3 | 112.2 | L214 S215 K221 R222 | L214-R218 WeakPolarHBondContact O-CB 3.42Å; L214-R218 VanDerWaalsContact O-CG 3.25Å; L214-R218 WeakPolarHBondContact O-CG 3.43Å; L214-R218 PolarHBondContact O-N 3.13Å; S215-R218 PolarHBondContact O-N 3.2Å; R218-K221 PolarHBondContact O-N 3.45Å; R218-R222 WeakPolarHBondContact O-CG 3.43Å; R218-R222 PolarHBondContact O-N 3.49Å |
| 219 | E | 98.5 | Very high | 98.4 | Very high | 98 Ų | 98 | 93 Ų | 93 | 46% | 0.458 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.7 | -49.1 | 174.5 | -173.6 | 58.1 | -151.8 | 0 | 0 | 111.4 | S215 G216 E217 K221 R222 H223 | S215-E219 PolarHBondContact O-N 2.97Å; G216-E219 WeakPolarHBondContact O-CB 3.46Å; G216-E219 PolarHBondContact O-N 3.42Å; E217-E219 VanDerWaalsContact C-N 3.33Å; E217-E219 PolarHBondContact O-N 3.49Å; E219-K221 VanDerWaalsContact C-N 3.28Å; E219-K221 PolarHBondContact O-N 2.88Å; E219-R222 PolarHBondContact O-N 3.32Å; E219-R222 VanDerWaalsContact O-N 3.11Å; E219-R222 IonicContact OE2-CZ 3.47Å; E219-R222 VanDerWaalsContact OE2-CZ 3.26Å; E219-R222 IonicContact OE2-NE 3.52Å; E219-R222 PolarHBondContact OE2-NE 2.94Å; E219-R222 IonicContact OE2-NH2 3.37Å; E219-R222 PolarHBondContact OE2-NH2 3.44Å; E219-H223 PolarHBondContact O-N 3.32Å |
| 220 | S | 98.4 | Very high | 98.4 | Very high | 55 Ų | 55 | 94.3 Ų | 94.3 | 39% | 0.385 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -58.9 | -40.9 | 177.1 | -177.1 | 0 | 0 | 0 | 0 | 111.9 | G216 E217 H223 L224 | G216-S220 PolarHBondContact O-N 3.46Å; E217-S220 PolarHBondContact O-N 3.41Å; S220-H223 PolarHBondContact O-N 2.97Å; S220-L224 WeakPolarHBondContact O-CG 3.28Å; S220-L224 PolarHBondContact O-N 3.1Å |
| 221 | K | 98.6 | Very high | 98.4 | Very high | 116 Ų | 116 | 94.1 Ų | 94.1 | 50% | 0.504 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -58.6 | -48.1 | 174 | -173 | 179.6 | -178 | -81.7 | 0 | 111.6 | E217 R218 E219 H223 L224 E225 | E217-K221 WeakPolarHBondContact O-CB 3.4Å; E217-K221 PolarHBondContact O-N 3.01Å; R218-K221 PolarHBondContact O-N 3.45Å; E219-K221 VanDerWaalsContact C-N 3.28Å; E219-K221 PolarHBondContact O-N 2.88Å; K221-H223 VanDerWaalsContact C-N 3.32Å; K221-H223 PolarHBondContact O-N 3.11Å; K221-L224 PolarHBondContact O-N 3.31Å; K221-E225 WeakPolarHBondContact CE-OE1 3.44Å; K221-E225 HydrophobicContact CG-CG 4.48Å; K221-E225 IonicContact NZ-OE1 3.7Å; K221-E225 PolarHBondContact NZ-OE1 3.25Å; K221-E225 IonicContact NZ-OE2 3.77Å; K221-E225 WeakPolarHBondContact O-CB 3.43Å; K221-E225 VanDerWaalsContact O-CG 3.28Å; K221-E225 WeakPolarHBondContact O-CG 3.26Å; K221-E225 PolarHBondContact O-N 3.4Å |
| 222 | R | 98.5 | Very high | 98.4 | Very high | 157 Ų | 157 | 93 Ų | 93 | 59% | 0.592 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -60.8 | -41.7 | 178.1 | -73.7 | -166.6 | -67.1 | 166.3 | -9.1 | 112.1 | R218 E219 E225 A226 | R218-R222 WeakPolarHBondContact O-CG 3.43Å; R218-R222 PolarHBondContact O-N 3.49Å; E219-R222 PolarHBondContact O-N 3.32Å; E219-R222 VanDerWaalsContact O-N 3.11Å; E219-R222 IonicContact OE2-CZ 3.47Å; E219-R222 VanDerWaalsContact OE2-CZ 3.26Å; E219-R222 IonicContact OE2-NE 3.52Å; E219-R222 PolarHBondContact OE2-NE 2.94Å; E219-R222 IonicContact OE2-NH2 3.37Å; E219-R222 PolarHBondContact OE2-NH2 3.44Å; R222-E225 PolarHBondContact O-N 3.35Å; R222-A226 PolarHBondContact O-N 2.92Å |
| 223 | H | 98.5 | Very high | 98.5 | Very high | 124 Ų | 124 | 92.3 Ų | 92.3 | 57% | 0.574 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -62.8 | -47.4 | 176.8 | -178.3 | 64.8 | 0 | 0 | 0 | 112 | E219 S220 K221 E225 A226 E227 | E219-H223 PolarHBondContact O-N 3.32Å; S220-H223 PolarHBondContact O-N 2.97Å; K221-H223 VanDerWaalsContact C-N 3.32Å; K221-H223 PolarHBondContact O-N 3.11Å; H223-E225 VanDerWaalsContact C-N 3.33Å; H223-E225 PolarHBondContact O-N 3.45Å; H223-A226 WeakPolarHBondContact O-CB 3.48Å; H223-A226 PolarHBondContact O-N 3.24Å; H223-E227 PolarHBondContact O-N 3.03Å |
| 224 | L | 98.7 | Very high | 98.5 | Very high | 88 Ų | 88 | 94.2 Ų | 94.2 | 46% | 0.461 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64 | -37.9 | 177.3 | -71.6 | 172.3 | 0 | 0 | 0 | 112.2 | S220 K221 A226 E227 V228 | S220-L224 WeakPolarHBondContact O-CG 3.28Å; S220-L224 PolarHBondContact O-N 3.1Å; K221-L224 PolarHBondContact O-N 3.31Å; L224-A226 VanDerWaalsContact C-N 3.33Å; L224-E227 PolarHBondContact O-N 3.42Å; L224-V228 WeakPolarHBondContact O-CB 3.24Å; L224-V228 VanDerWaalsContact O-CG2 3.26Å; L224-V228 WeakPolarHBondContact O-CG2 3.35Å; L224-V228 PolarHBondContact O-N 2.95Å |
| 225 | E | 98.7 | Very high | 98.5 | Very high | 101 Ų | 101 | 95.5 Ų | 95.5 | 47% | 0.472 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.3 | -41 | 174.3 | -76 | 173.3 | 157.9 | 0 | 0 | 111.6 | K221 R222 H223 V228 S229 | K221-E225 WeakPolarHBondContact CE-OE1 3.44Å; K221-E225 HydrophobicContact CG-CG 4.48Å; K221-E225 IonicContact NZ-OE1 3.7Å; K221-E225 PolarHBondContact NZ-OE1 3.25Å; K221-E225 IonicContact NZ-OE2 3.77Å; K221-E225 WeakPolarHBondContact O-CB 3.43Å; K221-E225 VanDerWaalsContact O-CG 3.28Å; K221-E225 WeakPolarHBondContact O-CG 3.26Å; K221-E225 PolarHBondContact O-N 3.4Å; R222-E225 PolarHBondContact O-N 3.35Å; H223-E225 VanDerWaalsContact C-N 3.33Å; H223-E225 PolarHBondContact O-N 3.45Å; E225-V228 PolarHBondContact O-N 2.89Å; E225-S229 PolarHBondContact O-N 3.35Å |
| 226 | A | 98.6 | Very high | 98.5 | Very high | 60 Ų | 60 | 97.2 Ų | 97.2 | 50% | 0.496 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.8 | -42.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112 | R222 H223 L224 S229 H230 | R222-A226 PolarHBondContact O-N 2.92Å; H223-A226 WeakPolarHBondContact O-CB 3.48Å; H223-A226 PolarHBondContact O-N 3.24Å; L224-A226 VanDerWaalsContact C-N 3.33Å; A226-S229 PolarHBondContact O-N 2.88Å; A226-H230 WeakPolarHBondContact O-CB 3.37Å; A226-H230 PolarHBondContact O-N 3.28Å |
| 227 | E | 98.4 | Very high | 98.5 | Very high | 93 Ų | 93 | 97.9 Ų | 97.9 | 44% | 0.435 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.7 | -44.1 | 176.1 | -173.3 | 177.9 | -173.5 | 0 | 0 | 111.8 | H223 L224 S229 H230 L231 | H223-E227 PolarHBondContact O-N 3.03Å; L224-E227 PolarHBondContact O-N 3.42Å; E227-S229 VanDerWaalsContact C-N 3.31Å; E227-S229 PolarHBondContact O-N 3.34Å; E227-H230 PolarHBondContact O-N 3.36Å; E227-L231 HydrophobicContact CG-CD1 4.06Å; E227-L231 HydrophobicContact CG-CG 4.44Å; E227-L231 WeakPolarHBondContact O-CB 3.48Å; E227-L231 WeakPolarHBondContact O-CG 3.45Å; E227-L231 PolarHBondContact O-N 3.31Å |
| 228 | V | 98.5 | Very high | 98.6 | Very high | 99 Ų | 99 | 95.5 Ų | 95.5 | 60% | 0.6 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -60.7 | -42.1 | 175.2 | 168.6 | 0 | 0 | 0 | 0 | 111 | L224 E225 N232 | L224-V228 WeakPolarHBondContact O-CB 3.24Å; L224-V228 VanDerWaalsContact O-CG2 3.26Å; L224-V228 WeakPolarHBondContact O-CG2 3.35Å; L224-V228 PolarHBondContact O-N 2.95Å; E225-V228 PolarHBondContact O-N 2.89Å; V228-N232 VanDerWaalsContact O-CB 3.24Å; V228-N232 WeakPolarHBondContact O-CB 3.46Å; V228-N232 PolarHBondContact O-N 2.87Å |
| 229 | S | 98.4 | Very high | 98.6 | Very high | 64 Ų | 64 | 91.4 Ų | 91.4 | 45% | 0.448 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.9 | -46.3 | 175.9 | -165.5 | 0 | 0 | 0 | 0 | 111.5 | E225 A226 E227 N232 D233 | E225-S229 PolarHBondContact O-N 3.35Å; A226-S229 PolarHBondContact O-N 2.88Å; E227-S229 VanDerWaalsContact C-N 3.31Å; E227-S229 PolarHBondContact O-N 3.34Å; S229-N232 WeakPolarHBondContact O-CB 3.46Å; S229-N232 PolarHBondContact O-N 2.95Å; S229-D233 PolarHBondContact O-N 3.45Å |
| 230 | H | 98.7 | Very high | 98.6 | Very high | 121 Ų | 121 | 92 Ų | 92 | 56% | 0.56 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -59.4 | -49.9 | 178.2 | 175.6 | 50.4 | 0 | 0 | 0 | 112.1 | A226 E227 N232 D233 E234 | A226-H230 WeakPolarHBondContact O-CB 3.37Å; A226-H230 PolarHBondContact O-N 3.28Å; E227-H230 PolarHBondContact O-N 3.36Å; H230-N232 VanDerWaalsContact C-N 3.28Å; H230-N232 PolarHBondContact O-N 3.27Å; H230-D233 PolarHBondContact O-N 3.37Å; H230-D233 VanDerWaalsContact O-N 3.17Å; H230-E234 PolarHBondContact O-N 2.93Å |
| 231 | L | 98.8 | Very high | 98.6 | Very high | 73 Ų | 73 | 95.6 Ų | 95.6 | 38% | 0.382 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.5 | -33.8 | 177.5 | -71.1 | 173 | 0 | 0 | 0 | 112.3 | E227 N235 | E227-L231 HydrophobicContact CG-CD1 4.06Å; E227-L231 HydrophobicContact CG-CG 4.44Å; E227-L231 WeakPolarHBondContact O-CB 3.48Å; E227-L231 WeakPolarHBondContact O-CG 3.45Å; E227-L231 PolarHBondContact O-N 3.31Å; L231-N235 WeakPolarHBondContact O-CB 3.44Å; L231-N235 VanDerWaalsContact O-CG 3.32Å; L231-N235 PolarHBondContact O-N 2.85Å; L231-N235 PolarHBondContact O-ND2 3.17Å |
| 232 | N | 98.6 | Very high | 98.6 | Very high | 82 Ų | 82 | 96.2 Ų | 96.2 | 44% | 0.439 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.1 | -40.5 | 175.3 | -175.3 | 45 | 0 | 0 | 0 | 111.4 | V228 S229 H230 N235 K236 | V228-N232 VanDerWaalsContact O-CB 3.24Å; V228-N232 WeakPolarHBondContact O-CB 3.46Å; V228-N232 PolarHBondContact O-N 2.87Å; S229-N232 WeakPolarHBondContact O-CB 3.46Å; S229-N232 PolarHBondContact O-N 2.95Å; H230-N232 VanDerWaalsContact C-N 3.28Å; H230-N232 PolarHBondContact O-N 3.27Å; N232-N235 PolarHBondContact O-N 3.05Å; N232-K236 WeakPolarHBondContact ND2-CE 3.17Å; N232-K236 PolarHBondContact ND2-NZ 3.19Å; N232-K236 WeakPolarHBondContact O-CG 3.34Å; N232-K236 PolarHBondContact O-N 3.47Å |
| 233 | D | 98.6 | Very high | 98.6 | Very high | 80 Ų | 80 | 94.7 Ų | 94.7 | 43% | 0.428 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -71.4 | -38.3 | 177.7 | -66.6 | -26.1 | 0 | 0 | 0 | 112.1 | S229 H230 K236 A237 | S229-D233 PolarHBondContact O-N 3.45Å; H230-D233 PolarHBondContact O-N 3.37Å; H230-D233 VanDerWaalsContact O-N 3.17Å; D233-K236 PolarHBondContact O-N 3.37Å; D233-K236 IonicContact OD1-NZ 3.48Å; D233-K236 PolarHBondContact OD1-NZ 2.97Å; D233-A237 PolarHBondContact O-N 2.93Å |
| 234 | E | 98.6 | Very high | 98.6 | Very high | 92 Ų | 92 | 90.9 Ų | 90.9 | 43% | 0.43 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.2 | -44.9 | 171.4 | -172.8 | 178.9 | -170.5 | 0 | 0 | 111.5 | H230 K236 A237 L238 | H230-E234 PolarHBondContact O-N 2.93Å; E234-K236 VanDerWaalsContact C-N 3.31Å; E234-K236 PolarHBondContact O-N 2.93Å; E234-A237 WeakPolarHBondContact O-CB 3.35Å; E234-A237 PolarHBondContact O-N 3.47Å; E234-A237 VanDerWaalsContact O-N 3.13Å; E234-L238 HydrophobicContact CG-CD1 4.17Å; E234-L238 HydrophobicContact CG-CG 4.47Å; E234-L238 WeakPolarHBondContact O-CG 3.48Å; E234-L238 PolarHBondContact O-N 3.12Å |
| 235 | N | 98.4 | Very high | 98.5 | Very high | 103 Ų | 103 | 89.1 Ų | 89.1 | 55% | 0.551 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.7 | -38.9 | 175.8 | -82.2 | -52.7 | 0 | 0 | 0 | 112.5 | L231 N232 S239 | L231-N235 WeakPolarHBondContact O-CB 3.44Å; L231-N235 VanDerWaalsContact O-CG 3.32Å; L231-N235 PolarHBondContact O-N 2.85Å; L231-N235 PolarHBondContact O-ND2 3.17Å; N232-N235 PolarHBondContact O-N 3.05Å; N235-S239 VanDerWaalsContact O-CB 3.3Å; N235-S239 WeakPolarHBondContact O-CB 3.3Å; N235-S239 PolarHBondContact O-N 3.4Å |
| 236 | K | 98.6 | Very high | 98.5 | Very high | 102 Ų | 102 | 90.5 Ų | 90.5 | 44% | 0.443 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.4 | -43.5 | 173.4 | -70.3 | 171.7 | -159.3 | 154 | 0 | 111.3 | N232 D233 E234 S239 N240 | N232-K236 WeakPolarHBondContact ND2-CE 3.17Å; N232-K236 PolarHBondContact ND2-NZ 3.19Å; N232-K236 WeakPolarHBondContact O-CG 3.34Å; N232-K236 PolarHBondContact O-N 3.47Å; D233-K236 PolarHBondContact O-N 3.37Å; D233-K236 IonicContact OD1-NZ 3.48Å; D233-K236 PolarHBondContact OD1-NZ 2.97Å; E234-K236 VanDerWaalsContact C-N 3.31Å; E234-K236 PolarHBondContact O-N 2.93Å; K236-S239 PolarHBondContact O-N 2.91Å; K236-N240 VanDerWaalsContact O-CG 3.27Å; K236-N240 PolarHBondContact O-N 3.13Å; K236-N240 PolarHBondContact O-ND2 3.31Å |
| 237 | A | 98.5 | Very high | 98.5 | Very high | 56 Ų | 56 | 91.8 Ų | 91.8 | 46% | 0.463 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.3 | -49.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | D233 E234 S239 N240 E241 | D233-A237 PolarHBondContact O-N 2.93Å; E234-A237 WeakPolarHBondContact O-CB 3.35Å; E234-A237 PolarHBondContact O-N 3.47Å; E234-A237 VanDerWaalsContact O-N 3.13Å; A237-S239 VanDerWaalsContact C-N 3.33Å; A237-S239 PolarHBondContact O-N 3.33Å; A237-N240 WeakPolarHBondContact O-CB 3.46Å; A237-N240 PolarHBondContact O-N 2.93Å; A237-N240 VanDerWaalsContact O-N 3.12Å; A237-E241 PolarHBondContact O-N 3.12Å |
| 238 | L | 98.7 | Very high | 98.5 | Very high | 85 Ų | 85 | 94 Ų | 94 | 45% | 0.445 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.4 | -38.7 | 176 | -70.6 | 173.3 | 0 | 0 | 0 | 112.3 | E234 N240 E241 L242 | E234-L238 HydrophobicContact CG-CD1 4.17Å; E234-L238 HydrophobicContact CG-CG 4.47Å; E234-L238 WeakPolarHBondContact O-CG 3.48Å; E234-L238 PolarHBondContact O-N 3.12Å; L238-N240 VanDerWaalsContact C-N 3.32Å; L238-N240 PolarHBondContact O-N 2.91Å; L238-E241 PolarHBondContact O-N 3.32Å; L238-L242 WeakPolarHBondContact O-CB 3.45Å; L238-L242 PolarHBondContact O-N 3.23Å |
| 239 | S | 98.6 | Very high | 98.5 | Very high | 71 Ų | 71 | 94.4 Ų | 94.4 | 50% | 0.497 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.5 | -36.6 | 175.2 | -176 | 0 | 0 | 0 | 0 | 112.3 | N235 K236 A237 K243 | N235-S239 VanDerWaalsContact O-CB 3.3Å; N235-S239 WeakPolarHBondContact O-CB 3.3Å; N235-S239 PolarHBondContact O-N 3.4Å; K236-S239 PolarHBondContact O-N 2.91Å; A237-S239 VanDerWaalsContact C-N 3.33Å; A237-S239 PolarHBondContact O-N 3.33Å; S239-K243 WeakPolarHBondContact O-CB 3.42Å; S239-K243 PolarHBondContact O-N 2.86Å; S239-K243 VanDerWaalsContact O-N 3.12Å |
| 240 | N | 98.6 | Very high | 98.5 | Very high | 109 Ų | 109 | 96.6 Ų | 96.6 | 58% | 0.583 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -70.2 | -42.1 | 176 | -70.2 | -25.3 | 0 | 0 | 0 | 111.2 | K236 A237 L238 K243 A244 | K236-N240 VanDerWaalsContact O-CG 3.27Å; K236-N240 PolarHBondContact O-N 3.13Å; K236-N240 PolarHBondContact O-ND2 3.31Å; A237-N240 WeakPolarHBondContact O-CB 3.46Å; A237-N240 PolarHBondContact O-N 2.93Å; A237-N240 VanDerWaalsContact O-N 3.12Å; L238-N240 VanDerWaalsContact C-N 3.32Å; L238-N240 PolarHBondContact O-N 2.91Å; N240-K243 WeakPolarHBondContact O-CB 3.46Å; N240-K243 PolarHBondContact O-N 3.22Å; N240-A244 PolarHBondContact O-N 2.86Å |
| 241 | E | 98.4 | Very high | 98.5 | Very high | 132 Ų | 132 | 96.8 Ų | 96.8 | 62% | 0.617 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -61.6 | -45.4 | 175.2 | -173.5 | 179.2 | 174.5 | 0 | 0 | 111.4 | A237 L238 K243 A244 A245 | A237-E241 PolarHBondContact O-N 3.12Å; L238-E241 PolarHBondContact O-N 3.32Å; E241-K243 VanDerWaalsContact C-N 3.27Å; E241-K243 PolarHBondContact O-N 3.33Å; E241-A244 PolarHBondContact O-N 3.39Å; E241-A245 WeakPolarHBondContact O-CB 3.46Å; E241-A245 PolarHBondContact O-N 3.2Å |
| 242 | L | 98.3 | Very high | 98.4 | Very high | 128 Ų | 128 | 98.9 Ų | 98.9 | 67% | 0.67 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -58.2 | -40.4 | 174.7 | -178.7 | 68.1 | 0 | 0 | 0 | 111.8 | L238 K246 | L238-L242 WeakPolarHBondContact O-CB 3.45Å; L238-L242 PolarHBondContact O-N 3.23Å; L242-K246 WeakPolarHBondContact O-CB 3.43Å; L242-K246 PolarHBondContact O-N 3Å |
| 243 | K | 98.6 | Very high | 98.4 | Very high | 125 Ų | 125 | 97.8 Ų | 97.8 | 54% | 0.543 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66 | -46 | 176.8 | -173.5 | -173.5 | 174.9 | -161.5 | 0 | 111.3 | S239 N240 E241 K246 E247 | S239-K243 WeakPolarHBondContact O-CB 3.42Å; S239-K243 PolarHBondContact O-N 2.86Å; S239-K243 VanDerWaalsContact O-N 3.12Å; N240-K243 WeakPolarHBondContact O-CB 3.46Å; N240-K243 PolarHBondContact O-N 3.22Å; E241-K243 VanDerWaalsContact C-N 3.27Å; E241-K243 PolarHBondContact O-N 3.33Å; K243-K246 WeakPolarHBondContact O-CB 3.38Å; K243-K246 PolarHBondContact O-N 3.03Å; K243-E247 WeakPolarHBondContact CE-OE1 3.32Å; K243-E247 IonicContact NZ-OE1 2.57Å; K243-E247 WeakPolarHBondContact O-CG 3.35Å; K243-E247 PolarHBondContact O-N 2.87Å |
| 244 | A | 98.5 | Very high | 98.3 | Very high | 44 Ų | 44 | 100 Ų | 100 | 36% | 0.364 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.9 | -47.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | N240 E241 K246 E247 E248 | N240-A244 PolarHBondContact O-N 2.86Å; E241-A244 PolarHBondContact O-N 3.39Å; A244-K246 VanDerWaalsContact C-N 3.26Å; A244-K246 PolarHBondContact O-N 3.15Å; A244-E247 PolarHBondContact O-N 3.09Å; A244-E247 VanDerWaalsContact O-N 3.09Å; A244-E248 PolarHBondContact O-N 2.93Å |
| 245 | A | 98.4 | Very high | 98.1 | Very high | 52 Ų | 52 | 102.4 Ų | 102.4 | 43% | 0.43 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.9 | -37 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | E241 L249 | E241-A245 WeakPolarHBondContact O-CB 3.46Å; E241-A245 PolarHBondContact O-N 3.2Å; A245-L249 WeakPolarHBondContact O-CB 3.41Å; A245-L249 PolarHBondContact O-N 2.9Å |
| 246 | K | 98.6 | Very high | 98 | Very high | 130 Ų | 130 | 102.3 Ų | 102.3 | 57% | 0.565 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.6 | -42.2 | 174.2 | -178.8 | -176.3 | 175.3 | -175.7 | 0 | 112.1 | L242 K243 A244 L249 Q250 | L242-K246 WeakPolarHBondContact O-CB 3.43Å; L242-K246 PolarHBondContact O-N 3Å; K243-K246 WeakPolarHBondContact O-CB 3.38Å; K243-K246 PolarHBondContact O-N 3.03Å; A244-K246 VanDerWaalsContact C-N 3.26Å; A244-K246 PolarHBondContact O-N 3.15Å; K246-L249 PolarHBondContact O-N 3.1Å; K246-Q250 WeakPolarHBondContact O-CG 3.43Å; K246-Q250 PolarHBondContact O-N 3.42Å |
| 247 | E | 98.5 | Very high | 97.8 | Very high | 86 Ų | 86 | 102 Ų | 102 | 40% | 0.402 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.7 | -44.2 | 177.4 | -72 | 170.8 | -177.5 | 0 | 0 | 111.1 | K243 A244 L249 Q250 H251 | K243-E247 WeakPolarHBondContact CE-OE1 3.32Å; K243-E247 IonicContact NZ-OE1 2.57Å; K243-E247 WeakPolarHBondContact O-CG 3.35Å; K243-E247 PolarHBondContact O-N 2.87Å; A244-E247 PolarHBondContact O-N 3.09Å; A244-E247 VanDerWaalsContact O-N 3.09Å; E247-L249 VanDerWaalsContact C-N 3.34Å; E247-L249 PolarHBondContact O-N 2.99Å; E247-Q250 WeakPolarHBondContact O-CB 3.45Å; E247-Q250 PolarHBondContact O-N 3.41Å; E247-Q250 VanDerWaalsContact O-N 3.15Å; E247-H251 PolarHBondContact O-CD2 3.03Å; E247-H251 PolarHBondContact O-N 3.3Å |
| 248 | E | 98.4 | Very high | 97.5 | Very high | 139 Ų | 139 | 102.1 Ų | 102.1 | 65% | 0.65 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -58.3 | -44.3 | 173.6 | -72.1 | -178.6 | -173 | 0 | 0 | 112.2 | A244 Q250 H251 F252 | A244-E248 PolarHBondContact O-N 2.93Å; E248-Q250 VanDerWaalsContact C-N 3.32Å; E248-Q250 PolarHBondContact O-N 2.87Å; E248-H251 PolarHBondContact O-N 3.49Å; E248-F252 WeakPolarHBondContact O-CB 3.3Å; E248-F252 PolarHBondContact O-N 3.28Å |
| 249 | L | 98.6 | Very high | 97.2 | Very high | 108 Ų | 108 | 100 Ų | 100 | 57% | 0.565 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.8 | -38.9 | 176.1 | -179.3 | 62.1 | 0 | 0 | 0 | 112 | A245 K246 E247 T253 | A245-L249 WeakPolarHBondContact O-CB 3.41Å; A245-L249 PolarHBondContact O-N 2.9Å; K246-L249 PolarHBondContact O-N 3.1Å; E247-L249 VanDerWaalsContact C-N 3.34Å; E247-L249 PolarHBondContact O-N 2.99Å; L249-T253 VanDerWaalsContact O-CB 3.3Å; L249-T253 WeakPolarHBondContact O-CB 3.26Å; L249-T253 PolarHBondContact O-N 2.72Å; L249-T253 PolarHBondContact O-OG1 3.48Å |
| 250 | Q | 98.1 | Very high | 96.9 | Very high | 111 Ų | 111 | 100.9 Ų | 100.9 | 52% | 0.519 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.8 | -45.5 | 175.6 | -75.6 | 178.9 | -17.9 | 0 | 0 | 111.4 | K246 E247 E248 T253 Q254 | K246-Q250 WeakPolarHBondContact O-CG 3.43Å; K246-Q250 PolarHBondContact O-N 3.42Å; E247-Q250 WeakPolarHBondContact O-CB 3.45Å; E247-Q250 PolarHBondContact O-N 3.41Å; E247-Q250 VanDerWaalsContact O-N 3.15Å; E248-Q250 VanDerWaalsContact C-N 3.32Å; E248-Q250 PolarHBondContact O-N 2.87Å; Q250-T253 PolarHBondContact O-N 3.37Å; Q250-Q254 WeakPolarHBondContact O-CB 3.4Å; Q250-Q254 PolarHBondContact O-N 3.3Å |
| 251 | H | 97.9 | Very high | 96.3 | Very high | 124 Ų | 124 | 102.2 Ų | 102.2 | 57% | 0.574 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.2 | -45 | 175.6 | -73.1 | -54 | 0 | 0 | 0 | 112 | E247 E248 T253 Q254 W255 | E247-H251 PolarHBondContact O-CD2 3.03Å; E247-H251 PolarHBondContact O-N 3.3Å; E248-H251 PolarHBondContact O-N 3.49Å; H251-T253 VanDerWaalsContact C-N 3.34Å; H251-T253 PolarHBondContact O-N 2.88Å; H251-Q254 PolarHBondContact O-N 3.44Å; H251-W255 VanDerWaalsContact O-CB 3.26Å; H251-W255 WeakPolarHBondContact O-CB 3.42Å; H251-W255 PolarHBondContact O-N 3.16Å |
| 252 | F | 97.8 | Very high | 95.7 | Very high | 118 Ų | 118 | 100.7 Ų | 100.7 | 52% | 0.518 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.5 | -45.9 | 174.9 | 175.5 | -99.6 | 0 | 0 | 0 | 111.6 | E248 Q254 W255 F256 | E248-F252 WeakPolarHBondContact O-CB 3.3Å; E248-F252 PolarHBondContact O-N 3.28Å; F252-Q254 PolarHBondContact O-N 2.85Å; F252-W255 HydrophobicContact CD2-CE3 4.1Å; F252-W255 HydrophobicContact CD2-CZ3 4.38Å; F252-W255 HydrophobicContact CE2-CE3 4.03Å; F252-W255 AromaticContact CE2-CZ3 3.87Å; F252-W255 HydrophobicContact CE2-CZ3 3.87Å; F252-W255 PolarHBondContact O-N 2.84Å; F252-F256 VanDerWaalsContact O-CB 3.28Å; F252-F256 WeakPolarHBondContact O-CB 3.47Å; F252-F256 PolarHBondContact O-N 2.96Å |
| 253 | T | 97.4 | Very high | 94.5 | Very high | 58 Ų | 58 | 98.4 Ų | 98.4 | 36% | 0.356 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.1 | -44.7 | 179.3 | -58.3 | 0 | 0 | 0 | 0 | 111 | L249 Q250 H251 F256 H257 | L249-T253 VanDerWaalsContact O-CB 3.3Å; L249-T253 WeakPolarHBondContact O-CB 3.26Å; L249-T253 PolarHBondContact O-N 2.72Å; L249-T253 PolarHBondContact O-OG1 3.48Å; Q250-T253 PolarHBondContact O-N 3.37Å; H251-T253 VanDerWaalsContact C-N 3.34Å; H251-T253 PolarHBondContact O-N 2.88Å; T253-F256 WeakPolarHBondContact O-CB 3.28Å; T253-F256 PolarHBondContact O-N 3.42Å; T253-H257 PolarHBondContact O-CD2 3.37Å; T253-H257 PolarHBondContact O-N 3.29Å |
| 254 | Q | 96.3 | Very high | 93.3 | Very high | 127 Ų | 127 | 98.3 Ų | 98.3 | 59% | 0.593 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.3 | -43.3 | 177.2 | -176.4 | -179.4 | 1.6 | 0 | 0 | 112.3 | Q250 H251 F252 F256 H257 S258 | Q250-Q254 WeakPolarHBondContact O-CB 3.4Å; Q250-Q254 PolarHBondContact O-N 3.3Å; H251-Q254 PolarHBondContact O-N 3.44Å; F252-Q254 PolarHBondContact O-N 2.85Å; Q254-F256 VanDerWaalsContact C-N 3.31Å; Q254-F256 PolarHBondContact O-N 2.91Å; Q254-H257 PolarHBondContact O-N 2.83Å; Q254-S258 WeakPolarHBondContact O-CB 3.42Å; Q254-S258 PolarHBondContact O-N 2.8Å; Q254-S258 PolarHBondContact O-OG 2.88Å |
| 255 | W | 95.1 | Very high | 92 | Very high | 142 Ų | 142 | 99.4 Ų | 99.4 | 54% | 0.538 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.5 | -44.4 | 174.2 | 170.4 | 81.4 | 0 | 0 | 0 | 111 | H251 F252 S258 T259 | H251-W255 VanDerWaalsContact O-CB 3.26Å; H251-W255 WeakPolarHBondContact O-CB 3.42Å; H251-W255 PolarHBondContact O-N 3.16Å; F252-W255 HydrophobicContact CD2-CE3 4.1Å; F252-W255 HydrophobicContact CD2-CZ3 4.38Å; F252-W255 HydrophobicContact CE2-CE3 4.03Å; F252-W255 AromaticContact CE2-CZ3 3.87Å; F252-W255 HydrophobicContact CE2-CZ3 3.87Å; F252-W255 PolarHBondContact O-N 2.84Å; W255-S258 PolarHBondContact O-N 2.97Å; W255-T259 WeakPolarHBondContact O-CB 3.47Å; W255-T259 PolarHBondContact O-N 3.42Å; W255-T259 PolarHBondContact O-OG1 3.35Å |
| 256 | F | 95.8 | Very high | 90.2 | Very high | 102 Ų | 102 | 104.3 Ų | 104.3 | 45% | 0.447 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.6 | -49.2 | 177.6 | -177.2 | -94.3 | 0 | 0 | 0 | 111.4 | F252 T253 Q254 S258 T259 V260 | F252-F256 VanDerWaalsContact O-CB 3.28Å; F252-F256 WeakPolarHBondContact O-CB 3.47Å; F252-F256 PolarHBondContact O-N 2.96Å; T253-F256 WeakPolarHBondContact O-CB 3.28Å; T253-F256 PolarHBondContact O-N 3.42Å; Q254-F256 VanDerWaalsContact C-N 3.31Å; Q254-F256 PolarHBondContact O-N 2.91Å; F256-S258 PolarHBondContact O-N 3.13Å; F256-T259 PolarHBondContact O-N 3.5Å; F256-V260 HydrophobicContact CD1-CG2 4.15Å; F256-V260 HydrophobicContact CD2-CG2 4.42Å; F256-V260 HydrophobicContact CE1-CG2 3.78Å; F256-V260 HydrophobicContact CE2-CG2 4.08Å; F256-V260 HydrophobicContact CG-CG2 4.46Å; F256-V260 HydrophobicContact CZ-CG2 3.74Å; F256-V260 WeakPolarHBondContact O-CB 3.35Å; F256-V260 WeakPolarHBondContact O-CG2 3.46Å; F256-V260 PolarHBondContact O-N 3.31Å |
| 257 | H | 94.3 | Very high | 88.6 | Confident | 95 Ų | 95 | 104 Ų | 104 | 44% | 0.44 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -56.9 | -47 | 175.5 | -84.7 | -74.5 | 0 | 0 | 0 | 112.2 | T253 Q254 T259 V260 E261 | T253-H257 PolarHBondContact O-CD2 3.37Å; T253-H257 PolarHBondContact O-N 3.29Å; Q254-H257 PolarHBondContact O-N 2.83Å; H257-T259 VanDerWaalsContact C-N 3.29Å; H257-T259 PolarHBondContact O-N 2.86Å; H257-V260 PolarHBondContact O-N 2.92Å; H257-E261 IonicContact ND1-OE1 3.65Å; H257-E261 VanDerWaalsContact O-CB 3.31Å; H257-E261 WeakPolarHBondContact O-CB 3.31Å; H257-E261 WeakPolarHBondContact O-CG 3.48Å; H257-E261 PolarHBondContact O-N 3.35Å |
| 258 | S | 93.1 | Very high | 86.8 | Confident | 58 Ų | 58 | 108 Ų | 108 | 41% | 0.406 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -61.7 | -39.5 | 180 | -55.4 | 0 | 0 | 0 | 0 | 112.1 | Q254 W255 F256 N262 | Q254-S258 WeakPolarHBondContact O-CB 3.42Å; Q254-S258 PolarHBondContact O-N 2.8Å; Q254-S258 PolarHBondContact O-OG 2.88Å; W255-S258 PolarHBondContact O-N 2.97Å; F256-S258 PolarHBondContact O-N 3.13Å; S258-N262 PolarHBondContact O-N 3.24Å; S258-N262 VanDerWaalsContact O-N 3.13Å |
| 259 | T | 92.1 | Very high | 84.8 | Confident | 42 Ų | 42 | 109.2 Ų | 109.2 | 26% | 0.258 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -71 | -40.1 | 179.8 | -55.4 | 0 | 0 | 0 | 0 | 111.8 | W255 F256 H257 | W255-T259 WeakPolarHBondContact O-CB 3.47Å; W255-T259 PolarHBondContact O-N 3.42Å; W255-T259 PolarHBondContact O-OG1 3.35Å; F256-T259 PolarHBondContact O-N 3.5Å; H257-T259 VanDerWaalsContact C-N 3.29Å; H257-T259 PolarHBondContact O-N 2.86Å |
| 260 | V | 91.2 | Very high | 82.8 | Confident | 89 Ų | 89 | 109.3 Ų | 109.3 | 54% | 0.539 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -75.4 | -35.7 | -179.9 | 172.8 | 0 | 0 | 0 | 0 | 112.2 | F256 H257 | F256-V260 HydrophobicContact CD1-CG2 4.15Å; F256-V260 HydrophobicContact CD2-CG2 4.42Å; F256-V260 HydrophobicContact CE1-CG2 3.78Å; F256-V260 HydrophobicContact CE2-CG2 4.08Å; F256-V260 HydrophobicContact CG-CG2 4.46Å; F256-V260 HydrophobicContact CZ-CG2 3.74Å; F256-V260 WeakPolarHBondContact O-CB 3.35Å; F256-V260 WeakPolarHBondContact O-CG2 3.46Å; F256-V260 PolarHBondContact O-N 3.31Å; H257-V260 PolarHBondContact O-N 2.92Å |
| 261 | E | 87.7 | Confident | 81 | Confident | 137 Ų | 137 | 109.8 Ų | 109.8 | 64% | 0.64 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -81.3 | -26.5 | -178.9 | -69.9 | 176.9 | -172.1 | 0 | 0 | 113 | H257 P263 | H257-E261 IonicContact ND1-OE1 3.65Å; H257-E261 VanDerWaalsContact O-CB 3.31Å; H257-E261 WeakPolarHBondContact O-CB 3.31Å; H257-E261 WeakPolarHBondContact O-CG 3.48Å; H257-E261 PolarHBondContact O-N 3.35Å; E261-P263 VanDerWaalsContact C-CD 3.41Å; E261-P263 WeakPolarHBondContact O-CD 3.33Å |
| 262 | N | 84.9 | Confident | 79.1 | Confident | 99 Ų | 99 | 110.6 Ų | 110.6 | 53% | 0.529 | 57% | 0.569 | S | S | . | * | trans | -124 | 60.5 | 177.3 | -74.6 | -60.4 | 0 | 0 | 0 | 112.7 | S258 M264 A265 | S258-N262 PolarHBondContact O-N 3.24Å; S258-N262 VanDerWaalsContact O-N 3.13Å; N262-M264 PolarHBondContact O-N 3.07Å; N262-M264 VanDerWaalsContact O-N 3.13Å; N262-A265 HydrophobicContact CB-CB 3.95Å; N262-A265 WeakPolarHBondContact O-CB 3.44Å; N262-A265 PolarHBondContact O-N 3.22Å | ||
| 263 | P | 73.9 | Confident | 77.3 | Confident | 80 Ų | 80 | 110.9 Ų | 110.9 | 52% | 0.519 | 58% | 0.576 | S | S | . | * | G | 310 helix | trans | -60.6 | -29.5 | -179.3 | 25.6 | -33.7 | 0 | 0 | 0 | 112.1 | E261 | E261-P263 VanDerWaalsContact C-CD 3.41Å; E261-P263 WeakPolarHBondContact O-CD 3.33Å |
| 264 | M | 73 | Confident | 75.6 | Confident | 124 Ų | 124 | 114.8 Ų | 114.8 | 61% | 0.611 | 59% | 0.594 | S | S | * | * | G | 310 helix | trans | -77.5 | -16.8 | -179.8 | -63.2 | -58 | -60.3 | 0 | 0 | 114.1 | N262 Y266 L267 Q268 | N262-M264 PolarHBondContact O-N 3.07Å; N262-M264 VanDerWaalsContact O-N 3.13Å; M264-Y266 PolarHBondContact O-N 3.13Å; M264-L267 HydrophobicContact CE-CB 4.17Å; M264-L267 HydrophobicContact CE-CD1 4.05Å; M264-L267 PolarHBondContact O-N 3.38Å; M264-L267 HydrophobicContact SD-CD1 3.68Å; M264-Q268 PolarHBondContact O-N 3.06Å |
| 265 | A | 69.9 | Low | 73.4 | Confident | 66 Ų | 66 | 116.8 Ų | 116.8 | 55% | 0.545 | 60% | 0.603 | S | S | . | * | G | 310 helix | trans | -64.2 | -24.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | N262 | N262-A265 HydrophobicContact CB-CB 3.95Å; N262-A265 WeakPolarHBondContact O-CB 3.44Å; N262-A265 PolarHBondContact O-N 3.22Å |
| 266 | Y | 62.3 | Low | 71.6 | Confident | 156 Ų | 156 | 122.7 Ų | 122.7 | 61% | 0.612 | 64% | 0.637 | S | S | * | * | G | 310 helix | trans | -94 | -9.1 | 175.8 | -63.3 | -78 | 0 | 0 | 0 | 113.8 | M264 | M264-Y266 PolarHBondContact O-N 3.13Š|
| 267 | L | 65.3 | Low | 70.4 | Confident | 123 Ų | 123 | 123.8 Ų | 123.8 | 64% | 0.644 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.2 | -12.4 | 178.6 | -73.1 | 174.5 | 0 | 0 | 0 | 113.5 | M264 E269 | M264-L267 HydrophobicContact CE-CB 4.17Å; M264-L267 HydrophobicContact CE-CD1 4.05Å; M264-L267 PolarHBondContact O-N 3.38Å; M264-L267 HydrophobicContact SD-CD1 3.68Å; L267-E269 PolarHBondContact O-N 2.93Å |
| 268 | Q | 59.1 | Low | 69.1 | Low | 170 Ų | 170 | 125.3 Ų | 125.3 | 79% | 0.794 | 66% | 0.657 | S | S | * | * | trans | -78.4 | 64 | 164.7 | -81.2 | 178.1 | -0.6 | 0 | 0 | 109.7 | M264 | M264-Q268 PolarHBondContact O-N 3.06Š| ||
| 269 | E | 56.7 | Low | 67.8 | Low | 165 Ų | 165 | 129 Ų | 129 | 77% | 0.771 | 67% | 0.671 | S | S | * | * | trans | -61.1 | 123.1 | 160 | -161.2 | 165.3 | -152.4 | 0 | 0 | 106.5 | L267 V271 | L267-E269 PolarHBondContact O-N 2.93Å; E269-V271 PolarHBondContact O-N 2.88Å | ||
| 270 | P | 56.9 | Low | 66.4 | Low | 110 Ų | 110 | 134.1 Ų | 134.1 | 71% | 0.714 | 70% | 0.696 | S | S | * | * | trans | -62.3 | 107.9 | 177.1 | 23.7 | -29.9 | 0 | 0 | 0 | 106.8 | L272 | P270-L272 VanDerWaalsContact C-N 3.27Å; P270-L272 PolarHBondContact O-N 2.78Å | ||
| 271 | V | 60.7 | Low | 64.8 | Low | 120 Ų | 120 | 136.9 Ų | 136.9 | 73% | 0.727 | 71% | 0.706 | S | S | * | * | trans | -53.2 | 104.4 | 163.7 | 178.5 | 0 | 0 | 0 | 0 | 104.7 | E269 N273 | E269-V271 PolarHBondContact O-N 2.88Å; V271-N273 PolarHBondContact O-N 2.8Å | ||
| 272 | L | 58.6 | Low | 63.3 | Low | 141 Ų | 141 | 136.9 Ų | 136.9 | 74% | 0.738 | 71% | 0.71 | S | S | * | * | trans | -55.4 | 96 | 168.6 | -78.5 | 164.5 | 0 | 0 | 0 | 105.3 | P270 D274 | P270-L272 VanDerWaalsContact C-N 3.27Å; P270-L272 PolarHBondContact O-N 2.78Å; L272-D274 PolarHBondContact O-N 2.84Å | ||
| 273 | N | 58.3 | Low | 61.8 | Low | 124 Ų | 124 | 139.6 Ų | 139.6 | 66% | 0.663 | 72% | 0.723 | S | S | * | * | trans | -69.9 | 79 | 163.2 | -77.5 | -23.1 | 0 | 0 | 0 | 105.7 | V271 H275 | V271-N273 PolarHBondContact O-N 2.8Å; N273-H275 PolarHBondContact O-N 3.48Å | ||
| 274 | D | 62.6 | Low | 60.8 | Low | 140 Ų | 140 | 144.2 Ų | 144.2 | 75% | 0.749 | 74% | 0.738 | S | S | * | * | trans | -65.9 | 83.7 | 156.5 | -77.5 | -30.5 | 0 | 0 | 0 | 106.4 | L272 Q276 | L272-D274 PolarHBondContact O-N 2.84Å; D274-Q276 PolarHBondContact O-N 2.88Å | ||
| 275 | H | 50.6 | Low | 59.8 | Low | 170 Ų | 170 | 145.9 Ų | 145.9 | 79% | 0.787 | 75% | 0.749 | S | S | * | * | trans | -85 | 93.3 | 159.3 | -81.1 | -4.8 | 0 | 0 | 0 | 107.6 | N273 | N273-H275 PolarHBondContact O-N 3.48Š| ||
| 276 | Q | 57 | Low | 58.9 | Low | 266 Ų | 266 | 153.2 Ų | 153.2 | 100% | 1.243 | 77% | 0.768 | S | S | * | * | trans | -121.3 | 0 | 148.5 | -85.3 | -167.5 | -42.3 | 0 | 0 | 108.1 | D274 | D274-Q276 PolarHBondContact O-N 2.88Š|
Retrieved 276 of 276 residues in 543.1 ms
(Link to these results)